data_r5a5wsf
# 
_audit.revision_id     1_0 
_audit.creation_date   ? 
_audit.update_record   'Initial release' 
# 
_cell.entry_id      5a5w 
_cell.length_a      46.5890 
_cell.length_b      46.5890 
_cell.length_c      197.8710 
_cell.angle_alpha   90.0000 
_cell.angle_beta    90.0000 
_cell.angle_gamma   120.0000 
# 
_diffrn.id                  1 
_diffrn.crystal_id          1 
_diffrn.ambient_temp        ? 
_diffrn.crystal_treatment   ? 
_diffrn.details             ? 
# 
_diffrn_radiation_wavelength.id           1 
_diffrn_radiation_wavelength.wavelength   0.97626 
# 
_diffrn_reflns.diffrn_id         1 
_diffrn_reflns.pdbx_d_res_high   1.405 
_diffrn_reflns.pdbx_d_res_low    65.957 
_diffrn_reflns.limit_h_max       28 
_diffrn_reflns.limit_h_min       0 
_diffrn_reflns.limit_k_max       16 
_diffrn_reflns.limit_k_min       0 
_diffrn_reflns.limit_l_max       140 
_diffrn_reflns.limit_l_min       -140 
_diffrn_reflns.number            49951 
_diffrn_reflns.pdbx_number_obs   49159 
# 
_entry.id   5a5w 
# 
_exptl_crystal.id   1 
# 
_reflns_scale.group_code   1 
# 
_symmetry.entry_id               5a5w 
_symmetry.space_group_name_H-M   'P 31 2 1' 
_symmetry.Int_Tables_number      152 
# 
loop_
_symmetry_equiv.id 
_symmetry_equiv.pos_as_xyz 
1 'X,  Y,  Z'          
2 'X-Y,  -Y,  -Z+2/3'  
3 'Y,  X,  -Z'         
4 '-X,  -X+Y,  -Z+1/3' 
5 '-X+Y,  -X,  Z+2/3'  
6 '-Y,  X-Y,  Z+1/3'   
# 
#
loop_
_refln.crystal_id
_refln.wavelength_id
_refln.scale_group_code
_refln.index_h
_refln.index_k
_refln.index_l
_refln.status
_refln.F_meas_au
_refln.F_meas_sigma_au
_refln.intensity_meas
_refln.intensity_sigma
_refln.pdbx_I_plus
_refln.pdbx_I_plus_sigma
_refln.pdbx_I_minus
_refln.pdbx_I_minus_sigma
_refln.pdbx_F_plus
_refln.pdbx_F_plus_sigma
_refln.pdbx_F_minus
_refln.pdbx_F_minus_sigma
_refln.pdbx_anom_difference
_refln.pdbx_anom_difference_sigma
1 1 1    0    0    6 o  937.135   10.920 35818.04  833.961 35818.04  833.961 35818.04  833.961  937.135   10.920  937.135   10.920 0.000000 0.000000 
1 1 1    0    0    9 o  356.232   4.3946  5174.73  127.567  5174.73  127.567  5174.73  127.567  356.232   4.3946  356.232   4.3946 -0.000000 0.000000 
1 1 1    0    0   12 o  1832.97   30.033 137317.20  4484.67 137317.20  4484.67 137317.20  4484.67  1832.97   30.033  1832.97   30.033 0.000000 0.000000 
1 1 1    0    0   18 o  1241.84   14.412 62909.05  1458.51 62909.05  1458.51 62909.05  1458.51  1241.84   14.412  1241.84   14.412 -0.000000 0.000000 
1 1 1    0    0   21 o  1917.19   22.180 150044.41  3465.16 150044.41  3465.16 150044.41  3465.16  1917.19   22.180  1917.19   22.180 0.000000 0.000000 
1 1 1    0    0   24 o  568.704   6.7523 13189.15  312.920 13189.15  312.920 13189.15  312.920  568.704   6.7523  568.704   6.7523 0.000000 0.000000 
1 1 1    0    0   27 o  209.729   2.9336  1793.87   50.131  1793.87   50.131  1793.87   50.131  209.729   2.9336  209.729   2.9336 0.000000 0.000000 
1 1 1    0    0   30 o  382.283   4.7096  5959.57  146.709  5959.57  146.709  5959.57  146.709  382.283   4.7096  382.283   4.7096 0.000000 0.000000 
1 1 1    0    0   33 o  560.006   9.4327 12797.61  430.313 12797.61  430.313 12797.61  430.313  560.006   9.4327  560.006   9.4327 -0.000000 0.000000 
1 1 1    0    0   36 o  435.949   7.4911  7754.46  266.027  7754.46  266.027  7754.46  266.027  435.949   7.4911  435.949   7.4911 -0.000000 0.000000 
1 1 1    0    0   39 o  313.622   3.9902  4010.98  101.971  4010.98  101.971  4010.98  101.971  313.622   3.9902  313.622   3.9902 -0.000000 0.000000 
1 1 1    0    0   42 o  1366.49   15.848 76177.87  1764.78 76177.87  1764.78 76177.87  1764.78  1366.49   15.848  1366.49   15.848 0.000000 0.000000 
1 1 1    0    0   45 o  1790.17   20.723 130779.10  3023.04 130779.10  3023.04 130779.10  3023.04  1790.17   20.723  1790.17   20.723 0.000000 0.000000 
1 1 1    0    0   48 o  1399.82   16.235 79939.94  1851.97 79939.94  1851.97 79939.94  1851.97  1399.82   16.235  1399.82   16.235 -0.000000 0.000000 
1 1 1    0    0   51 o  1507.52   17.474 92726.66  2146.65 92726.66  2146.65 92726.66  2146.65  1507.52   17.474  1507.52   17.474 0.000000 0.000000 
1 1 1    0    0   54 o   86.059   2.6668  302.728   18.667  302.728   18.667  302.728   18.667   86.059   2.6668   86.059   2.6668 0.000000 0.000000 
1 1 1    0    0   57 f  1013.63   16.735 41946.16  1381.93 41946.16  1381.93 41946.16  1381.93  1013.63   16.735  1013.63   16.735 -0.000000 0.000000 
1 1 1    0    0   60 o  466.325   5.6620  8868.11  215.155  8868.11  215.155  8868.11  215.155  466.325   5.6620  466.325   5.6620 -0.000000 0.000000 
1 1 1    0    0   63 o  173.865   2.7693  1233.05   39.226  1233.05   39.226  1233.05   39.226  173.865   2.7693  173.865   2.7693 -0.000000 0.000000 
1 1 1    0    0   66 o  172.599   2.7596  1215.18   38.804  1215.18   38.804  1215.18   38.804  172.599   2.7596  172.599   2.7596 -0.000000 0.000000 
1 1 1    0    0   69 o  116.259   2.4453  551.647   23.151  551.647   23.151  551.647   23.151  116.259   2.4453  116.259   2.4453 -0.000000 0.000000 
1 1 1    0    0   72 o  311.786   4.0431  3964.92  102.717  3964.92  102.717  3964.92  102.717  311.786   4.0431  311.786   4.0431 0.000000 0.000000 
1 1 1    0    0   75 o  208.606   3.0680  1775.04   52.144  1775.04   52.144  1775.04   52.144  208.606   3.0680  208.606   3.0680 -0.000000 0.000000 
1 1 1    0    0   78 f  164.352   2.7403  1101.99   36.689  1101.99   36.689  1101.99   36.689  164.352   2.7403  164.352   2.7403 0.000000 0.000000 
1 1 1    0    0   81 o  263.799   5.0502  2840.92  108.507  2840.92  108.507  2840.92  108.507  263.799   5.0502  263.799   5.0502 0.000000 0.000000 
1 1 1    0    0   84 o  164.956   2.7816  1110.18   37.378  1110.18   37.378  1110.18   37.378  164.956   2.7816  164.956   2.7816 0.000000 0.000000 
1 1 1    0    0   87 o  196.972   3.0876  1582.89   49.547  1582.89   49.547  1582.89   49.547  196.972   3.0876  196.972   3.0876 -0.000000 0.000000 
1 1 1    0    0   90 o   24.402   7.3750   30.095   12.792   30.095   12.792   30.095   12.792   24.402   7.3750   24.402   7.3750 0.000000 0.000000 
1 1 1    0    0   93 o   20.772   7.7736   23.710   12.272   23.710   12.272   23.710   12.272   20.772   7.7736   20.772   7.7736 -0.000000 0.000000 
1 1 1    0    0   96 o   84.414   3.7936  292.394   25.983  292.394   25.983  292.394   25.983   84.414   3.7936   84.414   3.7936 0.000000 0.000000 
1 1 1    0    0   99 o   9.3787   6.1523  -1.9159   11.775  -1.9159   11.775  -1.9159   11.775   9.3787   6.1523   9.3787   6.1523 -0.000000 0.000000 
1 1 1    0    0  102 o  108.407   4.2052  481.833   37.033  481.833   37.033  481.833   37.033  108.407   4.2052  108.407   4.2052 0.000000 0.000000 
1 1 1    0    0  105 o   45.298   3.9336   85.646   14.262   85.646   14.262   85.646   14.262   45.298   3.9336   45.298   3.9336 0.000000 0.000000 
1 1 1    0    0  108 o  187.191   3.0524  1431.35   46.548  1431.35   46.548  1431.35   46.548  187.191   3.0524  187.191   3.0524 -0.000000 0.000000 
1 1 1    0    0  111 o   68.619   2.9784  193.346   16.588  193.346   16.588  193.346   16.588   68.619   2.9784   68.619   2.9784 -0.000000 0.000000 
1 1 1    0    0  114 o  292.122   3.9771  3495.22   94.664  3495.22   94.664  3495.22   94.664  292.122   3.9771  292.122   3.9771 0.000000 0.000000 
1 1 1    0    0  117 o   43.286   3.8803   78.575   13.426   78.575   13.426   78.575   13.426   43.286   3.8803   43.286   3.8803 0.000000 0.000000 
1 1 1    0    0  120 o   88.036   2.8200  317.893   20.190  317.893   20.190  317.893   20.190   88.036   2.8200   88.036   2.8200 0.000000 0.000000 
1 1 1    0    0  123 o   7.5629   5.3266 -14.5276   12.925 -14.5276   12.925 -14.5276   12.925   7.5629   5.3266   7.5629   5.3266 0.000000 0.000000 
1 1 1    0    0  126 o   10.020   6.6300  -2.7314   14.142  -2.7314   14.142  -2.7314   14.142   10.020   6.6300   10.020   6.6300 0.000000 0.000000 
1 1 1    0    0  129 o   45.385   3.9596   86.940   14.381   86.940   14.381   86.940   14.381   45.385   3.9596   45.385   3.9596 -0.000000 0.000000 
1 1 1    0    0  135 o   9.7076   6.6959 -11.7133   17.695 -11.7133   17.695 -11.7133   17.695   9.7076   6.6959   9.7076   6.6959 -0.000000 0.000000 
1 1 1    1    0 -138 o   9.4075   6.5519 -10.1468   18.021 -10.1468   18.021 -10.1468   18.021   9.4075   6.5519   9.4075   6.5519 -0.000000 0.000000 
1 1 1    1    0 -137 o   7.8946   5.4975  -8.6214   12.676  -8.6214   12.676  -8.6214   12.676   7.8946   5.4975   7.8946   5.4975 0.000000 0.000000 
1 1 1    1    0 -136 o   6.2207   4.4996 -20.5785   11.989 -20.5785   11.989 -20.5785   11.989   6.2207   4.4996   6.2207   4.4996 -0.000000 0.000000 
1 1 1    1    0 -135 o   19.839   8.0429   25.476   12.728   25.476   12.728   25.476   12.728   19.839   8.0429   19.839   8.0429 0.000000 0.000000 
1 1 1    1    0 -134 o   11.051   6.5581   7.3802   10.267   7.3802   10.267   7.3802   10.267   11.051   6.5581   11.051   6.5581 -0.000000 0.000000 
1 1 1    1    0 -133 o   39.720   2.7826   66.707   8.9059   66.707   8.9059   66.707   8.9059   39.720   2.7826   39.720   2.7826 0.000000 0.000000 
1 1 1    1    0 -132 o   15.783   6.2161   15.010   7.6762   15.010   7.6762   15.010   7.6762   15.783   6.2161   15.783   6.2161 0.000000 0.000000 
1 1 1    1    0 -131 o   11.441   5.8294   8.6166   6.8302   8.6166   6.8302   8.6166   6.8302   11.441   5.8294   11.441   5.8294 -0.000000 0.000000 
1 1 1    1    0 -130 o   37.525   2.5549   59.180   7.7304   59.180   7.7304   59.180   7.7304   37.525   2.5549   37.525   2.5549 0.000000 0.000000 
1 1 1    1    0 -129 f   29.661   3.0585   37.809   7.1990   37.809   7.1990   37.809   7.1990   29.661   3.0585   29.661   3.0585 -0.000000 0.000000 
1 1 1    1    0 -128 o   34.148   2.7173   49.240   7.4503   49.240   7.4503   49.240   7.4503   34.148   2.7173   34.148   2.7173 -0.000000 0.000000 
1 1 1    1    0 -127 o   10.461   5.6380   6.9212   6.6665   6.9212   6.6665   6.9212   6.6665   10.461   5.6380   10.461   5.6380 -0.000000 0.000000 
1 1 1    1    0 -126 o   47.073   2.1376   91.708   8.1637   91.708   8.1637   91.708   8.1637   47.073   2.1376   47.073   2.1376 0.000000 0.000000 
1 1 1    1    0 -125 o   53.349   2.1121  117.518   9.1521  117.518   9.1521  117.518   9.1521   53.349   2.1121   53.349   2.1121 -0.000000 0.000000 
1 1 1    1    0 -124 o   7.6198   4.9057   0.5010   7.0141   0.5010   7.0141   0.5010   7.0141   7.6198   4.9057   7.6198   4.9057 0.000000 0.000000 
1 1 1    1    0 -123 o   41.729   2.5069   72.431   8.4560   72.431   8.4560   72.431   8.4560   41.729   2.5069   41.729   2.5069 -0.000000 0.000000 
1 1 1    1    0 -122 o   22.327   4.6889   23.309   7.5150   23.309   7.5150   23.309   7.5150   22.327   4.6889   22.327   4.6889 -0.000000 0.000000 
1 1 1    1    0 -121 o   21.158   4.5164   20.935   6.8437   20.935   6.8437   20.935   6.8437   21.158   4.5164   21.158   4.5164 -0.000000 0.000000 
1 1 1    1    0 -120 o   91.747   1.6271  344.530   12.160  344.530   12.160  344.530   12.160   91.747   1.6271   91.747   1.6271 -0.000000 0.000000 
1 1 1    1    0 -119 o  116.414   1.6003  554.331   15.180  554.331   15.180  554.331   15.180  116.414   1.6003  116.414   1.6003 -0.000000 0.000000 
1 1 1    1    0 -118 o   24.094   4.1295   26.022   7.3960   26.022   7.3960   26.022   7.3960   24.094   4.1295   24.094   4.1295 -0.000000 0.000000 
1 1 1    1    0 -117 o   36.158   2.7209   54.590   7.9126   54.590   7.9126   54.590   7.9126   36.158   2.7209   36.158   2.7209 -0.000000 0.000000 
1 1 1    1    0 -116 f   54.339   2.0811  121.386   9.1875  121.386   9.1875  121.386   9.1875   54.339   2.0811   54.339   2.0811 -0.000000 0.000000 
1 1 1    1    0 -115 o   17.610   5.5514   16.168   7.0006   16.168   7.0006   16.168   7.0006   17.610   5.5514   17.610   5.5514 0.000000 0.000000 
1 1 1    1    0 -114 f   53.660   2.2123  118.434   9.6392  118.434   9.6392  118.434   9.6392   53.660   2.2123   53.660   2.2123 0.000000 0.000000 
1 1 1    1    0 -113 o   39.793   2.7006   65.784   8.6658   65.784   8.6658   65.784   8.6658   39.793   2.7006   39.793   2.7006 0.000000 0.000000 
1 1 1    1    0 -112 o  154.585   1.8356  976.691   23.123  976.691   23.123  976.691   23.123  154.585   1.8356  154.585   1.8356 -0.000000 0.000000 
1 1 1    1    0 -111 o   47.607   2.3833   93.400   9.1956   93.400   9.1956   93.400   9.1956   47.607   2.3833   47.607   2.3833 0.000000 0.000000 
1 1 1    1    0 -110 o   60.234   1.8289  148.565   8.9609  148.565   8.9609  148.565   8.9609   60.234   1.8289   60.234   1.8289 0.000000 0.000000 
1 1 1    1    0 -109 o   31.721   2.8496   42.164   7.2251   42.164   7.2251   42.164   7.2251   31.721   2.8496   31.721   2.8496 -0.000000 0.000000 
1 1 1    1    0 -108 o   24.816   3.6642   26.826   6.9384   26.826   6.9384   26.826   6.9384   24.816   3.6642   24.816   3.6642 -0.000000 0.000000 
1 1 1    1    0 -107 o   53.562   1.9827  117.600   8.6297  117.600   8.6297  117.600   8.6297   53.562   1.9827   53.562   1.9827 -0.000000 0.000000 
1 1 1    1    0 -106 o  143.310   1.6184  838.208   18.900  838.208   18.900  838.208   18.900  143.310   1.6184  143.310   1.6184 0.000000 0.000000 
1 1 1    1    0 -105 o   4.7814   3.4474 -12.3002   6.7698 -12.3002   6.7698 -12.3002   6.7698   4.7814   3.4474   4.7814   3.4474 0.000000 0.000000 
1 1 1    1    0 -104 o   83.717   1.6901  286.253   11.523  286.253   11.523  286.253   11.523   83.717   1.6901   83.717   1.6901 -0.000000 0.000000 
1 1 1    1    0 -103 o  118.978   1.7828  577.848   17.282  577.848   17.282  577.848   17.282  118.978   1.7828  118.978   1.7828 -0.000000 0.000000 
1 1 1    1    0 -102 o  101.192   1.8123  418.096   14.938  418.096   14.938  418.096   14.938  101.192   1.8123  101.192   1.8123 -0.000000 0.000000 
1 1 1    1    0 -101 f  100.247   1.7965  410.284   14.670  410.284   14.670  410.284   14.670  100.247   1.7965  100.247   1.7965 0.000000 0.000000 
1 1 1    1    0 -100 o  226.293   2.1228  2089.64   39.150  2089.64   39.150  2089.64   39.150  226.293   2.1228  226.293   2.1228 -0.000000 0.000000 
1 1 1    1    0  -99 o   7.8211   5.0881  -0.6430   7.8148  -0.6430   7.8148  -0.6430   7.8148   7.8211   5.0881   7.8211   5.0881 0.000000 0.000000 
1 1 1    1    0  -98 f  117.177   1.6977  560.252   16.208  560.252   16.208  560.252   16.208  117.177   1.6977  117.177   1.6977 -0.000000 0.000000 
1 1 1    1    0  -97 o   19.021   5.8413   18.433   7.9177   18.433   7.9177   18.433   7.9177   19.021   5.8413   19.021   5.8413 -0.000000 0.000000 
1 1 1    1    0  -96 o   32.465   3.6225   44.620   9.2809   44.620   9.2809   44.620   9.2809   32.465   3.6225   32.465   3.6225 0.000000 0.000000 
1 1 1    1    0  -95 o   29.597   3.5011   37.233   8.1362   37.233   8.1362   37.233   8.1362   29.597   3.5011   29.597   3.5011 0.000000 0.000000 
1 1 1    1    0  -94 o   36.905   3.1566   56.789   9.3299   56.789   9.3299   56.789   9.3299   36.905   3.1566   36.905   3.1566 -0.000000 0.000000 
1 1 1    1    0  -93 o   54.751   2.1531  122.813   9.5755  122.813   9.5755  122.813   9.5755   54.751   2.1531   54.751   2.1531 -0.000000 0.000000 
1 1 1    1    0  -92 f  214.095   2.0355  1869.58   35.516  1869.58   35.516  1869.58   35.516  214.095   2.0355  214.095   2.0355 -0.000000 0.000000 
1 1 1    1    0  -91 o   27.116   3.4034   31.389   7.2020   31.389   7.2020   31.389   7.2020   27.116   3.4034   27.116   3.4034 -0.000000 0.000000 
1 1 1    1    0  -90 o   97.031   1.7195  384.198   13.590  384.198   13.590  384.198   13.590   97.031   1.7195   97.031   1.7195 -0.000000 0.000000 
1 1 1    1    0  -89 o  317.906   2.9640  4123.41   76.794  4123.41   76.794  4123.41   76.794  317.906   2.9640  317.906   2.9640 -0.000000 0.000000 
1 1 1    1    0  -88 o   77.827   1.9767  247.429   12.522  247.429   12.522  247.429   12.522   77.827   1.9767   77.827   1.9767 0.000000 0.000000 
1 1 1    1    0  -87 o  156.392   1.8037  997.533   22.987  997.533   22.987  997.533   22.987  156.392   1.8037  156.392   1.8037 0.000000 0.000000 
1 1 1    1    0  -86 o   40.086   2.4020   66.225   7.7838   66.225   7.7838   66.225   7.7838   40.086   2.4020   40.086   2.4020 0.000000 0.000000 
1 1 1    1    0  -85 o   99.175   1.5110  401.221   12.209  401.221   12.209  401.221   12.209   99.175   1.5110   99.175   1.5110 0.000000 0.000000 
1 1 1    1    0  -84 o   70.500   1.6008  202.924   9.1890  202.924   9.1890  202.924   9.1890   70.500   1.6008   70.500   1.6008 -0.000000 0.000000 
1 1 1    1    0  -83 o  112.907   1.4755  519.916   13.575  519.916   13.575  519.916   13.575  112.907   1.4755  112.907   1.4755 -0.000000 0.000000 
1 1 1    1    0  -82 o  212.514   1.8111  1841.49   31.369  1841.49   31.369  1841.49   31.369  212.514   1.8111  212.514   1.8111 0.000000 0.000000 
1 1 1    1    0  -81 o  395.968   2.8497  6394.62   91.971  6394.62   91.971  6394.62   91.971  395.968   2.8497  395.968   2.8497 -0.000000 0.000000 
1 1 1    1    0  -80 o   11.629   5.5816   8.1106   6.1019   8.1106   6.1019   8.1106   6.1019   11.629   5.5816   11.629   5.5816 -0.000000 0.000000 
1 1 1    1    0  -79 o  115.923   1.5793  548.088   14.917  548.088   14.917  548.088   14.917  115.923   1.5793  115.923   1.5793 -0.000000 0.000000 
1 1 1    1    0  -78 o  118.680   1.5820  574.448   15.298  574.448   15.298  574.448   15.298  118.680   1.5820  118.680   1.5820 -0.000000 0.000000 
1 1 1    1    0  -77 o  179.564   1.7982  1314.77   26.314  1314.77   26.314  1314.77   26.314  179.564   1.7982  179.564   1.7982 0.000000 0.000000 
1 1 1    1    0  -76 o  133.000   1.4733  721.299   15.968  721.299   15.968  721.299   15.968  133.000   1.4733  133.000   1.4733 0.000000 0.000000 
1 1 1    1    0  -75 o  173.746   1.7616  1230.94   24.944  1230.94   24.944  1230.94   24.944  173.746   1.7616  173.746   1.7616 -0.000000 0.000000 
1 1 1    1    0  -74 o   70.625   1.6338  203.646   9.3946  203.646   9.3946  203.646   9.3946   70.625   1.6338   70.625   1.6338 0.000000 0.000000 
1 1 1    1    0  -73 o  283.311   2.3732  3272.90   54.797  3272.90   54.797  3272.90   54.797  283.311   2.3732  283.311   2.3732 -0.000000 0.000000 
1 1 1    1    0  -72 o   82.948   1.5669  280.756   10.586  280.756   10.586  280.756   10.586   82.948   1.5669   82.948   1.5669 -0.000000 0.000000 
1 1 1    1    0  -71 o  126.584   1.4483  653.386   14.940  653.386   14.940  653.386   14.940  126.584   1.4483  126.584   1.4483 0.000000 0.000000 
1 1 1    1    0  -70 o  258.107   2.0252  2716.12   42.604  2716.12   42.604  2716.12   42.604  258.107   2.0252  258.107   2.0252 0.000000 0.000000 
1 1 1    1    0  -69 o   70.898   1.4945  205.157   8.6284  205.157   8.6284  205.157   8.6284   70.898   1.4945   70.898   1.4945 -0.000000 0.000000 
1 1 1    1    0  -68 o  123.048   1.4335  617.385   14.374  617.385   14.374  617.385   14.374  123.048   1.4335  123.048   1.4335 0.000000 0.000000 
1 1 1    1    0  -67 o   19.365   4.5301   17.574   6.2151   17.574   6.2151   17.574   6.2151   19.365   4.5301   19.365   4.5301 -0.000000 0.000000 
1 1 1    1    0  -66 o  221.886   2.0043  2007.30   36.245  2007.30   36.245  2007.30   36.245  221.886   2.0043  221.886   2.0043 -0.000000 0.000000 
1 1 1    1    0  -65 o  173.714   1.9663  1230.49   27.835  1230.49   27.835  1230.49   27.835  173.714   1.9663  173.714   1.9663 0.000000 0.000000 
1 1 1    1    0  -64 o  355.486   2.8333  5152.29   82.090  5152.29   82.090  5152.29   82.090  355.486   2.8333  355.486   2.8333 0.000000 0.000000 
1 1 1    1    0  -63 o   64.794   1.7182  171.480   9.0605  171.480   9.0605  171.480   9.0605   64.794   1.7182   64.794   1.7182 0.000000 0.000000 
1 1 1    1    0  -62 o  850.141   5.7508 29475.95  398.483 29475.95  398.483 29475.95  398.483  850.141   5.7508  850.141   5.7508 -0.000000 0.000000 
1 1 1    1    0  -61 o  349.291   2.5444  4973.81   72.435  4973.81   72.435  4973.81   72.435  349.291   2.5444  349.291   2.5444 -0.000000 0.000000 
1 1 1    1    0  -60 o  567.597   3.9115 13134.98  180.957 13134.98  180.957 13134.98  180.957  567.597   3.9115  567.597   3.9115 0.000000 0.000000 
1 1 1    1    0  -59 o   15.031   5.1965   11.999   5.7378   11.999   5.7378   11.999   5.7378   15.031   5.1965   15.031   5.1965 0.000000 0.000000 
1 1 1    1    0  -58 o  496.623   3.4580 10054.85  139.971 10054.85  139.971 10054.85  139.971  496.623   3.4580  496.623   3.4580 0.000000 0.000000 
1 1 1    1    0  -57 o  411.331   3.2043  6897.79  107.423  6897.79  107.423  6897.79  107.423  411.331   3.2043  411.331   3.2043 -0.000000 0.000000 
1 1 1    1    0  -56 o   87.518   2.0884  312.723   14.879  312.723   14.879  312.723   14.879   87.518   2.0884   87.518   2.0884 0.000000 0.000000 
1 1 1    1    0  -55 o  222.956   2.0190  2026.59   36.686  2026.59   36.686  2026.59   36.686  222.956   2.0190  222.956   2.0190 -0.000000 0.000000 
1 1 1    1    0  -54 o   64.424   1.9315  169.624   10.123  169.624   10.123  169.624   10.123   64.424   1.9315   64.424   1.9315 0.000000 0.000000 
1 1 1    1    0  -53 o  118.229   1.8025  570.125   17.362  570.125   17.362  570.125   17.362  118.229   1.8025  118.229   1.8025 -0.000000 0.000000 
1 1 1    1    0  -52 f  566.799   4.2801 13097.71  197.725 13097.71  197.725 13097.71  197.725  566.799   4.2801  566.799   4.2801 -0.000000 0.000000 
1 1 1    1    0  -51 o  318.009   2.5795  4122.78   66.858  4122.78   66.858  4122.78   66.858  318.009   2.5795  318.009   2.5795 -0.000000 0.000000 
1 1 1    1    0  -50 o  709.117   5.2822 20501.91  305.291 20501.91  305.291 20501.91  305.291  709.117   5.2822  709.117   5.2822 0.000000 0.000000 
1 1 1    1    0  -49 o  698.849   5.2087 19912.28  296.682 19912.28  296.682 19912.28  296.682  698.849   5.2087  698.849   5.2087 -0.000000 0.000000 
1 1 1    1    0  -48 o  738.779   5.0134 22251.68  301.880 22251.68  301.880 22251.68  301.880  738.779   5.0134  738.779   5.0134 0.000000 0.000000 
1 1 1    1    0  -47 o  1120.43   7.5193 51189.30  686.680 51189.30  686.680 51189.30  686.680  1120.43   7.5193  1120.43   7.5193 0.000000 0.000000 
1 1 1    1    0  -46 o  392.176   2.7919  6269.80   89.242  6269.80   89.242  6269.80   89.242  392.176   2.7919  392.176   2.7919 -0.000000 0.000000 
1 1 1    1    0  -45 o  523.815   3.6218 11185.56  154.629 11185.56  154.629 11185.56  154.629  523.815   3.6218  523.815   3.6218 -0.000000 0.000000 
1 1 1    1    0  -44 o  360.458   2.8436  5296.84   83.540  5296.84   83.540  5296.84   83.540  360.458   2.8436  360.458   2.8436 0.000000 0.000000 
1 1 1    1    0  -43 o  599.972   4.5024 14675.59  220.171 14675.59  220.171 14675.59  220.171  599.972   4.5024  599.972   4.5024 -0.000000 0.000000 
1 1 1    1    0  -42 o  556.645   4.1960 12632.38  190.369 12632.38  190.369 12632.38  190.369  556.645   4.1960  556.645   4.1960 0.000000 0.000000 
1 1 1    1    0  -41 o  1031.77   7.5949 43412.66  638.686 43412.66  638.686 43412.66  638.686  1031.77   7.5949  1031.77   7.5949 -0.000000 0.000000 
1 1 1    1    0  -40 o  483.772   4.1174  9541.93  162.340  9541.93  162.340  9541.93  162.340  483.772   4.1174  483.772   4.1174 0.000000 0.000000 
1 1 1    1    0  -39 o  1020.45   6.8616 42463.01  570.697 42463.01  570.697 42463.01  570.697  1020.45   6.8616  1020.45   6.8616 -0.000000 0.000000 
1 1 1    1    0  -38 o   25.106   2.3146   26.340   4.6393   26.340   4.6393   26.340   4.6393   25.106   2.3146   25.106   2.3146 -0.000000 0.000000 
1 1 1    1    0  -37 o  570.819   3.9189 13284.00  182.329 13284.00  182.329 13284.00  182.329  570.819   3.9189  570.819   3.9189 0.000000 0.000000 
1 1 1    1    0  -36 o  309.335   2.2762  3900.84   57.387  3900.84   57.387  3900.84   57.387  309.335   2.2762  309.335   2.2762 0.000000 0.000000 
1 1 1    1    0  -35 o  486.236   3.6987  9639.26  146.580  9639.26  146.580  9639.26  146.580  486.236   3.6987  486.236   3.6987 0.000000 0.000000 
1 1 1    1    0  -34 o   72.060   1.4774  211.912   8.6697  211.912   8.6697  211.912   8.6697   72.060   1.4774   72.060   1.4774 -0.000000 0.000000 
1 1 1    1    0  -33 o   66.958   1.3365  182.953   7.2884  182.953   7.2884  182.953   7.2884   66.958   1.3365   66.958   1.3365 0.000000 0.000000 
1 1 1    1    0  -32 o   47.772   1.6187   93.339   6.2870   93.339   6.2870   93.339   6.2870   47.772   1.6187   47.772   1.6187 0.000000 0.000000 
1 1 1    1    0  -31 o  323.139   2.5799  4257.03   67.945  4257.03   67.945  4257.03   67.945  323.139   2.5799  323.139   2.5799 0.000000 0.000000 
1 1 1    1    0  -30 o  202.851   1.8185  1677.58   30.064  1677.58   30.064  1677.58   30.064  202.851   1.8185  202.851   1.8185 -0.000000 0.000000 
1 1 1    1    0  -29 o   71.565   1.4528  209.007   8.4675  209.007   8.4675  209.007   8.4675   71.565   1.4528   71.565   1.4528 0.000000 0.000000 
1 1 1    1    0  -28 o  235.204   2.0096  2255.34   38.523  2255.34   38.523  2255.34   38.523  235.204   2.0096  235.204   2.0096 0.000000 0.000000 
1 1 1    1    0  -27 f  260.805   2.1661  2773.01   46.042  2773.01   46.042  2773.01   46.042  260.805   2.1661  260.805   2.1661 -0.000000 0.000000 
1 1 1    1    0  -26 o  175.100   1.5115  1249.94   21.570  1249.94   21.570  1249.94   21.570  175.100   1.5115  175.100   1.5115 0.000000 0.000000 
1 1 1    1    0  -25 o  725.399   4.9174 21454.46  290.737 21454.46  290.737 21454.46  290.737  725.399   4.9174  725.399   4.9174 -0.000000 0.000000 
1 1 1    1    0  -24 o  214.235   1.7119  1871.02   29.891  1871.02   29.891  1871.02   29.891  214.235   1.7119  214.235   1.7119 -0.000000 0.000000 
1 1 1    1    0  -23 o  348.564   2.5024  4952.91   71.092  4952.91   71.092  4952.91   71.092  348.564   2.5024  348.564   2.5024 -0.000000 0.000000 
1 1 1    1    0  -22 o  878.155   5.9168 31443.03  423.493 31443.03  423.493 31443.03  423.493  878.155   5.9168  878.155   5.9168 0.000000 0.000000 
1 1 1    1    0  -21 o  578.380   3.9583 13637.77  186.598 13637.77  186.598 13637.77  186.598  578.380   3.9583  578.380   3.9583 -0.000000 0.000000 
1 1 1    1    0  -20 o  165.359   1.7827  1114.86   24.023  1114.86   24.023  1114.86   24.023  165.359   1.7827  165.359   1.7827 -0.000000 0.000000 
1 1 1    1    0  -19 o  513.537   3.8788 10751.50  162.348 10751.50  162.348 10751.50  162.348  513.537   3.8788  513.537   3.8788 0.000000 0.000000 
1 1 1    1    0  -18 o  1197.37   8.7927 58473.16  858.091 58473.16  858.091 58473.16  858.091  1197.37   8.7927  1197.37   8.7927 0.000000 0.000000 
1 1 1    1    0  -17 o  420.652   3.6112  7214.17  123.805  7214.17  123.805  7214.17  123.805  420.652   3.6112  420.652   3.6112 0.000000 0.000000 
1 1 1    1    0  -16 o  1004.09   7.3892 41112.68  604.713 41112.68  604.713 41112.68  604.713  1004.09   7.3892  1004.09   7.3892 0.000000 0.000000 
1 1 1    1    0  -15 o  595.525   4.0706 14458.19  197.584 14458.19  197.584 14458.19  197.584  595.525   4.0706  595.525   4.0706 0.000000 0.000000 
1 1 1    1    0  -14 o  551.495   3.7824 12399.13  170.018 12399.13  170.018 12399.13  170.018  551.495   3.7824  551.495   3.7824 -0.000000 0.000000 
1 1 1    1    0  -13 o  157.635   1.3954  1013.03   17.928  1013.03   17.928  1013.03   17.928  157.635   1.3954  157.635   1.3954 -0.000000 0.000000 
1 1 1    1    0  -12 f  576.427   4.3204 13546.33  202.978 13546.33  202.978 13546.33  202.978  576.427   4.3204  576.427   4.3204 0.000000 0.000000 
1 1 1    1    0  -11 o  1086.63   8.9276 48160.00  790.651 48160.00  790.651 48160.00  790.651  1086.63   8.9276  1086.63   8.9276 -0.000000 0.000000 
1 1 1    1    0  -10 o  406.747   4.0377  6745.76  133.843  6745.76  133.843  6745.76  133.843  406.747   4.0377  406.747   4.0377 0.000000 0.000000 
1 1 1    1    0   -9 o  428.695   3.6676  7492.68  128.144  7492.68  128.144  7492.68  128.144  428.695   3.6676  428.695   3.6676 -0.000000 0.000000 
1 1 1    1    0   -8 o  218.482   2.4284  1946.33   43.236  1946.33   43.236  1946.33   43.236  218.482   2.4284  218.482   2.4284 -0.000000 0.000000 
1 1 1    1    0   -7 o  457.520   5.5038  8536.94  205.197  8536.94  205.197  8536.94  205.197  457.520   5.5038  457.520   5.5038 -0.000000 0.000000 
1 1 1    1    0   -5 o  681.224   5.6631 18922.04  314.421 18922.04  314.421 18922.04  314.421  681.224   5.6631  681.224   5.6631 0.000000 0.000000 
1 1 1    1    0   -4 o  557.717   4.6745 12682.00  212.479 12682.00  212.479 12682.00  212.479  557.717   4.6745  557.717   4.6745 0.000000 0.000000 
1 1 1    1    0   -3 f  1134.70   10.758 52530.91  994.847 52530.91  994.847 52530.91  994.847  1134.70   10.758  1134.70   10.758 0.000000 0.000000 
1 1 1    1    0   -2 o  884.975   8.4273 31944.09  607.808 31944.09  607.808 31944.09  607.808  884.975   8.4273  884.975   8.4273 0.000000 0.000000 
1 1 1    1    0   -1 o  353.464   3.0855  5093.57   88.887  5093.57   88.887  5093.57   88.887  353.464   3.0855  353.464   3.0855 -0.000000 0.000000 
1 1 1    1    0    0 o  1522.68   12.465 94613.79  1546.88 94613.79  1546.88 94613.79  1546.88  1522.68   12.465  1522.68   12.465 0.000000 0.000000 
1 1 1    1    0    1 o  608.322   5.8635 15090.14  290.696 15090.14  290.696 15090.14  290.696  608.322   5.8635  608.322   5.8635 -0.000000 0.000000 
1 1 1    1    0    3 f  306.654   5.4695  3837.09  136.622  3837.09  136.622  3837.09  136.622  306.654   5.4695  306.654   5.4695 -0.000000 0.000000 
1 1 1    1    0    4 o  912.842   15.070 34041.04  1120.66 34041.04  1120.66 34041.04  1120.66  912.842   15.070  912.842   15.070 -0.000000 0.000000 
1 1 1    1    0    5 o  887.947   14.668 32207.11  1061.00 32207.11  1061.00 32207.11  1061.00  887.947   14.668  887.947   14.668 -0.000000 0.000000 
1 1 1    1    0    6 o  304.341   3.8450  3777.27   95.353  3777.27   95.353  3777.27   95.353  304.341   3.8450  304.341   3.8450 0.000000 0.000000 
1 1 1    1    0    7 o  122.558   2.1307  612.771   21.272  612.771   21.272  612.771   21.272  122.558   2.1307  122.558   2.1307 0.000000 0.000000 
1 1 1    1    0    9 o  322.445   3.2957  4239.22   86.604  4239.22   86.604  4239.22   86.604  322.445   3.2957  322.445   3.2957 0.000000 0.000000 
1 1 1    1    0   10 o  175.686   1.6255  1258.34   23.274  1258.34   23.274  1258.34   23.274  175.686   1.6255  175.686   1.6255 0.000000 0.000000 
1 1 1    1    0   11 o  393.660   3.0398  6317.61   97.532  6317.61   97.532  6317.61   97.532  393.660   3.0398  393.660   3.0398 -0.000000 0.000000 
1 1 1    1    0   12 f  783.221   5.7981 25011.67  370.128 25011.67  370.128 25011.67  370.128  783.221   5.7981  783.221   5.7981 0.000000 0.000000 
1 1 1    1    0   13 o  250.127   1.9003  2550.43   38.740  2550.43   38.740  2550.43   38.740  250.127   1.9003  250.127   1.9003 0.000000 0.000000 
1 1 1    1    0   14 o   96.181   1.2541  377.236   9.8290  377.236   9.8290  377.236   9.8290   96.181   1.2541   96.181   1.2541 0.000000 0.000000 
1 1 1    1    0   15 o  789.698   5.8450 25427.15  376.210 25427.15  376.210 25427.15  376.210  789.698   5.8450  789.698   5.8450 0.000000 0.000000 
1 1 1    1    0   16 o  368.475   2.8704  5535.10   86.204  5535.10   86.204  5535.10   86.204  368.475   2.8704  368.475   2.8704 0.000000 0.000000 
1 1 1    1    0   17 o  1289.97   9.4605 67872.51  994.670 67872.51  994.670 67872.51  994.670  1289.97   9.4605  1289.97   9.4605 -0.000000 0.000000 
1 1 1    1    0   18 o  656.745   4.8926 17584.92  261.891 17584.92  261.891 17584.92  261.891  656.745   4.8926  656.745   4.8926 -0.000000 0.000000 
1 1 1    1    0   19 o  359.177   2.5647  5259.06   75.082  5259.06   75.082  5259.06   75.082  359.177   2.5647  359.177   2.5647 0.000000 0.000000 
1 1 1    1    0   20 o   87.897   1.3986  315.133   10.015  315.133   10.015  315.133   10.015   87.897   1.3986   87.897   1.3986 -0.000000 0.000000 
1 1 1    1    0   21 o  486.971   3.3728  9667.44  133.868  9667.44  133.868  9667.44  133.868  486.971   3.3728  486.971   3.3728 0.000000 0.000000 
1 1 1    1    0   22 o  661.128   4.4965 17819.92  242.300 17819.92  242.300 17819.92  242.300  661.128   4.4965  661.128   4.4965 -0.000000 0.000000 
1 1 1    1    0   23 o   64.478   1.1336  169.602   5.9537  169.602   5.9537  169.602   5.9537   64.478   1.1336   64.478   1.1336 0.000000 0.000000 
1 1 1    1    0   24 o  453.927   3.1635  8399.99  117.041  8399.99  117.041  8399.99  117.041  453.927   3.1635  453.927   3.1635 0.000000 0.000000 
1 1 1    1    0   25 o  627.871   4.2841 16072.42  219.243 16072.42  219.243 16072.42  219.243  627.871   4.2841  627.871   4.2841 0.000000 0.000000 
1 1 1    1    0   26 o  747.805   5.5475 22802.76  338.121 22802.76  338.121 22802.76  338.121  747.805   5.5475  747.805   5.5475 -0.000000 0.000000 
1 1 1    1    0   27 f   21.333   2.0432   19.054   3.4734   19.054   3.4734   19.054   3.4734   21.333   2.0432   21.333   2.0432 0.000000 0.000000 
1 1 1    1    0   28 o   41.254   1.4190   69.612   4.7592   69.612   4.7592   69.612   4.7592   41.254   1.4190   41.254   1.4190 -0.000000 0.000000 
1 1 1    1    0   29 o   41.784   1.6352   71.487   5.5501   71.487   5.5501   71.487   5.5501   41.784   1.6352   41.784   1.6352 0.000000 0.000000 
1 1 1    1    0   30 o  685.257   4.6582 19146.78  260.172 19146.78  260.172 19146.78  260.172  685.257   4.6582  685.257   4.6582 0.000000 0.000000 
1 1 1    1    0   31 o   51.564   1.3783  108.602   5.7839  108.602   5.7839  108.602   5.7839   51.564   1.3783   51.564   1.3783 0.000000 0.000000 
1 1 1    1    0   32 o  135.547   1.3489  749.080   14.901  749.080   14.901  749.080   14.901  135.547   1.3489  135.547   1.3489 -0.000000 0.000000 
1 1 1    1    0   33 o  288.966   2.3572  3404.22   55.514  3404.22   55.514  3404.22   55.514  288.966   2.3572  288.966   2.3572 0.000000 0.000000 
1 1 1    1    0   34 o   72.145   1.4842  212.414   8.7202  212.414   8.7202  212.414   8.7202   72.145   1.4842   72.145   1.4842 -0.000000 0.000000 
1 1 1    1    0   35 o  679.042   6.5338 18807.65  361.585 18807.65  361.585 18807.65  361.585  679.042   6.5338  679.042   6.5338 0.000000 0.000000 
1 1 1    1    0   36 o  150.646   1.5566  925.279   19.110  925.279   19.110  925.279   19.110  150.646   1.5566  150.646   1.5566 0.000000 0.000000 
1 1 1    1    0   37 o  659.148   4.9182 17715.22  264.221 17715.22  264.221 17715.22  264.221  659.148   4.9182  659.148   4.9182 -0.000000 0.000000 
1 1 1    1    0   38 o  545.479   3.7567 12130.49  167.022 12130.49  167.022 12130.49  167.022  545.479   3.7567  545.479   3.7567 -0.000000 0.000000 
1 1 1    1    0   39 o  702.127   5.2266 20100.41  299.099 20100.41  299.099 20100.41  299.099  702.127   5.2266  702.127   5.2266 0.000000 0.000000 
1 1 1    1    0   40 o  1118.04   9.1911 50988.83  837.518 50988.83  837.518 50988.83  837.518  1118.04   9.1911  1118.04   9.1911 -0.000000 0.000000 
1 1 1    1    0   41 o  408.423   3.1666  6800.39  105.409  6800.39  105.409  6800.39  105.409  408.423   3.1666  408.423   3.1666 -0.000000 0.000000 
1 1 1    1    0   42 o  771.042   5.7206 24239.54  359.502 24239.54  359.502 24239.54  359.502  771.042   5.7206  771.042   5.7206 -0.000000 0.000000 
1 1 1    1    0   43 o  230.639   1.8341  2168.53   34.477  2168.53   34.477  2168.53   34.477  230.639   1.8341  230.639   1.8341 -0.000000 0.000000 
1 1 1    1    0   44 o   9.6841   4.6851   5.6200   4.3098   5.6200   4.3098   5.6200   4.3098   9.6841   4.6851   9.6841   4.6851 0.000000 0.000000 
1 1 1    1    0   45 o  1023.32   6.8817 42698.03  573.981 42698.03  573.981 42698.03  573.981  1023.32   6.8817  1023.32   6.8817 -0.000000 0.000000 
1 1 1    1    0   46 o  827.409   5.5929 27911.75  377.177 27911.75  377.177 27911.75  377.177  827.409   5.5929  827.409   5.5929 -0.000000 0.000000 
1 1 1    1    0   47 o  977.814   6.5810 38984.47  524.491 38984.47  524.491 38984.47  524.491  977.814   6.5810  977.814   6.5810 -0.000000 0.000000 
1 1 1    1    0   48 o   68.882   1.5270  193.669   8.5643  193.669   8.5643  193.669   8.5643   68.882   1.5270   68.882   1.5270 -0.000000 0.000000 
1 1 1    1    0   49 o  775.611   5.7567 24527.79  363.914 24527.79  363.914 24527.79  363.914  775.611   5.7567  775.611   5.7567 0.000000 0.000000 
1 1 1    1    0   50 o  859.493   6.3602 30121.62  445.549 30121.62  445.549 30121.62  445.549  859.493   6.3602  859.493   6.3602 -0.000000 0.000000 
1 1 1    1    0   51 o  317.997   2.5802  4122.47   66.873  4122.47   66.873  4122.47   66.873  317.997   2.5802  317.997   2.5802 0.000000 0.000000 
1 1 1    1    0   52 f  220.181   1.9951  1976.45   35.802  1976.45   35.802  1976.45   35.802  220.181   1.9951  220.181   1.9951 0.000000 0.000000 
1 1 1    1    0   53 o  151.934   1.6988  941.210   21.033  941.210   21.033  941.210   21.033  151.934   1.6988  151.934   1.6988 -0.000000 0.000000 
1 1 1    1    0   54 o   96.842   1.5009  382.520   11.842  382.520   11.842  382.520   11.842   96.842   1.5009   96.842   1.5009 -0.000000 0.000000 
1 1 1    1    0   55 o   36.605   2.3851   55.306   7.0466   55.306   7.0466   55.306   7.0466   36.605   2.3851   36.605   2.3851 -0.000000 0.000000 
1 1 1    1    0   56 o  630.704   4.7324 16218.68  243.269 16218.68  243.269 16218.68  243.269  630.704   4.7324  630.704   4.7324 0.000000 0.000000 
1 1 1    1    0   57 o  302.732   2.4867  3736.24   61.355  3736.24   61.355  3736.24   61.355  302.732   2.4867  302.732   2.4867 -0.000000 0.000000 
1 1 1    1    0   58 o  881.853   6.5254 31714.46  469.013 31714.46  469.013 31714.46  469.013  881.853   6.5254  881.853   6.5254 -0.000000 0.000000 
1 1 1    1    0   59 o  341.594   2.7357  4757.15   76.166  4757.15   76.166  4757.15   76.166  341.594   2.7357  341.594   2.7357 0.000000 0.000000 
1 1 1    1    0   60 o  487.146   3.4005  9674.97  135.018  9674.97  135.018  9674.97  135.018  487.146   3.4005  487.146   3.4005 0.000000 0.000000 
1 1 1    1    0   61 o  257.728   2.2068  2708.03   46.353  2708.03   46.353  2708.03   46.353  257.728   2.2068  257.728   2.2068 0.000000 0.000000 
1 1 1    1    0   62 o  728.371   5.4293 21636.18  322.313 21636.18  322.313 21636.18  322.313  728.371   5.4293  728.371   5.4293 -0.000000 0.000000 
1 1 1    1    0   63 o   77.639   1.6358  246.016   10.342  246.016   10.342  246.016   10.342   77.639   1.6358   77.639   1.6358 0.000000 0.000000 
1 1 1    1    0   64 o  160.985   1.7030  1056.69   22.342  1056.69   22.342  1056.69   22.342  160.985   1.7030  160.985   1.7030 0.000000 0.000000 
1 1 1    1    0   65 o   86.711   1.5763  306.764   11.133  306.764   11.133  306.764   11.133   86.711   1.5763   86.711   1.5763 0.000000 0.000000 
1 1 1    1    0   66 o   69.151   1.4876  195.179   8.3767  195.179   8.3767  195.179   8.3767   69.151   1.4876   69.151   1.4876 0.000000 0.000000 
1 1 1    1    0   67 o  119.500   1.4215  582.305   13.843  582.305   13.843  582.305   13.843  119.500   1.4215  119.500   1.4215 0.000000 0.000000 
1 1 1    1    0   68 o   42.174   1.9010   72.940   6.5049   72.940   6.5049   72.940   6.5049   42.174   1.9010   42.174   1.9010 -0.000000 0.000000 
1 1 1    1    0   69 o  222.859   1.8347  2024.89   33.324  2024.89   33.324  2024.89   33.324  222.859   1.8347  222.859   1.8347 -0.000000 0.000000 
1 1 1    1    0   70 o   85.217   1.4263  296.247   9.9015  296.247   9.9015  296.247   9.9015   85.217   1.4263   85.217   1.4263 -0.000000 0.000000 
1 1 1    1    0   71 o   95.824   1.5318  374.566   11.958  374.566   11.958  374.566   11.958   95.824   1.5318   95.824   1.5318 0.000000 0.000000 
1 1 1    1    0   72 o  100.189   1.5386  409.444   12.559  409.444   12.559  409.444   12.559  100.189   1.5386  100.189   1.5386 -0.000000 0.000000 
1 1 1    1    0   73 o   27.274   2.9433   31.375   6.3512   31.375   6.3512   31.375   6.3512   27.274   2.9433   27.274   2.9433 0.000000 0.000000 
1 1 1    1    0   74 o   15.056   5.3497   12.182   5.9785   12.182   5.9785   12.182   5.9785   15.056   5.3497   15.056   5.3497 -0.000000 0.000000 
1 1 1    1    0   75 o   79.222   1.4648  256.088   9.4521  256.088   9.4521  256.088   9.4521   79.222   1.4648   79.222   1.4648 -0.000000 0.000000 
1 1 1    1    0   76 o   73.938   1.4890  223.110   8.9660  223.110   8.9660  223.110   8.9660   73.938   1.4890   73.938   1.4890 0.000000 0.000000 
1 1 1    1    0   77 o  168.680   1.5991  1160.14   21.983  1160.14   21.983  1160.14   21.983  168.680   1.5991  168.680   1.5991 -0.000000 0.000000 
1 1 1    1    0   78 o  118.647   1.4572  574.076   14.089  574.076   14.089  574.076   14.089  118.647   1.4572  118.647   1.4572 -0.000000 0.000000 
1 1 1    1    0   79 o  149.566   1.6747  912.232   20.412  912.232   20.412  912.232   20.412  149.566   1.6747  149.566   1.6747 -0.000000 0.000000 
1 1 1    1    0   80 o   71.784   1.6732  210.396   9.7787  210.396   9.7787  210.396   9.7787   71.784   1.6732   71.784   1.6732 0.000000 0.000000 
1 1 1    1    0   81 o  395.353   3.1150  6375.63  100.375  6375.63  100.375  6375.63  100.375  395.353   3.1150  395.353   3.1150 -0.000000 0.000000 
1 1 1    1    0   82 o   83.250   1.6245  282.846   11.015  282.846   11.015  282.846   11.015   83.250   1.6245   83.250   1.6245 0.000000 0.000000 
1 1 1    1    0   83 o   84.740   1.5121  292.996   10.437  292.996   10.437  292.996   10.437   84.740   1.5121   84.740   1.5121 -0.000000 0.000000 
1 1 1    1    0   84 o   22.874   3.7032   22.950   6.3622   22.950   6.3622   22.950   6.3622   22.874   3.7032   22.874   3.7032 -0.000000 0.000000 
1 1 1    1    0   85 o  202.538   1.7811  1672.72   29.400  1672.72   29.400  1672.72   29.400  202.538   1.7811  202.538   1.7811 0.000000 0.000000 
1 1 1    1    0   86 o   40.610   2.6548   68.111   8.7011   68.111   8.7011   68.111   8.7011   40.610   2.6548   40.610   2.6548 0.000000 0.000000 
1 1 1    1    0   87 o  571.403   4.3499 13330.70  202.582 13330.70  202.582 13330.70  202.582  571.403   4.3499  571.403   4.3499 -0.000000 0.000000 
1 1 1    1    0   88 o  264.719   2.3384  2858.11   50.450  2858.11   50.450  2858.11   50.450  264.719   2.3384  264.719   2.3384 0.000000 0.000000 
1 1 1    1    0   89 o   65.174   2.3571  173.887   12.485  173.887   12.485  173.887   12.485   65.174   2.3571   65.174   2.3571 0.000000 0.000000 
1 1 1    1    0   90 o   63.696   1.8202  165.819   9.4333  165.819   9.4333  165.819   9.4333   63.696   1.8202   63.696   1.8202 0.000000 0.000000 
1 1 1    1    0   91 o  195.529   1.9423  1559.29   30.950  1559.29   30.950  1559.29   30.950  195.529   1.9423  195.529   1.9423 -0.000000 0.000000 
1 1 1    1    0   92 f   5.8890   4.0824  -5.7929   6.7850  -5.7929   6.7850  -5.7929   6.7850   5.8890   4.0824   5.8890   4.0824 0.000000 0.000000 
1 1 1    1    0   93 o  152.904   1.7753  953.639   22.120  953.639   22.120  953.639   22.120  152.904   1.7753  152.904   1.7753 0.000000 0.000000 
1 1 1    1    0   94 o   15.436   6.6422   13.901   8.5727   13.901   8.5727   13.901   8.5727   15.436   6.6422   15.436   6.6422 -0.000000 0.000000 
1 1 1    1    0   95 o   11.970   6.1942   8.5650   7.7878   8.5650   7.7878   8.5650   7.7878   11.970   6.1942   11.970   6.1942 -0.000000 0.000000 
1 1 1    1    0   96 o   71.992   2.0859  211.915   12.218  211.915   12.218  211.915   12.218   71.992   2.0859   71.992   2.0859 -0.000000 0.000000 
1 1 1    1    0   97 o  151.847   1.6291  940.497   20.160  940.497   20.160  940.497   20.160  151.847   1.6291  151.847   1.6291 0.000000 0.000000 
1 1 1    1    0   98 f  271.732   2.3613  3013.09   52.293  3013.09   52.293  3013.09   52.293  271.732   2.3613  271.732   2.3613 -0.000000 0.000000 
1 1 1    1    0   99 o   85.330   1.6453  297.244   11.434  297.244   11.434  297.244   11.434   85.330   1.6453   85.330   1.6453 0.000000 0.000000 
1 1 1    1    0  100 o  160.205   1.6585  1047.00   21.653  1047.00   21.653  1047.00   21.653  160.205   1.6585  160.205   1.6585 -0.000000 0.000000 
1 1 1    1    0  101 f   87.548   1.6551  312.921   11.802  312.921   11.802  312.921   11.802   87.548   1.6551   87.548   1.6551 0.000000 0.000000 
1 1 1    1    0  102 o   61.511   2.1751  154.971   10.875  154.971   10.875  154.971   10.875   61.511   2.1751   61.511   2.1751 -0.000000 0.000000 
1 1 1    1    0  103 o   73.483   2.2835  221.033   13.648  221.033   13.648  221.033   13.648   73.483   2.2835   73.483   2.2835 0.000000 0.000000 
1 1 1    1    0  104 o   37.775   3.0270   59.432   9.1789   59.432   9.1789   59.432   9.1789   37.775   3.0270   37.775   3.0270 0.000000 0.000000 
1 1 1    1    0  105 o   77.759   1.8940  247.175   11.989  247.175   11.989  247.175   11.989   77.759   1.8940   77.759   1.8940 0.000000 0.000000 
1 1 1    1    0  106 o   80.602   1.6607  265.397   10.900  265.397   10.900  265.397   10.900   80.602   1.6607   80.602   1.6607 0.000000 0.000000 
1 1 1    1    0  107 o   38.855   2.4665   62.428   7.7391   62.428   7.7391   62.428   7.7391   38.855   2.4665   38.855   2.4665 0.000000 0.000000 
1 1 1    1    0  108 o   19.899   4.8326   18.855   6.7925   18.855   6.7925   18.855   6.7925   19.899   4.8326   19.899   4.8326 -0.000000 0.000000 
1 1 1    1    0  109 o   54.422   2.1650  121.582   9.5699  121.582   9.5699  121.582   9.5699   54.422   2.1650   54.422   2.1650 0.000000 0.000000 
1 1 1    1    0  110 o   44.349   2.4305   81.154   8.7257   81.154   8.7257   81.154   8.7257   44.349   2.4305   44.349   2.4305 -0.000000 0.000000 
1 1 1    1    0  111 o   19.208   5.4988   18.511   7.4618   18.511   7.4618   18.511   7.4618   19.208   5.4988   19.208   5.4988 0.000000 0.000000 
1 1 1    1    0  112 o   60.662   2.0368  150.928   10.046  150.928   10.046  150.928   10.046   60.662   2.0368   60.662   2.0368 0.000000 0.000000 
1 1 1    1    0  113 o   31.905   2.8026   42.686   7.1538   42.686   7.1538   42.686   7.1538   31.905   2.8026   31.905   2.8026 -0.000000 0.000000 
1 1 1    1    0  114 f   47.242   2.2625   91.973   8.6668   91.973   8.6668   91.973   8.6668   47.242   2.2625   47.242   2.2625 0.000000 0.000000 
1 1 1    1    0  115 o  156.084   1.8112  996.309   23.038  996.309   23.038  996.309   23.038  156.084   1.8112  156.084   1.8112 0.000000 0.000000 
1 1 1    1    0  116 f   70.077   1.8774  201.275   10.707  201.275   10.707  201.275   10.707   70.077   1.8774   70.077   1.8774 -0.000000 0.000000 
1 1 1    1    0  117 o   58.780   2.0385  141.942   9.7408  141.942   9.7408  141.942   9.7408   58.780   2.0385   58.780   2.0385 -0.000000 0.000000 
1 1 1    1    0  118 o  108.676   1.6007  483.063   14.173  483.063   14.173  483.063   14.173  108.676   1.6007  108.676   1.6007 -0.000000 0.000000 
1 1 1    1    0  119 o   23.739   3.8865   25.081   6.9157   25.081   6.9157   25.081   6.9157   23.739   3.8865   23.739   3.8865 -0.000000 0.000000 
1 1 1    1    0  120 o   7.2529   4.6807   0.1723   6.4354   0.1723   6.4354   0.1723   6.4354   7.2529   4.6807   7.2529   4.6807 -0.000000 0.000000 
1 1 1    1    0  121 o   11.697   5.8039   8.5688   6.6789   8.5688   6.6789   8.5688   6.6789   11.697   5.8039   11.697   5.8039 -0.000000 0.000000 
1 1 1    1    0  122 o   21.206   4.4953   21.028   6.8336   21.028   6.8336   21.028   6.8336   21.206   4.4953   21.206   4.4953 -0.000000 0.000000 
1 1 1    1    0  123 o   56.596   1.9104  131.745   8.7905  131.745   8.7905  131.745   8.7905   56.596   1.9104   56.596   1.9104 0.000000 0.000000 
1 1 1    1    0  124 o   42.989   2.4005   76.762   8.3515   76.762   8.3515   76.762   8.3515   42.989   2.4005   42.989   2.4005 -0.000000 0.000000 
1 1 1    1    0  125 o   29.432   3.2494   37.241   7.5538   37.241   7.5538   37.241   7.5538   29.432   3.2494   29.432   3.2494 0.000000 0.000000 
1 1 1    1    0  126 o   63.657   1.9352  166.879   10.021  166.879   10.021  166.879   10.021   63.657   1.9352   63.657   1.9352 -0.000000 0.000000 
1 1 1    1    0  127 o   11.259   5.9208   8.1672   7.1993   8.1672   7.1993   8.1672   7.1993   11.259   5.9208   11.259   5.9208 0.000000 0.000000 
1 1 1    1    0  128 o   22.552   4.2491   23.525   7.0020   23.525   7.0020   23.525   7.0020   22.552   4.2491   22.552   4.2491 -0.000000 0.000000 
1 1 1    1    0  129 f   26.806   3.3927   31.463   7.0904   31.463   7.0904   31.463   7.0904   26.806   3.3927   26.806   3.3927 0.000000 0.000000 
1 1 1    1    0  130 o   6.9777   4.5802  -0.4225   6.5421  -0.4225   6.5421  -0.4225   6.5421   6.9777   4.5802   6.9777   4.5802 -0.000000 0.000000 
1 1 1    1    0  131 o   37.237   2.5413   58.298   7.6300   58.298   7.6300   58.298   7.6300   37.237   2.5413   37.237   2.5413 -0.000000 0.000000 
1 1 1    1    0  132 o   14.589   6.2054   13.307   7.4944   13.307   7.4944   13.307   7.4944   14.589   6.2054   14.589   6.2054 0.000000 0.000000 
1 1 1    1    0  133 o   8.6421   5.6415   0.5581   9.7249   0.5581   9.7249   0.5581   9.7249   8.6421   5.6415   8.6421   5.6415 -0.000000 0.000000 
1 1 1    1    0  134 o   9.2905   5.9179   2.6443   9.8743   2.6443   9.8743   2.6443   9.8743   9.2905   5.9179   9.2905   5.9179 0.000000 0.000000 
1 1 1    1    0  135 o   16.679   7.3773   18.482   10.553   18.482   10.553   18.482   10.553   16.679   7.3773   16.679   7.3773 -0.000000 0.000000 
1 1 1    1    0  136 o   9.7520   6.4066   0.9656   12.839   0.9656   12.839   0.9656   12.839   9.7520   6.4066   9.7520   6.4066 -0.000000 0.000000 
1 1 1    1    0  137 o   22.019   10.005   36.374   19.421   36.374   19.421   36.374   19.421   22.019   10.005   22.019   10.005 0.000000 0.000000 
1 1 1    1    0  138 o   13.786   8.5148   12.987   18.821   12.987   18.821   12.987   18.821   13.786   8.5148   13.786   8.5148 -0.000000 0.000000 
1 1 1    1    1    0 o  832.026   7.9301 28226.72  537.838 27830.14  650.469 29083.85  956.281  826.077   9.6598  844.200   13.896 -18.12286 16.92407 
1 1 1    1    1    1 o  474.444   3.5977  9175.96  139.137  9515.17  226.741  8971.08  176.216  483.070   5.7582  469.092   4.6084 13.97769 7.375226 
1 1 1    1    1    2 o  1238.99   9.0896 62635.12  918.013 62803.11  1188.20 62386.35  1445.96  1240.20   11.753  1235.52   14.357 4.677124 18.55454 
1 1 1    1    1    3 o  190.656   1.7125  1481.57   26.614  1486.43   34.400  1474.32   42.006  190.965   2.2099  190.183   2.7096 0.7824402 3.496452 
1 1 1    1    1    4 o  128.175   1.2542  669.606   13.104  695.182   18.840  645.636   18.239  130.598   1.7698  125.858   1.7778 4.739891 2.508520 
1 1 1    1    1    5 o  438.159   3.0542  7825.70  109.084  7662.00  151.614  8001.39  157.067  433.526   4.2903  443.022   4.3493 -9.496033 6.109308 
1 1 1    1    1    6 o  214.426   1.8560  1874.05   32.440  1905.22   42.339  1829.74   50.484  216.199   2.4024  211.869   2.9231 4.329437 3.783682 
1 1 1    1    1    7 o  869.649   6.4165 30841.20  454.858 30931.84  721.086 30781.29  586.195  870.569   10.161  868.647   8.2787 1.921753 13.10681 
1 1 1    1    1    8 o  1356.48   9.0902 75077.29  1005.14 72734.91  1195.49 80726.83  1856.62  1334.82   10.987  1404.92   16.212 -70.10400 19.58429 
1 1 1    1    1    9 o  436.789   2.8231  7776.69  100.514  7981.88  135.880  7528.72  149.374  442.495   3.7671  429.739   4.2642 12.75595 5.689836 
1 1 1    1    1   10 o  978.371   6.0939 39032.52  486.003 37968.12  724.393 39903.80  655.397  964.635   9.2125  989.041   8.1293 -24.40643 12.28638 
1 1 1    1    1   11 o  166.244   1.5923  1126.45   21.578  1100.56   27.520  1167.77   34.766  164.320   2.0546  169.262   2.5198 -4.940918 3.251247 
1 1 1    1    1   12 o  560.665   3.5605 12814.03  162.723 12942.27  216.873 12648.83  246.148  563.428   4.7220  556.978   5.4215 6.450073 7.189628 
1 1 1    1    1   13 o  243.154   1.7316  2409.82   34.321  2415.00   45.441  2402.94   52.366  243.411   2.2902  242.800   2.6459 0.6113586 3.499356 
1 1 1    1    1   14 o  646.253   4.0734 17025.74  214.585 16900.69  282.061 17197.57  330.630  643.823   5.3745  649.409   6.2458 -5.586609 8.239876 
1 1 1    1    1   15 o  879.037   5.1275 31504.42  367.407 31019.59  512.567 32016.77  526.914  872.099   7.2102  885.999   7.2958 -13.89941 10.25746 
1 1 1    1    1   16 o  178.818   1.4082  1303.29   20.526  1257.75   26.604  1370.27   32.265  175.664   1.8579  183.352   2.1588 -7.687668 2.848195 
1 1 1    1    1   17 o  266.065   1.7370  2885.35   37.673  2789.29   51.988  2991.57   54.669  261.593   2.4380  270.912   2.4756 -9.318756 3.474545 
1 1 1    1    1   18 o  817.890   4.0812 27270.62  272.091 26570.74  394.373 27906.40  375.883  807.219   5.9935  827.287   5.5739 -20.06757 8.184769 
1 1 1    1    1   19 o  986.365   4.8986 39667.01  393.866 39861.93  586.643 39507.04  531.456  988.581   7.2799  984.234   6.6242 4.346680 9.842614 
1 1 1    1    1   20 o  618.959   3.2704 15617.05  165.003 15497.46  259.128 15698.60  213.996  616.512   5.1563  620.540   4.2306 -4.027832 6.669703 
1 1 1    1    1   21 o  248.621   1.5521  2519.40   31.455  2553.72   47.607  2492.81   41.905  250.303   2.3333  247.302   2.0787 3.000885 3.124959 
1 1 1    1    1   22 o  250.959   1.4846  2567.01   30.370  2565.21   47.945  2568.22   39.248  250.865   2.3446  251.015   1.9181 -0.1505890 3.029266 
1 1 1    1    1   23 o  121.480   1.0972  601.482   10.865  605.685   17.843  599.005   13.697  121.901   1.7957  121.229   1.3861 0.6727295 2.268443 
1 1 1    1    1   24 o  384.910   2.2288  6038.99   69.931  6100.26  105.753  5991.38   93.222  386.835   3.3537  383.376   2.9830 3.459534 4.488433 
1 1 1    1    1   25 o  247.150   1.6452  2489.72   33.146  2484.14   41.927  2499.02   54.127  246.869   2.0835  247.600   2.6818 -0.7311707 3.395998 
1 1 1    1    1   26 o  560.993   3.1440 12829.61  143.773 12526.43  189.007 13245.95  221.485  554.280   4.1832  569.944   4.7673 -15.66461 6.342472 
1 1 1    1    1   27 o  412.764   2.2505  6944.83   75.722  6938.03  107.051  6951.63  107.122  412.538   3.1834  412.942   3.1824 -0.4041443 4.501298 
1 1 1    1    1   28 o  190.168   1.2336  1474.00   19.123  1478.94   24.741  1466.67   30.141  190.484   1.5934  189.689   1.9493 0.7949066 2.517675 
1 1 1    1    1   29 f  653.155   3.6316 17393.51  193.352 17354.05  236.321 17473.42  336.282  652.358   4.4441  654.429   6.3038 -2.070129 7.712852 
1 1 1    1    1   30 o  401.758   2.0969  6579.39   68.672  6644.29   93.695  6504.06  100.944  403.714   2.8471  399.423   3.1003 4.291168 4.209308 
1 1 1    1    1   31 o  280.149   1.4847  3198.98   33.906  3303.28   49.086  3103.80   46.890  284.671   2.1153  275.942   2.0846 8.728821 2.969895 
1 1 1    1    1   32 o  402.025   2.0996  6588.13   68.807  6527.80   92.473  6662.97  102.989  400.161   2.8349  404.274   3.1252 -4.112579 4.219456 
1 1 1    1    1   33 o  466.108   2.3978  8856.12   91.104  9086.03  138.003  8678.52  121.289  472.078   3.5862  461.384   3.2250 10.69354 4.823010 
1 1 1    1    1   34 o  450.030   2.4367  8255.62   89.389  8013.11  137.923  8431.27  117.379  443.325   3.8166  454.770   3.1664 -11.44476 4.959068 
1 1 1    1    1   35 o  337.395   1.8953  4640.01   52.125  4483.57   80.234  4754.26   68.565  331.640   2.9679  341.514   2.4629 -9.874908 3.856772 
1 1 1    1    1   36 o  145.931   1.0891  867.981   12.955  900.599   18.676  837.727   17.986  148.646   1.5413  143.363   1.5391 5.282486 2.178203 
1 1 1    1    1   37 o  494.709   2.6571  9976.14  107.149  9945.65  151.232 10006.87  151.833  493.921   3.7562  495.439   3.7596 -1.517700 5.314475 
1 1 1    1    1   38 o  704.109   3.5360 20210.46  202.947 19855.22  296.384 20524.07  278.472  697.808   5.2105  709.487   4.8151 -11.67944 7.094688 
1 1 1    1    1   39 o  671.892   3.5442 18402.98  194.113 18138.25  271.222 18680.98  277.936  666.979   4.9886  676.882   5.0373 -9.902527 7.089438 
1 1 1    1    1   40 o  366.140   2.0341  5464.19   60.709  5638.91   88.006  5305.55   83.856  371.936   2.9027  360.776   2.8514 11.16095 4.068968 
1 1 1    1    1   41 o  370.819   2.0564  5604.71   62.160  5551.85   87.252  5659.19   88.579  369.056   2.9003  372.606   2.9164 -3.550262 4.113058 
1 1 1    1    1   42 o  227.013   1.4774  2100.48   27.338  2077.36   40.677  2119.53   36.920  225.756   2.2104  228.037   1.9862 -2.281113 2.971682 
1 1 1    1    1   43 o  487.115   2.7635  9671.83  109.731  9677.15  164.615  9667.57  147.208  487.221   4.1448  486.990   3.7083 0.2311096 5.561574 
1 1 1    1    1   44 o  500.770   2.5647 10221.53  104.692 10241.29  141.993 10198.00  154.971  501.237   3.4753  500.169   3.8010 1.067444 5.150237 
1 1 1    1    1   45 o  391.439   2.0570  6245.33   65.634  6228.99   88.687  6265.11   97.590  390.918   2.7832  392.046   3.0538 -1.128204 4.131751 
1 1 1    1    1   46 o  534.112   2.7251 11628.14  118.643 11758.55  177.519 11522.87  159.499  537.070   4.0549  531.670   3.6803 5.400452 5.475976 
1 1 1    1    1   47 o  726.420   3.8206 21510.96  226.231 21501.62  319.729 21520.32  320.150  726.197   5.4012  726.513   5.4060 -0.3155518 7.641836 
1 1 1    1    1   48 o  143.565   1.1244  840.065   13.159  856.174   18.688  824.221   18.533  144.934   1.5818  142.204   1.5988 2.730331 2.249036 
1 1 1    1    1   49 o  659.750   3.6754 17743.60  197.660 17579.02  294.015 17879.31  267.001  656.612   5.4932  662.221   4.9462 -5.609131 7.391902 
1 1 1    1    1   50 o  561.596   2.9982 12856.03  137.251 12843.62  193.848 12868.51  194.356  561.291   4.2368  561.834   4.2438 -0.5433960 5.996684 
1 1 1    1    1   51 o  587.386   2.9829 14063.96  142.825 14161.69  213.092 13984.25  192.451  589.379   4.4354  585.689   4.0310 3.690186 5.993527 
1 1 1    1    1   52 o  182.217   1.2162  1353.29   18.064  1338.68   26.614  1365.78   24.598  181.228   1.8016  183.053   1.6485 -1.825668 2.441944 
1 1 1    1    1   53 o  361.100   1.8549  5314.76   54.600  5302.99   77.064  5326.62   77.368  360.691   2.6211  361.493   2.6256 -0.8027039 3.709971 
1 1 1    1    1   54 o  203.184   1.2361  1682.66   20.474  1709.45   29.236  1656.87   28.680  204.793   1.7513  201.618   1.7451 3.174347 2.472339 
1 1 1    1    1   55 o  678.229   3.2720 18751.56  180.897 18513.71  252.997 19000.36  258.754  673.854   4.6059  682.651   4.6500 -8.796509 6.544972 
1 1 1    1    1   56 f  515.758   2.5334 10842.98  106.509 10805.66  150.115 10880.81  151.145  514.840   3.5770  516.627   3.5891 -1.786804 5.067152 
1 1 1    1    1   57 o  414.593   2.1746  7006.31   73.490  6926.25   98.548  7106.59  110.304  412.202   2.9329  417.526   3.2409 -5.324005 4.371021 
1 1 1    1    1   58 o  567.640   2.7656 13134.74  127.965 13257.78  182.354 13015.36  179.616  570.246   3.9230  565.009   3.8999 5.236450 5.531644 
1 1 1    1    1   59 o  315.275   1.7309  4051.50   44.482  3999.42   59.614  4116.92   66.815  313.233   2.3348  317.797   2.5792 -4.563599 3.479017 
1 1 1    1    1   60 o  189.160   1.2332  1458.41   19.016  1432.61   25.427  1491.15   28.644  187.476   1.6638  191.266   1.8372 -3.790497 2.478643 
1 1 1    1    1   61 o  641.645   3.2421 16785.25  169.572 16742.75  229.024 16836.82  252.280  640.752   4.3849  642.513   4.8169 -1.760681 6.513772 
1 1 1    1    1   62 o  118.887   1.1206  576.091   10.860  559.404   15.156  593.699   15.568  117.150   1.5871  120.688   1.5825 -3.537575 2.241224 
1 1 1    1    1   63 o  237.441   1.4108  2297.99   27.306  2329.18   37.296  2261.95   40.090  239.040   1.9140  235.562   2.0878 3.478027 2.832422 
1 1 1    1    1   64 o  479.049   2.4754  9355.59   96.665  9381.33  131.162  9324.99  143.015  479.659   3.3546  478.196   3.6689 1.463074 4.971344 
1 1 1    1    1   65 o  262.312   1.5814  2804.72   33.815  2799.72   47.663  2809.78   47.980  262.064   2.2312  262.534   2.2420 -0.4698486 3.163079 
1 1 1    1    1   66 o  329.017   1.8795  4412.84   50.407  4383.32   70.857  4443.09   71.724  327.887   2.6511  330.115   2.6654 -2.227539 3.759320 
1 1 1    1    1   67 o  112.830   1.0435  518.899   9.5977  514.305   14.095  522.870   13.105  112.326   1.5394  113.258   1.4195 -0.9324951 2.093984 
1 1 1    1    1   68 f  110.955   1.0429  501.794   9.4327  505.248   13.938  498.876   12.812  111.332   1.5359  110.629   1.4208 0.7031631 2.092243 
1 1 1    1    1   69 o  321.633   1.7629  4217.13   46.219  4162.13   62.016  4285.84   69.320  319.502   2.3812  324.202   2.6230 -4.700226 3.542657 
1 1 1    1    1   70 o  307.126   1.7031  3845.30   42.638  3771.74   57.013  3938.66   64.230  304.148   2.2996  310.792   2.5353 -6.644379 3.422864 
1 1 1    1    1   71 o  266.621   1.6091  2897.90   34.971  2915.90   49.766  2880.35   49.152  267.420   2.2830  265.785   2.2687 1.634521 3.218533 
1 1 1    1    1   72 f   89.792   1.1710  328.646   8.5708  326.757   11.714  330.821   12.573   89.529   1.6051   90.082   1.7123 -0.5536423 2.346988 
1 1 1    1    1   73 o  213.592   1.3943  1859.75   24.276  1815.32   33.965  1906.15   34.709  211.007   1.9747  216.221   1.9693 -5.214523 2.788817 
1 1 1    1    1   74 o  236.519   1.4862  2280.50   28.653  2265.21   40.502  2295.83   40.543  235.700   2.1080  237.288   2.0960 -1.588104 2.972748 
1 1 1    1    1   75 o  184.365   1.2270  1385.57   18.440  1399.38   25.164  1369.55   27.098  185.270   1.6662  183.279   1.8138 1.990356 2.462986 
1 1 1    1    1   76 o  144.379   1.0715  849.698   12.611  856.750   17.894  842.740   17.776  144.968   1.5142  143.778   1.5167 1.190216 2.143205 
1 1 1    1    1   77 o  159.278   1.1106  1034.13   14.419  1041.06   20.474  1027.31   20.311  159.800   1.5718  158.741   1.5697 1.058914 2.221334 
1 1 1    1    1   78 o  275.098   1.5089  3085.26   33.835  3084.86   47.854  3085.67   47.847  275.044   2.1344  275.080   2.1338 -0.3585815E-01 3.018116 
1 1 1    1    1   79 o  165.244   1.1313  1113.07   15.239  1106.63   21.455  1119.63   21.649  164.753   1.5976  165.718   1.6026 -0.9644928 2.262867 
1 1 1    1    1   80 o  150.834   1.0978  927.404   13.497  908.245   18.905  947.324   19.277  149.257   1.5539  152.434   1.5514 -3.177246 2.195734 
1 1 1    1    1   81 o  209.035   1.2699  1781.28   21.639  1767.93   30.460  1794.89   30.746  208.228   1.7945  209.810   1.7978 -1.581879 2.540141 
1 1 1    1    1   82 o  114.946   1.0548  538.591   9.8833  544.596   14.016  532.652   13.938  115.577   1.4877  114.302   1.4960 1.274567 2.109789 
1 1 1    1    1   83 o  389.341   2.0777  6181.93   65.939  6164.76   97.642  6196.33   89.404  388.661   3.0820  389.697   2.8145 -1.036011 4.173713 
1 1 1    1    1   84 o  262.067   1.5335  2800.12   32.758  2838.30   49.103  2769.50   43.974  263.793   2.2836  260.594   2.0701 3.199219 3.082220 
1 1 1    1    1   85 o  277.417   1.6001  3137.90   36.185  3136.73   53.700  3138.88   48.972  277.300   2.3757  277.415   2.1656 -0.1148682 3.214635 
1 1 1    1    1   86 o  374.372   2.1211  5716.45   64.728  5647.80   90.701  5787.70   92.402  371.985   2.9912  376.560   3.0103 -4.575623 4.243753 
1 1 1    1    1   87 o  272.093   1.7723  3019.06   39.309  2969.19   58.475  3060.19   53.097  269.746   2.6594  273.881   2.3783 -4.134949 3.567709 
1 1 1    1    1   88 o   74.819   1.4337  228.234   8.7442  223.580   12.292  233.002   12.442   74.011   2.0394   75.556   2.0219 -1.545403 2.871808 
1 1 1    1    1   89 o  236.185   1.5321  2274.56   29.496  2338.56   42.323  2214.11   41.131  239.434   2.1685  232.976   2.1658 6.457870 3.064792 
1 1 1    1    1   90 o  175.670   1.3939  1258.26   19.960  1324.85   30.588  1208.88   26.340  180.216   2.0822  172.162   1.8769 8.054108 2.803297 
1 1 1    1    1   91 o   47.491   1.6139   92.082   6.2388  106.459   9.5045   81.199   8.2698   51.028   2.2908   44.551   2.2848 6.476612 3.235490 
1 1 1    1    1   92 o   50.354   1.6243  103.511   6.6582  111.762   9.6582   96.039   9.1913   52.285   2.2715   48.455   2.3339 3.829201 3.256830 
1 1 1    1    1   93 o   68.149   1.4416  189.389   8.0082  195.373   13.806  186.355   9.8309   69.140   2.4536   67.568   1.7865 1.572067 3.035050 
1 1 1    1    1   94 o  131.812   1.3653  708.493   14.670  703.609   28.797  710.205   17.048  131.263   2.6914  131.960   1.5849 -0.6973572 3.123342 
1 1 1    1    1   95 o   76.505   1.3135  238.676   8.1914  250.322   11.725  227.573   11.449   78.331   1.8363   74.661   1.8826 3.669655 2.629914 
1 1 1    1    1   96 o  113.217   1.2907  522.704   11.912  509.114   15.833  540.427   18.081  111.711   1.7387  115.083   1.9275 -3.371506 2.595814 
1 1 1    1    1   97 o  121.362   1.2280  600.605   12.148  594.937   17.118  606.357   17.243  120.757   1.7390  121.911   1.7352 -1.153732 2.456638 
1 1 1    1    1   98 o  109.098   1.2168  485.370   10.821  474.535   14.000  501.447   17.054  107.853   1.5925  110.849   1.8874 -2.995667 2.469477 
1 1 1    1    1   99 o   26.769   2.6067   29.560   5.6162   28.268   7.6153   31.100   8.3159   26.011   3.6955   27.281   3.8461 -1.270338 5.333769 
1 1 1    1    1  100 o  127.665   1.1812  664.675   12.292  660.633   18.045  668.175   16.790  127.232   1.7399  127.968   1.6095 -0.7360992 2.370234 
1 1 1    1    1  101 o   60.342   1.3930  148.536   6.8516  155.392   9.6694  141.623   9.7100   61.663   1.9261   58.856   2.0269 2.806980 2.796092 
1 1 1    1    1  102 o  141.640   1.1689  818.240   13.495  826.048   19.185  810.593   18.988  142.264   1.6543  140.927   1.6529 1.336945 2.338557 
1 1 1    1    1  103 o   41.297   1.9214   69.804   6.4502   70.551   9.1425   69.064   9.1016   41.430   2.7223   40.987   2.7399 0.4431992 3.862385 
1 1 1    1    1  104 f   70.079   1.2874  200.374   7.3545  211.016   10.439  189.884   10.364   71.882   1.7815   68.156   1.8672 3.726196 2.580701 
1 1 1    1    1  105 o  110.127   1.1296  494.736   10.140  484.370   14.191  505.551   14.495  108.919   1.5984  111.275   1.5980 -2.356026 2.260189 
1 1 1    1    1  106 o   76.630   1.2675  239.632   7.9173  233.816   10.547  247.139   11.983   75.656   1.7102   77.762   1.8905 -2.106041 2.549262 
1 1 1    1    1  107 o   59.097   1.4613  142.607   7.0397  148.959   9.7653  135.735   10.158   60.319   1.9888   57.552   2.1691 2.767593 2.942823 
1 1 1    1    1  108 o   88.177   1.2607  317.381   9.0618  329.735   12.688  304.519   12.946   89.816   1.7331   86.298   1.8404 3.518486 2.527947 
1 1 1    1    1  109 o   81.339   1.2840  270.126   8.5135  270.832   11.823  269.367   12.270   81.378   1.7823   81.146   1.8549 0.2318192 2.572404 
1 1 1    1    1  110 o   62.739   1.3982  160.800   7.1507  170.769   9.9103  149.973   10.328   64.567   1.8850   60.467   2.0985 4.099678 2.820811 
1 1 1    1    1  111 o   35.928   1.9544   53.029   5.7024   51.181   7.4782   55.596   8.8144   35.182   2.6265   36.604   2.9799 -1.421455 3.972182 
1 1 1    1    1  112 o  113.885   1.2382  529.796   11.494  518.479   14.661  547.847   18.517  112.579   1.5976  115.614   1.9648 -3.035011 2.532366 
1 1 1    1    1  113 o   59.418   1.4557  144.379   7.0505  148.329   9.0937  138.427   11.163   60.134   1.8574   57.974   2.3672 2.160225 3.008931 
1 1 1    1    1  114 o   49.782   1.6058  101.556   6.5078  105.496   8.4028   95.652   10.287   50.656   2.0391   48.090   2.6343 2.565903 3.331314 
1 1 1    1    1  115 o   54.306   1.5306  120.817   6.7686  126.193   8.7441  112.780   10.692   55.417   1.9387   52.238   2.5182 3.179016 3.178034 
1 1 1    1    1  116 o   79.227   1.2231  256.594   7.8988  255.746   10.834  257.555   11.540   78.990   1.6827   79.241   1.7866 -0.2504501 2.454232 
1 1 1    1    1  117 f   45.454   1.5950   84.767   5.9004   92.999   8.1519   75.709   8.5514   47.496   2.1108   42.754   2.4642 4.742210 3.244643 
1 1 1    1    1  118 o   53.780   1.4408  118.523   6.3108  118.648   8.6327  118.379   9.2486   53.682   1.9762   53.579   2.1218 0.1021881 2.899533 
1 1 1    1    1  119 o   15.182   3.8563   10.091   4.7808   13.817   6.7192   6.2704   6.8036   17.647   4.6183   13.178   4.8357 4.469621 6.686715 
1 1 1    1    1  120 o   46.361   1.5306   88.214   5.7764   91.332   8.1427   85.055   8.1958   47.022   2.1299   45.346   2.2240 1.675385 3.079413 
1 1 1    1    1  121 o   43.740   1.6842   78.692   5.9937   87.897   9.0445   71.484   8.0035   46.014   2.4198   41.498   2.3760 4.516323 3.391283 
1 1 1    1    1  122 o   26.414   2.5136   29.214   5.3470   30.183   8.1344   28.477   7.0954   26.381   3.9000   25.774   3.4650 0.6077385 5.216893 
1 1 1    1    1  123 o   36.716   1.8810   55.711   5.6110   50.636   8.4953   59.637   7.4729   34.613   3.0418   37.818   2.4371 -3.204441 3.897738 
1 1 1    1    1  124 o   33.119   2.0446   45.526   5.4929   39.872   8.3290   49.879   7.3072   30.495   3.4089   34.477   2.6197 -3.982203 4.299223 
1 1 1    1    1  125 o   9.6174   3.9187   1.9101   4.8370   6.6679   7.2986  -1.8161   6.4591   13.351   4.9882   9.3325   4.1668 4.018027 6.499621 
1 1 1    1    1  126 f   18.846   3.2086   15.458   4.7528   12.816   6.7375   18.075   6.7055   16.704   4.7331   20.001   4.2444 -3.296688 6.357410 
1 1 1    1    1  127 o   9.7954   3.8818   2.6233   4.6079   4.1386   6.6490   1.2230   6.3919   11.758   4.6618   10.338   4.3806 1.419851 6.397058 
1 1 1    1    1  128 f   23.255   2.7570   23.136   5.1248   18.541   7.0975   28.142   7.4075   20.051   4.4579   25.231   3.7126 -5.179926 5.801353 
1 1 1    1    1  129 o   58.873   1.3947  142.703   6.6933  145.541   9.2436  139.574   9.7047   59.160   1.9193   57.845   2.0615 1.314888 2.816632 
1 1 1    1    1  130 o   8.4313   3.7999  -1.9152   5.5117  -6.8620   8.7643   1.3211   7.0890   9.4796   4.4532   10.706   4.5773 -1.226242 6.386179 
1 1 1    1    1  131 o   31.941   2.2715   42.984   5.8755   43.179   9.6029   42.868   7.4282   31.085   3.8736   31.567   2.9199 -0.4824181 4.850830 
1 1 1    1    1  132 o   24.973   3.2098   27.298   6.3833   23.983   9.1205   30.480   8.9371   22.257   5.1320   25.666   4.4319 -3.409037 6.780787 
1 1 1    1    1  133 o   10.350   4.3267   2.0742   6.1033   1.0464   8.7989   3.0273   8.4730   11.483   5.0045   11.980   5.0583 -0.4970798 7.115642 
1 1 1    1    1  134 o   35.519   2.8680   54.331   8.2332   55.445   11.581   53.191   11.707   34.901   4.1520   34.039   4.3161 0.8618546 5.988982 
1 1 1    1    1  135 o   19.806   5.2018   19.391   8.5045   7.0797   13.022   28.547   11.230   14.826   6.2661   23.612   5.8618 -8.785765 8.580531 
1 1 1    1    1  136 o   17.074   5.7845   14.663   9.5850 -26.7445   19.335   28.154   11.037   11.653   5.7400   23.430   5.8079 -11.77711 8.165766 
1 1 1    1    1  137 o   10.058   4.7734  -8.6437   10.558 -21.0968   18.421  -2.5519   12.884   11.849   5.7881   12.354   5.6612 -0.5040808 8.096360 
1 1 1    1    1  138 o   15.518   6.0475   11.006   11.023   16.377   19.288   8.4015   13.432   18.045   7.6262   15.147   6.3808 2.898142 9.943560 
1 1 1    1    1  139 o   12.754   6.1308 -13.1978   18.633 -13.1978   18.633   0.0000   0.0000   12.754   6.1308  ?   ?  0.000000 6.130756 
1 1 1    1    1  140 o   20.353   8.0815   25.618   20.009   25.618   20.009   0.0000   0.0000   20.353   8.0815  ?   ?  0.000000 8.081457 
1 1 1    2    0 -139 o   11.265   7.5094   1.3113   18.709   1.3113   18.709   1.3113   18.709   11.265   7.5094   11.265   7.5094 -0.000000 0.000000 
1 1 1    2    0 -138 o   15.553   9.1107   19.387   19.368   19.387   19.368   19.387   19.368   15.553   9.1107   15.553   9.1107 0.000000 0.000000 
1 1 1    2    0 -137 o   11.053   6.9513   5.8517   13.136   5.8517   13.136   5.8517   13.136   11.053   6.9513   11.053   6.9513 -0.000000 0.000000 
1 1 1    2    0 -136 o   9.8913   6.2502   3.8476   10.760   3.8476   10.760   3.8476   10.760   9.8913   6.2502   9.8913   6.2502 0.000000 0.000000 
1 1 1    2    0 -135 o   10.439   6.4694   5.3502   10.953   5.3502   10.953   5.3502   10.953   10.439   6.4694   10.439   6.4694 0.000000 0.000000 
1 1 1    2    0 -134 o   27.471   5.7072   36.872   11.273   36.872   11.273   36.872   11.273   27.471   5.7072   27.471   5.7072 0.000000 0.000000 
1 1 1    2    0 -133 o   32.929   3.2775   46.868   8.5825   46.868   8.5825   46.868   8.5825   32.929   3.2775   32.929   3.2775 0.000000 0.000000 
1 1 1    2    0 -132 o   34.528   3.1562   51.161   8.7039   51.161   8.7039   51.161   8.7039   34.528   3.1562   34.528   3.1562 0.000000 0.000000 
1 1 1    2    0 -131 o   28.433   4.2722   36.587   9.2426   36.587   9.2426   36.587   9.2426   28.433   4.2722   28.433   4.2722 -0.000000 0.000000 
1 1 1    2    0 -130 o   21.191   6.0146   23.567   8.9982   23.567   8.9982   23.567   8.9982   21.191   6.0146   21.191   6.0146 -0.000000 0.000000 
1 1 1    2    0 -129 o   48.066   2.3542   96.197   9.1731   96.197   9.1731   96.197   9.1731   48.066   2.3542   48.066   2.3542 0.000000 0.000000 
1 1 1    2    0 -128 o   5.9412   4.0930  -4.3180   6.5631  -4.3180   6.5631  -4.3180   6.5631   5.9412   4.0930   5.9412   4.0930 -0.000000 0.000000 
1 1 1    2    0 -127 o   28.880   3.4612   36.281   7.8389   36.281   7.8389   36.281   7.8389   28.880   3.4612   28.880   3.4612 0.000000 0.000000 
1 1 1    2    0 -126 o   8.6100   5.3081   2.9169   7.2825   2.9169   7.2825   2.9169   7.2825   8.6100   5.3081   8.6100   5.3081 0.000000 0.000000 
1 1 1    2    0 -125 o   53.058   2.2475  116.472   9.6806  116.472   9.6806  116.472   9.6806   53.058   2.2475   53.058   2.2475 -0.000000 0.000000 
1 1 1    2    0 -124 o   45.289   2.5065   85.283   9.1879   85.283   9.1879   85.283   9.1879   45.289   2.5065   45.289   2.5065 0.000000 0.000000 
1 1 1    2    0 -123 o   9.5497   5.6625   4.6303   7.6423   4.6303   7.6423   4.6303   7.6423   9.5497   5.6625   9.5497   5.6625 -0.000000 0.000000 
1 1 1    2    0 -122 o   5.9750   4.2224  -9.7256   8.3449  -9.7256   8.3449  -9.7256   8.3449   5.9750   4.2224   5.9750   4.2224 -0.000000 0.000000 
1 1 1    2    0 -121 o   78.712   1.8510  254.113   11.862  254.113   11.862  254.113   11.862   78.712   1.8510   78.712   1.8510 0.000000 0.000000 
1 1 1    2    0 -120 o   98.957   1.7542  401.059   14.140  401.059   14.140  401.059   14.140   98.957   1.7542   98.957   1.7542 -0.000000 0.000000 
1 1 1    2    0 -119 o   46.124   2.3256   87.923   8.6926   87.923   8.6926   87.923   8.6926   46.124   2.3256   46.124   2.3256 -0.000000 0.000000 
1 1 1    2    0 -118 o   24.150   3.8713   25.875   7.0344   25.875   7.0344   25.875   7.0344   24.150   3.8713   24.150   3.8713 0.000000 0.000000 
1 1 1    2    0 -117 o   53.437   1.9717  117.345   8.5621  117.345   8.5621  117.345   8.5621   53.437   1.9717   53.437   1.9717 -0.000000 0.000000 
1 1 1    2    0 -116 o   7.1953   4.6886  -0.4311   6.6738  -0.4311   6.6738  -0.4311   6.6738   7.1953   4.6886   7.1953   4.6886 -0.000000 0.000000 
1 1 1    2    0 -115 o   53.652   1.9963  118.243   8.7031  118.243   8.7031  118.243   8.7031   53.652   1.9963   53.652   1.9963 -0.000000 0.000000 
1 1 1    2    0 -114 o   26.728   3.4132   30.779   7.1053   30.779   7.1053   30.779   7.1053   26.728   3.4132   26.728   3.4132 -0.000000 0.000000 
1 1 1    2    0 -113 o   13.417   5.9166   10.777   6.7886   10.777   6.7886   10.777   6.7886   13.417   5.9166   13.417   5.9166 0.000000 0.000000 
1 1 1    2    0 -112 o   45.918   2.1939   86.823   8.1688   86.823   8.1688   86.823   8.1688   45.918   2.1939   45.918   2.1939 -0.000000 0.000000 
1 1 1    2    0 -111 o  122.108   1.6026  609.059   15.945  609.059   15.945  609.059   15.945  122.108   1.6026  122.108   1.6026 0.000000 0.000000 
1 1 1    2    0 -110 o   45.385   2.3233   84.877   8.5434   84.877   8.5434   84.877   8.5434   45.385   2.3233   45.385   2.3233 0.000000 0.000000 
1 1 1    2    0 -109 o   21.426   4.9004   21.578   7.4553   21.578   7.4553   21.578   7.4553   21.426   4.9004   21.426   4.9004 -0.000000 0.000000 
1 1 1    2    0 -108 o   84.904   1.7690  294.633   12.231  294.633   12.231  294.633   12.231   84.904   1.7690   84.904   1.7690 -0.000000 0.000000 
1 1 1    2    0 -107 o   28.427   3.2829   34.376   7.3435   34.376   7.3435   34.376   7.3435   28.427   3.2829   28.427   3.2829 0.000000 0.000000 
1 1 1    2    0 -106 o   58.041   1.9482  137.967   9.1935  137.967   9.1935  137.967   9.1935   58.041   1.9482   58.041   1.9482 0.000000 0.000000 
1 1 1    2    0 -105 o  111.960   1.5972  511.660   14.570  511.660   14.570  511.660   14.570  111.960   1.5972  111.960   1.5972 -0.000000 0.000000 
1 1 1    2    0 -104 o   12.350   6.1384   9.2513   7.4767   9.2513   7.4767   9.2513   7.4767   12.350   6.1384   12.350   6.1384 -0.000000 0.000000 
1 1 1    2    0 -103 f   89.132   1.7313  324.446   12.568  324.446   12.568  324.446   12.568   89.132   1.7313   89.132   1.7313 0.000000 0.000000 
1 1 1    2    0 -102 o   62.708   1.9897  160.916   10.147  160.916   10.147  160.916   10.147   62.708   1.9897   62.708   1.9897 0.000000 0.000000 
1 1 1    2    0 -101 o   79.260   1.7403  256.597   11.232  256.597   11.232  256.597   11.232   79.260   1.7403   79.260   1.7403 0.000000 0.000000 
1 1 1    2    0 -100 o   17.076   6.6840   16.408   8.8962   16.408   8.8962   16.408   8.8962   17.076   6.6840   17.076   6.6840 0.000000 0.000000 
1 1 1    2    0  -99 o   66.634   2.2401  181.758   12.136  181.758   12.136  181.758   12.136   66.634   2.2401   66.634   2.2401 0.000000 0.000000 
1 1 1    2    0  -98 o   97.446   1.9688  387.764   15.625  387.764   15.625  387.764   15.625   97.446   1.9688   97.446   1.9688 -0.000000 0.000000 
1 1 1    2    0  -97 o   20.048   6.7460   21.216   9.8468   21.216   9.8468   21.216   9.8468   20.048   6.7460   20.048   6.7460 -0.000000 0.000000 
1 1 1    2    0  -96 o  154.674   1.7954  975.974   22.630  975.974   22.630  975.974   22.630  154.674   1.7954  154.674   1.7954 -0.000000 0.000000 
1 1 1    2    0  -95 f   91.175   1.7930  339.366   13.314  339.366   13.314  339.366   13.314   91.175   1.7930   91.175   1.7930 0.000000 0.000000 
1 1 1    2    0  -94 o   32.887   2.9542   45.188   7.7654   45.188   7.7654   45.188   7.7654   32.887   2.9542   32.887   2.9542 0.000000 0.000000 
1 1 1    2    0  -93 o   30.478   3.1694   39.119   7.6616   39.119   7.6616   39.119   7.6616   30.478   3.1694   30.478   3.1694 -0.000000 0.000000 
1 1 1    2    0  -92 o  118.725   1.7335  575.068   16.769  575.068   16.769  575.068   16.769  118.725   1.7335  118.725   1.7335 -0.000000 0.000000 
1 1 1    2    0  -91 o   37.459   2.8439   58.220   8.5658   58.220   8.5658   58.220   8.5658   37.459   2.8439   37.459   2.8439 -0.000000 0.000000 
1 1 1    2    0  -90 o  326.599   2.4652  4350.85   65.622  4350.85   65.622  4350.85   65.622  326.599   2.4652  326.599   2.4652 0.000000 0.000000 
1 1 1    2    0  -89 o  121.677   1.7636  603.982   17.484  603.982   17.484  603.982   17.484  121.677   1.7636  121.677   1.7636 0.000000 0.000000 
1 1 1    2    0  -88 o   7.5147   5.0415  -3.4443   8.6760  -3.4443   8.6760  -3.4443   8.6760   7.5147   5.0415   7.5147   5.0415 -0.000000 0.000000 
1 1 1    2    0  -87 o  336.944   2.7698  4631.19   76.063  4631.19   76.063  4631.19   76.063  336.944   2.7698  336.944   2.7698 0.000000 0.000000 
1 1 1    2    0  -86 o  256.497   2.5441  2683.64   53.181  2683.64   53.181  2683.64   53.181  256.497   2.5441  256.497   2.5441 -0.000000 0.000000 
1 1 1    2    0  -85 o   26.529   3.4778   30.154   7.1628   30.154   7.1628   30.154   7.1628   26.529   3.4778   26.529   3.4778 0.000000 0.000000 
1 1 1    2    0  -84 o   61.528   1.7414  154.699   8.7179  154.699   8.7179  154.699   8.7179   61.528   1.7414   61.528   1.7414 0.000000 0.000000 
1 1 1    2    0  -83 o  132.656   1.5172  717.632   16.402  717.632   16.402  717.632   16.402  132.656   1.5172  132.656   1.5172 -0.000000 0.000000 
1 1 1    2    0  -82 f  237.065   1.9377  2291.59   37.439  2291.59   37.439  2291.59   37.439  237.065   1.9377  237.065   1.9377 0.000000 0.000000 
1 1 1    2    0  -81 o   64.039   1.6494  167.509   8.5973  167.509   8.5973  167.509   8.5973   64.039   1.6494   64.039   1.6494 -0.000000 0.000000 
1 1 1    2    0  -80 o  307.354   2.3200  3852.14   58.118  3852.14   58.118  3852.14   58.118  307.354   2.3200  307.354   2.3200 -0.000000 0.000000 
1 1 1    2    0  -79 o   79.875   1.5011  260.342   9.7658  260.342   9.7658  260.342   9.7658   79.875   1.5011   79.875   1.5011 -0.000000 0.000000 
1 1 1    2    0  -78 o  194.554   1.8806  1543.47   29.818  1543.47   29.818  1543.47   29.818  194.554   1.8806  194.554   1.8806 0.000000 0.000000 
1 1 1    2    0  -77 o  165.955   1.7424  1123.06   23.565  1123.06   23.565  1123.06   23.565  165.955   1.7424  165.955   1.7424 -0.000000 0.000000 
1 1 1    2    0  -76 o   66.003   1.6956  177.932   9.1092  177.932   9.1092  177.932   9.1092   66.003   1.6956   66.003   1.6956 -0.000000 0.000000 
1 1 1    2    0  -75 o   95.037   1.7849  368.566   13.816  368.566   13.816  368.566   13.816   95.037   1.7849   95.037   1.7849 -0.000000 0.000000 
1 1 1    2    0  -74 o  216.694   2.2339  1914.88   39.449  1914.88   39.449  1914.88   39.449  216.694   2.2339  216.694   2.2339 0.000000 0.000000 
1 1 1    2    0  -73 o  142.967   1.6648  833.507   19.395  833.507   19.395  833.507   19.395  142.967   1.6648  142.967   1.6648 -0.000000 0.000000 
1 1 1    2    0  -72 o  188.613   1.8503  1450.57   28.442  1450.57   28.442  1450.57   28.442  188.613   1.8503  188.613   1.8503 -0.000000 0.000000 
1 1 1    2    0  -71 o  433.461   3.3680  7662.71  118.986  7662.71  118.986  7662.71  118.986  433.461   3.3680  433.461   3.3680 -0.000000 0.000000 
1 1 1    2    0  -70 o  276.014   2.1284  3106.13   47.882  3106.13   47.882  3106.13   47.882  276.014   2.1284  276.014   2.1284 -0.000000 0.000000 
1 1 1    2    0  -69 o  327.574   2.6524  4375.34   70.814  4375.34   70.814  4375.34   70.814  327.574   2.6524  327.574   2.6524 0.000000 0.000000 
1 1 1    2    0  -68 o  177.450   1.7718  1283.89   25.623  1283.89   25.623  1283.89   25.623  177.450   1.7718  177.450   1.7718 -0.000000 0.000000 
1 1 1    2    0  -67 o   64.124   1.6810  167.947   8.7729  167.947   8.7729  167.947   8.7729   64.124   1.6810   64.124   1.6810 -0.000000 0.000000 
1 1 1    2    0  -66 o  210.446   1.9367  1805.67   33.216  1805.67   33.216  1805.67   33.216  210.446   1.9367  210.446   1.9367 0.000000 0.000000 
1 1 1    2    0  -65 o  235.789   2.0787  2266.70   39.946  2266.70   39.946  2266.70   39.946  235.789   2.0787  235.789   2.0787 0.000000 0.000000 
1 1 1    2    0  -64 o   79.463   1.4488  257.627   9.3776  257.627   9.3776  257.627   9.3776   79.463   1.4488   79.463   1.4488 0.000000 0.000000 
1 1 1    2    0  -63 o  721.733   4.9105 21242.62  288.862 21242.62  288.862 21242.62  288.862  721.733   4.9105  721.733   4.9105 0.000000 0.000000 
1 1 1    2    0  -62 o   48.924   1.8019   97.958   7.1638   97.958   7.1638   97.958   7.1638   48.924   1.8019   48.924   1.8019 -0.000000 0.000000 
1 1 1    2    0  -61 o  319.410   2.3694  4159.22   61.685  4159.22   61.685  4159.22   61.685  319.410   2.3694  319.410   2.3694 0.000000 0.000000 
1 1 1    2    0  -60 o   16.533   4.9722   13.779   5.8392   13.779   5.8392   13.779   5.8392   16.533   4.9722   16.533   4.9722 -0.000000 0.000000 
1 1 1    2    0  -59 o  226.801   1.8487  2097.01   34.173  2097.01   34.173  2097.01   34.173  226.801   1.8487  226.801   1.8487 0.000000 0.000000 
1 1 1    2    0  -58 o   87.574   1.7585  312.966   12.541  312.966   12.541  312.966   12.541   87.574   1.7585   87.574   1.7585 -0.000000 0.000000 
1 1 1    2    0  -57 o  255.789   2.0034  2667.27   41.766  2667.27   41.766  2667.27   41.766  255.789   2.0034  255.789   2.0034 0.000000 0.000000 
1 1 1    2    0  -56 o  337.508   2.4761  4643.74   68.115  4643.74   68.115  4643.74   68.115  337.508   2.4761  337.508   2.4761 0.000000 0.000000 
1 1 1    2    0  -55 o  220.154   1.8250  1975.89   32.746  1975.89   32.746  1975.89   32.746  220.154   1.8250  220.154   1.8250 -0.000000 0.000000 
1 1 1    2    0  -54 o   90.615   1.6661  335.011   12.297  335.011   12.297  335.011   12.297   90.615   1.6661   90.615   1.6661 -0.000000 0.000000 
1 1 1    2    0  -53 o  163.747   1.9428  1093.33   25.924  1093.33   25.924  1093.33   25.924  163.747   1.9428  163.747   1.9428 0.000000 0.000000 
1 1 1    2    0  -52 o  593.575   4.4730 14364.67  216.399 14364.67  216.399 14364.67  216.399  593.575   4.4730  593.575   4.4730 -0.000000 0.000000 
1 1 1    2    0  -51 o  680.722   5.6901 18894.53  315.687 18894.53  315.687 18894.53  315.687  680.722   5.6901  680.722   5.6901 0.000000 0.000000 
1 1 1    2    0  -50 o   39.648   2.2535   64.690   7.2289   64.690   7.2289   64.690   7.2289   39.648   2.2535   39.648   2.2535 0.000000 0.000000 
1 1 1    2    0  -49 o   11.406   5.4446   7.7847   5.7974   7.7847   5.7974   7.7847   5.7974   11.406   5.4446   11.406   5.4446 0.000000 0.000000 
1 1 1    2    0  -48 o  448.309   3.4497  8193.53  126.048  8193.53  126.048  8193.53  126.048  448.309   3.4497  448.309   3.4497 0.000000 0.000000 
1 1 1    2    0  -47 o   23.337   3.0163   23.286   5.4743   23.286   5.4743   23.286   5.4743   23.337   3.0163   23.337   3.0163 0.000000 0.000000 
1 1 1    2    0  -46 o  265.426   2.2351  2872.09   48.351  2872.09   48.351  2872.09   48.351  265.426   2.2351  265.426   2.2351 -0.000000 0.000000 
1 1 1    2    0  -45 o  236.370   2.0459  2277.71   39.413  2277.71   39.413  2277.71   39.413  236.370   2.0459  236.370   2.0459 -0.000000 0.000000 
1 1 1    2    0  -44 o  170.013   1.8738  1178.52   25.962  1178.52   25.962  1178.52   25.962  170.013   1.8738  170.013   1.8738 -0.000000 0.000000 
1 1 1    2    0  -43 o  188.635   2.2735  1450.96   34.946  1450.96   34.946  1450.96   34.946  188.635   2.2735  188.635   2.2735 0.000000 0.000000 
1 1 1    2    0  -42 o  422.904   3.6484  7291.60  125.750  7291.60  125.750  7291.60  125.750  422.904   3.6484  422.904   3.6484 0.000000 0.000000 
1 1 1    2    0  -41 o  630.780   4.3093 16220.90  221.552 16220.90  221.552 16220.90  221.552  630.780   4.3093  630.780   4.3093 0.000000 0.000000 
1 1 1    2    0  -40 o  186.305   1.6033  1415.01   24.345  1415.01   24.345  1415.01   24.345  186.305   1.6033  186.305   1.6033 -0.000000 0.000000 
1 1 1    2    0  -39 o  985.147   6.6340 39573.96  532.683 39573.96  532.683 39573.96  532.683  985.147   6.6340  985.147   6.6340 -0.000000 0.000000 
1 1 1    2    0  -38 o  158.355   1.8046  1022.47   23.287  1022.47   23.287  1022.47   23.287  158.355   1.8046  158.355   1.8046 -0.000000 0.000000 
1 1 1    2    0  -37 o  235.824   1.8567  2267.13   35.687  2267.13   35.687  2267.13   35.687  235.824   1.8567  235.824   1.8567 0.000000 0.000000 
1 1 1    2    0  -36 o   24.480   2.2150   25.020   4.3326   25.020   4.3326   25.020   4.3326   24.480   2.2150   24.480   2.2150 -0.000000 0.000000 
1 1 1    2    0  -35 o  424.242   2.9854  7337.35  103.230  7337.35  103.230  7337.35  103.230  424.242   2.9854  424.242   2.9854 -0.000000 0.000000 
1 1 1    2    0  -34 o  211.571   1.7183  1824.81   29.629  1824.81   29.629  1824.81   29.629  211.571   1.7183  211.571   1.7183 0.000000 0.000000 
1 1 1    2    0  -33 o  636.769   4.3468 16532.28  225.599 16532.28  225.599 16532.28  225.599  636.769   4.3468  636.769   4.3468 0.000000 0.000000 
1 1 1    2    0  -32 o   38.162   1.8282   59.766   5.6571   59.766   5.6571   59.766   5.6571   38.162   1.8282   38.162   1.8282 0.000000 0.000000 
1 1 1    2    0  -31 o  828.315   5.5979 27979.35  377.928 27979.35  377.928 27979.35  377.928  828.315   5.5979  828.315   5.5979 0.000000 0.000000 
1 1 1    2    0  -30 o  367.847   2.6288  5516.30   78.816  5516.30   78.816  5516.30   78.816  367.847   2.6288  367.847   2.6288 -0.000000 0.000000 
1 1 1    2    0  -29 o  385.688   2.9998  6064.70   94.299  6064.70   94.299  6064.70   94.299  385.688   2.9998  385.688   2.9998 -0.000000 0.000000 
1 1 1    2    0  -28 o  112.751   1.3772  518.380   12.654  518.380   12.654  518.380   12.654  112.751   1.3772  112.751   1.3772 -0.000000 0.000000 
1 1 1    2    0  -27 f  296.978   2.6918  3595.84   65.152  3595.84   65.152  3595.84   65.152  296.978   2.6918  296.978   2.6918 -0.000000 0.000000 
1 1 1    2    0  -26 o  592.539   4.9698 14317.00  240.006 14317.00  240.006 14317.00  240.006  592.539   4.9698  592.539   4.9698 -0.000000 0.000000 
1 1 1    2    0  -25 o  130.555   1.4427  694.965   15.350  694.965   15.350  694.965   15.350  130.555   1.4427  130.555   1.4427 0.000000 0.000000 
1 1 1    2    0  -24 o   65.256   1.6758  173.908   8.9010  173.908   8.9010  173.908   8.9010   65.256   1.6758   65.256   1.6758 -0.000000 0.000000 
1 1 1    2    0  -23 o  182.253   2.1956  1354.46   32.607  1354.46   32.607  1354.46   32.607  182.253   2.1956  182.253   2.1956 -0.000000 0.000000 
1 1 1    2    0  -22 o  107.455   2.1092  471.166   18.458  471.166   18.458  471.166   18.458  107.455   2.1092  107.455   2.1092 -0.000000 0.000000 
1 1 1    2    0  -21 o   74.381   1.6418  225.826   9.9438  225.826   9.9438  225.826   9.9438   74.381   1.6418   74.381   1.6418 0.000000 0.000000 
1 1 1    2    0  -20 o  408.044   4.0646  6788.98  135.163  6788.98  135.163  6788.98  135.163  408.044   4.0646  408.044   4.0646 0.000000 0.000000 
1 1 1    2    0  -19 o  281.368   2.5650  3227.63   58.818  3227.63   58.818  3227.63   58.818  281.368   2.5650  281.368   2.5650 0.000000 0.000000 
1 1 1    2    0  -18 o  1198.99   8.8058 58633.28  860.531 58633.28  860.531 58633.28  860.531  1198.99   8.8058  1198.99   8.8058 -0.000000 0.000000 
1 1 1    2    0  -17 o  345.887   3.0488  4877.57   85.946  4877.57   85.946  4877.57   85.946  345.887   3.0488  345.887   3.0488 0.000000 0.000000 
1 1 1    2    0  -16 o  908.624   7.4980 33668.54  555.265 33668.54  555.265 33668.54  555.265  908.624   7.4980  908.624   7.4980 -0.000000 0.000000 
1 1 1    2    0  -15 o  1318.17   10.806 70887.62  1160.93 70887.62  1160.93 70887.62  1160.93  1318.17   10.806  1318.17   10.806 -0.000000 0.000000 
1 1 1    2    0  -14 f  549.407   4.6208 12306.87  206.909 12306.87  206.909 12306.87  206.909  549.407   4.6208  549.407   4.6208 -0.000000 0.000000 
1 1 1    2    0  -13 o  140.612   1.8889  806.301   21.641  806.301   21.641  806.301   21.641  140.612   1.8889  140.612   1.8889 0.000000 0.000000 
1 1 1    2    0  -12 o  833.256   6.1569 28310.23  418.138 28310.23  418.138 28310.23  418.138  833.256   6.1569  833.256   6.1569 0.000000 0.000000 
1 1 1    2    0  -11 o   13.194   2.0525   7.5914   2.0484   7.5914   2.0484   7.5914   2.0484   13.194   2.0525   13.194   2.0525 -0.000000 0.000000 
1 1 1    2    0  -10 o   63.271   1.1743  163.329   6.0516  163.329   6.0516  163.329   6.0516   63.271   1.1743   63.271   1.1743 0.000000 0.000000 
1 1 1    2    0   -9 o  121.728   1.5016  604.219   14.894  604.219   14.894  604.219   14.894  121.728   1.5016  121.728   1.5016 -0.000000 0.000000 
1 1 1    2    0   -8 o   56.244   1.2869  129.133   5.8931  129.133   5.8931  129.133   5.8931   56.244   1.2869   56.244   1.2869 -0.000000 0.000000 
1 1 1    2    0   -7 o  820.135   6.7818 27428.27  453.318 27428.27  453.318 27428.27  453.318  820.135   6.7818  820.135   6.7818 -0.000000 0.000000 
1 1 1    2    0   -6 o  916.599   8.7365 34269.11  652.623 34269.11  652.623 34269.11  652.623  916.599   8.7365  916.599   8.7365 -0.000000 0.000000 
1 1 1    2    0   -5 o   98.484   1.6284  395.644   13.065  395.644   13.065  395.644   13.065   98.484   1.6284   98.484   1.6284 -0.000000 0.000000 
1 1 1    2    0   -4 o  710.755   6.8128 20601.52  394.633 20601.52  394.633 20601.52  394.633  710.755   6.8128  710.755   6.8128 0.000000 0.000000 
1 1 1    2    0   -3 o  142.667   1.8814  830.028   21.872  830.028   21.872  830.028   21.872  142.667   1.8814  142.667   1.8814 0.000000 0.000000 
1 1 1    2    0   -2 o   32.453   1.3606   43.153   3.5851   43.153   3.5851   43.153   3.5851   32.453   1.3606   32.453   1.3606 -0.000000 0.000000 
1 1 1    2    0   -1 o  165.838   2.0384  1121.46   27.546  1121.46   27.546  1121.46   27.546  165.838   2.0384  165.838   2.0384 0.000000 0.000000 
1 1 1    2    0    0 o  356.956   3.1188  5194.72   90.731  5194.72   90.731  5194.72   90.731  356.956   3.1188  356.956   3.1188 -0.000000 0.000000 
1 1 1    2    0    1 o  608.822   5.0878 15113.04  252.456 15113.04  252.456 15113.04  252.456  608.822   5.0878  608.822   5.0878 0.000000 0.000000 
1 1 1    2    0    2 o  943.247   8.9791 36291.64  690.248 36291.64  690.248 36291.64  690.248  943.247   8.9791  943.247   8.9791 0.000000 0.000000 
1 1 1    2    0    3 o  994.302   11.576 40346.34  937.977 40346.34  937.977 40346.34  937.977  994.302   11.576  994.302   11.576 0.000000 0.000000 
1 1 1    2    0    4 o  781.489   9.1521 24915.56  582.833 24915.56  582.833 24915.56  582.833  781.489   9.1521  781.489   9.1521 0.000000 0.000000 
1 1 1    2    0    5 o   30.716   1.9901   38.937   4.9341   38.937   4.9341   38.937   4.9341   30.716   1.9901   30.716   1.9901 0.000000 0.000000 
1 1 1    2    0    6 o  128.902   2.2035  677.833   23.138  677.833   23.138  677.833   23.138  128.902   2.2035  128.902   2.2035 -0.000000 0.000000 
1 1 1    2    0    8 o  379.286   4.6611  5866.78  144.059  5866.78  144.059  5866.78  144.059  379.286   4.6611  379.286   4.6611 -0.000000 0.000000 
1 1 1    2    0    9 o  932.263   10.873 35464.94  826.027 35464.94  826.027 35464.94  826.027  932.263   10.873  932.263   10.873 0.000000 0.000000 
1 1 1    2    0   10 o  281.562   3.6268  3233.02   83.208  3233.02   83.208  3233.02   83.208  281.562   3.6268  281.562   3.6268 -0.000000 0.000000 
1 1 1    2    0   11 o  251.494   3.3240  2579.41   68.117  2579.41   68.117  2579.41   68.117  251.494   3.3240  251.494   3.3240 -0.000000 0.000000 
1 1 1    2    0   12 o  420.966   5.1167  7227.17  175.521  7227.17  175.521  7227.17  175.521  420.966   5.1167  420.966   5.1167 0.000000 0.000000 
1 1 1    2    0   13 o  611.317   7.2301 15243.04  360.172 15243.04  360.172 15243.04  360.172  611.317   7.2301  611.317   7.2301 0.000000 0.000000 
1 1 1    2    0   15 o  328.579   4.1273  4402.92  110.507  4402.92  110.507  4402.92  110.507  328.579   4.1273  328.579   4.1273 -0.000000 0.000000 
1 1 1    2    0   16 o  264.914   3.4532  2862.01   74.540  2862.01   74.540  2862.01   74.540  264.914   3.4532  264.914   3.4532 -0.000000 0.000000 
1 1 1    2    0   17 o  1409.87   11.565 81105.05  1328.90 81105.05  1328.90 81105.05  1328.90  1409.87   11.565  1409.87   11.565 0.000000 0.000000 
1 1 1    2    0   18 o  191.434   2.2477  1494.31   35.063  1494.31   35.063  1494.31   35.063  191.434   2.2477  191.434   2.2477 -0.000000 0.000000 
1 1 1    2    0   19 o  188.940   2.2271  1455.62   34.289  1455.62   34.289  1455.62   34.289  188.940   2.2271  188.940   2.2271 0.000000 0.000000 
1 1 1    2    0   20 o  552.674   5.3679 12455.54  241.777 12455.54  241.777 12455.54  241.777  552.674   5.3679  552.674   5.3679 -0.000000 0.000000 
1 1 1    2    0   21 o  683.541   5.6892 19051.84  316.945 19051.84  316.945 19051.84  316.945  683.541   5.6892  683.541   5.6892 -0.000000 0.000000 
1 1 1    2    0   22 o  271.854   2.4957  3013.07   55.295  3013.07   55.295  3013.07   55.295  271.854   2.4957  271.854   2.4957 -0.000000 0.000000 
1 1 1    2    0   23 o  364.119   2.6019  5404.88   77.218  5404.88   77.218  5404.88   77.218  364.119   2.6019  364.119   2.6019 0.000000 0.000000 
1 1 1    2    0   24 o  183.757   1.7023  1376.63   25.494  1376.63   25.494  1376.63   25.494  183.757   1.7023  183.757   1.7023 -0.000000 0.000000 
1 1 1    2    0   25 o  232.589   1.9936  2205.45   37.791  2205.45   37.791  2205.45   37.791  232.589   1.9936  232.589   1.9936 0.000000 0.000000 
1 1 1    2    0   26 o  131.263   1.4559  702.526   15.574  702.526   15.574  702.526   15.574  131.263   1.4559  131.263   1.4559 0.000000 0.000000 
1 1 1    2    0   27 f   31.789   1.7133   41.547   4.4099   41.547   4.4099   41.547   4.4099   31.789   1.7133   31.789   1.7133 -0.000000 0.000000 
1 1 1    2    0   28 o   31.856   1.4951   41.633   3.8628   41.633   3.8628   41.633   3.8628   31.856   1.4951   31.856   1.4951 0.000000 0.000000 
1 1 1    2    0   29 o  108.534   1.2543  480.307   11.093  480.307   11.093  480.307   11.093  108.534   1.2543  108.534   1.2543 0.000000 0.000000 
1 1 1    2    0   30 o  408.888   3.5323  6816.90  117.712  6816.90  117.712  6816.90  117.712  408.888   3.5323  408.888   3.5323 0.000000 0.000000 
1 1 1    2    0   31 o  767.658   6.3652 24036.10  398.244 24036.10  398.244 24036.10  398.244  767.658   6.3652  767.658   6.3652 0.000000 0.000000 
1 1 1    2    0   32 o  181.662   1.9062  1345.54   28.219  1345.54   28.219  1345.54   28.219  181.662   1.9062  181.662   1.9062 -0.000000 0.000000 
1 1 1    2    0   33 o  1021.22   8.4097 42551.34  699.951 42551.34  699.951 42551.34  699.951  1021.22   8.4097  1021.22   8.4097 -0.000000 0.000000 
1 1 1    2    0   34 o   15.122   3.3095   10.553   3.5721   10.553   3.5721   10.553   3.5721   15.122   3.3095   15.122   3.3095 0.000000 0.000000 
1 1 1    2    0   35 o  265.690   2.0212  2877.73   43.770  2877.73   43.770  2877.73   43.770  265.690   2.0212  265.690   2.0212 0.000000 0.000000 
1 1 1    2    0   36 o  721.044   4.8992 21197.84  287.921 21197.84  287.921 21197.84  287.921  721.044   4.8992  721.044   4.8992 -0.000000 0.000000 
1 1 1    2    0   37 o  538.694   4.5459 11832.13  199.585 11832.13  199.585 11832.13  199.585  538.694   4.5459  538.694   4.5459 0.000000 0.000000 
1 1 1    2    0   38 o  223.222   1.7901  2031.31   32.568  2031.31   32.568  2031.31   32.568  223.222   1.7901  223.222   1.7901 0.000000 0.000000 
1 1 1    2    0   39 o  1021.08   6.8632 42514.51  571.184 42514.51  571.184 42514.51  571.184  1021.08   6.8632  1021.08   6.8632 0.000000 0.000000 
1 1 1    2    0   40 o  316.447   2.3265  4082.20   60.004  4082.20   60.004  4082.20   60.004  316.447   2.3265  316.447   2.3265 -0.000000 0.000000 
1 1 1    2    0   41 o   37.378   1.8395   57.358   5.5738   57.358   5.5738   57.358   5.5738   37.378   1.8395   37.378   1.8395 0.000000 0.000000 
1 1 1    2    0   42 o  1172.53   8.6155 56068.98  823.360 56068.98  823.360 56068.98  823.360  1172.53   8.6155  1172.53   8.6155 0.000000 0.000000 
1 1 1    2    0   43 o  816.877   6.7685 27209.91  450.625 27209.91  450.625 27209.91  450.625  816.877   6.7685  816.877   6.7685 -0.000000 0.000000 
1 1 1    2    0   44 o  1016.48   8.3807 42137.64  694.298 42137.64  694.298 42137.64  694.298  1016.48   8.3807  1016.48   8.3807 -0.000000 0.000000 
1 1 1    2    0   45 o  612.864   4.5985 15313.05  229.701 15313.05  229.701 15313.05  229.701  612.864   4.5985  612.864   4.5985 0.000000 0.000000 
1 1 1    2    0   46 o  563.372   4.2478 12939.53  195.045 12939.53  195.045 12939.53  195.045  563.372   4.2478  563.372   4.2478 0.000000 0.000000 
1 1 1    2    0   47 o  134.518   1.5555  737.810   17.051  737.810   17.051  737.810   17.051  134.518   1.5555  134.518   1.5555 -0.000000 0.000000 
1 1 1    2    0   48 o  337.221   2.4621  4635.77   67.671  4635.77   67.671  4635.77   67.671  337.221   2.4621  337.221   2.4621 0.000000 0.000000 
1 1 1    2    0   49 o  137.768   1.4403  773.840   16.171  773.840   16.171  773.840   16.171  137.768   1.4403  137.768   1.4403 -0.000000 0.000000 
1 1 1    2    0   50 o  182.068   1.6290  1351.41   24.172  1351.41   24.172  1351.41   24.172  182.068   1.6290  182.068   1.6290 0.000000 0.000000 
1 1 1    2    0   51 o   62.117   1.6501  157.598   8.3417  157.598   8.3417  157.598   8.3417   62.117   1.6501   62.117   1.6501 0.000000 0.000000 
1 1 1    2    0   52 o   78.815   1.5486  253.472   9.9405  253.472   9.9405  253.472   9.9405   78.815   1.5486   78.815   1.5486 0.000000 0.000000 
1 1 1    2    0   53 o  478.104   3.3467  9318.64  130.415  9318.64  130.415  9318.64  130.415  478.104   3.3467  478.104   3.3467 -0.000000 0.000000 
1 1 1    2    0   54 o  118.552   1.4733  573.106   14.232  573.106   14.232  573.106   14.232  118.552   1.4733  118.552   1.4733 -0.000000 0.000000 
1 1 1    2    0   55 o   99.561   1.7568  404.391   14.248  404.391   14.248  404.391   14.248   99.561   1.7568   99.561   1.7568 0.000000 0.000000 
1 1 1    2    0   56 o  125.826   1.8097  645.697   18.553  645.697   18.553  645.697   18.553  125.826   1.8097  125.826   1.8097 0.000000 0.000000 
1 1 1    2    0   57 o  641.833   4.8081 16796.65  251.520 16796.65  251.520 16796.65  251.520  641.833   4.8081  641.833   4.8081 -0.000000 0.000000 
1 1 1    2    0   58 o  296.762   2.4484  3590.36   59.218  3590.36   59.218  3590.36   59.218  296.762   2.4484  296.762   2.4484 0.000000 0.000000 
1 1 1    2    0   59 o  412.451   2.9316  6935.23   98.551  6935.23   98.551  6935.23   98.551  412.451   2.9316  412.451   2.9316 0.000000 0.000000 
1 1 1    2    0   60 o  138.141   1.4755  778.056   16.611  778.056   16.611  778.056   16.611  138.141   1.4755  138.141   1.4755 -0.000000 0.000000 
1 1 1    2    0   61 o  874.352   5.9075 31178.92  421.001 31178.92  421.001 31178.92  421.001  874.352   5.9075  874.352   5.9075 -0.000000 0.000000 
1 1 1    2    0   62 o  764.814   5.1923 23854.40  323.673 23854.40  323.673 23854.40  323.673  764.814   5.1923  764.814   5.1923 0.000000 0.000000 
1 1 1    2    0   63 o  360.547   2.8633  5300.01   84.139  5300.01   84.139  5300.01   84.139  360.547   2.8633  360.547   2.8633 -0.000000 0.000000 
1 1 1    2    0   64 o   15.637   5.3380   12.923   6.1052   12.923   6.1052   12.923   6.1052   15.637   5.3380   15.637   5.3380 -0.000000 0.000000 
1 1 1    2    0   65 o  109.632   1.6976  490.256   15.162  490.256   15.162  490.256   15.162  109.632   1.6976  109.632   1.6976 0.000000 0.000000 
1 1 1    2    0   66 o  252.006   2.1743  2589.26   44.657  2589.26   44.657  2589.26   44.657  252.006   2.1743  252.006   2.1743 -0.000000 0.000000 
1 1 1    2    0   67 o  362.113   2.8782  5346.57   84.945  5346.57   84.945  5346.57   84.945  362.113   2.8782  362.113   2.8782 0.000000 0.000000 
1 1 1    2    0   68 o  389.983   3.0715  6201.56   97.628  6201.56   97.628  6201.56   97.628  389.983   3.0715  389.983   3.0715 -0.000000 0.000000 
1 1 1    2    0   69 o  273.722   2.3220  3054.91   51.800  3054.91   51.800  3054.91   51.800  273.722   2.3220  273.722   2.3220 0.000000 0.000000 
1 1 1    2    0   70 o  191.545   1.8656  1495.99   29.124  1495.99   29.124  1495.99   29.124  191.545   1.8656  191.545   1.8656 0.000000 0.000000 
1 1 1    2    0   71 o   76.263   1.6792  237.416   10.428  237.416   10.428  237.416   10.428   76.263   1.6792   76.263   1.6792 -0.000000 0.000000 
1 1 1    2    0   72 o  170.116   1.6041  1179.95   22.240  1179.95   22.240  1179.95   22.240  170.116   1.6041  170.116   1.6041 0.000000 0.000000 
1 1 1    2    0   73 o   19.810   4.1312   17.938   5.8808   17.938   5.8808   17.938   5.8808   19.810   4.1312   19.810   4.1312 0.000000 0.000000 
1 1 1    2    0   74 o  145.528   1.6522  863.622   19.594  863.622   19.594  863.622   19.594  145.528   1.6522  145.528   1.6522 -0.000000 0.000000 
1 1 1    2    0   75 o   47.382   1.8574   91.939   7.1487   91.939   7.1487   91.939   7.1487   47.382   1.8574   47.382   1.8574 -0.000000 0.000000 
1 1 1    2    0   76 o   75.811   1.5167  234.555   9.3641  234.555   9.3641  234.555   9.3641   75.811   1.5167   75.811   1.5167 0.000000 0.000000 
1 1 1    2    0   77 o  223.919   1.8610  2044.38   33.963  2044.38   33.963  2044.38   33.963  223.919   1.8610  223.919   1.8610 0.000000 0.000000 
1 1 1    2    0   78 o   71.901   1.5651  211.037   9.1631  211.037   9.1631  211.037   9.1631   71.901   1.5651   71.901   1.5651 0.000000 0.000000 
1 1 1    2    0   79 o   11.473   5.7067   7.9044   6.4642   7.9044   6.4642   7.9044   6.4642   11.473   5.7067   11.473   5.7067 0.000000 0.000000 
1 1 1    2    0   80 o  435.225   3.3859  7727.13  120.105  7727.13  120.105  7727.13  120.105  435.225   3.3859  435.225   3.3859 0.000000 0.000000 
1 1 1    2    0   81 o   67.219   1.7712  184.579   9.6899  184.579   9.6899  184.579   9.6899   67.219   1.7712   67.219   1.7712 -0.000000 0.000000 
1 1 1    2    0   82 f  215.296   1.9995  1890.18   35.084  1890.18   35.084  1890.18   35.084  215.296   1.9995  215.296   1.9995 0.000000 0.000000 
1 1 1    2    0   83 o  140.326   1.6800  803.073   19.211  803.073   19.211  803.073   19.211  140.326   1.6800  140.326   1.6800 0.000000 0.000000 
1 1 1    2    0   84 o  539.428   3.7537 11873.50  165.038 11873.50  165.038 11873.50  165.038  539.428   3.7537  539.428   3.7537 -0.000000 0.000000 
1 1 1    2    0   85 o  142.130   1.7430  823.901   20.188  823.901   20.188  823.901   20.188  142.130   1.7430  142.130   1.7430 -0.000000 0.000000 
1 1 1    2    0   86 o   91.771   1.8039  343.741   13.483  343.741   13.483  343.741   13.483   91.771   1.8039   91.771   1.8039 -0.000000 0.000000 
1 1 1    2    0   87 o   43.665   3.5289   79.301   12.366   79.301   12.366   79.301   12.366   43.665   3.5289   43.665   3.5289 -0.000000 0.000000 
1 1 1    2    0   88 o   15.047   6.9639   13.509   9.4256   13.509   9.4256   13.509   9.4256   15.047   6.9639   15.047   6.9639 0.000000 0.000000 
1 1 1    2    0   89 o  192.790   1.7867  1515.71   28.072  1515.71   28.072  1515.71   28.072  192.790   1.7867  192.790   1.7867 0.000000 0.000000 
1 1 1    2    0   90 o   99.604   1.7519  404.850   14.214  404.850   14.214  404.850   14.214   99.604   1.7519   99.604   1.7519 -0.000000 0.000000 
1 1 1    2    0   91 o  135.092   1.7363  744.433   19.113  744.433   19.113  744.433   19.113  135.092   1.7363  135.092   1.7363 0.000000 0.000000 
1 1 1    2    0   92 o   8.6356   5.3871   1.8230   7.7223   1.8230   7.7223   1.8230   7.7223   8.6356   5.3871   8.6356   5.3871 0.000000 0.000000 
1 1 1    2    0   93 o   51.501   2.3010  108.819   9.6156  108.819   9.6156  108.819   9.6156   51.501   2.3010   51.501   2.3010 0.000000 0.000000 
1 1 1    2    0   94 o   30.517   3.5206   39.507   8.4551   39.507   8.4551   39.507   8.4551   30.517   3.5206   30.517   3.5206 0.000000 0.000000 
1 1 1    2    0   95 f   26.891   4.3795   31.789   8.8359   31.789   8.8359   31.789   8.8359   26.891   4.3795   26.891   4.3795 0.000000 0.000000 
1 1 1    2    0   96 o  135.457   1.9774  748.784   21.823  748.784   21.823  748.784   21.823  135.457   1.9774  135.457   1.9774 -0.000000 0.000000 
1 1 1    2    0   97 o   37.353   2.6520   57.789   7.9796   57.789   7.9796   57.789   7.9796   37.353   2.6520   37.353   2.6520 -0.000000 0.000000 
1 1 1    2    0   98 o   12.643   6.0758   9.6301   7.2331   9.6301   7.2331   9.6301   7.2331   12.643   6.0758   12.643   6.0758 -0.000000 0.000000 
1 1 1    2    0   99 o   44.060   2.3893   79.905   8.5232   79.905   8.5232   79.905   8.5232   44.060   2.3893   44.060   2.3893 -0.000000 0.000000 
1 1 1    2    0  100 o  292.808   2.4952  3499.84   59.547  3499.84   59.547  3499.84   59.547  292.808   2.4952  292.808   2.4952 0.000000 0.000000 
1 1 1    2    0  101 o   54.909   2.2565  123.649   10.061  123.649   10.061  123.649   10.061   54.909   2.2565   54.909   2.2565 -0.000000 0.000000 
1 1 1    2    0  102 o   73.701   2.0638  222.155   12.377  222.155   12.377  222.155   12.377   73.701   2.0638   73.701   2.0638 -0.000000 0.000000 
1 1 1    2    0  103 f   22.306   6.1286   24.517   9.6344   24.517   9.6344   24.517   9.6344   22.306   6.1286   22.306   6.1286 0.000000 0.000000 
1 1 1    2    0  104 o   13.169   6.5211   10.536   8.4240   10.536   8.4240   10.536   8.4240   13.169   6.5211   13.169   6.5211 -0.000000 0.000000 
1 1 1    2    0  105 o   28.342   3.9385   34.742   8.5974   34.742   8.5974   34.742   8.5974   28.342   3.9385   28.342   3.9385 0.000000 0.000000 
1 1 1    2    0  106 o  181.762   1.8987  1348.86   28.124  1348.86   28.124  1348.86   28.124  181.762   1.8987  181.762   1.8987 -0.000000 0.000000 
1 1 1    2    0  107 o   38.919   2.6524   62.777   8.3235   62.777   8.3235   62.777   8.3235   38.919   2.6524   38.919   2.6524 0.000000 0.000000 
1 1 1    2    0  108 o   87.895   1.7518  315.713   12.540  315.713   12.540  315.713   12.540   87.895   1.7518   87.895   1.7518 -0.000000 0.000000 
1 1 1    2    0  109 o   54.188   2.1070  120.507   9.2750  120.507   9.2750  120.507   9.2750   54.188   2.1070   54.188   2.1070 0.000000 0.000000 
1 1 1    2    0  110 o   86.577   1.6379  306.316   11.550  306.316   11.550  306.316   11.550   86.577   1.6379   86.577   1.6379 -0.000000 0.000000 
1 1 1    2    0  111 o   36.484   2.5679   55.286   7.5484   55.286   7.5484   55.286   7.5484   36.484   2.5679   36.484   2.5679 -0.000000 0.000000 
1 1 1    2    0  112 o   13.117   5.8797   10.341   6.7028   10.341   6.7028   10.341   6.7028   13.117   5.8797   13.117   5.8797 0.000000 0.000000 
1 1 1    2    0  113 o   70.549   1.7512  203.728   10.057  203.728   10.057  203.728   10.057   70.549   1.7512   70.549   1.7512 -0.000000 0.000000 
1 1 1    2    0  114 o   5.6618   3.9419  -5.8614   6.5090  -5.8614   6.5090  -5.8614   6.5090   5.6618   3.9419   5.6618   3.9419 0.000000 0.000000 
1 1 1    2    0  115 o   8.2682   5.0792   2.4282   6.6126   2.4282   6.6126   2.4282   6.6126   8.2682   5.0792   8.2682   5.0792 -0.000000 0.000000 
1 1 1    2    0  116 o   10.851   5.7135   7.2117   6.7103   7.2117   6.7103   7.2117   6.7103   10.851   5.7135   10.851   5.7135 0.000000 0.000000 
1 1 1    2    0  117 o   12.977   5.8340   10.221   6.5994   10.221   6.5994   10.221   6.5994   12.977   5.8340   12.977   5.8340 -0.000000 0.000000 
1 1 1    2    0  118 o   82.674   1.8385  280.059   12.376  280.059   12.376  280.059   12.376   82.674   1.8385   82.674   1.8385 0.000000 0.000000 
1 1 1    2    0  119 o   71.607   1.9177  210.355   11.176  210.355   11.176  210.355   11.176   71.607   1.9177   71.607   1.9177 0.000000 0.000000 
1 1 1    2    0  120 o   42.990   2.5210   76.703   8.7643   76.703   8.7643   76.703   8.7643   42.990   2.5210   42.990   2.5210 -0.000000 0.000000 
1 1 1    2    0  121 o   31.094   3.2665   41.237   8.0504   41.237   8.0504   41.237   8.0504   31.094   3.2665   31.094   3.2665 0.000000 0.000000 
1 1 1    2    0  122 o   5.2351   3.7317  -9.8374   7.0344  -9.8374   7.0344  -9.8374   7.0344   5.2351   3.7317   5.2351   3.7317 -0.000000 0.000000 
1 1 1    2    0  123 o   64.695   1.7938  171.872   9.4431  171.872   9.4431  171.872   9.4431   64.695   1.7938   64.695   1.7938 0.000000 0.000000 
1 1 1    2    0  124 o   11.720   5.9328   8.7549   7.0487   8.7549   7.0487   8.7549   7.0487   11.720   5.9328   11.720   5.9328 0.000000 0.000000 
1 1 1    2    0  125 o   21.841   4.6534   22.521   7.2808   22.521   7.2808   22.521   7.2808   21.841   4.6534   21.841   4.6534 0.000000 0.000000 
1 1 1    2    0  126 o   43.326   2.7521   78.620   9.6286   78.620   9.6286   78.620   9.6286   43.326   2.7521   43.326   2.7521 0.000000 0.000000 
1 1 1    2    0  127 o   43.006   2.7781   77.604   9.6445   77.604   9.6445   77.604   9.6445   43.006   2.7781   43.006   2.7781 0.000000 0.000000 
1 1 1    2    0  128 o   40.960   2.6113   70.333   8.6365   70.333   8.6365   70.333   8.6365   40.960   2.6113   40.960   2.6113 0.000000 0.000000 
1 1 1    2    0  129 o   35.681   2.9097   54.036   8.3291   54.036   8.3291   54.036   8.3291   35.681   2.9097   35.681   2.9097 -0.000000 0.000000 
1 1 1    2    0  130 o   19.255   5.6750   19.569   7.7419   19.569   7.7419   19.569   7.7419   19.255   5.6750   19.255   5.6750 0.000000 0.000000 
1 1 1    2    0  131 o   8.8276   5.4247   3.4565   7.5489   3.4565   7.5489   3.4565   7.5489   8.8276   5.4247   8.8276   5.4247 -0.000000 0.000000 
1 1 1    2    0  132 o   12.342   6.2099   10.185   7.6974   10.185   7.6974   10.185   7.6974   12.342   6.2099   12.342   6.2099 -0.000000 0.000000 
1 1 1    2    0  133 o   51.173   2.6268  109.787   10.891  109.787   10.891  109.787   10.891   51.173   2.6268   51.173   2.6268 0.000000 0.000000 
1 1 1    2    0  134 o   40.396   3.8076   71.132   12.267   71.132   12.267   71.132   12.267   40.396   3.8076   40.396   3.8076 -0.000000 0.000000 
1 1 1    2    0  135 o   12.329   7.0343   10.341   11.087   10.341   11.087   10.341   11.087   12.329   7.0343   12.329   7.0343 -0.000000 0.000000 
1 1 1    2    0  136 o   12.955   7.1462   11.838   10.968   11.838   10.968   11.838   10.968   12.955   7.1462   12.955   7.1462 0.000000 0.000000 
1 1 1    2    0  137 o   10.897   7.3082  -0.4130   18.202  -0.4130   18.202  -0.4130   18.202   10.897   7.3082   10.897   7.3082 -0.000000 0.000000 
1 1 1    2    0  138 o   12.747   8.1403   8.6623   18.827   8.6623   18.827   8.6623   18.827   12.747   8.1403   12.747   8.1403 -0.000000 0.000000 
1 1 1    2    0  139 o   13.595   8.5361   11.983   19.722   11.983   19.722   11.983   19.722   13.595   8.5361   13.595   8.5361 -0.000000 0.000000 
1 1 1    2    0  140 o   17.760   9.7255   26.481   20.154   26.481   20.154   26.481   20.154   17.760   9.7255   17.760   9.7255 0.000000 0.000000 
1 1 1    2    1 -139 o   17.009   7.5242   11.066   20.573   0.0000   0.0000   11.066   20.573  ?   ?    17.009   7.5242 0.000000 7.524188 
1 1 1    2    1 -138 o   9.1361   4.3831  -9.9880   9.4191 -20.4989   18.425  -6.2690   10.960   11.854   5.7899   10.679   5.0048 1.175271 7.653178 
1 1 1    2    1 -137 o   9.0196   4.3417 -10.7695   9.4215   27.234   19.122 -22.9530   10.827   20.965   8.0194   8.2092   4.0872 12.75617 9.000864 
1 1 1    2    1 -136 o   10.889   4.9333  -1.9636   9.4333   7.2188   18.977  -4.9770   10.872   16.165   7.1845   10.946   5.0815 5.218709 8.799903 
1 1 1    2    1 -135 f   25.128   3.7918   28.557   7.5254   11.052   9.6472   55.765   12.027   15.444   5.7419   34.770   4.3376 -19.32518 7.196163 
1 1 1    2    1 -134 o   8.4263   4.0050  -7.4119   7.4850 -14.5887   10.495   0.0180   10.678   9.1038   4.4295   12.067   5.3747 -2.963634 6.964781 
1 1 1    2    1 -133 o   7.9488   3.8235  -9.0592   7.2756   5.8816   10.319 -23.8311   10.260   13.694   5.6668   7.8399   3.9152 5.854105 6.887786 
1 1 1    2    1 -132 o   48.095   2.1087   96.937   8.2471   80.797   12.576  109.116   10.924   42.753   3.6432   50.631   2.6562 -7.878242 4.508646 
1 1 1    2    1 -131 o   10.223   4.3853   0.9939   6.5459   20.491   12.449  -6.4563   7.6957   19.807   6.5912   8.8287   4.1554 10.97836 7.791796 
1 1 1    2    1 -130 o   32.407   2.7576   44.887   7.2155   40.239   14.071   46.546   8.4047   28.112   6.2970   32.754   3.1882 -4.641310 7.058091 
1 1 1    2    1 -129 o   8.9703   4.0678  -2.5126   6.4318  -0.7976   12.988  -3.0699   7.4034   13.078   5.8685   9.5071   4.3319 3.570480 7.294170 
1 1 1    2    1 -128 f   19.748   3.6689   17.406   5.6886   15.053   10.221   18.462   6.8469   17.691   5.9736   20.048   4.3175 -2.356487 7.370530 
1 1 1    2    1 -127 o   47.727   1.8304   94.411   7.1081   88.218   9.8251  101.211   10.296   45.719   2.6477   49.018   2.5859 -3.298885 3.700959 
1 1 1    2    1 -126 o   32.618   2.1458   44.395   5.6735   46.895   7.9886   41.851   8.0591   33.175   2.9860   31.220   3.2126 1.955091 4.385937 
1 1 1    2    1 -125 o   31.561   2.2293   41.593   5.6984   31.475   7.8305   52.982   8.3082   26.872   3.6707   35.357   2.9084 -8.485405 4.683198 
1 1 1    2    1 -124 o   7.8136   3.5774  -3.0778   5.1288   2.0610   7.0191  -8.9645   7.5124   11.164   4.6514   8.3109   3.9675 2.853208 6.113633 
1 1 1    2    1 -123 o   48.376   1.7739   96.510   6.9832  100.841   9.0014   89.963   11.067   49.279   2.2468   46.228   2.9523 3.051273 3.709989 
1 1 1    2    1 -122 o   36.493   1.9898   55.094   5.8966   57.779   8.1251   52.105   8.5707   37.146   2.7018   35.148   3.0208 1.998447 4.052748 
1 1 1    2    1 -121 o   41.429   1.8024   70.721   6.0721   70.857   8.3261   70.566   8.8746   41.268   2.4867   41.122   2.6618 0.1460381 3.642647 
1 1 1    2    1 -120 f   65.950   1.3963  178.176   7.5063  192.019   10.521  163.823   10.713   68.294   1.8917   63.007   2.0887 5.286968 2.817981 
1 1 1    2    1 -119 o   39.770   1.7063   65.040   5.5187   74.210   7.8663   56.151   7.7443   42.342   2.2876   36.727   2.6037 5.614540 3.465855 
1 1 1    2    1 -118 o   34.026   1.9297   47.744   5.3303   54.194   7.5914   41.471   7.4860   36.095   2.5975   31.452   2.9545 4.642590 3.933958 
1 1 1    2    1 -117 o   16.288   3.7324   11.566   4.8492   9.5393   6.9232   13.517   6.7942   15.068   4.9107   17.487   4.6759 -2.419496 6.780748 
1 1 1    2    1 -116 o   85.203   1.1838  296.734   8.2218  300.344   11.721  293.237   11.536   85.595   1.6799   84.578   1.6733 1.016846 2.371045 
1 1 1    2    1 -115 o   40.833   1.6966   68.449   5.6348   63.298   8.0104   73.495   7.9278   39.091   2.5274   42.186   2.3143 -3.095642 3.426894 
1 1 1    2    1 -114 o   69.034   1.2505  194.775   7.0367  202.413   10.088  187.539   9.8201   70.257   1.7629   67.620   1.7831 2.637009 2.507471 
1 1 1    2    1 -113 o  121.630   1.1782  604.335   11.681  602.598   15.924  606.357   17.187  121.336   1.6101  121.673   1.7329 -0.3370285 2.365439 
1 1 1    2    1 -112 o   22.545   2.8565   21.292   5.1319   20.681   7.1132   21.956   7.4110   21.909   4.1344   22.579   4.1805 -0.6695824 5.879646 
1 1 1    2    1 -111 o   92.230   1.1980  347.382   9.0069  348.671   12.354  345.921   13.159   92.321   1.6416   91.931   1.7561 0.3893585 2.403888 
1 1 1    2    1 -110 o   42.446   1.7366   73.829   5.9959   72.816   8.1106   75.050   8.9039   42.056   2.3755   42.661   2.5724 -0.6056747 3.501471 
1 1 1    2    1 -109 o  115.766   1.2228  547.137   11.540  554.295   15.203  537.407   17.725  116.450   1.6016  114.596   1.8975 1.854424 2.483036 
1 1 1    2    1 -108 o   46.280   1.6557   87.649   6.2361   84.516   8.2640   91.793   9.5037   45.368   2.2416   47.247   2.4763 -1.879532 3.340168 
1 1 1    2    1 -107 o   56.626   1.4751  131.035   6.8031  138.106   9.0630  121.909   10.297   58.083   1.9168   54.509   2.3227 3.573982 3.011484 
1 1 1    2    1 -106 o   61.135   1.4716  152.598   7.3338  152.746   9.4955  152.379   11.546   61.098   1.9089   60.967   2.3275 0.1315575 3.010161 
1 1 1    2    1 -105 o  158.176   1.3026  1020.99   16.795  1029.47   21.768  1008.52   26.400  158.766   1.6820  157.060   2.0621 1.705215 2.661040 
1 1 1    2    1 -104 o   70.164   1.3679  200.897   7.8238  195.950   10.545  206.955   11.669   69.233   1.8702   71.135   2.0145 -1.902031 2.748797 
1 1 1    2    1 -103 o   50.266   1.7653  103.298   7.2217  109.089   10.028   97.060   10.408   51.592   2.3911   48.628   2.6357 2.964199 3.558639 
1 1 1    2    1 -102 o   73.421   1.3944  219.942   8.3452  229.029   12.336  212.274   11.332   74.852   2.0236   72.070   1.9307 2.782196 2.796860 
1 1 1    2    1 -101 o   45.443   1.7848   84.426   6.5987   87.012   9.6567   82.161   9.0378   46.058   2.5824   44.762   2.4867 1.295738 3.585068 
1 1 1    2    1 -100 o  159.783   1.2883  1041.33   16.779  1043.07   23.890  1039.64   23.573  159.856   1.8334  159.596   1.8120 0.2599640 2.577683 
1 1 1    2    1  -99 o  100.838   1.2353  414.693   10.154  419.060   14.331  410.291   14.388  101.337   1.7349  100.269   1.7604 1.067665 2.471602 
1 1 1    2    1  -98 o   81.968   1.3047  274.011   8.7174  263.862   12.138  284.823   12.528   80.409   1.8518   83.543   1.8396 -3.133591 2.610279 
1 1 1    2    1  -97 o  107.527   1.2321  471.485   10.799  458.883   15.031  484.930   15.526  106.052   1.7387  109.020   1.7471 -2.967690 2.464844 
1 1 1    2    1  -96 f   87.122   1.2124  309.505   8.6104  315.193   12.710  304.680   11.706   87.894   1.7739   86.422   1.6617 1.472710 2.430640 
1 1 1    2    1  -95 o   59.752   1.4775  145.611   7.1961  152.534   11.229  140.786   9.3742   61.087   2.2589   58.706   1.9617 2.380890 2.991793 
1 1 1    2    1  -94 o   38.117   1.9674   59.438   6.0921   62.044   9.2023   57.404   8.1284   38.861   2.9265   37.396   2.6844 1.464745 3.971201 
1 1 1    2    1  -93 o  134.057   1.1324  732.700   12.374  744.350   17.676  721.502   17.328  135.096   1.6051  133.006   1.5983 2.089127 2.265127 
1 1 1    2    1  -92 o  143.742   1.1426  842.381   13.388  850.407   19.055  834.555   18.815  144.402   1.6188  143.050   1.6136 1.351883 2.285626 
1 1 1    2    1  -91 o  311.908   1.8390  3968.18   46.757  3973.87   74.003  3964.41   60.323  311.952   2.9102  311.680   2.3743 0.2719727 3.755917 
1 1 1    2    1  -90 o  107.506   1.3114  471.224   11.492  491.997   17.359  455.016   15.333  109.827   1.9390  105.625   1.7809 4.201790 2.632746 
1 1 1    2    1  -89 o  118.940   1.3096  576.771   12.697  585.544   19.133  569.867   16.974  119.817   1.9590  118.210   1.7615 1.606560 2.634480 
1 1 1    2    1  -88 o  201.078   1.4166  1648.50   23.220  1673.21   37.011  1632.47   29.818  202.525   2.2419  200.074   1.8283 2.451096 2.892905 
1 1 1    2    1  -87 o  160.007   1.3286  1043.80   17.329  1026.50   27.475  1055.23   22.331  158.639   2.1246  160.865   1.7030 -2.226517 2.722924 
1 1 1    2    1  -86 o   87.774   1.3606  314.100   9.7349  315.107   14.138  313.191   13.424   87.899   1.9732   87.634   1.8792 0.2649612 2.724875 
1 1 1    2    1  -85 o   50.658   1.4803  104.718   6.1062  104.548   8.6355  104.888   8.6355   50.586   2.0988   50.669   2.0953 -0.8256912E-01 2.965660 
1 1 1    2    1  -84 o  243.797   1.4703  2423.26   29.219  2399.24   43.179  2443.55   39.687  242.539   2.1840  244.783   1.9890 -2.243927 2.953962 
1 1 1    2    1  -83 o  170.857   1.3491  1190.10   18.790  1202.47   28.588  1180.69   24.931  171.714   2.0424  170.163   1.7974 1.550476 2.720653 
1 1 1    2    1  -82 o  208.112   1.4732  1765.74   24.992  1743.17   37.480  1783.81   33.536  206.738   2.2240  209.150   1.9671 -2.411758 2.969121 
1 1 1    2    1  -81 o   98.724   1.2292  397.315   9.8916  386.515   15.064  405.501   13.115   97.359   1.8981   99.728   1.6133 -2.369041 2.491125 
1 1 1    2    1  -80 o  265.628   1.7084  2876.83   36.992  2922.63   56.366  2842.18   49.029  267.671   2.5833  263.986   2.2784 3.684967 3.444515 
1 1 1    2    1  -79 o  113.090   1.0912  521.336   10.059  522.654   14.946  520.244   13.601  113.223   1.6194  112.965   1.4771 0.2584152 2.191844 
1 1 1    2    1  -78 o  254.660   1.4325  2643.81   29.736  2622.68   41.859  2665.34   42.250  253.610   2.0248  255.664   2.0273 -2.054352 2.865291 
1 1 1    2    1  -77 o  270.294   1.4911  2978.44   32.853  2963.27   46.299  2993.83   46.624  269.572   2.1070  270.958   2.1109 -1.386261 2.982512 
1 1 1    2    1  -76 o  208.162   1.2614  1766.37   21.405  1749.27   30.074  1783.93   30.471  207.134   1.7812  209.176   1.7871 -2.041504 2.523125 
1 1 1    2    1  -75 o  178.658   1.1655  1301.11   16.974  1295.66   23.941  1306.61   24.069  178.272   1.6475  179.023   1.6493 -0.7518158 2.331220 
1 1 1    2    1  -74 o  159.828   1.1639  1041.29   15.164  1038.27   20.423  1044.99   22.638  159.588   1.5699  160.099   1.7347 -0.5110931 2.339584 
1 1 1    2    1  -73 o  158.101   1.2181  1018.91   15.698  1022.75   20.162  1013.01   25.016  158.391   1.5616  157.626   1.9469 0.7654572 2.495788 
1 1 1    2    1  -72 o  160.348   1.1632  1048.06   15.203  1049.37   20.550  1046.46   22.597  160.440   1.5713  160.214   1.7303 0.2261658 2.337287 
1 1 1    2    1  -71 o  233.531   1.4061  2223.14   26.766  2238.00   36.361  2205.57   39.546  234.294   1.9039  232.583   2.0859 1.711014 2.824107 
1 1 1    2    1  -70 o  170.854   1.1859  1189.88   16.516  1188.14   22.280  1191.99   24.608  170.721   1.6010  170.994   1.7655 -0.2731934 2.383299 
1 1 1    2    1  -69 o  117.940   1.0635  566.970   10.225  571.273   13.899  561.896   15.094  118.382   1.4403  117.405   1.5772 0.9773254 2.135923 
1 1 1    2    1  -68 o   77.701   1.1258  246.089   7.1302  245.781   9.2893  246.531   11.124   77.650   1.4676   77.766   1.7549 -0.1161652 2.287672 
1 1 1    2    1  -67 o  146.785   1.1618  878.217   13.901  864.247   17.926  899.288   22.016  145.609   1.5103  148.527   1.8185 -2.918106 2.363864 
1 1 1    2    1  -66 o  204.791   1.3493  1709.50   22.524  1706.67   29.142  1713.71   35.497  204.615   1.7472  205.029   2.1239 -0.4142609 2.750238 
1 1 1    2    1  -65 o  248.661   1.4547  2520.37   29.485  2542.81   40.228  2494.32   43.344  249.755   1.9759  247.358   2.1496 2.396698 2.919809 
1 1 1    2    1  -64 o  224.681   1.3595  2057.66   24.899  2042.35   33.635  2076.23   37.037  223.836   1.8434  225.682   2.0132 -1.845932 2.729704 
1 1 1    2    1  -63 o  137.123   1.0419  766.380   11.646  742.489   16.240  791.672   16.709  134.966   1.4762  139.364   1.4709 -4.398560 2.083855 
1 1 1    2    1  -62 o  160.700   1.1420  1052.59   14.959  1068.35   22.213  1039.50   20.236  161.895   1.6832  159.695   1.5545 2.200165 2.291257 
1 1 1    2    1  -61 o  264.139   1.5143  2843.82   32.605  2807.07   47.834  2875.71   44.562  262.415   2.2362  265.608   2.0582 -3.192322 3.039190 
1 1 1    2    1  -60 o  241.612   1.4224  2379.41   28.015  2330.13   40.891  2423.00   38.458  239.089   2.0981  243.809   1.9351 -4.720078 2.854242 
1 1 1    2    1  -59 o  308.535   1.7843  3880.18   44.877  3835.67   62.775  3926.70   64.178  306.749   2.5105  310.367   2.5367 -3.618225 3.569021 
1 1 1    2    1  -58 o  184.205   1.3447  1383.01   20.190  1388.07   26.910  1376.50   30.541  184.538   1.7889  183.766   2.0388 0.7727203 2.712385 
1 1 1    2    1  -57 o  129.621   1.1345  684.810   11.988  702.570   15.445  657.906   19.011  131.290   1.4432  127.047   1.8357 4.243408 2.335081 
1 1 1    2    1  -56 o  382.837   2.1314  5974.10   66.515  5931.22   85.289  6040.68  106.267  381.450   2.7430  384.939   3.3866 -3.489288 4.358108 
1 1 1    2    1  -55 o  136.403   1.2242  758.346   13.612  770.268   18.147  743.008   20.583  137.470   1.6194  135.014   1.8702 2.455551 2.473911 
1 1 1    2    1  -54 o  370.499   1.9787  5595.10   59.760  5587.04   80.769  5604.86   88.831  370.221   2.6764  370.807   2.9389 -0.5853882 3.974911 
1 1 1    2    1  -53 o  242.073   1.3764  2388.42   27.160  2426.73   38.830  2351.73   38.002  244.003   1.9523  240.203   1.9409 3.800018 2.752882 
1 1 1    2    1  -52 o  803.979   3.8509 26350.80  252.374 26612.33  359.965 26097.97  353.933  807.867   5.4662  800.024   5.4273 7.842590 7.702884 
1 1 1    2    1  -51 o   51.301   1.3167  107.340   5.5018  113.988   7.8391  100.886   7.7235   52.852   1.8223   49.714   1.9094 3.137325 2.639470 
1 1 1    2    1  -50 o  626.870   3.0360 16018.34  155.139 16202.95  221.594 15840.86  217.268  630.431   4.3121  623.349   4.2759 7.082581 6.072668 
1 1 1    2    1  -49 o  151.570   1.0651  936.349   13.160  910.364   18.451  963.254   18.775  149.451   1.5146  153.731   1.4982 -4.280167 2.130422 
1 1 1    2    1  -48 o  609.287   3.0838 15132.27  153.160 15071.32  226.420 15183.69  207.958  608.013   4.5684  610.290   4.1803 -2.276062 6.192337 
1 1 1    2    1  -47 o  1027.80   5.1049 43068.82  427.689 43689.93  642.349 42574.21  573.224  1034.97   7.6139  1021.74   6.8825 13.23187 10.26357 
1 1 1    2    1  -46 o  953.777   4.9778 37087.93  387.005 37865.08  623.154 36600.00  493.769  963.491   7.9344  947.388   6.3938 16.10303 10.18993 
1 1 1    2    1  -45 o  673.377   3.7446 18483.98  205.543 18674.06  359.212 18391.45  250.629  676.714   6.5119  671.661   4.5777 5.053101 7.959924 
1 1 1    2    1  -44 o  310.522   1.7780  3930.14   45.005  3928.68   71.148  3931.11   58.107  310.456   2.8114  310.557   2.2954 -0.1010437 3.629438 
1 1 1    2    1  -43 o  869.380   4.5468 30812.92  322.218 31679.58  521.914 30279.14  409.599  881.353   7.2646  861.749   5.8310 19.60455 9.315324 
1 1 1    2    1  -42 f  882.191   4.8611 31728.88  349.567 32528.66  535.829 31136.27  461.238  893.076   7.3604  873.818   6.4754 19.25885 9.803406 
1 1 1    2    1  -41 o  673.529   3.5548 18492.14  195.169 18599.77  277.618 18386.97  274.430  675.433   5.0423  671.559   5.0132 3.873657 7.110322 
1 1 1    2    1  -40 o  379.334   2.0998  5865.08   64.927  6153.14  106.523  5694.81   81.899  388.520   3.3635  373.780   2.6880 14.73996 4.305629 
1 1 1    2    1  -39 o  589.889   3.1323 14184.24  150.616 14331.68  214.960 14042.04  211.099  592.906   4.4477  586.885   4.4126 6.020691 6.265243 
1 1 1    2    1  -38 o  210.842   1.4039  1811.90   24.128  1822.01   36.301  1803.90   32.294  211.426   2.1063  210.374   1.8832 1.051987 2.825444 
1 1 1    2    1  -37 o  1216.84   6.3190 60389.28  626.788 59749.43  878.175 61053.70  894.884  1209.99   8.9035  1223.12   8.9756 -13.12219 12.64255 
1 1 1    2    1  -36 o  145.781   1.3072  866.210   15.534  831.058   29.035  880.306   18.387  142.787   2.4946  146.962   1.5349 -4.174911 2.928968 
1 1 1    2    1  -35 o  718.821   3.7812 21065.40  221.555 20473.50  341.640 21495.00  291.056  708.507   5.9155  726.044   4.9179 -17.53662 7.692726 
1 1 1    2    1  -34 o  303.062   1.7379  3743.66   42.932  3827.14   69.153  3691.31   54.764  306.407   2.7687  300.929   2.2325 5.477814 3.556666 
1 1 1    2    1  -33 o  346.172   1.9382  4884.60   54.691  4908.33   86.911  4869.04   70.371  346.990   3.0727  345.611   2.4979 1.379028 3.959930 
1 1 1    2    1  -32 o  585.069   3.2765 13955.17  156.263 14405.17  278.349 13748.08  188.827  594.265   5.7461  580.675   3.9893 13.58978 6.995140 
1 1 1    2    1  -31 o  719.653   3.9899 21116.94  234.055 21525.47  412.152 20922.48  284.356  726.275   6.9618  716.260   4.8703 10.01575 8.496239 
1 1 1    2    1  -30 o  253.311   1.6903  2615.45   34.902  2577.49   48.789  2655.23   49.948  251.456   2.3802  255.220   2.4009 -3.763443 3.380789 
1 1 1    2    1  -29 o  441.444   2.5266  7943.88   90.916  8130.28  138.934  7804.28  120.233  446.544   3.8169  437.519   3.3713 9.025085 5.092547 
1 1 1    2    1  -28 o  509.488   2.7304 10581.83  113.394 10605.39  179.672 10566.23  146.185  509.979   4.3221  509.079   3.5227 0.8999634 5.575849 
1 1 1    2    1  -27 o  514.491   2.7567 10790.61  115.614 10656.33  181.065 10883.04  150.224  511.205   4.3451  516.655   3.5670 -5.450226 5.621718 
1 1 1    2    1  -26 o  358.647   1.9949  5243.04   58.320  5168.97   81.553  5320.57   83.432  356.087   2.8096  361.271   2.8331 -5.183563 3.990043 
1 1 1    2    1  -25 o  679.937   3.7854 18848.98  209.807 19093.60  285.121 18560.11  309.841  684.241   5.1119  674.570   5.6348 9.670776 7.608047 
1 1 1    2    1  -24 o  102.821   1.0839  430.905   9.0847  447.569   13.019  415.090   12.683  104.789   1.5242  100.915   1.5418 3.873749 2.167991 
1 1 1    2    1  -23 o  364.676   2.2615  5420.81   67.227  5399.65   94.778  5442.24   95.371  363.945   3.1947  365.377   3.2021 -1.432098 4.523275 
1 1 1    2    1  -22 o  225.378   1.5502  2070.38   28.479  2036.10   39.814  2106.31   40.755  223.500   2.1853  227.320   2.1994 -3.820465 3.100501 
1 1 1    2    1  -21 o  751.230   4.4067 23009.12  269.847 23153.20  383.758 22868.19  379.522  753.448   6.2484  748.799   6.2178 4.649170 8.814930 
1 1 1    2    1  -20 o  1013.97   6.8175 41936.59  563.491 42021.47  691.573 41768.95  971.960  1014.80   8.3603  1011.16   11.792 3.634766 14.45502 
1 1 1    2    1  -19 o  155.077   1.4252  980.206   18.016  991.537   22.201  958.352   30.832  155.970   1.7462  153.334   2.4668 2.635910 3.022286 
1 1 1    2    1  -18 f  158.203   1.5784  1020.12   20.355  1009.18   22.579  1067.57   47.026  157.352   1.7604  161.828   3.5649 -4.475983 3.975890 
1 1 1    2    1  -17 o  681.325   5.0885 18926.88  282.606 18445.63  355.522 19752.90  465.781  672.528   6.4852  695.822   8.2120 -23.29456 10.46392 
1 1 1    2    1  -16 o  741.808   4.6627 22434.81  281.947 23021.66  381.027 21724.62  419.161  751.357   6.2212  729.828   7.0457 21.52911 9.399213 
1 1 1    2    1  -15 o  269.723   1.8816  2965.26   41.369  2916.11   62.422  3003.74   55.242  267.470   2.8630  271.462   2.4964 -3.992493 3.798581 
1 1 1    2    1  -14 o  627.567   3.7097 16054.83  189.775 15628.41  261.997 16525.51  275.260  619.122   5.1914  636.638   5.3041 -17.51630 7.421879 
1 1 1    2    1  -13 o  295.893   2.1839  3568.63   52.674  3635.97   92.593  3536.41   64.047  298.652   3.8034  294.549   2.6675 4.102814 4.645625 
1 1 1    2    1  -12 o  497.090   3.1822 10072.43  128.945 10119.74  171.309 10010.58  195.857  498.231   4.2181  495.518   4.8489 2.713196 6.426832 
1 1 1    2    1  -11 o  510.436   3.0506 10620.45  126.929 10623.18  179.546 10617.73  179.465  510.470   4.3149  510.340   4.3140 0.1309509 6.101567 
1 1 1    2    1  -10 o  327.881   2.3779  4381.98   63.556  4160.46   86.241  4645.28   94.025  319.474   3.3116  337.574   3.4169 -18.10007 4.758404 
1 1 1    2    1   -9 o  1448.52   9.6913 85624.04  1144.31 84715.91  1388.23 87549.02  2021.16  1440.38   11.824  1462.84   16.950 -22.46118 20.66630 
1 1 1    2    1   -8 o  449.963   2.9032  8252.93  106.484  8199.02  140.100  8326.68  163.856  448.472   3.8324  451.935   4.4479 -3.462524 5.871153 
1 1 1    2    1   -7 o  268.882   1.8700  2946.79   40.987  2941.20   54.187  2954.26   62.660  268.622   2.4747  269.214   2.8553 -0.5919495 3.778453 
1 1 1    2    1   -6 o  252.956   1.6646  2608.02   34.324  2676.28   49.413  2544.37   47.715  256.240   2.3657  249.845   2.3429 6.394638 3.329499 
1 1 1    2    1   -5 o  882.263   5.1486 31736.21  370.274 31040.62  513.604 32488.98  534.301  872.393   7.2224  892.503   7.3441 -20.11041 10.30043 
1 1 1    2    1   -4 o  815.276   4.7665 27098.56  316.767 27360.17  451.885 26845.82  444.166  819.077   6.7681  811.345   6.7159 7.731812 9.534698 
1 1 1    2    1   -3 o  855.802   4.9962 29860.46  348.538 29431.76  486.523 30312.41  499.549  849.499   7.0259  862.108   7.1085 -12.60883 9.994752 
1 1 1    2    1   -2 o  841.800   6.2161 28896.54  426.542 28967.17  675.993 28849.82  549.813  842.503   9.8432  840.976   8.0204 1.526917 12.69703 
1 1 1    2    1   -1 o  131.430   1.2857  704.056   13.774  714.779   19.610  693.613   19.351  132.426   1.8167  130.451   1.8198 1.975449 2.571393 
1 1 1    2    1    0 o  138.675   1.4446  783.819   16.329  732.299   25.065  821.810   21.524  134.037   2.2940  141.995   1.8596 -7.957489 2.953077 
1 1 1    2    1    1 o  781.256   5.7830 24887.75  368.282 25261.06  481.685 24362.47  571.386  786.974   7.5087  772.718   9.0714 14.25653 11.77585 
1 1 1    2    1    2 o  140.244   1.3254  801.651   15.152  789.218   21.260  814.485   21.600  139.151   1.8743  141.361   1.8745 -2.209961 2.650835 
1 1 1    2    1    3 o  514.838   3.5477 10804.89  148.885 10831.73  210.955 10778.24  210.157  515.434   5.0209  514.160   5.0143 1.273926 7.095946 
1 1 1    2    1    4 o  265.780   1.9986  2879.21   43.300  2806.12   60.119  2957.98   62.417  262.378   2.8109  269.384   2.8424 -7.005615 3.997599 
1 1 1    2    1    5 o  149.338   1.4999  908.988   18.258  878.861   23.171  958.331   29.654  146.841   1.9358  153.334   2.3725 -6.493423 3.062069 
1 1 1    2    1    6 o  433.411   3.3190  7657.19  117.258  7858.17  154.569  7384.73  179.968  439.040   4.3190  425.586   5.1877 13.45435 6.750238 
1 1 1    2    1    7 o  601.260   4.1072 14737.64  201.301 14352.23  278.362 15160.16  291.454  593.282   5.7559  609.747   5.8639 -16.46497 8.216773 
1 1 1    2    1    8 o  597.371   4.4713 14548.21  217.727 14243.60  275.920 15050.88  354.446  591.034   5.7271  607.478   7.1579 -16.44409 9.167045 
1 1 1    2    1    9 o  609.422   4.5552 15141.26  226.287 15170.40  292.601 15097.90  356.940  609.953   5.8850  608.424   7.1970 1.528442 9.296770 
1 1 1    2    1   10 o  507.089   3.8351 10482.35  158.523 10361.25  202.500 10674.03  254.761  504.119   4.9278  511.628   6.1086 -7.508453 7.848492 
1 1 1    2    1   11 o  854.532   9.9866 29801.33  695.635 29801.33  695.635   0.0000   0.0000  854.532   9.9866  ?   ?  0.000000 9.986579 
1 1 1    2    1   12 o  703.645   5.8513 20188.78  335.616 19871.88  468.433 20523.03  481.086  697.946   8.2336  709.282   8.3208 -11.33588 11.70592 
1 1 1    2    1   13 o  1638.45   13.443 109675.20  1795.42 118606.90  3847.17 107188.30  2030.05  1697.23   27.808  1619.17   15.381 78.06592 31.77781 
1 1 1    2    1   14 o  253.431   2.7312  2617.99   56.422  2769.72  101.777  2550.68   67.793  260.644   4.7903  250.145   3.3247 10.49883 5.831068 
1 1 1    2    1   15 o  1113.88   12.966 50685.61  1177.33 49201.63  1621.01 52342.33  1712.76  1096.24   18.140  1130.56   18.585 -34.32092 25.97062 
1 1 1    2    1   16 o  390.959   3.9180  6231.08  124.862  6240.92  153.087  6211.53  215.810  391.246   4.8001  390.261   6.7839 0.9858093 8.310386 
1 1 1    2    1   17 o  969.212   9.2247 38333.98  728.798 38021.70  886.184 38986.54  1281.05  964.961   11.266  976.185   16.099 -11.22424 19.64950 
1 1 1    2    1   18 f  171.335   1.8486  1196.52   25.818  1166.36   29.354  1299.57   54.262  169.161   2.1288  178.546   3.7283 -9.385880 4.293232 
1 1 1    2    1   19 o  658.688   4.4854 17689.02  240.836 17776.48  296.197 17518.39  413.714  660.261   5.5034  655.297   7.7451 4.964600 9.501224 
1 1 1    2    1   20 o  205.027   1.6768  1713.37   28.024  1689.86   33.983  1763.33   49.541  203.614   2.0475  207.985   2.9221 -4.371628 3.568042 
1 1 1    2    1   21 o  478.253   3.0768  9323.80  119.947  9132.23  155.904  9601.67  187.764  473.285   4.0411  485.271   4.7467 -11.98557 6.233919 
1 1 1    2    1   22 o  399.512   2.6155  6506.10   85.175  6394.03  111.117  6665.77  132.632  396.038   3.4420  404.349   4.0240 -8.311646 5.295236 
1 1 1    2    1   23 o  580.710   3.6861 13748.08  174.489 13952.89  233.738 13490.28  262.245  584.958   4.9019  575.138   5.5937 9.820618 7.437636 
1 1 1    2    1   24 o  697.742   4.3902 19850.67  249.699 19568.90  326.211 20249.37  388.038  692.668   5.7775  704.515   6.7569 -11.84753 8.890163 
1 1 1    2    1   25 o  225.505   1.4621  2072.72   26.877  2056.02   40.125  2086.31   36.198  224.588   2.1918  226.238   1.9628 -1.650665 2.942173 
1 1 1    2    1   26 o  424.806   2.3125  7356.05   80.078  7373.48  126.860  7344.50  103.246  425.266   3.6596  424.453   2.9841 0.8128052 4.721973 
1 1 1    2    1   27 o  412.332   2.3758  6930.49   79.853  6874.33  118.920  6976.60  107.761  410.621   3.5529  413.677   3.1957 -3.056000 4.778622 
1 1 1    2    1   28 o  145.743   1.1412  865.757   13.557  876.646   20.543  857.355   18.045  146.653   1.7184  145.032   1.5264 1.621414 2.298420 
1 1 1    2    1   29 o  279.563   1.7168  3185.68   39.123  3213.79   59.045  3163.67   52.235  280.780   2.5798  278.587   2.3002 2.193207 3.456300 
1 1 1    2    1   30 o  394.126   2.2845  6331.93   73.393  6293.27  109.528  6363.44   98.874  392.887   3.4200  395.083   3.0701 -2.195984 4.595857 
1 1 1    2    1   31 o  126.718   1.0328  654.481   10.668  633.808   16.754  668.580   13.835  124.698   1.6482  128.075   1.3252 -3.376572 2.114912 
1 1 1    2    1   32 o  326.263   1.7572  4338.84   46.734  4278.88   68.569  4390.86   63.866  323.986   2.5964  328.202   2.3872 -4.216217 3.527021 
1 1 1    2    1   33 o  605.211   3.3817 14932.55  166.829 15027.90  290.485 14885.61  203.790  606.979   5.8710  604.219   4.1376 2.759644 7.182538 
1 1 1    2    1   34 o  371.712   1.9629  5631.90   59.477  5559.70   87.305  5694.42   81.247  369.303   2.9002  373.756   2.6668 -4.452698 3.939857 
1 1 1    2    1   35 o  333.291   1.8767  4527.76   50.988  4547.77   72.400  4508.07   71.818  334.015   2.6591  332.554   2.6493 1.460938 3.753640 
1 1 1    2    1   36 o  485.288   2.6123  9599.73  103.339  9634.90  146.560  9564.95  145.730  486.147   3.6984  484.379   3.6909 1.767883 5.224978 
1 1 1    2    1   37 o  299.010   1.7197  3644.16   41.915  3584.59   58.618  3706.48   59.958  296.549   2.4249  301.548   2.4393 -4.999481 3.439497 
1 1 1    2    1   38 o  635.477   3.7590 16462.54  194.717 16410.14  317.140 16494.25  246.689  634.353   6.1332  636.048   4.7580 -1.694885 7.762364 
1 1 1    2    1   39 o  168.305   1.3949  1154.55   19.137  1174.56   29.686  1140.33   25.033  169.754   2.1453  167.264   1.8360 2.490570 2.823733 
1 1 1    2    1   40 o   98.638   1.1990  396.556   9.6401  370.574   12.451  435.444   15.233   95.351   1.6019  103.360   1.8079 -8.008888 2.415505 
1 1 1    2    1   41 o  505.677   2.7157 10422.99  111.942 10319.45  175.513 10493.99  145.341  503.125   4.2796  507.381   3.5141 -4.255829 5.537477 
1 1 1    2    1   42 f  597.121   2.8941 14533.65  140.867 14457.70  198.389 14610.89  200.055  595.529   4.0867  598.675   4.0994 -3.146179 5.788494 
1 1 1    2    1   43 o  840.508   4.1925 28799.23  287.245 28786.27  388.821 28814.81  426.199  840.246   5.6768  840.630   6.2197 -0.3840942 8.420903 
1 1 1    2    1   44 o  328.559   1.7745  4399.95   47.527  4435.87   64.766  4358.05   69.959  329.892   2.4085  326.983   2.6247 2.908569 3.562288 
1 1 1    2    1   45 o  683.977   3.4384 19069.99  191.708 19106.15  284.726 19040.01  259.287  684.566   5.1024  683.398   4.6545 1.167908 6.906431 
1 1 1    2    1   46 o  344.417   1.9376  4834.98   54.399  4894.54   86.697  4796.30   69.864  346.520   3.0693  343.031   2.4985 3.488617 3.957691 
1 1 1    2    1   47 o  1150.74   5.7022 53992.93  534.881 54212.44  796.321 53812.49  722.000  1152.79   8.4743  1148.61   7.7113 4.170288 11.45763 
1 1 1    2    1   48 o  708.498   3.5586 20462.32  205.519 20305.37  302.825 20596.34  279.831  705.706   5.2642  710.765   4.8299 -5.058655 7.144179 
1 1 1    2    1   49 o  543.918   2.7740 12059.17  122.991 11988.31  181.498 12119.34  167.246  542.284   4.1059  545.249   3.7629 -2.965515 5.569388 
1 1 1    2    1   50 o  132.070   1.0844  710.921   11.674  720.382   17.355  703.103   15.777  132.945   1.6015  131.341   1.4736 1.603683 2.176305 
1 1 1    2    1   51 o   36.436   1.6837   54.225   4.9872   49.645   6.9997   58.948   7.1075   34.811   2.4831   37.959   2.3079 -3.148235 3.390018 
1 1 1    2    1   52 o  663.244   3.2052 17931.68  173.287 18330.77  249.653 17560.63  240.720  670.531   4.5675  656.297   4.4996 14.23370 6.411626 
1 1 1    2    1   53 o  297.093   1.6640  3597.58   40.297  3631.30   54.846  3558.02   59.404  298.477   2.2542  295.448   2.4666 3.029175 3.341536 
1 1 1    2    1   54 o  286.227   1.6148  3339.22   37.676  3357.42   51.135  3317.61   55.726  287.000   2.1857  285.291   2.3963 1.708954 3.243376 
1 1 1    2    1   55 o  295.266   1.6497  3553.47   39.705  3628.05   54.500  3469.12   57.962  298.342   2.2410  291.732   2.4374 6.610138 3.311061 
1 1 1    2    1   56 o  466.731   2.4164  8879.48   91.934  8907.42  124.731  8846.26  136.030  467.443   3.2735  465.826   3.5824 1.616974 4.852775 
1 1 1    2    1   57 o  177.689   1.3260  1286.89   19.206  1269.51   23.229  1324.44   34.145  176.483   1.6147  180.256   2.3238 -3.772690 2.829732 
1 1 1    2    1   58 o  356.385   1.9101  5177.03   55.491  5151.76   81.921  5198.46   75.432  355.496   2.8270  357.109   2.5913 -1.612762 3.834936 
1 1 1    2    1   59 o  146.532   1.1043  875.157   13.191  881.919   19.498  869.451   17.912  147.095   1.6261  146.052   1.5045 1.042755 2.215362 
1 1 1    2    1   60 o  149.736   1.1142  913.849   13.599  913.450   20.021  914.191   18.530  149.700   1.6407  149.762   1.5178 -0.6147766E-01 2.235121 
1 1 1    2    1   61 o  320.290   1.9362  4181.62   50.551  4197.65   67.991  4161.80   75.592  320.888   2.5993  319.507   2.9024 1.381439 3.896228 
1 1 1    2    1   62 o  357.961   2.0137  5223.21   58.757  5207.72   75.722  5246.65   93.148  357.413   2.5990  358.725   3.1855 -1.312286 4.111250 
1 1 1    2    1   63 o   41.281   1.5207   69.555   5.1083   68.765   6.6302   70.710   8.0133   41.024   1.9886   41.580   2.3741 -0.5561104 3.096923 
1 1 1    2    1   64 o  134.052   1.2005  732.455   13.119  712.859   15.832  775.395   23.435  132.245   1.4686  137.917   2.0845 -5.672287 2.549936 
1 1 1    2    1   65 o   39.460   1.6165   63.578   5.1887   75.041   6.5531   44.314   8.4952   42.864   1.8801   32.808   3.2179 10.05547 3.726834 
1 1 1    2    1   66 o  188.473   1.2400  1447.91   19.051  1424.58   25.484  1477.46   28.684  186.943   1.6723  190.378   1.8484 -3.434433 2.492613 
1 1 1    2    1   67 o  224.455   1.3689  2053.59   25.046  2038.36   33.654  2072.49   37.498  223.612   1.8463  225.471   2.0403 -1.859634 2.751635 
1 1 1    2    1   68 o  244.185   1.4456  2430.54   28.775  2409.49   38.672  2456.66   43.069  243.112   1.9515  245.474   2.1524 -2.362122 2.905321 
1 1 1    2    1   69 o  381.425   1.9447  5931.17   60.463  5890.66   85.031  5972.59   85.993  380.070   2.7446  382.703   2.7565 -2.633240 3.889903 
1 1 1    2    1   70 o  153.922   1.0957  965.717   13.747  965.490   19.360  965.948   19.524  153.897   1.5432  153.934   1.5560 -0.3633118E-01 2.191516 
1 1 1    2    1   71 o  273.629   1.5622  3052.24   34.845  3081.04   47.531  3018.77   51.233  274.893   2.1212  272.092   2.3099 2.801666 3.136127 
1 1 1    2    1   72 o  390.946   2.0745  6231.70   66.111  6200.06   89.217  6270.24   98.455  389.890   2.8072  392.062   3.0807 -2.172272 4.167827 
1 1 1    2    1   73 o  173.844   1.1972  1231.93   16.966  1244.28   23.178  1217.67   24.900  174.703   1.6276  172.822   1.7675 1.881958 2.402741 
1 1 1    2    1   74 o   79.841   1.0574  259.838   6.8815  262.425   9.6946  257.210   9.7697   80.233   1.4823   79.431   1.5089 0.8014145 2.115180 
1 1 1    2    1   75 o  157.853   1.1089  1015.70   14.268  1020.96   20.226  1010.49   20.131  158.251   1.5679  157.438   1.5686 0.8132629 2.217882 
1 1 1    2    1   76 o  178.143   1.1679  1293.61   16.960  1312.72   24.182  1275.11   23.792  179.440   1.6533  176.851   1.6504 2.589081 2.336029 
1 1 1    2    1   77 o  250.930   1.4839  2566.96   30.353  2570.35   45.219  2564.17   40.949  251.058   2.2096  250.768   2.0032 0.2893829 2.982494 
1 1 1    2    1   78 o  149.036   1.1510  905.425   13.984  940.116   21.254  878.948   18.568  151.849   1.7171  146.831   1.5514 5.018433 2.314141 
1 1 1    2    1   79 o  121.143   1.1621  598.235   11.475  594.943   16.393  601.399   16.070  120.799   1.6648  121.453   1.6232 -0.6546936 2.325098 
1 1 1    2    1   80 o  115.633   1.1635  545.060   10.967  540.478   15.688  549.440   15.337  115.136   1.6716  116.088   1.6208 -0.9518127 2.328332 
1 1 1    2    1   81 o  295.080   1.7507  3550.25   42.110  3575.02   60.025  3526.25   59.092  296.047   2.4873  294.023   2.4655 2.024323 3.502231 
1 1 1    2    1   82 o   53.586   1.3806  117.141   6.0254  116.967   8.2108  117.343   8.8699   53.525   1.8848   53.603   2.0337 -0.7839584E-01 2.772783 
1 1 1    2    1   83 o  355.974   1.9317  5167.41   56.053  5167.01   83.248  5167.74   75.814  355.848   2.8699  355.908   2.6132 -0.6030273E-01 3.881431 
1 1 1    2    1   84 o  146.613   1.1651  876.270   13.924  867.010   20.641  884.003   18.863  145.818   1.7365  147.246   1.5716 -1.427933 2.342062 
1 1 1    2    1   85 o  149.432   1.2602  910.329   15.350  885.026   24.431  926.832   19.731  147.311   2.0346  150.768   1.6054 -3.457550 2.591718 
1 1 1    2    1   86 o  147.646   1.2050  888.704   14.503  843.525   21.011  929.821   20.044  143.824   1.7922  151.008   1.6284 -7.184738 2.421441 
1 1 1    2    1   87 o  155.829   1.3954  990.022   17.725  1017.55   26.727  968.408   23.683  157.949   2.0758  154.097   1.8854 3.851242 2.804257 
1 1 1    2    1   88 o  220.828   1.5659  1988.40   28.187  1969.10   37.255  2014.23   43.106  219.718   2.0801  222.195   2.3799 -2.477264 3.160839 
1 1 1    2    1   89 o  198.879   1.4723  1612.73   23.868  1600.35   35.508  1622.94   32.237  198.063   2.1993  199.473   1.9826 -1.409912 2.961007 
1 1 1    2    1   90 o   87.579   1.2172  312.709   8.6894  317.730   13.027  308.684   11.663   88.263   1.8107   87.003   1.6445 1.260345 2.446006 
1 1 1    2    1   91 o  133.014   1.1726  721.338   12.714  707.483   18.805  733.004   17.256  131.706   1.7516  134.069   1.5790 -2.363129 2.358245 
1 1 1    2    1   92 o  137.318   1.1812  768.793   13.222  741.727   19.471  791.951   18.011  134.851   1.7713  139.352   1.5855 -4.501328 2.377301 
1 1 1    2    1   93 o   72.221   1.3415  212.685   7.8976  212.432   12.397  212.857   10.246   72.123   2.1110   72.239   1.7399 -0.1163788 2.735632 
1 1 1    2    1   94 o  124.064   1.1714  627.569   11.846  637.350   17.732  619.687   15.919  124.998   1.7403  123.262   1.5844 1.735260 2.353489 
1 1 1    2    1   95 o  143.987   1.2002  845.359   14.087  840.928   20.910  849.042   19.061  143.570   1.7867  144.274   1.6208 -0.7034912 2.412353 
1 1 1    2    1   96 f  159.705   1.2941  1040.11   16.848  1036.86   26.736  1042.25   21.697  159.388   2.0578  159.840   1.6653 -0.4521027 2.647200 
1 1 1    2    1   97 o  108.966   1.1740  484.165   10.428  465.387   14.126  506.654   15.459  106.808   1.6224  111.438   1.7018 -4.629799 2.351238 
1 1 1    2    1   98 o  145.976   1.2135  868.982   14.440  888.424   19.687  846.341   21.245  147.567   1.6366  144.013   1.8097 3.553558 2.440023 
1 1 1    2    1   99 o  118.008   1.1409  567.889   10.975  558.662   15.457  577.271   15.586  117.014   1.6205  118.948   1.6075 -1.933952 2.282535 
1 1 1    2    1  100 o   43.234   1.8006   76.426   6.3317   73.029   9.2291   79.447   8.7028   42.176   2.6986   44.026   2.4345 -1.849888 3.634490 
1 1 1    2    1  101 o   30.846   2.5520   39.167   6.3594   45.782   9.0737   32.780   8.9154   33.252   3.3951   27.970   4.0261 5.282074 5.266564 
1 1 1    2    1  102 o  119.925   1.2272  586.651   11.996  597.004   17.783  578.005   16.252  120.921   1.8041  118.996   1.6754 1.925308 2.462071 
1 1 1    2    1  103 o   87.042   1.3474  309.129   9.5603  309.479   13.327  308.757   13.723   87.047   1.8782   86.940   1.9363 0.1073608 2.697577 
1 1 1    2    1  104 o   78.275   1.3473  250.020   8.5965  247.325   11.155  253.961   13.489   77.819   1.7586   78.794   2.1020 -0.9749527 2.740623 
1 1 1    2    1  105 o   48.815   1.6646   97.428   6.6138   96.656   8.7145   98.478   10.157   48.562   2.2072   48.973   2.5531 -0.4107285 3.374948 
1 1 1    2    1  106 o   82.693   1.2884  279.080   8.6848  260.697   11.155  307.370   13.838   79.882   1.7132   86.706   1.9579 -6.824684 2.601594 
1 1 1    2    1  107 o   47.453   1.6723   92.124   6.4584   92.184   8.3802   92.036   10.135   47.407   2.1744   47.298   2.6392 0.1089211 3.419525 
1 1 1    2    1  108 o   40.987   1.6897   68.783   5.6333   74.756   7.9604   62.790   7.9730   42.653   2.2981   39.046   2.5185 3.606949 3.409345 
1 1 1    2    1  109 o   49.837   1.4895  101.574   6.0443   99.382   8.4953  103.821   8.6015   49.210   2.1228   50.302   2.1024 -1.092094 2.987692 
1 1 1    2    1  110 o   75.080   1.2128  230.166   7.4225  233.835   10.468  226.457   10.526   75.610   1.6985   74.401   1.7355 1.208275 2.428376 
1 1 1    2    1  111 o   12.207   4.2360   5.6483   5.1483  -5.1461   6.7194   20.993   8.0113   8.7420   4.0360   21.988   4.6171 -13.24564 6.132397 
1 1 1    2    1  112 o   25.006   2.6772   26.046   5.3723   32.389   7.1504   17.826   8.1407   27.797   3.2149   20.152   4.9839 7.645531 5.930771 
1 1 1    2    1  113 o   26.698   2.5430   29.615   5.4674   27.260   7.2345   32.751   8.3488   25.358   3.6011   27.786   3.7843 -2.428486 5.223834 
1 1 1    2    1  114 o   34.455   2.1316   48.955   5.9573   45.332   7.4851   55.217   9.8398   33.006   2.8087   36.300   3.3637 -3.293442 4.382123 
1 1 1    2    1  115 o   31.390   2.1920   40.722   5.5735   41.400   7.2762   39.759   8.6699   31.500   2.8650   30.681   3.5310 0.8194809 4.547135 
1 1 1    2    1  116 o   20.455   3.3119   17.850   5.3335   13.170   6.9891   24.374   8.2530   17.297   4.7921   23.633   4.4472 -6.336483 6.537702 
1 1 1    2    1  117 o   81.433   1.2938  271.275   8.5885  284.352   11.302  253.406   13.212   83.273   1.6651   78.456   2.0677 4.817139 2.654761 
1 1 1    2    1  118 o   9.6316   4.0037   1.1676   5.1831  -2.5407   6.6342   6.9771   8.3036   9.3656   4.1992   14.168   5.3151 -4.802885 6.773734 
1 1 1    2    1  119 o   81.318   1.2534  270.548   8.3081  266.521   11.111  275.657   12.513   80.584   1.6914   81.889   1.8746 -1.304825 2.524850 
1 1 1    2    1  120 f   12.705   4.1964   6.6551   5.0486   3.6935   6.6951   10.559   7.6868   11.811   4.6795   15.732   5.1771 -3.921653 6.978565 
1 1 1    2    1  121 o   20.665   3.1959   18.284   5.2101   20.185   6.9793   15.890   7.8303   21.423   4.1466   18.758   5.0216 2.664890 6.512361 
1 1 1    2    1  122 o   47.717   1.5831   93.617   6.1494   90.777   8.2367   97.193   9.2431   46.810   2.1645   48.370   2.3513 -1.559849 3.195867 
1 1 1    2    1  123 o   48.599   1.5289   97.110   6.0491   99.885   8.9838   94.808   8.1818   49.042   2.2533   47.834   2.1035 1.207893 3.082549 
1 1 1    2    1  124 o   12.257   4.2154   6.1256   5.0939   6.9204   8.1564   5.6173   6.5222   13.828   5.2499   12.532   4.7086 1.296418 7.052166 
1 1 1    2    1  125 o   11.172   4.1478   4.4920   5.0308   8.1269   8.2356   2.3283   6.3541   14.355   5.3111   10.828   4.4606 3.527074 6.935768 
1 1 1    2    1  126 o   10.350   4.0585   3.1528   4.9896 -10.9953   8.0219   12.080   6.3722   8.2553   3.9820   16.238   4.6037 -7.982809 6.086888 
1 1 1    2    1  127 o   13.773   4.1453   8.5045   5.0333   6.1714   8.1444   9.9462   6.4023   13.315   5.1955   14.833   4.7120 -1.518740 7.014048 
1 1 1    2    1  128 f   33.308   2.1433   46.439   5.7884   41.131   9.5371   49.534   7.2833   30.411   3.9398   34.180   2.6344 -3.768896 4.739425 
1 1 1    2    1  129 o   19.372   3.5896   16.762   5.4596   25.330   9.1416   12.012   6.8069   23.101   4.9999   15.997   4.8220 7.104138 6.946336 
1 1 1    2    1  130 o   33.536   2.1736   47.222   5.9101   41.753   9.7156   50.434   7.4462   30.488   4.0062   34.408   2.6759 -3.920069 4.817694 
1 1 1    2    1  131 o   50.464   1.8597  105.973   7.6368  111.254   11.054  101.150   10.563   51.164   2.6596   48.774   2.6669 2.389656 3.766453 
1 1 1    2    1  132 o   28.648   3.1398   35.746   7.2121   48.794   9.5607   18.518   10.986   33.206   3.5891   18.987   6.1859 14.21885 7.151713 
1 1 1    2    1  133 o   32.622   2.8363   45.802   7.4673   44.290   9.7830   47.914   11.558   31.352   3.9129   32.120   4.5411 -0.7673283 5.994378 
1 1 1    2    1  134 o   32.174   3.2827   45.404   8.4888   64.806   12.018   26.083   11.992   37.922   3.9453   22.190   6.3237 15.73148 7.453502 
1 1 1    2    1  135 f   20.603   5.3566   21.207   9.0786   28.293   14.218   16.329   11.797   22.432   7.0081   17.806   6.3911 4.625984 9.484737 
1 1 1    2    1  136 o   17.731   5.5488   15.882   8.9093   8.2709   13.978   21.089   11.563   15.322   6.4846   19.847   6.3355 -4.524570 9.065801 
1 1 1    2    1  137 o   11.173   4.9214   0.5217   8.7119   3.3977   13.707  -1.4272   11.284   13.950   6.1577   11.895   5.3916 2.055515 8.184488 
1 1 1    2    1  138 o   10.085   4.9225 -17.4070   13.250   0.0000   0.0000 -17.4070   13.250  ?   ?    10.085   4.9225 0.000000 4.922464 
1 1 1    2    1  139 o   13.003   6.2155 -11.0051   18.565   0.0000   0.0000 -11.0051   18.565  ?   ?    13.003   6.2155 0.000000 6.215531 
1 1 1    2    1  140 o   18.307   7.7502   17.343   19.976   0.0000   0.0000   17.343   19.976  ?   ?    18.307   7.7502 0.000000 7.750157 
1 1 1    2    2    0 o  740.744   6.1423 22369.21  370.884 22413.43  525.248 22325.24  523.774  741.382   8.6913  739.923   8.6840 1.459717 12.28624 
1 1 1    2    2    1 o  919.376   5.7315 34465.27  429.531 35335.18  580.662 33414.01  638.321  930.747   7.6534  904.994   8.6528 25.75378 11.55189 
1 1 1    2    2    2 o  756.584   4.4376 23336.42  273.680 22533.83  375.378 24247.14  399.867  743.368   6.1948  771.100   6.3616 -27.73181 8.879537 
1 1 1    2    2    3 o  961.320   5.9854 37683.26  469.022 38382.33  728.126 37187.48  613.182  969.881   9.2098  954.809   7.8784 15.07153 12.11982 
1 1 1    2    2    4 o  459.605   3.1988  8610.61  119.843  8531.55  206.042  8651.02  147.328  457.428   5.5258  460.666   3.9234 -3.237854 6.776998 
1 1 1    2    2    5 o   99.470   1.1037  403.274   8.9490  432.526   14.008  383.103   11.632  103.014   1.6682   96.950   1.4719 6.063591 2.224710 
1 1 1    2    2    6 o  1489.86   10.919 90611.59  1326.04 88979.70  1683.99 93274.80  2151.28  1475.63   14.000  1509.73   17.481 -34.10059 22.39584 
1 1 1    2    2    7 o  554.759   6.5948 12550.64  298.225   0.0000   0.0000 12550.64  298.225  ?   ?   554.759   6.5948 0.000000 6.594833 
1 1 1    2    2    8 o  354.815   3.1138  5131.76   90.059  5281.83  130.121  4993.78  124.772  359.942   4.4348  349.991   4.3735 9.951233 6.228564 
1 1 1    2    2    9 o  678.173   5.6422 18753.13  311.906 18648.64  438.936 18859.70  443.298  676.138   7.9640  679.950   7.9980 -3.812866 11.28687 
1 1 1    2    2   10 o  886.479   7.3236 32052.54  529.209 33076.80  768.553 31129.01  729.781  900.186   10.474  873.307   10.252 26.87915 14.65591 
1 1 1    2    2   11 o  887.441   6.5537 32117.82  474.092 31548.02  602.592 33043.51  768.053  879.363   8.4066  899.719   10.472 -20.35583 13.42917 
1 1 1    2    2   12 o  570.945   3.9135 13288.95  182.136 13548.91  261.771 13044.99  253.583  576.438   5.5710  565.620   5.5000 10.81793 7.828509 
1 1 1    2    2   13 o  208.626   1.8518  1774.06   31.492  1739.44   40.039  1830.20   50.996  206.578   2.3777  211.894   2.9524 -5.316269 3.790838 
1 1 1    2    2   14 o  544.377   3.7483 12080.84  166.331 11726.05  198.491 12917.48  304.802  536.297   4.5404  562.783   6.6442 -26.48651 8.047394 
1 1 1    2    2   15 o  463.489   3.2283  8757.00  121.968  8715.92  148.787  8841.18  212.959  462.382   3.9476  465.635   5.6107 -3.253326 6.860231 
1 1 1    2    2   16 o  584.041   4.0012 13906.10  190.491 13717.87  230.503 14311.60  338.315  580.039   4.8751  592.336   7.0068 -12.29810 8.535876 
1 1 1    2    2   17 o  557.883   3.8345 12688.18  174.376 12594.82  212.281 12881.89  305.767  555.792   4.6856  561.983   6.6747 -6.190979 8.155114 
1 1 1    2    2   18 o  1062.60   6.6124 46055.64  572.751 47096.01  772.801 44787.77  853.129  1074.21   8.8256  1047.35   9.9928 26.85864 13.33213 
1 1 1    2    2   19 o  465.250   3.2425  8823.97  122.970  8725.62  172.454  8925.71  175.395  462.605   4.5733  467.878   4.5988 -5.272980 6.485683 
1 1 1    2    2   20 o  371.040   2.6542  5611.87   80.278  5417.16  110.565  5828.96  116.748  364.522   3.7210  378.121   3.7878 -13.59949 5.309689 
1 1 1    2    2   21 o  179.194   1.4367  1308.80   20.985  1275.42   27.502  1355.32   32.468  176.891   1.9073  182.346   2.1843 -5.454498 2.899872 
1 1 1    2    2   22 o  244.454   1.6480  2435.73   32.838  2405.89   46.088  2466.50   46.801  242.945   2.3272  245.986   2.3341 -3.041245 3.296047 
1 1 1    2    2   23 o  347.984   2.1788  4936.00   61.802  4849.85   86.155  5027.33   88.705  344.915   3.0643  351.168   3.0988 -6.253235 4.358050 
1 1 1    2    2   24 o  151.236   1.3230  932.250   16.310  954.541   25.199  916.180   21.396  153.028   2.0201  149.924   1.7508 3.104538 2.673188 
1 1 1    2    2   25 o  365.176   2.6251  5436.12   78.142  5359.97  109.243  5515.91  111.821  362.577   3.6962  367.813   3.7296 -5.235382 5.250883 
1 1 1    2    2   26 o  174.796   1.5593  1245.37   22.218  1225.62   31.104  1265.94   31.748  173.399   2.2005  176.228   2.2101 -2.828766 3.118797 
1 1 1    2    2   27 o  631.018   4.3134 16237.06  221.871 16281.30  314.443 16193.19  313.107  631.717   6.1064  630.006   6.0969 1.710632 8.629048 
1 1 1    2    2   28 o  547.039   3.7721 12201.30  168.206 12164.84  237.251 12238.14  238.514  546.118   5.3295  547.760   5.3418 -1.641968 7.545732 
1 1 1    2    2   29 o  170.523   1.6910  1185.23   23.505  1165.67   30.050  1216.07   37.727  169.106   2.1799  172.717   2.6797 -3.611404 3.454373 
1 1 1    2    2   30 o  590.480   4.4385 14217.65  213.637 14125.93  274.268 14359.17  340.672  588.477   5.7175  593.191   7.0454 -4.713989 9.073481 
1 1 1    2    2   31 o  505.919   3.5095 10435.01  144.733 10515.19  206.091 10356.98  203.303  507.785   4.9790  503.952   4.9490 3.832947 7.020206 
1 1 1    2    2   32 o   32.373   1.7462   42.841   4.5909   41.641   7.3692   43.602   5.8689   31.832   2.8709   32.630   2.2197 -0.7987061 3.628894 
1 1 1    2    2   33 o  226.464   1.6884  2090.40   31.169  2203.79   60.742  2049.87   36.314  232.508   3.2049  224.255   1.9865 8.252625 3.770630 
1 1 1    2    2   34 o  550.224   3.2877 12341.59  147.459 12188.47  238.306 12436.60  187.712  546.711   5.3474  552.304   4.1694 -5.593811 6.780762 
1 1 1    2    2   35 o  462.311   2.6406  8712.14   99.511  8545.18  169.878  8799.37  122.783  457.806   4.5522  464.605   3.2420 -6.799194 5.588664 
1 1 1    2    2   36 o  507.247   3.0465 10488.36  125.969 10762.29  257.321 10402.02  144.463  513.715   6.1449  505.143   3.5084 8.571808 7.075937 
1 1 1    2    2   37 o  966.868   5.6418 38118.80  444.651 37980.77  885.464 38165.34  514.184  964.459   11.263  967.384   6.5205 -2.925659 13.01426 
1 1 1    2    2   38 o  781.930   4.5873 24926.66  292.391 25481.68  595.765 24750.55  335.587  790.245   9.2486  779.127   5.2840 11.11816 10.65164 
1 1 1    2    2   39 o  888.464   4.8955 32182.33  354.548 32020.62  610.975 32264.43  435.347  885.961   8.4601  889.528   6.0040 -3.567078 10.37403 
1 1 1    2    2   40 o  291.114   1.7833  3454.22   42.317  3491.19   73.916  3436.20   51.613  292.656   3.0984  290.351   2.1807 2.305389 3.788908 
1 1 1    2    2   41 o  539.863   3.2262 11880.28  141.976 11797.70  230.535 11930.74  180.205  537.928   5.2575  540.987   4.0864 -3.059814 6.658818 
1 1 1    2    2   42 o  728.260   4.0382 21620.41  239.726 21525.24  320.421 21741.39  361.294  726.599   5.4099  730.205   6.0699 -3.606018 8.130844 
1 1 1    2    2   43 o  739.263   3.7068 22278.00  223.377 22615.25  335.731 22010.11  299.219  744.763   5.5302  734.756   4.9959 10.00696 7.452593 
1 1 1    2    2   44 o   36.033   1.3626   52.996   3.9951   54.254   5.7618   51.830   5.5444   36.432   1.9472   35.608   1.9172 0.8239594 2.732669 
1 1 1    2    2   45 o  313.871   1.7164  4015.36   43.913  4112.73   66.294  3939.24   58.618  317.647   2.5603  310.877   2.3131 6.769409 3.450480 
1 1 1    2    2   46 o  138.940   1.0630  786.804   12.039  795.918   17.897  779.272   16.270  139.741   1.5711  138.273   1.4435 1.468643 2.133589 
1 1 1    2    2   47 o  621.302   3.1425 15735.08  159.150 15688.89  235.431 15773.96  215.971  620.341   4.6558  622.036   4.2594 -1.694153 6.310226 
1 1 1    2    2   48 o  210.753   1.4403  1810.36   24.743  1726.14   35.771  1887.62   34.263  205.788   2.1324  215.201   1.9532 -9.412079 2.891713 
1 1 1    2    2   49 o  215.698   1.3283  1896.31   23.354  1884.88   34.427  1906.07   31.787  215.044   1.9640  216.250   1.8032 -1.206360 2.666264 
1 1 1    2    2   50 o  334.428   1.8195  4558.60   49.600  4523.78   73.074  4588.34   67.543  333.138   2.6909  335.510   2.4697 -2.371399 3.652446 
1 1 1    2    2   51 o  198.595   1.2850  1607.51   20.802  1593.33   30.617  1619.66   28.349  197.714   1.8997  199.342   1.7447 -1.628098 2.579296 
1 1 1    2    2   52 o  134.329   1.1563  735.451   12.661  731.054   19.650  738.572   16.556  133.925   1.7999  134.613   1.5088 -0.6878662 2.348658 
1 1 1    2    2   53 o  238.544   1.4868  2319.32   28.910  2351.41   45.812  2298.09   37.268  240.182   2.3400  237.447   1.9254 2.735153 3.030299 
1 1 1    2    2   54 o  359.345   2.0208  5263.35   59.194  5278.81   93.550  5253.03   76.443  359.853   3.1892  358.984   2.6123 0.8687134 4.122550 
1 1 1    2    2   55 o  281.794   1.6640  3236.62   38.223  3246.39   60.378  3230.10   49.378  282.207   2.6247  281.504   2.1519 0.7026672 3.394012 
1 1 1    2    2   56 o  123.398   1.0620  620.630   10.683  610.233   15.629  629.748   14.636  122.358   1.5669  124.300   1.4445 -1.941597 2.131144 
1 1 1    2    2   57 o  575.644   2.9303 13508.26  137.501 13973.15  209.703 13157.64  182.114  585.394   4.3946  568.080   3.9328 17.31433 5.897394 
1 1 1    2    2   58 o  254.041   1.6307  2630.54   33.768  2623.03   45.170  2640.05   50.843  253.672   2.1845  254.489   2.4509 -0.8175659 3.283096 
1 1 1    2    2   59 f  273.117   1.7171  3040.47   38.228  3014.92   50.942  3073.40   57.838  271.958   2.2980  274.578   2.5841 -2.619415 3.458067 
1 1 1    2    2   60 o  543.297   3.0698 12034.00  135.952 11875.26  180.321 12243.10  206.950  539.639   4.0993  547.893   4.6338 -8.253662 6.186739 
1 1 1    2    2   61 o  313.652   1.9090  4010.12   48.808  4032.71   65.701  3982.31   72.910  314.518   2.5627  312.538   2.8618 1.980316 3.841527 
1 1 1    2    2   62 f  220.533   1.4881  1982.39   26.752  1957.02   35.540  2015.55   40.635  219.110   1.9899  222.358   2.2419 -3.248169 2.997575 
1 1 1    2    2   63 o   92.947   1.1572  352.125   8.7678  346.601   11.593  359.508   13.402   92.213   1.5423   93.912   1.7507 -1.699951 2.333167 
1 1 1    2    2   64 o  172.632   1.3102  1214.74   18.437  1208.54   24.593  1222.69   27.858  172.186   1.7522  173.187   1.9733 -1.001343 2.638983 
1 1 1    2    2   65 o  297.156   1.8332  3599.57   44.405  3619.24   59.750  3575.31   66.365  297.946   2.4602  296.121   2.7494 1.825592 3.689384 
1 1 1    2    2   66 o  351.153   1.9898  5026.87   56.955  5011.46   80.179  5042.56   80.920  350.575   2.8057  351.660   2.8229 -1.085236 3.980057 
1 1 1    2    2   67 f  147.865   1.1197  891.188   13.496  877.209   19.786  903.349   18.455  146.693   1.6547  148.865   1.5209 -2.171616 2.247437 
1 1 1    2    2   68 o   31.617   1.8296   40.888   4.6952   34.845   6.4068   47.899   6.9009   29.104   2.7325   34.183   2.4938 -5.079115 3.699360 
1 1 1    2    2   69 o  421.728   2.3235  7251.88   79.876  7232.36  112.627  7271.63  113.300  421.074   3.2813  422.214   3.2920 -1.140503 4.648046 
1 1 1    2    2   70 o  204.085   1.3616  1697.83   22.651  1655.55   31.447  1743.41   32.653  201.513   1.9145  206.790   1.9371 -5.277023 2.723536 
1 1 1    2    2   71 o   81.829   1.1366  272.940   7.5814  268.572   10.543  277.617   10.910   81.167   1.5934   82.522   1.6219 -1.355125 2.273682 
1 1 1    2    2   72 o  186.888   1.3722  1423.78   20.904  1429.39   31.314  1419.27   28.077  187.235   2.0517  186.578   1.8461 0.6568146 2.759960 
1 1 1    2    2   73 o   65.614   1.2190  175.492   6.5199  177.617   9.1520  173.303   9.2905   65.983   1.7030   65.175   1.7503 0.8083496 2.442086 
1 1 1    2    2   74 o  223.079   1.4354  2028.68   26.102  2003.16   36.607  2055.08   37.227  221.648   2.0261  224.502   2.0343 -2.853897 2.871130 
1 1 1    2    2   75 o   37.782   1.6622   58.311   5.1068   64.250   7.0749   51.850   7.3788   39.633   2.1985   35.563   2.5625 4.069889 3.376413 
1 1 1    2    2   76 o  109.873   1.0831  492.087   9.7007  492.007   14.242  492.156   13.250  109.855   1.5904  109.874   1.4794 -0.1881409E-01 2.172075 
1 1 1    2    2   77 o   72.086   1.1513  211.826   6.7654  207.659   9.7610  215.678   9.3855   71.368   1.6779   72.734   1.5830 -1.366219 2.306766 
1 1 1    2    2   78 o   44.323   1.4579   80.177   5.2602   69.754   7.4894   90.323   7.3897   41.297   2.2331   47.026   1.9319 -5.728542 2.952781 
1 1 1    2    2   79 o  177.772   1.2255  1288.29   17.758  1267.96   26.059  1305.91   24.264  176.344   1.8129  178.970   1.6632 -2.625763 2.460237 
1 1 1    2    2   80 o  154.636   1.2218  974.795   15.400  978.295   24.294  972.443   19.913  154.892   1.9241  154.440   1.5817 0.4519958 2.490811 
1 1 1    2    2   81 o  132.734   1.1851  718.208   12.822  714.220   20.175  720.911   16.608  132.346   1.8701  132.975   1.5321 -0.6287384 2.417625 
1 1 1    2    2   82 o  254.321   1.6700  2637.19   34.620  2574.32   59.415  2669.50   42.598  251.173   2.9019  255.850   2.0425 -4.677277 3.548681 
1 1 1    2    2   83 o  102.099   1.1838  424.947   9.8524  407.298   15.324  437.383   12.864   99.940   1.8810  103.575   1.5236 -3.634514 2.420660 
1 1 1    2    2   84 o  110.300   1.1972  495.967   10.764  488.473   16.774  501.213   14.034  109.446   1.8802  110.873   1.5528 -1.427742 2.438520 
1 1 1    2    2   85 o  117.892   1.3648  566.643   13.115  567.842   20.800  565.851   16.898  117.990   2.1626  117.798   1.7598 0.1918564 2.788132 
1 1 1    2    2   86 o   95.031   1.4799  368.212   11.464  349.328   17.750  381.726   15.016   92.506   2.3559   96.747   1.9040 -4.241692 3.029130 
1 1 1    2    2   87 o  362.336   2.3230  5355.93   68.611  5369.71  111.719  5347.58   86.938  362.523   3.7806  361.951   2.9466 0.5722351 4.793259 
1 1 1    2    2   88 o   68.285   1.6031  190.138   8.9232  180.557   13.579  197.419   11.838   66.472   2.5106   69.537   2.0908 -3.065178 3.267197 
1 1 1    2    2   89 o   41.676   1.9956   71.010   6.7596   76.857   10.833   67.282   8.6505   43.274   3.0913   40.516   2.6335 2.757278 4.060995 
1 1 1    2    2   90 o   51.749   1.6756  109.327   7.0587  118.884   11.427  103.430   8.9762   53.905   2.6083   50.301   2.1944 3.603867 3.408596 
1 1 1    2    2   91 o   32.999   2.3639   44.668   6.3165   51.892   10.269   40.271   8.0111   35.446   3.6043   31.234   3.1913 4.211775 4.814045 
1 1 1    2    2   92 o  214.246   1.5336  1871.93   26.782  1853.12   46.507  1881.26   32.760  213.036   2.6781  214.748   1.8714 -1.711227 3.267176 
1 1 1    2    2   93 o  256.957   1.7005  2693.21   35.619  2626.31   60.762  2728.24   43.966  253.548   2.9399  258.572   2.0859 -5.024246 3.604752 
1 1 1    2    2   94 o   37.435   2.1097   57.373   6.4119   58.508   9.7467   56.507   8.5134   37.696   3.2022   37.083   2.8380 0.6136665 4.278792 
1 1 1    2    2   95 o  242.503   1.6329  2398.91   32.278  2354.03   54.590  2423.03   40.023  240.028   2.7901  243.665   2.0150 -3.637222 3.441638 
1 1 1    2    2   96 o  118.979   1.2301  577.258   11.930  569.071   18.411  583.184   15.664  118.089   1.9126  119.566   1.6072 -1.477196 2.498228 
1 1 1    2    2   97 o   45.941   1.6916   86.227   6.3238   83.910   9.1824   88.316   8.7218   45.254   2.4989   46.447   2.3109 -1.193733 3.403645 
1 1 1    2    2   98 o   76.627   1.2825  239.468   8.0106  231.997   11.635  246.202   11.046   75.369   1.8952   77.675   1.7446 -2.305931 2.575931 
1 1 1    2    2   99 o   40.432   1.9357   66.889   6.3613   68.559   8.9825   65.209   9.0101   40.860   2.7123   39.835   2.7924 1.024414 3.892818 
1 1 1    2    2  100 o   17.361   4.3084   12.879   6.0683   15.893   8.2150   9.2582   9.0026   19.291   5.1342   15.919   5.5963 3.371576 7.594637 
1 1 1    2    2  101 o   67.794   1.4776  187.533   8.1657  182.193   11.314  193.340   11.797   66.752   2.0818   68.763   2.1072 -2.010925 2.962128 
1 1 1    2    2  102 o   61.267   1.5985  153.318   7.9765  165.820   11.202  140.457   11.361   63.662   2.1617   58.560   2.3850 5.102383 3.218873 
1 1 1    2    2  103 o   45.586   1.8388   85.017   6.8187   93.747   9.6331   76.252   9.6531   47.803   2.4807   43.062   2.7647 4.740868 3.714435 
1 1 1    2    2  104 o   87.659   1.2906  313.548   9.2217  312.928   13.023  314.172   13.060   87.522   1.8254   87.695   1.8270 -0.1736832 2.582607 
1 1 1    2    2  105 o   56.272   1.4586  129.359   6.6850  127.997   9.7371  130.574   9.1944   55.900   2.1409   56.478   2.0003 -0.5785332 2.929918 
1 1 1    2    2  106 o   60.014   1.4309  147.057   6.9998  146.575   9.9380  147.532   9.8609   59.826   2.0408   60.025   2.0182 -0.1982079 2.870229 
1 1 1    2    2  107 o   89.967   1.2476  330.387   9.1493  334.569   12.995  326.276   12.884   90.467   1.7622   89.338   1.7691 1.129257 2.497056 
1 1 1    2    2  108 o   61.611   1.4169  155.048   7.1160  153.625   10.092  156.456   10.036   61.226   2.0248   61.793   1.9950 -0.5670586 2.842512 
1 1 1    2    2  109 o   48.409   1.6118   95.913   6.3513   98.186   9.0343   93.692   8.9307   48.880   2.2736   47.741   2.3016 1.139019 3.235254 
1 1 1    2    2  110 o   82.541   1.2924  278.293   8.6954  280.353   12.047  276.053   12.564   82.764   1.7857   82.108   1.8771 0.6550751 2.590801 
1 1 1    2    2  111 f   56.881   1.5031  132.394   6.9633  121.813   9.5424  144.447   10.184   54.444   2.1544   59.303   2.1101 -4.859501 3.015622 
1 1 1    2    2  112 o   44.708   1.8068   82.021   6.5709   88.733   9.4573   75.757   9.1364   46.361   2.5119   42.799   2.6315 3.561745 3.637905 
1 1 1    2    2  113 o   87.194   1.3522  310.843   9.6107  305.909   12.630  317.630   14.813   86.397   1.7933   87.958   2.0660 -1.560944 2.735751 
1 1 1    2    2  114 o   42.681   1.7950   74.820   6.2311   89.517   8.7623   59.784   8.8628   46.578   2.3150   37.902   2.8904 8.676598 3.703257 
1 1 1    2    2  115 o   20.652   3.3543   18.196   5.4531   9.6891   7.5606   27.419   7.8724   15.345   5.1372   25.272   3.9507 -9.927433 6.480662 
1 1 1    2    2  116 o   35.595   1.9444   52.211   5.6204   52.139   8.2311   52.274   7.6931   35.342   2.8821   35.444   2.6826 -0.1013718 3.937405 
1 1 1    2    2  117 o   51.547   1.5725  109.006   6.5996  112.429   9.3017  105.536   9.3650   52.192   2.1912   50.538   2.2791 1.654076 3.161655 
1 1 1    2    2  118 o   46.014   1.6779   86.987   6.2830   81.852   8.8503   92.204   8.9211   44.432   2.4531   47.205   2.3256 -2.773602 3.380235 
1 1 1    2    2  119 o   31.522   2.2384   41.210   5.7142   37.477   8.0543   44.994   8.1083   29.721   3.3847   32.702   3.0779 -2.980627 4.574935 
1 1 1    2    2  120 o   44.178   1.7336   80.314   6.2307   69.806   8.7901   90.925   8.8331   40.916   2.6497   46.836   2.3209 -5.919876 3.522429 
1 1 1    2    2  121 o   41.752   1.8848   71.936   6.3983   65.041   9.6002   77.446   8.5822   39.316   3.0186   43.144   2.4504 -3.828274 3.887990 
1 1 1    2    2  122 o   35.251   2.2082   51.631   6.3134   47.912   9.0821   55.108   8.7824   33.532   3.3683   36.136   3.0088 -2.604240 4.516454 
1 1 1    2    2  123 o   24.690   2.9831   25.950   5.8823   28.728   8.4916   23.387   8.1561   25.485   4.2363   22.810   4.5462 2.674662 6.214034 
1 1 1    2    2  124 o   20.977   3.5151   19.214   5.7982   23.683   8.4251   15.192   7.9920   22.824   4.6855   18.114   5.1624 4.709412 6.971706 
1 1 1    2    2  125 f   33.374   2.1556   46.452   5.8329   42.889   8.0918   50.305   8.4156   31.645   3.1800   34.364   3.0355 -2.719648 4.396236 
1 1 1    2    2  126 o   9.9679   4.1541   1.6047   5.6005   0.8112   8.5431   2.2027   7.4164   11.509   4.9740   11.358   4.7603 0.1508331 6.884846 
1 1 1    2    2  127 o   11.233   4.2555   4.4660   5.3521   12.962   8.6358  -0.8323   6.8198   16.650   5.4878   9.8355   4.3423 6.814285 6.997974 
1 1 1    2    2  128 o   18.780   3.9165   15.992   5.8011   13.513   10.449   17.096   6.9746   16.947   6.0227   19.142   4.5391 -2.194899 7.541628 
1 1 1    2    2  129 o   7.6631   3.6347  -6.3221   6.1025  -6.4453   10.051  -6.2501   7.6802   10.354   4.8332   8.8842   4.1720 1.470116 6.384799 
1 1 1    2    2  130 o   13.715   4.8206   8.2411   6.6797   13.948   10.224   3.9911   8.8230   17.005   5.9650   12.554   5.2215 4.451099 7.927442 
1 1 1    2    2  131 o   20.321   5.0777   20.008   8.3865   36.369   12.837   7.8270   11.077   26.816   6.0206   14.669   5.9474 12.14758 8.462810 
1 1 1    2    2  132 o   10.781   4.6572   1.0828   7.4820  -4.3433   10.408   6.8849   10.763   10.923   5.0358   14.196   5.8221 -3.273485 7.697787 
1 1 1    2    2  133 o   12.924   5.0639   6.2087   7.7634   5.4542   10.794   7.0174   11.174   13.702   5.7428   14.331   5.9105 -0.6283245 8.240976 
1 1 1    2    2  134 o   39.479   2.8344   67.056   9.0607   60.500   12.655   73.952   12.979   36.220   4.3747   40.462   3.9868 -4.242233 5.918857 
1 1 1    2    2  135 o   49.179   2.4166  102.560   9.6581  112.330   13.561   92.503   13.758   50.634   3.3036   45.486   3.7438 5.148617 4.992971 
1 1 1    2    2  136 f   15.766   5.5692   12.036   8.9236   15.681   14.223   9.6697   11.459   17.562   6.8623   15.170   6.0849 2.392735 9.171492 
1 1 1    2    2  137 o   14.293   5.4801   8.8886   8.9435   17.381   14.120   3.1982   11.558   18.050   6.8943   13.153   5.7340 4.897146 8.967190 
1 1 1    2    2  138 o   12.854   5.4524   4.3178   9.9191   52.220   20.245 -10.8136   11.378   28.800   8.2192   10.084   4.8324 18.71659 9.534553 
1 1 1    2    2  139 o   18.283   5.8884   17.476   9.9720   41.978   20.029   9.4002   11.498   25.311   8.3583   15.001   6.0677 10.30957 10.32853 
1 1 1    3    0 -138 o   11.059   7.4339  -0.2888   19.032  -0.2888   19.032  -0.2888   19.032   11.059   7.4339   11.059   7.4339 -0.000000 0.000000 
1 1 1    3    0 -137 o   7.2799   5.0582  -7.1632   10.574  -7.1632   10.574  -7.1632   10.574   7.2799   5.0582   7.2799   5.0582 0.000000 0.000000 
1 1 1    3    0 -136 o   8.5776   5.7050  -0.9394   10.696  -0.9394   10.696  -0.9394   10.696   8.5776   5.7050   8.5776   5.7050 -0.000000 0.000000 
1 1 1    3    0 -135 o   16.020   7.5535   17.790   11.125   17.790   11.125   17.790   11.125   16.020   7.5535   16.020   7.5535 0.000000 0.000000 
1 1 1    3    0 -134 o   15.695   7.5498   17.167   11.172   17.167   11.172   17.167   11.172   15.695   7.5498   15.695   7.5498 0.000000 0.000000 
1 1 1    3    0 -133 o   7.1120   4.8646  -4.2857   8.8988  -4.2857   8.8988  -4.2857   8.8988   7.1120   4.8646   7.1120   4.8646 -0.000000 0.000000 
1 1 1    3    0 -132 o   13.011   6.6791   11.578   9.0072   11.578   9.0072   11.578   9.0072   13.011   6.6791   13.011   6.6791 0.000000 0.000000 
1 1 1    3    0 -131 o   13.270   6.7127   11.967   9.0201   11.967   9.0201   11.967   9.0201   13.270   6.7127   13.270   6.7127 0.000000 0.000000 
1 1 1    3    0 -130 o   8.8817   5.6139   2.5002   8.6884   2.5002   8.6884   2.5002   8.6884   8.8817   5.6139   8.8817   5.6139 -0.000000 0.000000 
1 1 1    3    0 -129 o   16.376   7.2937   17.526   10.314   17.526   10.314   17.526   10.314   16.376   7.2937   16.376   7.2937 -0.000000 0.000000 
1 1 1    3    0 -128 o   25.439   5.0262   30.604   9.2667   30.604   9.2667   30.604   9.2667   25.439   5.0262   25.439   5.0262 -0.000000 0.000000 
1 1 1    3    0 -127 o   30.378   3.3293   39.872   7.9924   39.872   7.9924   39.872   7.9924   30.378   3.3293   30.378   3.3293 -0.000000 0.000000 
1 1 1    3    0 -126 o   16.574   6.0934   15.731   7.6089   15.731   7.6089   15.731   7.6089   16.574   6.0934   16.574   6.0934 -0.000000 0.000000 
1 1 1    3    0 -125 o   42.695   2.5184   76.005   8.6942   76.005   8.6942   76.005   8.6942   42.695   2.5184   42.695   2.5184 0.000000 0.000000 
1 1 1    3    0 -124 o   18.891   5.5597   18.488   7.4400   18.488   7.4400   18.488   7.4400   18.891   5.5597   18.891   5.5597 -0.000000 0.000000 
1 1 1    3    0 -123 o   21.930   5.4977   23.683   8.5009   23.683   8.5009   23.683   8.5009   21.930   5.4977   21.930   5.4977 0.000000 0.000000 
1 1 1    3    0 -122 o   60.847   2.2827  152.754   11.286  152.754   11.286  152.754   11.286   60.847   2.2827   60.847   2.2827 -0.000000 0.000000 
1 1 1    3    0 -121 o   23.711   5.0490   26.441   8.5769   26.441   8.5769   26.441   8.5769   23.711   5.0490   23.711   5.0490 -0.000000 0.000000 
1 1 1    3    0 -120 o   46.364   2.3699   88.943   8.9030   88.943   8.9030   88.943   8.9030   46.364   2.3699   46.364   2.3699 0.000000 0.000000 
1 1 1    3    0 -119 o   32.147   3.3585   44.039   8.5606   44.039   8.5606   44.039   8.5606   32.147   3.3585   32.147   3.3585 0.000000 0.000000 
1 1 1    3    0 -118 o   9.2460   5.4802   4.1696   7.1531   4.1696   7.1531   4.1696   7.1531   9.2460   5.4802   9.2460   5.4802 -0.000000 0.000000 
1 1 1    3    0 -117 o   44.987   2.3941   83.707   8.7224   83.707   8.7224   83.707   8.7224   44.987   2.3941   44.987   2.3941 -0.000000 0.000000 
1 1 1    3    0 -116 o   33.771   3.0356   48.031   8.1937   48.031   8.1937   48.031   8.1937   33.771   3.0356   33.771   3.0356 0.000000 0.000000 
1 1 1    3    0 -115 o   68.450   1.7966  191.957   10.009  191.957   10.009  191.957   10.009   68.450   1.7966   68.450   1.7966 -0.000000 0.000000 
1 1 1    3    0 -114 o   64.030   1.8165  167.998   9.4637  167.998   9.4637  167.998   9.4637   64.030   1.8165   64.030   1.8165 0.000000 0.000000 
1 1 1    3    0 -113 f   71.557   1.7656  209.615   10.285  209.615   10.285  209.615   10.285   71.557   1.7656   71.557   1.7656 -0.000000 0.000000 
1 1 1    3    0 -112 o   41.589   2.3941   71.502   8.0544   71.502   8.0544   71.502   8.0544   41.589   2.3941   41.589   2.3941 0.000000 0.000000 
1 1 1    3    0 -111 o   48.949   2.1287   98.519   8.4573   98.519   8.4573   98.519   8.4573   48.949   2.1287   48.949   2.1287 -0.000000 0.000000 
1 1 1    3    0 -110 o   94.519   1.6428  365.076   12.649  365.076   12.649  365.076   12.649   94.519   1.6428   94.519   1.6428 0.000000 0.000000 
1 1 1    3    0 -109 o   5.5755   3.9331  -8.3886   7.1358  -8.3886   7.1358  -8.3886   7.1358   5.5755   3.9331   5.5755   3.9331 -0.000000 0.000000 
1 1 1    3    0 -108 o   52.666   2.1951  113.918   9.3864  113.918   9.3864  113.918   9.3864   52.666   2.1951   52.666   2.1951 0.000000 0.000000 
1 1 1    3    0 -107 o   49.207   2.2845   99.560   9.1181   99.560   9.1181   99.560   9.1181   49.207   2.2845   49.207   2.2845 0.000000 0.000000 
1 1 1    3    0 -106 o   59.579   2.0665  145.452   10.009  145.452   10.009  145.452   10.009   59.579   2.0665   59.579   2.0665 0.000000 0.000000 
1 1 1    3    0 -105 o   18.597   5.8366   17.834   7.7658   17.834   7.7658   17.834   7.7658   18.597   5.8366   18.597   5.8366 -0.000000 0.000000 
1 1 1    3    0 -104 o   73.820   1.8106  222.749   10.880  222.749   10.880  222.749   10.880   73.820   1.8106   73.820   1.8106 -0.000000 0.000000 
1 1 1    3    0 -103 o   25.931   4.5164   29.916   8.6799   29.916   8.6799   29.916   8.6799   25.931   4.5164   25.931   4.5164 -0.000000 0.000000 
1 1 1    3    0 -102 o   75.917   2.0101  235.656   12.419  235.656   12.419  235.656   12.419   75.917   2.0101   75.917   2.0101 -0.000000 0.000000 
1 1 1    3    0 -101 o   78.366   1.9313  250.991   12.320  250.991   12.320  250.991   12.320   78.366   1.9313   78.366   1.9313 0.000000 0.000000 
1 1 1    3    0 -100 o   64.788   2.0515  171.756   10.810  171.756   10.810  171.756   10.810   64.788   2.0515   64.788   2.0515 -0.000000 0.000000 
1 1 1    3    0  -99 o   10.541   5.8420   6.2570   7.3686   6.2570   7.3686   6.2570   7.3686   10.541   5.8420   10.541   5.8420 0.000000 0.000000 
1 1 1    3    0  -98 o   10.123   5.7530   5.4712   7.3752   5.4712   7.3752   5.4712   7.3752   10.123   5.7530   10.123   5.7530 -0.000000 0.000000 
1 1 1    3    0  -97 o   9.3695   5.7952   2.5883   8.7484   2.5883   8.7484   2.5883   8.7484   9.3695   5.7952   9.3695   5.7952 0.000000 0.000000 
1 1 1    3    0  -96 o  202.959   2.0119  1680.51   33.278  1680.51   33.278  1680.51   33.278  202.959   2.0119  202.959   2.0119 -0.000000 0.000000 
1 1 1    3    0  -95 o   77.229   1.9042  243.668   11.971  243.668   11.971  243.668   11.971   77.229   1.9042   77.229   1.9042 0.000000 0.000000 
1 1 1    3    0  -94 o   50.472   2.3981  104.610   9.8154  104.610   9.8154  104.610   9.8154   50.472   2.3981   50.472   2.3981 0.000000 0.000000 
1 1 1    3    0  -93 o  287.878   2.4635  3381.16   57.799  3381.16   57.799  3381.16   57.799  287.878   2.4635  287.878   2.4635 -0.000000 0.000000 
1 1 1    3    0  -92 o   10.097   5.8787   5.0076   7.9834   5.0076   7.9834   5.0076   7.9834   10.097   5.8787   10.097   5.8787 0.000000 0.000000 
1 1 1    3    0  -91 o  123.223   1.7328  619.438   17.397  619.438   17.397  619.438   17.397  123.223   1.7328  123.223   1.7328 -0.000000 0.000000 
1 1 1    3    0  -90 o   59.605   1.9501  145.322   9.4519  145.322   9.4519  145.322   9.4519   59.605   1.9501   59.605   1.9501 0.000000 0.000000 
1 1 1    3    0  -89 o   5.5814   3.9663 -10.6230   7.7250 -10.6230   7.7250 -10.6230   7.7250   5.5814   3.9663   5.5814   3.9663 -0.000000 0.000000 
1 1 1    3    0  -88 o  186.381   1.7690  1416.60   26.870  1416.60   26.870  1416.60   26.870  186.381   1.7690  186.381   1.7690 -0.000000 0.000000 
1 1 1    3    0  -87 o  229.837   1.9717  2154.20   36.934  2154.20   36.934  2154.20   36.934  229.837   1.9717  229.837   1.9717 0.000000 0.000000 
1 1 1    3    0  -86 o  236.314   1.9854  2277.31   38.239  2277.31   38.239  2277.31   38.239  236.314   1.9854  236.314   1.9854 -0.000000 0.000000 
1 1 1    3    0  -85 o  287.849   2.2397  3379.01   52.546  3379.01   52.546  3379.01   52.546  287.849   2.2397  287.849   2.2397 -0.000000 0.000000 
1 1 1    3    0  -84 o   98.077   1.7478  392.510   13.963  392.510   13.963  392.510   13.963   98.077   1.7478   98.077   1.7478 -0.000000 0.000000 
1 1 1    3    0  -83 o   48.748   2.3139   97.544   9.1472   97.544   9.1472   97.544   9.1472   48.748   2.3139   48.748   2.3139 0.000000 0.000000 
1 1 1    3    0  -82 o  257.590   2.5217  2706.31   52.938  2706.31   52.938  2706.31   52.938  257.590   2.5217  257.590   2.5217 0.000000 0.000000 
1 1 1    3    0  -81 o  274.791   2.6342  3079.85   58.993  3079.85   58.993  3079.85   58.993  274.791   2.6342  274.791   2.6342 0.000000 0.000000 
1 1 1    3    0  -80 o  254.044   2.4944  2632.21   51.644  2632.21   51.644  2632.21   51.644  254.044   2.4944  254.044   2.4944 -0.000000 0.000000 
1 1 1    3    0  -79 o  184.890   1.8432  1393.96   27.774  1393.96   27.774  1393.96   27.774  184.890   1.8432  184.890   1.8432 0.000000 0.000000 
1 1 1    3    0  -78 o  113.762   1.4845  527.815   13.761  527.815   13.761  527.815   13.761  113.762   1.4845  113.762   1.4845 0.000000 0.000000 
1 1 1    3    0  -77 o  538.279   3.7391 11820.32  164.047 11820.32  164.047 11820.32  164.047  538.279   3.7391  538.279   3.7391 0.000000 0.000000 
1 1 1    3    0  -76 o   39.061   2.1914   62.788   6.9270   62.788   6.9270   62.788   6.9270   39.061   2.1914   39.061   2.1914 0.000000 0.000000 
1 1 1    3    0  -75 o  305.407   2.3054  3803.29   57.386  3803.29   57.386  3803.29   57.386  305.407   2.3054  305.407   2.3054 0.000000 0.000000 
1 1 1    3    0  -74 o  107.783   1.7748  473.942   15.584  473.942   15.584  473.942   15.584  107.783   1.7748  107.783   1.7748 -0.000000 0.000000 
1 1 1    3    0  -73 o  252.350   2.1949  2596.63   45.141  2596.63   45.141  2596.63   45.141  252.350   2.1949  252.350   2.1949 0.000000 0.000000 
1 1 1    3    0  -72 o   74.183   1.8404  224.739   11.114  224.739   11.114  224.739   11.114   74.183   1.8404   74.183   1.8404 0.000000 0.000000 
1 1 1    3    0  -71 o   18.080   4.8843   15.928   6.2205   15.928   6.2205   15.928   6.2205   18.080   4.8843   18.080   4.8843 -0.000000 0.000000 
1 1 1    3    0  -70 o  120.140   1.5812  588.640   15.479  588.640   15.479  588.640   15.479  120.140   1.5812  120.140   1.5812 0.000000 0.000000 
1 1 1    3    0  -69 o  179.878   1.6407  1319.21   24.053  1319.21   24.053  1319.21   24.053  179.878   1.6407  179.878   1.6407 0.000000 0.000000 
1 1 1    3    0  -68 o  108.098   1.5721  476.599   13.846  476.599   13.846  476.599   13.846  108.098   1.5721  108.098   1.5721 0.000000 0.000000 
1 1 1    3    0  -67 o  405.505   2.8970  6704.62   95.749  6704.62   95.749  6704.62   95.749  405.505   2.8970  405.505   2.8970 0.000000 0.000000 
1 1 1    3    0  -66 o  235.330   1.9081  2257.82   36.598  2257.82   36.598  2257.82   36.598  235.330   1.9081  235.330   1.9081 -0.000000 0.000000 
1 1 1    3    0  -65 o  124.895   1.6103  636.121   16.388  636.121   16.388  636.121   16.388  124.895   1.6103  124.895   1.6103 -0.000000 0.000000 
1 1 1    3    0  -64 o  718.310   4.8910 21043.60  286.350 21043.60  286.350 21043.60  286.350  718.310   4.8910  718.310   4.8910 0.000000 0.000000 
1 1 1    3    0  -63 o  272.202   2.1008  3020.68   46.608  3020.68   46.608  3020.68   46.608  272.202   2.1008  272.202   2.1008 -0.000000 0.000000 
1 1 1    3    0  -62 o   56.297   1.8906  129.618   8.6536  129.618   8.6536  129.618   8.6536   56.297   1.8906   56.297   1.8906 0.000000 0.000000 
1 1 1    3    0  -61 o   77.754   1.5847  246.725   10.034  246.725   10.034  246.725   10.034   77.754   1.5847   77.754   1.5847 0.000000 0.000000 
1 1 1    3    0  -60 o   60.844   1.7043  151.242   8.4378  151.242   8.4378  151.242   8.4378   60.844   1.7043   60.844   1.7043 0.000000 0.000000 
1 1 1    3    0  -59 o  145.242   1.8230  860.232   21.576  860.232   21.576  860.232   21.576  145.242   1.8230  145.242   1.8230 -0.000000 0.000000 
1 1 1    3    0  -58 o  273.164   2.5678  3042.31   57.166  3042.31   57.166  3042.31   57.166  273.164   2.5678  273.164   2.5678 -0.000000 0.000000 
1 1 1    3    0  -57 o   35.283   2.4294   51.459   6.9098   51.459   6.9098   51.459   6.9098   35.283   2.4294   35.283   2.4294 -0.000000 0.000000 
1 1 1    3    0  -56 o  180.072   1.7889  1322.03   26.252  1322.03   26.252  1322.03   26.252  180.072   1.7889  180.072   1.7889 -0.000000 0.000000 
1 1 1    3    0  -55 o  184.586   1.8166  1389.12   27.327  1389.12   27.327  1389.12   27.327  184.586   1.8166  184.586   1.8166 -0.000000 0.000000 
1 1 1    3    0  -54 o  262.014   2.2453  2798.78   47.948  2798.78   47.948  2798.78   47.948  262.014   2.2453  262.014   2.2453 -0.000000 0.000000 
1 1 1    3    0  -53 o  277.659   2.1364  3142.83   48.348  3142.83   48.348  3142.83   48.348  277.659   2.1364  277.659   2.1364 0.000000 0.000000 
1 1 1    3    0  -52 o  151.951   1.5634  941.362   19.359  941.362   19.359  941.362   19.359  151.951   1.5634  151.951   1.5634 -0.000000 0.000000 
1 1 1    3    0  -51 o  538.529   3.7313 11823.10  163.777 11823.10  163.777 11823.10  163.777  538.529   3.7313  538.529   3.7313 -0.000000 0.000000 
1 1 1    3    0  -50 o  237.107   1.9102  2291.88   36.914  2291.88   36.914  2291.88   36.914  237.107   1.9102  237.107   1.9102 0.000000 0.000000 
1 1 1    3    0  -49 o   43.595   2.1529   78.030   7.6081   78.030   7.6081   78.030   7.6081   43.595   2.1529   43.595   2.1529 0.000000 0.000000 
1 1 1    3    0  -48 o   15.697   5.3282   12.991   6.1061   12.991   6.1061   12.991   6.1061   15.697   5.3282   15.697   5.3282 -0.000000 0.000000 
1 1 1    3    0  -47 o  533.190   4.0421 11590.17  175.657 11590.17  175.657 11590.17  175.657  533.190   4.0421  533.190   4.0421 0.000000 0.000000 
1 1 1    3    0  -46 f  149.117   1.6099  906.610   19.563  906.610   19.563  906.610   19.563  149.117   1.6099  149.117   1.6099 0.000000 0.000000 
1 1 1    3    0  -45 o  499.186   4.2428 10159.50  172.617 10159.50  172.617 10159.50  172.617  499.186   4.2428  499.186   4.2428 0.000000 0.000000 
1 1 1    3    0  -44 f   94.420   1.4226  363.608   10.943  363.608   10.943  363.608   10.943   94.420   1.4226   94.420   1.4226 0.000000 0.000000 
1 1 1    3    0  -43 o  851.829   6.3038 29585.91  437.659 29585.91  437.659 29585.91  437.659  851.829   6.3038  851.829   6.3038 0.000000 0.000000 
1 1 1    3    0  -42 o  119.605   1.4915  583.325   14.536  583.325   14.536  583.325   14.536  119.605   1.4915  119.605   1.4915 -0.000000 0.000000 
1 1 1    3    0  -41 o  844.731   6.2519 29094.99  430.442 29094.99  430.442 29094.99  430.442  844.731   6.2519  844.731   6.2519 -0.000000 0.000000 
1 1 1    3    0  -40 o  686.198   5.1178 19197.70  286.231 19197.70  286.231 19197.70  286.231  686.198   5.1178  686.198   5.1178 0.000000 0.000000 
1 1 1    3    0  -39 o  544.779   5.3106 12101.88  235.782 12101.88  235.782 12101.88  235.782  544.779   5.3106  544.779   5.3106 0.000000 0.000000 
1 1 1    3    0  -38 f  1393.73   11.443 79260.53  1299.81 79260.53  1299.81 79260.53  1299.81  1393.73   11.443  1393.73   11.443 0.000000 0.000000 
1 1 1    3    0  -37 o  638.576   5.3460 16627.17  278.235 16627.17  278.235 16627.17  278.235  638.576   5.3460  638.576   5.3460 -0.000000 0.000000 
1 1 1    3    0  -36 o  850.035   7.0320 29467.94  487.175 29467.94  487.175 29467.94  487.175  850.035   7.0320  850.035   7.0320 -0.000000 0.000000 
1 1 1    3    0  -35 o   70.324   1.5411  201.859   8.8249  201.859   8.8249  201.859   8.8249   70.324   1.5411   70.324   1.5411 0.000000 0.000000 
1 1 1    3    0  -34 o  244.653   2.0907  2440.18   41.687  2440.18   41.687  2440.18   41.687  244.653   2.0907  244.653   2.0907 -0.000000 0.000000 
1 1 1    3    0  -33 o  285.293   2.6234  3318.43   60.998  3318.43   60.998  3318.43   60.998  285.293   2.6234  285.293   2.6234 0.000000 0.000000 
1 1 1    3    0  -32 o  270.273   2.2476  2978.02   49.510  2978.02   49.510  2978.02   49.510  270.273   2.2476  270.273   2.2476 -0.000000 0.000000 
1 1 1    3    0  -31 o  759.558   5.6407 23527.31  349.199 23527.31  349.199 23527.31  349.199  759.558   5.6407  759.558   5.6407 -0.000000 0.000000 
1 1 1    3    0  -30 o   9.0213   4.7546   4.7907   4.6505   4.7907   4.6505   4.7907   4.6505   9.0213   4.7546   9.0213   4.7546 0.000000 0.000000 
1 1 1    3    0  -29 o  124.512   1.6432  632.228   16.672  632.228   16.672  632.228   16.672  124.512   1.6432  124.512   1.6432 0.000000 0.000000 
1 1 1    3    0  -28 o  551.542   4.6529 12404.64  209.156 12404.64  209.156 12404.64  209.156  551.542   4.6529  551.542   4.6529 -0.000000 0.000000 
1 1 1    3    0  -27 o  208.062   2.0943  1765.02   35.511  1765.02   35.511  1765.02   35.511  208.062   2.0943  208.062   2.0943 -0.000000 0.000000 
1 1 1    3    0  -26 o  123.155   1.6225  618.519   16.282  618.519   16.282  618.519   16.282  123.155   1.6225  123.155   1.6225 -0.000000 0.000000 
1 1 1    3    0  -25 o  444.236   3.8142  8046.52  138.096  8046.52  138.096  8046.52  138.096  444.236   3.8142  444.236   3.8142 -0.000000 0.000000 
1 1 1    3    0  -24 o  204.825   2.0672  1710.52   34.507  1710.52   34.507  1710.52   34.507  204.825   2.0672  204.825   2.0672 -0.000000 0.000000 
1 1 1    3    0  -23 o  569.205   4.7881 13211.21  222.126 13211.21  222.126 13211.21  222.126  569.205   4.7881  569.205   4.7881 0.000000 0.000000 
1 1 1    3    0  -22 o  1164.65   11.061 55366.93  1049.90 55366.93  1049.90 55366.93  1049.90  1164.65   11.061  1164.65   11.061 -0.000000 0.000000 
1 1 1    3    0  -21 o  367.393   3.7230  5503.75  111.471  5503.75  111.471  5503.75  111.471  367.393   3.7230  367.393   3.7230 -0.000000 0.000000 
1 1 1    3    0  -20 o  430.364   4.2761  7552.26  149.978  7552.26  149.978  7552.26  149.978  430.364   4.2761  430.364   4.2761 0.000000 0.000000 
1 1 1    3    0  -19 f  408.721   3.5295  6810.87  117.572  6810.87  117.572  6810.87  117.572  408.721   3.5295  408.721   3.5295 -0.000000 0.000000 
1 1 1    3    0  -18 o  119.094   1.7843  578.485   17.313  578.485   17.313  578.485   17.313  119.094   1.7843  119.094   1.7843 0.000000 0.000000 
1 1 1    3    0  -17 o  1165.67   9.5753 55430.84  909.700 55430.84  909.700 55430.84  909.700  1165.67   9.5753  1165.67   9.5753 0.000000 0.000000 
1 1 1    3    0  -16 o  151.421   1.9797  935.007   24.426  935.007   24.426  935.007   24.426  151.421   1.9797  151.421   1.9797 -0.000000 0.000000 
1 1 1    3    0  -15 o  1306.52   10.716 69644.46  1141.08 69644.46  1141.08 69644.46  1141.08  1306.52   10.716  1306.52   10.716 -0.000000 0.000000 
1 1 1    3    0  -14 o  178.664   2.1473  1301.61   31.262  1301.61   31.262  1301.61   31.262  178.664   2.1473  178.664   2.1473 -0.000000 0.000000 
1 1 1    3    0  -13 o  892.116   7.3602 32456.25  535.157 32456.25  535.157 32456.25  535.157  892.116   7.3602  892.116   7.3602 -0.000000 0.000000 
1 1 1    3    0  -12 o  806.746   5.9723 26537.17  392.702 26537.17  392.702 26537.17  392.702  806.746   5.9723  806.746   5.9723 -0.000000 0.000000 
1 1 1    3    0  -11 o  1020.75   8.3970 42494.71  698.575 42494.71  698.575 42494.71  698.575  1020.75   8.3970  1020.75   8.3970 0.000000 0.000000 
1 1 1    3    0  -10 o  326.645   2.5939  4349.70   69.057  4349.70   69.057  4349.70   69.057  326.645   2.5939  326.645   2.5939 0.000000 0.000000 
1 1 1    3    0   -9 o  265.602   2.1945  2875.88   47.504  2875.88   47.504  2875.88   47.504  265.602   2.1945  265.602   2.1945 -0.000000 0.000000 
1 1 1    3    0   -8 o  423.288   3.6362  7304.88  125.442  7304.88  125.442  7304.88  125.442  423.288   3.6362  423.288   3.6362 0.000000 0.000000 
1 1 1    3    0   -7 o  778.774   6.4485 24730.77  409.298 24730.77  409.298 24730.77  409.298  778.774   6.4485  778.774   6.4485 0.000000 0.000000 
1 1 1    3    0   -6 o  162.739   1.7648  1079.82   23.405  1079.82   23.405  1079.82   23.405  162.739   1.7648  162.739   1.7648 0.000000 0.000000 
1 1 1    3    0   -5 f  627.358   5.2392 16047.48  267.887 16047.48  267.887 16047.48  267.887  627.358   5.2392  627.358   5.2392 0.000000 0.000000 
1 1 1    3    0   -4 o   88.436   1.6119  319.084   11.611  319.084   11.611  319.084   11.611   88.436   1.6119   88.436   1.6119 0.000000 0.000000 
1 1 1    3    0   -3 o  1068.47   8.7855 46562.83  765.061 46562.83  765.061 46562.83  765.061  1068.47   8.7855  1068.47   8.7855 0.000000 0.000000 
1 1 1    3    0   -2 o  375.807   3.2704  5757.92  100.168  5757.92  100.168  5757.92  100.168  375.807   3.2704  375.807   3.2704 -0.000000 0.000000 
1 1 1    3    0   -1 o  485.017   4.1165  9590.99  162.725  9590.99  162.725  9590.99  162.725  485.017   4.1165  485.017   4.1165 -0.000000 0.000000 
1 1 1    3    0    0 o  248.809   2.3334  2523.87   47.316  2523.87   47.316  2523.87   47.316  248.809   2.3334  248.809   2.3334 0.000000 0.000000 
1 1 1    3    0    1 o  385.198   3.3417  6049.30  104.911  6049.30  104.911  6049.30  104.911  385.198   3.3417  385.198   3.3417 -0.000000 0.000000 
1 1 1    3    0    2 o  1156.80   10.972 54599.58  1034.44 54599.58  1034.44 54599.58  1034.44  1156.80   10.972  1156.80   10.972 0.000000 0.000000 
1 1 1    3    0    3 o  289.523   3.0314  3417.75   71.525  3417.75   71.525  3417.75   71.525  289.523   3.0314  289.523   3.0314 -0.000000 0.000000 
1 1 1    3    0    4 o  524.480   5.1127 11216.65  218.537 11216.65  218.537 11216.65  218.537  524.480   5.1127  524.480   5.1127 -0.000000 0.000000 
1 1 1    3    0    5 f  210.189   2.9263  1801.78   50.115  1801.78   50.115  1801.78   50.115  210.189   2.9263  210.189   2.9263 0.000000 0.000000 
1 1 1    3    0    7 o  160.085   2.4841  1045.30   32.398  1045.30   32.398  1045.30   32.398  160.085   2.4841  160.085   2.4841 0.000000 0.000000 
1 1 1    3    0    8 o  114.221   2.1517  532.320   20.018  532.320   20.018  532.320   20.018  114.221   2.1517  114.221   2.1517 0.000000 0.000000 
1 1 1    3    0    9 o  713.042   8.3816 20740.45  487.017 20740.45  487.017 20740.45  487.017  713.042   8.3816  713.042   8.3816 0.000000 0.000000 
1 1 1    3    0   11 o  757.324   12.579 23419.79  776.055 23419.79  776.055 23419.79  776.055  757.324   12.579  757.324   12.579 -0.000000 0.000000 
1 1 1    3    0   12 o  790.354   13.112 25509.65  844.203 25509.65  844.203 25509.65  844.203  790.354   13.112  790.354   13.112 -0.000000 0.000000 
1 1 1    3    0   13 o  438.337   7.5222  7841.04  268.597  7841.04  268.597  7841.04  268.597  438.337   7.5222  438.337   7.5222 -0.000000 0.000000 
1 1 1    3    0   14 o  1364.90   22.458 76258.85  2497.16 76258.85  2497.16 76258.85  2497.16  1364.90   22.458  1364.90   22.458 0.000000 0.000000 
1 1 1    3    0   15 o  237.621   3.2133  2302.75   62.214  2302.75   62.214  2302.75   62.214  237.621   3.2133  237.621   3.2133 0.000000 0.000000 
1 1 1    3    0   16 o  383.623   4.7255  6001.86  147.720  6001.86  147.720  6001.86  147.720  383.623   4.7255  383.623   4.7255 -0.000000 0.000000 
1 1 1    3    0   17 o  347.860   4.3452  4934.94  123.169  4934.94  123.169  4934.94  123.169  347.860   4.3452  347.860   4.3452 -0.000000 0.000000 
1 1 1    3    0   18 o  515.412   6.1720 10835.13  259.223 10835.13  259.223 10835.13  259.223  515.412   6.1720  515.412   6.1720 0.000000 0.000000 
1 1 1    3    0   19 f  730.503   8.5878 21772.07  511.219 21772.07  511.219 21772.07  511.219  730.503   8.5878  730.503   8.5878 -0.000000 0.000000 
1 1 1    3    0   20 o  291.432   3.7618  3463.80   89.332  3463.80   89.332  3463.80   89.332  291.432   3.7618  291.432   3.7618 -0.000000 0.000000 
1 1 1    3    0   21 o  445.510   5.4117  8095.29  196.463  8095.29  196.463  8095.29  196.463  445.510   5.4117  445.510   5.4117 -0.000000 0.000000 
1 1 1    3    0   22 o  177.043   2.6851  1278.48   38.730  1278.48   38.730  1278.48   38.730  177.043   2.6851  177.043   2.6851 0.000000 0.000000 
1 1 1    3    0   23 o   83.225   1.6853  282.658   11.422  282.658   11.422  282.658   11.422   83.225   1.6853   83.225   1.6853 0.000000 0.000000 
1 1 1    3    0   24 o  742.246   6.1661 22468.95  373.014 22468.95  373.014 22468.95  373.014  742.246   6.1661  742.246   6.1661 -0.000000 0.000000 
1 1 1    3    0   25 o  131.804   1.8884  708.521   20.280  708.521   20.280  708.521   20.280  131.804   1.8884  131.804   1.8884 -0.000000 0.000000 
1 1 1    3    0   26 o  663.096   5.5312 17931.66  298.927 17931.66  298.927 17931.66  298.927  663.096   5.5312  663.096   5.5312 0.000000 0.000000 
1 1 1    3    0   27 o  297.626   2.7055  3611.59   65.627  3611.59   65.627  3611.59   65.627  297.626   2.7055  297.626   2.7055 0.000000 0.000000 
1 1 1    3    0   28 o  715.321   5.9513 20869.25  346.961 20869.25  346.961 20869.25  346.961  715.321   5.9513  715.321   5.9513 -0.000000 0.000000 
1 1 1    3    0   29 o  441.528   3.7905  7948.79  136.402  7948.79  136.402  7948.79  136.402  441.528   3.7905  441.528   3.7905 0.000000 0.000000 
1 1 1    3    0   30 o  359.246   4.4882  5263.90  131.385  5263.90  131.385  5263.90  131.385  359.246   4.4882  359.246   4.4882 0.000000 0.000000 
1 1 1    3    0   31 o  804.338   6.6727 26388.45  437.431 26388.45  437.431 26388.45  437.431  804.338   6.6727  804.338   6.6727 -0.000000 0.000000 
1 1 1    3    0   32 o  190.278   1.9813  1476.19   30.723  1476.19   30.723  1476.19   30.723  190.278   1.9813  190.278   1.9813 0.000000 0.000000 
1 1 1    3    0   33 o  263.804   2.8487  2837.65   61.241  2837.65   61.241  2837.65   61.241  263.804   2.8487  263.804   2.8487 0.000000 0.000000 
1 1 1    3    0   34 o  156.596   1.7696  999.880   22.582  999.880   22.582  999.880   22.582  156.596   1.7696  156.596   1.7696 0.000000 0.000000 
1 1 1    3    0   35 o  780.615   6.4744 24850.63  411.914 24850.63  411.914 24850.63  411.914  780.615   6.4744  780.615   6.4744 -0.000000 0.000000 
1 1 1    3    0   36 o  249.773   2.7228  2543.79   55.423  2543.79   55.423  2543.79   55.423  249.773   2.7228  249.773   2.7228 -0.000000 0.000000 
1 1 1    3    0   37 o  117.554   1.8726  563.665   17.934  563.665   17.934  563.665   17.934  117.554   1.8726  117.554   1.8726 0.000000 0.000000 
1 1 1    3    0   38 f  361.827   2.6055  5336.99   76.838  5336.99   76.838  5336.99   76.838  361.827   2.6055  361.827   2.6055 -0.000000 0.000000 
1 1 1    3    0   39 o  235.957   1.8665  2269.67   35.895  2269.67   35.895  2269.67   35.895  235.957   1.8665  235.957   1.8665 0.000000 0.000000 
1 1 1    3    0   40 o  752.587   5.5900 23092.84  342.888 23092.84  342.888 23092.84  342.888  752.587   5.5900  752.587   5.5900 -0.000000 0.000000 
1 1 1    3    0   41 o   60.261   1.4673  148.272   7.1978  148.272   7.1978  148.272   7.1978   60.261   1.4673   60.261   1.4673 -0.000000 0.000000 
1 1 1    3    0   42 o  162.482   1.5062  1076.30   19.946  1076.30   19.946  1076.30   19.946  162.482   1.5062  162.482   1.5062 0.000000 0.000000 
1 1 1    3    0   43 o  917.140   6.1810 34295.37  462.047 34295.37  462.047 34295.37  462.047  917.140   6.1810  917.140   6.1810 -0.000000 0.000000 
1 1 1    3    0   44 f  969.711   6.5293 38340.74  516.062 38340.74  516.062 38340.74  516.062  969.711   6.5293  969.711   6.5293 0.000000 0.000000 
1 1 1    3    0   45 o  1092.60   7.3406 48677.55  653.707 48677.55  653.707 48677.55  653.707  1092.60   7.3406  1092.60   7.3406 0.000000 0.000000 
1 1 1    3    0   46 f  298.590   2.4439  3634.62   59.475  3634.62   59.475  3634.62   59.475  298.590   2.4439  298.590   2.4439 0.000000 0.000000 
1 1 1    3    0   47 o  117.749   1.5439  565.397   14.813  565.397   14.813  565.397   14.813  117.749   1.5439  117.749   1.5439 0.000000 0.000000 
1 1 1    3    0   48 o  138.234   1.8385  779.248   20.709  779.248   20.709  779.248   20.709  138.234   1.8385  138.234   1.8385 -0.000000 0.000000 
1 1 1    3    0   49 o   47.644   2.0910   93.052   8.0851   93.052   8.0851   93.052   8.0851   47.644   2.0910   47.644   2.0910 -0.000000 0.000000 
1 1 1    3    0   50 o   29.521   3.2661   36.809   7.6143   36.809   7.6143   36.809   7.6143   29.521   3.2661   29.521   3.2661 -0.000000 0.000000 
1 1 1    3    0   51 o  108.982   1.6590  484.422   14.730  484.422   14.730  484.422   14.730  108.982   1.6590  108.982   1.6590 -0.000000 0.000000 
1 1 1    3    0   52 o  112.683   2.0425  518.040   18.747  518.040   18.747  518.040   18.747  112.683   2.0425  112.683   2.0425 -0.000000 0.000000 
1 1 1    3    0   53 o  438.272   3.3929  7830.93  121.198  7830.93  121.198  7830.93  121.198  438.272   3.3929  438.272   3.3929 -0.000000 0.000000 
1 1 1    3    0   54 o  305.069   2.5078  3794.14   62.354  3794.14   62.354  3794.14   62.354  305.069   2.5078  305.069   2.5078 -0.000000 0.000000 
1 1 1    3    0   55 o  348.498   2.7844  4951.32   79.086  4951.32   79.086  4951.32   79.086  348.498   2.7844  348.498   2.7844 -0.000000 0.000000 
1 1 1    3    0   56 o  319.063   2.8895  4150.51   75.137  4150.51   75.137  4150.51   75.137  319.063   2.8895  319.063   2.8895 -0.000000 0.000000 
1 1 1    3    0   57 o  243.688   2.1206  2421.00   42.117  2421.00   42.117  2421.00   42.117  243.688   2.1206  243.688   2.1206 0.000000 0.000000 
1 1 1    3    0   58 o  565.479   4.2711 13037.92  196.848 13037.92  196.848 13037.92  196.848  565.479   4.2711  565.479   4.2711 -0.000000 0.000000 
1 1 1    3    0   59 o  300.618   2.4715  3684.34   60.554  3684.34   60.554  3684.34   60.554  300.618   2.4715  300.618   2.4715 -0.000000 0.000000 
1 1 1    3    0   60 o  103.442   1.4269  436.376   12.027  436.376   12.027  436.376   12.027  103.442   1.4269  103.442   1.4269 0.000000 0.000000 
1 1 1    3    0   61 o  241.898   1.9361  2385.51   38.171  2385.51   38.171  2385.51   38.171  241.898   1.9361  241.898   1.9361 0.000000 0.000000 
1 1 1    3    0   62 o  306.615   2.2980  3832.72   57.429  3832.72   57.429  3832.72   57.429  306.615   2.2980  306.615   2.2980 -0.000000 0.000000 
1 1 1    3    0   63 o  660.040   4.5123 17765.80  242.750 17765.80  242.750 17765.80  242.750  660.040   4.5123  660.040   4.5123 -0.000000 0.000000 
1 1 1    3    0   64 o  158.575   1.7231  1025.31   22.267  1025.31   22.267  1025.31   22.267  158.575   1.7231  158.575   1.7231 -0.000000 0.000000 
1 1 1    3    0   65 o  539.843   3.7407 11883.71  164.594 11883.71  164.594 11883.71  164.594  539.843   3.7407  539.843   3.7407 -0.000000 0.000000 
1 1 1    3    0   66 o  248.736   1.9788  2522.38   40.117  2522.38   40.117  2522.38   40.117  248.736   1.9788  248.736   1.9788 0.000000 0.000000 
1 1 1    3    0   67 o  195.758   1.7126  1562.36   27.324  1562.36   27.324  1562.36   27.324  195.758   1.7126  195.758   1.7126 -0.000000 0.000000 
1 1 1    3    0   68 o  116.033   1.6087  549.104   15.209  549.104   15.209  549.104   15.209  116.033   1.6087  116.033   1.6087 -0.000000 0.000000 
1 1 1    3    0   69 o  320.731   2.3882  4194.21   62.430  4194.21   62.430  4194.21   62.430  320.731   2.3882  320.731   2.3882 0.000000 0.000000 
1 1 1    3    0   70 o  257.967   2.0335  2713.22   42.755  2713.22   42.755  2713.22   42.755  257.967   2.0335  257.967   2.0335 0.000000 0.000000 
1 1 1    3    0   71 o  114.471   1.4527  534.374   13.550  534.374   13.550  534.374   13.550  114.471   1.4527  114.471   1.4527 0.000000 0.000000 
1 1 1    3    0   72 o   75.964   1.5069  235.494   9.3228  235.494   9.3228  235.494   9.3228   75.964   1.5069   75.964   1.5069 -0.000000 0.000000 
1 1 1    3    0   73 o   68.960   1.5478  194.135   8.6905  194.135   8.6905  194.135   8.6905   68.960   1.5478   68.960   1.5478 -0.000000 0.000000 
1 1 1    3    0   74 o  135.719   1.6629  751.173   18.390  751.173   18.390  751.173   18.390  135.719   1.6629  135.719   1.6629 -0.000000 0.000000 
1 1 1    3    0   75 o  232.432   2.0964  2202.94   39.713  2202.94   39.713  2202.94   39.713  232.432   2.0964  232.432   2.0964 0.000000 0.000000 
1 1 1    3    0   76 o  114.711   1.6326  536.711   15.259  536.711   15.259  536.711   15.259  114.711   1.6326  114.711   1.6326 -0.000000 0.000000 
1 1 1    3    0   77 o  219.491   2.6093  1965.14   46.670  1965.14   46.670  1965.14   46.670  219.491   2.6093  219.491   2.6093 -0.000000 0.000000 
1 1 1    3    0   78 o   49.870   2.2340  102.004   9.0399  102.004   9.0399  102.004   9.0399   49.870   2.2340   49.870   2.2340 -0.000000 0.000000 
1 1 1    3    0   79 o  365.228   3.2554  5441.50   96.902  5441.50   96.902  5441.50   96.902  365.228   3.2554  365.228   3.2554 -0.000000 0.000000 
1 1 1    3    0   80 o  348.006   3.1340  4940.34   88.889  4940.34   88.889  4940.34   88.889  348.006   3.1340  348.006   3.1340 0.000000 0.000000 
1 1 1    3    0   81 o  320.739   2.4042  4195.15   62.850  4195.15   62.850  4195.15   62.850  320.739   2.4042  320.739   2.4042 -0.000000 0.000000 
1 1 1    3    0   82 o   24.143   3.6992   25.389   6.7730   25.389   6.7730   25.389   6.7730   24.143   3.6992   24.143   3.6992 0.000000 0.000000 
1 1 1    3    0   83 o  147.265   1.5732  884.359   18.881  884.359   18.881  884.359   18.881  147.265   1.5732  147.265   1.5732 -0.000000 0.000000 
1 1 1    3    0   84 o   61.816   1.8008  156.177   9.0565  156.177   9.0565  156.177   9.0565   61.816   1.8008   61.816   1.8008 -0.000000 0.000000 
1 1 1    3    0   85 o   11.146   6.2459   6.8117   8.5350   6.8117   8.5350   6.8117   8.5350   11.146   6.2459   11.146   6.2459 -0.000000 0.000000 
1 1 1    3    0   86 o  162.320   1.7004  1074.48   22.493  1074.48   22.493  1074.48   22.493  162.320   1.7004  162.320   1.7004 -0.000000 0.000000 
1 1 1    3    0   87 o   5.7187   4.0991 -14.5668   8.9695 -14.5668   8.9695 -14.5668   8.9695   5.7187   4.0991   5.7187   4.0991 0.000000 0.000000 
1 1 1    3    0   88 o  125.454   1.6411  641.955   16.776  641.955   16.776  641.955   16.776  125.454   1.6411  125.454   1.6411 -0.000000 0.000000 
1 1 1    3    0   89 o  191.912   1.7871  1501.97   27.952  1501.97   27.952  1501.97   27.952  191.912   1.7871  191.912   1.7871 0.000000 0.000000 
1 1 1    3    0   90 o   88.892   2.0280  322.696   14.678  322.696   14.678  322.696   14.678   88.892   2.0280   88.892   2.0280 0.000000 0.000000 
1 1 1    3    0   91 o   47.903   2.2815   94.218   8.8628   94.218   8.8628   94.218   8.8628   47.903   2.2815   47.903   2.2815 0.000000 0.000000 
1 1 1    3    0   92 o   52.736   2.1206  113.963   9.0824  113.963   9.0824  113.963   9.0824   52.736   2.1206   52.736   2.1206 0.000000 0.000000 
1 1 1    3    0   93 o  157.902   1.6613  1016.91   21.378  1016.91   21.378  1016.91   21.378  157.902   1.6613  157.902   1.6613 -0.000000 0.000000 
1 1 1    3    0   94 o  138.660   1.6151  784.232   18.250  784.232   18.250  784.232   18.250  138.660   1.6151  138.660   1.6151 0.000000 0.000000 
1 1 1    3    0   95 o   35.867   2.9525   53.558   8.4928   53.558   8.4928   53.558   8.4928   35.867   2.9525   35.867   2.9525 0.000000 0.000000 
1 1 1    3    0   96 o  268.463   2.1495  2940.29   47.033  2940.29   47.033  2940.29   47.033  268.463   2.1495  268.463   2.1495 0.000000 0.000000 
1 1 1    3    0   97 o   62.564   1.9236  160.092   9.7892  160.092   9.7892  160.092   9.7892   62.564   1.9236   62.564   1.9236 -0.000000 0.000000 
1 1 1    3    0   98 o   46.410   2.8347   88.897   10.631   88.897   10.631   88.897   10.631   46.410   2.8347   46.410   2.8347 0.000000 0.000000 
1 1 1    3    0   99 o   75.722   1.8973  234.308   11.694  234.308   11.694  234.308   11.694   75.722   1.8973   75.722   1.8973 -0.000000 0.000000 
1 1 1    3    0  100 o  140.107   2.0160  801.304   23.014  801.304   23.014  801.304   23.014  140.107   2.0160  140.107   2.0160 -0.000000 0.000000 
1 1 1    3    0  101 o   58.716   2.9874  141.912   14.214  141.912   14.214  141.912   14.214   58.716   2.9874   58.716   2.9874 0.000000 0.000000 
1 1 1    3    0  102 o   38.575   3.8112   62.637   11.696   62.637   11.696   62.637   11.696   38.575   3.8112   38.575   3.8112 -0.000000 0.000000 
1 1 1    3    0  103 o   67.853   2.7503  189.002   15.155  189.002   15.155  189.002   15.155   67.853   2.7503   67.853   2.7503 0.000000 0.000000 
1 1 1    3    0  104 o  123.376   2.0443  621.782   20.546  621.782   20.546  621.782   20.546  123.376   2.0443  123.376   2.0443 0.000000 0.000000 
1 1 1    3    0  105 o   93.652   1.6561  358.173   12.633  358.173   12.633  358.173   12.633   93.652   1.6561   93.652   1.6561 0.000000 0.000000 
1 1 1    3    0  106 o   8.8889   5.3595   3.2325   7.0702   3.2325   7.0702   3.2325   7.0702   8.8889   5.3595   8.8889   5.3595 -0.000000 0.000000 
1 1 1    3    0  107 o   72.598   1.7520  215.490   10.354  215.490   10.354  215.490   10.354   72.598   1.7520   72.598   1.7520 0.000000 0.000000 
1 1 1    3    0  108 o   26.339   3.5573   29.952   7.2457   29.952   7.2457   29.952   7.2457   26.339   3.5573   26.339   3.5573 -0.000000 0.000000 
1 1 1    3    0  109 o   25.157   3.7573   27.646   7.1992   27.646   7.1992   27.646   7.1992   25.157   3.7573   25.157   3.7573 -0.000000 0.000000 
1 1 1    3    0  110 o   9.9201   5.5596   5.5436   6.7635   5.5436   6.7635   5.5436   6.7635   9.9201   5.5596   9.9201   5.5596 0.000000 0.000000 
1 1 1    3    0  111 o   66.169   1.8111  179.262   9.7520  179.262   9.7520  179.262   9.7520   66.169   1.8111   66.169   1.8111 0.000000 0.000000 
1 1 1    3    0  112 o   21.222   4.6458   21.019   7.0371   21.019   7.0371   21.019   7.0371   21.222   4.6458   21.222   4.6458 -0.000000 0.000000 
1 1 1    3    0  113 f   62.344   1.8528  159.283   9.3970  159.283   9.3970  159.283   9.3970   62.344   1.8528   62.344   1.8528 0.000000 0.000000 
1 1 1    3    0  114 o   86.827   1.6493  308.352   11.664  308.352   11.664  308.352   11.664   86.827   1.6493   86.827   1.6493 -0.000000 0.000000 
1 1 1    3    0  115 o   19.569   5.0659   18.712   6.9830   18.712   6.9830   18.712   6.9830   19.569   5.0659   19.569   5.0659 -0.000000 0.000000 
1 1 1    3    0  116 o   72.678   1.7434  216.338   10.315  216.338   10.315  216.338   10.315   72.678   1.7434   72.678   1.7434 -0.000000 0.000000 
1 1 1    3    0  117 o   76.141   1.7104  237.415   10.604  237.415   10.604  237.415   10.604   76.141   1.7104   76.141   1.7104 -0.000000 0.000000 
1 1 1    3    0  118 o   27.239   3.8307   32.447   8.0227   32.447   8.0227   32.447   8.0227   27.239   3.8307   27.239   3.8307 -0.000000 0.000000 
1 1 1    3    0  119 o   22.217   5.0475   23.449   7.9684   23.449   7.9684   23.449   7.9684   22.217   5.0475   22.217   5.0475 -0.000000 0.000000 
1 1 1    3    0  120 o  136.134   1.8026  758.994   19.995  758.994   19.995  758.994   19.995  136.134   1.8026  136.134   1.8026 -0.000000 0.000000 
1 1 1    3    0  121 o   28.634   3.1770   35.086   7.1822   35.086   7.1822   35.086   7.1822   28.634   3.1770   28.634   3.1770 -0.000000 0.000000 
1 1 1    3    0  122 o   17.067   5.5623   15.565   6.8503   15.565   6.8503   15.565   6.8503   17.067   5.5623   17.067   5.5623 0.000000 0.000000 
1 1 1    3    0  123 o   12.776   6.0129   10.260   7.0472   10.260   7.0472   10.260   7.0472   12.776   6.0129   12.776   6.0129 0.000000 0.000000 
1 1 1    3    0  124 o   39.466   2.5525   65.032   8.1318   65.032   8.1318   65.032   8.1318   39.466   2.5525   39.466   2.5525 0.000000 0.000000 
1 1 1    3    0  125 o   36.148   2.7303   54.945   7.9372   54.945   7.9372   54.945   7.9372   36.148   2.7303   36.148   2.7303 0.000000 0.000000 
1 1 1    3    0  126 o   39.020   2.5702   63.733   8.0924   63.733   8.0924   63.733   8.0924   39.020   2.5702   39.020   2.5702 -0.000000 0.000000 
1 1 1    3    0  127 o   30.887   3.1962   41.005   7.8325   41.005   7.8325   41.005   7.8325   30.887   3.1962   30.887   3.1962 -0.000000 0.000000 
1 1 1    3    0  128 o   35.334   2.8439   52.884   8.0653   52.884   8.0653   52.884   8.0653   35.334   2.8439   35.334   2.8439 0.000000 0.000000 
1 1 1    3    0  129 o   59.499   2.6631  147.883   12.857  147.883   12.857  147.883   12.857   59.499   2.6631   59.499   2.6631 -0.000000 0.000000 
1 1 1    3    0  130 o   38.148   3.1597   62.126   9.6650   62.126   9.6650   62.126   9.6650   38.148   3.1597   38.148   3.1597 0.000000 0.000000 
1 1 1    3    0  131 o   14.767   6.7040   14.240   8.7185   14.240   8.7185   14.240   8.7185   14.767   6.7040   14.767   6.7040 -0.000000 0.000000 
1 1 1    3    0  132 o   8.5245   5.6279  -0.4425   10.099  -0.4425   10.099  -0.4425   10.099   8.5245   5.6279   8.5245   5.6279 -0.000000 0.000000 
1 1 1    3    0  133 o   55.702   3.8778  134.014   17.408  134.014   17.408  134.014   17.408   55.702   3.8778   55.702   3.8778 -0.000000 0.000000 
1 1 1    3    0  134 o   8.8367   6.0300  -4.7950   13.499  -4.7950   13.499  -4.7950   13.499   8.8367   6.0300   8.8367   6.0300 -0.000000 0.000000 
1 1 1    3    0  135 o   9.4148   6.3175  -1.7993   13.635  -1.7993   13.635  -1.7993   13.635   9.4148   6.3175   9.4148   6.3175 0.000000 0.000000 
1 1 1    3    0  136 o   33.807   9.1841   65.485   21.874   65.485   21.874   65.485   21.874   33.807   9.1841   33.807   9.1841 -0.000000 0.000000 
1 1 1    3    0  137 o   7.3664   5.3666 -35.5603   18.803 -35.5603   18.803 -35.5603   18.803   7.3664   5.3666   7.3664   5.3666 -0.000000 0.000000 
1 1 1    3    0  138 o   11.205   7.5360  -0.1800   19.607  -0.1800   19.607  -0.1800   19.607   11.205   7.5360   11.205   7.5360 -0.000000 0.000000 
1 1 1    3    0  140 o   12.346   8.0493   6.0546   19.711   6.0546   19.711   6.0546   19.711   12.346   8.0493   12.346   8.0493 -0.000000 0.000000 
1 1 1    3    1 -139 o   18.653   7.0689   19.286   14.772   7.6007   20.416   32.125   21.400   16.342   7.3438   21.927   8.4587 -5.584066 11.20179 
1 1 1    3    1 -138 o   21.919   5.7351   24.918   10.363   39.902   20.696   19.904   11.973   24.372   8.4911   19.097   6.4650 5.275471 10.67211 
1 1 1    3    1 -137 o   23.882   4.8893   27.678   9.1976   20.961   14.339   32.374   11.989   19.305   7.0302   24.904   5.9811 -5.598654 9.230280 
1 1 1    3    1 -136 o   23.610   4.8691   26.937   9.0596   25.229   14.326   28.076   11.695   21.028   7.0718   23.066   6.1199 -2.038334 9.352183 
1 1 1    3    1 -135 o   16.711   5.0029   13.658   7.3458   21.462   9.6114   2.6971   11.391   20.535   5.5921   13.022   5.6844 7.513497 7.973942 
1 1 1    3    1 -134 o   19.907   5.0053   19.362   8.1126   25.791   11.141   12.106   11.836   22.289   6.0000   16.191   6.2788 6.097788 8.684632 
1 1 1    3    1 -133 o   12.681   5.0155   5.7334   7.6786  -0.3288   10.525   12.632   11.228   11.917   5.3201   16.364   6.1715 -4.447021 8.148059 
1 1 1    3    1 -132 o   14.880   4.9272   10.352   6.9590   9.5535   10.507   10.976   9.2880   15.086   5.8971   15.452   5.6533 -0.3660755 8.169146 
1 1 1    3    1 -131 o   7.9210   3.7621  -6.7706   6.5810 -13.4968   10.054  -1.7280   8.7051   9.0481   4.3869   10.647   4.7890 -1.598952 6.494525 
1 1 1    3    1 -130 o   13.769   4.8362   8.3270   6.7221   12.651   10.554   5.3752   8.7196   16.460   6.0255   13.027   5.2785 3.433425 8.010578 
1 1 1    3    1 -129 o   40.059   2.3769   67.643   7.7266   63.673   12.101   70.375   10.039   37.754   3.9926   40.423   3.0697 -2.668873 5.036281 
1 1 1    3    1 -128 o   12.256   4.7341   5.3376   6.7096   9.8023   10.650   2.3994   8.6398   15.432   5.9636   11.968   5.0830 3.463578 7.835871 
1 1 1    3    1 -127 o   18.460   4.3317   15.678   6.4054   16.161   9.3574   15.252   8.7867   18.295   5.6807   17.849   5.4983 0.4456329 7.905796 
1 1 1    3    1 -126 f   12.431   4.5182   6.0746   5.9187  -1.4692   10.127   9.9883   7.2942   11.716   5.2250   14.993   5.0462 -3.277885 7.263954 
1 1 1    3    1 -125 o   20.884   3.4217   19.050   5.6233   23.578   8.4141   15.395   7.5596   22.690   4.7037   18.200   4.9608 4.490046 6.836250 
1 1 1    3    1 -124 o   36.379   2.0601   54.991   6.0840   54.538   9.0720   55.361   8.2018   35.781   3.1422   36.212   2.8003 -0.4301605 4.208975 
1 1 1    3    1 -123 f   23.928   3.1481   24.516   5.9917   24.449   9.7223   24.557   7.6082   22.986   5.2975   23.571   4.1091 -0.5843391 6.704360 
1 1 1    3    1 -122 o   80.600   1.4328  266.539   9.4138  275.016   15.295  261.368   11.944   81.414   2.3070   79.644   1.8398 1.769707 2.950777 
1 1 1    3    1 -121 o   37.874   2.0444   59.356   6.2881   53.664   9.4682   63.847   8.4109   35.575   3.3027   39.087   2.6556 -3.511215 4.237936 
1 1 1    3    1 -120 o   34.781   2.1688   50.124   6.1183   44.243   9.2795   54.646   8.1377   32.205   3.5961   36.136   2.7841 -3.930332 4.547880 
1 1 1    3    1 -119 o   27.939   2.4391   32.531   5.4993   33.905   7.9376   31.264   7.6261   28.200   3.5302   27.059   3.5424 1.140316 5.001070 
1 1 1    3    1 -118 o   47.537   1.6349   92.798   6.3259   93.731   9.0429   91.903   8.8524   47.590   2.3383   47.130   2.3113 0.4590378 3.287764 
1 1 1    3    1 -117 o   19.505   3.4287   16.351   5.2526   22.949   7.6134   10.359   7.2561   22.942   4.2267   15.598   5.0229 7.343950 6.564633 
1 1 1    3    1 -116 o   30.623   2.2849   38.860   5.6626   36.946   8.1085   40.682   7.9114   29.552   3.4296   31.109   3.1638 -1.556654 4.666015 
1 1 1    3    1 -115 f   18.763   3.8029   15.262   5.6171   7.6317   7.5490   24.726   8.4077   14.245   5.1127   23.800   4.4986 -9.555063 6.810044 
1 1 1    3    1 -114 o   80.205   1.3152  263.036   8.5984  257.948   12.094  268.237   12.227   79.294   1.8710   80.865   1.8550 -1.570511 2.634704 
1 1 1    3    1 -113 o   43.820   1.7845   78.819   6.3608   83.743   8.9741   73.849   9.0171   45.030   2.4541   42.236   2.6322 2.794411 3.598767 
1 1 1    3    1 -112 o   94.986   1.2007  368.583   9.2971  363.246   13.706  373.131   12.653   94.164   1.7857   95.479   1.6257 -1.314285 2.414858 
1 1 1    3    1 -111 o   64.984   1.3291  172.561   7.0405  173.647   10.348  171.625   9.6065   65.061   1.9535   64.708   1.8231 0.3531570 2.672027 
1 1 1    3    1 -110 o   26.284   2.4731   28.629   5.2363   35.450   7.6771   22.696   7.1604   29.105   3.2936   23.055   3.9523 6.050842 5.144791 
1 1 1    3    1 -109 o   21.435   3.1469   19.336   5.3349   19.061   7.6085   19.602   7.4825   20.976   4.5787   21.301   4.4528 -0.3257294 6.386860 
1 1 1    3    1 -108 o   31.308   2.2370   40.370   5.6715   42.514   8.0369   38.243   8.0046   31.980   3.1227   30.281   3.2961 1.699394 4.540421 
1 1 1    3    1 -107 o   47.013   1.6631   90.440   6.3633   84.608   8.9258   96.467   9.0743   45.369   2.4223   48.471   2.3032 -3.102383 3.342537 
1 1 1    3    1 -106 o   94.981   1.2514  368.194   9.6884  369.959   13.628  366.390   13.776   95.145   1.7572   94.681   1.7849 0.4640808 2.504742 
1 1 1    3    1 -105 o   49.498   1.5742  100.153   6.3434   99.552   9.1656  100.706   8.7883   49.268   2.2885   49.568   2.1804 -0.2996292 3.160893 
1 1 1    3    1 -104 o   47.944   1.6924   93.993   6.6039   93.638   9.9627   94.272   8.8200   47.752   2.5689   47.954   2.2627 -0.2019997 3.423331 
1 1 1    3    1 -103 o   68.793   1.3799  193.119   7.7379  194.793   11.238  191.611   10.671   69.015   1.9996   68.458   1.9141 0.5567169 2.768051 
1 1 1    3    1 -102 o   82.239   1.4546  275.996   9.7510  277.837   13.065  273.680   14.651   82.473   1.9434   81.799   2.1992 0.6737595 2.934855 
1 1 1    3    1 -101 o   83.388   1.4342  283.715   9.7486  291.421   13.056  274.005   14.656   84.479   1.8959   81.859   2.1984 2.619026 2.902975 
1 1 1    3    1 -100 o  114.545   1.3292  535.213   12.411  547.994   16.629  519.142   18.647  115.868   1.7607  112.749   2.0289 3.118713 2.686346 
1 1 1    3    1  -99 o   31.627   2.5769   41.156   6.5859   39.164   8.5996   43.982   10.242   30.722   3.4961   32.507   3.9460 -1.784798 5.271915 
1 1 1    3    1  -98 o  171.627   1.3324  1201.39   18.641  1189.75   26.020  1213.67   26.717  170.734   1.8696  172.438   1.9007 -1.703934 2.666138 
1 1 1    3    1  -97 o  238.137   1.6219  2313.56   31.485  2362.34   54.616  2289.29   38.531  240.406   2.7870  236.825   1.9959 3.580688 3.428012 
1 1 1    3    1  -96 o   64.226   1.4527  168.244   7.6054  168.867   11.587  167.773   10.081   64.276   2.2148   64.089   1.9319 0.1868591 2.938954 
1 1 1    3    1  -95 o  178.360   1.5115  1297.54   21.976  1275.82   43.990  1304.77   25.368  176.660   3.0548  178.834   1.7402 -2.174561 3.515653 
1 1 1    3    1  -94 o  210.389   1.5227  1805.31   26.114  1733.92   44.446  1842.95   32.271  206.042   2.6463  212.534   1.8627 -6.491882 3.236163 
1 1 1    3    1  -93 o   50.674   1.7335  104.867   7.1498  104.898   11.614  104.848   9.0726   50.598   2.8272   50.638   2.2032 -0.4035950E-01 3.584320 
1 1 1    3    1  -92 o   14.456   4.5999   8.3911   6.0991   15.462   9.8677   4.0197   7.7585   19.308   5.8026   12.924   5.0628 6.384502 7.700788 
1 1 1    3    1  -91 o  126.754   1.2455  655.079   12.869  688.289   20.905  634.818   16.329  129.891   1.9744  124.763   1.6056 5.127632 2.544879 
1 1 1    3    1  -90 o  298.350   1.7811  3630.48   43.315  3603.45   60.839  3658.27   61.683  297.133   2.5118  299.382   2.5276 -2.248932 3.563436 
1 1 1    3    1  -89 o   80.480   1.2521  264.071   8.2140  257.451   11.929  270.041   11.327   79.450   1.8419   81.373   1.7077 -1.923470 2.511707 
1 1 1    3    1  -88 o  242.010   1.5587  2388.20   30.749  2340.01   47.900  2421.97   40.104  239.475   2.4538  243.677   2.0190 -4.202286 3.177649 
1 1 1    3    1  -87 o  187.488   1.4548  1433.23   22.233  1409.24   32.972  1453.22   30.108  185.870   2.1762  188.763   1.9567 -2.893143 2.926504 
1 1 1    3    1  -86 o  144.480   1.2978  851.033   15.284  844.357   23.968  855.609   19.842  143.882   2.0436  144.854   1.6804 -0.9721680 2.645757 
1 1 1    3    1  -85 f  117.444   1.2430  562.313   11.899  541.906   18.510  576.688   15.535  115.271   1.9699  118.926   1.6025 -3.654686 2.539402 
1 1 1    3    1  -84 o  227.975   1.4917  2118.99   27.721  2133.05   44.016  2109.75   35.688  228.670   2.3614  227.451   1.9249 1.219696 3.046509 
1 1 1    3    1  -83 o  158.051   1.2562  1018.36   16.184  1004.89   22.535  1032.71   23.257  156.985   1.7610  159.142   1.7928 -2.156982 2.513001 
1 1 1    3    1  -82 o  232.556   1.5855  2205.03   30.055  2150.98   44.552  2250.17   40.715  229.637   2.3801  234.891   2.1265 -5.254059 3.191652 
1 1 1    3    1  -81 o  173.739   1.3511  1230.58   19.135  1226.72   28.342  1233.82   25.940  173.441   2.0047  173.950   1.8294 -0.5092010 2.713946 
1 1 1    3    1  -80 o  282.903   1.7880  3263.35   41.232  3274.27   61.731  3254.55   55.401  283.304   2.6731  282.474   2.4061 0.8294067 3.596482 
1 1 1    3    1  -79 o  147.011   1.2688  881.037   15.205  885.172   22.524  877.575   20.610  147.338   1.8754  146.710   1.7234 0.6286316 2.547018 
1 1 1    3    1  -78 o   84.508   1.2662  291.128   8.7224  286.874   15.455  293.116   10.566   83.840   2.2635   84.792   1.5287 -0.9522171 2.731350 
1 1 1    3    1  -77 o  251.768   1.5587  2584.22   31.988  2572.45   50.370  2592.18   41.411  251.141   2.4605  252.131   2.0149 -0.9905090 3.180212 
1 1 1    3    1  -76 f  432.227   2.5072  7619.69   88.335  7531.20  131.295  7692.87  119.401  429.522   3.7499  434.173   3.3737 -4.651123 5.044213 
1 1 1    3    1  -75 o  169.380   1.3164  1169.54   18.176  1158.26   27.150  1178.69   24.467  168.543   1.9762  170.029   1.7653 -1.486908 2.649832 
1 1 1    3    1  -74 o  193.869   1.3980  1532.18   22.092  1517.47   32.983  1544.15   29.752  192.912   2.0974  194.609   1.8755 -1.697723 2.813687 
1 1 1    3    1  -73 o   66.319   1.2095  179.284   6.5387  197.533   9.2312  160.909   9.2632   69.608   1.6269   62.796   1.8115 6.811665 2.434842 
1 1 1    3    1  -72 o  122.151   1.1304  608.206   11.255  626.183   16.063  590.869   15.775  123.936   1.5900  120.390   1.6074 3.545715 2.260994 
1 1 1    3    1  -71 o  152.596   1.1395  949.168   14.174  956.069   21.029  943.422   19.187  153.139   1.6846  152.126   1.5473 1.013199 2.287317 
1 1 1    3    1  -70 o  275.604   1.5740  3096.47   35.361  3135.51   52.873  3064.88   47.564  277.301   2.3391  274.171   2.1282 3.130005 3.162387 
1 1 1    3    1  -69 o   65.614   1.1579  175.488   6.1930  177.389   9.0017  173.780   8.5335   65.944   1.6760   65.291   1.6034 0.6524811 2.319431 
1 1 1    3    1  -68 o  485.978   2.5126  9630.20   99.537  9570.99  146.786  9680.61  135.432  484.352   3.7178  487.156   3.4105 -2.803772 5.045143 
1 1 1    3    1  -67 o  160.401   1.2186  1048.72   15.934  1056.90   22.460  1040.44   22.607  161.017   1.7112  159.758   1.7360 1.258774 2.437625 
1 1 1    3    1  -66 o  216.617   1.4076  1912.68   24.855  1908.30   34.970  1917.14   35.334  216.357   1.9828  216.857   1.9988 -0.4999847 2.815495 
1 1 1    3    1  -65 o  532.834   3.0188 11577.07  131.117 11543.85  175.407 11619.13  197.389  531.967   4.0451  533.639   4.5377 -1.672119 6.078960 
1 1 1    3    1  -64 f  192.057   1.3854  1503.50   21.689  1490.43   28.860  1520.47   32.876  191.213   1.8516  193.126   2.0883 -1.912674 2.790981 
1 1 1    3    1  -63 o  136.955   1.2098  764.521   13.506  766.011   18.002  762.604   20.426  137.085   1.6110  136.778   1.8321 0.3074646 2.439622 
1 1 1    3    1  -62 o  166.113   1.2209  1124.71   16.532  1130.78   23.392  1118.65   23.368  166.556   1.7229  165.660   1.7305 0.8958130 2.441973 
1 1 1    3    1  -61 o  256.455   1.5595  2680.81   32.601  2639.43   45.596  2724.10   46.630  254.457   2.1983  258.506   2.2129 -4.048813 3.119179 
1 1 1    3    1  -60 o  528.031   2.8359 11366.77  122.064 11253.29  171.275 11483.91  174.006  525.322   3.9997  530.676   4.0225 -5.354126 5.672629 
1 1 1    3    1  -59 o  166.133   1.2153  1124.95   16.458  1110.54   23.158  1139.66   23.395  165.061   1.7212  167.212   1.7164 -2.150055 2.430725 
1 1 1    3    1  -58 o  446.918   2.4368  8141.95   88.775  8171.68  126.005  8112.65  125.094  447.698   3.4528  446.078   3.4402 1.619385 4.874100 
1 1 1    3    1  -57 o   73.163   1.1963  218.175   7.1344  234.398   10.805  205.634   9.4997   75.833   1.7479   71.028   1.6408 4.804794 2.397357 
1 1 1    3    1  -56 o  169.730   1.1731  1174.18   16.231  1194.10   24.216  1157.94   21.870  171.161   1.7357  168.549   1.5918 2.611145 2.355075 
1 1 1    3    1  -55 o  600.732   3.1949 14711.41  156.448 14617.42  245.890 14775.34  202.788  598.720   5.0383  601.995   4.1325 -3.274536 6.516270 
1 1 1    3    1  -54 o  548.814   2.9372 12277.92  131.401 12190.07  206.361 12337.83  170.414  546.782   4.6300  550.122   3.8002 -3.339294 5.989841 
1 1 1    3    1  -53 o  374.366   2.0918  5712.56   63.835  5710.03  100.690  5714.27   82.543  374.262   3.3005  374.412   2.7045 -0.1504517 4.267037 
1 1 1    3    1  -52 o  958.685   5.2762 37476.17  412.319 37253.00  615.138 37658.24  555.609  955.557   7.8973  960.834   7.0939 -5.277588 10.61560 
1 1 1    3    1  -51 o  119.410   1.4687  581.169   14.296  618.061   22.645  556.721   18.434  123.139   2.2560  116.870   1.9350 6.268875 2.972121 
1 1 1    3    1  -50 o  143.750   1.3397  842.232   15.699  839.503   19.439  847.348   26.619  143.516   1.6617  144.182   2.2649 -0.6664734 2.809041 
1 1 1    3    1  -49 o  308.673   1.7899  3883.50   45.036  3936.89   64.281  3832.03   63.117  310.780   2.5374  306.614   2.5254 4.166840 3.579919 
1 1 1    3    1  -48 o   90.290   1.1574  332.271   8.5184  350.273   12.586  317.054   11.572   92.703   1.6655   88.197   1.6095 4.505165 2.316170 
1 1 1    3    1  -47 o  805.607   4.4541 26458.66  292.498 26474.54  438.814 26445.97  392.380  805.716   6.6813  805.329   5.9772 0.3869629 8.964763 
1 1 1    3    1  -46 o  388.747   2.1544  6159.81   68.270  6211.52   97.127  6109.31   95.980  390.364   3.0523  387.139   3.0414 3.224945 4.308950 
1 1 1    3    1  -45 o  490.152   2.7866  9792.85  111.339  9707.31  148.320  9903.29  168.524  487.987   3.7287  492.877   4.1946 -4.889740 5.612247 
1 1 1    3    1  -44 o  283.217   1.7498  3269.35   40.398  3242.89   53.868  3303.37   61.070  282.065   2.3428  284.680   2.6317 -2.615479 3.523443 
1 1 1    3    1  -43 f  469.323   2.5410  8978.08   97.209  8916.41  136.679  9041.19  138.283  467.690   3.5852  470.951   3.6021 -3.260803 5.082166 
1 1 1    3    1  -42 o  385.642   2.5537  6061.90   80.276  6147.28  107.486  5954.21  120.718  388.337   3.3955  382.182   3.8749 6.154755 5.152160 
1 1 1    3    1  -41 o  697.378   4.3932 19826.36  249.738 19975.45  332.623 19633.73  378.095  699.934   5.8299  693.877   6.6847 6.057129 8.869765 
1 1 1    3    1  -40 o  595.570   3.5395 14459.00  171.834 14460.09  280.695 14458.34  217.313  595.517   5.7824  595.529   4.4766 -0.1245117E-01 7.312684 
1 1 1    3    1  -39 o  832.600   5.2108 28263.60  353.651 28310.73  662.959 28244.85  418.108  832.938   9.7642  832.267   6.1630 0.6701050 11.54653 
1 1 1    3    1  -38 o  530.178   3.1732 11457.96  137.136 11298.46  221.311 11557.39  174.724  526.418   5.1575  532.452   4.0256 -6.034363 6.542573 
1 1 1    3    1  -37 o  494.608   2.8092  9971.86  113.261  9988.35  170.195  9958.76  151.740  494.982   4.2181  494.261   3.7662 0.7211914 5.654842 
1 1 1    3    1  -36 o  164.426   1.8562  1101.96   24.878   0.0000   0.0000  1101.96   24.878  ?   ?   164.426   1.8562 0.000000 1.856163 
1 1 1    3    1  -35 o  801.123   4.7046 26167.47  307.225 26246.23  504.170 26120.96  387.476  802.083   7.7112  800.325   5.9394 1.758118 9.733395 
1 1 1    3    1  -34 o  390.198   2.2717  6206.06   72.257  6309.22  109.932  6127.60   95.877  393.404   3.4281  387.710   3.0337 5.694794 4.577657 
1 1 1    3    1  -33 o  290.038   1.8830  3428.82   44.518  3496.18   73.743  3390.19   55.842  292.856   3.0891  288.393   2.3754 4.462341 3.896819 
1 1 1    3    1  -32 o  443.710   2.8803  8025.67  104.177  8054.47  159.646  8004.31  137.482  444.453   4.4065  443.090   3.8064 1.363129 5.822934 
1 1 1    3    1  -31 o  353.582   2.5574  5096.27   73.709  5117.10  104.572  5075.70  103.910  354.278   3.6211  352.842   3.6128 1.435577 5.115103 
1 1 1    3    1  -30 o  584.663   4.0128 13937.56  191.242 13758.44  231.589 14321.58  339.092  580.839   4.8913  592.425   7.0218 -11.58606 8.557476 
1 1 1    3    1  -29 o  441.872   2.8716  7959.61  103.431  8070.01  138.359  7819.76  155.722  444.890   3.8152  437.913   4.3624 6.977722 5.795400 
1 1 1    3    1  -28 o  326.679   2.0705  4350.09   55.136  4415.21   78.840  4287.75   77.135  329.096   2.9389  324.312   2.9178 4.784393 4.141343 
1 1 1    3    1  -27 o  263.318   1.7475  2826.20   37.510  2812.79   52.835  2839.83   53.260  262.682   2.4675  263.942   2.4755 -1.259888 3.495223 
1 1 1    3    1  -26 o  126.533   1.2490  652.581   12.882  654.557   19.577  651.071   17.108  126.721   1.8952  126.385   1.6606 0.3364029 2.519801 
1 1 1    3    1  -25 o  316.873   2.0174  4092.83   52.110  4152.94   74.485  4035.20   72.928  319.174   2.8629  314.618   2.8436 4.556641 4.035162 
1 1 1    3    1  -24 o  255.124   1.6058  2652.99   33.394  2665.03   44.870  2638.04   49.998  255.695   2.1528  254.393   2.4111 1.302200 3.232297 
1 1 1    3    1  -23 o  262.022   1.7363  2798.42   37.085  2811.10   46.945  2777.37   60.484  262.608   2.1930  261.018   2.8427 1.590790 3.590336 
1 1 1    3    1  -22 o  488.946   3.1454  9746.04  125.363  9655.84  164.483  9871.08  193.645  486.636   4.1465  491.995   4.8285 -5.358704 6.364554 
1 1 1    3    1  -21 o  110.235   1.0329  495.283   9.2813  490.071   12.370  501.995   14.039  109.652   1.3840  110.978   1.5519 -1.325302 2.079352 
1 1 1    3    1  -20 o  303.687   2.0788  3759.22   51.461  3719.37   78.148  3789.73   68.379  302.056   3.1739  304.907   2.7512 -2.851471 4.200315 
1 1 1    3    1  -19 o  451.321   2.7318  8303.09  100.501  8290.26  141.930  8316.00  142.331  450.940   3.8612  451.639   3.8661 -0.6991272 5.464001 
1 1 1    3    1  -18 o  799.594   5.0056 26070.25  326.260 25919.78  429.492 26275.55  501.675  797.148   6.6097  802.488   7.6692 -5.340820 10.12443 
1 1 1    3    1  -17 o  533.662   3.4069 11609.85  148.203 11645.91  196.553 11562.33  225.623  534.449   4.5117  532.497   5.1979 1.952209 6.882847 
1 1 1    3    1  -16 o  852.056   5.3233 29603.82  369.729 29578.72  488.767 29637.39  565.292  851.544   7.0414  852.269   8.1369 -0.7257690 10.76061 
1 1 1    3    1  -15 o  415.509   2.5338  7037.40   85.821  6985.66  120.632  7090.43  122.119  413.958   3.5749  417.050   3.5922 -3.092285 5.067943 
1 1 1    3    1  -14 f  622.604   3.4698 15801.95  176.096 16080.44  268.144 15590.76  233.509  627.991   5.2382  618.384   4.6324 9.607056 6.992682 
1 1 1    3    1  -13 o  590.227   3.2988 14200.90  158.712 14194.94  237.955 14205.67  213.014  590.043   4.9474  590.288   4.4270 -0.2448120 6.638891 
1 1 1    3    1  -12 o  739.567   4.0926 22298.07  246.724 22579.79  374.087 22081.18  328.233  744.107   6.1674  735.890   5.4718 8.217834 8.244855 
1 1 1    3    1  -11 o  435.089   2.6390  7716.22   93.596  7544.20  129.955  7901.62  134.914  430.191   3.7059  440.262   3.7593 -10.07117 5.278864 
1 1 1    3    1  -10 o  237.807   1.6000  2304.99   31.016  2286.45   39.090  2336.50   50.957  236.846   2.0247  239.419   2.6110 -2.573944 3.304098 
1 1 1    3    1   -9 o  218.214   1.7391  1940.84   30.935  1939.94   37.886  1942.65   53.586  218.161   2.1304  218.306   3.0113 -0.1450043 3.688695 
1 1 1    3    1   -8 o  282.593   1.9499  3255.00   44.916  3349.83   60.720  3140.39   66.749  286.674   2.5984  277.564   2.9502 9.109894 3.931293 
1 1 1    3    1   -7 o  1710.18   10.579 119381.70  1474.76 119236.30  1948.18 119576.80  2256.99  1708.18   13.991  1709.86   16.193 -1.679077 21.40044 
1 1 1    3    1   -6 o  249.981   1.9144  2547.07   39.010  2554.44   55.364  2539.81   54.975  250.336   2.7131  249.619   2.7018 0.7175598 3.828942 
1 1 1    3    1   -5 o  633.291   4.3150 16350.08  222.749 16162.03  311.931 16545.75  318.193  629.562   6.0783  636.989   6.1280 -7.427063 8.631274 
1 1 1    3    1   -4 o  348.940   2.5045  4962.98   71.237  4916.15  100.020  5011.19  101.485  347.275   3.5333  350.615   3.5509 -3.340302 5.009252 
1 1 1    3    1   -3 o  487.480   3.3775  9686.94  134.212  9434.44  185.541  9964.04  194.376  481.050   4.7317  494.365   4.8235 -13.31464 6.756799 
1 1 1    3    1   -2 o  1164.66   7.8101 55328.99  741.466 54692.61  1038.11 55991.73  1059.39  1157.48   11.003  1171.13   11.097 -13.64990 15.62713 
1 1 1    3    1   -1 o  723.976   4.9065 21369.44  289.558 21189.89  406.571 21554.25  412.486  720.814   6.9195  726.982   6.9606 -6.168030 9.814815 
1 1 1    3    1    0 f  718.690   5.3400 21059.78  312.836 21711.59  507.792 20661.05  397.155  729.512   8.5392  711.767   6.8452 17.74493 10.94417 
1 1 1    3    1    1 o  891.012   6.5857 32375.98  478.324 34014.07  644.415 30366.17  713.797  913.083   8.6580  862.571   10.152 50.51172 13.34245 
1 1 1    3    1    2 o  518.217   3.5729 10947.19  150.926 10969.73  213.879 10924.82  213.008  518.706   5.0584  517.643   5.0481 1.062622 7.146370 
1 1 1    3    1    3 o  914.737   6.1653 34120.65  459.711 35728.49  676.659 32742.37  626.495  935.788   8.8707  895.859   8.5791 39.92865 12.34057 
1 1 1    3    1    4 o  957.773   6.4420 37408.51  502.946 37048.75  705.281 37780.76  717.421  952.898   9.0799  962.258   9.1463 -9.359985 12.88796 
1 1 1    3    1    5 o  1322.75   10.853 71423.23  1170.17 72492.49  1676.14 70406.56  1634.39  1331.55   15.442  1312.30   15.279 19.25342 21.72353 
1 1 1    3    1    6 o  814.543   6.7380 27057.98  447.382 27756.63  646.896 26417.48  619.389  824.734   9.6224  804.611   9.4437 20.12274 13.48237 
1 1 1    3    1    7 o  1029.03   8.4668 43199.54  710.205 43040.66  1000.76 43360.73  1008.04  1026.65   11.958  1030.45   12.001 -3.803101 16.94185 
1 1 1    3    1    8 o  627.615   5.2429 16060.33  268.227 15761.72  373.346 16378.88  385.613  621.640   7.3678  633.687   7.4652 -12.04736 10.48872 
1 1 1    3    1    9 o  680.585   8.0099 18895.38  444.373 18895.38  444.373   0.0000   0.0000  680.585   8.0099  ?   ?  0.000000 8.009932 
1 1 1    3    1   10 o   86.373   1.1833  304.066   8.3311  321.015   11.988  288.237   11.586   88.747   1.6572   84.094   1.6901 4.652962 2.367040 
1 1 1    3    1   11 o  495.360   3.7595 10003.13  151.805  9780.70  235.784 10160.60  198.395  489.749   5.9062  499.209   4.8754 -9.460724 7.658476 
1 1 1    3    1   12 o  242.593   2.0604  2398.77   40.745  2434.16   65.157  2376.04   52.212  244.364   3.2711  241.436   2.6530 2.928162 4.211667 
1 1 1    3    1   13 o  294.382   2.3905  3532.36   57.363  3511.26   90.394  3546.58   74.222  293.482   3.7785  294.965   3.0869 -1.482880 4.879167 
1 1 1    3    1   14 f  711.476   5.2907 20640.28  306.836 21421.42  500.996 20171.40  388.151  724.568   8.4824  703.252   6.7710 21.31641 10.85348 
1 1 1    3    1   15 o  650.565   4.8561 17256.44  257.522 17536.20  412.959 17078.42  329.421  655.627   7.7271  647.120   6.2450 8.506714 9.935144 
1 1 1    3    1   16 o  565.370   4.2517 13031.77  195.946 13047.39  310.154 13021.39  252.783  565.581   6.7274  565.088   5.4878 0.4924316 8.681778 
1 1 1    3    1   17 o  551.179   6.5753 12391.35  295.423   0.0000   0.0000 12391.35  295.423  ?   ?   551.179   6.5753 0.000000 6.575300 
1 1 1    3    1   18 o  186.924   1.9559  1424.18   29.803  1454.69   42.683  1395.15   41.631  188.909   2.7719  185.002   2.7606 3.906387 3.912044 
1 1 1    3    1   19 o  349.631   3.0920  4983.18   88.122  4949.18  123.995  5017.88  125.260  348.404   4.3660  350.814   4.3803 -2.409393 6.184559 
1 1 1    3    1   20 o  201.464   2.0531  1654.40   33.717  1620.21   47.107  1690.31   48.281  199.363   2.8987  203.630   2.9087 -4.266830 4.106455 
1 1 1    3    1   21 o  223.991   2.1995  2045.10   40.160  2106.63   57.874  1987.95   55.774  227.324   3.1232  220.828   3.0984 6.496017 4.399385 
1 1 1    3    1   22 o  380.844   2.9809  5912.76   92.540  5920.59  119.660  5901.12  145.969  381.069   3.8522  380.410   4.7073 0.6595764 6.082597 
1 1 1    3    1   23 o  136.783   1.5236  762.594   16.987  738.066   21.650  801.882   27.401  134.562   1.9738  140.256   2.3966 -5.693512 3.104803 
1 1 1    3    1   24 o  429.466   3.3143  7519.46  116.026  7353.69  147.091  7792.48  188.771  424.667   4.2491  437.097   5.2981 -12.43011 6.791550 
1 1 1    3    1   25 o  430.815   3.3228  7566.83  116.690  7530.48  150.072  7622.42  185.573  429.737   4.2841  432.299   5.2662 -2.561920 6.788682 
1 1 1    3    1   26 o  600.954   4.1169 14726.16  201.673 14563.48  244.563 15071.87  356.515  597.558   5.0208  607.679   7.1973 -10.12036 8.775492 
1 1 1    3    1   27 o  187.556   1.6119  1433.83   24.643  1434.40   30.131  1432.69   42.826  187.590   1.9705  187.468   2.8025 0.1214294 3.425894 
1 1 1    3    1   28 o  179.656   1.4522  1315.57   21.268  1357.15   28.732  1265.17   31.631  182.469   1.9317  176.174   2.2026 6.294785 2.929627 
1 1 1    3    1   29 o  709.159   4.8217 20509.40  278.725 20361.35  339.403 20816.07  488.469  706.490   5.8935  714.008   8.3926 -7.518066 10.25521 
1 1 1    3    1   30 o  428.897   3.6971  7499.91  129.257  7329.94  179.865  7681.44  185.878  423.940   5.2048  433.983   5.2544 -10.04300 7.395825 
1 1 1    3    1   31 o  746.589   5.5482 22733.87  337.653 22355.00  526.411 22998.71  440.119  739.959   8.7273  750.746   7.1919 -10.78662 11.30880 
1 1 1    3    1   32 o  433.907   3.0505  7675.11  107.895  7487.09  149.734  7878.17  155.610  428.518   4.2866  439.565   4.3429 -11.04684 6.102114 
1 1 1    3    1   33 o  179.791   1.5692  1317.54   22.998  1322.66   39.924  1315.00   28.135  180.131   2.7190  179.616   1.9216 0.5155640 3.329494 
1 1 1    3    1   34 o  286.193   1.8626  3338.49   43.452  3353.65   61.769  3323.65   61.136  286.833   2.6418  285.547   2.6265 1.285767 3.725315 
1 1 1    3    1   35 o  704.831   4.1503 20253.44  238.451 20231.59  337.051 20275.33  337.392  704.352   5.8704  705.113   5.8700 -0.7611084 8.301756 
1 1 1    3    1   36 o  1132.59   6.5841 52315.75  607.857 52474.97  862.126 52158.35  857.174  1133.94   9.3271  1130.51   9.3016 3.422119 13.17249 
1 1 1    3    1   37 o  1196.29   6.9506 58367.84  677.785 57225.64  941.650 59595.78  976.356  1184.14   9.7555  1208.38   9.9121 -24.24695 13.90759 
1 1 1    3    1   38 o  223.972   1.6844  2044.60   30.752  2074.78   47.651  2023.06   40.258  225.613   2.5910  222.786   2.2168 2.827057 3.409947 
1 1 1    3    1   39 o  545.299   3.4865 12121.10  154.973 12113.00  236.644 12127.18  205.063  545.062   5.3262  545.404   4.6125 -0.3430176 7.045756 
1 1 1    3    1   40 o  809.951   4.7465 26745.01  313.378 25950.60  610.638 27029.04  365.128  797.513   9.3931  814.202   5.5014 -16.68958 10.88561 
1 1 1    3    1   41 o  748.243   4.1494 22823.43  253.084 21640.18  418.660 23504.84  317.706  728.447   7.0506  759.289   5.1331 -30.84167 8.721253 
1 1 1    3    1   42 o  1009.87   6.2894 41585.75  517.737 41002.30  956.445 41827.57  615.752  1002.18   11.708  1012.71   7.4591 -10.52753 13.88210 
1 1 1    3    1   43 f  274.393   1.8167  3068.81   40.635  3118.61   82.599  3052.91   46.673  276.594   3.6635  273.679   2.0921 2.914520 4.218794 
1 1 1    3    1   44 o  420.291   2.4263  7200.07   83.124  7209.44  144.081  7195.40  101.768  420.534   4.2031  420.147   2.9715 0.3870544 5.147405 
1 1 1    3    1   45 o  606.309   3.2196 14984.80  159.122 15121.69  253.417 14895.70  204.450  609.012   5.1047  604.478   4.1493 4.534180 6.578358 
1 1 1    3    1   46 o  832.533   4.5964 28257.11  311.932 28640.42  473.444 27963.09  414.654  838.015   6.9308  828.101   6.1428 9.913269 9.261185 
1 1 1    3    1   47 o  358.609   1.9194  5241.68   56.107  5259.13   83.341  5227.21   75.878  359.195   2.8464  358.107   2.5994 1.088593 3.854698 
1 1 1    3    1   48 o  429.767   2.3534  7528.44   82.446  7514.15  129.937  7538.06  106.669  429.335   3.7128  430.030   3.0430 -0.6957703 4.800476 
1 1 1    3    1   49 o  294.115   1.6456  3525.79   39.452  3507.23   58.211  3541.55   53.653  293.333   2.4345  294.766   2.2330 -1.433411 3.303455 
1 1 1    3    1   50 o  423.168   2.2194  7299.02   76.558  7263.80  113.038  7328.86  104.057  422.128   3.2851  424.020   3.0106 -1.891602 4.455914 
1 1 1    3    1   51 o  785.802   4.1281 25173.72  264.423 25595.30  423.951 24905.30  338.286  792.194   6.5652  781.534   5.3101 10.66040 8.443861 
1 1 1    3    1   52 o  178.180   1.2749  1294.00   18.517  1327.99   29.258  1271.29   23.915  180.502   1.9885  176.608   1.6612 3.893646 2.591118 
1 1 1    3    1   53 o  493.807   2.8112  9939.85  113.158 10041.34  170.997  9860.77  150.935  496.279   4.2269  491.812   3.7649 4.466919 5.660516 
1 1 1    3    1   54 o  469.903   2.6873  9000.79  102.935  8863.31  152.357  9116.25  139.620  466.263   4.0086  472.882   3.6221 -6.619263 5.402652 
1 1 1    3    1   55 o  256.327   1.5563  2678.04   32.517  2652.60   45.645  2704.25   46.335  255.101   2.1951  257.573   2.2068 -2.471573 3.112637 
1 1 1    3    1   56 o  540.198   2.8943 11895.69  127.450 11982.58  181.385 11810.95  179.119  542.118   4.1046  538.223   4.0827 3.895203 5.789287 
1 1 1    3    1   57 o  268.240   1.7904  2932.83   39.149  2959.10   49.964  2891.05   63.005  269.433   2.2750  266.307   2.9024 3.126068 3.687734 
1 1 1    3    1   58 o  122.603   1.1810  612.669   11.803  599.578   15.473  630.887   18.254  121.285   1.5651  124.410   1.8000 -3.125061 2.385252 
1 1 1    3    1   59 o  166.398   1.2910  1128.56   17.510  1138.15   23.357  1116.24   26.459  167.101   1.7147  165.482   1.9615 1.618103 2.605362 
1 1 1    3    1   60 o  419.481   2.4339  7173.20   83.226  7152.33  111.253  7199.72  125.414  418.839   3.2586  420.205   3.6614 -1.366547 4.901469 
1 1 1    3    1   61 o  463.042   2.6567  8740.88  100.275  8805.32  135.210  8662.12  149.480  464.699   3.5695  460.880   3.9789 3.819183 5.345322 
1 1 1    3    1   62 o  275.358   1.6457  3090.62   36.938  3092.15   52.069  3089.08   52.409  275.411   2.3193  275.274   2.3356 0.1368408 3.291574 
1 1 1    3    1   63 o  235.996   1.4812  2270.15   28.494  2244.10   39.827  2297.47   40.782  234.626   2.0824  237.400   2.1074 -2.773224 2.962718 
1 1 1    3    1   64 f  452.131   2.3523  8333.91   86.694  8234.40  127.253  8420.10  118.429  449.353   3.4741  454.412   3.1972 -5.058868 4.721422 
1 1 1    3    1   65 o  213.441   1.3252  1856.96   23.056  1854.53   34.080  1859.01   31.308  213.290   1.9602  213.551   1.7985 -0.2612152 2.660285 
1 1 1    3    1   66 o  109.814   1.0623  491.535   9.5091  502.727   14.096  482.187   12.882  111.053   1.5571  108.762   1.4530 2.291389 2.129749 
1 1 1    3    1   67 o  245.040   1.4466  2447.59   28.894  2449.90   42.788  2445.65   39.176  245.136   2.1413  244.929   1.9622 0.2068024 2.904362 
1 1 1    3    1   68 o  149.470   1.2423  910.672   15.136  902.751   20.164  920.897   22.909  148.812   1.6623  150.296   1.8699 -1.484238 2.501979 
1 1 1    3    1   69 o  187.792   1.3698  1437.55   20.969  1443.96   28.145  1429.55   31.435  188.199   1.8346  187.251   2.0595 0.9477844 2.758131 
1 1 1    3    1   70 o   77.847   1.2145  247.026   7.7068  251.747   10.257  240.905   11.679   78.584   1.6012   76.870   1.8639 1.713737 2.457210 
1 1 1    3    1   71 o   56.109   1.3156  128.332   6.0170  134.826   7.8025  118.802   9.4513   57.484   1.6669   53.935   2.1540 3.548801 2.723690 
1 1 1    3    1   72 o  254.654   1.5673  2643.69   32.534  2675.40   42.271  2597.60   50.956  256.157   2.0244  252.381   2.4768 3.776337 3.198926 
1 1 1    3    1   73 o  208.668   1.3195  1774.97   22.444  1783.62   30.485  1764.75   33.164  209.160   1.7880  208.044   1.9556 1.115860 2.649790 
1 1 1    3    1   74 o  151.755   1.1457  938.747   14.172  926.796   19.085  953.439   21.161  150.777   1.5528  152.925   1.6976 -2.148163 2.300640 
1 1 1    3    1   75 o  216.077   1.4155  1903.35   24.931  1897.01   35.232  1909.71   35.283  215.694   2.0039  216.415   2.0001 -0.7209930 2.831214 
1 1 1    3    1   76 f  327.365   1.8016  4369.48   48.075  4415.11   71.860  4332.52   64.681  328.997   2.6795  325.928   2.4345 3.068665 3.620351 
1 1 1    3    1   77 o  100.517   1.1022  411.856   9.0310  414.546   13.482  409.666   12.164  100.836   1.6402  100.243   1.4886 0.5925598 2.214940 
1 1 1    3    1   78 o   79.085   1.1476  254.955   7.3980  255.186   11.050  254.767   9.9597   79.113   1.7134   79.051   1.5456 0.6238556E-01 2.307534 
1 1 1    3    1   79 o   88.164   1.0721  316.851   7.7050  306.788   10.913  326.854   10.880   86.746   1.5433   89.539   1.4907 -2.792778 2.145673 
1 1 1    3    1   80 o  214.988   1.2974  1884.21   22.737  1899.34   32.368  1869.48   31.946  215.825   1.8398  214.123   1.8303 1.702682 2.595171 
1 1 1    3    1   81 o  175.621   1.1796  1257.31   16.886  1235.48   23.748  1279.62   24.017  174.074   1.6736  177.156   1.6631 -3.082748 2.359428 
1 1 1    3    1   82 o  121.543   1.0822  602.199   10.722  595.122   15.274  609.076   15.056  120.816   1.5509  122.226   1.5111 -1.409325 2.165361 
1 1 1    3    1   83 o   97.857   1.1324  390.370   9.0327  378.601   13.240  400.618   12.355   96.360   1.6855   99.126   1.5290 -2.765999 2.275716 
1 1 1    3    1   84 o  224.964   1.4084  2063.32   25.828  2071.77   38.266  2056.24   35.004  225.383   2.0828  224.549   1.9123 0.8347168 2.827576 
1 1 1    3    1   85 f   74.594   1.4958  226.867   9.0951  237.242   13.772  218.844   12.112   76.231   2.2187   73.223   2.0312 3.007988 3.008048 
1 1 1    3    1   86 o   82.350   1.5432  276.512   10.359  358.453   20.024  246.565   12.105   93.689   2.6246   77.755   1.9099 15.93410 3.245923 
1 1 1    3    1   87 o  288.258   1.9694  3388.93   46.275  3407.51   65.580  3370.51   65.307  288.948   2.7843  287.375   2.7879 1.573639 3.940108 
1 1 1    3    1   88 o   22.621   3.5978   21.421   6.4122   28.863   9.6913   15.626   8.5516   26.161   4.7181   19.234   5.2898 6.926672 7.088224 
1 1 1    3    1   89 o   61.868   1.4745  156.075   7.4360  162.480   11.596  151.602   9.6907   63.066   2.2594   60.934   1.9535 2.131969 2.986825 
1 1 1    3    1   90 o  227.441   1.4316  2109.31   26.541  2101.20   39.463  2116.00   35.863  226.940   2.1333  227.759   1.9317 -0.8185883 2.877907 
1 1 1    3    1   91 o  137.309   1.1470  768.670   12.839  747.268   18.143  790.137   18.170  135.361   1.6443  139.192   1.6014 -3.830917 2.295260 
1 1 1    3    1   92 o  144.400   1.3051  850.223   15.362  864.181   26.020  842.755   19.033  145.523   2.1935  143.748   1.6243 1.775330 2.729445 
1 1 1    3    1   93 o  221.284   1.5452  1997.06   27.871  1982.59   47.293  2004.77   34.499  220.343   2.6331  221.672   1.9092 -1.329330 3.252417 
1 1 1    3    1   94 o  202.236   1.4772  1668.04   24.353  1700.92   41.786  1651.13   29.968  204.093   2.5117  201.173   1.8275 2.919891 3.106161 
1 1 1    3    1   95 o   44.775   1.9666   81.971   7.1601   79.632   12.744   83.050   8.6555   43.966   3.5870   45.038   2.3659 -1.071655 4.297000 
1 1 1    3    1   96 o   40.883   1.9947   68.379   6.6274   69.568   9.8614   67.399   8.9498   41.147   2.9599   40.523   2.7253 0.6242180 4.023427 
1 1 1    3    1   97 o   73.267   1.4688  218.965   8.7723  225.917   12.671  212.566   12.157   74.362   2.0924   72.131   2.0697 2.230507 2.943131 
1 1 1    3    1   98 o   20.833   3.7057   18.313   6.0625   11.924   9.0034   23.613   8.2000   17.266   5.5980   23.602   4.4246 -6.336592 7.135509 
1 1 1    3    1   99 o   40.733   2.0483   67.917   6.7792   61.567   9.9822   73.352   9.2358   38.650   3.1970   42.271   2.6944 -3.621380 4.180952 
1 1 1    3    1  100 o   59.780   1.5805  145.927   7.6948  158.053   10.605  132.447   11.182   62.173   2.0956   56.876   2.4173 5.297119 3.199218 
1 1 1    3    1  101 o   11.945   4.5140   4.2515   6.0134  -4.4034   8.5781   12.615   8.4323   10.498   4.7352   17.466   5.3874 -6.967620 7.172571 
1 1 1    3    1  102 o  254.247   1.5534  2638.34   32.194  2639.12   47.486  2637.68   43.796  254.074   2.2928  254.063   2.1147 0.1113892E-01 3.119171 
1 1 1    3    1  103 o   72.757   1.4183  216.029   8.4118  217.488   11.761  214.502   12.036   72.930   1.9802   72.420   2.0409 0.5100403 2.843631 
1 1 1    3    1  104 o  100.768   1.2085  414.281   9.9268  412.752   14.439  415.651   13.670  100.523   1.7621  100.888   1.6622 -0.3645706 2.422404 
1 1 1    3    1  105 o  120.155   1.2348  589.135   12.094  594.166   18.591  585.444   15.924  120.570   1.8916  119.725   1.6316 0.8450394 2.498047 
1 1 1    3    1  106 o   35.986   1.9679   53.117   5.7505   40.097   8.1295   66.155   8.1353   31.055   3.2600   40.101   2.5012 -9.046448 4.108938 
1 1 1    3    1  107 o   49.950   1.5438  102.023   6.2784   99.869   9.0371  104.033   8.7290   49.328   2.2535   50.366   2.1309 -1.038155 3.101452 
1 1 1    3    1  108 o   46.711   1.6084   89.283   6.1152   82.609   8.8101   95.488   8.4948   44.814   2.4207   48.232   2.1662 -3.418148 3.248439 
1 1 1    3    1  109 o   51.415   1.5845  108.168   6.6327  110.872   9.0948  105.095   9.6938   51.968   2.1516   50.557   2.3587 1.411327 3.192634 
1 1 1    3    1  110 o   40.115   1.8684   66.034   6.0929   70.703   8.4014   60.854   8.8493   41.404   2.5009   38.331   2.8527 3.073555 3.793721 
1 1 1    3    1  111 o   83.870   1.3593  287.475   9.2933  290.617   12.066  282.893   14.571   84.250   1.7569   83.001   2.1555 1.249451 2.780802 
1 1 1    3    1  112 o   86.143   1.3514  303.333   9.4897  303.190   12.382  303.536   14.773   86.034   1.7656   85.992   2.1076 0.4196167E-01 2.749388 
1 1 1    3    1  113 o   69.987   1.5912  200.510   9.0778  199.017   10.642  204.497   17.395   69.642   1.8763   70.210   3.0467 -0.5680695 3.578137 
1 1 1    3    1  114 o   23.123   3.2517   22.629   5.9599   27.704   7.6180   14.622   9.5688   25.479   3.7826   18.357   5.7513 7.121284 6.883758 
1 1 1    3    1  115 f   98.527   1.3654  397.147   10.966  397.567   15.674  396.745   15.348   98.386   1.9544   98.299   1.9155 0.8696747E-01 2.736554 
1 1 1    3    1  116 o   61.658   1.5560  155.858   7.8144  155.033   11.255  156.626   10.858   61.298   2.2564   61.643   2.1642 -0.3445892 3.126500 
1 1 1    3    1  117 o   19.246   3.7028   16.050   5.5982   13.282   8.2540   18.407   7.6184   17.393   5.3238   20.370   4.6858 -2.977560 7.092188 
1 1 1    3    1  118 o   25.158   2.8484   26.611   5.7387   28.396   8.4552   25.087   7.8142   25.567   4.2029   24.021   4.1403 1.546577 5.899674 
1 1 1    3    1  119 o   60.801   1.3647  151.384   6.7637  159.955   9.8432  143.718   9.3096   62.318   1.9401   59.069   1.9361 3.249458 2.740846 
1 1 1    3    1  120 o   81.230   1.2280  270.038   8.1313  275.755   11.849  264.949   11.179   81.903   1.7747   80.307   1.7078 1.595520 2.462939 
1 1 1    3    1  121 o   17.513   3.6678   13.441   5.0680   6.8192   7.1809   20.013   7.1536   13.524   4.9671   21.256   4.2770 -7.731532 6.554716 
1 1 1    3    1  122 o   41.289   1.7326   70.277   5.8185   65.884   8.3658   74.394   8.0980   39.694   2.5998   42.282   2.3589 -2.587967 3.510507 
1 1 1    3    1  123 f   57.826   1.4025  137.234   6.6110  140.047   9.6278  134.724   9.0938   58.161   2.0339   57.077   1.9575 1.084560 2.822812 
1 1 1    3    1  124 o   19.914   3.3581   17.265   5.2575   20.113   7.1874   13.988   7.7105   21.142   4.3167   17.423   5.1029 3.718874 6.683778 
1 1 1    3    1  125 o   44.414   1.7896   81.598   6.4659   86.972   8.5864   74.558   9.8269   45.632   2.3159   41.956   2.8910 3.675491 3.704239 
1 1 1    3    1  126 f   21.701   3.2620   20.481   5.5920   15.336   7.4724   27.031   8.4305   18.114   4.9300   24.435   4.3941 -6.321213 6.604002 
1 1 1    3    1  127 o   18.294   4.1887   15.306   6.1112   19.800   8.8579   11.223   8.4422   20.321   5.2950   15.731   5.4262 4.589478 7.581577 
1 1 1    3    1  128 o   32.334   2.5187   44.269   6.5862   47.765   9.6266   41.194   9.0304   32.944   3.6456   30.537   3.7035 2.407726 5.196756 
1 1 1    3    1  129 o   21.372   3.7273   20.478   6.2575   33.707   9.0778   8.5016   8.6375   27.228   4.2271   14.339   5.4119 12.88868 6.867083 
1 1 1    3    1  130 o   9.3890   4.2307  -2.0063   6.8288  -1.0673   9.6189  -2.9606   9.6963   11.362   5.0781   10.917   4.9678 0.4451256 7.103918 
1 1 1    3    1  131 o   27.004   3.8986   32.828   8.3334   26.936   10.621   42.263   13.441   23.235   5.6609   29.107   5.8677 -5.872475 8.153248 
1 1 1    3    1  132 o   25.297   4.8224   30.381   9.5814   20.336   13.532   40.480   13.568   19.495   6.8606   28.177   6.0857 -8.681581 9.170736 
1 1 1    3    1  133 o   53.341   2.4365  120.463   10.566  117.119   13.665  125.433   16.662   51.849   3.2496   52.941   3.8882 -1.091866 5.067327 
1 1 1    3    1  134 o   22.639   6.3260   27.228   12.123   7.1730   14.596   71.840   21.770   15.255   6.5461   35.469   7.7469 -20.21414 10.14227 
1 1 1    3    1  135 o   36.049   4.4729   60.444   12.862   46.378   15.462   92.041   23.174   29.446   6.6047   40.961   7.2035 -11.51534 9.773056 
1 1 1    3    1  136 o   16.635   6.3215   13.575   11.833   5.1016   14.114   33.621   21.708   14.506   6.3299   22.505   8.5599 -7.998625 10.64608 
1 1 1    3    1  137 o   16.574   6.3038   13.588   11.773   9.2227   14.067   23.792   21.508   15.509   6.5313   19.849   8.1946 -4.340623 10.47899 
1 1 1    3    1  138 o   14.552   5.7659   8.9564   10.165   23.786   14.331  -6.0608   14.421   20.311   7.0663   12.249   5.7408 8.062410 9.104422 
1 1 1    3    1  139 o   14.380   5.9829   7.4307   11.589   7.6331   19.383   7.3181   14.458   16.162   7.2171   15.064   6.4903 1.098377 9.706238 
1 1 1    3    2 -139 o   12.912   5.9637  -2.9733   14.695  -3.1705   19.844  -2.7338   21.866   14.470   6.7663   15.033   7.0533 -0.5638065 9.774020 
1 1 1    3    2 -138 o   21.780   7.3292   28.208   15.387   17.186   20.898   41.258   22.740   18.260   7.8342   24.168   8.8452 -5.907984 11.81574 
1 1 1    3    2 -137 o   12.765   5.2820   5.0948   8.9632  -0.5516   13.401   9.6662   12.057   12.899   5.8580   15.192   6.1881 -2.293107 8.521059 
1 1 1    3    2 -136 o   17.577   5.2863   15.497   8.1876   14.196   11.137   17.026   12.078   16.792   6.1827   17.946   6.4636 -1.154886 8.944537 
1 1 1    3    2 -135 o   9.0066   4.2304  -5.9423   7.9039  -9.5184   10.895  -1.9693   11.484   10.089   4.8058   11.883   5.4069 -1.793242 7.233928 
1 1 1    3    2 -134 o   26.561   4.1173   32.408   8.6260   36.803   11.974   27.666   12.437   27.112   5.6034   22.679   6.4321 4.432705 8.530592 
1 1 1    3    2 -133 o   20.251   5.0996   20.117   8.4117   13.360   11.661   27.447   12.145   16.657   6.2879   22.755   6.3219 -6.098267 8.916526 
1 1 1    3    2 -132 o   15.938   5.2836   12.224   8.0013   16.104   11.065   7.9717   11.584   17.808   6.2082   14.761   6.0454 3.046855 8.665387 
1 1 1    3    2 -131 o   13.558   5.1417   7.4940   7.8181   10.723   10.823   3.9711   11.305   15.620   6.0183   13.475   5.7714 2.144627 8.338410 
1 1 1    3    2 -130 o   28.132   3.2699   34.607   7.3588   37.275   11.568   32.793   9.5376   27.794   5.2990   26.562   4.5698 1.232424 6.997330 
1 1 1    3    2 -129 o   34.988   2.4844   51.852   7.0397   51.457   10.151   52.217   9.7716   34.085   3.7133   34.469   3.5275 -0.3843422 5.121704 
1 1 1    3    2 -128 o   19.617   4.1307   17.634   6.3961   13.419   9.4425   21.207   8.6947   16.780   5.7403   21.005   5.1244 -4.224459 7.694855 
1 1 1    3    2 -127 o   20.458   4.0792   19.017   6.5638   21.469   9.5630   16.833   9.0256   20.986   5.5181   18.613   5.5392 2.373137 7.818637 
1 1 1    3    2 -126 o   25.938   3.0408   28.949   6.3073   20.206   10.876   33.380   7.7422   20.225   6.0949   27.641   3.5155 -7.416119 7.036120 
1 1 1    3    2 -125 o   26.490   3.0423   30.088   6.4501   38.621   11.044   25.671   7.9464   29.068   4.8302   23.903   4.2333 5.165058 6.422742 
1 1 1    3    2 -124 o   26.439   2.9513   29.818   6.2522   31.750   10.473   28.748   7.7936   26.237   5.0802   25.564   3.8602 0.6733952 6.380374 
1 1 1    3    2 -123 o   21.271   3.1816   19.505   5.3474   23.122   7.6750   16.092   7.4545   22.739   4.2982   18.720   4.8473 4.019129 6.478513 
1 1 1    3    2 -122 o   16.543   4.1050   12.232   5.5091   11.273   8.3063   12.986   7.3611   16.060   5.3847   16.931   4.9932 -0.8708591 7.343554 
1 1 1    3    2 -121 o   47.705   1.8420   93.878   7.1494   93.263   11.515   94.264   9.1202   47.080   3.0164   47.623   2.3567 -0.5434036 3.827901 
1 1 1    3    2 -120 o   24.804   3.0767   26.117   6.0876   36.085   9.8789   20.014   7.7297   28.710   4.3579   21.157   4.6124 7.553083 6.345476 
1 1 1    3    2 -119 o   55.698   1.6798  127.508   7.6178  127.972   12.273  127.218   9.7162   55.423   2.7249   55.486   2.1523 -0.6260300E-01 3.472373 
1 1 1    3    2 -118 o   33.873   2.2176   47.533   6.0894   47.051   9.1667   47.914   8.1467   33.334   3.4221   33.789   2.9885 -0.4556580 4.543383 
1 1 1    3    2 -117 o   67.529   1.3973  186.716   7.6916  182.928   10.932  190.430   10.824   66.647   2.0145   68.021   1.9542 -1.374756 2.806610 
1 1 1    3    2 -116 o   42.575   1.7981   74.545   6.2263   84.306   8.9530   65.403   8.6648   45.115   2.4436   39.648   2.6971 5.466755 3.639416 
1 1 1    3    2 -115 o   63.045   1.4322  162.698   7.3600  165.207   10.534  160.306   10.287   63.356   2.0424   62.414   2.0247 0.9426994 2.875948 
1 1 1    3    2 -114 o   16.781   3.8987   12.273   5.2310   16.416   7.5930   8.5297   7.2168   19.264   4.8417   14.615   5.0178 4.649142 6.972836 
1 1 1    3    2 -113 o   22.840   2.9934   21.957   5.4391   29.554   7.8807   15.046   7.5163   26.342   3.7782   18.482   4.9073 7.859295 6.193238 
1 1 1    3    2 -112 o   41.030   1.8166   69.128   6.0606   70.136   8.6451   68.153   8.4989   41.173   2.5890   40.586   2.5823 0.5869675 3.656660 
1 1 1    3    2 -111 o   50.027   1.5881  102.508   6.4681  109.807   9.1227   95.130   9.1720   51.671   2.1707   48.050   2.3488 3.621269 3.198308 
1 1 1    3    2 -110 o   16.545   4.1625   11.869   5.6082   15.407   9.2987   9.8466   7.0308   18.861   5.6246   15.408   4.9426 3.452350 7.487735 
1 1 1    3    2 -109 o   13.419   4.4088   7.2484   5.5753   8.6338   9.2464   6.4570   6.9887   15.523   5.6465   13.525   4.9106 1.998008 7.483118 
1 1 1    3    2 -108 o   47.578   2.0062   92.859   7.7632   95.841   11.217   90.117   10.755   48.178   2.8692   46.719   2.8376 1.459347 4.035343 
1 1 1    3    2 -107 o   14.998   4.8037   9.2163   6.6430   10.626   9.7744   8.0065   9.0558   16.684   5.8338   15.216   5.5797 1.467980 8.072549 
1 1 1    3    2 -106 o   34.306   2.7104   48.595   7.5178   49.081   11.540   48.237   9.9089   34.166   4.2342   34.005   3.6309 0.1613159 5.577745 
1 1 1    3    2 -105 o   49.722   1.8479  101.197   7.4765  109.909   11.467   94.753   9.8608   51.694   2.7309   48.020   2.5281 3.674347 3.721404 
1 1 1    3    2 -104 o  101.602   1.3668  421.340   11.320  430.998   17.077  413.769   15.119  102.670   2.0404  100.627   1.8432 2.043663 2.749657 
1 1 1    3    2 -103 o   92.040   1.2349  345.637   9.2648  345.784   13.349  345.500   12.869   92.008   1.7798   91.977   1.7164 0.3084564E-01 2.472657 
1 1 1    3    2 -102 o  122.151   1.3382  608.822   13.325  602.872   17.601  616.810   20.394  121.501   1.7772  122.859   2.0364 -1.358398 2.702807 
1 1 1    3    2 -101 o  120.787   1.4161  595.309   13.943  573.369   17.529  633.092   23.003  118.497   1.8148  124.450   2.2676 -5.953125 2.904357 
1 1 1    3    2 -100 o   81.466   1.4202  270.776   9.4310  265.312   12.599  277.739   14.223   80.606   1.9175   82.428   2.1186 -1.822029 2.857468 
1 1 1    3    2  -99 o   31.045   2.5986   39.677   6.5158   36.745   8.6092   43.609   9.9693   29.719   3.6290   32.375   3.8531 -2.656422 5.293005 
1 1 1    3    2  -98 o   62.290   1.5393  158.302   7.8161  159.940   10.434  156.207   11.799   62.554   2.0490   61.791   2.3467 0.7629318 3.115379 
1 1 1    3    2  -97 o   53.976   1.6470  118.979   7.2378  125.074   10.961  114.266   9.6381   55.278   2.4385   52.849   2.2424 2.428879 3.312739 
1 1 1    3    2  -96 o  191.126   1.3814  1489.87   21.522  1470.19   33.321  1503.95   28.192  189.766   2.1541  191.981   1.8015 -2.214905 2.808098 
1 1 1    3    2  -95 o   49.871   1.6628  101.574   6.7501   99.022   9.5635  104.107   9.5287   49.185   2.3925   50.441   2.3237 -1.255882 3.335245 
1 1 1    3    2  -94 o   99.113   1.2128  400.562   9.7984  403.953   14.264  397.533   13.483   99.506   1.7585   98.716   1.6756 0.7893524 2.429004 
1 1 1    3    2  -93 o   84.061   1.3065  288.145   8.9524  293.578   13.569  283.957   11.913   84.823   1.9625   83.431   1.7517 1.391846 2.630563 
1 1 1    3    2  -92 o  120.351   1.1857  590.568   11.632  581.139   16.829  599.193   16.096  119.360   1.7297  121.206   1.6292 -1.845497 2.376119 
1 1 1    3    2  -91 o  159.218   1.2311  1033.61   15.978  1000.66   23.126  1063.72   22.103  156.625   1.8113  161.494   1.6790 -4.868820 2.469829 
1 1 1    3    2  -90 o  143.789   1.2506  842.981   14.658  836.673   22.612  847.554   19.250  143.212   1.9370  144.159   1.6382 -0.9465790 2.536814 
1 1 1    3    2  -89 o   93.385   1.2488  355.554   9.5058  338.803   14.332  368.713   12.702   91.137   1.9292   95.085   1.6388 -3.948502 2.531255 
1 1 1    3    2  -88 o  126.228   1.2996  649.632   13.372  652.750   19.503  646.866   18.369  126.507   1.8913  125.940   1.7894 0.5666580 2.603603 
1 1 1    3    2  -87 o  259.530   1.6249  2746.61   34.376  2724.05   53.626  2762.35   44.788  258.370   2.5462  260.229   2.1114 -1.859375 3.307784 
1 1 1    3    2  -86 o  165.142   1.2640  1111.83   17.016  1122.13   25.053  1103.01   23.184  165.878   1.8528  164.465   1.7293 1.412994 2.534443 
1 1 1    3    2  -85 o  137.679   1.2308  772.774   13.813  784.256   20.244  762.770   18.895  138.678   1.7908  136.769   1.6949 1.908905 2.465670 
1 1 1    3    2  -84 o  244.012   1.4924  2427.66   29.685  2428.79   43.810  2426.71   40.362  244.017   2.2025  243.926   2.0299 0.9008789E-01 2.995279 
1 1 1    3    2  -83 o   75.545   1.3112  232.665   8.0744  230.583   11.091  235.014   11.778   75.197   1.8094   75.890   1.9054 -0.6931915 2.627629 
1 1 1    3    2  -82 o   98.385   1.1893  394.596   9.5382  398.722   14.815  391.675   12.465   98.884   1.8380   98.013   1.5602 0.8708649 2.410921 
1 1 1    3    2  -81 o   52.682   1.4473  113.237   6.2092  115.536   9.4142  111.466   8.2607   53.180   2.1763   52.246   1.9430 0.9341011 2.917468 
1 1 1    3    2  -80 o  297.228   1.8533  3602.36   44.903  3541.32   76.521  3634.42   55.454  294.565   3.1869  298.512   2.2789 -3.947205 3.917861 
1 1 1    3    2  -79 o   68.549   1.8435  191.742   10.292   0.0000   0.0000  191.742   10.292  ?   ?    68.549   1.8435 0.000000 1.843521 
1 1 1    3    2  -78 o  167.222   1.5041  1140.03   20.502  1205.24   38.566  1114.34   24.205  171.881   2.7526  165.317   1.7962 6.564087 3.286787 
1 1 1    3    2  -77 o  224.089   1.7420  2047.41   31.820  1986.68   47.133  2098.27   43.133  220.689   2.6200  226.822   2.3328 -6.132645 3.508093 
1 1 1    3    2  -76 o   19.763   3.4001   16.393   5.2800   15.736   6.7758   17.408   8.4247   19.245   4.4134   20.245   5.1065 -0.9998550 6.749400 
1 1 1    3    2  -75 o   78.359   1.2437  250.301   7.9443  240.187   10.215  265.784   12.638   76.755   1.6326   80.737   1.9203 -3.981735 2.520515 
1 1 1    3    2  -74 o  302.066   1.7749  3720.11   43.704  3704.24   61.429  3736.39   62.190  301.370   2.5006  302.674   2.5207 -1.303497 3.550561 
1 1 1    3    2  -73 o   68.996   1.2183  194.051   6.8522  205.626   9.3613  180.693   10.057   71.019   1.6170   66.546   1.8558 4.473412 2.461464 
1 1 1    3    2  -72 o  122.410   1.0862  610.794   10.839  607.148   15.825  614.015   14.876  122.036   1.5908  122.727   1.4870 -0.6901169 2.177580 
1 1 1    3    2  -71 o  274.147   1.6445  3063.97   36.749  3003.71   51.246  3127.75   52.726  271.403   2.3164  276.949   2.3356 -5.545929 3.289448 
1 1 1    3    2  -70 o  198.705   1.3434  1609.51   21.760  1569.55   30.245  1652.39   31.329  196.207   1.8911  201.318   1.9091 -5.110336 2.687151 
1 1 1    3    2  -69 o  259.695   1.5829  2749.32   33.509  2726.38   47.078  2772.88   47.705  258.582   2.2335  260.777   2.2442 -2.195282 3.166204 
1 1 1    3    2  -68 o  178.054   1.2669  1292.31   18.387  1307.94   26.106  1276.91   25.903  179.117   1.7880  176.979   1.7955 2.138123 2.533926 
1 1 1    3    2  -67 o   58.197   1.2315  138.058   5.8424  135.874   8.0201  140.527   8.5281   57.707   1.7068   58.685   1.7848 -0.9776192 2.469582 
1 1 1    3    2  -66 f  169.519   1.2351  1171.35   17.067  1119.05   23.536  1229.36   24.787  165.683   1.7427  173.658   1.7510 -7.974548 2.470403 
1 1 1    3    2  -65 o  109.901   1.0558  492.311   9.4585  492.410   13.857  492.224   12.942  109.908   1.5467  109.888   1.4448 0.1974487E-01 2.116595 
1 1 1    3    2  -64 o  137.984   1.0975  776.057   12.344  766.283   18.064  784.620   16.907  137.107   1.6162  138.740   1.4950 -1.632217 2.201658 
1 1 1    3    2  -63 o  264.351   1.5243  2848.51   32.846  2790.15   47.976  2900.00   45.065  261.612   2.2497  266.717   2.0728 -5.105438 3.059019 
1 1 1    3    2  -62 o   35.204   1.5705   50.616   4.4954   52.376   6.2531   48.733   6.4673   35.779   2.1540   34.497   2.3132 1.282150 3.160798 
1 1 1    3    2  -61 o  184.955   1.2240  1394.33   18.453  1382.34   27.173  1404.60   25.139  184.152   1.8102  185.630   1.6613 -1.478790 2.457011 
1 1 1    3    2  -60 o  187.636   1.2333  1435.03   18.864  1457.36   28.112  1416.74   25.442  189.084   1.8239  186.432   1.6742 2.652023 2.475770 
1 1 1    3    2  -59 o  283.815   1.6019  3283.33   37.059  3239.89   54.357  3321.06   50.657  281.917   2.3654  285.431   2.1772 -3.513885 3.214865 
1 1 1    3    2  -58 o  343.231   1.9455  4802.08   54.431  4664.32   75.281  4952.99   78.794  338.254   2.7303  348.563   2.7732 -10.30890 3.891651 
1 1 1    3    2  -57 o  164.320   1.2698  1100.54   17.008  1058.08   22.418  1158.14   26.108  161.116   1.7070  168.560   1.9001 -7.444382 2.554277 
1 1 1    3    2  -56 o  417.112   2.4173  7092.08   82.190  7111.95  110.631  7067.60  122.784  417.672   3.2494  416.355   3.6178 1.317047 4.862831 
1 1 1    3    2  -55 o  254.740   1.6310  2645.00   33.867  2633.72   45.429  2659.12   50.814  254.190   2.1925  255.410   2.4407 -1.219727 3.280828 
1 1 1    3    2  -54 o  162.642   1.3426  1078.18   17.799  1098.89   22.877  1046.40   28.334  164.195   1.7093  160.223   2.1694 3.971863 2.761858 
1 1 1    3    2  -53 o  271.226   1.9438  2998.46   42.975  3030.24   57.573  2958.47   64.580  272.652   2.5905  269.398   2.9408 3.253418 3.919018 
1 1 1    3    2  -52 f  740.329   4.1137 22345.27  248.254 22395.09  372.871 22305.60  332.718  741.015   6.1730  739.583   5.5189 1.431885 8.280350 
1 1 1    3    2  -51 o   70.025   1.5424  199.864   8.8040  176.649   12.181  225.260   12.740   65.792   2.2746   74.310   2.1053 -8.518036 3.099400 
1 1 1    3    2  -50 o  426.480   2.8131  7414.08   97.796  7514.39  150.608  7340.94  128.595  429.319   4.3036  424.351   3.7176 4.967896 5.686948 
1 1 1    3    2  -49 o  220.311   1.7297  1978.32   31.064  2017.70   47.612  1949.13   40.989  222.486   2.6253  218.676   2.2995 3.810562 3.489969 
1 1 1    3    2  -48 o  126.839   1.5267  655.728   15.785  599.014   21.166  726.796   23.693  121.227   2.1419  133.533   2.1767 -12.30544 3.053816 
1 1 1    3    2  -47 o  250.490   1.8530  2557.46   37.836  2579.92   71.201  2548.62   44.665  251.572   3.4720  250.055   2.1913 1.517838 4.105692 
1 1 1    3    2  -46 f  205.876   1.5262  1727.55   25.613  1767.51   42.205  1704.26   32.225  208.238   2.4864  204.482   1.9333 3.756363 3.149578 
1 1 1    3    2  -45 o  522.205   3.6231 11116.38  154.228 11491.16  224.202 10779.73  212.491  530.887   5.1809  514.194   5.0696 16.69250 7.248619 
1 1 1    3    2  -44 o  192.335   1.6699  1507.79   26.182  1505.27   32.264  1512.64   44.804  192.173   2.0596  192.638   2.8532 -0.4646759 3.518933 
1 1 1    3    2  -43 o  230.926   1.6231  2173.53   30.553  2173.62   43.121  2173.45   43.295  230.927   2.2908  230.918   2.3001 0.9063721E-02 3.246250 
1 1 1    3    2  -42 o  396.019   2.4524  6392.48   79.168  6440.88  112.493  6344.98  111.436  397.500   3.4718  394.530   3.4650 2.970123 4.905075 
1 1 1    3    2  -41 o  401.702   2.3374  6577.23   76.536  6524.80  114.051  6620.19  103.232  400.082   3.4972  403.001   3.1425 -2.919617 4.701629 
1 1 1    3    2  -40 o  872.523   4.8099 31037.02  342.097 31028.77  512.946 31043.64  459.114  872.255   7.2143  872.519   6.4552 -0.2633057 9.680663 
1 1 1    3    2  -39 o  619.806   3.4685 15659.60  175.242 15306.42  257.975 15962.21  238.793  612.723   5.1651  625.729   4.6817 -13.00604 6.971077 
1 1 1    3    2  -38 o  675.231   4.2615 18586.94  234.558 18482.90  436.603 18629.15  278.099  673.153   7.9568  675.967   5.0471 -2.814758 9.422478 
1 1 1    3    2  -37 o  762.270   4.7896 23689.16  297.605 23399.64  389.496 24095.29  461.313  757.517   6.3078  768.624   7.3628 -11.10760 9.695329 
1 1 1    3    2  -36 o  224.663   1.6952  2057.24   31.044  2066.15   41.051  2045.33   47.446  225.146   2.2368  224.006   2.5984 1.139816 3.428525 
1 1 1    3    2  -35 o  300.401   2.0842  3678.21   51.036  3720.95   67.983  3623.01   77.256  302.135   2.7603  298.126   3.1790 4.008301 4.210198 
1 1 1    3    2  -34 o  579.128   3.9856 13672.86  188.150 13815.83  268.436 13534.79  263.794  582.078   5.6575  576.129   5.6171 5.948853 7.972371 
1 1 1    3    2  -33 o  336.188   2.4634  4606.94   67.509  4724.03   97.311  4498.30   93.733  340.416   3.5068  332.184   3.4616 8.231812 4.927542 
1 1 1    3    2  -32 o  486.249   3.1397  9638.27  124.445  9533.67  163.135  9783.87  192.462  483.572   4.1386  489.850   4.8200 -6.277679 6.352962 
1 1 1    3    2  -31 o  361.797   2.8648  5335.84   84.489  5442.04  135.480  5268.25  108.081  365.336   4.5493  359.479   3.6884 5.856598 5.856672 
1 1 1    3    2  -30 o  639.713   4.7912 16687.17  249.842 16697.62  394.875 16680.20  322.632  639.686   7.5728  639.478   6.1894 0.2078857 9.780371 
1 1 1    3    2  -29 o  347.385   2.7649  4919.30   78.295  4825.42  121.768  4985.47  102.228  344.012   4.3423  349.694   3.5863 -5.681885 5.631826 
1 1 1    3    2  -28 o  287.944   2.3773  3379.71   55.799  3314.88   86.713  3425.53   72.897  285.141   3.7307  289.876   3.0850 -4.735260 4.841012 
1 1 1    3    2  -27 o  110.103   1.2257  494.106   11.001  501.202   17.213  489.206   14.303  110.888   1.9043  109.554   1.6017 1.333656 2.488336 
1 1 1    3    2  -26 o  496.867   3.1978 10064.72  129.518  9936.10  169.439 10245.50  200.882  493.634   4.2109  501.218   4.9167 -7.584656 6.473470 
1 1 1    3    2  -25 o  315.401   2.0086  4054.89   51.640  4012.59   64.840  4128.25   85.394  313.742   2.5353  318.213   3.2921 -4.470886 4.155217 
1 1 1    3    2  -24 o  606.755   3.8489 15010.90  190.363 14712.94  221.274 15859.50  373.423  600.657   4.5193  623.340   7.3492 -22.68274 8.627534 
1 1 1    3    2  -23 o  244.789   1.7706  2442.45   35.330  2397.86   41.165  2567.16   68.840  242.540   2.0821  250.932   3.3655 -8.392563 3.957502 
1 1 1    3    2  -22 o  451.651   2.9296  8315.93  107.856  8351.02  143.017  8269.67  164.237  452.564   3.8768  450.324   4.4742 2.239594 5.920090 
1 1 1    3    2  -21 o  111.749   1.3021  508.990   11.861  517.104   14.520  492.711   20.566  112.634   1.5814  109.942   2.2948 2.692520 2.786964 
1 1 1    3    2  -20 o  337.172   2.4511  4634.21   67.367  4538.64   81.103  4846.90  120.987  333.665   2.9819  344.768   4.3050 -11.10269 5.236878 
1 1 1    3    2  -19 o  317.988   2.1579  4121.70   55.934  4112.83   73.924  4133.59   85.547  317.632   2.8551  318.422   3.2958 -0.7901917 4.360554 
1 1 1    3    2  -18 o  528.760   3.6546 11398.73  157.519 10953.77  215.491 11909.30  230.830  518.262   5.1009  540.385   5.2403 -22.12341 7.312945 
1 1 1    3    2  -17 o  838.029   5.2419 28640.63  358.083 28257.14  468.269 29180.68  555.691  832.219   6.9027  845.550   8.0623 -13.33203 10.61358 
1 1 1    3    2  -16 o  360.997   2.3989  5312.09   70.590  5322.07   93.600  5298.94  107.494  361.320   3.1780  360.522   3.6578 0.7981873 4.845499 
1 1 1    3    2  -15 o  437.856   2.8420  7815.16  101.436  7848.14  134.689  7771.95  154.184  438.753   3.7660  436.598   4.3323 2.154816 5.740350 
1 1 1    3    2  -14 o  477.834   3.0773  9307.59  119.862  9527.26  161.727  9039.87  178.539  483.406   4.1042  470.858   4.6517 12.54852 6.203451 
1 1 1    3    2  -13 o  591.558   4.0543 14266.93  195.500 14409.03  241.643 13997.68  332.624  594.451   4.9868  585.779   6.9660 8.672058 8.566997 
1 1 1    3    2  -12 o  366.591   2.4274  5477.92   72.537  5462.22  110.626  5489.76   96.073  366.040   3.7076  366.973   3.2117 -0.9328613 4.905188 
1 1 1    3    2  -11 o  490.970   3.1509  9826.29  126.105  9587.93  188.755 10018.46  169.477  484.926   4.7752  495.716   4.1941 -10.78973 6.355546 
1 1 1    3    2  -10 o  251.575   1.7906  2579.66   36.720  2643.38   57.078  2534.67   47.963  254.654   2.7497  249.366   2.3596 5.287323 3.623299 
1 1 1    3    2   -9 o  251.614   1.7909  2580.47   36.732  2599.55   56.475  2566.48   48.358  252.534   2.7435  250.926   2.3642 1.607788 3.621631 
1 1 1    3    2   -8 o  470.588   3.0305  9027.16  116.250  9206.21  180.510  8900.27  151.957  475.185   4.6602  467.244   3.9897 7.940979 6.134739 
1 1 1    3    2   -7 o  413.485   2.5229  6968.97   85.033  7008.85  120.836  6929.85  119.683  414.646   3.5751  412.303   3.5611 2.343170 5.046001 
1 1 1    3    2   -6 o  639.368   4.0354 16665.40  210.319 16733.56  279.144 16575.89  319.870  640.614   5.3456  637.543   6.1550 3.070618 8.152259 
1 1 1    3    2   -5 o  984.054   6.1255 39490.24  491.359 39424.94  648.926 39577.98  752.238  983.031   8.0983  984.772   9.3709 -1.740723 12.38533 
1 1 1    3    2   -4 o  138.969   1.2579  787.136   14.250  775.063   18.732  803.720   21.954  137.898   1.6664  140.423   1.9180 -2.525162 2.540814 
1 1 1    3    2   -3 o  777.412   5.2591 24642.65  333.273 24139.44  462.699 25185.19  480.441  769.281   7.3787  785.756   7.5009 -16.47589 10.52183 
1 1 1    3    2   -2 o  832.523   5.6212 28261.88  381.474 29054.71  552.505 27539.62  527.344  843.914   8.0316  821.631   7.8737 22.28271 11.24733 
1 1 1    3    2   -1 o  763.877   5.6631 23793.52  352.624 24156.58  564.912 23561.75  451.355  769.405   9.0072  760.030   7.2854 9.374939 11.58474 
1 1 1    3    2    0 o  651.560   5.4397 17310.30  288.915 18309.13  605.834 17016.28  328.699  669.633   11.099  645.958   6.2425 23.67493 12.73399 
1 1 1    3    2    1 o  954.425   7.8700 37160.89  612.280   0.0000   0.0000 37160.89  612.280  ?   ?   954.425   7.8700 0.000000 7.869960 
1 1 1    3    2    2 o  900.005   6.6431 33035.34  487.363 33167.84  773.373 32948.06  627.680  901.364   10.526  898.620   8.5689 2.743347 13.57269 
1 1 1    3    2    3 o  539.857   4.0712 11881.47  179.159 12310.02  291.907 11622.47  226.929  549.401   6.5181  533.898   5.2143 15.50250 8.347098 
1 1 1    3    2    4 o  478.409   3.3263  9329.90  129.715  8851.34  175.479  9906.43  192.605  465.942   4.6202  492.925   4.7935 -26.98270 6.657574 
1 1 1    3    2    5 o  367.672   2.6281  5510.26   78.767  5402.71  109.716  5624.64  113.151  364.047   3.6972  371.448   3.7370 -7.400757 5.256873 
1 1 1    3    2    6 o  231.078   1.8182  2176.43   34.248  2190.39   48.643  2162.71   48.229  231.812   2.5742  230.342   2.5686 1.469330 3.636538 
1 1 1    3    2    7 o  323.028   2.3546  4253.29   61.999  4202.65   86.865  4305.88   88.518  321.086   3.3188  325.005   3.3412 -3.919037 4.709414 
1 1 1    3    2    8 o  367.737   2.6301  5512.24   78.839  5517.66  111.530  5506.83  111.461  367.898   3.7190  367.536   3.7204 0.3614197 5.260440 
1 1 1    3    2    9 o  867.759   5.8540 30707.50  414.087 31133.91  592.747 30301.03  578.719  873.517   8.3246  861.764   8.2384 11.75330 11.71196 
1 1 1    3    2   10 o  627.607   4.2848 16058.81  219.208 15654.01  303.213 16502.03  317.278  619.556   6.0039  636.109   6.1189 -16.55267 8.572463 
1 1 1    3    2   11 o  1077.22   7.9321 47345.77  696.515 48083.66  911.823 46312.02  1079.25  1085.19   10.308  1064.57   12.437 20.61609 16.15328 
1 1 1    3    2   12 o  322.908   2.3557  4250.16   62.006  4278.27   88.133  4222.61   87.253  323.958   3.3374  321.844   3.3258 2.114349 4.711625 
1 1 1    3    2   13 o  566.333   3.8880 13075.80  179.486 13121.93  254.504 13030.15  253.165  567.253   5.5040  565.266   5.4943 1.986938 7.777038 
1 1 1    3    2   14 o  686.960   4.6710 19241.88  261.563 19058.96  366.939 19430.84  372.947  683.548   6.5855  690.181   6.6290 -6.632813 9.344106 
1 1 1    3    2   15 o  559.070   3.8425 12742.78  175.112 12671.37  246.514 12815.53  248.794  557.420   5.4253  560.581   5.4446 -3.160767 7.686176 
1 1 1    3    2   16 o  486.366   3.3759  9643.48  133.841  9538.07  187.536  9752.91  191.074  483.644   4.7569  489.059   4.7930 -5.414978 6.752804 
1 1 1    3    2   17 o  333.921   2.4251  4545.17   66.010  4489.15   92.448  4603.43   94.283  331.836   3.4177  336.033   3.4420 -4.196869 4.850614 
1 1 1    3    2   18 o  478.056   3.6437  9317.42  141.992  9166.43  221.655  9422.51  184.915  474.060   5.7360  480.695   4.7192 -6.634644 7.427797 
1 1 1    3    2   19 o  456.973   3.4988  8513.68  130.332  8171.10  199.347  8769.43  172.243  447.589   5.4638  463.738   4.5565 -16.14914 7.114404 
1 1 1    3    2   20 o  144.063   1.5416  845.938   18.103  826.169   28.599  859.156   23.384  142.363   2.4644  145.182   1.9759 -2.818253 3.158746 
1 1 1    3    2   21 o  497.253   3.4521 10080.79  139.927  9830.41  193.914 10352.80  202.115  490.965   4.8453  503.836   4.9212 -12.87152 6.906194 
1 1 1    3    2   22 o  502.366   3.8228 10290.02  156.546 10519.48  205.767  9974.71  241.211  507.869   4.9704  494.470   5.9844 13.39822 7.779317 
1 1 1    3    2   23 o  529.091   4.4799 11415.74  193.210 11324.10  221.653 11705.65  394.246  526.915   5.1606  535.317   9.0348 -8.401733 10.40478 
1 1 1    3    2   24 o  182.424   1.9616  1356.49   29.170  1317.53   33.216  1487.83   60.983  179.782   2.2666  191.022   3.9165 -11.23949 4.525022 
1 1 1    3    2   25 o  407.352   4.0915  6766.10  135.859  6674.38  164.765  6960.90  240.129  404.537   4.9965  412.988   7.1330 -8.450165 8.708911 
1 1 1    3    2   26 o  481.656   4.7508  9460.96  186.528  9495.79  229.321  9392.85  320.650  482.470   5.8309  479.641   8.2012 2.829681 10.06280 
1 1 1    3    2   27 o  712.860   5.9377 20729.86  345.030 20809.28  489.704 20651.58  486.207  713.908   8.4150  711.202   8.3867 2.706177 11.88065 
1 1 1    3    2   28 o  632.867   4.7418 16332.84  244.621 16521.72  390.826 16211.19  313.658  636.259   7.5355  630.396   6.1039 5.862732 9.697502 
1 1 1    3    2   29 o  239.398   1.7485  2336.03   34.122  2277.54   44.557  2418.98   53.060  236.376   2.3125  243.600   2.6721 -7.224106 3.533799 
1 1 1    3    2   30 o  165.389   1.6579  1114.92   22.351  1146.55   29.821  1074.38   33.761  167.715   2.1813  162.348   2.5512 5.367050 3.356551 
1 1 1    3    2   31 o  769.020   5.2216 24116.09  327.325 24294.25  569.619 24028.26  399.953  771.452   9.0582  767.518   6.3927 3.933594 11.08678 
1 1 1    3    2   32 o  709.350   4.8255 20516.62  279.022 20308.33  390.710 20733.41  398.602  705.598   6.7930  712.939   6.8589 -7.340698 9.653431 
1 1 1    3    2   33 o  189.665   1.6254  1466.22   25.130  1456.01   35.536  1476.45   35.542  188.999   2.3066  190.321   2.2910 -1.322342 3.250999 
1 1 1    3    2   34 o  539.067   3.7243 11846.28  163.652 11852.88  231.406 11839.68  231.472  539.161   5.2653  538.860   5.2697 0.3005981 7.449344 
1 1 1    3    2   35 o  977.829   6.5901 38994.00  525.277 38987.07  741.805 39000.98  743.908  977.444   9.3103  977.615   9.3350 -0.1712646 13.18421 
1 1 1    3    2   36 o  755.888   4.7545 23294.36  292.951 23442.71  389.377 23100.86  444.703  758.205   6.3001  752.592   7.2489 5.612671 9.604085 
1 1 1    3    2   37 o  188.631   1.5166  1450.26   23.319  1379.09   30.123  1556.69   36.837  183.942   2.0090  195.426   2.3124 -11.48415 3.063217 
1 1 1    3    2   38 o  451.704   2.5912  8316.66   95.410  8416.64  144.438  8239.26  127.082  454.387   3.8996  449.582   3.4677 4.804657 5.218400 
1 1 1    3    2   39 o  243.093   1.5727  2408.59   31.165  2441.10   47.208  2383.48   41.491  244.723   2.3665  241.819   2.1049 2.903900 3.167118 
1 1 1    3    2   40 o  902.916   5.2794 33238.84  388.569 32886.94  628.026 33457.11  494.605  897.877   8.5807  905.783   6.6988 -7.906189 10.88593 
1 1 1    3    2   41 o  179.895   1.4837  1319.04   21.758  1325.57   33.546  1314.29   28.586  180.337   2.2820  179.570   1.9529 0.7673645 3.003593 
1 1 1    3    2   42 o  496.838   2.8260 10061.87  114.451  9842.49  168.402 10250.19  156.024  491.363   4.2044  501.446   3.8171 -10.08307 5.678679 
1 1 1    3    2   43 o  1274.63   6.9782 66258.40  725.043 65072.79  1069.26 67267.50  986.467  1262.71   10.388  1283.98   9.4251 -21.27014 14.02675 
1 1 1    3    2   44 o  630.198   3.7384 16189.66  192.044 16134.21  270.623 16245.91  272.569  629.062   5.2776  631.234   5.2972 -2.172974 7.477546 
1 1 1    3    2   45 o  146.133   1.6340  870.395   19.464  824.403   29.964  903.967   25.600  142.216   2.5847  148.923   2.1089 -6.706879 3.335880 
1 1 1    3    2   46 f  199.208   1.5989  1617.46   25.963  1688.10   49.554  1590.73   30.481  203.503   2.9873  197.554   1.8928 5.949036 3.536467 
1 1 1    3    2   47 o  633.629   3.7590 16366.74  194.151 16317.32  316.125 16396.67  246.016  632.567   6.1308  634.170   4.7591 -1.602722 7.761136 
1 1 1    3    2   48 o  357.681   2.1302  5214.65   62.109  5094.61  105.567  5278.21   76.810  353.517   3.6634  359.848   2.6186 -6.330872 4.503018 
1 1 1    3    2   49 o  582.850   3.2824 13848.11  155.952 13767.78  232.848 13913.46  210.014  581.098   4.9157  584.185   4.4102 -3.087219 6.604123 
1 1 1    3    2   50 o   95.011   1.3544  367.933   10.489  364.964   15.264  370.590   14.438   94.626   1.9790   95.352   1.8576 -0.7269897 2.714216 
1 1 1    3    2   51 o  920.107   5.3795 34521.76  403.473 35003.32  666.512 34243.22  506.902  926.122   8.8288  916.256   6.7869 9.866089 11.13599 
1 1 1    3    2   52 f  321.909   1.9583  4223.79   51.385  4302.38   78.304  4164.35   68.100  324.876   2.9569  319.628   2.6138 5.248627 3.946486 
1 1 1    3    2   53 o  366.585   2.1709  5477.64   64.871  5481.44   97.545  5474.62   86.865  366.691   3.2634  366.471   2.9078 0.2206421 4.370944 
1 1 1    3    2   54 o  472.604   2.5667  9104.55   98.879  9012.96  155.197  9167.14  128.286  470.174   4.0494  474.204   3.3188 -4.030304 5.235633 
1 1 1    3    2   55 o  317.523   1.8324  4109.50   47.428  4021.10   73.934  4171.30   61.824  314.072   2.8879  319.894   2.3709 -5.821686 3.736445 
1 1 1    3    2   56 o  162.111   1.1516  1071.14   15.218  1063.17   22.308  1078.08   20.812  161.504   1.6945  162.633   1.5699 -1.128983 2.309968 
1 1 1    3    2   57 o  410.173   2.1580  6857.97   72.152  6864.82  107.012  6852.26   97.699  410.348   3.1992  409.981   2.9234 0.3662415 4.333759 
1 1 1    3    2   58 o  341.423   1.8507  4751.57   51.506  4799.43   76.864  4712.56   69.389  343.117   2.7482  340.004   2.5036 3.112976 3.717607 
1 1 1    3    2   59 o  376.512   2.1017  5778.64   64.503  5775.56   91.182  5781.72   91.259  376.384   2.9719  376.585   2.9729 -0.2005615 4.203625 
1 1 1    3    2   60 o  199.496   1.4032  1622.20   22.819  1655.56   30.945  1582.45   33.783  201.531   1.8837  197.028   2.1035 4.502762 2.823649 
1 1 1    3    2   61 o  153.331   1.2430  958.276   15.536  967.422   20.876  946.923   23.260  154.057   1.6624  152.414   1.8722 1.643127 2.503703 
1 1 1    3    2   62 o   57.760   1.2801  135.986   6.0273  152.296   8.0482  115.158   9.0951   61.103   1.6173   53.108   2.1051 7.995110 2.654619 
1 1 1    3    2   63 o  145.868   1.2341  867.283   14.674  856.081   19.358  882.416   22.500  144.919   1.6387  147.128   1.8761 -2.209091 2.490968 
1 1 1    3    2   64 o  143.601   1.2286  840.538   14.382  832.353   18.974  851.590   22.049  142.896   1.6289  144.535   1.8715 -1.638550 2.481094 
1 1 1    3    2   65 o  327.891   1.9852  4382.96   53.061  4450.81   71.814  4301.38   78.743  330.389   2.6665  324.778   2.9743 5.610535 3.994625 
1 1 1    3    2   66 f  431.182   2.4958  7580.63   87.722  7561.87  117.393  7604.36  132.003  430.578   3.3447  431.746   3.7508 -1.167389 5.025451 
1 1 1    3    2   67 o  152.901   1.2544  952.961   15.634  936.973   20.731  974.047   23.807  151.606   1.6775  154.572   1.8895 -2.966064 2.526706 
1 1 1    3    2   68 o  197.525   1.3354  1590.42   21.501  1591.63   30.328  1589.19   30.486  197.587   1.8830  197.435   1.8943 0.1523285 2.670949 
1 1 1    3    2   69 o  482.361   2.6197  9488.57  103.005  9549.64  146.356  9428.62  144.995  483.770   3.7114  480.696   3.7004 3.073425 5.240922 
1 1 1    3    2   70 o  227.238   1.4574  2104.99   26.996  2078.35   37.648  2133.18   38.732  225.774   2.0457  228.732   2.0773 -2.957306 2.915473 
1 1 1    3    2   71 o   64.973   1.2443  172.084   6.5900  161.868   8.8611  184.727   9.8577   62.987   1.7275   67.288   1.7988 -4.301189 2.493981 
1 1 1    3    2   72 o  220.383   1.5092  1979.98   27.112  1956.93   40.072  1999.44   36.820  219.066   2.2440  221.443   2.0398 -2.376175 3.032544 
1 1 1    3    2   73 o  210.778   1.4749  1811.15   25.342  1781.20   37.354  1836.68   34.494  209.000   2.1926  212.239   1.9938 -3.239105 2.963545 
1 1 1    3    2   74 o  224.727   1.5323  2058.85   28.070  2045.58   41.658  2069.88   37.988  223.967   2.2818  225.305   2.0684 -1.337723 3.079798 
1 1 1    3    2   75 o  103.128   1.0810  433.524   9.0877  425.251   13.334  440.699   12.418  102.131   1.6017  103.972   1.4653 -1.840958 2.170803 
1 1 1    3    2   76 o   60.112   1.2234  147.300   5.9948  144.563   8.7098  149.763   8.2635   59.518   1.7973   60.585   1.6749 -1.066868 2.456738 
1 1 1    3    2   77 o  131.544   1.1120  705.366   11.924  701.853   17.552  708.376   16.248  131.205   1.6412  131.816   1.5122 -0.6115417 2.231605 
1 1 1    3    2   78 o  330.680   1.8176  4458.63   48.993  4457.00   72.565  4459.99   66.415  330.538   2.6932  330.673   2.4640 -0.1352539 3.650285 
1 1 1    3    2   79 o   98.383   1.1056  394.566   8.8669  385.962   12.916  402.237   12.195   97.296   1.6285   99.328   1.5061 -2.032669 2.218212 
1 1 1    3    2   80 o  163.812   1.2631  1093.93   16.866  1082.96   26.698  1101.22   21.758  162.962   2.0098  164.345   1.6242 -1.383133 2.584039 
1 1 1    3    2   81 o   84.816   1.1512  293.252   7.9594  289.707   11.582  296.424   10.957   84.293   1.6856   85.266   1.5764 -0.9736328 2.307870 
1 1 1    3    2   82 o  254.500   1.5815  2640.83   32.809  2624.19   51.369  2652.29   42.638  253.628   2.4847  255.019   2.0511 -1.391052 3.221902 
1 1 1    3    2   83 o  148.082   1.2370  893.947   14.932  898.351   23.240  890.851   19.487  148.421   1.9209  147.813   1.6173 0.6085358 2.511064 
1 1 1    3    2   84 o   60.649   1.4752  149.972   7.2931  140.770   10.852  157.553   9.8492   58.701   2.2721   62.124   1.9473 -3.423607 2.992444 
1 1 1    3    2   85 o  202.240   1.6097  1667.77   26.536  1684.36   36.919  1650.03   38.168  203.203   2.2289  201.113   2.3282 2.089371 3.223086 
1 1 1    3    2   86 o   34.315   2.4069   48.276   6.6897   56.010   9.8449   41.642   9.1181   36.888   3.3092   31.728   3.5885 5.160585 4.881373 
1 1 1    3    2   87 o   18.065   4.1799   13.880   6.0331   11.420   8.7791   16.082   8.3047   16.997   5.5291   19.471   5.1529 -2.474497 7.558021 
1 1 1    3    2   88 o  211.871   1.4390  1830.33   24.852  1773.59   38.158  1872.13   32.751  208.498   2.2451  214.245   1.8753 -5.747208 2.925316 
1 1 1    3    2   89 o  164.114   1.3626  1098.18   18.229  1094.79   30.956  1099.98   22.554  163.797   2.3184  164.231   1.6848 -0.4337616 2.865944 
1 1 1    3    2   90 o   87.697   1.2767  313.578   9.1267  296.525   13.927  326.415   12.083   85.255   2.0040   89.462   1.6569 -4.207291 2.600236 
1 1 1    3    2   91 o   29.590   2.5031   35.996   5.9809   23.403   8.8341   46.652   8.1266   23.475   4.7792   33.662   2.9928 -10.18691 5.638888 
1 1 1    3    2   92 o  123.013   1.2336  617.002   12.370  628.068   19.410  609.434   16.052  124.075   1.9191  122.238   1.6110 1.836349 2.505654 
1 1 1    3    2   93 o   53.543   1.6750  117.055   7.3017  119.569   10.630  114.810   10.047   54.063   2.4183   52.981   2.3320 1.081776 3.359524 
1 1 1    3    2   94 o   53.333   1.6555  116.144   7.1885  111.424   10.251  120.711   10.084   52.182   2.4165   54.329   2.2820 -2.146660 3.323680 
1 1 1    3    2   95 o   57.485   1.5403  134.887   7.2109  146.067   10.083  123.186   10.316   59.786   2.0722   54.878   2.3112 4.907272 3.104175 
1 1 1    3    2   96 o  110.496   1.2415  497.902   11.183  488.412   15.591  507.957   16.048  109.408   1.7482  111.575   1.7645 -2.166512 2.483861 
1 1 1    3    2   97 o   37.276   1.9996   56.884   6.0536   55.789   8.7309   57.897   8.4006   36.819   2.9333   37.533   2.7652 -0.7132912 4.031166 
1 1 1    3    2   98 o   50.584   1.6080  104.507   6.6221  115.410   9.5879   94.562   9.1570   53.111   2.2195   48.054   2.3447 5.056812 3.228645 
1 1 1    3    2   99 o   46.268   1.8833   87.538   7.0880   89.299   10.503   86.065   9.6049   46.643   2.7750   45.810   2.5826 0.8333206 3.790870 
1 1 1    3    2  100 o  175.003   1.3763  1249.45   19.633  1252.76   31.136  1247.27   25.296  175.106   2.1814  174.793   1.7754 0.3125916 2.812541 
1 1 1    3    2  101 o   48.503   2.1057   96.304   8.3053   91.461   12.389  100.257   11.193   47.121   3.2452   49.410   2.7904 -2.289165 4.279926 
1 1 1    3    2  102 o   61.780   1.7062  155.966   8.5840  171.318   13.004  144.109   11.428   64.663   2.4716   59.311   2.3684 5.351536 3.423185 
1 1 1    3    2  103 o   72.843   1.4910  216.596   8.8533  220.654   13.530  213.557   11.708   73.415   2.2635   72.260   1.9896 1.154602 3.013621 
1 1 1    3    2  104 o   60.453   1.5959  149.342   7.8572  144.548   12.176  152.762   10.285   59.356   2.5223   61.087   2.0685 -1.731300 3.262022 
1 1 1    3    2  105 o  100.858   1.4134  415.310   11.620  410.049   16.761  420.180   16.124  100.123   2.0537  101.370   1.9513 -1.247025 2.832880 
1 1 1    3    2  106 o   45.347   1.8002   84.201   6.6413   85.014   8.8185   83.135   10.095   45.487   2.3867   44.917   2.7706 0.5699654 3.656828 
1 1 1    3    2  107 o   26.498   2.7582   29.151   5.8705   29.505   7.7252   28.667   9.0311   26.475   3.6789   25.911   4.4353 0.5641098 5.762451 
1 1 1    3    2  108 o  119.470   1.2478  582.795   12.152  570.841   16.761  596.042   17.644  118.137   1.7406  120.704   1.7933 -2.566437 2.499079 
1 1 1    3    2  109 o   41.514   1.7607   70.647   5.9447   73.597   8.5668   67.907   8.2560   42.252   2.4985   40.578   2.5082 1.673584 3.540295 
1 1 1    3    2  110 o   58.238   1.4189  138.634   6.7358  137.261   9.7177  139.904   9.3449   57.820   2.0651   58.395   1.9660 -0.5746918 2.851294 
1 1 1    3    2  111 o   43.311   1.7065   76.920   6.0131   74.680   8.6341   79.030   8.3792   42.527   2.5017   43.783   2.3565 -1.256424 3.436806 
1 1 1    3    2  112 o   67.913   1.3268  188.535   7.3449  181.796   10.627  194.699   10.163   66.543   1.9613   68.903   1.8111 -2.359558 2.669550 
1 1 1    3    2  113 o   35.118   2.0558   50.823   5.8593   45.478   9.0940   54.616   7.6615   32.882   3.4438   36.292   2.6072 -3.409931 4.319428 
1 1 1    3    2  114 o   51.241   1.5802  107.640   6.5923  110.965   10.279  105.317   8.5923   51.819   2.4402   50.574   2.0887 1.245377 3.212079 
1 1 1    3    2  115 o   35.630   2.0511   52.368   5.9319   46.644   9.1670   56.491   7.7804   33.256   3.4308   36.878   2.6049 -3.622311 4.307646 
1 1 1    3    2  116 o   58.625   1.4095  140.705   6.7358  140.824   9.8420  140.599   9.2383   58.465   2.0684   58.455   1.9415 0.9513855E-02 2.836854 
1 1 1    3    2  117 o   18.303   3.7871   14.593   5.4637   12.576   7.4109   16.996   8.0868   16.900   5.0168   19.484   5.0505 -2.583448 7.118718 
1 1 1    3    2  118 o   32.918   2.2044   44.892   5.8810   41.836   7.9611   48.562   8.7253   31.508   3.1415   33.952   3.1901 -2.443146 4.477215 
1 1 1    3    2  119 o   66.854   1.4096  183.134   7.6819  193.475   10.524  171.341   11.239   68.548   1.8853   64.408   2.1436 4.139458 2.854692 
1 1 1    3    2  120 o   11.047   4.3320   3.4162   5.6852   6.0366   7.0605  -1.4153   9.5873   13.093   4.9033   11.682   5.1533 1.411677 7.113317 
1 1 1    3    2  121 o   62.176   1.5426  158.738   7.8182  154.219   10.027  165.745   12.486   61.092   2.0163   63.143   2.4303 -2.050911 3.157857 
1 1 1    3    2  122 o   49.538   1.6480  101.057   6.6456   99.749   9.0841  102.563   9.7476   48.987   2.2812   49.616   2.4174 -0.6284828 3.323789 
1 1 1    3    2  123 o   12.344   4.3306   6.1110   5.3890   7.4172   7.4560   4.6823   7.7978   13.801   5.0626   12.670   5.0405 1.130445 7.143944 
1 1 1    3    2  124 o   41.336   2.2365   71.248   7.5077   92.528   14.451   63.381   8.7865   46.126   3.8793   38.731   2.8020 7.395271 4.785453 
1 1 1    3    2  125 o   15.905   4.3419   11.533   5.7859   15.902   10.179   9.4475   7.0325   18.299   5.9537   14.667   4.9549 3.632006 7.745790 
1 1 1    3    2  126 o   23.302   3.2082   23.568   5.9322   24.060   10.172   23.314   7.3027   22.300   5.6035   22.766   4.0853 -0.4658127 6.934629 
1 1 1    3    2  127 o   21.369   3.5610   20.236   5.9846   20.793   10.487   19.968   7.2879   20.438   5.9412   20.795   4.4348 -0.3569279 7.413820 
1 1 1    3    2  128 o   41.933   2.4142   74.141   8.2173   77.891   12.007   70.836   11.270   42.208   3.5219   40.284   3.4657 1.924595 4.941146 
1 1 1    3    2  129 o   14.618   5.2893   9.4119   8.0990   4.6115   10.168   17.744   13.396   13.328   5.5789   18.700   6.7972 -5.372063 8.793546 
1 1 1    3    2  130 o   14.058   5.2821   8.2502   8.2077  -1.0588   10.150   25.835   13.951   11.621   5.2035   21.817   6.9585 -10.19602 8.688963 
1 1 1    3    2  131 o   20.334   4.7681   19.754   7.7654   16.636   9.3168   26.848   14.054   18.233   5.6695   22.100   6.9764 -3.867697 8.989596 
1 1 1    3    2  132 o   17.236   5.8339   14.803   9.7493   21.339   11.217  -5.3903   19.716   20.186   6.2112   14.376   6.7296 5.810576 9.157823 
1 1 1    3    2  133 o   26.889   4.9736   34.697   10.500   41.227   12.036   13.901   21.480   29.106   5.2668   18.031   7.8393 11.07544 9.444258 
1 1 1    3    2  134 o   10.783   4.9274  -2.9518   9.6684 -11.1878   11.000   25.013   20.270   9.8842   4.7406   20.441   8.1283 -10.55667 9.409702 
1 1 1    3    2  135 o   26.931   4.5821   34.231   9.6992   47.514   12.589   14.829   15.215   31.329   5.1052   17.383   6.9979 13.94580 8.662216 
1 1 1    3    2  136 o   21.964   5.7944   25.015   10.522   27.889   14.697   21.993   15.072   21.933   7.1552   19.637   7.1988 2.295835 10.14988 
1 1 1    3    2  137 o   21.992   5.6969   25.016   10.294   24.218   14.521   25.823   14.595   20.438   7.1130   21.044   7.1378 -0.6063709 10.07685 
1 1 1    3    2  138 o   11.278   5.0775  -0.9634   9.8120   11.261   13.803 -13.4496   13.950   15.998   6.5807   10.916   5.2619 5.081905 8.425748 
1 1 1    3    2  139 o   8.7550   4.3258 -20.1463   11.276 -26.2382   19.053 -16.8624   13.989   11.516   5.6772   10.498   5.1091 1.018235 7.637688 
1 1 1    3    3    0 o  468.930   4.0007  8963.71  152.927  9074.38  218.432  8857.31  214.174  471.780   5.6799  466.104   5.6370 5.675781 8.002303 
1 1 1    3    3    1 f  324.496   2.0525  4292.00   54.291  4335.08   77.367  4250.22   76.204  326.107   2.9104  322.900   2.8952 3.207306 4.105181 
1 1 1    3    3    2 o  591.395   3.5086 14258.15  169.143 14101.72  236.977 14420.59  241.494  588.075   4.9435  594.684   4.9818 -6.609436 7.018317 
1 1 1    3    3    3 o  202.818   1.5528  1676.64   25.672  1631.88   38.627  1712.05   34.357  200.087   2.3683  204.945   2.0566 -4.858337 3.136630 
1 1 1    3    3    4 o  353.484   2.5460  5093.29   73.361  5156.03  128.368  5062.87   89.398  355.609   4.4284  352.415   3.1120 3.193359 5.412515 
1 1 1    3    3    5 o  613.972   4.1978 15369.27  210.091 15591.49  368.427 15262.19  255.748  618.179   7.3114  611.778   5.1284 6.400635 8.930699 
1 1 1    3    3    6 o  278.201   2.0961  3154.72   47.535  3165.22   82.699  3149.54   58.090  278.639   3.6410  277.966   2.5637 0.6725769 4.453066 
1 1 1    3    3    7 o  568.865   3.6157 13192.88  167.661 13087.04  254.386 13274.16  222.932  566.480   5.5090  570.558   4.7933 -4.077881 7.302401 
1 1 1    3    3    8 o  480.403   3.0928  9408.12  121.115  9529.71  186.953  9320.18  158.989  483.432   4.7442  478.117   4.0794 5.315002 6.256889 
1 1 1    3    3    9 o  708.423   4.4556 20463.24  257.298 20109.18  386.972 20743.81  344.474  702.075   6.7618  713.148   5.9257 -11.07281 8.990854 
1 1 1    3    3   10 o  598.917   3.7959 14624.31  185.320 14710.81  284.499 14560.56  244.245  600.558   5.8115  597.540   5.0145 3.018494 7.675832 
1 1 1    3    3   11 o  351.785   2.5367  5044.58   72.742  5100.87  103.792  4990.24  101.978  353.716   3.5998  349.861   3.5758 3.855865 5.073934 
1 1 1    3    3   12 o  201.921   1.6755  1661.88   27.578  1668.71   39.102  1655.12   38.902  202.329   2.3709  201.504   2.3684 0.8254852 3.351148 
1 1 1    3    3   13 o  287.272   2.1511  3363.89   50.372  3445.07   72.439  3287.87   70.093  290.701   3.0570  283.992   3.0278 6.709076 4.302642 
1 1 1    3    3   14 o  294.447   2.1924  3534.05   52.622  3539.56   74.482  3528.56   74.357  294.659   3.1009  294.200   3.1006 0.4581299 4.385132 
1 1 1    3    3   15 o  338.078   2.6912  4659.29   74.164  4644.38  117.165  4669.26   95.800  337.489   4.2589  338.418   3.4728 -0.9293213 5.495329 
1 1 1    3    3   16 o  660.010   4.9345 17765.74  265.477 17005.91  329.890 19162.14  447.214  645.615   6.2684  685.101   8.0080 -39.48602 10.16965 
1 1 1    3    3   17 f  546.277   4.6067 12169.63  205.136 11855.33  283.787 12513.58  296.868  539.029   6.4587  553.780   6.5764 -14.75104 9.217588 
1 1 1    3    3   18 o  452.249   3.8721  8339.49  142.746  8493.40  205.072  8194.82  198.819  456.308   5.5133  448.220   5.4416 8.087555 7.746499 
1 1 1    3    3   19 o  281.090   2.5842  3220.90   59.211  3266.21   84.780  3177.75   82.732  283.034   3.6747  279.176   3.6355 3.857544 5.169136 
1 1 1    3    3   20 o  505.479   3.8387 10418.03  158.170 10871.42  258.940 10148.17  199.771  516.201   6.1538  498.827   4.9130 17.37411 7.874461 
1 1 1    3    3   21 o  476.753   4.0707  9267.97  158.196  9114.71  220.353  9430.98  227.254  472.694   5.7188  480.819   5.7982 -8.125000 8.143925 
1 1 1    3    3   22 f  366.825   2.8821  5485.51   86.180  5694.01  140.239  5359.00  109.242  373.668   4.6041  362.544   3.6965 11.12347 5.904408 
1 1 1    3    3   23 f  121.631   1.3312  602.994   13.198  574.160   18.363  633.805   18.982  118.684   1.8981  124.697   1.8675 -6.012505 2.662735 
1 1 1    3    3   24 o  159.667   1.4768  1039.11   19.221  991.864   26.586  1090.85   27.822  155.991   2.0908  163.590   2.0864 -7.598572 2.953704 
1 1 1    3    3   25 o   98.764   1.3181  397.574   10.612  399.657   15.674  395.811   14.419   99.020   1.9419   98.543   1.7950 0.4769516 2.644450 
1 1 1    3    3   26 o  682.556   4.6499 18997.06  258.713 18845.42  363.535 19152.67  368.260  679.668   6.5617  685.183   6.5935 -5.514954 9.302094 
1 1 1    3    3   27 o  788.653   5.8562 25367.54  376.474 24944.05  478.842 26053.06  609.229  781.867   7.5132  798.809   9.3562 -16.94153 11.99946 
1 1 1    3    3   28 o  191.452   1.8277  1494.01   28.523  1458.87   36.399  1549.91   45.913  189.183   2.3603  194.992   2.8885 -5.808365 3.730272 
1 1 1    3    3   29 o  784.214   5.3146 25077.84  339.735 25015.34  415.206 25204.44  590.959  783.140   6.5041  785.800   9.2259 -2.660095 11.28810 
1 1 1    3    3   30 o  608.466   3.8631 15093.28  191.607 15173.71  254.530 14988.08  291.081  610.029   5.1186  606.244   5.8902 3.784973 7.803504 
1 1 1    3    3   31 o  408.445   2.9027  6800.31   96.645  6756.17  136.234  6845.02  137.123  407.091   4.1054  409.759   4.1053 -2.668335 5.805859 
1 1 1    3    3   32 o  1049.27   6.5449 44899.82  559.792 43842.22  724.090 46470.97  882.552  1036.61   8.5692  1067.01   10.147 -30.40015 13.28127 
1 1 1    3    3   33 o  303.204   2.0992  3747.15   51.882  3722.57   68.368  3780.52   79.666  302.201   2.7754  304.539   3.2092 -2.337708 4.242809 
1 1 1    3    3   34 o  322.395   2.3856  4236.56   62.694  4182.83   75.974  4351.22  110.994  320.338   2.9095  326.704   4.1678 -6.365540 5.082911 
1 1 1    3    3   35 o  489.980   3.4175  9786.46  136.496  9865.25  168.234  9634.68  233.502  491.930   4.1954  486.096   5.8930 5.834595 7.233831 
1 1 1    3    3   36 o  162.191   1.5468  1072.19   20.450  1076.19   25.044  1064.17   35.426  162.492   1.8908  161.579   2.6897 0.9133301 3.287756 
1 1 1    3    3   37 o  284.444   2.3699  3297.83   54.948  3289.58   70.708  3310.41   87.308  284.082   3.0535  284.971   3.7585 -0.8894348 4.842533 
1 1 1    3    3   38 o  806.939   5.4651 26548.74  359.480 26380.38  505.245 26721.36  511.579  804.233   7.7070  809.411   7.7537 -5.177368 10.93237 
1 1 1    3    3   39 o  715.661   4.8709 20880.76  284.152 20918.12  402.257 20843.55  401.447  716.198   6.8902  714.920   6.8887 1.277710 9.743147 
1 1 1    3    3   40 o  172.112   1.6072  1207.37   22.549  1200.85   31.408  1214.31   32.393  171.644   2.2448  172.603   2.3023 -0.9588776 3.215548 
1 1 1    3    3   41 f  283.955   2.3858  3286.52   55.223  3236.07   85.843  3322.13   72.130  281.752   3.7377  285.482   3.0996 -3.729828 4.855672 
1 1 1    3    3   42 o  740.766   5.5179 22373.83  333.192 22699.34  533.037 22165.07  426.864  745.911   8.7667  737.207   7.1034 8.704224 11.28327 
1 1 1    3    3   43 o  815.258   5.5248 27100.26  367.155 26797.01  445.260 27744.48  648.983  810.604   6.7386  824.547   9.6557 -13.94287 11.77456 
1 1 1    3    3   44 o  213.115   1.8136  1851.20   31.507  1842.52   38.412  1869.04   55.077  212.613   2.2164  214.130   3.1554 -1.517151 3.856055 
1 1 1    3    3   45 o  112.005   1.5563  511.322   14.209  495.067   16.767  552.740   26.765  110.209   1.8664  116.448   2.8197 -6.238976 3.381436 
1 1 1    3    3   46 o  251.515   1.8812  2578.44   38.568  2570.08   50.635  2589.99   59.523  251.102   2.4738  252.069   2.8969 -0.9664612 3.809399 
1 1 1    3    3   47 o  196.154   2.1745  1568.31   34.769  1568.31   34.769   0.0000   0.0000  196.154   2.1745  ?   ?  0.000000 2.174482 
1 1 1    3    3   48 o  430.248   2.8433  7545.72   99.720  7747.03  134.493  7299.92  148.612  435.928   3.7849  423.148   4.3085 12.78052 5.734827 
1 1 1    3    3   49 o  316.519   2.0727  4083.54   53.477  4116.86   75.703  4050.36   75.552  317.796   2.9223  315.219   2.9404 2.577362 4.145546 
1 1 1    3    3   50 f  607.198   3.8688 15030.78  191.489 14885.35  251.207 15232.50  295.849  604.194   5.1006  611.149   5.9386 -6.954956 7.828368 
1 1 1    3    3   51 o  108.242   1.4072  477.543   12.416  468.148   16.181  490.992   19.361  107.170   1.8523  109.753   2.1641 -2.582321 2.848506 
1 1 1    3    3   52 o  315.282   2.1894  4051.77   56.267  4002.59   73.714  4120.44   87.099  313.351   2.8859  317.921   3.3609 -4.570313 4.429913 
1 1 1    3    3   53 o  731.820   4.9796 21839.74  297.054 21643.50  416.604 22042.70  423.681  728.332   7.0171  735.012   7.0715 -6.679993 9.962199 
1 1 1    3    3   54 o  103.544   1.3237  436.993   11.172  472.833   15.791  401.073   15.809  107.705   1.7986   99.195   1.9551 8.509743 2.656618 
1 1 1    3    3   55 o  251.992   1.7472  2588.30   35.890  2548.59   49.973  2630.61   51.578  250.042   2.4518  254.033   2.4908 -3.991440 3.495043 
1 1 1    3    3   56 o  364.393   2.1702  5412.59   64.461  5301.15   94.994  5507.69   87.758  360.592   3.2318  367.560   2.9290 -6.967499 4.361619 
1 1 1    3    3   57 o  511.794   2.9145 10678.61  121.588 10773.61  183.570 10604.36  162.293  513.978   4.3815  509.957   3.9042 4.021088 5.868568 
1 1 1    3    3   58 o  307.575   1.8967  3856.23   47.554  3819.84   70.770  3886.19   64.210  306.096   2.8363  308.752   2.5513 -2.655151 3.814935 
1 1 1    3    3   59 o  434.802   2.3916  7707.00   84.763  7558.26  131.848  7811.79  110.663  430.517   3.7571  437.715   3.1015 -7.198853 4.871848 
1 1 1    3    3   60 f  184.413   1.3652  1386.19   20.522  1374.70   30.875  1395.29   27.468  183.637   2.0626  185.011   1.8213 -1.373901 2.751651 
1 1 1    3    3   61 o   79.723   1.3066  259.065   8.4910  298.338   12.761  227.860   11.375   85.549   1.8299   74.765   1.8664 10.78489 2.613778 
1 1 1    3    3   62 o  369.182   2.1888  5556.41   65.869  5549.05   98.845  5562.29   88.343  368.880   3.2872  369.341   2.9343 -0.4607239 4.406394 
1 1 1    3    3   63 o  207.338   1.4526  1752.33   24.550  1741.18   36.878  1761.21   32.900  206.661   2.1891  207.853   1.9418 -1.191849 2.926207 
1 1 1    3    3   64 f   47.317   1.4525   91.349   5.5958   89.817   9.1476   92.264   7.0738   46.874   2.4021   47.539   1.8289 -0.6649780 3.019075 
1 1 1    3    3   65 o  180.640   1.2868  1330.09   18.947  1360.23   30.511  1311.18   24.173  182.659   2.0492  179.344   1.6535 3.314835 2.633117 
1 1 1    3    3   66 o  162.225   1.2319  1072.74   16.290  1090.50   26.146  1061.47   20.827  163.548   1.9612  161.365   1.5833 2.183289 2.520550 
1 1 1    3    3   67 o  279.356   1.7667  3181.50   40.230  3215.52   70.536  3165.09   48.978  280.773   3.0819  278.617   2.1565 2.155396 3.761486 
1 1 1    3    3   68 o  244.041   1.7117  2427.97   34.050  2400.20   55.412  2444.81   43.159  242.589   2.8022  244.867   2.1623 -2.278015 3.539444 
1 1 1    3    3   69 o   22.264   3.0134   20.588   5.3285   22.162   9.3106   19.821   6.4979   22.842   5.1266   21.722   3.8086 1.120127 6.386507 
1 1 1    3    3   70 o  120.099   1.2938  587.974   12.666  566.630   20.832  600.493   15.954  117.882   2.1679  121.366   1.6126 -3.483688 2.701941 
1 1 1    3    3   71 o  123.659   1.2290  623.336   12.389  612.255   18.644  632.097   16.578  122.542   1.8665  124.517   1.6333 -1.975029 2.480180 
1 1 1    3    3   72 o  323.657   1.9794  4271.24   52.221  4278.58   78.555  4265.43   69.903  323.851   2.9757  323.384   2.6518 0.4672241 3.985860 
1 1 1    3    3   73 o   95.809   1.3407  374.200   10.471  371.525   14.521  377.096   15.112   95.457   1.8662   96.169   1.9277 -0.7118759 2.683056 
1 1 1    3    3   74 o  122.078   1.2230  607.509   12.170  617.081   21.274  602.852   14.838  123.015   2.1215  121.604   1.4969 1.410835 2.596457 
1 1 1    3    3   75 o  121.143   1.2254  598.247   12.100  592.811   20.889  600.992   14.845  120.570   2.1254  121.415   1.4999 -0.8453903 2.601383 
1 1 1    3    3   76 o  186.657   1.3118  1420.32   19.959  1424.56   31.279  1417.41   25.922  186.907   2.0530  186.452   1.7055 0.4545441 2.669042 
1 1 1    3    3   77 o   76.575   1.2926  239.041   8.0685  251.138   14.123  233.180   9.8307   78.442   2.2110   75.626   1.5947 2.815414 2.726067 
1 1 1    3    3   78 o  145.175   1.1465  859.145   13.567  845.599   19.791  871.155   18.635  144.012   1.6859  146.176   1.5639 -2.163742 2.299583 
1 1 1    3    3   79 o  105.686   1.1107  455.314   9.5682  452.310   13.916  458.008   13.177  105.326   1.6208  105.990   1.5252 -0.6635208 2.225607 
1 1 1    3    3   80 o  425.800   2.2499  7394.89   78.091  7139.26  112.606  7631.73  108.390  418.202   3.3032  432.430   3.0750 -14.22827 4.512948 
1 1 1    3    3   81 o  215.405   1.5107  1891.75   26.526  1856.64   44.760  1910.76   32.933  213.327   2.5740  216.465   1.8664 -3.137558 3.179464 
1 1 1    3    3   82 o   63.374   1.5892  163.858   8.2030  167.813   11.893  160.268   11.330   64.100   2.2797   62.644   2.2222 1.456062 3.183583 
1 1 1    3    3   83 o  197.303   1.5601  1587.26   25.091  1577.78   39.938  1593.44   32.250  196.651   2.4914  197.661   2.0016 -1.009857 3.195879 
1 1 1    3    3   84 o   45.445   2.8323   84.616   10.440   70.139   16.464   94.352   13.502   41.094   5.0191   47.939   3.4788 -6.845150 6.106812 
1 1 1    3    3   85 o  109.949   1.3605  492.865   12.194  487.455   17.356  498.139   17.136  109.325   1.9475  110.518   1.9021 -1.193275 2.722298 
1 1 1    3    3   86 o  192.674   1.4765  1513.68   23.190  1492.42   30.295  1543.76   36.038  191.288   1.9429  194.525   2.2727 -3.237030 2.990008 
1 1 1    3    3   87 o   48.996   1.7326   98.026   6.9091  103.879   8.9911   89.588   10.797   50.412   2.1932   46.759   2.8461 3.653690 3.593136 
1 1 1    3    3   88 o   72.063   1.3799  211.744   8.1055  211.170   10.754  212.499   12.333   71.930   1.8356   72.141   2.0995 -0.2106857 2.788824 
1 1 1    3    3   89 o  144.836   1.3336  855.357   15.745  841.289   20.571  875.254   24.465  143.618   1.7572  146.469   2.0491 -2.850876 2.699324 
1 1 1    3    3   90 o   94.904   1.3205  367.254   10.215  360.939   14.727  373.110   14.181   94.061   1.9208   95.638   1.8190 -1.577393 2.645445 
1 1 1    3    3   91 o   78.016   1.3396  248.194   8.5189  252.577   11.602  243.066   12.549   78.686   1.8088   77.157   1.9969 1.528992 2.694326 
1 1 1    3    3   92 o   98.523   1.2644  395.811   10.154  397.272   13.959  394.169   14.799   98.684   1.7352   98.292   1.8470 0.3919754 2.534274 
1 1 1    3    3   93 o   21.699   3.3438   19.704   5.7248   27.023   7.7426   10.878   8.5029   25.405   3.8601   16.601   5.4441 8.804117 6.673749 
1 1 1    3    3   94 o  103.043   1.2032  432.967   10.106  436.038   14.510  430.073   14.084  103.381   1.7219  102.674   1.6828 0.7071991 2.407606 
1 1 1    3    3   95 o   28.073   2.5616   32.464   5.7973   32.333   7.8853   32.618   8.5527   27.880   3.5501   27.955   3.8558 -0.7507133E-01 5.241239 
1 1 1    3    3   96 o   65.979   1.4734  177.578   7.9245  176.110   11.279  179.009   11.136   65.642   2.1106   66.185   2.0667 -0.5424042 2.953985 
1 1 1    3    3   97 o   60.184   1.5128  147.866   7.4157  156.979   10.269  137.934   10.721   61.972   2.0355   58.066   2.2694 3.906197 3.048490 
1 1 1    3    3   98 o  108.879   1.2582  483.524   11.167  479.268   15.612  487.983   15.979  108.360   1.7674  109.339   1.7928 -0.9784470 2.517547 
1 1 1    3    3   99 o  141.644   1.4295  818.574   16.506  813.197   23.293  823.997   23.392  141.103   2.0251  142.038   2.0203 -0.9346161 2.860591 
1 1 1    3    3  100 o   81.236   1.5840  269.351   10.489  274.629   15.641  265.038   14.140   81.925   2.3446   80.505   2.1567 1.419830 3.185667 
1 1 1    3    3  101 o   9.3976   4.1265  -1.5264   6.0816   1.3133   7.7538  -6.0664   9.8040   11.744   4.8906   10.941   4.9852 0.8031864 6.983578 
1 1 1    3    3  102 o   80.468   1.2861  264.208   8.4358  271.124   12.118  257.705   11.750   81.467   1.8248   79.427   1.8149 2.040756 2.573650 
1 1 1    3    3  103 o   70.985   1.3721  205.665   7.9395  211.330   10.929  199.335   11.554   71.888   1.8666   69.795   2.0329 2.093102 2.759863 
1 1 1    3    3  104 f  137.589   1.3477  772.765   15.115  794.162   19.993  744.221   23.092  139.406   1.7593  134.876   2.1003 4.529816 2.739818 
1 1 1    3    3  105 o   68.150   1.4195  189.654   7.8859  192.274   10.712  186.554   11.651   68.539   1.9193   67.479   2.1209 1.059761 2.860374 
1 1 1    3    3  106 o   35.955   2.0801   53.104   6.0704   48.289   8.1792   59.008   9.0574   34.137   2.9688   37.762   2.9663 -3.624752 4.196736 
1 1 1    3    3  107 o   73.631   1.3628  221.444   8.1796  223.556   11.217  219.046   11.953   73.889   1.8639   73.112   2.0075 0.7769089 2.739426 
1 1 1    3    3  108 o   44.755   1.8149   82.115   6.6074   80.449   9.3708   83.762   9.3180   44.159   2.6150   45.077   2.5463 -0.9171982 3.649866 
1 1 1    3    3  109 f   53.787   1.6417  118.471   7.1893  120.548   10.386  116.560   9.9616   54.121   2.3599   53.229   2.3013 0.8918495 3.296221 
1 1 1    3    3  110 o   91.499   1.4326  342.314   10.685  349.406   14.801  334.595   15.442   92.312   1.9670   90.298   2.0979 2.014755 2.875819 
1 1 1    3    3  111 o   60.013   1.6481  147.570   8.0550  148.498   11.068  146.524   11.745   60.062   2.2648   59.618   2.4217 0.4435272 3.315745 
1 1 1    3    3  112 o   67.071   1.5639  184.162   8.5506  179.774   11.626  189.332   12.619   66.101   2.1606   67.799   2.2867 -1.698158 3.145977 
1 1 1    3    3  113 o   67.222   1.4758  184.963   8.0869  188.225   10.587  180.394   12.531   67.686   1.9207   66.139   2.3279 1.547668 3.017975 
1 1 1    3    3  114 o   32.238   2.3418   43.064   6.1121   55.074   8.0512   26.728   9.3901   36.377   2.7352   24.630   4.8497 11.74685 5.567831 
1 1 1    3    3  115 o   6.6962   3.2151  -7.1763   5.0909  -3.9716   6.9844 -10.8088   7.4360   9.2186   4.2032   7.9837   3.8466 1.234937 5.697645 
1 1 1    3    3  116 o   11.627   4.2551   4.7895   5.2624   7.0528   7.2909   2.3280   7.6033   13.790   5.0144   11.800   4.8720 1.989951 6.991450 
1 1 1    3    3  117 o   41.848   1.9837   72.227   6.7474   77.072   10.293   68.576   8.9347   42.927   2.9598   40.564   2.7178 2.363449 4.018323 
1 1 1    3    3  118 o   8.0297   3.6884  -3.6757   5.5125  -5.3902   8.0692  -2.1753   7.5485   9.6273   4.4368   10.142   4.5181 -0.5152044 6.332329 
1 1 1    3    3  119 o   27.566   2.7721   31.943   6.1447   22.312   9.2421   39.574   8.2261   22.159   5.2056   30.507   3.3637 -8.348221 6.197820 
1 1 1    3    3  120 o   83.614   1.5794  287.155   10.765  275.821   17.051  294.668   13.881   81.394   2.5731   84.497   2.0154 -3.103348 3.268437 
1 1 1    3    3  121 o   11.081   4.3688   3.4368   5.8093   11.270   9.3027  -1.5710   7.4380   16.256   5.6908   10.175   4.5114 6.081223 7.262086 
1 1 1    3    3  122 o   29.896   2.6101   37.604   6.2972   39.108   9.9627   36.603   8.1263   29.777   4.2228   29.142   3.4903 0.6357784 5.478497 
1 1 1    3    3  123 o   27.384   2.8647   31.875   6.3002   20.549   10.038   39.238   8.0928   20.749   5.7407   30.199   3.3435 -9.449924 6.643359 
1 1 1    3    3  124 o   30.348   2.6974   38.984   6.6034   43.432   10.225   35.802   8.6489   31.323   4.1033   28.557   3.8105 2.765778 5.599705 
1 1 1    3    3  125 o   15.073   4.6083   10.352   6.1868   8.2102   9.4378   11.966   8.1926   14.621   5.6234   16.142   5.3462 -1.520281 7.759184 
1 1 1    3    3  126 o   11.726   4.7131   3.9658   6.8897  -0.9276   9.5041   9.3854   10.002   11.431   5.0823   15.164   5.8000 -3.733027 7.711665 
1 1 1    3    3  127 o   26.951   3.3998   31.834   7.3032   32.058   9.8644   31.562   10.865   26.195   4.7964   25.576   5.3820 0.6194725 7.209056 
1 1 1    3    3  128 o   19.532   4.5804   17.941   7.1657   12.428   9.7219   24.498   10.603   16.285   5.8069   22.106   5.8094 -5.820101 8.213990 
1 1 1    3    3  129 o   15.257   5.4263   10.641   8.4841   8.4496   9.3276   21.141   20.416   14.442   5.5810   19.941   8.0781 -5.499063 9.818514 
1 1 1    3    3  130 o   17.731   5.4604   15.525   8.6666   14.060   9.5401   22.443   20.733   16.940   5.7705   20.134   8.1464 -3.194361 9.983088 
1 1 1    3    3  131 o   18.330   5.4639   16.763   8.7763   14.000   9.6576   29.860   21.028   16.854   5.8040   21.946   8.4058 -5.092007 10.21493 
1 1 1    3    3  132 o   42.983   3.0148   79.940   10.496   77.300   13.209   84.462   17.288   41.413   3.9611   41.972   5.1617 -0.5582619 6.506400 
1 1 1    3    3  133 o   18.760   5.6478   17.914   9.3421   9.7101   11.699   32.355   15.521   15.289   6.1428   23.687   7.3095 -8.398251 9.547920 
1 1 1    3    3  134 o   15.790   5.9127   11.803   10.266   15.383   11.838   0.9409   20.619   17.354   6.3768   15.399   7.0953 1.954399 9.539720 
1 1 1    3    3  135 o   16.485   5.9725   13.529   10.331   11.964   11.799   18.669   21.386   16.001   6.2507   18.737   7.9790 -2.735924 10.13582 
1 1 1    3    3  136 o   14.769   5.7753   9.5580   10.080   7.7938   11.517   15.334   20.841   14.471   5.9876   17.885   7.7491 -3.413497 9.792871 
1 1 1    3    3  137 o   14.040   5.7275   7.4634   10.347   4.6584   13.916   10.932   15.474   14.238   6.2473   16.166   6.8313 -1.928163 9.257225 
1 1 1    3    3  138 o   10.354   4.8356  -5.5758   10.081  -7.5579   13.843  -3.3378   14.709   11.768   5.5492   12.839   5.9430 -1.071503 8.130991 
1 1 1    4    0 -139 o   44.687   4.7158   90.011   16.698   90.011   16.698   90.011   16.698   44.687   4.7158   44.687   4.7158 -0.000000 0.000000 
1 1 1    4    0 -138 o   11.053   7.0569   5.2019   14.138   5.2019   14.138   5.2019   14.138   11.053   7.0569   11.053   7.0569 -0.000000 0.000000 
1 1 1    4    0 -137 o   11.456   6.8448   8.2763   11.328   8.2763   11.328   8.2763   11.328   11.456   6.8448   11.456   6.8448 0.000000 0.000000 
1 1 1    4    0 -136 o   7.8573   5.3697  -4.4576   10.791  -4.4576   10.791  -4.4576   10.791   7.8573   5.3697   7.8573   5.3697 0.000000 0.000000 
1 1 1    4    0 -135 o   14.487   7.5070   15.120   11.450   15.120   11.450   15.120   11.450   14.487   7.5070   14.487   7.5070 -0.000000 0.000000 
1 1 1    4    0 -134 o   12.579   7.1691   10.897   11.498   10.897   11.498   10.897   11.498   12.579   7.1691   12.579   7.1691 0.000000 0.000000 
1 1 1    4    0 -133 o   41.518   3.6265   74.642   12.048   74.642   12.048   74.642   12.048   41.518   3.6265   41.518   3.6265 -0.000000 0.000000 
1 1 1    4    0 -132 o   7.9296   5.3803  -3.5798   10.432  -3.5798   10.432  -3.5798   10.432   7.9296   5.3803   7.9296   5.3803 -0.000000 0.000000 
1 1 1    4    0 -131 o   8.2795   5.5159  -1.4134   10.070  -1.4134   10.070  -1.4134   10.070   8.2795   5.5159   8.2795   5.5159 -0.000000 0.000000 
1 1 1    4    0 -130 o   24.706   5.4699   29.861   9.6319   29.861   9.6319   29.861   9.6319   24.706   5.4699   24.706   5.4699 -0.000000 0.000000 
1 1 1    4    0 -129 o   10.151   6.1018   5.5663   9.1088   5.5663   9.1088   5.5663   9.1088   10.151   6.1018   10.151   6.1018 -0.000000 0.000000 
1 1 1    4    0 -128 o   8.9655   5.6755   2.4403   8.9186   2.4403   8.9186   2.4403   8.9186   8.9655   5.6755   8.9655   5.6755 0.000000 0.000000 
1 1 1    4    0 -127 o   8.0539   5.2988  -0.5316   8.8322  -0.5316   8.8322  -0.5316   8.8322   8.0539   5.2988   8.0539   5.2988 -0.000000 0.000000 
1 1 1    4    0 -126 o   76.974   2.1888  244.714   13.709  244.714   13.709  244.714   13.709   76.974   2.1888   76.974   2.1888 0.000000 0.000000 
1 1 1    4    0 -125 f   7.0583   4.7060  -1.7340   7.3543  -1.7340   7.3543  -1.7340   7.3543   7.0583   4.7060   7.0583   4.7060 0.000000 0.000000 
1 1 1    4    0 -124 o   20.010   5.4923   20.321   7.7451   20.321   7.7451   20.321   7.7451   20.010   5.4923   20.010   5.4923 0.000000 0.000000 
1 1 1    4    0 -123 o   24.755   4.2910   27.809   7.8797   27.809   7.8797   27.809   7.8797   24.755   4.2910   24.755   4.2910 0.000000 0.000000 
1 1 1    4    0 -122 o   14.532   6.2065   12.807   7.4925   12.807   7.4925   12.807   7.4925   14.532   6.2065   14.532   6.2065 -0.000000 0.000000 
1 1 1    4    0 -121 o   8.6765   5.3208   2.9463   7.2277   2.9463   7.2277   2.9463   7.2277   8.6765   5.3208   8.6765   5.3208 -0.000000 0.000000 
1 1 1    4    0 -120 o   17.905   5.7978   17.075   7.4787   17.075   7.4787   17.075   7.4787   17.905   5.7978   17.905   5.7978 -0.000000 0.000000 
1 1 1    4    0 -119 o   46.384   2.3907   89.032   8.9840   89.032   8.9840   89.032   8.9840   46.384   2.3907   46.384   2.3907 0.000000 0.000000 
1 1 1    4    0 -118 o   5.4332   3.8431  -8.4384   6.9656  -8.4384   6.9656  -8.4384   6.9656   5.4332   3.8431   5.4332   3.8431 0.000000 0.000000 
1 1 1    4    0 -117 o   9.7074   5.6161   5.0703   7.2134   5.0703   7.2134   5.0703   7.2134   9.7074   5.6161   9.7074   5.6161 0.000000 0.000000 
1 1 1    4    0 -116 f   14.220   6.1097   12.097   7.2547   12.097   7.2547   12.097   7.2547   14.220   6.1097   14.220   6.1097 0.000000 0.000000 
1 1 1    4    0 -115 o   13.676   6.7189   11.718   8.9130   11.718   8.9130   11.718   8.9130   13.676   6.7189   13.676   6.7189 -0.000000 0.000000 
1 1 1    4    0 -114 o   45.236   2.9975   85.203   10.940   85.203   10.940   85.203   10.940   45.236   2.9975   45.236   2.9975 0.000000 0.000000 
1 1 1    4    0 -113 o   34.627   3.6431   51.015   9.9978   51.015   9.9978   51.015   9.9978   34.627   3.6431   34.627   3.6431 -0.000000 0.000000 
1 1 1    4    0 -112 o   60.450   2.2188  150.136   10.900  150.136   10.900  150.136   10.900   60.450   2.2188   60.450   2.2188 0.000000 0.000000 
1 1 1    4    0 -111 o   89.134   1.7932  324.995   13.017  324.995   13.017  324.995   13.017   89.134   1.7932   89.134   1.7932 -0.000000 0.000000 
1 1 1    4    0 -110 o   39.356   2.6482   64.282   8.4060   64.282   8.4060   64.282   8.4060   39.356   2.6482   39.356   2.6482 -0.000000 0.000000 
1 1 1    4    0 -109 o  109.279   1.7549  488.027   15.623  488.027   15.623  488.027   15.623  109.279   1.7549  109.279   1.7549 -0.000000 0.000000 
1 1 1    4    0 -108 f   13.971   6.1678   11.634   7.3769   11.634   7.3769   11.634   7.3769   13.971   6.1678   13.971   6.1678 0.000000 0.000000 
1 1 1    4    0 -107 o   10.640   5.8478   6.5535   7.3153   6.5535   7.3153   6.5535   7.3153   10.640   5.8478   10.640   5.8478 -0.000000 0.000000 
1 1 1    4    0 -106 o   11.450   5.9786   7.9060   7.3011   7.9060   7.3011   7.9060   7.3011   11.450   5.9786   11.450   5.9786 0.000000 0.000000 
1 1 1    4    0 -105 o   67.923   1.9596  188.799   10.829  188.799   10.829  188.799   10.829   67.923   1.9596   67.923   1.9596 -0.000000 0.000000 
1 1 1    4    0 -104 f   17.086   6.2682   16.031   8.0609   16.031   8.0609   16.031   8.0609   17.086   6.2682   17.086   6.2682 -0.000000 0.000000 
1 1 1    4    0 -103 o   64.416   2.0584  169.877   10.783  169.877   10.783  169.877   10.783   64.416   2.0584   64.416   2.0584 0.000000 0.000000 
1 1 1    4    0 -102 o   5.8084   4.1108 -10.1125   8.0091 -10.1125   8.0091 -10.1125   8.0091   5.8084   4.1108   5.8084   4.1108 0.000000 0.000000 
1 1 1    4    0 -101 o  100.573   1.8522  413.060   15.173  413.060   15.173  413.060   15.173  100.573   1.8522  100.573   1.8522 -0.000000 0.000000 
1 1 1    4    0 -100 o  164.803   1.8739  1108.35   25.166  1108.35   25.166  1108.35   25.166  164.803   1.8739  164.803   1.8739 0.000000 0.000000 
1 1 1    4    0  -99 o   70.725   2.1710  204.661   12.489  204.661   12.489  204.661   12.489   70.725   2.1710   70.725   2.1710 -0.000000 0.000000 
1 1 1    4    0  -98 o  178.056   1.8974  1293.58   27.532  1293.58   27.532  1293.58   27.532  178.056   1.8974  178.056   1.8974 0.000000 0.000000 
1 1 1    4    0  -97 o   22.899   5.4467   24.758   8.8238   24.758   8.8238   24.758   8.8238   22.899   5.4467   22.899   5.4467 -0.000000 0.000000 
1 1 1    4    0  -96 o   71.371   2.0782  208.295   12.067  208.295   12.067  208.295   12.067   71.371   2.0782   71.371   2.0782 -0.000000 0.000000 
1 1 1    4    0  -95 o   39.262   4.0183   64.939   12.526   64.939   12.526   64.939   12.526   39.262   4.0183   39.262   4.0183 -0.000000 0.000000 
1 1 1    4    0  -94 o  176.038   2.4488  1264.95   35.125  1264.95   35.125  1264.95   35.125  176.038   2.4488  176.038   2.4488 0.000000 0.000000 
1 1 1    4    0  -93 o  139.765   2.3089  797.421   26.289  797.421   26.289  797.421   26.289  139.765   2.3089  139.765   2.3089 0.000000 0.000000 
1 1 1    4    0  -92 o  260.038   3.0088  2760.39   63.758  2760.39   63.758  2760.39   63.758  260.038   3.0088  260.038   3.0088 -0.000000 0.000000 
1 1 1    4    0  -91 o   52.562   3.3333  114.106   14.148  114.106   14.148  114.106   14.148   52.562   3.3333   52.562   3.3333 -0.000000 0.000000 
1 1 1    4    0  -90 o   89.821   2.5095  329.831   18.341  329.831   18.341  329.831   18.341   89.821   2.5095   89.821   2.5095 0.000000 0.000000 
1 1 1    4    0  -89 o  165.129   2.0497  1112.36   27.581  1112.36   27.581  1112.36   27.581  165.129   2.0497  165.129   2.0497 0.000000 0.000000 
1 1 1    4    0  -88 o   26.630   4.1144   30.938   8.2973   30.938   8.2973   30.938   8.2973   26.630   4.1144   26.630   4.1144 -0.000000 0.000000 
1 1 1    4    0  -87 o  108.030   1.7782  476.178   15.649  476.178   15.649  476.178   15.649  108.030   1.7782  108.030   1.7782 -0.000000 0.000000 
1 1 1    4    0  -86 o   86.992   1.9419  308.999   13.755  308.999   13.755  308.999   13.755   86.992   1.9419   86.992   1.9419 0.000000 0.000000 
1 1 1    4    0  -85 o  149.354   1.8150  909.811   22.090  909.811   22.090  909.811   22.090  149.354   1.8150  149.354   1.8150 -0.000000 0.000000 
1 1 1    4    0  -84 o  108.279   1.7310  478.334   15.269  478.334   15.269  478.334   15.269  108.279   1.7310  108.279   1.7310 0.000000 0.000000 
1 1 1    4    0  -83 o  277.591   2.3845  3142.67   53.946  3142.67   53.946  3142.67   53.946  277.591   2.3845  277.591   2.3845 -0.000000 0.000000 
1 1 1    4    0  -82 o   50.892   2.1005  106.133   8.6800  106.133   8.6800  106.133   8.6800   50.892   2.1005   50.892   2.1005 0.000000 0.000000 
1 1 1    4    0  -81 o   34.188   3.4927   49.150   9.4812   49.150   9.4812   49.150   9.4812   34.188   3.4927   34.188   3.4927 0.000000 0.000000 
1 1 1    4    0  -80 o   16.159   5.6538   13.950   6.7403   13.950   6.7403   13.950   6.7403   16.159   5.6538   16.159   5.6538 -0.000000 0.000000 
1 1 1    4    0  -79 o  242.077   2.1567  2389.72   42.550  2389.72   42.550  2389.72   42.550  242.077   2.1567  242.077   2.1567 0.000000 0.000000 
1 1 1    4    0  -78 o   76.803   1.8598  240.888   11.628  240.888   11.628  240.888   11.628   76.803   1.8598   76.803   1.8598 0.000000 0.000000 
1 1 1    4    0  -77 o  142.498   1.6853  828.090   19.569  828.090   19.569  828.090   19.569  142.498   1.6853  142.498   1.6853 -0.000000 0.000000 
1 1 1    4    0  -76 o  203.461   2.1604  1688.23   35.820  1688.23   35.820  1688.23   35.820  203.461   2.1604  203.461   2.1604 -0.000000 0.000000 
1 1 1    4    0  -75 o   86.516   2.2107  305.751   15.568  305.751   15.568  305.751   15.568   86.516   2.2107   86.516   2.2107 -0.000000 0.000000 
1 1 1    4    0  -74 o  184.634   2.0527  1390.22   30.885  1390.22   30.885  1390.22   30.885  184.634   2.0527  184.634   2.0527 0.000000 0.000000 
1 1 1    4    0  -73 o   40.596   2.4612   67.929   8.0753   67.929   8.0753   67.929   8.0753   40.596   2.4612   40.596   2.4612 -0.000000 0.000000 
1 1 1    4    0  -72 o   95.184   1.7683  369.698   13.709  369.698   13.709  369.698   13.709   95.184   1.7683   95.184   1.7683 -0.000000 0.000000 
1 1 1    4    0  -71 o  233.339   2.0928  2220.11   39.799  2220.11   39.799  2220.11   39.799  233.339   2.0928  233.339   2.0928 0.000000 0.000000 
1 1 1    4    0  -70 o  163.191   1.7408  1085.94   23.151  1085.94   23.151  1085.94   23.151  163.191   1.7408  163.191   1.7408 0.000000 0.000000 
1 1 1    4    0  -69 o  453.148   3.9203  8376.35  144.786  8376.35  144.786  8376.35  144.786  453.148   3.9203  453.148   3.9203 0.000000 0.000000 
1 1 1    4    0  -68 o  149.485   1.8861  911.308   22.975  911.308   22.975  911.308   22.975  149.485   1.8861  149.485   1.8861 -0.000000 0.000000 
1 1 1    4    0  -67 o  202.358   2.1438  1669.79   35.354  1669.79   35.354  1669.79   35.354  202.358   2.1438  202.358   2.1438 0.000000 0.000000 
1 1 1    4    0  -66 f  191.286   2.0770  1492.06   32.377  1492.06   32.377  1492.06   32.377  191.286   2.0770  191.286   2.0770 -0.000000 0.000000 
1 1 1    4    0  -65 o  341.762   3.0772  4762.94   85.710  4762.94   85.710  4762.94   85.710  341.762   3.0772  341.762   3.0772 0.000000 0.000000 
1 1 1    4    0  -64 o  283.914   2.3828  3286.51   55.137  3286.51   55.137  3286.51   55.137  283.914   2.3828  283.914   2.3828 0.000000 0.000000 
1 1 1    4    0  -63 o  185.143   1.8254  1397.58   27.543  1397.58   27.543  1397.58   27.543  185.143   1.8254  185.143   1.8254 -0.000000 0.000000 
1 1 1    4    0  -62 o   34.378   2.4273   48.890   6.7226   48.890   6.7226   48.890   6.7226   34.378   2.4273   34.378   2.4273 -0.000000 0.000000 
1 1 1    4    0  -61 o   81.093   1.7550  268.417   11.589  268.417   11.589  268.417   11.589   81.093   1.7550   81.093   1.7550 0.000000 0.000000 
1 1 1    4    0  -60 o  656.124   4.9181 17556.18  263.006 17556.18  263.006 17556.18  263.006  656.124   4.9181  656.124   4.9181 -0.000000 0.000000 
1 1 1    4    0  -59 o  147.673   1.6621  889.183   20.001  889.183   20.001  889.183   20.001  147.673   1.6621  147.673   1.6621 0.000000 0.000000 
1 1 1    4    0  -58 f  285.967   2.3897  3333.98   55.697  3333.98   55.697  3333.98   55.697  285.967   2.3897  285.967   2.3897 -0.000000 0.000000 
1 1 1    4    0  -57 o  370.351   2.9347  5591.94   88.583  5591.94   88.583  5591.94   88.583  370.351   2.9347  370.351   2.9347 0.000000 0.000000 
1 1 1    4    0  -56 o  101.162   1.5566  417.410   12.829  417.410   12.829  417.410   12.829  101.162   1.5566  101.162   1.5566 0.000000 0.000000 
1 1 1    4    0  -55 o  234.398   2.0788  2239.93   39.713  2239.93   39.713  2239.93   39.713  234.398   2.0788  234.398   2.0788 0.000000 0.000000 
1 1 1    4    0  -54 o   45.122   2.5649   83.789   9.3637   83.789   9.3637   83.789   9.3637   45.122   2.5649   45.122   2.5649 -0.000000 0.000000 
1 1 1    4    0  -53 o  179.210   1.9956  1309.50   29.144  1309.50   29.144  1309.50   29.144  179.210   1.9956  179.210   1.9956 -0.000000 0.000000 
1 1 1    4    0  -52 o  165.366   1.9332  1115.03   26.051  1115.03   26.051  1115.03   26.051  165.366   1.9332  165.366   1.9332 -0.000000 0.000000 
1 1 1    4    0  -51 o  425.795   3.6992  7391.86  128.371  7391.86  128.371  7391.86  128.371  425.795   3.6992  425.795   3.6992 -0.000000 0.000000 
1 1 1    4    0  -50 o  227.297   2.0642  2106.27   38.238  2106.27   38.238  2106.27   38.238  227.297   2.0642  227.297   2.0642 0.000000 0.000000 
1 1 1    4    0  -49 o  109.933   1.6216  492.894   14.524  492.894   14.524  492.894   14.524  109.933   1.6216  109.933   1.6216 0.000000 0.000000 
1 1 1    4    0  -48 o  195.636   1.8753  1560.39   29.900  1560.39   29.900  1560.39   29.900  195.636   1.8753  195.636   1.8753 0.000000 0.000000 
1 1 1    4    0  -47 o  457.900   3.9346  8548.49  146.837  8548.49  146.837  8548.49  146.837  457.900   3.9346  457.900   3.9346 -0.000000 0.000000 
1 1 1    4    0  -46 o  237.613   2.0872  2301.76   40.419  2301.76   40.419  2301.76   40.419  237.613   2.0872  237.613   2.0872 0.000000 0.000000 
1 1 1    4    0  -45 o  190.414   2.0567  1478.31   31.915  1478.31   31.915  1478.31   31.915  190.414   2.0567  190.414   2.0567 -0.000000 0.000000 
1 1 1    4    0  -44 o  887.625   6.5635 32125.81  474.841 32125.81  474.841 32125.81  474.841  887.625   6.5635  887.625   6.5635 -0.000000 0.000000 
1 1 1    4    0  -43 o  102.168   1.4806  425.707   12.325  425.707   12.325  425.707   12.325  102.168   1.4806  102.168   1.4806 0.000000 0.000000 
1 1 1    4    0  -42 o  467.677   4.0105  8917.37  152.865  8917.37  152.865  8917.37  152.865  467.677   4.0105  467.677   4.0105 0.000000 0.000000 
1 1 1    4    0  -41 o  464.147   4.5898  8784.12  173.615  8784.12  173.615  8784.12  173.615  464.147   4.5898  464.147   4.5898 0.000000 0.000000 
1 1 1    4    0  -40 o  243.406   2.3540  2415.50   46.696  2415.50   46.696  2415.50   46.696  243.406   2.3540  243.406   2.3540 0.000000 0.000000 
1 1 1    4    0  -39 o  1317.21   12.492 70802.57  1341.03 70802.57  1341.03 70802.57  1341.03  1317.21   12.492  1317.21   12.492 0.000000 0.000000 
1 1 1    4    0  -38 o  557.146   4.7050 12656.01  213.645 12656.01  213.645 12656.01  213.645  557.146   4.7050  557.146   4.7050 -0.000000 0.000000 
1 1 1    4    0  -37 o  478.923   3.6597  9350.87  142.853  9350.87  142.853  9350.87  142.853  478.923   3.6597  478.923   3.6597 -0.000000 0.000000 
1 1 1    4    0  -36 o  820.642   6.0812 27459.87  406.749 27459.87  406.749 27459.87  406.749  820.642   6.0812  820.642   6.0812 -0.000000 0.000000 
1 1 1    4    0  -35 o  137.989   1.5405  776.366   17.323  776.366   17.323  776.366   17.323  137.989   1.5405  137.989   1.5405 -0.000000 0.000000 
1 1 1    4    0  -34 o  350.771   3.1186  5016.38   89.153  5016.38   89.153  5016.38   89.153  350.771   3.1186  350.771   3.1186 -0.000000 0.000000 
1 1 1    4    0  -33 o  274.018   2.5513  3061.28   56.976  3061.28   56.976  3061.28   56.976  274.018   2.5513  274.018   2.5513 -0.000000 0.000000 
1 1 1    4    0  -32 o  209.413   2.1287  1788.00   36.328  1788.00   36.328  1788.00   36.328  209.413   2.1287  209.413   2.1287 -0.000000 0.000000 
1 1 1    4    0  -31 o  350.032   3.5878  4995.95  102.345  4995.95  102.345  4995.95  102.345  350.032   3.5878  350.032   3.5878 -0.000000 0.000000 
1 1 1    4    0  -30 o   71.045   1.8573  206.149   10.739  206.149   10.739  206.149   10.739   71.045   1.8573   71.045   1.8573 -0.000000 0.000000 
1 1 1    4    0  -29 o  397.672   3.9967  6448.66  129.529  6448.66  129.529  6448.66  129.529  397.672   3.9967  397.672   3.9967 0.000000 0.000000 
1 1 1    4    0  -28 o  354.636   3.6222  5128.36  104.686  5128.36  104.686  5128.36  104.686  354.636   3.6222  354.636   3.6222 0.000000 0.000000 
1 1 1    4    0  -27 o  478.791   4.0794  9347.32  159.186  9347.32  159.186  9347.32  159.186  478.791   4.0794  478.791   4.0794 0.000000 0.000000 
1 1 1    4    0  -26 o   80.844   1.3541  266.609   8.9177  266.609   8.9177  266.609   8.9177   80.844   1.3541   80.844   1.3541 -0.000000 0.000000 
1 1 1    4    0  -25 o  462.701   3.5392  8728.84  133.470  8728.84  133.470  8728.84  133.470  462.701   3.5392  462.701   3.5392 -0.000000 0.000000 
1 1 1    4    0  -24 o  520.806   3.9437 11059.18  167.403 11059.18  167.403 11059.18  167.403  520.806   3.9437  520.806   3.9437 -0.000000 0.000000 
1 1 1    4    0  -23 o  356.082   2.8077  5169.29   81.484  5169.29   81.484  5169.29   81.484  356.082   2.8077  356.082   2.8077 -0.000000 0.000000 
1 1 1    4    0  -22 o   26.944   1.8576   30.010   4.0347   30.010   4.0347   30.010   4.0347   26.944   1.8576   26.944   1.8576 -0.000000 0.000000 
1 1 1    4    0  -21 o  473.500   3.6124  9140.94  139.410  9140.94  139.410  9140.94  139.410  473.500   3.6124  473.500   3.6124 -0.000000 0.000000 
1 1 1    4    0  -20 o  327.615   2.9342  4376.04   78.345  4376.04   78.345  4376.04   78.345  327.615   2.9342  327.615   2.9342 0.000000 0.000000 
1 1 1    4    0  -19 o   64.804   1.5632  171.467   8.2469  171.467   8.2469  171.467   8.2469   64.804   1.5632   64.804   1.5632 0.000000 0.000000 
1 1 1    4    0  -18 o  618.985   4.2274 15620.92  213.279 15620.92  213.279 15620.92  213.279  618.985   4.2274  618.985   4.2274 0.000000 0.000000 
1 1 1    4    0  -17 o  523.679   3.6126 11180.28  154.195 11180.28  154.195 11180.28  154.195  523.679   3.6126  523.679   3.6126 -0.000000 0.000000 
1 1 1    4    0  -16 o   76.548   1.3010  239.035   8.1129  239.035   8.1129  239.035   8.1129   76.548   1.3010   76.548   1.3010 0.000000 0.000000 
1 1 1    4    0  -15 o   11.118   3.7307   6.4872   3.0173   6.4872   3.0173   6.4872   3.0173   11.118   3.7307   11.118   3.7307 0.000000 0.000000 
1 1 1    4    0  -14 o   86.831   1.3117  307.512   9.2794  307.512   9.2794  307.512   9.2794   86.831   1.3117   86.831   1.3117 0.000000 0.000000 
1 1 1    4    0  -13 o  309.681   2.4905  3909.69   62.859  3909.69   62.859  3909.69   62.859  309.681   2.4905  309.681   2.4905 0.000000 0.000000 
1 1 1    4    0  -12 o  228.268   1.9735  2124.25   36.716  2124.25   36.716  2124.25   36.716  228.268   1.9735  228.268   1.9735 -0.000000 0.000000 
1 1 1    4    0  -11 o   52.600   1.3231  112.981   5.6648  112.981   5.6648  112.981   5.6648   52.600   1.3231   52.600   1.3231 0.000000 0.000000 
1 1 1    4    0  -10 o   76.297   1.4480  237.520   8.9984  237.520   8.9984  237.520   8.9984   76.297   1.4480   76.297   1.4480 -0.000000 0.000000 
1 1 1    4    0   -9 o  802.146   6.6396 26238.79  434.074 26238.79  434.074 26238.79  434.074  802.146   6.6396  802.146   6.6396 -0.000000 0.000000 
1 1 1    4    0   -8 o  1191.20   9.7784 57885.40  949.350 57885.40  949.350 57885.40  949.350  1191.20   9.7784  1191.20   9.7784 -0.000000 0.000000 
1 1 1    4    0   -7 o  168.112   1.8225  1152.30   24.968  1152.30   24.968  1152.30   24.968  168.112   1.8225  168.112   1.8225 0.000000 0.000000 
1 1 1    4    0   -6 o  764.075   6.3402 23806.26  394.830 23806.26  394.830 23806.26  394.830  764.075   6.3402  764.075   6.3402 0.000000 0.000000 
1 1 1    4    0   -5 o  1266.25   12.010 65433.72  1239.43 65433.72  1239.43 65433.72  1239.43  1266.25   12.010  1266.25   12.010 0.000000 0.000000 
1 1 1    4    0   -4 o  1132.27   10.754 52308.82  992.323 52308.82  992.323 52308.82  992.323  1132.27   10.754  1132.27   10.754 0.000000 0.000000 
1 1 1    4    0   -3 f  464.858   4.5762  8811.21  173.368  8811.21  173.368  8811.21  173.368  464.858   4.5762  464.858   4.5762 0.000000 0.000000 
1 1 1    4    0   -2 o  647.112   7.6396 17081.27  402.857 17081.27  402.857 17081.27  402.857  647.112   7.6396  647.112   7.6396 -0.000000 0.000000 
1 1 1    4    0   -1 o  876.874   8.3593 31362.21  597.387 31362.21  597.387 31362.21  597.387  876.874   8.3593  876.874   8.3593 -0.000000 0.000000 
1 1 1    4    0    0 o   94.976   1.4866  367.925   11.503  367.925   11.503  367.925   11.503   94.976   1.4866   94.976   1.4866 0.000000 0.000000 
1 1 1    4    0    1 o  1370.50   11.242 76635.05  1255.72 76635.05  1255.72 76635.05  1255.72  1370.50   11.242  1370.50   11.242 0.000000 0.000000 
1 1 1    4    0    2 o  156.261   2.4798  995.984   31.569  995.984   31.569  995.984   31.569  156.261   2.4798  156.261   2.4798 -0.000000 0.000000 
1 1 1    4    0    3 f   9.1650   4.9429   4.8513   5.1273   4.8513   5.1273   4.8513   5.1273   9.1650   4.9429   9.1650   4.9429 -0.000000 0.000000 
1 1 1    4    0    4 o  134.864   2.3267  742.001   25.562  742.001   25.562  742.001   25.562  134.864   2.3267  134.864   2.3267 0.000000 0.000000 
1 1 1    4    0    5 o  716.655   8.4260 20951.87  492.076 20951.87  492.076 20951.87  492.076  716.655   8.4260  716.655   8.4260 0.000000 0.000000 
1 1 1    4    0    6 o   26.365   3.0551   29.455   6.3364   29.455   6.3364   29.455   6.3364   26.365   3.0551   26.365   3.0551 -0.000000 0.000000 
1 1 1    4    0    7 o  860.785   10.061 30233.54  705.737 30233.54  705.737 30233.54  705.737  860.785   10.061  860.785   10.061 0.000000 0.000000 
1 1 1    4    0    8 o  355.348   4.4228  5149.64  128.067  5149.64  128.067  5149.64  128.067  355.348   4.4228  355.348   4.4228 0.000000 0.000000 
1 1 1    4    0    9 o  1173.85   13.655 56260.64  1306.18 56260.64  1306.18 56260.64  1306.18  1173.85   13.655  1173.85   13.655 0.000000 0.000000 
1 1 1    4    0   10 o  576.409   6.8511 13552.07  321.803 13552.07  321.803 13552.07  321.803  576.409   6.8511  576.409   6.8511 0.000000 0.000000 
1 1 1    4    0   11 o  596.656   7.0765 14521.30  344.065 14521.30  344.065 14521.30  344.065  596.656   7.0765  596.656   7.0765 -0.000000 0.000000 
1 1 1    4    0   12 o   74.962   2.0980  229.575   12.797  229.575   12.797  229.575   12.797   74.962   2.0980   74.962   2.0980 0.000000 0.000000 
1 1 1    4    0   13 o  172.205   2.6383  1209.56   37.015  1209.56   37.015  1209.56   37.015  172.205   2.6383  172.205   2.6383 -0.000000 0.000000 
1 1 1    4    0   14 o  304.372   3.9014  3778.20   96.761  3778.20   96.761  3778.20   96.761  304.372   3.9014  304.372   3.9014 0.000000 0.000000 
1 1 1    4    0   15 o  213.298   3.0037  1855.55   52.202  1855.55   52.202  1855.55   52.202  213.298   3.0037  213.298   3.0037 0.000000 0.000000 
1 1 1    4    0   16 o  283.296   3.6878  3273.13   85.128  3273.13   85.128  3273.13   85.128  283.296   3.6878  283.296   3.6878 -0.000000 0.000000 
1 1 1    4    0   17 o  1112.14   12.948 50513.84  1173.48 50513.84  1173.48 50513.84  1173.48  1112.14   12.948  1112.14   12.948 0.000000 0.000000 
1 1 1    4    0   18 o  260.260   3.4620  2762.52   73.416  2762.52   73.416  2762.52   73.416  260.260   3.4620  260.260   3.4620 0.000000 0.000000 
1 1 1    4    0   19 o  1137.96   13.246 52900.25  1228.31 52900.25  1228.31 52900.25  1228.31  1137.96   13.246  1137.96   13.246 0.000000 0.000000 
1 1 1    4    0   20 o  699.839   8.2503 19985.83  470.511 19985.83  470.511 19985.83  470.511  699.839   8.2503  699.839   8.2503 0.000000 0.000000 
1 1 1    4    0   21 o  316.482   4.0374  4085.10  104.119  4085.10  104.119  4085.10  104.119  316.482   4.0374  316.482   4.0374 0.000000 0.000000 
1 1 1    4    0   22 o   34.157   2.9892   48.641   8.1700   48.641   8.1700   48.641   8.1700   34.157   2.9892   34.157   2.9892 0.000000 0.000000 
1 1 1    4    0   23 o  264.041   3.5086  2843.47   75.487  2843.47   75.487  2843.47   75.487  264.041   3.5086  264.041   3.5086 0.000000 0.000000 
1 1 1    4    0   24 o   46.554   2.5829   89.152   9.7321   89.152   9.7321   89.152   9.7321   46.554   2.5829   46.554   2.5829 0.000000 0.000000 
1 1 1    4    0   25 o   97.295   2.2471  386.468   17.801  386.468   17.801  386.468   17.801   97.295   2.2471   97.295   2.2471 0.000000 0.000000 
1 1 1    4    0   26 o  129.381   3.3838  683.760   35.632  683.760   35.632  683.760   35.632  129.381   3.3838  129.381   3.3838 0.000000 0.000000 
1 1 1    4    0   27 o  303.862   5.5459  3768.48  137.265  3768.48  137.265  3768.48  137.265  303.862   5.5459  303.862   5.5459 0.000000 0.000000 
1 1 1    4    0   28 o  548.649   9.2884 12292.54  415.137 12292.54  415.137 12292.54  415.137  548.649   9.2884  548.649   9.2884 0.000000 0.000000 
1 1 1    4    0   29 o  300.090   5.5010  3675.39  134.462  3675.39  134.462  3675.39  134.462  300.090   5.5010  300.090   5.5010 0.000000 0.000000 
1 1 1    4    0   30 o  798.384   7.6446 26003.70  497.406 26003.70  497.406 26003.70  497.406  798.384   7.6446  798.384   7.6446 0.000000 0.000000 
1 1 1    4    0   31 o  131.428   1.6846  704.386   18.041  704.386   18.041  704.386   18.041  131.428   1.6846  131.428   1.6846 0.000000 0.000000 
1 1 1    4    0   32 o  501.902   4.2679 10271.05  174.583 10271.05  174.583 10271.05  174.583  501.902   4.2679  501.902   4.2679 0.000000 0.000000 
1 1 1    4    0   33 o  211.638   2.1315  1826.18   36.763  1826.18   36.763  1826.18   36.763  211.638   2.1315  211.638   2.1315 0.000000 0.000000 
1 1 1    4    0   34 o  490.710   4.1819  9817.78  167.249  9817.78  167.249  9817.78  167.249  490.710   4.1819  490.710   4.1819 0.000000 0.000000 
1 1 1    4    0   35 o  875.031   7.2328 31225.75  515.818 31225.75  515.818 31225.75  515.818  875.031   7.2328  875.031   7.2328 0.000000 0.000000 
1 1 1    4    0   36 o  911.062   7.5255 33850.40  558.794 33850.40  558.794 33850.40  558.794  911.062   7.5255  911.062   7.5255 0.000000 0.000000 
1 1 1    4    0   37 o  562.039   4.7406 12879.41  217.151 12879.41  217.151 12879.41  217.151  562.039   4.7406  562.039   4.7406 0.000000 0.000000 
1 1 1    4    0   38 o  1707.38   13.983 118983.40  1945.87 118983.40  1945.87 118983.40  1945.87  1707.38   13.983  1707.38   13.983 0.000000 0.000000 
1 1 1    4    0   39 o  288.906   2.6670  3402.90   62.795  3402.90   62.795  3402.90   62.795  288.906   2.6670  288.906   2.6670 0.000000 0.000000 
1 1 1    4    0   40 o  114.647   1.9036  536.163   17.779  536.163   17.779  536.163   17.779  114.647   1.9036  114.647   1.9036 0.000000 0.000000 
1 1 1    4    0   41 o  308.812   2.8112  3887.96   70.753  3887.96   70.753  3887.96   70.753  308.812   2.8112  308.812   2.8112 0.000000 0.000000 
1 1 1    4    0   42 o  372.385   3.2850  5653.53   99.698  5653.53   99.698  5653.53   99.698  372.385   3.2850  372.385   3.2850 0.000000 0.000000 
1 1 1    4    0   43 o  522.522   5.1215 11132.96  218.094 11132.96  218.094 11132.96  218.094  522.522   5.1215  522.522   5.1215 0.000000 0.000000 
1 1 1    4    0   44 o  551.294   4.6608 12391.54  209.418 12391.54  209.418 12391.54  209.418  551.294   4.6608  551.294   4.6608 0.000000 0.000000 
1 1 1    4    0   45 o   21.533   4.0924   20.823   6.4294   20.823   6.4294   20.823   6.4294   21.533   4.0924   21.533   4.0924 0.000000 0.000000 
1 1 1    4    0   46 o  318.451   3.3409  4134.91   86.702  4134.91   86.702  4134.91   86.702  318.451   3.3409  318.451   3.3409 0.000000 0.000000 
1 1 1    4    0   47 o  344.853   3.5639  4848.98  100.160  4848.98  100.160  4848.98  100.160  344.853   3.5639  344.853   3.5639 0.000000 0.000000 
1 1 1    4    0   48 o  198.915   2.9542  1613.81   47.878  1613.81   47.878  1613.81   47.878  198.915   2.9542  198.915   2.9542 0.000000 0.000000 
1 1 1    4    0   49 o  246.457   3.3891  2477.26   68.058  2477.26   68.058  2477.26   68.058  246.457   3.3891  246.457   3.3891 0.000000 0.000000 
1 1 1    4    0   50 o  380.842   6.7872  5919.21  210.553  5919.21  210.553  5919.21  210.553  380.842   6.7872  380.842   6.7872 0.000000 0.000000 
1 1 1    4    0   51 o   20.692   6.5404   21.970   9.6967   21.970   9.6967   21.970   9.6967   20.692   6.5404   20.692   6.5404 0.000000 0.000000 
1 1 1    4    0   52 o   87.923   2.1079  315.631   15.088  315.631   15.088  315.631   15.088   87.923   2.1079   87.923   2.1079 0.000000 0.000000 
1 1 1    4    0   53 o  134.616   2.1938  739.207   24.059  739.207   24.059  739.207   24.059  134.616   2.1938  134.616   2.1938 0.000000 0.000000 
1 1 1    4    0   54 o  128.946   1.7996  678.097   18.908  678.097   18.908  678.097   18.908  128.946   1.7996  128.946   1.7996 0.000000 0.000000 
1 1 1    4    0   55 o   94.662   1.7660  365.613   13.616  365.613   13.616  365.613   13.616   94.662   1.7660   94.662   1.7660 0.000000 0.000000 
1 1 1    4    0   56 o  225.195   2.0164  2067.52   37.008  2067.52   37.008  2067.52   37.008  225.195   2.0164  225.195   2.0164 0.000000 0.000000 
1 1 1    4    0   57 o  333.179   2.6834  4525.70   72.869  4525.70   72.869  4525.70   72.869  333.179   2.6834  333.179   2.6834 0.000000 0.000000 
1 1 1    4    0   58 f  308.661   2.5268  3884.14   63.567  3884.14   63.567  3884.14   63.567  308.661   2.5268  308.661   2.5268 0.000000 0.000000 
1 1 1    4    0   59 o  109.628   1.5445  490.147   13.796  490.147   13.796  490.147   13.796  109.628   1.5445  109.628   1.5445 0.000000 0.000000 
1 1 1    4    0   60 o  595.382   4.4847 14455.06  217.625 14455.06  217.625 14455.06  217.625  595.382   4.4847  595.382   4.4847 0.000000 0.000000 
1 1 1    4    0   61 o  132.226   1.7826  713.023   19.206  713.023   19.206  713.023   19.206  132.226   1.7826  132.226   1.7826 0.000000 0.000000 
1 1 1    4    0   62 o  152.091   1.6637  943.173   20.620  943.173   20.620  943.173   20.620  152.091   1.6637  152.091   1.6637 0.000000 0.000000 
1 1 1    4    0   63 o  600.048   4.5193 14684.37  221.023 14684.37  221.023 14684.37  221.023  600.048   4.5193  600.048   4.5193 0.000000 0.000000 
1 1 1    4    0   64 o  209.166   1.9393  1783.78   33.059  1783.78   33.059  1783.78   33.059  209.166   1.9393  209.166   1.9393 0.000000 0.000000 
1 1 1    4    0   65 o  451.703   3.4870  8320.25  128.376  8320.25  128.376  8320.25  128.376  451.703   3.4870  451.703   3.4870 0.000000 0.000000 
1 1 1    4    0   66 f   47.656   1.9577   93.044   7.5758   93.044   7.5758   93.044   7.5758   47.656   1.9577   47.656   1.9577 0.000000 0.000000 
1 1 1    4    0   67 o  300.332   2.4811  3677.80   60.732  3677.80   60.732  3677.80   60.732  300.332   2.4811  300.332   2.4811 0.000000 0.000000 
1 1 1    4    0   68 o  108.043   1.4504  476.066   12.769  476.066   12.769  476.066   12.769  108.043   1.4504  108.043   1.4504 0.000000 0.000000 
1 1 1    4    0   69 o  141.386   1.5122  815.091   17.424  815.091   17.424  815.091   17.424  141.386   1.5122  141.386   1.5122 0.000000 0.000000 
1 1 1    4    0   70 o   54.495   1.9164  121.507   8.4889  121.507   8.4889  121.507   8.4889   54.495   1.9164   54.495   1.9164 0.000000 0.000000 
1 1 1    4    0   71 o  434.905   3.3813  7714.43  119.855  7714.43  119.855  7714.43  119.855  434.905   3.3813  434.905   3.3813 0.000000 0.000000 
1 1 1    4    0   72 o  150.769   1.8825  927.066   23.128  927.066   23.128  927.066   23.128  150.769   1.8825  150.769   1.8825 0.000000 0.000000 
1 1 1    4    0   73 o  254.095   2.4598  2633.01   50.938  2633.01   50.938  2633.01   50.938  254.095   2.4598  254.095   2.4598 0.000000 0.000000 
1 1 1    4    0   74 o  113.374   1.5796  524.256   14.592  524.256   14.592  524.256   14.592  113.374   1.5796  113.374   1.5796 0.000000 0.000000 
1 1 1    4    0   75 o   28.247   2.9818   33.607   6.6737   33.607   6.6737   33.607   6.6737   28.247   2.9818   28.247   2.9818 0.000000 0.000000 
1 1 1    4    0   76 o   77.060   1.6324  242.389   10.244  242.389   10.244  242.389   10.244   77.060   1.6324   77.060   1.6324 0.000000 0.000000 
1 1 1    4    0   77 o   39.043   2.3488   62.820   7.4125   62.820   7.4125   62.820   7.4125   39.043   2.3488   39.043   2.3488 0.000000 0.000000 
1 1 1    4    0   78 o  373.552   2.7184  5690.80   82.766  5690.80   82.766  5690.80   82.766  373.552   2.7184  373.552   2.7184 0.000000 0.000000 
1 1 1    4    0   79 o   74.259   1.5987  225.102   9.6673  225.102   9.6673  225.102   9.6673   74.259   1.5987   74.259   1.5987 0.000000 0.000000 
1 1 1    4    0   80 o   30.323   3.3082   38.822   7.9303   38.822   7.9303   38.822   7.9303   30.323   3.3082   30.323   3.3082 0.000000 0.000000 
1 1 1    4    0   81 o   66.630   1.9235  181.441   10.427  181.441   10.427  181.441   10.427   66.630   1.9235   66.630   1.9235 0.000000 0.000000 
1 1 1    4    0   82 o  144.327   1.9262  849.671   22.652  849.671   22.652  849.671   22.652  144.327   1.9262  144.327   1.9262 0.000000 0.000000 
1 1 1    4    0   83 o  130.927   1.7611  699.200   18.788  699.200   18.788  699.200   18.788  130.927   1.7611  130.927   1.7611 0.000000 0.000000 
1 1 1    4    0   84 o  164.850   1.8746  1108.34   25.182  1108.34   25.182  1108.34   25.182  164.850   1.8746  164.850   1.8746 0.000000 0.000000 
1 1 1    4    0   85 o  248.307   2.0573  2514.38   41.635  2514.38   41.635  2514.38   41.635  248.307   2.0573  248.307   2.0573 0.000000 0.000000 
1 1 1    4    0   86 o  140.923   1.7094  809.968   19.630  809.968   19.630  809.968   19.630  140.923   1.7094  140.923   1.7094 0.000000 0.000000 
1 1 1    4    0   87 o  107.777   1.6767  473.894   14.723  473.894   14.723  473.894   14.723  107.777   1.6767  107.777   1.6767 0.000000 0.000000 
1 1 1    4    0   88 o  124.676   1.6391  634.031   16.652  634.031   16.652  634.031   16.652  124.676   1.6391  124.676   1.6391 0.000000 0.000000 
1 1 1    4    0   89 o  293.297   2.4968  3509.17   59.684  3509.17   59.684  3509.17   59.684  293.297   2.4968  293.297   2.4968 0.000000 0.000000 
1 1 1    4    0   90 o  457.085   3.9784  8532.81  148.207  8532.81  148.207  8532.81  148.207  457.085   3.9784  457.085   3.9784 0.000000 0.000000 
1 1 1    4    0   91 o   40.984   2.8928   69.546   9.5517   69.546   9.5517   69.546   9.5517   40.984   2.8928   40.984   2.8928 0.000000 0.000000 
1 1 1    4    0   92 o  167.237   1.8595  1140.86   25.342  1140.86   25.342  1140.86   25.342  167.237   1.8595  167.237   1.8595 0.000000 0.000000 
1 1 1    4    0   93 o   45.935   2.5814   86.890   9.5955   86.890   9.5955   86.890   9.5955   45.935   2.5814   45.935   2.5814 0.000000 0.000000 
1 1 1    4    0   94 o   7.4638   4.9008  -1.2670   7.4977  -1.2670   7.4977  -1.2670   7.4977   7.4638   4.9008   7.4638   4.9008 0.000000 0.000000 
1 1 1    4    0   95 o   17.252   6.1718   16.090   7.9253   16.090   7.9253   16.090   7.9253   17.252   6.1718   17.252   6.1718 0.000000 0.000000 
1 1 1    4    0   96 o  140.191   1.7590  801.846   20.095  801.846   20.095  801.846   20.095  140.191   1.7590  140.191   1.7590 0.000000 0.000000 
1 1 1    4    0   97 o  144.301   1.7709  849.572   20.824  849.572   20.824  849.572   20.824  144.301   1.7709  144.301   1.7709 0.000000 0.000000 
1 1 1    4    0   98 o   98.501   1.7668  396.083   14.176  396.083   14.176  396.083   14.176   98.501   1.7668   98.501   1.7668 0.000000 0.000000 
1 1 1    4    0   99 o   7.2241   4.8887  -4.2000   8.4991  -4.2000   8.4991  -4.2000   8.4991   7.2241   4.8887   7.2241   4.8887 0.000000 0.000000 
1 1 1    4    0  100 o  203.315   2.2519  1687.51   37.310  1687.51   37.310  1687.51   37.310  203.315   2.2519  203.315   2.2519 0.000000 0.000000 
1 1 1    4    0  101 o   8.0647   5.4000  -3.5771   9.8659  -3.5771   9.8659  -3.5771   9.8659   8.0647   5.4000   8.0647   5.4000 0.000000 0.000000 
1 1 1    4    0  102 o   54.749   2.5839  123.229   11.473  123.229   11.473  123.229   11.473   54.749   2.5839   54.749   2.5839 0.000000 0.000000 
1 1 1    4    0  103 o   7.5124   4.9774  -1.9949   8.0129  -1.9949   8.0129  -1.9949   8.0129   7.5124   4.9774   7.5124   4.9774 0.000000 0.000000 
1 1 1    4    0  104 f  117.677   1.7390  565.398   16.673  565.398   16.673  565.398   16.673  117.677   1.7390  117.677   1.7390 0.000000 0.000000 
1 1 1    4    0  105 o   13.884   6.3928   11.606   7.9379   11.606   7.9379   11.606   7.9379   13.884   6.3928   13.884   6.3928 0.000000 0.000000 
1 1 1    4    0  106 o   40.733   2.5040   68.578   8.2414   68.578   8.2414   68.578   8.2414   40.733   2.5040   40.733   2.5040 0.000000 0.000000 
1 1 1    4    0  107 o   13.744   6.0334   11.209   7.0608   11.209   7.0608   11.209   7.0608   13.744   6.0334   13.744   6.0334 0.000000 0.000000 
1 1 1    4    0  108 f   13.732   6.4079   11.456   7.9907   11.456   7.9907   11.456   7.9907   13.732   6.4079   13.732   6.4079 0.000000 0.000000 
1 1 1    4    0  109 o   59.978   2.2065  147.656   10.755  147.656   10.755  147.656   10.755   59.978   2.2065   59.978   2.2065 0.000000 0.000000 
1 1 1    4    0  110 o   12.722   6.7376   9.8666   9.3748   9.8666   9.3748   9.8666   9.3748   12.722   6.7376   12.722   6.7376 0.000000 0.000000 
1 1 1    4    0  111 o   93.799   2.2545  360.598   17.216  360.598   17.216  360.598   17.216   93.799   2.2545   93.799   2.2545 0.000000 0.000000 
1 1 1    4    0  112 o   91.507   2.2630  343.343   16.857  343.343   16.857  343.343   16.857   91.507   2.2630   91.507   2.2630 0.000000 0.000000 
1 1 1    4    0  113 o   32.513   3.4035   44.900   8.7728   44.900   8.7728   44.900   8.7728   32.513   3.4035   32.513   3.4035 0.000000 0.000000 
1 1 1    4    0  114 o   52.544   2.1152  113.551   9.0260  113.551   9.0260  113.551   9.0260   52.544   2.1152   52.544   2.1152 0.000000 0.000000 
1 1 1    4    0  115 o   49.720   2.2126  101.855   8.9269  101.855   8.9269  101.855   8.9269   49.720   2.2126   49.720   2.2126 0.000000 0.000000 
1 1 1    4    0  116 f   28.981   3.3436   35.971   7.6259   35.971   7.6259   35.971   7.6259   28.981   3.3436   28.981   3.3436 -0.000000 0.000000 
1 1 1    4    0  117 o   21.430   4.8478   21.736   7.3858   21.736   7.3858   21.736   7.3858   21.430   4.8478   21.430   4.8478 0.000000 0.000000 
1 1 1    4    0  118 o   76.927   1.8061  242.551   11.312  242.551   11.312  242.551   11.312   76.927   1.8061   76.927   1.8061 -0.000000 0.000000 
1 1 1    4    0  119 o   10.195   5.6850   6.1202   7.0286   6.1202   7.0286   6.1202   7.0286   10.195   5.6850   10.195   5.6850 -0.000000 0.000000 
1 1 1    4    0  120 o   25.962   3.8299   29.700   7.5883   29.700   7.5883   29.700   7.5883   25.962   3.8299   25.962   3.8299 -0.000000 0.000000 
1 1 1    4    0  121 o   14.034   6.1173   11.991   7.2621   11.991   7.2621   11.991   7.2621   14.034   6.1173   14.034   6.1173 0.000000 0.000000 
1 1 1    4    0  122 o   48.032   2.2876   95.480   8.9101   95.480   8.9101   95.480   8.9101   48.032   2.2876   48.032   2.2876 0.000000 0.000000 
1 1 1    4    0  123 o   58.430   2.0668  140.745   9.8161  140.745   9.8161  140.745   9.8161   58.430   2.0668   58.430   2.0668 -0.000000 0.000000 
1 1 1    4    0  124 o   26.558   3.8148   31.206   7.7646   31.206   7.7646   31.206   7.7646   26.558   3.8148   26.558   3.8148 -0.000000 0.000000 
1 1 1    4    0  125 f   15.377   6.0263   13.910   7.2282   13.910   7.2282   13.910   7.2282   15.377   6.0263   15.377   6.0263 0.000000 0.000000 
1 1 1    4    0  126 o   17.907   5.6933   17.238   7.3136   17.238   7.3136   17.238   7.3136   17.907   5.6933   17.907   5.6933 0.000000 0.000000 
1 1 1    4    0  127 o   13.048   6.5764   11.331   8.6405   11.331   8.6405   11.331   8.6405   13.048   6.5764   13.048   6.5764 0.000000 0.000000 
1 1 1    4    0  128 o   45.129   3.1650   86.392   11.509   86.392   11.509   86.392   11.509   45.129   3.1650   45.129   3.1650 0.000000 0.000000 
1 1 1    4    0  129 o   24.377   5.9102   29.852   10.178   29.852   10.178   29.852   10.178   24.377   5.9102   24.377   5.9102 0.000000 0.000000 
1 1 1    4    0  130 o   10.539   6.6825   4.1403   12.422   4.1403   12.422   4.1403   12.422   10.539   6.6825   10.539   6.6825 0.000000 0.000000 
1 1 1    4    0  131 o   18.819   7.3377   21.865   10.738   21.865   10.738   21.865   10.738   18.819   7.3377   18.819   7.3377 0.000000 0.000000 
1 1 1    4    0  132 o   15.255   8.0231   17.007   13.220   17.007   13.220   17.007   13.220   15.255   8.0231   15.255   8.0231 0.000000 0.000000 
1 1 1    4    0  133 o   8.1647   5.6764  -8.7171   13.369  -8.7171   13.369  -8.7171   13.369   8.1647   5.6764   8.1647   5.6764 -0.000000 0.000000 
1 1 1    4    0  134 o   20.482   8.7466   28.677   14.880   28.677   14.880   28.677   14.880   20.482   8.7466   20.482   8.7466 0.000000 0.000000 
1 1 1    4    0  135 o   15.913   8.3910   19.156   14.490   19.156   14.490   19.156   14.490   15.913   8.3910   15.913   8.3910 -0.000000 0.000000 
1 1 1    4    0  136 o   14.505   8.1059   15.801   14.328   15.801   14.328   15.801   14.328   14.505   8.1059   14.505   8.1059 -0.000000 0.000000 
1 1 1    4    0  137 o   13.353   7.7793   12.828   13.995   12.828   13.995   12.828   13.995   13.353   7.7793   13.353   7.7793 -0.000000 0.000000 
1 1 1    4    0  138 o   22.902   8.6197   33.716   15.048   33.716   15.048   33.716   15.048   22.902   8.6197   22.902   8.6197 -0.000000 0.000000 
1 1 1    4    0  139 o   8.7841   6.0356  -5.8617   14.053  -5.8617   14.053  -5.8617   14.053   8.7841   6.0356   8.7841   6.0356 0.000000 0.000000 
1 1 1    4    1 -138 o   14.903   5.5597   10.320   9.0595   1.5083   14.223   16.336   11.752   13.619   6.1238   17.606   6.3712 -3.986993 8.837082 
1 1 1    4    1 -137 o   13.998   5.4862   8.1816   9.1144   10.623   14.281   6.5040   11.839   15.884   6.6277   14.143   5.9758 1.741294 8.923955 
1 1 1    4    1 -136 o   33.349   3.6928   49.993   9.8705   59.961   15.623   43.371   12.734   34.442   5.7685   29.463   5.5045 4.979549 7.973356 
1 1 1    4    1 -135 o   18.008   5.0018   15.974   7.6036   13.581   9.6852   19.818   12.276   16.523   5.8049   19.144   6.5453 -2.621424 8.748573 
1 1 1    4    1 -134 o   26.155   3.7860   30.932   7.8374   27.261   10.117   36.443   12.394   23.363   5.4177   26.730   5.8511 -3.367218 7.974166 
1 1 1    4    1 -133 o   12.386   5.0230   4.8840   7.9034   4.5341   9.4414   5.7033   14.447   12.868   5.3804   14.851   6.4431 -1.983055 8.394229 
1 1 1    4    1 -132 o   19.218   4.6414   17.628   7.1883   10.828   9.4676   26.884   11.045   15.380   5.6938   22.925   5.8821 -7.544849 8.186452 
1 1 1    4    1 -131 o   26.947   3.4610   32.131   7.4270   18.775   9.7603   50.501   11.447   19.252   5.7676   33.180   4.3358 -13.92854 7.215572 
1 1 1    4    1 -130 o   24.820   3.4422   27.227   6.7771   30.620   9.5835   23.833   9.5850   25.486   4.7888   22.020   5.3853 3.465868 7.206553 
1 1 1    4    1 -129 o   11.943   4.6227   5.0650   6.4069   0.6995   9.2255   9.1321   8.9046   11.660   5.1022   14.654   5.5027 -2.993992 7.504153 
1 1 1    4    1 -128 o   64.738   1.7024  173.629   8.9762  176.820   12.928  170.658   12.473   64.771   2.4529   63.669   2.4077 1.101803 3.437110 
1 1 1    4    1 -127 o   17.555   4.5803   14.420   6.6224   13.609   9.5871   15.160   9.1586   16.936   5.7844   17.703   5.6372 -0.7670670 8.076944 
1 1 1    4    1 -126 f   44.421   2.4839   83.041   8.9582   75.994   15.671   86.461   10.918   40.790   4.8051   45.013   2.9925 -4.222870 5.660772 
1 1 1    4    1 -125 o   23.933   4.1201   25.640   7.7480   32.215   13.935   22.697   9.3219   25.266   6.6693   21.903   5.2828 3.362745 8.508057 
1 1 1    4    1 -124 o   14.059   4.7584   8.5113   6.4859   19.180   13.496   5.3072   7.3960   19.908   6.8609   12.702   4.9526 7.206647 8.461700 
1 1 1    4    1 -123 o   18.798   3.8387   15.683   5.6829   2.3193   8.6119   25.992   7.5635   12.157   5.1145   24.283   3.9571 -12.12628 6.466630 
1 1 1    4    1 -122 o   11.395   4.2182   4.6455   5.1962   2.8314   7.4620   6.3534   7.2401   11.762   4.8383   13.234   4.9634 -1.472001 6.931351 
1 1 1    4    1 -121 o   44.106   1.8053   80.241   6.4768   81.351   9.5532   79.297   8.8108   44.102   2.6699   43.613   2.4887 0.4890060 3.649943 
1 1 1    4    1 -120 o   10.337   4.1246   2.6141   5.2368   2.5413   7.8030   2.6738   7.0639   11.919   4.9297   11.535   4.7220 0.3841305 6.826349 
1 1 1    4    1 -119 f   66.236   1.4446  179.824   7.7995  175.788   11.530  183.228   10.590   65.222   2.1717   66.678   1.9505 -1.455338 2.919054 
1 1 1    4    1 -118 o   20.699   3.3799   18.387   5.5061   16.900   8.2170   19.599   7.4178   19.378   5.1243   21.047   4.4622 -1.669184 6.794860 
1 1 1    4    1 -117 f   33.839   2.1693   47.381   5.9523   46.176   8.8439   48.379   8.0479   33.073   3.3256   33.987   2.9336 -0.9145508 4.434588 
1 1 1    4    1 -116 o   45.951   1.6940   86.737   6.3344   90.167   9.0854   83.493   8.8363   46.671   2.3961   44.898   2.4234 1.773109 3.407955 
1 1 1    4    1 -115 o   40.234   2.0209   66.717   6.6066   66.168   9.5245   67.227   9.1717   39.817   2.9556   40.179   2.8183 -0.3615074 4.083880 
1 1 1    4    1 -114 o   50.148   1.6901  103.201   6.8988   97.258   10.267  108.093   9.3147   48.452   2.6093   51.195   2.2375 -2.742439 3.437218 
1 1 1    4    1 -113 o   27.867   2.6062   32.318   5.8515   22.651   8.5869   40.699   7.9953   22.706   4.7903   31.153   3.1936 -8.447157 5.757308 
1 1 1    4    1 -112 o   52.543   1.8147  113.288   7.7605   97.748   13.389  121.151   9.5235   48.377   3.4171   54.263   2.1574 -5.885456 4.041176 
1 1 1    4    1 -111 o   53.353   1.6902  116.664   7.3414  120.204   11.445  114.189   9.5696   53.953   2.6100   52.675   2.2338 1.278034 3.435385 
1 1 1    4    1 -110 o   44.391   1.8836   80.875   6.8005   71.748   10.731   86.999   8.7912   41.531   3.1943   45.957   2.3546 -4.425529 3.968349 
1 1 1    4    1 -109 o   23.874   3.1246   23.912   5.9348   35.133   9.7389   17.284   7.4852   28.721   4.2912   19.921   4.6881 8.799902 6.355510 
1 1 1    4    1 -108 o   68.541   1.5945  192.057   8.9085  182.230   12.938  200.914   12.284   66.598   2.3872   69.984   2.1559 -3.385674 3.216590 
1 1 1    4    1 -107 o   12.936   4.6138   6.0426   6.1377   14.736   9.6590   0.1546   7.9489   18.657   5.7679   11.387   4.8572 7.269539 7.540655 
1 1 1    4    1 -106 o   61.647   1.7758  155.493   8.9144  159.056   14.055  153.095   11.530   62.176   2.7801   61.086   2.3198 1.090897 3.620862 
1 1 1    4    1 -105 o  117.892   1.3075  567.317   12.565  572.042   16.834  561.373   18.882  118.313   1.7455  117.160   1.9771 1.152664 2.637393 
1 1 1    4    1 -104 o   81.617   1.3639  271.893   9.0742  266.101   12.082  279.389   13.744   80.695   1.8368   82.660   2.0397 -1.964806 2.744862 
1 1 1    4    1 -103 o   77.774   1.4379  246.890   9.1161  241.227   11.749  255.456   14.450   76.837   1.8758   78.997   2.2463 -2.159782 2.926572 
1 1 1    4    1 -102 o   59.982   1.5805  146.977   7.7212  153.286   10.412  139.267   11.510   61.205   2.0899   58.295   2.4274 2.910583 3.203165 
1 1 1    4    1 -101 o   81.701   1.4515  272.392   9.6665  272.135   12.847  272.729   14.675   81.624   1.9309   81.656   2.2068 -0.3233337E-01 2.932281 
1 1 1    4    1 -100 o   52.888   1.6925  114.292   7.2871  102.901   10.058  126.878   10.572   50.106   2.4701   55.666   2.3352 -5.559856 3.399184 
1 1 1    4    1  -99 o   52.232   1.8119  111.503   7.7028  104.583   10.608  119.221   11.203   50.509   2.5851   53.941   2.5551 -3.431107 3.634759 
1 1 1    4    1  -98 o   40.130   1.9573   65.901   6.3835   59.132   8.8327   73.302   9.2360   37.913   2.8796   42.257   2.6954 -4.343380 3.944246 
1 1 1    4    1  -97 o  147.013   1.3446  881.527   16.113  878.012   21.443  886.087   24.422  146.678   1.7934  147.324   2.0336 -0.6457367 2.711479 
1 1 1    4    1  -96 o   60.229   1.5759  148.085   7.7301  147.973   10.250  148.233   11.771   60.169   2.0931   60.195   2.4038 -0.2565384E-01 3.187328 
1 1 1    4    1  -95 o  162.815   1.6685  1081.46   22.144  1091.27   31.574  1071.96   31.063  163.472   2.3695  162.022   2.3520 1.450180 3.338642 
1 1 1    4    1  -94 o  105.618   1.3738  454.930   11.827  459.962   15.059  446.828   19.108  106.180   1.7399  104.619   2.2406 1.560806 2.836763 
1 1 1    4    1  -93 o  100.873   1.5086  415.004   12.404  418.812   14.460  404.396   24.136  101.322   1.7508   99.431   2.9813 1.890877 3.457353 
1 1 1    4    1  -92 o  132.419   1.3914  715.055   15.018  711.562   18.763  721.284   25.055  132.075   1.7428  132.932   2.3122 -0.8566589 2.895452 
1 1 1    4    1  -91 f  168.318   1.3927  1155.27   19.109  1165.68   25.309  1141.47   29.141  169.043   1.8367  167.253   2.1375 1.790359 2.818227 
1 1 1    4    1  -90 o   42.346   2.1199   73.346   7.2941   74.780   8.6201   69.731   13.688   42.730   2.4855   41.071   4.1451 1.658852 4.833160 
1 1 1    4    1  -89 o   38.970   2.2248   62.166   7.0380   58.695   9.0067   67.608   11.279   37.798   2.9465   40.529   3.4467 -2.731102 4.534456 
1 1 1    4    1  -88 o  250.690   1.7781  2563.09   36.334  2574.97   50.979  2550.83   51.800  251.191   2.4897  250.004   2.5418 1.187286 3.558031 
1 1 1    4    1  -87 o   91.177   1.3357  338.938   9.9272  346.372   14.459  332.308   13.654   92.154   1.9247   90.266   1.8557 1.888046 2.673618 
1 1 1    4    1  -86 o  108.945   1.2627  483.882   11.214  486.018   15.625  481.613   16.103  109.170   1.7558  108.672   1.8178 0.4979630 2.527333 
1 1 1    4    1  -85 o  112.919   1.3576  519.844   12.496  552.247   16.718  478.817   18.812  116.372   1.7624  108.346   2.1300 8.025879 2.764584 
1 1 1    4    1  -84 o   41.619   1.8973   70.785   6.4197   72.038   8.5965   69.205   9.6527   41.943   2.5260   41.076   2.9016 0.8678551 3.847070 
1 1 1    4    1  -83 o  210.058   1.5088  1799.04   25.835  1816.27   38.765  1785.28   34.652  211.015   2.2537  209.223   2.0318 1.792465 3.034357 
1 1 1    4    1  -82 o   10.442   4.1168   2.4569   5.1583   2.5711   7.1253   2.3312   7.4773   11.899   4.7895   12.034   4.8837 -0.1343813 6.840293 
1 1 1    4    1  -81 f  125.882   1.3399  646.021   13.749  666.025   19.206  624.992   19.692  127.802   1.8436  123.799   1.9514 4.003082 2.684536 
1 1 1    4    1  -80 o  210.960   1.4891  1814.43   25.607  1797.30   38.044  1828.62   34.624  209.923   2.2233  211.757   2.0059 -1.834274 2.994411 
1 1 1    4    1  -79 o  167.146   1.3516  1138.94   18.415  1093.68   27.284  1176.81   24.957  163.766   2.0439  169.886   1.8022 -6.120087 2.724953 
1 1 1    4    1  -78 o  152.902   1.2240  953.047   15.256  945.948   21.342  960.465   21.817  152.317   1.7189  153.481   1.7439 -1.163498 2.448586 
1 1 1    4    1  -77 o   80.706   1.1903  265.514   7.8307  275.584   10.884  254.709   11.275   82.216   1.6241   79.038   1.7500 3.177322 2.387469 
1 1 1    4    1  -76 o  268.169   1.6323  2931.97   35.681  2892.26   49.870  2973.62   51.073  266.305   2.2973  270.024   2.3203 -3.718323 3.265227 
1 1 1    4    1  -75 o   99.375   1.1487  402.554   9.3051  406.973   12.985  397.889   13.341   99.912   1.5944   98.789   1.6567 1.122543 2.299270 
1 1 1    4    1  -74 o  104.760   1.1914  447.369   10.174  443.725   14.762  450.666   14.042  104.324   1.7359  105.138   1.6385 -0.8147125 2.387002 
1 1 1    4    1  -73 o  197.402   1.4983  1588.59   24.109  1673.02   39.799  1539.64   30.302  202.542   2.4106  194.323   1.9130 8.219513 3.077401 
1 1 1    4    1  -72 o  208.741   1.5467  1776.33   26.319  1763.04   42.345  1784.70   33.596  207.917   2.4985  209.216   1.9699 -1.298752 3.181674 
1 1 1    4    1  -71 o  194.762   1.4899  1546.35   23.654  1548.73   38.198  1544.88   30.124  194.878   2.4046  194.656   1.8985 0.2219849 3.063729 
1 1 1    4    1  -70 o  302.424   1.8706  3728.88   46.114  3774.71   69.636  3693.09   61.541  304.216   2.8081  300.930   2.5088 3.285187 3.765581 
1 1 1    4    1  -69 o   98.744   1.2473  397.456   10.040  393.660   14.015  401.457   14.389   98.265   1.7497   99.233   1.7789 -0.9679184 2.495157 
1 1 1    4    1  -68 o   59.123   1.3893  142.490   6.6955  142.060   9.1994  142.975   9.7636   58.998   1.9154   59.184   2.0268 -0.1851730 2.788681 
1 1 1    4    1  -67 o  211.434   1.4635  1822.32   25.223  1803.63   33.543  1846.63   38.264  210.334   1.9564  212.818   2.2057 -2.483994 2.948319 
1 1 1    4    1  -66 o  148.756   1.2455  901.993   15.103  901.228   20.151  902.973   22.815  148.687   1.6626  148.827   1.8806 -0.1399994 2.510140 
1 1 1    4    1  -65 o  223.097   1.4344  2028.85   26.086  2017.10   36.576  2041.02   37.214  222.436   2.0172  223.751   2.0404 -1.314407 2.869172 
1 1 1    4    1  -64 o  258.251   1.5782  2718.64   33.224  2693.94   46.534  2744.32   47.451  257.058   2.2208  259.450   2.2437 -2.391937 3.156872 
1 1 1    4    1  -63 o  146.931   1.1796  879.962   14.128  879.889   19.793  880.039   20.173  146.920   1.6527  146.932   1.6843 -0.1211548E-01 2.359756 
1 1 1    4    1  -62 o  131.774   1.1445  707.765   12.293  711.516   17.203  703.851   17.574  132.119   1.5973  131.405   1.6407 0.7140808 2.289830 
1 1 1    4    1  -61 o  287.604   1.7009  3371.71   39.876  3332.57   55.785  3412.59   57.022  285.914   2.3936  289.325   2.4178 -3.411652 3.402195 
1 1 1    4    1  -60 o  249.747   1.6216  2542.43   33.012  2512.77   43.816  2581.38   50.206  248.276   2.1650  251.637   2.4476 -3.360535 3.267751 
1 1 1    4    1  -59 o  222.740   1.5060  2022.26   27.344  2035.45   36.671  2005.74   41.037  223.459   2.0132  221.818   2.2696 1.641098 3.033776 
1 1 1    4    1  -58 o  202.243   1.5036  1667.19   24.787  1682.78   34.897  1651.32   35.214  203.180   2.1070  201.271   2.1463 1.908325 3.007721 
1 1 1    4    1  -57 o  261.094   1.6714  2778.66   35.572  2752.96   47.298  2812.11   53.972  259.876   2.2328  262.648   2.5209 -2.772125 3.367527 
1 1 1    4    1  -56 o  576.421   3.2471 13545.73  152.570 13594.57  205.271 13485.44  228.058  577.398   4.3613  575.042   4.8653 2.356201 6.533922 
1 1 1    4    1  -55 o  780.197   4.1014 24818.83  260.836 25156.05  373.250 24496.96  364.656  785.325   5.8306  774.975   5.7724 10.34998 8.204702 
1 1 1    4    1  -54 o  289.129   1.8008  3407.36   42.442  3509.58   58.002  3289.55   62.268  293.425   2.4250  284.074   2.6890 9.350891 3.620965 
1 1 1    4    1  -53 o  363.394   2.2860  5382.78   67.717  5312.91   84.699  5506.56  112.737  361.017   2.8782  367.517   3.7631 -6.499512 4.737623 
1 1 1    4    1  -52 o  739.878   4.3582 22319.09  262.845 22400.81  373.073 22238.55  370.380  741.102   6.1756  738.415   6.1533 2.687073 8.717896 
1 1 1    4    1  -51 o  257.631   1.7650  2705.35   37.065  2724.21   52.949  2687.24   51.903  258.520   2.5126  256.760   2.4799 1.759827 3.530322 
1 1 1    4    1  -50 f  566.820   3.6241 13097.52  167.449 13104.56  256.060 13092.25  221.333  566.891   5.5412  566.660   4.7917 0.2305908 7.325673 
1 1 1    4    1  -49 o  375.591   2.3603  5750.08   72.262  5693.13  101.689  5808.18  102.706  373.710   3.3381  377.467   3.3380 -3.757294 4.720722 
1 1 1    4    1  -48 o  296.354   1.9589  3579.74   47.321  3646.38   78.194  3541.23   59.441  299.085   3.2073  294.750   2.4740 4.334412 4.050607 
1 1 1    4    1  -47 o  516.713   3.1119 10883.40  131.071 10811.67  184.474 10956.52  186.263  514.971   4.3946  518.409   4.4078 -3.437866 6.224181 
1 1 1    4    1  -46 o  403.474   2.4946  6635.51   82.046  6726.27  117.329  6548.67  114.774  406.206   3.5434  400.808   3.5129 5.398102 4.989658 
1 1 1    4    1  -45 o  411.688   2.3935  6908.38   80.322  6891.70  120.265  6921.81  107.919  411.171   3.5882  412.076   3.2128 -0.9042969 4.816378 
1 1 1    4    1  -44 o  248.287   1.6035  2512.62   32.454  2526.30   43.713  2495.83   48.444  248.958   2.1540  247.451   2.4017 1.507492 3.226125 
1 1 1    4    1  -43 o  486.119   2.9409  9632.50  116.537  9688.72  165.556  9577.28  164.071  487.509   4.1661  484.697   4.1527 2.811493 5.882239 
1 1 1    4    1  -42 o  688.754   4.3466 19339.09  244.034 19068.64  318.841 19721.58  379.181  683.862   5.7197  695.420   6.6890 -11.55786 8.800995 
1 1 1    4    1  -41 o  529.076   3.3932 11410.47  146.339 11506.68  224.931 11339.86  192.696  531.252   5.1941  527.409   4.4822 3.842896 6.860679 
1 1 1    4    1  -40 o  812.667   5.0920 26925.65  337.315 26985.72  516.078 26880.84  445.696  813.404   7.7835  811.896   6.7345 1.507935 10.29248 
1 1 1    4    1  -39 o  452.143   2.7523  8332.93  101.440  8434.41  144.912  8235.43  142.047  454.867   3.9083  449.470   3.8770 5.396790 5.505053 
1 1 1    4    1  -38 o  394.895   2.4458  6356.23   78.730  6461.04  112.730  6256.44  110.003  398.122   3.4737  391.768   3.4446 6.354004 4.891992 
1 1 1    4    1  -37 o  371.465   2.4818  5624.38   75.148  5611.46  114.732  5634.09   99.451  371.019   3.7936  371.775   3.2816 -0.7555847 5.016033 
1 1 1    4    1  -36 f  722.717   4.5507 21294.05  268.089 20850.99  402.237 21648.17  359.606  715.036   6.9011  728.628   6.0546 -13.59155 9.180589 
1 1 1    4    1  -35 o  160.583   1.3225  1051.03   17.311  1054.78   24.461  1047.28   24.502  160.867   1.8654  160.294   1.8752 0.5732422 2.644993 
1 1 1    4    1  -34 o  334.894   2.1242  4571.39   57.987  4541.65   81.533  4601.84   82.487  333.792   2.9965  335.996   3.0117 -2.204407 4.248499 
1 1 1    4    1  -33 o  215.633   1.5325  1895.20   26.938  1822.22   36.958  1977.91   39.346  211.438   2.1443  220.285   2.1912 -8.846771 3.065852 
1 1 1    4    1  -32 o  629.343   3.7383 16146.62  191.775 16256.41  273.486 16040.40  268.992  631.404   5.3136  627.198   5.2614 4.205994 7.477742 
1 1 1    4    1  -31 o  377.386   2.5105  5805.33   77.229  5968.45  104.319  5607.52  114.879  382.634   3.3446  370.874   3.7999 11.76086 5.062208 
1 1 1    4    1  -30 o  591.904   3.5226 14282.82  169.963 14549.74  244.236 14032.17  236.670  597.336   5.0160  586.619   4.9494 10.71680 7.046732 
1 1 1    4    1  -29 o  506.577   3.2564 10461.51  134.468 10471.12  178.030 10448.74  205.180  506.767   4.3097  506.193   4.9726 0.5746460 6.580294 
1 1 1    4    1  -28 o  621.505   3.9400 15748.78  199.608 15873.32  265.854 15587.86  302.203  623.874   5.2277  618.179   5.9972 5.695496 7.955826 
1 1 1    4    1  -27 o  120.520   1.2428  592.023   12.209  602.568   15.923  576.981   19.019  121.587   1.6066  118.976   1.9611 2.611259 2.535166 
1 1 1    4    1  -26 o  555.389   3.5413 12575.84  160.325 12582.35  212.017 12567.14  245.012  555.467   4.6825  555.080   5.4150 0.3873291 7.158734 
1 1 1    4    1  -25 o  638.854   4.3635 16642.73  227.232 16682.85  278.820 16563.38  392.121  639.544   5.3483  637.014   7.5515 2.529785 9.253662 
1 1 1    4    1  -24 o  732.581   4.6029 21885.77  274.867 21786.54  362.175 22020.56  422.116  730.765   6.0800  734.556   7.0497 -3.790222 9.309397 
1 1 1    4    1  -23 o  239.598   1.7382  2339.95   33.949  2390.45   45.532  2276.72   50.945  242.162   2.3066  236.326   2.6446 5.836426 3.509151 
1 1 1    4    1  -22 o  368.708   2.2845  5541.58   68.661  5588.35   97.818  5496.17   96.400  370.234   3.2412  367.168   3.2209 3.065613 4.569431 
1 1 1    4    1  -21 o  146.968   1.1527  880.377   13.810  871.736   18.555  891.105   20.676  146.243   1.5565  147.858   1.7155 -1.614761 2.316388 
1 1 1    4    1  -20 o  239.415   1.5347  2336.34   29.950  2324.63   40.034  2351.24   45.136  238.809   2.0565  240.168   2.3055 -1.359268 3.089474 
1 1 1    4    1  -19 o   91.152   1.0989  338.651   8.1649  336.100   10.142  343.351   13.765   90.807   1.3701   91.780   1.8399 -0.9725342 2.294027 
1 1 1    4    1  -18 o  432.015   2.3510  7607.89   82.794  7575.47  116.782  7640.66  117.397  431.064   3.3235  432.915   3.3267 -1.850525 4.702426 
1 1 1    4    1  -17 o  324.966   2.0582  4304.51   54.520  4296.51   89.187  4309.28   68.891  324.637   3.3703  325.136   2.5993 -0.4995117 4.256234 
1 1 1    4    1  -16 o  156.427   1.2589  997.349   16.052  957.454   25.824  1022.47   20.492  153.262   2.0670  158.384   1.5873 -5.121368 2.606137 
1 1 1    4    1  -15 o  591.159   3.3080 14246.73  159.408 14021.47  235.945 14435.91  216.217  586.384   4.9362  595.015   4.4579 -8.631165 6.651214 
1 1 1    4    1  -14 o  501.266   2.6892 10242.52  109.883 10208.55  154.986 10276.86  155.814  500.398   3.7996  502.069   3.8072 -1.671051 5.378840 
1 1 1    4    1  -13 o  702.340   3.6957 20110.19  211.582 20212.46  300.644 20009.82  297.819  704.029   5.2387  700.493   5.2157 3.536499 7.392422 
1 1 1    4    1  -12 o  519.606   2.7792 11005.69  117.714 10978.86  166.146 11032.73  166.801  518.935   3.9277  520.206   3.9336 -1.271301 5.558785 
1 1 1    4    1  -11 o  329.618   1.9595  4428.52   52.650  4602.25   81.334  4303.22   69.075  336.006   2.9696  324.913   2.6080 11.09360 3.952233 
1 1 1    4    1  -10 o  254.183   1.5960  2633.42   33.069  2620.67   49.435  2643.74   44.488  253.560   2.3918  254.677   2.1430 -1.116287 3.211389 
1 1 1    4    1   -9 o  872.804   5.0960 31062.30  362.565 30804.25  509.080 31327.91  516.488  868.980   7.1869  876.330   7.2303 -7.350403 10.19453 
1 1 1    4    1   -8 o  160.016   1.2625  1043.62   16.467  1005.19   22.914  1084.66   23.681  157.040   1.7900  163.130   1.7808 -6.089569 2.524981 
1 1 1    4    1   -7 o  917.345   5.3529 34314.38  400.271 33426.67  553.007 35291.21  580.103  905.196   7.4947  930.081   7.6515 -24.88525 10.71054 
1 1 1    4    1   -6 o  184.199   1.3625  1382.91   20.458  1418.60   29.444  1349.59   28.447  186.558   1.9362  181.964   1.9179 4.593872 2.725250 
1 1 1    4    1   -5 o  340.840   2.4649  4735.32   68.485  4753.63   84.151  4699.40  117.853  341.490   3.0230  339.512   4.2584 1.977936 5.222361 
1 1 1    4    1   -4 o  193.555   1.7762  1526.99   28.025  1607.31   37.323  1423.17   42.433  198.577   2.3058  186.852   2.7859 11.72446 3.616344 
1 1 1    4    1   -3 o  1204.00   8.0716 59143.12  792.182 58535.33  961.282 60429.47  1398.48  1197.50   9.8478  1215.75   14.112 -18.24976 17.20796 
1 1 1    4    1   -2 o  152.407   2.4586  946.801   30.544   0.0000   0.0000  946.801   30.544  ?   ?   152.407   2.4586 0.000000 2.458555 
1 1 1    4    1   -1 o  490.906   4.1726  9824.71  166.971  9467.36  228.887 10231.19  244.112  481.833   5.8276  500.887   5.9788 -19.05325 8.349043 
1 1 1    4    1    0 o  617.676   5.9646 15558.48  300.314 15463.97  517.111 15606.58  368.900  615.460   10.307  618.544   7.3165 -3.084045 12.64012 
1 1 1    4    1    1 o  541.850   4.5672 11970.29  201.728 11343.03  385.228 12207.28  236.790  527.219   8.9638  547.156   5.3090 -19.93787 10.41802 
1 1 1    4    1    2 o  263.823   2.8357  2837.17   60.983   0.0000   0.0000  2837.17   60.983  ?   ?   263.823   2.8357 0.000000 2.835679 
1 1 1    4    1    3 o  211.552   1.8763  1824.16   32.357  1772.39   50.231  1860.88   42.302  208.520   2.9552  213.666   2.4288 -5.146271 3.825221 
1 1 1    4    1    4 o  662.648   4.9408 17903.55  266.878 18495.68  433.978 17543.43  338.438  673.314   7.9070  655.869   6.3303 17.44543 10.12888 
1 1 1    4    1    5 o  592.943   4.0589 14333.29  196.181 14346.37  277.730 14320.26  277.153  593.135   5.7443  592.595   5.7375 0.5395508 8.118855 
1 1 1    4    1    6 o  325.430   2.3719  4316.79   62.921  4284.90   88.560  4349.29   89.413  324.211   3.3510  326.638   3.3581 -2.426941 4.744080 
1 1 1    4    1    7 o  200.363   1.8179  1636.31   29.691  1637.83   38.359  1634.06   46.895  200.452   2.3476  200.217   2.8734 0.2352753 3.710431 
1 1 1    4    1    8 o  114.560   1.4098  534.919   13.166  536.218   17.029  532.987   20.758  114.698   1.8214  114.350   2.2269 0.3476791 2.876908 
1 1 1    4    1    9 o  436.274   3.0599  7758.81  108.819  7614.35  151.491  7912.82  156.415  432.160   4.3004  440.547   4.3556 -8.386658 6.120839 
1 1 1    4    1   10 o  709.753   4.8205 20539.91  278.893 20115.55  387.414 20996.39  401.808  702.243   6.7679  717.445   6.8706 -15.20172 9.644121 
1 1 1    4    1   11 o  426.646   3.2869  7420.40  114.312  7551.31  183.391  7337.22  146.186  430.329   5.2281  424.221   4.2274 6.107666 6.723402 
1 1 1    4    1   12 o  580.904   4.3663 13758.46  206.754 13815.51  328.054 13720.86  266.300  581.950   6.9155  580.041   5.6322 1.909424 8.918839 
1 1 1    4    1   13 o  673.492   5.0218 18496.30  275.697 18758.88  441.319 18328.23  353.070  678.002   7.9852  670.318   6.4617 7.684021 10.27211 
1 1 1    4    1   14 o  180.326   1.7167  1325.40   25.234  1369.72   40.799  1297.94   32.113  183.307   2.7304  178.445   2.2077 4.862961 3.511294 
1 1 1    4    1   15 o  630.568   4.7177 16213.40  242.491 16388.18  387.070 16100.49  311.110  633.731   7.4929  628.271   6.0748 5.459412 9.646041 
1 1 1    4    1   16 o  325.937   2.6096  4330.50   69.334  4296.02  109.087  4353.87   89.807  324.600   4.1228  326.798   3.3713 -2.198669 5.325671 
1 1 1    4    1   17 o  411.470   3.1854  6902.16  106.841  6917.77  169.433  6891.86  137.660  411.861   5.0467  411.130   4.1076 0.7306213 6.507084 
1 1 1    4    1   18 o  211.205   1.8929  1818.25   32.589  1921.52   53.522  1757.42   41.082  217.105   3.0243  207.636   2.4273 9.468964 3.877893 
1 1 1    4    1   19 o  419.515   3.2425  7174.92  110.884  7327.98  178.405  7078.57  141.543  423.879   5.1633  416.652   4.1675 7.226624 6.635388 
1 1 1    4    1   20 o  415.592   3.5987  7041.85  121.913  6995.45  171.393  7089.37  173.448  414.151   5.0769  416.921   5.1037 -2.769440 7.198756 
1 1 1    4    1   21 o  462.251   7.9196  8723.44  298.413   0.0000   0.0000  8723.44  298.413  ?   ?   462.251   7.9196 0.000000 7.919627 
1 1 1    4    1   22 o  558.829   6.6720 12743.63  303.927 13254.85  444.555 12295.00  416.456  569.560   9.5752  548.587   9.3130 20.97272 13.35726 
1 1 1    4    1   23 o  191.075   2.8422  1488.36   44.269  1456.81   62.139  1520.86   63.083  189.018   4.0329  193.129   4.0071 -4.111008 5.685190 
1 1 1    4    1   24 o  395.479   4.8809  6378.65  157.347  6637.90  229.910  6150.23  215.804  403.302   6.9934  388.217   6.8194 15.08524 9.767961 
1 1 1    4    1   25 o  761.031   7.3065 23638.24  453.258 24390.63  806.688 23291.12  547.928  771.933   12.820  755.169   8.9011 16.76471 15.60715 
1 1 1    4    1   26 o  418.814   3.6288  7151.42  123.884  6941.80  170.976  7383.11  179.751  412.565   5.0840  425.471   5.1828 -12.90659 7.260075 
1 1 1    4    1   27 o  496.008   4.2251 10031.54  170.828 10146.46  243.826  9920.74  239.409  498.734   5.9976  493.158   5.9555 5.575867 8.452147 
1 1 1    4    1   28 o  520.324   4.4151 11039.39  187.262 11247.63  269.015 10843.62  260.832  525.090   6.2850  515.579   6.2063 9.510986 8.832849 
1 1 1    4    1   29 o  531.529   4.0306 11518.85  174.637 11595.98  226.743 11406.39  273.809  533.245   5.2164  528.794   6.3522 4.450256 8.219584 
1 1 1    4    1   30 o  764.320   5.6805 23824.75  353.913 23793.89  456.526 23871.23  560.275  763.665   7.3338  764.705   8.9882 -1.039856 11.60048 
1 1 1    4    1   31 o  258.272   2.2052  2718.94   46.426  2702.98   59.776  2743.19   73.701  257.506   2.8478  259.405   3.4854 -1.898834 4.500896 
1 1 1    4    1   32 o  453.770   3.9025  8394.35  144.349  8430.08  204.843  8359.11  203.444  454.677   5.5269  452.759   5.5124 1.917511 7.805985 
1 1 1    4    1   33 o  419.651   2.9696  7178.63  101.583  6868.83  138.691  7537.17  149.205  410.470   4.1451  429.972   4.2570 -19.50275 5.941720 
1 1 1    4    1   34 o  309.687   2.5154  3909.24   63.500  3937.16  101.353  3891.20   81.473  310.770   4.0009  308.963   3.2350 1.806915 5.145150 
1 1 1    4    1   35 o  333.919   2.6751  4544.96   72.814  4494.68  114.589  4579.02   94.300  332.042   4.2336  335.157   3.4517 -3.114441 5.462390 
1 1 1    4    1   36 f  362.841   2.8689  5366.43   84.854  5348.11  134.218  5378.62  109.518  362.193   4.5461  363.241   3.6987 -1.048065 5.860663 
1 1 1    4    1   37 o  495.223   3.4466  9997.03  139.131 10014.79  241.610  9988.22  170.179  495.589   5.9808  494.986   4.2177 0.6024475 7.318388 
1 1 1    4    1   38 o  696.192   4.7412 19759.77  269.060 19354.50  457.842 19973.58  332.543  688.833   8.1539  699.900   5.8288 -11.06683 10.02299 
1 1 1    4    1   39 o  671.971   4.5841 18408.44  251.099 18665.89  440.442 18284.47  305.632  676.480   7.9873  669.663   5.5989 6.816956 9.754211 
1 1 1    4    1   40 o  1301.06   8.0749 69046.16  856.390 67296.42  1279.04 70467.99  1152.98  1283.82   12.222  1313.99   10.765 -30.16772 16.28662 
1 1 1    4    1   41 o  916.307   5.7227 34234.29  427.445 34212.32  652.616 34250.80  565.662  915.771   8.7425  916.391   7.5725 -0.6210327 11.56607 
1 1 1    4    1   42 o  669.643   4.2308 18280.53  230.943 18344.57  354.036 18233.09  304.695  670.715   6.4755  668.718   5.5897 1.996765 8.554328 
1 1 1    4    1   43 o  1048.58   7.0614 44841.59  603.566 42084.18  988.556 46480.38  762.101  1015.23   11.945  1067.38   8.7590 -52.15625 14.81264 
1 1 1    4    1   44 o  337.753   2.2918  4649.80   63.097  4537.19   94.550  4740.21   84.723  333.623   3.4767  341.012   3.0479 -7.388580 4.623530 
1 1 1    4    1   45 o  616.623   4.6278 15501.38  232.611 15525.07  300.881 15466.20  366.729  617.034   5.9820  615.791   7.3059 1.243713 9.442540 
1 1 1    4    1   46 o  490.015   3.4225  9788.05  136.705 10108.38  198.490  9498.98  188.552  497.927   4.8903  482.688   4.7921 15.23923 6.846869 
1 1 1    4    1   47 o  663.282   4.5315 17936.21  245.007 17813.75  344.538 18061.49  348.480  660.917   6.3952  665.495   6.4239 -4.578064 9.064465 
1 1 1    4    1   48 o  1114.32   6.9332 50645.14  629.765 51074.81  839.322 50091.60  952.647  1118.73   9.2038  1107.69   10.551 11.03967 14.00087 
1 1 1    4    1   49 o  390.881   2.6064  6227.90   83.046  6231.87  110.161  6222.68  126.394  390.990   3.4564  390.690   3.9688 0.3000793 5.262890 
1 1 1    4    1   50 f  909.875   5.6920 33759.75  422.165 33697.80  557.648 33842.91  646.144  908.860   7.5271  910.673   8.7042 -1.812927 11.50742 
1 1 1    4    1   51 o  405.127   2.8964  6690.39   95.649  6674.88  135.051  6706.01  135.486  404.628   4.0946  405.571   4.0982 -0.9425354 5.793136 
1 1 1    4    1   52 o  588.581   3.7547 14123.10  180.141 14052.04  237.418 14219.53  276.552  587.042   4.9615  590.485   5.7456 -3.442993 7.591279 
1 1 1    4    1   53 o  394.811   2.6228  6353.92   84.409  6236.05  110.129  6521.76  131.416  391.112   3.4543  399.954   4.0309 -8.842224 5.308543 
1 1 1    4    1   54 o  229.937   1.7417  2155.02   32.645  2112.01   42.766  2215.07   50.535  227.625   2.3049  233.109   2.6595 -5.483566 3.519272 
1 1 1    4    1   55 o  463.020   3.0133  8739.68  113.732  8710.65  150.136  8778.76  174.220  462.214   3.9848  463.990   4.6063 -1.775360 6.090695 
1 1 1    4    1   56 o  394.156   2.4488  6333.00   78.679  6335.33  111.388  6330.68  111.150  394.199   3.4665  394.055   3.4603 0.1445007 4.897975 
1 1 1    4    1   57 o  335.753   2.1431  4595.17   58.655  4651.77   83.816  4540.86   82.111  337.792   3.0440  333.742   3.0183 4.050476 4.286702 
1 1 1    4    1   58 o  344.444   2.1879  4836.23   61.431  4814.33   86.659  4858.35   87.097  343.637   3.0937  345.205   3.0952 -1.567444 4.376221 
1 1 1    4    1   59 o  297.139   1.9487  3599.00   47.200  3581.44   66.613  3616.70   66.890  296.394   2.7571  297.849   2.7550 -1.455322 3.897684 
1 1 1    4    1   60 o  236.382   1.5601  2277.59   30.062  2277.77   45.344  2277.45   40.154  236.378   2.3533  236.367   2.0841 0.1119995E-01 3.143455 
1 1 1    4    1   61 o  242.401   1.5868  2395.08   31.355  2409.23   47.455  2384.12   41.772  243.100   2.3948  241.836   2.1190 1.263809 3.197643 
1 1 1    4    1   62 o  303.661   1.8664  3758.84   46.198  3793.58   69.963  3731.98   61.516  305.030   2.8138  302.555   2.4943 2.475220 3.760154 
1 1 1    4    1   63 o  386.301   2.4106  6083.96   75.907  6109.46  107.748  6058.84  106.954  387.053   3.4151  385.447   3.4040 1.605957 4.821873 
1 1 1    4    1   64 o   55.312   1.4994  124.799   6.7541  121.557   9.4926  128.123   9.6119   54.563   2.1384   56.021   2.1086 -1.457893 3.003199 
1 1 1    4    1   65 o   84.853   1.3635  293.487   9.4313  306.490   12.631  277.101   14.179   86.709   1.7870   82.416   2.1122 4.292122 2.766773 
1 1 1    4    1   66 o  222.284   1.5932  2014.18   28.867  2016.56   36.488  2010.20   47.197  222.404   2.0127  222.032   2.6077 0.3719330 3.294101 
1 1 1    4    1   67 o  384.539   2.5640  6029.76   80.369  5965.47  105.338  6119.31  124.326  382.415   3.3792  387.256   3.9385 -4.840485 5.189482 
1 1 1    4    1   68 o   99.936   1.1879  407.096   9.6773  397.827   13.956  415.681   13.431   98.785   1.7331  100.979   1.6317 -2.193802 2.380351 
1 1 1    4    1   69 o   72.762   1.1608  215.809   6.8850  199.875   10.440  228.073   9.1590   69.995   1.8313   74.798   1.5022 -4.803619 2.368618 
1 1 1    4    1   70 o  348.622   1.9807  4955.33   56.287  4904.32   88.090  4990.53   73.173  346.731   3.1167  349.815   2.5661 -3.084412 4.037189 
1 1 1    4    1   71 o  340.002   1.8517  4713.17   51.319  4701.81   75.883  4722.74   69.668  339.525   2.7418  340.299   2.5115 -0.7749634 3.718231 
1 1 1    4    1   72 o  278.860   1.6726  3170.30   38.019  3155.70   53.371  3185.35   54.173  278.178   2.3537  279.480   2.3779 -1.302277 3.345759 
1 1 1    4    1   73 o  106.984   1.1384  466.555   9.9278  455.426   13.636  479.107   14.482  105.694   1.5828  108.406   1.6388 -2.712044 2.278356 
1 1 1    4    1   74 o  124.136   1.1516  628.154   11.653  624.789   16.175  631.783   16.801  123.795   1.6029  124.485   1.6557 -0.6898117 2.304489 
1 1 1    4    1   75 o   23.443   2.5797   22.687   4.8484   18.014   6.4703   28.672   7.3217   20.656   3.9871   26.273   3.5061 -5.617079 5.309400 
1 1 1    4    1   76 o  362.598   2.0542  5361.34   60.716  5317.14   85.110  5407.15   86.642  361.011   2.8922  364.051   2.9197 -3.039307 4.109626 
1 1 1    4    1   77 o  298.953   1.7668  3643.99   43.055  3656.47   60.830  3631.47   60.948  299.408   2.4924  298.382   2.5058 1.026398 3.534293 
1 1 1    4    1   78 o  162.403   1.1863  1075.16   15.705  1060.94   23.007  1087.58   21.491  161.308   1.7497  163.326   1.6142 -2.017609 2.380562 
1 1 1    4    1   79 o  116.244   1.1051  550.826   10.471  541.222   15.269  559.354   14.388  115.215   1.6258  117.132   1.5069 -1.916946 2.216699 
1 1 1    4    1   80 o  152.680   1.2351  950.304   15.371  962.522   24.476  942.346   19.752  153.634   1.9544  152.029   1.5939 1.605362 2.521937 
1 1 1    4    1   81 f  215.053   1.3598  1885.43   23.838  1849.20   34.764  1917.58   32.750  212.943   2.0027  216.854   1.8527 -3.910355 2.728263 
1 1 1    4    1   82 o   59.583   1.3336  144.732   6.4771  139.816   9.3953  149.184   8.9415   58.520   1.9724   60.458   1.8164 -1.938309 2.681352 
1 1 1    4    1   83 o   67.158   1.3948  183.880   7.6357  179.978   10.426  188.394   11.214   66.404   1.9281   67.936   2.0274 -1.531136 2.797815 
1 1 1    4    1   84 o  213.845   1.3864  1864.43   24.166  1847.04   35.432  1879.55   33.046  212.806   2.0426  214.682   1.8884 -1.875702 2.781723 
1 1 1    4    1   85 o  140.240   1.5503  801.913   17.722  801.948   25.637  801.881   24.525  140.211   2.2431  140.210   2.1458 0.7171631E-03 3.104214 
1 1 1    4    1   86 o   65.373   1.4866  174.248   7.9216  174.926   11.964  173.719   10.570   65.445   2.2461   65.233   1.9902 0.2118988 3.000954 
1 1 1    4    1   87 o   52.386   1.7023  112.032   7.2596  116.548   10.635  108.091   9.9340   53.388   2.4503   51.416   2.3767 1.972553 3.413591 
1 1 1    4    1   88 o  179.207   1.4890  1309.52   21.752  1285.24   34.934  1324.90   27.798  177.471   2.4148  180.230   1.8921 -2.759583 3.067822 
1 1 1    4    1   89 o  269.695   1.7453  2966.54   38.368  2931.46   56.850  2995.88   51.995  267.983   2.6025  270.950   2.3542 -2.966278 3.509274 
1 1 1    4    1   90 o  133.223   1.2927  723.666   14.038  696.886   20.490  747.359   19.272  130.702   1.9232  135.363   1.7466 -4.661011 2.597964 
1 1 1    4    1   91 f  112.943   1.2810  520.131   11.794  519.848   17.405  520.371   16.036  112.884   1.8915  112.949   1.7418 -0.6467438E-01 2.571255 
1 1 1    4    1   92 o   13.962   4.3987   7.8753   5.5894   10.105   8.3809   6.0892   7.5014   16.168   5.4087   13.750   5.0721 2.418501 7.414843 
1 1 1    4    1   93 o  117.147   1.1804  559.570   11.272  556.928   16.445  561.912   15.481  116.842   1.7266  117.370   1.6181 -0.5280609 2.366346 
1 1 1    4    1   94 o   70.717   1.4215  203.955   8.1940  208.003   12.907  201.223   10.605   71.347   2.2221   70.201   1.8549 1.145866 2.894515 
1 1 1    4    1   95 o  213.443   1.4663  1858.20   25.512  1832.69   39.869  1875.90   33.199  211.857   2.3087  214.403   1.8996 -2.546280 2.989712 
1 1 1    4    1   96 o  101.873   1.3201  423.255   10.962  421.106   16.729  424.872   14.513  101.570   2.0205  102.042   1.7448 -0.4728165 2.669577 
1 1 1    4    1   97 o   69.551   1.4790  197.330   8.3851  199.322   12.975  195.902   10.988   69.821   2.2828   69.249   1.9485 0.5724182 3.001290 
1 1 1    4    1   98 o   75.423   1.4349  232.065   8.8217  238.003   13.745  227.905   11.504   76.303   2.2121   74.696   1.8909 1.607422 2.910130 
1 1 1    4    1   99 o   98.054   1.3521  392.204   10.807  399.636   16.670  386.816   14.194   98.921   2.0674   97.346   1.7888 1.574646 2.733855 
1 1 1    4    1  100 o   53.005   1.6920  114.800   7.3013  103.259   10.167  127.091   10.492   50.190   2.4929   55.715   2.3152 -5.524319 3.402146 
1 1 1    4    1  101 o   69.681   1.5579  198.174   8.8489  190.957   13.175  204.106   11.944   68.296   2.3702   70.647   2.0763 -2.350922 3.151004 
1 1 1    4    1  102 o   88.617   1.4569  320.501   10.524  319.961   14.848  321.046   14.918   88.482   2.0586   88.631   2.0649 -0.1490631 2.915732 
1 1 1    4    1  103 o   40.227   2.0480   66.318   6.6933   53.147   9.7247   78.175   9.2266   35.813   3.3708   43.615   2.6071 -7.801376 4.261371 
1 1 1    4    1  104 o  111.405   1.3773  506.596   12.507  506.642   17.677  506.549   17.698  111.327   1.9479  111.317   1.9505 0.1066589E-01 2.756568 
1 1 1    4    1  105 o   83.752   1.5067  286.459   10.286  282.771   13.784  291.094   15.452   83.143   2.0338   84.294   2.2508 -1.150986 3.033586 
1 1 1    4    1  106 o   42.461   2.1134   73.980   7.2919   73.743   9.6935   74.291   11.067   42.280   2.8289   42.361   3.2294 -0.8091736E-01 4.293208 
1 1 1    4    1  107 o  101.245   1.4417  418.726   11.899  411.257   17.890  424.651   15.934  100.190   2.1906  101.870   1.9188 -1.679794 2.912117 
1 1 1    4    1  108 o   13.686   4.4944   7.5325   5.7941   9.6124   8.4709   5.7039   7.9428   15.740   5.4351   13.627   5.1790 2.113458 7.507468 
1 1 1    4    1  109 o   63.640   1.5423  165.588   8.0010  176.331   11.606  155.858   11.045   65.535   2.1755   61.603   2.2032 3.932117 3.096237 
1 1 1    4    1  110 o   26.471   2.8247   29.207   6.0009   34.908   8.6118   23.826   8.3666   28.741   3.7664   23.459   4.5393 5.281250 5.898422 
1 1 1    4    1  111 o   72.325   1.3050  213.777   7.6938  213.906   10.942  213.651   10.820   72.222   1.8602   72.184   1.8404 0.3848267E-01 2.616756 
1 1 1    4    1  112 o   72.619   1.3111  215.566   7.7610  217.665   11.048  213.521   10.905   72.839   1.8623   72.144   1.8559 0.6955185 2.629117 
1 1 1    4    1  113 o   10.567   4.1111   3.0548   5.0871  -5.2584   7.2224   11.240   7.1665   9.0867   4.1913   16.178   4.9623 -7.091354 6.495498 
1 1 1    4    1  114 o   12.986   4.2255   6.9369   5.1271  -0.5183   7.3107   14.153   7.1925   10.586   4.5882   17.911   4.8206 -7.324632 6.655105 
1 1 1    4    1  115 o  107.056   1.2261  468.625   10.700  456.638   15.077  480.790   15.188  105.501   1.7531  108.268   1.7209 -2.767029 2.456630 
1 1 1    4    1  116 o   22.114   3.0403   20.705   5.3356   13.536   7.4907   28.087   7.6018   17.489   5.0024   25.599   3.7545 -8.110407 6.254607 
1 1 1    4    1  117 f   67.103   1.3664  184.338   7.4742  179.230   10.466  189.654   10.677   65.987   1.9479   67.887   1.9314 -1.899071 2.743131 
1 1 1    4    1  118 o   47.682   1.6186   93.383   6.2820  102.380   8.9521   84.654   8.8175   49.765   2.2124   45.184   2.4026 4.580185 3.266061 
1 1 1    4    1  119 f   22.163   3.0394   20.871   5.3464   26.196   7.6004   15.655   7.5220   24.576   3.9259   18.661   4.8878 5.915340 6.269215 
1 1 1    4    1  120 o   56.042   1.4782  128.915   6.7467  126.217   9.5822  131.568   9.5008   55.242   2.1320   56.426   2.0691 -1.184063 2.970929 
1 1 1    4    1  121 o   21.372   3.1853   19.594   5.3802   22.803   7.6288   16.419   7.5887   22.682   4.2831   19.009   4.8746 3.672638 6.488914 
1 1 1    4    1  122 o   28.646   2.5045   34.415   5.7894   32.802   8.5001   35.812   7.9070   27.418   3.9141   28.883   3.4250 -1.464399 5.201073 
1 1 1    4    1  123 o   35.561   2.1046   52.583   6.0736   44.851   8.9783   59.107   8.2470   32.285   3.4658   37.469   2.7187 -5.184292 4.404907 
1 1 1    4    1  124 o   16.040   4.1170   11.624   5.4096   11.147   7.9018   12.045   7.4215   15.783   5.2512   16.242   5.0616 -0.4592094 7.293428 
1 1 1    4    1  125 o   16.066   4.1577   11.731   5.4864   13.547   8.7433   10.551   7.0463   17.061   5.5154   15.291   4.9519 1.769278 7.412227 
1 1 1    4    1  126 f   24.475   3.0247   25.816   5.9062   32.832   9.1073   20.724   7.7590   26.973   4.2853   21.151   4.6291 5.821739 6.308129 
1 1 1    4    1  127 o   72.726   1.7653  219.051   10.465  206.874   12.916  242.318   17.854   70.288   2.2573   75.419   2.9097 -5.131111 3.682609 
1 1 1    4    1  128 o   9.2393   4.2005  -2.7613   6.9124   2.3367   8.7600 -11.1737   11.253   11.976   5.1033   10.158   4.8510 1.817668 7.041078 
1 1 1    4    1  129 o   20.332   4.2464   19.086   6.8103   25.762   9.0041   10.161   10.411   23.297   4.8972   15.417   5.9122 7.879504 7.676970 
1 1 1    4    1  130 o   16.574   5.3876   13.261   8.3362   10.360   11.011   17.157   12.760   15.569   6.0507   18.378   6.6405 -2.808848 8.983732 
1 1 1    4    1  131 o   19.309   5.2842   18.393   8.5574   14.314   10.903   24.935   13.809   17.075   6.1425   21.330   6.9342 -4.254519 9.263540 
1 1 1    4    1  132 o   33.373   3.6020   49.467   9.6439   36.587   12.179   71.120   15.791   27.042   5.7048   38.541   5.1556 -11.49900 7.689284 
1 1 1    4    1  133 o   29.663   4.1153   40.213   9.6831   28.301   12.149   60.959   16.033   23.140   6.2812   34.873   5.8470 -11.73309 8.581482 
1 1 1    4    1  134 o   14.898   5.8497   9.4531   10.378   17.243   14.575   1.4415   14.781   18.148   6.9862   13.918   6.2518 4.230794 9.375069 
1 1 1    4    1  135 o   17.983   6.0991   16.816   10.656   13.396   15.240   20.087   14.905   16.953   6.9375   19.054   7.1266 -2.100653 9.945719 
1 1 1    4    1  136 o   22.885   5.7189   26.961   10.638   34.409   15.184   19.780   14.908   24.416   7.1635   18.861   7.1118 5.555387 10.09418 
1 1 1    4    1  137 o   28.792   4.7648   39.728   10.792   16.398   15.160   63.700   15.367   17.686   7.0305   35.820   5.4334 -18.13387 8.885386 
1 1 1    4    1  138 o   17.390   6.0119   15.711   10.365   9.2215   14.597   22.312   14.722   15.566   6.6087   19.691   7.1302 -4.125143 9.721912 
1 1 1    4    1  139 o   25.151   7.2979   36.999   15.836   37.636   22.297   36.350   22.494   23.296   8.7158   22.896   8.7123 0.3993435 12.32354 
1 1 1    4    2 -138 o   16.200   5.6824   13.070   9.2783   22.832   14.181   5.7630   12.269   19.980   7.0238   14.069   6.0187 5.911324 9.249799 
1 1 1    4    2 -137 o   15.775   5.6237   12.223   9.1177   4.9896   11.406   25.026   15.175   13.562   5.8026   20.608   7.2639 -7.045196 9.297043 
1 1 1    4    2 -136 o   35.904   3.8428   58.420   11.072   52.048   12.543   80.905   23.562   32.984   4.8065   36.682   8.0969 -3.698494 9.416119 
1 1 1    4    2 -135 o   11.741   5.2052   0.5087   9.8978   4.3237   11.194 -13.1611   21.190   13.350   5.7307   13.588   6.5334 -0.2388344 8.690570 
1 1 1    4    2 -134 o   27.989   4.3537   36.470   9.6105   33.509   11.951   41.889   16.168   25.544   5.8639   27.184   7.1877 -1.640018 9.276208 
1 1 1    4    2 -133 o   12.962   5.0524   6.4613   7.6951   8.6452   9.7920   2.9347   12.443   14.465   5.6814   13.485   5.9125 0.9797726 8.199780 
1 1 1    4    2 -132 o   43.614   2.7041   81.380   9.5661   80.385   11.393   83.760   17.614   42.869   3.2853   41.607   5.3146 1.262280 6.248013 
1 1 1    4    2 -131 o   14.167   5.2887   8.6668   8.2008   3.1916   9.7188   22.203   15.281   12.566   5.3659   20.014   7.2621 -7.447833 9.029429 
1 1 1    4    2 -130 f   11.849   4.7594   4.3825   7.0211   0.5654   9.5300   8.9141   10.384   11.718   5.1548   14.836   5.8433 -3.117503 7.792088 
1 1 1    4    2 -129 o   11.432   4.6851   3.4162   6.9634   4.2864   9.3968   2.3564   10.370   12.878   5.3750   12.674   5.4788 0.2039099 7.675142 
1 1 1    4    2 -128 o   12.423   4.7352   5.8212   6.6517   0.0485   9.6054   11.140   9.2203   11.669   5.1524   15.628   5.6450 -3.959312 7.642919 
1 1 1    4    2 -127 o   19.373   4.9929   17.958   7.9342   6.4295   14.287   23.100   9.5407   15.307   6.5200   21.773   5.4017 -6.465694 8.466892 
1 1 1    4    2 -126 o   14.717   5.0206   9.7088   7.2222   8.4478   11.283   10.584   9.4001   15.141   6.0500   15.533   5.6866 -0.3918791 8.302975 
1 1 1    4    2 -125 o   40.679   2.4121   69.503   7.9625   75.784   12.478   65.188   10.342   41.664   3.7128   38.900   3.2925 2.763985 4.962402 
1 1 1    4    2 -124 o   10.824   4.4154   2.6856   6.1497  -1.2232   10.975   4.4745   7.4248   12.251   5.4531   12.310   4.9114 -0.5906677E-01 7.338815 
1 1 1    4    2 -123 o   12.869   4.6269   6.5792   6.1857   7.7925   11.137   6.0379   7.4386   15.151   6.0248   13.072   5.0013 2.078505 7.830204 
1 1 1    4    2 -122 o   39.184   2.0884   63.764   6.6464   73.588   10.713   57.617   8.4745   41.606   3.1830   36.951   2.8352 4.655010 4.262619 
1 1 1    4    2 -121 o   41.638   1.7875   71.557   6.0529   70.058   8.5420   73.069   8.5783   40.926   2.5735   41.817   2.5284 -0.8916245 3.607743 
1 1 1    4    2 -120 o   13.004   4.2682   7.1059   5.2260  -1.9317   7.5160   15.565   7.2713   10.143   4.5140   18.547   4.7797 -8.403634 6.574270 
1 1 1    4    2 -119 o   16.804   3.9732   12.480   5.3560   12.256   7.7227   12.688   7.4346   16.636   5.1599   16.865   5.0294 -0.2289944 7.205492 
1 1 1    4    2 -118 f   46.661   1.7292   89.566   6.5655   89.099   9.5712   89.982   9.0231   46.290   2.5464   46.576   2.3845 -0.2860298 3.488559 
1 1 1    4    2 -117 o   29.866   2.4198   37.116   5.8408   35.243   8.6970   38.655   7.8830   28.666   3.8166   30.241   3.2488 -1.574596 5.012073 
1 1 1    4    2 -116 o   55.566   1.5708  126.672   7.1078  121.957   10.502  130.658   9.6556   54.290   2.3788   56.287   2.1082 -1.996311 3.178517 
1 1 1    4    2 -115 o   55.685   1.5908  127.205   7.2135  132.571   10.728  122.777   9.7457   56.641   2.3284   54.547   2.1963 2.094467 3.200851 
1 1 1    4    2 -114 o   41.868   1.8752   72.115   6.3835   64.376   9.2625   79.116   8.8097   39.290   2.9128   43.707   2.4829 -4.416988 3.827443 
1 1 1    4    2 -113 o   54.082   1.5997  119.914   7.0444  125.086   10.240  115.267   9.7064   55.069   2.2860   52.868   2.2575 2.201382 3.212846 
1 1 1    4    2 -112 o   34.989   2.1110   50.480   5.9927   51.519   8.6370   49.516   8.3218   35.131   3.0461   34.451   2.9930 0.6805267 4.270440 
1 1 1    4    2 -111 o  100.490   1.3142  412.776   10.765  416.439   15.880  409.661   14.643  100.764   1.9333   99.983   1.7967 0.7806854 2.639240 
1 1 1    4    2 -110 o   99.843   1.2560  407.303   10.222  405.359   14.348  409.306   14.567   99.484   1.7693   99.962   1.7878 -0.4779892 2.515237 
1 1 1    4    2 -109 o   14.598   4.0871   9.1491   5.0551   13.705   6.9111   3.9066   7.4134   17.743   4.7031   12.486   4.9313 5.256787 6.814489 
1 1 1    4    2 -108 o   51.399   1.6165  108.147   6.7642  109.133   9.6761  107.204   9.4597   51.517   2.3100   51.065   2.2783 0.4520836 3.244508 
1 1 1    4    2 -107 o   46.610   1.6650   88.947   6.3157   93.792   8.7441   83.662   9.1321   47.777   2.2516   45.074   2.4952 2.702454 3.360867 
1 1 1    4    2 -106 o   61.033   1.4425  152.161   7.1768  151.328   9.9356  153.070   10.378   60.770   2.0085   61.106   2.0865 -0.3363152 2.896117 
1 1 1    4    2 -105 o   76.129   1.3333  236.616   8.2741  229.801   11.316  244.446   12.129   74.966   1.8518   77.308   1.9247 -2.341736 2.670875 
1 1 1    4    2 -104 o   67.199   1.4017  184.363   7.6784  178.311   10.397  191.626   11.389   66.009   1.9343   68.415   2.0445 -2.406151 2.814495 
1 1 1    4    2 -103 o   38.964   2.0008   62.230   6.3335   65.422   8.3147   57.817   9.7752   39.881   2.5714   37.376   3.2405 2.505310 4.136739 
1 1 1    4    2 -102 o   62.853   1.5599  161.283   7.9921  164.024   10.391  157.313   12.505   63.317   2.0159   61.945   2.4815 1.371605 3.197154 
1 1 1    4    2 -101 o   51.077   1.9785  106.752   8.2218  108.990   9.5715  100.455   16.058   51.577   2.2823   49.231   4.0369 2.345070 4.637371 
1 1 1    4    2 -100 o  107.465   1.4541  471.274   12.738  456.152   15.584  501.721   22.112  105.692   1.8088  110.759   2.4492 -5.066711 3.044697 
1 1 1    4    2  -99 o   8.8625   4.0188  -3.6454   6.2774  -3.5400   7.8203  -3.8365   10.526   10.168   4.5590   12.012   5.3439 -1.844278 7.024361 
1 1 1    4    2  -98 o  145.133   1.4319  859.333   16.940  848.372   23.121  872.038   24.892  144.143   1.9677  146.122   2.0898 -1.979614 2.870398 
1 1 1    4    2  -97 o   54.161   1.7898  119.855   7.8910  112.892   10.469  129.016   12.008   52.504   2.4529   56.117   2.6323 -3.612965 3.598020 
1 1 1    4    2  -96 o   62.709   1.5313  160.425   7.8274  160.069   10.126  160.954   12.339   62.588   1.9872   62.722   2.4179 -0.1342697 3.129726 
1 1 1    4    2  -95 o   29.543   2.5586   35.923   6.1009   35.884   7.6958   35.989   10.009   29.436   3.2619   29.308   4.3190 0.1286926 5.412384 
1 1 1    4    2  -94 o   28.262   2.6795   32.926   6.0992   28.459   7.6731   40.591   10.052   26.106   3.7101   31.215   4.0456 -5.108759 5.489269 
1 1 1    4    2  -93 o  181.389   1.5999  1342.11   23.655  1320.93   31.050  1371.40   36.518  179.896   2.1174  183.256   2.4446 -3.360138 3.234147 
1 1 1    4    2  -92 o  195.247   1.4603  1554.72   23.241  1543.92   30.967  1568.64   35.170  194.518   1.9530  196.039   2.2008 -1.520752 2.942434 
1 1 1    4    2  -91 o  171.240   1.3842  1195.77   19.322  1175.58   25.564  1222.67   29.509  169.753   1.8474  173.097   2.0914 -3.343475 2.790502 
1 1 1    4    2  -90 o  208.598   1.5050  1774.52   25.591  1753.35   33.975  1802.28   38.905  207.303   2.0106  210.145   2.2712 -2.842239 3.033242 
1 1 1    4    2  -89 o  156.191   1.2867  994.705   16.382  1001.67   22.861  987.352   23.486  156.708   1.7896  155.579   1.8519 1.128448 2.575343 
1 1 1    4    2  -88 o  109.587   1.4021  489.681   12.525  490.980   15.203  486.935   22.098  109.720   1.6998  109.227   2.4819 0.4931259 3.008223 
1 1 1    4    2  -87 o  107.164   1.3270  468.233   11.592  454.556   14.801  489.933   18.643  105.574   1.7198  109.590   2.0869 -4.015388 2.704269 
1 1 1    4    2  -86 o  209.428   1.5318  1788.42   26.150  1733.26   33.912  1869.33   41.071  206.139   2.0182  214.048   2.3539 -7.908737 3.100648 
1 1 1    4    2  -85 o  188.389   1.4726  1447.06   22.614  1427.21   29.568  1475.05   35.101  187.066   1.9391  190.152   2.2646 -3.085999 2.981317 
1 1 1    4    2  -84 o   64.211   2.0544  168.338   10.739  162.203   13.664  178.252   17.369   62.990   2.6671   65.994   3.2386 -3.003567 4.195498 
1 1 1    4    2  -83 o   48.926   1.8851   97.768   7.5041   91.451   9.4828  108.351   12.274   47.280   2.4690   51.439   2.9395 -4.159050 3.838839 
1 1 1    4    2  -82 o   42.565   1.8353   74.021   6.3530   71.384   8.4316   77.484   9.6627   41.756   2.4884   43.490   2.7396 -1.733963 3.701044 
1 1 1    4    2  -81 o  110.455   1.2537  497.372   11.288  499.591   16.172  495.263   15.763  110.688   1.7923  110.208   1.7546 0.4794388 2.508191 
1 1 1    4    2  -80 o  112.868   1.2549  519.328   11.545  512.319   14.939  529.721   18.192  112.094   1.6349  113.973   1.9581 -1.878357 2.550931 
1 1 1    4    2  -79 o   67.211   1.2868  184.155   7.0501  182.630   9.3493  186.167   10.734   66.904   1.7157   67.539   1.9518 -0.6347504 2.598698 
1 1 1    4    2  -78 o  110.358   1.1664  496.465   10.492  506.968   14.504  484.935   15.197  111.510   1.5957  109.057   1.7095 2.452789 2.338504 
1 1 1    4    2  -77 o  189.364   1.4220  1461.88   21.950  1470.00   32.965  1455.42   29.419  189.858   2.1301  188.925   1.9103 0.9329376 2.861204 
1 1 1    4    2  -76 o  108.843   1.1575  482.920   10.270  472.057   14.025  495.480   15.080  107.603   1.5989  110.239   1.6781 -2.635590 2.317919 
1 1 1    4    2  -75 o  115.247   1.1572  541.417   10.871  534.828   14.988  548.733   15.793  114.535   1.6053  116.013   1.6700 -1.477928 2.316467 
1 1 1    4    2  -74 o  338.248   2.1751  4665.67   59.973  4575.68   96.239  4722.80   76.682  334.822   3.5262  340.256   2.7647 -5.433716 4.480803 
1 1 1    4    2  -73 o  259.871   1.7893  2753.43   37.904  2717.60   61.064  2775.89   48.345  258.100   2.9024  260.900   2.2732 -2.799957 3.686661 
1 1 1    4    2  -72 o  153.273   1.4539  957.715   18.165  938.437   32.464  966.501   21.917  151.685   2.6255  153.967   1.7463 -2.282608 3.153249 
1 1 1    4    2  -71 o  337.719   2.3180  4651.10   63.813  4569.96  117.125  4685.35   76.100  334.538   4.2951  338.922   2.7545 -4.384918 5.102439 
1 1 1    4    2  -70 o  261.370   1.7896  2785.18   38.128  2671.93   60.044  2861.70   49.355  255.937   2.8781  264.909   2.2856 -8.972473 3.675222 
1 1 1    4    2  -69 o   99.750   1.1837  405.592   9.6244  401.527   13.724  409.525   13.500   99.242   1.6965  100.226   1.6524 -0.9842834 2.368279 
1 1 1    4    2  -68 o  270.451   1.7238  2981.92   38.003  2960.53   56.339  2999.77   51.477  269.436   2.5652  271.229   2.3283 -1.793549 3.464290 
1 1 1    4    2  -67 o   69.821   1.3322  198.722   7.5823  195.589   11.369  201.232   10.176   69.233   2.0167   70.234   1.7788 -1.001541 2.689102 
1 1 1    4    2  -66 o  131.366   1.2441  703.435   13.322  750.166   20.498  669.259   17.529  135.650   1.8538  128.129   1.6783 7.520706 2.500676 
1 1 1    4    2  -65 o  268.783   1.7227  2945.10   37.743  2980.58   57.081  2917.54   50.312  270.362   2.5901  267.500   2.3073 2.861450 3.468750 
1 1 1    4    2  -64 o   58.286   1.4422  138.481   6.8520  136.910   10.176  139.783   9.2679   57.909   2.1595   58.524   1.9454 -0.6143188 2.906593 
1 1 1    4    2  -63 o  591.543   3.5335 14272.21  170.383 14365.47  242.364 14181.08  239.577  593.256   5.0117  589.441   4.9862 3.815369 7.069635 
1 1 1    4    2  -62 o   99.827   1.2868  406.202   10.472  417.724   15.042  395.368   14.586  101.229   1.8229   98.483   1.8170 2.745949 2.573801 
1 1 1    4    2  -61 o  144.127   1.3325  846.705   15.655  868.536   22.477  826.138   21.816  145.967   1.8891  142.360   1.8800 3.607101 2.665109 
1 1 1    4    2  -60 o   52.846   1.5882  113.939   6.8340  114.697   9.9050  113.252   9.4412   52.993   2.2985   52.662   2.2042 0.3309784 3.184584 
1 1 1    4    2  -59 o  394.733   2.3210  6351.92   74.682  6437.30  113.181  6286.07   99.391  397.323   3.4946  392.649   3.1053 4.674957 4.674932 
1 1 1    4    2  -58 o  599.552   3.3714 14656.70  164.766 14593.37  246.293 14708.01  221.676  598.104   5.0517  600.503   4.5286 -2.398254 6.784418 
1 1 1    4    2  -57 o  283.850   1.7874  3284.20   41.356  3297.02   62.238  3274.06   55.341  284.385   2.6848  283.400   2.3956 0.9849854 3.598181 
1 1 1    4    2  -56 o  325.005   1.9782  4305.64   52.407  4285.74   78.353  4321.75   70.499  324.230   2.9646  325.598   2.6562 -1.367706 3.980481 
1 1 1    4    2  -55 o  512.770   2.9193 10718.91  122.020 10539.01  180.427 10870.53  165.645  508.378   4.3539  516.336   3.9356 -7.957977 5.869015 
1 1 1    4    2  -54 o  237.044   1.5809  2290.29   30.547  2271.67   45.634  2305.40   41.118  236.070   2.3714  237.819   2.1210 -1.749466 3.181583 
1 1 1    4    2  -53 o  138.972   1.3243  787.187   15.002  787.952   24.245  786.712   19.097  139.035   2.1393  138.928   1.6863 0.1067352 2.724006 
1 1 1    4    2  -52 o  451.437   2.7589  8307.45  101.522  8405.26  167.265  8250.40  127.743  454.027   4.5195  449.863   3.4835 4.163879 5.706196 
1 1 1    4    2  -51 o  468.015   2.8523  8928.81  108.815  8944.19  154.146  8913.53  153.631  468.382   4.0373  467.578   4.0308 0.8032532 5.705016 
1 1 1    4    2  -50 o  538.218   3.2375 11808.74  142.038 11866.78  201.751 11751.71  200.004  539.488   4.5877  536.866   4.5702 2.621338 6.475651 
1 1 1    4    2  -49 o  240.919   1.7098  2365.75   33.578  2501.62   49.220  2247.47   45.925  247.734   2.4374  234.814   2.3993 12.92055 3.420164 
1 1 1    4    2  -48 o  753.597   4.7462 23154.87  291.554 22978.72  383.333 23396.61  449.063  750.624   6.2650  757.335   7.2742 -6.710999 9.600163 
1 1 1    4    2  -47 o  226.171   2.6995  2085.11   49.769  2085.11   49.769   0.0000   0.0000  226.171   2.6995  ?   ?  0.000000 2.699496 
1 1 1    4    2  -46 o  291.645   1.9391  3466.89   46.099  3578.76   66.877  3365.62   63.632  296.305   2.7689  287.346   2.7166 8.958130 3.879014 
1 1 1    4    2  -45 o  211.245   1.6805  1818.84   28.937  1784.72   38.010  1865.90   44.628  209.250   2.2284  213.954   2.5589 -4.703613 3.393213 
1 1 1    4    2  -44 o  536.470   3.2274 11731.66  141.135 12106.88  204.740 11391.92  194.821  544.941   4.6091  528.608   4.5213 16.33228 6.456484 
1 1 1    4    2  -43 o  762.193   4.7941 23684.81  297.854 23289.53  388.010 24251.95  464.762  755.721   6.2986  771.100   7.3941 -15.37903 9.713140 
1 1 1    4    2  -42 o  367.530   2.6686  5505.96   79.950  5436.41  111.547  5579.45  114.651  365.185   3.7472  369.957   3.8018 -4.772156 5.338103 
1 1 1    4    2  -41 o  594.687   4.0953 14417.03  198.521 14075.83  274.824 14789.34  287.080  587.547   5.7382  602.250   5.8478 -14.70251 8.192890 
1 1 1    4    2  -40 o  619.651   4.6543 15653.69  235.092 15440.76  366.797 15802.15  306.269  615.300   7.3131  622.525   6.0355 -7.225037 9.482017 
1 1 1    4    2  -39 o  514.815   3.9231 10804.13  164.631 10801.84  260.111 10805.65  212.643  514.688   6.1998  514.819   5.0671 -0.1309814 8.007093 
1 1 1    4    2  -38 o  216.868   1.8168  1916.97   32.118  1876.91   44.795  1959.36   46.076  214.586   2.5609  219.248   2.5781 -4.662369 3.633835 
1 1 1    4    2  -37 o  590.037   3.7580 14191.85  180.746 14143.88  238.225 14256.93  277.465  589.002   4.9617  591.321   5.7564 -2.318665 7.599660 
1 1 1    4    2  -36 o  237.601   1.7703  2301.01   34.287  2330.96   45.648  2262.25   51.937  239.139   2.3417  235.585   2.7046 3.553757 3.577459 
1 1 1    4    2  -35 o  537.748   3.4456 11787.67  151.034 11750.17  199.176 11838.41  231.678  536.863   4.5513  538.851   5.2745 -1.988281 6.966685 
1 1 1    4    2  -34 o  297.747   2.2484  3613.50   54.571  3585.85   76.662  3641.91   77.699  296.596   3.1709  298.905   3.1890 -2.309113 4.497084 
1 1 1    4    2  -33 o  471.493   3.0569  9061.72  117.489  9059.56  155.254  9064.62  179.728  471.415   4.0402  471.530   4.6760 -0.1141968 6.179631 
1 1 1    4    2  -32 o  486.474   3.1439  9646.85  124.672  9754.45  166.324  9508.86  188.348  489.154   4.1713  482.938   4.7845 6.215607 6.347510 
1 1 1    4    2  -31 o  463.819   2.6563  8768.99  100.430  8751.19  134.394  8791.49  151.135  463.329   3.5584  464.384   3.9926 -1.054169 5.348151 
1 1 1    4    2  -30 o  278.113   1.7258  3152.61   39.124  3130.00   52.181  3181.64   59.126  277.109   2.3101  279.382   2.5962 -2.273163 3.475163 
1 1 1    4    2  -29 o  247.520   1.6856  2497.16   34.010  2498.22   42.828  2495.36   55.957  247.569   2.1222  247.420   2.7745 0.1483154 3.493098 
1 1 1    4    2  -28 o  484.255   2.9236  9559.22  115.405  9625.07  146.673  9452.19  186.986  485.897   3.7031  481.474   4.7643 4.423126 6.034209 
1 1 1    4    2  -27 o  326.887   2.0803  4355.51   55.431  4371.34   70.137  4329.17   90.474  327.473   2.6274  325.874   3.4060 1.598206 4.301630 
1 1 1    4    2  -26 o  250.421   1.6971  2556.07   34.642  2543.57   43.470  2577.82   57.347  249.803   2.1348  251.471   2.7976 -1.667587 3.519067 
1 1 1    4    2  -25 o  306.899   1.8588  3839.10   46.500  3836.40   62.334  3842.50   69.823  306.781   2.4926  307.019   2.7899 -0.2383728 3.741271 
1 1 1    4    2  -24 o  328.942   2.0855  4410.51   55.919  4446.89   79.596  4375.05   78.578  330.279   2.9565  327.600   2.9425 2.678253 4.171237 
1 1 1    4    2  -23 f  663.733   4.1903 17963.09  226.713 17993.69  346.795 17940.24  299.599  664.106   6.4062  663.203   5.5419 0.9027100 8.470640 
1 1 1    4    2  -22 o  286.241   2.3488  3339.88   54.805  3283.94   85.526  3378.85   71.388  283.804   3.6969  287.892   3.0420 -4.088043 4.787587 
1 1 1    4    2  -21 o  267.207   2.4994  2910.53   54.440  2856.81   75.646  2968.24   78.406  264.708   3.5058  269.820   3.5648 -5.111908 4.999860 
1 1 1    4    2  -20 o  350.317   3.1047  5003.12   88.659  5022.18  125.582  4984.19  125.184  350.939   4.3900  349.609   4.3927 1.329926 6.210272 
1 1 1    4    2  -19 o  446.775   3.8289  8138.74  139.444  8168.26  198.071  8109.73  196.348  447.495   5.4300  445.891   5.4021 1.604218 7.659431 
1 1 1    4    2  -18 o  737.783   6.1358 22208.18  369.007 21511.77  507.845 22987.12  537.091  725.763   8.5842  750.203   8.7828 -24.43958 12.28114 
1 1 1    4    2  -17 o  733.894   6.0979 21974.02  364.797 21740.31  511.258 22216.42  520.674  729.618   8.5962  737.553   8.6604 -7.934875 12.20234 
1 1 1    4    2  -16 o  281.712   2.3177  3235.03   53.223  3196.73   68.258  3294.44   85.006  280.026   2.9903  284.256   3.6686 -4.230438 4.732935 
1 1 1    4    2  -15 o  497.716   3.7864 10100.24  153.620 10238.44  200.954  9905.92  238.287  501.045   4.9202  492.771   5.9323 8.274078 7.707154 
1 1 1    4    2  -14 o  268.023   2.0487  2928.18   44.761  2895.84   63.066  2961.00   63.539  266.525   2.9028  269.507   2.8922 -2.982361 4.097743 
1 1 1    4    2  -13 o  330.907   2.2355  4463.47   60.301  4492.97   80.265  4425.26   91.366  331.983   2.9660  329.460   3.4021 2.522461 4.513488 
1 1 1    4    2  -12 o  203.198   1.5635  1682.95   25.897  1667.66   34.161  1703.62   39.710  202.268   2.0719  204.434   2.3830 -2.165665 3.157742 
1 1 1    4    2  -11 o  840.403   4.9160 28802.36  336.769 29267.92  432.013 28081.26  537.663  847.019   6.2570  829.435   7.9523 17.58356 10.11874 
1 1 1    4    2  -10 o  279.755   1.9501  3190.06   44.471  3186.48   58.801  3194.85   67.974  279.589   2.5800  279.949   2.9787 -0.3602600 3.940727 
1 1 1    4    2   -9 o  505.492   3.0320 10416.53  124.936 10618.91  179.603 10226.79  173.906  510.326   4.3175  500.818   4.2599 9.508423 6.065249 
1 1 1    4    2   -8 o  133.563   1.1768  727.096   12.812  743.639   18.305  711.208   17.939  135.072   1.6625  132.094   1.6660 2.978210 2.353591 
1 1 1    4    2   -7 o  229.725   1.6873  2151.03   31.596  2147.44   48.273  2153.72   41.791  229.523   2.5801  229.863   2.2304 -0.3394623 3.410521 
1 1 1    4    2   -6 o  640.436   4.3721 16723.56  228.246 17045.80  401.924 16570.17  277.297  646.317   7.6289  637.431   5.3367 8.886047 9.310264 
1 1 1    4    2   -5 o  338.203   2.4539  4662.44   67.650  4746.52  118.822  4622.12   82.289  341.196   4.2723  336.727   2.9980 4.469208 5.219197 
1 1 1    4    2   -4 o  178.491   2.1948  1298.61   31.933   0.0000   0.0000  1298.61   31.933  ?   ?   178.491   2.1948 0.000000 2.194779 
1 1 1    4    2   -3 o  678.582   4.6164 18775.60  255.353 19154.34  450.047 18595.77  310.103  685.096   8.0588  675.255   5.6338 9.841492 9.832795 
1 1 1    4    2   -2 o  422.574   2.7533  7279.07   94.840  7216.63  143.848  7327.08  126.138  420.716   4.1945  423.941   3.6501 -3.225159 5.560313 
1 1 1    4    2   -1 o  797.623   4.9945 25942.57  324.733 25428.75  487.327 26352.93  435.513  789.434   7.5730  803.755   6.6472 -14.32092 10.07652 
1 1 1    4    2    0 o   75.352   1.1422  231.422   7.0156  236.016   10.735  227.998   9.2686   76.095   1.7307   74.792   1.5203 1.303238 2.303623 
1 1 1    4    2    1 o  223.284   1.6537  2032.09   30.098  2000.11   45.460  2057.05   40.161  221.512   2.5176  224.646   2.1932 -3.134018 3.338936 
1 1 1    4    2    2 o  408.503   3.1631  6802.71  105.328  6952.71  138.363  6595.99  162.427  412.954   4.1104  402.191   4.9544 10.76355 6.437485 
1 1 1    4    2    3 o  165.889   1.4971  1121.65   20.245  1126.06   28.689  1117.29   28.572  166.210   2.1175  165.562   2.1171 0.6483765 2.994318 
1 1 1    4    2    4 o  492.377   3.4165  9883.32  137.125  9735.77  191.527 10038.50  196.414  488.632   4.8085  496.168   4.8563 -7.536346 6.834169 
1 1 1    4    2    5 o  214.989   2.1345  1884.00   37.407  1865.85   52.657  1902.48   53.150  213.942   3.0194  216.031   3.0182 -2.089508 4.269248 
1 1 1    4    2    6 o  718.785   5.3464 21069.73  313.256 20494.91  483.401 21485.87  411.302  708.610   8.3688  725.701   6.9529 -17.09076 10.88027 
1 1 1    4    2    7 o  269.902   2.2460  2969.38   49.415  2895.40   76.813  3021.61   64.543  266.498   3.5359  272.256   2.9083 -5.757782 4.578301 
1 1 1    4    2    8 o  552.413   4.1659 12442.15  187.590 12815.85  304.081 12212.55  238.349  560.485   6.6556  547.227   5.3433 13.25903 8.535129 
1 1 1    4    2    9 o  284.904   2.1376  3308.62   49.643  3216.17   68.771  3409.23   71.734  280.881   3.0036  289.188   3.0431 -8.306763 4.275725 
1 1 1    4    2   10 o  358.144   2.5770  5228.63   75.234  5368.92  108.622  5099.27  104.304  362.889   3.6720  353.660   3.6181 9.228729 5.155054 
1 1 1    4    2   11 o  495.898   3.7700 10026.18  152.394 10000.99  196.430 10064.27  241.529  495.219   4.8660  496.714   5.9652 -1.494629 7.698178 
1 1 1    4    2   12 o  195.358   1.6447  1555.59   26.191  1582.90   37.449  1529.45   36.644  197.058   2.3314  193.703   2.3208 3.355255 3.289546 
1 1 1    4    2   13 o  238.635   1.8749  2321.20   36.472  2296.93   51.265  2346.07   51.898  237.374   2.6494  239.899   2.6539 -2.525681 3.750043 
1 1 1    4    2   14 o  574.282   3.9463 13447.16  184.735 13657.48  264.583 13247.11  258.048  578.638   5.6094  569.883   5.5549 8.755127 7.894496 
1 1 1    4    2   15 o  317.248   2.5589  4102.78   66.175  3722.42   96.995  4434.00   90.513  302.149   3.9381  329.785   3.3670 -27.63538 5.181283 
1 1 1    4    2   16 o  117.904   1.8696  566.635   17.968  597.184   32.806  553.543   21.476  120.983   3.3297  116.532   2.2609 4.451157 4.024754 
1 1 1    4    2   17 o  656.140   5.4789 17561.14  293.037 17243.38  408.082 17899.42  421.058  649.920   7.7028  662.154   7.8009 -12.23425 10.96305 
1 1 1    4    2   18 o  228.435   2.5760  2127.22   47.966  2041.24   81.741  2172.37   59.238  223.730   4.4821  230.837   3.1482 -7.107162 5.477246 
1 1 1    4    2   19 o  264.602   2.8615  2854.22   61.720  2822.48  106.933  2870.08   75.581  263.067   4.9866  265.321   3.4947 -2.254150 6.089274 
1 1 1    4    2   20 o  426.284   4.2454  7409.92  147.520   0.0000   0.0000  7409.92  147.520  ?   ?   426.284   4.2454 0.000000 4.245372 
1 1 1    4    2   21 o  289.898   2.6707  3425.92   63.112  3370.04   88.156  3484.66   90.393  287.497   3.7617  292.345   3.7932 -4.847229 5.342146 
1 1 1    4    2   22 o  404.023   3.5165  6655.13  115.813  6773.02  166.127  6543.67  161.538  407.519   5.0010  400.562   4.9473 6.956696 7.034599 
1 1 1    4    2   23 f  184.720   1.7604  1390.81   26.507  1420.18   42.771  1372.49   33.775  186.650   2.8111  183.495   2.2580 3.154282 3.605732 
1 1 1    4    2   24 o  912.305   6.7407 33958.61  501.282 34588.34  805.532 33560.62  640.388  919.969   10.742  906.627   8.6652 13.34174 13.80109 
1 1 1    4    2   25 o  456.514   3.5012  8496.38  130.290  8558.67  207.526  8455.86  167.392  458.089   5.5576  455.383   4.5094 2.705841 7.156950 
1 1 1    4    2   26 o  182.725   1.7536  1360.91   26.120  1356.99   41.552  1363.47   33.585  182.452   2.7939  182.893   2.2527 -0.4403687 3.588929 
1 1 1    4    2   27 o  233.029   2.0369  2213.42   38.691  2257.98   62.313  2185.45   49.358  235.349   3.2481  231.547   2.6151 3.802292 4.169982 
1 1 1    4    2   28 o  380.759   2.7307  5909.71   84.754  5767.17  117.862  6062.35  121.964  376.114   3.8443  385.618   3.8801 -9.504333 5.462014 
1 1 1    4    2   29 o  788.127   5.3391 25328.45  343.005 25334.46  485.313 25322.46  484.852  788.029   7.5552  787.843   7.5498 0.1860962 10.68079 
1 1 1    4    2   30 o  282.541   2.1439  3253.87   49.377  3280.21   70.612  3228.66   69.071  283.672   3.0537  281.434   3.0108 2.237427 4.288377 
1 1 1    4    2   31 o  408.846   2.9047  6813.65   96.805  6780.11  136.701  6847.39  137.105  407.813   4.1122  409.831   4.1040 -2.018524 5.809755 
1 1 1    4    2   32 o  360.168   2.6065  5287.60   76.523  5275.88  108.405  5299.23  108.036  359.752   3.6967  360.547   3.6760 -0.7955933 5.213264 
1 1 1    4    2   33 o  176.320   1.4702  1267.13   21.131  1312.41   28.723  1213.71   31.199  179.440   1.9637  172.560   2.2180 6.879990 2.962354 
1 1 1    4    2   34 o  492.208   3.7563  9876.02  150.712  9803.81  193.227  9988.17  240.825  490.377   4.8340  494.928   5.9693 -4.550751 7.681120 
1 1 1    4    2   35 o  499.027   3.8038 10151.56  154.730 10027.38  197.555 10348.61  248.864  495.937   4.8868  503.778   6.0602 -7.841064 7.785041 
1 1 1    4    2   36 o  699.548   4.7641 19950.78  271.667 19948.35  332.656 19955.64  470.728  699.457   5.8344  699.441   8.2562 0.1605225E-01 10.10970 
1 1 1    4    2   37 o  1068.48   6.6509 46555.23  579.270 45968.33  757.329 47382.73  899.258  1061.51   8.7523  1077.54   10.238 -16.02380 13.46922 
1 1 1    4    2   38 o  628.856   4.3039 16121.51  220.620 16321.55  315.288 15929.59  308.821  632.674   6.1135  625.033   6.0613 7.640503 8.609001 
1 1 1    4    2   39 o  251.203   1.9676  2572.03   40.290  2608.55   57.735  2537.36   56.251  252.974   2.7998  249.499   2.7658 3.475204 3.935576 
1 1 1    4    2   40 o  849.297   5.7417 29410.54  397.501 29388.17  561.556 29433.01  562.748  848.800   8.1162  849.446   8.1272 -0.6463623 11.48583 
1 1 1    4    2   41 o  279.213   2.3301  3177.66   53.034  3212.99   69.337  3127.86   82.326  280.754   3.0297  277.003   3.6460 3.751465 4.740520 
1 1 1    4    2   42 o  620.240   4.2558 15682.97  215.166 15579.79  262.175 15895.85  376.584  618.160   5.2030  624.285   7.4002 -6.125366 9.046211 
1 1 1    4    2   43 o  232.945   1.7558  2211.73   33.341  2177.06   43.951  2258.72   51.170  231.109   2.3330  235.401   2.6667 -4.291901 3.543177 
1 1 1    4    2   44 o  299.723   2.4762  3661.70   60.499  3757.61   97.650  3601.95   77.072  303.603   3.9458  297.259   3.1807 6.343842 5.068135 
1 1 1    4    2   45 o  630.768   3.7487 16219.33  192.749 15999.98  269.342 16449.58  275.954  626.427   5.2747  635.164   5.3299 -8.737671 7.498647 
1 1 1    4    2   46 o  811.011   4.7622 26816.70  314.827 26529.43  440.899 27115.55  449.696  806.522   6.7064  815.378   6.7659 -8.855957 9.526409 
1 1 1    4    2   47 o  597.032   3.8080 14531.12  185.325 14479.16  244.441 14601.35  284.210  595.914   5.0322  598.383   5.8267 -2.469360 7.698913 
1 1 1    4    2   48 o  558.578   3.5789 12719.33  162.957 12632.72  214.456 12837.66  250.668  556.631   4.7265  561.093   5.4806 -4.462036 7.237160 
1 1 1    4    2   49 o  332.080   2.2794  4495.01   61.703  4510.10   82.021  4475.33   93.654  332.626   3.0251  331.333   3.4676 1.292633 4.601641 
1 1 1    4    2   50 o  225.711   1.6277  2076.51   29.948  2037.69   41.933  2116.92   42.785  223.587   2.3008  227.891   2.3032 -4.304932 3.255479 
1 1 1    4    2   51 o  266.600   1.8038  2897.03   39.201  2949.61   56.283  2847.50   54.630  269.000   2.5668  264.303   2.5357 4.696472 3.608058 
1 1 1    4    2   52 o  376.103   2.3547  5765.93   72.189  5749.52  101.912  5782.46  102.270  375.546   3.3291  376.621   3.3313 -1.074249 4.709589 
1 1 1    4    2   53 o  320.029   2.3773  4174.84   62.018  4156.11   87.430  4193.81   87.985  319.290   3.3592  320.735   3.3653 -1.444702 4.754965 
1 1 1    4    2   54 o  295.286   2.2337  3554.22   53.766  3623.81   77.163  3488.54   74.958  298.144   3.1750  292.527   3.1435 5.617004 4.467942 
1 1 1    4    2   55 o  187.235   1.6693  1428.94   25.477  1441.88   36.451  1416.58   35.624  188.074   2.3776  186.417   2.3443 1.656723 3.339004 
1 1 1    4    2   56 o  324.082   2.2293  4281.35   58.892  4321.82   78.640  4229.67   88.866  325.592   2.9630  322.090   3.3847 3.502625 4.498415 
1 1 1    4    2   57 o   65.495   1.5180  174.844   8.1042  163.622   10.429  191.953   12.877   63.324   2.0230   68.582   2.3066 -5.258453 3.068027 
1 1 1    4    2   58 o  310.164   2.1548  3921.57   54.479  4005.89   73.335  3817.74   81.380  313.461   2.8701  305.997   3.2626 7.463287 4.345341 
1 1 1    4    2   59 o  378.163   2.7297  5830.30   84.144  5839.28  103.374  5812.65  144.853  378.426   3.3512  377.480   4.7076 0.9452515 5.778543 
1 1 1    4    2   60 o   89.201   1.3305  324.323   9.6741  298.634   12.885  357.509   14.646   85.592   1.8468   93.650   1.9185 -8.057343 2.662988 
1 1 1    4    2   61 o  385.662   2.5712  6063.97   80.831  6073.11  107.299  6051.97  122.911  385.907   3.4109  385.200   3.9144 0.7062378 5.192044 
1 1 1    4    2   62 o  365.043   2.4562  5432.90   73.089  5434.69   96.894  5430.53  111.329  365.059   3.2561  364.887   3.7429 0.1723022 4.961029 
1 1 1    4    2   63 o  155.882   1.4405  990.489   18.304  975.495   28.101  1001.54   24.123  154.685   2.2286  156.742   1.8881 -2.057587 2.920874 
1 1 1    4    2   64 o  360.107   2.4318  5287.28   71.384  5358.80  110.471  5236.02   93.534  362.441   3.7392  358.307   3.2024 4.133698 4.923095 
1 1 1    4    2   65 o  564.831   3.6174 13014.92  166.553 13102.54  256.046 12950.65  219.287  566.379   5.5459  563.243   4.7762 3.135742 7.319103 
1 1 1    4    2   66 o   71.206   1.4155  206.685   8.2160  198.127   13.015  212.355   10.593   69.670   2.2949   72.173   1.8006 -2.502762 2.916977 
1 1 1    4    2   67 o  132.694   1.3796  717.757   14.922  724.793   23.251  712.828   19.459  133.328   2.1393  132.230   1.8053 1.097824 2.799249 
1 1 1    4    2   68 o  230.291   1.5559  2162.00   29.208  2060.17   42.451  2253.53   40.249  224.774   2.3169  235.095   2.1003 -10.32143 3.127157 
1 1 1    4    2   69 o  292.259   1.8298  3482.39   43.592  3359.89   63.720  3590.15   59.767  287.018   2.7235  296.708   2.4711 -9.690033 3.677491 
1 1 1    4    2   70 o  308.331   1.9053  3876.09   47.887  3863.56   71.707  3886.18   64.335  307.763   2.8583  308.687   2.5568 -0.9242859 3.834982 
1 1 1    4    2   71 o  116.084   1.2226  549.307   11.569  571.733   17.619  532.311   15.338  118.419   1.8253  114.267   1.6467 4.151917 2.458282 
1 1 1    4    2   72 o  275.489   1.6654  3094.15   37.400  3054.72   58.625  3121.21   48.566  273.668   2.6280  276.664   2.1535 -2.995728 3.397632 
1 1 1    4    2   73 o   31.348   1.9678   40.226   5.0030   35.583   8.0902   43.102   6.3663   29.327   3.4502   32.418   2.4267 -3.091543 4.218140 
1 1 1    4    2   74 o  182.674   1.3095  1360.34   19.499  1321.63   30.468  1387.19   25.377  180.030   2.0762  184.456   1.6878 -4.426346 2.675665 
1 1 1    4    2   75 o  183.267   1.3142  1369.19   19.632  1358.16   30.977  1376.60   25.380  182.499   2.0823  183.750   1.6945 -1.250595 2.684597 
1 1 1    4    2   76 o  311.683   1.8274  3961.04   46.428  3906.30   72.788  3998.59   60.283  309.427   2.8858  313.113   2.3619 -3.686493 3.729108 
1 1 1    4    2   77 o  186.543   1.3288  1418.61   20.206  1417.26   32.030  1419.50   26.042  186.422   2.1078  186.587   1.7122 -0.1654510 2.715571 
1 1 1    4    2   78 o  254.710   1.6778  2645.22   34.836  2626.46   51.891  2660.61   47.002  253.747   2.5087  255.412   2.2576 -1.664825 3.374949 
1 1 1    4    2   79 o  148.508   1.3941  899.136   16.876  873.856   26.783  915.783   21.734  146.375   2.2447  149.864   1.7791 -3.489746 2.864222 
1 1 1    4    2   80 o   37.248   2.3409   56.816   7.0717   50.425   12.013   60.205   8.7483   34.863   4.3194   38.309   2.8213 -3.445244 5.159118 
1 1 1    4    2   81 o  205.396   1.6879  1720.19   28.261  1664.08   50.646  1745.55   34.056  201.918   3.0771  206.886   2.0194 -4.967224 3.680532 
1 1 1    4    2   82 o  119.794   1.8067  585.190   17.642   0.0000   0.0000  585.190   17.642  ?   ?   119.794   1.8067 0.000000 1.806695 
1 1 1    4    2   83 o  144.336   1.5726  849.444   18.502  801.405   26.817  893.085   25.560  140.159   2.3472  147.972   2.1191 -7.812653 3.162263 
1 1 1    4    2   84 o   76.385   1.7997  237.938   11.206  292.704   18.446  205.906   14.107   84.650   2.6766   70.999   2.4411 13.65099 3.622591 
1 1 1    4    2   85 o  181.199   1.4445  1338.69   21.336  1311.96   31.725  1360.76   28.828  179.339   2.1702  182.660   1.9362 -3.320282 2.908329 
1 1 1    4    2   86 o   88.730   1.3883  320.999   10.042  326.223   15.183  316.938   13.388   89.428   2.0827   88.154   1.8631 1.274536 2.794465 
1 1 1    4    2   87 o   94.000   1.3509  360.267   10.351  346.714   15.542  371.070   13.876   92.191   2.0682   95.385   1.7846 -3.194016 2.731655 
1 1 1    4    2   88 o   67.264   1.6138  184.511   8.8485  186.817   15.090  183.303   10.924   67.590   2.7446   67.003   2.0023 0.5870972 3.397364 
1 1 1    4    2   89 o  108.897   1.2542  483.506   11.133  482.455   17.726  484.190   14.307  108.746   1.9996  108.960   1.6108 -0.2139359 2.567718 
1 1 1    4    2   90 o   48.952   1.7589   97.870   7.0070   85.879   11.202  105.577   8.9810   45.750   3.0207   50.818   2.1730 -5.068279 3.721109 
1 1 1    4    2   91 o  154.858   1.2961  977.862   16.361  941.130   25.555  1003.37   21.297  151.868   2.0643  156.842   1.6658 -4.973938 2.652614 
1 1 1    4    2   92 o   40.432   2.1773   66.917   7.1497   66.497   10.775   67.247   9.5565   40.190   3.3186   40.463   2.9169 -0.2730026 4.418311 
1 1 1    4    2   93 o  137.186   1.3326  767.496   14.902  730.816   25.113  787.430   18.513  133.791   2.3027  138.936   1.6347 -5.144836 2.823969 
1 1 1    4    2   94 o  192.681   1.5800  1514.45   24.816  1386.45   48.558  1559.70   28.871  184.106   3.2356  195.512   1.8116 -11.40553 3.708255 
1 1 1    4    2   95 o   23.405   3.7194   22.987   6.8590   27.766   12.048   20.695   8.3433   25.437   5.9215   22.022   4.7848 3.415075 7.613023 
1 1 1    4    2   96 o   83.097   1.4983  281.687   10.149  283.978   17.427  280.510   12.485   83.323   2.5689   82.904   1.8475 0.4186707 3.164224 
1 1 1    4    2   97 o   48.530   2.0195   96.327   7.9715  109.379   14.046   90.125   9.6818   51.570   3.3595   46.890   2.5425 4.680046 4.213203 
1 1 1    4    2   98 o  100.979   1.5583  416.075   12.827  429.765   20.493  407.256   16.448  102.541   2.4517   99.865   2.0205 2.675995 3.176992 
1 1 1    4    2   99 o   13.860   4.9678   6.7408   7.1245   3.8510   10.231   9.4609   9.9264   14.220   5.7336   16.352   5.8635 -2.132098 8.200881 
1 1 1    4    2  100 o   31.862   3.4123   42.121   8.7248   39.825   11.487   45.251   13.413   30.717   4.7402   32.681   5.2097 -1.963909 7.043458 
1 1 1    4    2  101 o  102.673   1.5469  430.303   12.947  450.193   20.646  417.414   16.620  104.904   2.4144  101.069   2.0174 3.834908 3.146271 
1 1 1    4    2  102 o   86.691   1.3895  306.718   9.8193  303.951   15.117  308.738   12.915   86.219   2.1510   86.934   1.8224 -0.7155914 2.819207 
1 1 1    4    2  103 o  108.799   1.3351  483.115   11.841  494.447   18.229  474.844   15.573  109.967   2.0336  107.807   1.7722 2.160599 2.697410 
1 1 1    4    2  104 o   42.707   2.1584   74.823   7.4895   73.433   10.973   76.036   10.248   42.139   3.2187   42.933   2.9461 -0.7939568 4.363461 
1 1 1    4    2  105 o   77.485   1.5999  245.303   10.106  231.334   16.288  254.047   12.886   75.038   2.6670   78.774   2.0084 -3.735779 3.338655 
1 1 1    4    2  106 o   49.211   1.8919   99.225   7.5751   94.095   12.990  101.868   9.3248   47.647   3.3662   49.801   2.3033 -2.153587 4.078749 
1 1 1    4    2  107 o   39.299   2.2103   63.505   7.0520   50.661   12.205   69.940   8.6401   34.598   4.4292   41.184   2.5867 -6.585766 5.129269 
1 1 1    4    2  108 o   80.117   1.3928  262.271   9.0958  249.564   14.127  271.268   11.888   77.970   2.2250   81.413   1.7913 -3.443512 2.856451 
1 1 1    4    2  109 o   14.826   4.5682   9.2516   6.0649   11.045   10.482   8.3491   7.4359   16.988   6.0326   14.686   5.0912 2.301880 7.893866 
1 1 1    4    2  110 o  100.873   1.3187  415.851   10.843  407.269   16.751  422.041   14.226   99.631   2.0625  101.524   1.7190 -1.893578 2.684929 
1 1 1    4    2  111 o   46.738   1.7944   89.645   6.8235   82.624   10.810   94.295   8.7975   44.593   2.9913   47.841   2.2623 -3.247974 3.750443 
1 1 1    4    2  112 o   73.207   1.4207  219.236   8.4780  225.397   13.322  215.043   10.991   74.003   2.2109   72.384   1.8643 1.619072 2.892005 
1 1 1    4    2  113 o   75.190   1.4070  231.325   8.6236  225.043   13.394  235.773   11.271   73.914   2.2255   75.809   1.8239 -1.895508 2.877393 
1 1 1    4    2  114 o   44.131   1.8874   80.117   6.7738   77.731   10.553   81.790   8.8340   43.158   3.0187   44.451   2.4474 -1.293385 3.886188 
1 1 1    4    2  115 o   43.121   1.9163   76.559   6.7191   71.086   10.444   80.425   8.7768   41.199   3.1333   44.058   2.4536 -2.859482 3.979639 
1 1 1    4    2  116 o   37.596   2.4867   58.693   7.5781   52.626   11.895   62.838   9.8318   34.969   4.2608   38.698   3.1439 -3.729317 5.295088 
1 1 1    4    2  117 o   53.108   1.9350  116.179   8.3628  119.208   13.079  114.084   10.877   53.399   3.0170   52.423   2.5530 0.9764748 3.952234 
1 1 1    4    2  118 f   85.952   1.5644  303.077   10.961  303.235   16.967  302.963   14.359   85.547   2.4356   85.734   2.0547 -0.1873856 3.186496 
1 1 1    4    2  119 o   58.384   1.8273  140.397   8.6857  131.833   13.442  146.535   11.380   56.104   2.9497   59.445   2.3532 -3.340816 3.773346 
1 1 1    4    2  120 o   9.4126   4.1229  -0.8233   6.0373   6.6421   8.8025  -7.4545   8.2961   14.062   5.4249   9.2584   4.3441 4.803342 6.949872 
1 1 1    4    2  121 o   58.023   1.7033  138.686   8.0476  138.230   11.641  139.104   11.138   57.584   2.4858   57.826   2.3679 -0.2415733 3.433097 
1 1 1    4    2  122 o   48.797   1.7768   98.316   7.0558  110.970   11.100   89.737   9.1399   51.445   2.6560   46.357   2.4272 5.087303 3.598011 
1 1 1    4    2  123 o   26.382   2.9475   29.683   6.2304   36.504   9.4105   24.359   8.3133   28.719   4.1392   23.170   4.5641 5.549652 6.161473 
1 1 1    4    2  124 o   29.762   2.8301   37.653   6.7834   40.139   9.4442   35.005   9.7494   30.186   3.9315   27.883   4.4380 2.302315 5.928967 
1 1 1    4    2  125 o   23.813   3.7213   25.069   6.9870   24.350   10.582   25.625   9.3032   22.353   5.7689   23.379   5.0310 -1.025692 7.654497 
1 1 1    4    2  126 o   40.074   2.7027   68.155   8.7770   73.134   11.605   61.500   13.416   40.975   3.5082   36.745   4.5781 4.230267 5.767730 
1 1 1    4    2  127 o   10.142   4.4850  -0.7160   7.3037   0.0633   10.182  -1.5419   10.482   12.000   5.3017   11.728   5.2669 0.2721500 7.473117 
1 1 1    4    2  128 o   22.529   4.8399   24.047   8.6231   30.758   10.568   10.678   14.916   25.222   5.3084   16.551   6.8278 8.670832 8.648575 
1 1 1    4    2  129 o   10.441   4.5893  -0.1258   7.5388   1.8211   8.9155  -5.0099   14.121   11.833   5.0974   12.590   5.8261 -0.7573271 7.741262 
1 1 1    4    2  130 f   23.049   4.9858   25.536   9.0948   31.255   11.635   16.554   14.582   24.893   5.8361   18.164   6.9889 6.729334 9.105188 
1 1 1    4    2  131 o   29.260   4.0676   38.957   9.4397   52.031   12.080   18.454   15.128   33.462   4.5462   18.726   7.1401 14.73670 8.464583 
1 1 1    4    2  132 o   10.650   4.8246  -2.1578   9.0205   5.8820   11.416 -15.5189   14.717   14.009   5.8907   11.094   5.3615 2.914937 7.965320 
1 1 1    4    2  133 o   11.894   5.2521   0.7248   9.9804  -1.0890   11.322   7.0468   21.137   12.042   5.4349   16.593   7.4630 -4.551064 9.232223 
1 1 1    4    2  134 o   36.922   3.8417   61.475   11.393   60.482   12.952   64.874   23.959   35.989   4.5139   31.477   8.9276 4.511696 10.00384 
1 1 1    4    2  135 o   31.497   5.1411   48.295   12.745   41.958   15.323   62.524   22.958   27.531   6.8544   31.073   8.7137 -3.542547 11.08652 
1 1 1    4    2  136 o   14.316   5.8106   8.0453   10.586   1.0886   14.639   15.670   15.326   13.670   6.1738   17.490   7.0297 -3.820828 9.355866 
1 1 1    4    2  137 o   19.031   6.1483   19.402   10.866   21.031   14.854   17.527   15.938   19.208   7.1279   18.054   7.1983 1.154158 10.13029 
1 1 1    4    2  138 o   18.565   6.0535   18.235   10.520   8.0948   14.680   28.940   15.083   15.308   6.5669   22.169   7.2497 -6.861075 9.781757 
1 1 1    4    3 -137 o   13.131   5.4268   5.6584   9.4458   2.2141   11.824   11.733   15.703   12.951   5.7176   16.412   6.9055 -3.461725 8.965344 
1 1 1    4    3 -136 o   12.719   5.3436   4.5683   9.3805  -3.0454   11.606   18.912   15.930   11.622   5.3434   18.454   7.2470 -6.832469 9.003929 
1 1 1    4    3 -135 o   11.373   5.0536   0.1611   9.3847  -8.3031   11.686   15.536   15.750   10.660   5.0485   17.484   7.0907 -6.823591 8.704271 
1 1 1    4    3 -134 o   27.213   4.6085   35.091   9.8584   21.054   12.221   61.244   16.681   19.627   6.5305   34.357   6.1838 -14.72972 8.993663 
1 1 1    4    3 -133 o   23.109   5.3032   26.560   9.7776   33.916   12.391   14.422   15.917   25.522   6.0489   17.326   7.0900 8.196136 9.319738 
1 1 1    4    3 -132 o   18.076   5.7305   16.640   9.4731   17.492   11.857   15.135   15.751   18.269   6.4226   17.592   7.1068 0.6769524 9.578924 
1 1 1    4    3 -131 o   42.349   3.0629   77.763   10.502   63.387   13.142  103.162   17.468   37.024   4.4431   47.105   4.6082 -10.08090 6.401286 
1 1 1    4    3 -130 o   9.6112   4.5822  -9.5299   9.9523  -2.5458   11.135 -37.2719   22.192   11.670   5.3156   11.830   5.8834 -0.1593361 7.929057 
1 1 1    4    3 -129 o   16.138   5.6143   12.446   9.0463   19.286   9.8309 -25.3440   23.107   19.520   5.7740   13.177   6.4463 6.343616 8.654076 
1 1 1    4    3 -128 o   19.721   5.4741   19.252   9.1105   19.582   9.8909   17.399   23.401   19.726   5.7801   19.293   8.2839 0.4336891 10.10110 
1 1 1    4    3 -127 o   13.807   5.0413   8.1093   7.3805   4.7284   9.5079   13.235   11.707   13.105   5.4329   16.845   6.3128 -3.740251 8.328681 
1 1 1    4    3 -126 o   34.493   2.8807   50.962   8.0259   51.028   10.558   50.872   12.353   33.858   3.8964   33.202   4.6951 0.6555824 6.101303 
1 1 1    4    3 -125 o   11.305   4.7278   2.4507   7.2919   4.9839   9.7629  -0.7456   10.966   13.410   5.5272   12.233   5.4478 1.177008 7.760691 
1 1 1    4    3 -124 o   59.762   1.9256  148.219   9.3681  142.056   12.651  155.699   13.939   58.019   2.6823   60.631   2.8281 -2.612267 3.897836 
1 1 1    4    3 -123 o   20.511   4.0355   18.869   6.5068   16.830   10.030   20.351   8.5501   18.766   5.8896   20.841   5.0798 -2.075052 7.777658 
1 1 1    4    3 -122 o   37.046   2.2380   57.260   6.7269   57.300   10.677   57.234   8.6625   36.378   3.6497   36.746   2.9159 -0.3671188 4.671462 
1 1 1    4    3 -121 o   8.8271   3.9522  -1.9290   5.8542  -9.1650   9.5382   2.4442   7.4151   9.6966   4.5828   11.548   4.7935 -1.851343 6.631773 
1 1 1    4    3 -120 o   41.656   2.0597   71.907   6.9722   78.035   11.112   67.928   8.9542   42.911   3.1998   40.227   2.7472 2.684586 4.217320 
1 1 1    4    3 -119 o   51.544   1.7694  109.468   7.4235  119.844   11.844  102.756   9.5267   53.545   2.7226   49.729   2.3569 3.816521 3.601043 
1 1 1    4    3 -118 o   21.995   3.5802   20.903   6.1983   14.519   10.082   24.782   7.8590   18.079   5.9281   23.759   4.2122 -5.679943 7.272207 
1 1 1    4    3 -117 o   13.342   4.5297   7.2479   5.8778   5.7716   9.4364   8.1838   7.5133   14.069   5.5615   14.400   5.1080 -0.3312073 7.551250 
1 1 1    4    3 -116 o   34.175   2.3754   48.493   6.5761   45.546   10.332   50.499   8.5259   32.582   3.9723   34.676   3.0473 -2.093563 5.006486 
1 1 1    4    3 -115 o   28.535   2.8051   34.110   6.4406   46.366   10.251   26.116   8.2786   32.940   3.8929   24.467   4.3083 8.473433 5.806506 
1 1 1    4    3 -114 o   12.744   4.5934   6.0046   6.1009   5.8587   9.5661   6.1046   7.9209   14.251   5.6100   13.611   5.1722 0.6400299 7.630424 
1 1 1    4    3 -113 o   9.3623   4.1443  -1.6760   6.2516   16.376   10.952 -10.4004   7.6139   19.302   6.1665   8.2108   3.9396 11.09166 7.317538 
1 1 1    4    3 -112 o   48.664   1.9604   97.408   7.7606   86.111   12.912  103.799   9.7104   45.284   3.5256   50.129   2.3832 -4.845398 4.255522 
1 1 1    4    3 -111 o   18.404   4.5148   14.866   6.7212   12.190   13.076   15.827   7.8356   18.085   6.6920   18.935   5.0025 -0.8498459 8.355143 
1 1 1    4    3 -110 o   52.011   1.9679  111.134   8.3282  114.403   15.845  109.886   9.7897   52.238   3.7459   51.635   2.3319 0.6025772 4.412380 
1 1 1    4    3 -109 o   59.916   1.7058  147.101   8.3228  152.148   13.883  144.270   10.399   60.658   2.8154   59.241   2.1570 1.417694 3.546676 
1 1 1    4    3 -108 o   51.996   1.9260  110.931   8.1494  109.935   13.973  111.445   10.032   51.417   3.3521   52.028   2.3718 -0.6106873 4.106345 
1 1 1    4    3 -107 o   83.645   1.5452  286.048   10.535  275.618   17.652  291.819   13.130   81.818   2.6502   84.416   1.9082 -2.597740 3.265699 
1 1 1    4    3 -106 o   52.024   2.2948  111.211   9.7075  111.773   13.955  110.683   13.513   51.930   3.3140   51.698   3.2225 0.2314568 4.622452 
1 1 1    4    3 -105 o   27.545   3.4930   31.809   7.6670   26.260   11.966   35.674   9.9862   24.441   6.0411   28.988   4.3611 -4.547712 7.450743 
1 1 1    4    3 -104 o   68.730   1.8013  193.264   10.083  197.867   13.088  186.543   15.816   69.459   2.3148   67.322   2.8887 2.136589 3.701729 
1 1 1    4    3 -103 o  118.843   1.5520  576.849   15.035  575.862   19.716  578.221   23.244  118.651   2.0385  118.811   2.4000 -0.1599960 3.148859 
1 1 1    4    3 -102 o   52.989   1.9861  114.952   8.5636  106.772   11.780  124.119   12.471   50.944   2.8482   54.947   2.7934 -4.003723 3.989379 
1 1 1    4    3 -101 o   73.090   1.5825  218.115   9.4286  219.602   13.899  216.848   12.832   73.227   2.3315   72.790   2.1651 0.4368744 3.181807 
1 1 1    4    3 -100 o   43.908   2.2505   79.038   8.0280   75.984   11.868   81.614   10.901   42.883   3.4234   44.518   3.0218 -1.634579 4.566280 
1 1 1    4    3  -99 o  135.052   1.5293  744.390   16.835  723.849   27.202  757.143   21.433  133.022   2.5087  136.148   1.9312 -3.126602 3.165947 
1 1 1    4    3  -98 o   51.442   2.0794  108.275   8.7014  108.092   12.815  108.432   11.853   51.279   3.0800   51.392   2.8404 -0.1134796 4.189755 
1 1 1    4    3  -97 o  149.878   1.4964  916.529   18.282  948.122   29.686  897.226   23.204  152.312   2.3910  148.239   1.9203 4.072372 3.066684 
1 1 1    4    3  -96 o   82.404   1.5175  277.039   10.193  289.031   15.185  267.204   13.751   84.091   2.2172   80.864   2.0879 3.226456 3.045563 
1 1 1    4    3  -95 o   69.413   1.7331  196.617   9.8062  194.495   13.610  198.908   14.141   68.955   2.4251   69.727   2.4920 -0.7720184 3.477250 
1 1 1    4    3  -94 o   78.008   1.6386  248.270   10.419  264.164   14.572  231.645   14.904   80.402   2.2256   75.266   2.4324 5.135063 3.296929 
1 1 1    4    3  -93 o  109.045   1.4778  485.008   13.136  498.414   18.378  471.007   18.782  110.504   2.0403  107.414   2.1451 3.089310 2.960456 
1 1 1    4    3  -92 o   38.982   2.4370   62.296   7.7051   64.893   11.273   60.019   10.555   39.667   3.5231   38.148   3.4310 1.518356 4.917719 
1 1 1    4    3  -91 o   88.212   1.5674  317.386   11.270  284.043   17.689  340.172   14.623   83.354   2.6066   91.304   1.9648 -7.950058 3.264157 
1 1 1    4    3  -90 o  127.300   1.4293  660.870   14.832  640.369   20.885  681.729   21.067  125.272   2.0453  129.258   1.9995 -3.985672 2.860258 
1 1 1    4    3  -89 o  139.132   1.4313  789.388   16.233  802.720   23.135  776.461   22.782  140.264   2.0235  137.950   2.0259 2.313431 2.863359 
1 1 1    4    3  -88 o   15.815   5.0815   9.9891   7.4292   0.9276   9.7800   22.351   11.423   12.993   5.4573   22.905   6.0348 -9.911751 8.136453 
1 1 1    4    3  -87 o  131.132   1.5098  701.214   16.138  718.727   21.652  679.323   24.207  132.733   2.0011  129.024   2.3016 3.709137 3.049934 
1 1 1    4    3  -86 o  328.842   2.3126  4412.42   61.991  4269.87   79.750  4630.06   98.540  323.356   3.0256  336.584   3.5916 -13.22827 4.696123 
1 1 1    4    3  -85 o  157.852   1.4881  1016.00   19.148  997.491   26.579  1035.97   27.610  156.374   2.0852  159.359   2.1254 -2.985168 2.977472 
1 1 1    4    3  -84 o  127.825   1.4869  666.213   15.493  694.952   21.774  636.741   22.050  130.530   2.0464  124.938   2.1651 5.592041 2.979180 
1 1 1    4    3  -83 o   75.241   1.6704  230.848   10.245  235.621   15.005  226.680   14.022   75.956   2.4265   74.506   2.3116 1.449440 3.351353 
1 1 1    4    3  -82 o  106.058   1.4174  458.608   12.254  463.102   18.045  454.763   16.692  106.555   2.0775  105.596   1.9392 0.9586945 2.841965 
1 1 1    4    3  -81 o  186.541   1.5619  1418.82   23.749  1421.51   33.280  1416.03   33.902  186.682   2.1870  186.319   2.2322 0.3633728 3.125003 
1 1 1    4    3  -80 o   20.230   4.1941   17.346   6.6890   15.076   8.9859   20.166   10.017   18.994   5.4932   21.783   5.6083 -2.788609 7.850410 
1 1 1    4    3  -79 o  137.402   1.3969  769.689   15.646  784.820   21.973  754.128   22.284  138.727   1.9431  135.985   2.0103 2.742310 2.795873 
1 1 1    4    3  -78 o  176.079   1.4841  1264.02   21.302  1232.85   29.434  1298.30   30.867  173.868   2.0768  178.421   2.1223 -4.552567 2.969402 
1 1 1    4    3  -77 o   94.513   1.6230  364.207   12.504  379.830   21.393  356.101   15.410   96.450   2.7238   93.447   2.0230 3.003227 3.392905 
1 1 1    4    3  -76 o  111.775   1.5805  509.372   14.401  520.386   24.568  503.606   17.774  112.943   2.6685  111.131   1.9621 1.812088 3.312207 
1 1 1    4    3  -75 o  153.108   1.6319  955.755   20.367  962.791   34.987  952.148   25.048  153.621   2.7940  152.805   2.0110 0.8153687 3.442425 
1 1 1    4    3  -74 o  116.265   1.5703  551.109   14.882  549.750   25.262  551.831   18.417  116.089   2.6695  116.332   1.9421 -0.2431183 3.301252 
1 1 1    4    3  -73 o  189.460   1.5128  1463.39   23.364  1487.52   38.608  1449.45   29.348  190.973   2.4801  188.541   1.9095 2.431610 3.130061 
1 1 1    4    3  -72 o  170.074   1.4447  1179.20   20.029  1190.72   33.059  1172.52   25.175  170.869   2.3735  169.580   1.8212 1.288574 2.991688 
1 1 1    4    3  -71 o  155.909   1.3131  990.896   16.688  967.286   24.725  1010.65   22.617  154.022   1.9693  157.443   1.7623 -3.421463 2.642685 
1 1 1    4    3  -70 o   22.758   3.0074   21.496   5.4426   23.721   8.0867   19.654   7.3588   23.733   4.3400   21.555   4.3385 2.177641 6.136658 
1 1 1    4    3  -69 o  144.408   1.2850  850.077   15.127  847.290   22.609  852.335   20.353  144.156   1.9241  144.589   1.7268 -0.4337769 2.585354 
1 1 1    4    3  -68 o  276.233   2.0042  3111.20   45.128  3124.45   68.816  3101.20   59.775  276.750   3.0505  275.748   2.6593 1.001892 4.046903 
1 1 1    4    3  -67 o   84.362   1.4559  290.126   10.012  272.201   14.635  305.892   13.726   81.675   2.2002   86.618   1.9440 -4.942863 2.935990 
1 1 1    4    3  -66 o  186.041   1.7298  1411.03   26.233  1360.15   44.453  1438.21   32.494  182.609   2.9864  187.812   2.1225 -5.203171 3.663759 
1 1 1    4    3  -65 f  149.567   1.5898  911.944   19.382  924.203   33.275  905.648   23.845  150.540   2.7116  149.042   1.9627 1.497711 3.347404 
1 1 1    4    3  -64 o  407.721   2.7173  6779.10   90.309  6578.00  134.673  6943.42  121.736  401.485   4.1150  412.545   3.6200 -11.05991 5.480709 
1 1 1    4    3  -63 o  258.310   1.9131  2720.18   40.283  2686.58   60.909  2746.29   53.706  256.668   2.9112  259.522   2.5387 -2.854462 3.862674 
1 1 1    4    3  -62 o   88.463   1.4591  319.000   10.522  348.796   16.029  296.440   13.947   92.496   2.1259   85.273   2.0065 7.222694 2.923269 
1 1 1    4    3  -61 o  218.250   1.6095  1941.68   28.634  1923.53   40.048  1960.66   40.958  217.212   2.2618  219.298   2.2912 -2.085617 3.219566 
1 1 1    4    3  -60 o  553.020   3.3257 12472.01  149.920 12430.03  211.250 12514.60  212.796  551.932   4.6954  553.804   4.7138 -1.871948 6.653337 
1 1 1    4    3  -59 o  218.476   1.6144  1945.65   28.750  1984.04   40.894  1908.14   40.428  220.607   2.2741  216.346   2.2924 4.261429 3.229016 
1 1 1    4    3  -58 o  526.612   3.1775 11307.73  136.398 11323.69  192.938 11291.78  192.853  526.869   4.4924  526.126   4.4968 0.7431641 6.356300 
1 1 1    4    3  -57 o  619.350   3.6915 15642.62  186.370 15760.56  264.984 15527.18  262.172  621.514   5.2304  616.897   5.2136 4.616760 7.385017 
1 1 1    4    3  -56 o  458.255   2.9996  8561.69  112.050  8358.06  145.226  8861.21  176.134  452.721   3.9353  466.099   4.6359 -13.37802 6.080939 
1 1 1    4    3  -55 o  299.973   2.2821  3668.11   55.802  3663.69   78.499  3672.64   79.340  299.767   3.2125  300.132   3.2430 -0.3649292 4.564780 
1 1 1    4    3  -54 f  262.536   1.9270  2809.51   41.238  2830.28   54.652  2782.05   62.840  263.494   2.5445  261.230   2.9510 2.263397 3.896538 
1 1 1    4    3  -53 o  160.641   1.4084  1051.83   18.442  1085.09   26.140  1018.86   26.022  163.158   1.9654  158.100   2.0192 5.058167 2.817805 
1 1 1    4    3  -52 o  346.993   2.2184  4907.94   62.746  4979.35   89.484  4838.87   88.007  349.487   3.1411  344.522   3.1338 4.964996 4.436985 
1 1 1    4    3  -51 o  725.076   4.2809 21436.39  253.021 21353.65  356.456 21520.41  359.211  723.528   6.0439  726.345   6.0670 -2.817444 8.563662 
1 1 1    4    3  -50 o  791.768   4.6588 25562.18  300.683 25753.45  427.532 25374.98  422.965  794.545   6.6011  788.688   6.5791 5.857361 9.319765 
1 1 1    4    3  -49 o  663.402   4.2060 17943.56  227.450 17834.02  299.134 18093.68  350.190  661.290   5.5493  666.017   6.4503 -4.726990 8.508913 
1 1 1    4    3  -48 o  475.190   3.3486  9205.13  129.706  9288.50  184.201  9123.14  182.674  477.289   4.7345  473.021   4.7376 4.267700 6.697802 
1 1 1    4    3  -47 f  454.113   3.2209  8406.42  119.226  8418.02  145.848  8383.06  206.998  454.406   3.9375  453.399   5.6008 1.006683 6.846369 
1 1 1    4    3  -46 o  359.788   2.6461  5276.55   77.606  5260.73   94.795  5308.71  135.140  359.238   3.2372  360.841   4.5944 -1.602631 5.620342 
1 1 1    4    3  -45 o  624.952   3.9836 15922.36  202.936 16004.90  269.480 15814.23  308.439  626.510   5.2767  622.722   6.0763 3.787659 8.047662 
1 1 1    4    3  -44 o  499.189   3.2448 10157.92  132.036 10355.09  177.113  9911.25  198.098  503.979   4.3112  493.039   4.9291 10.94040 6.548454 
1 1 1    4    3  -43 o  253.663   2.5030  2622.78   51.756  2622.78   51.756   0.0000   0.0000  253.663   2.5030  ?   ?  0.000000 2.503013 
1 1 1    4    3  -42 o  264.477   2.9985  2851.27   64.645  2780.87   78.003  3005.68  115.518  261.184   3.6638  271.509   5.2195 -10.32556 6.377006 
1 1 1    4    3  -41 o  443.081   3.8489  8003.15  139.014  8034.54  160.932  7910.88  275.920  443.934   4.4472  440.385   7.6862 3.548676 8.880081 
1 1 1    4    3  -40 o  331.338   3.0035  4475.08   81.122  4419.32   92.607  4659.00  168.183  329.261   3.4504  338.014   6.1039 -8.753662 7.011639 
1 1 1    4    3  -39 o  640.034   4.8048 16701.04  250.680 16611.47  278.922 17077.36  571.711  638.292   5.3608  646.807   10.843 -8.514343 12.09618 
1 1 1    4    3  -38 o  370.755   2.9441  5603.09   88.977  5554.86   98.741  5811.44  205.212  369.151   3.2814  377.499   6.6688 -8.348419 7.432428 
1 1 1    4    3  -37 o  695.909   4.7453 19743.91  269.184 20048.44  333.908 19178.62  454.940  701.205   5.8418  685.687   8.1394 15.51733 10.01878 
1 1 1    4    3  -36 o  402.153   3.1557  6592.36  103.449  6325.98  128.755  7077.49  173.756  393.929   4.0097  416.646   5.1161 -22.71649 6.500138 
1 1 1    4    3  -35 o  165.167   1.6957  1111.91   22.830  1138.67   37.347  1095.94   28.848  167.139   2.7412  163.975   2.1583 3.163681 3.488877 
1 1 1    4    3  -34 o  591.773   4.0682 14275.92  196.244 14230.96  276.818 14321.34  278.249  590.782   5.7482  592.654   5.7597 -1.872681 8.137276 
1 1 1    4    3  -33 o  151.816   1.6582  939.414   20.521  942.968   26.423  934.011   32.576  152.102   2.1312  151.375   2.6400 0.7263794 3.392852 
1 1 1    4    3  -32 o  652.780   4.8958 17372.72  260.510 17089.07  331.688 17829.42  420.871  647.367   6.2856  661.154   7.8093 -13.78680 10.02462 
1 1 1    4    3  -31 o  585.506   4.0286 13975.19  192.273 13860.36  233.881 14214.62  337.711  583.066   4.9209  590.377   7.0175 -7.310730 8.570855 
1 1 1    4    3  -30 f  430.219   2.8126  7544.50   98.637  7372.30  128.169  7794.63  154.471  425.265   3.6973  437.262   4.3338 -11.99673 5.696670 
1 1 1    4    3  -29 o  706.479   4.4523 20347.99  256.401 20046.79  335.024 20773.82  398.356  701.161   5.8617  713.701   6.8473 -12.54016 9.013597 
1 1 1    4    3  -28 o  663.615   4.1926 17953.43  226.798 17974.62  300.450 17925.37  345.790  663.943   5.5514  662.984   6.3984 0.9584961 8.471023 
1 1 1    4    3  -27 o  305.253   2.1048  3798.01   52.373  3712.53   68.242  3920.52   81.694  301.791   2.7740  310.123   3.2316 -8.332123 4.258929 
1 1 1    4    3  -26 o  573.437   3.6514 13405.13  170.681 13384.17  225.609 13433.19  260.997  572.943   4.8307  573.955   5.5786 -1.012268 7.379423 
1 1 1    4    3  -25 o  104.875   1.3580  448.292   11.610  445.406   16.989  450.820   15.901  104.535   1.9938  105.169   1.8549 -0.6338501 2.723202 
1 1 1    4    3  -24 o  748.528   4.7025 22845.26  286.925 22652.43  376.896 23111.06  442.502  745.251   6.2042  752.665   7.2124 -7.414001 9.513653 
1 1 1    4    3  -23 o  285.112   1.9936  3313.37   46.333  3329.45   61.618  3292.46   70.283  285.794   2.6450  284.197   3.0339 1.597778 4.024941 
1 1 1    4    3  -22 o  157.804   1.3850  1014.98   17.816  1014.35   23.684  1015.81   27.040  157.752   1.8418  157.864   2.1013 -0.1120300 2.794204 
1 1 1    4    3  -21 o  409.953   2.6907  6850.83   89.915  6860.46  119.185  6838.11  136.982  410.217   3.5643  409.530   4.1034 0.6871338 5.435233 
1 1 1    4    3  -20 o  549.427   3.5078 12306.88  157.103 12341.15  208.411 12261.78  239.089  550.133   4.6475  548.318   5.3492 1.815613 7.086143 
1 1 1    4    3  -19 o  462.007   3.2327  8701.84  121.744  8966.95  152.935  8243.20  201.153  468.962   4.0007  449.563   5.4891 19.39890 6.792305 
1 1 1    4    3  -18 o  718.040   4.8831 21026.02  285.815 21078.17  350.874 20923.19  492.740  718.824   5.9881  715.867   8.4440 2.957886 10.35179 
1 1 1    4    3  -17 o  395.272   2.4366  6368.88   78.507  6402.56  111.690  6336.00  110.372  396.285   3.4576  394.221   3.4347 2.064362 4.873577 
1 1 1    4    3  -16 o  387.832   2.7623  6131.70   87.326  6137.54  123.776  6125.92  123.222  387.978   3.9138  387.611   3.8999 0.3669128 5.525119 
1 1 1    4    3  -15 o  315.160   2.1498  4048.75   55.229  4021.85   83.989  4069.24   73.306  314.086   3.2805  315.942   2.8464 -1.856140 4.343243 
1 1 1    4    3  -14 o  769.154   4.8253 24126.99  302.534 24346.78  465.711 23966.52  397.933  772.325   7.3974  766.415   6.3696 5.910034 9.761831 
1 1 1    4    3  -13 f  186.809   1.6172  1422.44   24.626  1391.98   42.292  1438.06   30.291  184.785   2.8077  187.829   1.9784 -3.043869 3.434728 
1 1 1    4    3  -12 o  201.917   2.3702  1661.95   39.011   0.0000   0.0000  1661.95   39.011  ?   ?   201.917   2.3702 0.000000 2.370177 
1 1 1    4    3  -11 o  677.099   5.6472 18702.16  311.690 18609.31  621.246 18733.39  360.323  674.528   11.299  677.565   6.5239 -3.036621 13.04687 
1 1 1    4    3  -10 o  348.922   3.0916  4963.38   87.932  5162.86  182.114  4902.73  100.412  355.717   6.2806  346.769   3.5523 8.948608 7.215618 
1 1 1    4    3   -9 o  191.349   1.7831  1492.43   27.812  1461.86   43.630  1513.36   36.096  189.366   2.8265  192.680   2.2982 -3.313690 3.642894 
1 1 1    4    3   -8 o  420.903   2.9685  7222.26  101.849  7421.17  180.325  7129.08  123.419  426.555   5.1862  418.155   3.6209 8.400635 6.325091 
1 1 1    4    3   -7 o  221.175   1.6517  1993.93   29.779  1965.12   45.072  2016.25   39.670  219.561   2.5183  222.403   2.1882 -2.842407 3.336212 
1 1 1    4    3   -6 o  429.204   2.7969  7509.71   97.852  7465.60  148.711  7543.40  129.947  427.882   4.2637  430.131   3.7062 -2.249084 5.649331 
1 1 1    4    3   -5 o  814.138   4.7719 27031.13  316.685 26546.07  440.906 27548.05  455.154  806.564   6.7061  821.631   6.7959 -15.06781 9.547561 
1 1 1    4    3   -4 o  422.093   2.5783  7262.70   88.711  7317.79  126.255  7208.98  124.673  423.653   3.6560  420.492   3.6373 3.160614 5.157145 
1 1 1    4    3   -3 o  348.096   2.1821  4939.23   61.916  4933.95   87.511  4944.52   87.614  347.888   3.0859  348.261   3.0863 -0.3724060 4.364400 
1 1 1    4    3   -2 o  332.566   2.1009  4508.29   56.953  4572.35   81.426  4446.94   79.689  334.901   2.9827  330.277   2.9600 4.623993 4.202128 
1 1 1    4    3   -1 o  198.857   1.5455  1611.82   25.053  1620.29   38.410  1605.54   33.051  199.371   2.3635  198.465   2.0430 0.9057007 3.124061 
1 1 1    4    3    0 o  219.203   1.6438  1958.53   29.372  1987.74   45.312  1937.36   38.573  220.821   2.5173  218.010   2.1705 2.811661 3.323861 
1 1 1    4    3    1 o  536.710   3.4309 11744.09  150.100 11663.93  227.972 11805.44  199.428  534.767   5.2297  538.048   4.5471 -3.281067 6.930079 
1 1 1    4    3    2 o  215.470   1.6249  1892.39   28.540  1868.37   43.236  1910.94   37.993  214.089   2.4775  216.518   2.1526 -2.429550 3.282087 
1 1 1    4    3    3 o  183.301   1.4742  1369.49   22.026  1372.17   33.673  1367.50   29.121  183.473   2.2515  183.163   1.9504 0.3094940 2.978829 
1 1 1    4    3    4 o   37.718   1.4977   58.078   4.5956   62.472   7.0339   54.805   6.0702   39.086   2.2168   36.611   2.0421 2.474648 3.014067 
1 1 1    4    3    5 o   40.943   1.4354   68.409   4.7832   57.078   7.1455   77.609   6.4386   37.345   2.3593   43.597   1.8157 -6.251846 2.977113 
1 1 1    4    3    6 o  405.559   2.6608  6704.96   87.965  6634.10  133.283  6759.65  117.087  403.360   4.0537  407.181   3.5276 -3.820404 5.373678 
1 1 1    4    3    7 o  468.052   3.2659  8931.39  124.605  8815.90  213.501  8991.04  153.450  464.885   5.6340  469.579   4.0089 -4.694000 6.914720 
1 1 1    4    3    8 o   75.940   1.4187  235.055   8.7820  228.426   13.843  239.519   11.361   74.824   2.2723   76.656   1.8181 -1.832504 2.910145 
1 1 1    4    3    9 o  260.259   2.1945  2761.05   46.556  2784.39   74.006  2745.76   59.892  261.331   3.4741  259.526   2.8311 1.804749 4.481571 
1 1 1    4    3   10 o  400.580   4.9202  6544.48  160.659   0.0000   0.0000  6544.48  160.659  ?   ?   400.580   4.9202 0.000000 4.920167 
1 1 1    4    3   11 o  171.113   2.1714  1193.52   30.287  1262.81   54.716  1162.91   36.367  175.986   3.8141  168.900   2.6415 7.086380 4.639511 
1 1 1    4    3   12 o  802.217   9.4131 26292.89  615.549   0.0000   0.0000 26292.89  615.549  ?   ?   802.217   9.4131 0.000000 9.413150 
1 1 1    4    3   13 f  239.012   2.3078  2328.67   44.962  2414.57   65.387  2251.63   61.926  243.362   3.2961  235.009   3.2326 8.353760 4.616719 
1 1 1    4    3   14 o  520.831   3.9488 11060.67  167.646 10962.37  263.226 11127.76  217.452  518.351   6.2297  522.335   5.1072 -3.984253 8.055589 
1 1 1    4    3   15 o  321.487   2.3611  4213.06   61.876  4284.83   88.632  4144.83   86.421  324.190   3.3540  318.850   3.3250 5.339294 4.722789 
1 1 1    4    3   16 o  414.550   2.9304  7005.80   99.025  6996.77  139.916  7014.87  140.169  414.236   4.1436  414.772   4.1458 -0.5354614 5.861525 
1 1 1    4    3   17 o  531.087   3.6696 11499.69  158.863 11357.06  222.356 11648.42  227.051  527.695   5.1693  534.418   5.2120 -6.723022 7.340755 
1 1 1    4    3   18 o  355.006   2.8140  5137.61   81.432  5066.99  103.922  5249.94  131.071  352.535   3.6163  358.812   4.4813 -6.276978 5.758473 
1 1 1    4    3   19 o  527.654   3.9985 11351.92  171.982 11312.36  221.281 11412.27  273.315  526.669   5.1543  528.904   6.3394 -2.235596 8.170401 
1 1 1    4    3   20 o  224.140   1.8079  2047.75   33.031  2013.59   46.239  2083.35   47.201  222.254   2.5522  226.071   2.5614 -3.817047 3.615875 
1 1 1    4    3   21 o  667.863   4.5532 18187.62  247.878 18161.78  350.231 18213.56  350.873  667.238   6.4393  668.188   6.4419 -0.9503174 9.108390 
1 1 1    4    3   22 o  445.510   3.1266  8091.09  113.545  8131.04  161.244  8051.78  159.919  446.563   4.4296  444.382   4.4148 2.181335 6.253909 
1 1 1    4    3   23 o  649.044   4.4333 17175.88  234.550 16805.40  325.599 17575.52  338.167  641.888   6.2228  656.423   6.3199 -14.53503 8.869309 
1 1 1    4    3   24 o  749.861   5.0869 22928.30  310.932 22632.63  434.788 23237.79  444.833  744.839   7.1611  754.724   7.2306 -9.885437 10.17657 
1 1 1    4    3   25 o  532.106   3.6827 11542.56  159.736 11544.11  226.335 11541.02  225.470  532.079   5.2184  532.009   5.1992 0.7037354E-01 7.366356 
1 1 1    4    3   26 o  278.653   2.1254  3164.93   48.277  3157.13   68.560  3172.61   67.993  278.299   3.0222  278.980   2.9899 -0.6818542 4.251239 
1 1 1    4    3   27 o  417.292   2.9590  7098.12  100.652  7099.13  142.667  7097.12  142.022  417.294   4.1942  417.235   4.1758 0.5868530E-01 5.918473 
1 1 1    4    3   28 o  459.668   3.2241  8613.09  120.807  8528.58  169.739  8699.85  171.975  457.373   4.5528  461.942   4.5671 -4.569244 6.448738 
1 1 1    4    3   29 o  392.934   2.8094  6293.51   89.984  6428.34  129.778  6168.67  124.876  397.099   4.0093  388.997   3.9382 8.101379 5.619924 
1 1 1    4    3   30 f  378.981   2.7248  5854.42   84.175  5823.25  118.985  5885.65  119.099  377.953   3.8621  379.973   3.8452 -2.019806 5.449874 
1 1 1    4    3   31 o  657.581   4.4916 17628.50  240.760 17835.64  344.183 17430.03  336.906  661.347   6.3845  653.787   6.3217 7.560059 8.984751 
1 1 1    4    3   32 o  427.907   3.3139  7463.87  115.591  7656.23  187.036  7344.99  147.032  433.341   5.2949  424.467   4.2494 8.873230 6.789258 
1 1 1    4    3   33 o  512.210   3.8997 10695.03  162.824 10817.61  260.294 10616.23  208.697  515.064   6.1997  510.289   5.0172 4.775604 7.975479 
1 1 1    4    3   34 o  1260.06   10.357 64797.05  1063.76 63387.63  1475.12 66324.12  1535.45  1245.50   14.529  1273.96   14.786 -28.46509 20.72973 
1 1 1    4    3   35 o  572.566   5.5831 13366.60  260.580 13366.60  260.580   0.0000   0.0000  572.566   5.5831  ?   ?  0.000000 5.583146 
1 1 1    4    3   36 o  574.460   4.3413 13453.21  203.291 13245.95  224.196 14411.68  482.132  570.002   4.8252  594.279   9.9527 -24.27698 11.06065 
1 1 1    4    3   37 o  716.868   5.9767 20954.55  349.250 20745.98  399.618 21629.03  718.621  713.240   6.8734  727.810   12.113 -14.56982 13.92712 
1 1 1    4    3   38 o  430.377   3.0488  7550.16  106.958  7702.81  133.198  7273.03  179.468  434.693   3.7591  422.357   5.2128 12.33603 6.426814 
1 1 1    4    3   39 o  496.616   3.4667 10053.48  140.337 10053.59  171.871 10053.26  243.089  496.600   4.2458  496.533   6.0059 0.6643677E-01 7.355153 
1 1 1    4    3   40 o  361.067   2.2730  5313.88   66.901  5454.03   96.740  5185.40   92.619  365.784   3.2445  356.664   3.1857 9.120758 4.547015 
1 1 1    4    3   41 o  304.218   1.9853  3772.23   49.232  3776.12   70.014  3768.42   69.242  304.366   2.8220  304.056   2.7937 0.3102722 3.970942 
1 1 1    4    3   42 o  208.876   1.8132  1778.30   30.873  1749.26   37.397  1840.43   54.708  207.162   2.2146  212.484   3.1586 -5.322235 3.857582 
1 1 1    4    3   43 o  356.725   2.6232  5187.02   76.279  5140.33   92.702  5284.90  134.229  355.108   3.2025  360.039   4.5736 -4.931213 5.583402 
1 1 1    4    3   44 o  496.222   3.8174 10038.15  154.413 10052.24  199.594 10017.15  243.694  496.533   4.9313  495.621   6.0320 0.9127808 7.791193 
1 1 1    4    3   45 o  607.018   4.1856 15022.06  207.105 14883.53  251.584 15313.31  364.788  604.172   5.1084  612.701   7.3039 -8.529480 8.913074 
1 1 1    4    3   46 o  199.911   1.8031  1628.93   29.383  1632.11   36.002  1622.57   50.849  200.104   2.2072  199.509   3.1267 0.5941925 3.827245 
1 1 1    4    3   47 f  509.562   3.5639 10585.11  148.034 10408.01  178.670 10972.86  264.375  505.255   4.3382  518.693   6.2528 -13.43817 7.610320 
1 1 1    4    3   48 o  348.524   2.3819  4951.25   67.669  4949.31   89.346  4953.87  103.633  348.442   3.1457  348.591   3.6471 -0.1496887 4.816266 
1 1 1    4    3   49 o  475.378   3.0985  9212.22  120.067  9557.25  163.510  8808.47  176.877  484.163   4.1430  464.789   4.6685 19.37411 6.241782 
1 1 1    4    3   50 o  604.823   4.5617 14915.95  224.901 14649.17  247.453 16182.68  539.215  599.360   5.0649  629.398   10.510 -30.03772 11.66671 
1 1 1    4    3   51 o  258.864   1.9058  2731.40   40.215  2708.47   52.699  2763.37   62.225  257.767   2.5081  260.360   2.9319 -2.592712 3.858304 
1 1 1    4    3   52 o  781.848   4.9155 24929.22  313.278 24744.04  411.679 25183.99  482.873  778.768   6.4851  785.518   7.5412 -6.750183 9.946151 
1 1 1    4    3   53 o  242.810   1.9714  2403.18   39.019  2401.42   47.676  2406.75   67.903  242.715   2.4097  242.965   3.4285 -0.2499542 4.190640 
1 1 1    4    3   54 f  345.975   2.5467  4879.55   71.823  4853.23   87.504  4933.89  125.736  345.025   3.1113  347.828   4.4347 -2.803650 5.417222 
1 1 1    4    3   55 o  623.636   4.6923 15862.78  238.537 15955.67  309.255 15726.35  374.799  625.308   6.0672  620.616   7.4087 4.692505 9.575959 
1 1 1    4    3   56 o  175.196   2.3135  1251.23   33.039  1251.23   33.039   0.0000   0.0000  175.196   2.3135  ?   ?  0.000000 2.313493 
1 1 1    4    3   57 o  181.791   1.6865  1347.10   24.992  1329.20   30.272  1385.41   44.288  180.574   2.0566  184.337   2.9474 -3.762268 3.594002 
1 1 1    4    3   58 o  448.679   3.1769  8208.54  116.193  8156.73  141.471  8315.93  203.680  447.213   3.8808  451.405   5.5353 -4.191925 6.760207 
1 1 1    4    3   59 o  240.274   2.1498  2353.50   42.105  2329.95   53.849  2390.54   67.542  239.052   2.7634  242.117   3.4222 -3.065170 4.398672 
1 1 1    4    3   60 o  336.625   2.7380  4620.28   75.129  4549.11   95.707  4734.55  121.273  333.981   3.5155  340.661   4.3672 -6.680145 5.606365 
1 1 1    4    3   61 o  156.125   1.7496  993.635   22.266  998.511   28.633  986.175   35.416  156.499   2.2445  155.517   2.7937 0.9819183 3.583633 
1 1 1    4    3   62 o  204.461   1.9629  1704.24   32.715  1702.10   42.029  1707.52   52.113  204.316   2.5236  204.620   3.1244 -0.3033905 4.016226 
1 1 1    4    3   63 o  256.802   2.0502  2688.60   42.918  2675.95   52.279  2714.75   75.160  256.179   2.5035  257.972   3.5742 -1.793030 4.363767 
1 1 1    4    3   64 o  352.586   2.5959  5069.38   74.609  5055.31   91.108  5098.04  129.997  352.052   3.1748  353.401   4.5126 -1.349091 5.517503 
1 1 1    4    3   65 f   49.122   1.8122   98.507   7.2438   96.217   9.4035  101.850   11.360   48.518   2.3850   49.895   2.8044 -1.377182 3.681436 
1 1 1    4    3   66 o  374.684   2.5244  5725.00   77.102  5757.88  102.445  5682.05  117.096  375.680   3.3453  373.139   3.8498 2.540649 5.100174 
1 1 1    4    3   67 o  407.991   2.7142  6788.93   90.268  6855.42  120.314  6703.31  136.537  409.878   3.6010  405.229   4.1335 4.649628 5.482042 
1 1 1    4    3   68 o  272.392   2.1361  3025.43   47.430  3004.28   66.638  3047.15   67.523  271.379   3.0124  273.307   3.0308 -1.928040 4.273212 
1 1 1    4    3   69 o  197.535   1.6353  1590.78   26.332  1573.14   34.562  1615.18   40.653  196.417   2.1587  199.007   2.5060 -2.590485 3.307583 
1 1 1    4    3   70 o  259.217   1.7940  2739.54   37.908  2668.71   60.502  2785.32   48.639  255.774   2.9019  261.347   2.2831 -5.572250 3.692358 
1 1 1    4    3   71 o  339.253   2.1849  4693.30   60.421  4574.86   96.576  4769.47   77.451  334.804   3.5387  341.940   2.7787 -7.136169 4.499253 
1 1 1    4    3   72 o   41.438   1.7731   70.136   5.9752   80.690   10.284   64.758   7.3413   44.382   2.8579   39.784   2.2732 4.598083 3.651728 
1 1 1    4    3   73 o   62.868   1.4453  161.130   7.4066  181.458   12.566  150.307   9.1687   66.663   2.3159   60.687   1.8556 5.976295 2.967599 
1 1 1    4    3   74 o  216.024   1.5990  1902.59   28.157  1903.04   45.846  1902.32   35.678  215.994   2.6039  215.988   2.0265 0.5615234E-02 3.299526 
1 1 1    4    3   75 o  148.189   1.3638  895.234   16.474  869.697   26.369  911.584   21.099  146.032   2.2152  149.525   1.7311 -3.493271 2.811327 
1 1 1    4    3   76 o  134.182   1.3370  734.002   14.624  723.851   23.630  740.303   18.618  133.225   2.1759  134.747   1.6950 -1.521942 2.758174 
1 1 1    4    3   77 o   77.992   1.3173  247.973   8.3747  218.451   12.408  272.672   11.350   73.160   2.0828   81.777   1.7026 -8.617638 2.690153 
1 1 1    4    3   78 o  155.107   1.3234  980.784   16.732  955.465   24.846  1001.80   22.634  153.068   1.9913  156.744   1.7715 -3.676437 2.665236 
1 1 1    4    3   79 o   93.471   1.2854  356.178   9.7941  373.020   14.976  343.591   12.946   95.641   1.9210   91.796   1.7302 3.845596 2.585260 
1 1 1    4    3   80 o  130.491   1.4096  694.226   14.994  695.970   20.804  692.341   21.630  130.637   1.9537  130.292   2.0365 0.3443909 2.822107 
1 1 1    4    3   81 o  277.399   1.9052  3138.14   43.081  3096.02   60.433  3181.66   61.432  275.450   2.6915  279.233   2.6989 -3.782837 3.811616 
1 1 1    4    3   82 o  156.967   1.5858  1004.64   20.290  973.831   26.530  1048.06   31.494  154.516   2.1064  160.277   2.4105 -5.761475 3.201169 
1 1 1    4    3   83 o  138.251   1.4698  779.302   16.564  732.005   23.032  829.972   23.839  133.964   2.1092  142.650   2.0502 -8.686005 2.941401 
1 1 1    4    3   84 o   98.271   1.5942  393.781   12.770  411.745   20.174  381.771   16.496  100.455   2.4637   96.744   2.0918 3.710579 3.231923 
1 1 1    4    3   85 o  124.601   1.4330  633.028   14.555  611.421   23.676  646.153   18.453  122.413   2.3727  125.871   1.7985 -3.458542 2.977304 
1 1 1    4    3   86 o   86.241   1.4903  303.276   10.477  294.143   17.163  308.701   13.227   84.861   2.4838   86.997   1.8652 -2.136505 3.106211 
1 1 1    4    3   87 o  114.549   1.4195  535.047   13.255  527.471   21.732  539.534   16.726  113.689   2.3450  115.013   1.7841 -1.323433 2.946508 
1 1 1    4    3   88 o  123.428   1.4180  621.228   14.267  632.740   23.688  614.675   17.872  124.514   2.3338  122.758   1.7860 1.756134 2.938815 
1 1 1    4    3   89 o  179.018   1.5272  1306.96   22.286  1275.70   36.264  1325.93   28.250  176.771   2.5167  180.280   1.9223 -3.509033 3.166881 
1 1 1    4    3   90 o   49.406   1.8887   99.731   7.5922  103.429   11.382   96.768   10.190   50.243   2.7901   48.612   2.5809 1.630711 3.800752 
1 1 1    4    3   91 o   45.695   2.0025   85.370   7.4408   92.500   11.153   79.649   9.9890   47.491   2.8946   44.066   2.7953 3.425331 4.024014 
1 1 1    4    3   92 o  197.382   1.6807  1589.38   27.042  1552.48   35.635  1639.48   41.524  195.007   2.2418  200.349   2.5426 -5.341934 3.389747 
1 1 1    4    3   93 o   87.543   1.7582  312.694   12.547  326.557   15.337  284.641   21.817   89.442   2.1035   83.357   3.2169 6.084572 3.843573 
1 1 1    4    3   94 o  145.745   1.6770  866.661   19.923  882.037   24.509  836.715   34.205  146.994   2.0455  143.049   2.9334 3.944977 3.576133 
1 1 1    4    3   95 o   12.286   5.1579   0.9190   8.7295  -3.1894   10.800   8.6622   14.827   12.383   5.4659   18.063   7.0210 -5.680005 8.897778 
1 1 1    4    3   96 o   86.452   1.6457  304.982   11.597  321.417   15.482  283.972   17.505   88.714   2.1409   83.309   2.5808 5.405258 3.353268 
1 1 1    4    3   97 o   69.824   1.8286  199.163   10.399  193.392   13.698  207.012   15.975   68.741   2.4486   71.085   2.7623 -2.343338 3.691274 
1 1 1    4    3   98 o  126.856   1.5865  656.762   16.406  663.435   21.873  648.179   24.805  127.435   2.1056  125.914   2.4168 1.520485 3.205382 
1 1 1    4    3   99 o  114.723   1.6171  537.240   15.123  528.098   20.010  549.418   23.093  113.674   2.1595  115.902   2.4443 -2.227600 3.261614 
1 1 1    4    3  100 o   14.297   5.1882   7.0321   7.7998   3.7880   10.420   11.167   11.763   14.271   5.7747   17.711   6.3790 -3.440536 8.604539 
1 1 1    4    3  101 o  143.103   1.7032  836.348   19.868  816.982   28.114  855.668   28.081  141.285   2.4411  144.606   2.3823 -3.320740 3.410917 
1 1 1    4    3  102 o  105.830   1.6939  457.504   14.613  477.929   21.290  439.311   20.093  108.041   2.4174  103.591   2.3795 4.449638 3.392067 
1 1 1    4    3  103 o   94.751   1.7277  366.858   13.344  363.683   19.177  369.839   18.580   94.173   2.5004   94.990   2.4015 -0.8166733 3.466842 
1 1 1    4    3  104 o   47.262   2.1856   91.653   8.3975   84.915   11.215  100.252   12.670   45.342   3.0520   49.259   3.1723 -3.916706 4.402062 
1 1 1    4    3  105 o   33.284   2.8411   45.866   7.6347   54.600   10.274   35.097   11.409   36.195   3.5269   28.555   5.0880 7.640213 6.190852 
1 1 1    4    3  106 o   92.852   1.7071  352.598   12.920  358.167   15.886  341.717   22.207   93.503   2.0843   91.035   2.9967 2.468369 3.650217 
1 1 1    4    3  107 o   17.092   4.8148   12.611   6.9931   4.2564   9.4602   22.677   10.384   13.783   5.5287   22.689   5.6388 -8.906512 7.896970 
1 1 1    4    3  108 o   22.233   4.0346   21.213   7.0428   17.035   9.6653   25.942   10.284   19.739   5.6937   24.297   5.3384 -4.558397 7.804901 
1 1 1    4    3  109 o   43.312   2.2552   77.275   7.9348   73.929   10.830   81.153   11.659   42.143   3.1759   44.139   3.2635 -1.996563 4.553771 
1 1 1    4    3  110 o   31.843   2.9823   42.298   7.6508   48.698   11.555   37.301   10.209   33.799   4.2905   29.489   4.3801 4.310234 6.131390 
1 1 1    4    3  111 o   37.709   2.6046   58.943   7.9567   68.605   11.961   51.275   10.656   40.376   3.6745   34.816   3.8175 5.560841 5.298562 
1 1 1    4    3  112 o   32.386   2.9254   43.808   7.6397   38.193   11.365   48.436   10.319   29.586   4.8827   33.796   3.8121 -4.209244 6.194566 
1 1 1    4    3  113 o   22.626   4.1302   22.220   7.3369   6.0546   10.872   35.740   9.9424   14.937   5.9484   28.747   4.3811 -13.81071 7.387688 
1 1 1    4    3  114 o   77.482   1.6291  246.155   10.289  262.083   14.181  228.447   14.952   79.732   2.1840   74.316   2.4717 5.415596 3.298339 
1 1 1    4    3  115 o   88.707   1.6678  322.829   12.060  337.711   17.504  309.384   16.638   90.394   2.3776   86.526   2.3612 3.868507 3.350889 
1 1 1    4    3  116 o   24.456   3.7786   25.763   7.2902   26.733   10.754   24.939   9.9168   24.264   5.5568   23.513   5.3011 0.7515430 7.679782 
1 1 1    4    3  117 o   69.376   1.8202  198.031   10.284  209.236   14.860  187.732   14.247   70.981   2.5726   67.214   2.6053 3.767265 3.661416 
1 1 1    4    3  118 o   51.133   2.1282  108.123   8.8509  115.849   13.030  101.504   12.061   52.535   3.0559   49.179   3.0231 3.355320 4.298542 
1 1 1    4    3  119 o   46.675   2.1329   90.231   8.0934   83.064   11.028   98.598   11.915   44.401   3.0658   48.407   3.0349 -4.005520 4.313910 
1 1 1    4    3  120 o   48.740   2.2152   98.624   8.7779   89.766   11.359  111.758   13.831   46.124   3.0381   51.316   3.3243 -5.192654 4.503403 
1 1 1    4    3  121 o   15.568   5.0430   10.754   7.3076   5.0487   9.5894   18.657   11.286   13.640   5.5325   19.823   6.2510 -6.182919 8.347619 
1 1 1    4    3  122 o   45.548   2.3343   86.624   8.6381   95.629   11.180   73.289   13.606   47.561   2.8976   40.849   4.1433 6.711662 5.056001 
1 1 1    4    3  123 o   19.490   4.5728   17.459   7.1388   17.573   9.6321   17.320   10.634   19.164   5.7268   18.990   6.0772 0.1743202 8.350387 
1 1 1    4    3  124 o   34.195   2.7430   49.604   7.5817   40.977   10.163   60.428   11.385   30.252   4.2373   37.112   3.8177 -6.859821 5.703506 
1 1 1    4    3  125 o   39.441   2.5070   65.649   8.0182   55.675   10.752   78.147   12.035   35.551   3.7675   42.366   3.5166 -6.814419 5.153698 
1 1 1    4    3  126 o   17.430   5.2511   14.620   8.0737   22.685   9.8582  -1.8084   14.070   21.461   5.5829   13.288   6.0220 8.173212 8.211805 
1 1 1    4    3  127 o   13.019   5.3516   4.9202   9.1206   10.222   9.8977 -24.9232   23.483   15.341   5.7926   13.446   6.5606 1.895861 8.751859 
1 1 1    4    3  128 o   12.612   5.2345   4.1973   8.8406   3.5359   9.6388   7.7014   22.187   12.725   5.3850   17.280   7.7184 -4.555192 9.411257 
1 1 1    4    3  129 o   14.533   5.5250   8.9559   9.0410   7.3957   9.7892   18.007   23.579   14.101   5.6349   19.284   8.2982 -5.183414 10.03059 
1 1 1    4    3  130 o   17.362   5.7558   15.057   9.4956   9.3601   12.063   24.337   15.397   15.332   6.2100   20.774   7.3174 -5.442212 9.597262 
1 1 1    4    3  131 o   27.604   4.5484   35.671   9.8785   42.355   12.446   24.291   16.240   29.396   5.3926   20.595   7.4844 8.801661 9.224791 
1 1 1    4    3  132 o   14.585   5.6181   9.1432   9.4302   2.2484   11.727   21.758   15.863   13.045   5.7291   19.672   7.3532 -6.627317 9.321602 
1 1 1    4    3  133 o   19.468   5.7073   19.508   9.6414   7.6602   11.983   41.254   16.235   14.632   6.0855   26.886   7.2454 -12.25372 9.461966 
1 1 1    4    3  134 o   14.521   5.6036   9.1858   9.3935   9.9221   11.626   7.8016   15.941   15.248   6.1247   15.567   6.7609 -0.3187246 9.122631 
1 1 1    4    3  135 o   29.221   4.3120   39.820   9.9626   41.053   12.570   37.737   16.338   28.496   5.6111   25.206   7.4404 3.290491 9.319048 
1 1 1    4    3  136 o   13.150   5.5892   4.7018   10.460   0.0485   13.838   10.903   15.975   13.162   5.9677   16.222   6.9015 -3.060164 9.123884 
1 1 1    4    3  137 o   11.339   5.1889  -2.6196   10.773   3.6720   15.224  -8.9298   15.247   14.381   6.4107   12.101   5.7413 2.280184 8.605775 
1 1 1    4    4    0 o  633.678   6.1251 16374.07  316.388 16582.30  553.898 16273.23  385.458  637.377   10.661  631.647   7.4863 5.729675 13.02694 
1 1 1    4    4    1 o  478.471   3.0892  9333.10  120.488  9145.19  180.980  9482.69  161.474  473.553   4.6884  482.244   4.1077 -8.691284 6.233346 
1 1 1    4    4    2 o  288.645   2.0106  3396.10   47.307  3417.34   72.606  3380.43   62.360  289.526   3.0764  287.967   2.6566 1.558807 4.064730 
1 1 1    4    4    3 o   57.206   1.3905  133.385   6.4842  132.545   9.2396  134.201   9.1022   56.989   1.9920   57.346   1.9500 -0.3568726 2.787596 
1 1 1    4    4    4 o  132.474   1.3934  715.303   15.047  710.911   21.299  719.679   21.261  132.063   1.9785  132.876   1.9629 -0.8121033 2.787020 
1 1 1    4    4    5 o  205.927   1.7146  1728.48   28.782  1750.32   41.112  1707.49   40.307  207.216   2.4339  204.665   2.4160 2.550797 3.429441 
1 1 1    4    4    6 o  825.858   5.5868 27820.14  376.102 28460.97  542.662 27227.79  521.731  834.975   7.9730  816.708   7.8369 18.26746 11.17968 
1 1 1    4    4    7 o  787.845   4.9413 25313.50  317.333 25941.06  495.130 24876.02  413.401  797.218   7.6191  780.835   6.4950 16.38269 10.01179 
1 1 1    4    4    8 f  220.633   1.7917  1984.18   32.223  2008.82   46.030  1960.50   45.124  221.990   2.5438  219.304   2.5242 2.685883 3.583622 
1 1 1    4    4    9 f  401.129   2.6419  6559.16   86.384  6334.80  128.471  6744.32  116.707  394.166   3.9984  406.725   3.5201 -12.55893 5.327168 
1 1 1    4    4   10 o  123.054   1.3720  617.185   13.762  619.369   24.116  616.130   16.759  123.266   2.4000  122.947   1.6723 0.3184814 2.925179 
1 1 1    4    4   11 o  550.811   3.5160 12369.04  157.868 12262.62  239.392 12450.93  210.001  548.333   5.3559  552.571   4.6623 -4.238525 7.100851 
1 1 1    4    4   12 o  811.107   5.0807 26829.76  335.919 26771.64  512.109 26873.65  445.043  809.912   7.7569  811.591   6.7271 -1.678894 10.26761 
1 1 1    4    4   13 o  228.572   1.7021  2129.52   31.714  2097.56   48.003  2154.27   42.248  226.841   2.5960  229.891   2.2545 -3.050232 3.438329 
1 1 1    4    4   14 o  310.375   2.1316  3926.64   53.929  3954.83   82.897  3905.94   71.009  311.467   3.2651  309.545   2.8142 1.922241 4.310506 
1 1 1    4    4   15 o  630.264   4.3129 16196.31  221.577 16315.12  315.318 16080.41  311.434  632.450   6.1163  627.887   6.0848 4.563354 8.627494 
1 1 1    4    4   16 o  564.504   4.2646 12992.55  196.238 12876.75  251.511 13172.73  313.738  561.917   5.4910  568.250   6.7732 -6.333740 8.719305 
1 1 1    4    4   17 o   23.858   2.8191   23.525   5.3766   33.756   8.9205   17.688   6.7381   28.504   3.9448   20.457   4.1820 8.047331 5.748996 
1 1 1    4    4   18 o  189.266   1.8042  1460.09   27.836  1446.98   44.037  1468.81   35.922  188.406   2.8674  189.827   2.3215 -1.420975 3.689331 
1 1 1    4    4   19 o  880.910   6.5187 31650.88  468.091 31722.23  741.883 31603.68  603.347  881.417   10.326  880.040   8.4106 1.377808 13.31758 
1 1 1    4    4   20 o  690.409   4.7039 19434.62  264.728 18981.70  366.948 19926.20  382.289  682.197   6.5987  698.955   6.7098 -16.75806 9.410826 
1 1 1    4    4   21 o  713.497   4.8516 20756.33  282.174 20833.24  400.450 20680.49  397.672  714.686   6.8738  712.062   6.8513 2.623291 9.705106 
1 1 1    4    4   22 o  576.128   3.9613 13531.51  186.035 13600.36  264.266 13463.88  261.935  577.524   5.6135  574.620   5.5921 2.904053 7.923594 
1 1 1    4    4   23 o  463.905   3.2462  8772.63  122.755  8732.78  172.969  8813.07  174.242  462.816   4.5849  464.938   4.5975 -2.122253 6.492913 
1 1 1    4    4   24 o  408.060   2.6865  6787.30   89.362  6708.94  117.244  6895.93  138.041  405.683   3.5454  411.285   4.1174 -5.602081 5.433536 
1 1 1    4    4   25 o  597.482   3.7971 14552.51  184.935 14496.94  243.986 14627.55  283.519  596.297   5.0196  598.944   5.8071 -2.646423 7.675827 
1 1 1    4    4   26 o  554.883   3.8264 12551.36  173.072 12556.89  244.954 12545.85  244.569  554.953   5.4149  554.709   5.4088 0.2437134 7.653524 
1 1 1    4    4   27 o  245.784   2.1357  2462.28   42.788  2570.16   70.268  2398.70   53.943  251.099   3.4330  242.586   2.7279 8.513351 4.384867 
1 1 1    4    4   28 o  662.054   4.9502 17869.95  267.148 17591.51  340.308 18317.11  431.251  656.811   6.3562  670.130   7.8947 -13.31879 10.13544 
1 1 1    4    4   29 f  216.360   2.1962  1908.03   38.733  1943.68   56.149  1875.67   53.500  218.365   3.1544  214.511   3.0596 3.853928 4.394500 
1 1 1    4    4   30 o  211.345   1.7629  1820.57   30.371  1784.30   36.937  1896.27   53.364  209.227   2.1658  215.686   3.0352 -6.459381 3.728678 
1 1 1    4    4   31 o  145.150   1.8085  858.736   21.398  872.287   31.157  846.638   29.439  146.288   2.6128  144.122   2.5059 2.166321 3.620265 
1 1 1    4    4   32 o  205.889   1.9219  1727.80   32.256  1734.06   42.281  1719.09   49.892  206.258   2.5147  205.363   2.9804 0.8950348 3.899566 
1 1 1    4    4   33 o  786.911   5.8482 25248.96  375.131 24753.02  476.193 26060.14  609.013  779.037   7.4987  799.186   9.3485 -20.14868 11.98440 
1 1 1    4    4   34 o  308.117   2.3137  3869.60   58.111  3777.76   81.263  3965.71   83.130  304.428   3.2747  311.909   3.2696 -7.480988 4.627536 
1 1 1    4    4   35 o  745.285   5.0682 22646.25  307.901 22674.41  436.211 22618.29  434.668  745.623   7.1770  744.701   7.1604 0.9222412 10.13808 
1 1 1    4    4   36 o  235.510   1.9190  2260.71   36.841  2241.69   52.422  2279.27   51.785  234.511   2.7423  236.469   2.6866 -1.958206 3.839003 
1 1 1    4    4   37 o  412.263   2.7245  6927.87   91.560  6902.19  121.007  6962.25  140.038  411.483   3.6076  413.258   4.1571 -1.774658 5.504200 
1 1 1    4    4   38 o  607.140   4.1804 15027.59  206.893 14966.69  252.486 15152.04  360.952  605.872   5.1123  609.498   7.2651 -3.626709 8.883548 
1 1 1    4    4   39 o  398.368   3.1451  6469.01  102.130  6454.27  131.369  6491.52  162.377  397.896   4.0503  399.018   4.9922 -1.122162 6.428632 
1 1 1    4    4   40 o  742.164   5.0574 22457.91  305.960 22323.75  430.026 22595.45  435.409  739.805   7.1308  744.290   7.1766 -4.484680 10.11695 
1 1 1    4    4   41 o  136.677   1.4737  761.393   16.418  730.637   22.246  798.192   24.333  133.886   2.0383  139.938   2.1331 -6.052292 2.950428 
1 1 1    4    4   42 o  566.173   3.9272 13068.05  181.248 12973.41  220.547 13264.93  318.112  564.085   4.7965  570.280   6.8432 -6.194519 8.356722 
1 1 1    4    4   43 o  278.504   2.1986  3161.57   49.914  3092.58   60.145  3314.24   89.466  275.443   2.6787  285.125   3.8493 -9.682068 4.689672 
1 1 1    4    4   44 o  429.544   3.3665  7521.54  117.876  7497.68  151.760  7557.83  187.153  428.834   4.3414  430.515   5.3330 -1.681061 6.876699 
1 1 1    4    4   45 o  305.502   2.3338  3804.32   58.118  3706.63   69.723  4026.73  105.203  301.547   2.8365  314.273   4.1066 -12.72583 4.991007 
1 1 1    4    4   46 o  101.681   1.5704  421.414   13.017  405.370   15.681  456.961   23.342   99.726   1.9291  105.843   2.7076 -6.117653 3.324512 
1 1 1    4    4   47 o  105.699   1.6921  455.383   14.579  467.556   16.452  410.862   31.462  107.102   1.8845  100.313   3.8548 6.788704 4.290785 
1 1 1    4    4   48 o  121.057   1.9135  597.338   18.883  612.425   22.154  557.266   36.105  122.575   2.2173  116.851   3.7956 5.723923 4.395747 
1 1 1    4    4   49 o  364.736   2.9177  5423.14   86.746  5473.76   97.681  5234.27  188.683  366.424   3.2703  358.187   6.4623 8.237823 7.242692 
1 1 1    4    4   50 o  289.705   2.7272  3421.39   64.404  3421.39   64.404   0.0000   0.0000  289.705   2.7272  ?   ?  0.000000 2.727216 
1 1 1    4    4   51 o  240.605   1.9705  2359.73   38.647  2391.92   47.629  2297.70   66.121  242.233   2.4122  237.395   3.4169 4.838577 4.182563 
1 1 1    4    4   52 o  205.940   2.1887  1728.83   36.742  1723.69   42.227  1744.83   74.547  205.629   2.5192  206.843   4.4213 -1.214142 5.088678 
1 1 1    4    4   53 o  533.008   3.7138 11584.52  161.357 11531.44  196.803 11693.39  281.838  531.724   4.5406  535.252   6.4596 -3.528259 7.895758 
1 1 1    4    4   54 o  389.295   2.8176  6178.62   89.412  6042.26  124.158  6325.53  128.870  384.920   3.9570  393.836   4.0142 -8.916229 5.636649 
1 1 1    4    4   55 o  262.771   2.0901  2814.74   44.770  2808.03   63.120  2821.53   63.511  262.435   2.9506  263.064   2.9618 -0.6295166 4.180692 
1 1 1    4    4   56 o  442.054   3.1407  7967.96  113.172  7930.99  159.473  8005.46  160.632  440.931   4.4369  442.995   4.4483 -2.064301 6.282815 
1 1 1    4    4   57 o   90.067   1.5816  330.667   11.612  353.809   16.520  308.066   16.325   93.160   2.1754   86.898   2.3067 6.262428 3.170668 
1 1 1    4    4   58 o   42.426   2.2042   73.577   7.5965   76.981   10.284   69.489   11.270   43.351   2.9272   41.139   3.3909 2.212242 4.479603 
1 1 1    4    4   59 o  505.463   3.5403 10420.81  145.868 10369.87  177.870 10525.41  254.904  504.136   4.3283  507.619   6.1603 -3.483734 7.528855 
1 1 1    4    4   60 o  345.183   2.7959  4858.71   78.670  4908.98  102.126  4785.34  123.376  346.906   3.6115  342.439   4.4199 4.467255 5.707753 
1 1 1    4    4   61 o   69.811   1.8173  198.813   10.333  207.686   13.136  184.413   16.734   71.335   2.2618   67.174   3.0642 4.161713 3.808572 
1 1 1    4    4   62 o  168.900   1.8042  1162.98   24.840  1182.75   32.088  1133.40   39.240  170.316   2.3112  166.706   2.8876 3.610275 3.698680 
1 1 1    4    4   63 o  341.383   2.7758  4752.95   77.244  4823.68  100.609  4651.38  120.558  343.841   3.5896  337.557   4.3814 6.283630 5.664052 
1 1 1    4    4   64 o  285.138   2.2218  3315.14   51.642  3281.30   62.740  3386.24   90.939  283.648   2.7135  288.052   3.8729 -4.404175 4.728929 
1 1 1    4    4   65 o  102.004   1.5343  424.164   12.757  417.838   15.391  438.048   22.802  101.235   1.8651  103.601   2.7024 -2.365891 3.283538 
1 1 1    4    4   66 o  240.458   1.9784  2357.49   38.779  2363.94   47.451  2344.51   67.288  240.764   2.4178  239.702   3.4438 1.061813 4.207753 
1 1 1    4    4   67 o   78.104   1.6309  248.697   10.383  250.332   12.496  245.053   18.661   78.356   1.9565   77.449   2.9613 0.9064713 3.549222 
1 1 1    4    4   68 o   69.263   1.6612  195.587   9.3791  190.064   12.889  201.803   13.673   68.230   2.3209   70.304   2.3894 -2.074463 3.331029 
1 1 1    4    4   69 o  338.335   2.5144  4668.73   69.345  4676.34   97.961  4661.07   98.177  338.495   3.5503  337.940   3.5640 0.5548096 5.030557 
1 1 1    4    4   70 o  229.873   1.9164  2154.59   35.910  2132.49   50.280  2177.59   51.303  228.645   2.6977  231.048   2.7240 -2.403229 3.833776 
1 1 1    4    4   71 o  196.964   1.6411  1581.67   26.348  1540.06   34.372  1640.97   41.029  194.332   2.1698  200.579   2.5094 -6.247009 3.317382 
1 1 1    4    4   72 o  128.663   1.4427  674.878   15.131  645.423   19.772  716.512   23.507  125.812   1.9280  132.551   2.1756 -6.739441 2.906951 
1 1 1    4    4   73 o  201.316   1.7989  1652.48   29.521  1618.85   41.555  1686.75   41.945  199.215   2.5590  203.352   2.5305 -4.136627 3.598835 
1 1 1    4    4   74 f   77.053   1.6582  242.072   10.415  238.995   14.924  244.993   14.542   76.510   2.3958   77.470   2.3054 -0.9598312 3.324869 
1 1 1    4    4   75 o   87.240   1.6040  310.304   11.406  338.915   16.708  285.331   15.610   91.158   2.2485   83.609   2.2926 7.548538 3.211157 
1 1 1    4    4   76 o   74.663   1.7034  227.300   10.367  215.712   14.678  238.836   14.646   72.677   2.4813   76.485   2.3519 -3.808037 3.418772 
1 1 1    4    4   77 o  135.391   1.7445  747.446   19.253  748.184   25.157  746.403   29.913  135.437   2.2787  135.254   2.7131 0.1826172 3.543082 
1 1 1    4    4   78 o  100.089   1.7765  408.499   14.494  411.602   19.037  404.218   22.358  100.452   2.3249   99.492   2.7595 0.9599915 3.608261 
1 1 1    4    4   79 o  113.380   1.7824  524.203   16.473  514.200   18.152  570.888   39.215  112.286   1.9832  118.124   4.0788 -5.837692 4.535398 
1 1 1    4    4   80 f   65.643   1.8452  175.865   9.8639  189.709   12.955  156.770   15.215   68.153   2.3354   61.898   3.0247 6.255123 3.821356 
1 1 1    4    4   81 o   43.634   2.8164   78.030   9.9638   93.915   13.620   59.738   14.615   47.823   3.5184   37.904   4.8404 9.918701 5.984066 
1 1 1    4    4   82 o  127.425   1.5557  662.070   16.159  675.307   21.506  644.906   24.489  128.672   2.0504  125.726   2.3895 2.946541 3.148669 
1 1 1    4    4   83 o   52.558   2.1284  112.866   9.0998  101.367   11.902  129.049   14.119   49.742   2.9485   56.133   3.0976 -6.390911 4.276539 
1 1 1    4    4   84 o  100.003   1.5587  407.805   12.706  432.636   16.866  375.221   19.321  102.986   2.0091   95.856   2.4748 7.129250 3.187642 
1 1 1    4    4   85 o  232.749   1.8319  2209.57   34.756  2198.88   45.828  2224.03   53.323  232.121   2.4220  233.393   2.8028 -1.272064 3.704328 
1 1 1    4    4   86 o  239.184   2.0098  2333.96   39.185  2297.32   47.593  2411.08   69.043  237.241   2.4610  242.864   3.4876 -5.623520 4.268446 
1 1 1    4    4   87 o  160.127   1.6950  1045.81   22.124  1069.94   27.380  1000.42   37.554  161.934   2.0743  156.497   2.9438 5.436432 3.601233 
1 1 1    4    4   88 o   84.093   1.9371  288.520   13.279  281.063   17.095  299.863   21.084   82.931   2.5318   85.614   3.0260 -2.683197 3.945435 
1 1 1    4    4   89 o   45.209   2.5300   83.720   9.2862   89.990   11.270   70.464   16.388   46.835   2.9674   41.134   4.9892 5.700413 5.804983 
1 1 1    4    4   90 o  145.244   1.6856  860.597   19.957  841.710   28.036  879.998   28.415  143.575   2.3955  146.807   2.3745 -3.231583 3.372950 
1 1 1    4    4   91 o   42.441   2.4537   73.809   8.4527   81.016   11.098   63.851   13.045   44.406   3.0851   39.253   4.1391 5.153934 5.162339 
1 1 1    4    4   92 o   95.885   1.5775  375.060   12.330  385.669   16.475  361.553   18.589   97.200   2.0793   94.054   2.4266 3.145653 3.195648 
1 1 1    4    4   93 o   26.825   3.6743   30.022   7.8233   26.746   10.352   34.384   11.945   25.026   5.2429   28.437   5.3495 -3.411015 7.490362 
1 1 1    4    4   94 o   12.255   4.9142   2.9535   7.4719   7.0961   9.8111  -2.7669   11.529   15.300   5.7694   12.953   5.6849 2.347099 8.099589 
1 1 1    4    4   95 o   64.605   1.8881  170.538   9.9325  154.604   12.991  192.956   15.409   61.440   2.5999   68.631   2.7601 -7.191326 3.791736 
1 1 1    4    4   96 o  137.905   1.5853  776.085   17.821  744.509   23.322  820.392   27.627  135.003   2.1193  141.673   2.3922 -6.669586 3.195961 
1 1 1    4    4   97 o  113.869   1.9110  529.531   17.738  516.636   27.962  538.214   22.946  112.257   3.0586  114.724   2.4536 -2.467110 3.921128 
1 1 1    4    4   98 o   17.564   5.6180   12.565   9.0883   3.3352   13.093   21.148   12.625   15.522   6.3995   22.277   6.5312 -6.754718 9.143821 
1 1 1    4    4   99 o  189.442   1.8401  1466.02   28.415  1465.04   40.532  1466.97   39.847  189.157   2.6287  189.297   2.5823 -0.1398468 3.684888 
1 1 1    4    4  100 o   24.107   4.1153   24.625   7.7967   25.597   10.391   23.372   11.794   24.346   5.3793   23.214   6.1396 1.132263 8.162801 
1 1 1    4    4  101 o   44.429   2.5093   81.120   9.0510   89.087   13.109   73.861   12.512   46.395   3.4918   42.184   3.6754 4.210979 5.069630 
1 1 1    4    4  102 o   93.852   1.5777  359.807   12.070  364.650   16.160  353.696   18.153   94.400   2.1001   92.885   2.3996 1.515320 3.188762 
1 1 1    4    4  103 o   38.715   2.5528   61.749   8.0115   58.620   10.749   65.659   12.016   37.527   3.5564   39.688   3.7591 -2.161160 5.174823 
1 1 1    4    4  104 o   51.630   2.0713  109.334   8.6996  105.860   11.551  113.889   13.225   50.667   2.8077   52.492   3.1046 -1.825497 4.185874 
1 1 1    4    4  105 o   71.374   1.8658  208.648   10.846  208.826   15.532  208.477   15.152   71.220   2.6802   71.177   2.6160 0.4272461E-01 3.745255 
1 1 1    4    4  106 o   73.807   1.9738  223.348   11.864  243.751   18.705  209.612   15.347   76.816   2.9929   71.332   2.6439 5.484322 3.993467 
1 1 1    4    4  107 o   17.505   5.2137   13.207   7.9937   23.816   12.885   6.5689   10.192   23.105   6.5449   14.995   5.8232 8.110583 8.760417 
1 1 1    4    4  108 o   29.943   3.5885   37.799   8.5846   37.964   11.102   37.554   13.538   29.653   4.7537   29.085   5.9118 0.5684891 7.585932 
1 1 1    4    4  109 o   50.972   2.1417  106.918   8.8788  109.933   12.846  104.161   12.286   51.427   3.0785   50.071   3.0242 1.355812 4.315437 
1 1 1    4    4  110 o   45.828   2.1658   86.537   8.0679   88.190   11.218   84.766   11.612   46.035   3.0059   45.073   3.1808 0.9619522 4.376363 
1 1 1    4    4  111 o   12.705   4.8035   5.2424   6.8115   2.0699   9.5739   8.4946   9.6932   12.912   5.4098   15.450   5.7533 -2.537407 7.897274 
1 1 1    4    4  112 f   15.028   5.0438   9.2981   7.2876   6.8866   11.075   11.140   9.6781   15.315   6.0340   16.598   5.8049 -1.282689 8.372945 
1 1 1    4    4  113 o   23.377   3.8223   23.550   7.0320   31.010   9.9252   16.031   9.9645   26.558   4.7596   18.986   5.8565 7.571842 7.546642 
1 1 1    4    4  114 o   85.584   1.6003  300.366   11.164  309.347   15.374  290.347   16.238   86.602   2.1796   83.803   2.3795 2.798828 3.226856 
1 1 1    4    4  115 o   27.600   3.2666   32.292   7.2071   26.723   10.047   38.194   10.344   24.376   5.2143   29.612   4.4203 -5.235867 6.835762 
1 1 1    4    4  116 o   31.678   3.0193   42.260   7.7023   46.298   10.111   36.676   11.890   32.853   3.8483   28.561   5.3020 4.291933 6.551387 
1 1 1    4    4  117 o   61.111   1.9458  154.040   9.6804  148.997   12.523  161.525   15.258   59.835   2.5737   62.062   3.0252 -2.227100 3.971857 
1 1 1    4    4  118 f   24.308   3.9800   25.840   7.6135   31.868   10.306   18.597   11.296   26.617   4.9316   19.992   6.2468 6.624695 7.958903 
1 1 1    4    4  119 o   47.865   2.2913   95.269   8.9140   93.809   11.868   97.158   13.502   47.106   3.1081   47.719   3.4955 -0.6128883 4.677444 
1 1 1    4    4  120 o   11.515   4.7033   2.9817   6.9885   19.106   10.248 -11.0355   9.5550   20.069   5.8843   9.3493   4.4663 10.71945 7.387331 
1 1 1    4    4  121 o   50.516   2.3400  106.539   9.6092  107.444   12.250  105.091   15.494   50.350   2.9982   49.152   3.8990 1.197853 4.918490 
1 1 1    4    4  122 o   22.956   4.4715   23.966   8.0665   27.849   10.310   17.835   12.953   24.292   5.3512   19.237   6.7165 5.055136 8.587583 
1 1 1    4    4  123 o   46.789   2.8045   92.827   10.647   90.013   11.643  107.204   26.320   45.853   3.1337   45.677   7.3157 0.1763725 7.958624 
1 1 1    4    4  124 o   20.121   5.0975   19.338   8.3688   19.005   10.251   20.004   14.492   19.582   5.9206   19.781   7.0858 -0.1990623 9.233763 
1 1 1    4    4  125 o   14.708   5.3906   9.3782   8.4505   2.4158   10.120   25.415   15.359   12.644   5.4385   21.597   7.3223 -8.953933 9.121050 
1 1 1    4    4  126 o   9.5258   4.4175  -4.9053   8.1836   1.0993   9.8410 -18.3664   14.735   12.081   5.2783   10.852   5.2730 1.228419 7.460867 
1 1 1    4    4  127 o   18.236   5.3303   16.315   8.4204   17.539   10.050   13.429   15.425   18.658   5.9008   17.354   7.0248 1.304125 9.174253 
1 1 1    4    4  128 o   11.544   4.9568   1.8851   8.3789   0.5964   10.055   4.8137   15.158   11.975   5.2803   14.946   6.5400 -2.970660 8.405537 
1 1 1    4    4  129 o   8.6051   4.1271  -9.4744   8.3362  -7.2509   9.9207 -14.8159   15.376   10.018   4.7161   11.486   5.5334 -1.467835 7.270463 
1 1 1    4    4  130 o   20.695   5.6491   21.765   9.7947   27.251   12.354   12.479   16.072   22.575   6.4133   16.943   7.0473 5.631502 9.528588 
1 1 1    4    4  131 o   15.086   5.7580   10.185   9.8441   18.050   12.475  -2.7942   16.026   18.454   6.5783   13.515   6.2371 4.939860 9.065034 
1 1 1    4    4  132 o   10.152   4.7177  -4.9363   9.4078 -15.1744   11.903   12.104   15.356   9.7414   4.7346   16.592   6.8938 -6.850663 8.363066 
1 1 1    4    4  133 o   16.056   5.7329   12.688   9.4786   30.211   12.152 -14.5341   15.146   23.822   6.1993   11.310   5.4595 12.51194 8.260620 
1 1 1    4    4  134 o   23.534   5.8507   28.871   11.176   22.264   15.568   35.896   16.053   19.582   7.2913   24.564   7.4053 -4.982128 10.39240 
1 1 1    4    4  135 o   10.980   5.0768  -3.9897   10.688   2.1252   14.746 -10.7576   15.513   13.883   6.2397   11.916   5.6922 1.966543 8.445982 
1 1 1    4    4  136 o   16.392   6.1507   13.411   11.121   6.9942   15.310   20.579   16.181   15.138   6.5995   18.967   7.3450 -3.828903 9.874357 
1 1 1    5    0 -138 o   37.136   5.7354   65.679   16.130   65.679   16.130   65.679   16.130   37.136   5.7354   37.136   5.7354 0.000000 0.000000 
1 1 1    5    0 -137 o   9.4864   6.1932   1.5336   11.724   1.5336   11.724   1.5336   11.724   9.4864   6.1932   9.4864   6.1932 0.000000 0.000000 
1 1 1    5    0 -136 o   11.675   6.9684   8.7223   11.716   8.7223   11.716   8.7223   11.716   11.675   6.9684   11.675   6.9684 0.000000 0.000000 
1 1 1    5    0 -135 o   11.871   7.0333   9.1579   11.774   9.1579   11.774   9.1579   11.774   11.871   7.0333   11.871   7.0333 -0.000000 0.000000 
1 1 1    5    0 -134 o   12.413   7.1738   10.519   11.751   10.519   11.751   10.519   11.751   12.413   7.1738   12.413   7.1738 0.000000 0.000000 
1 1 1    5    0 -133 o   11.163   6.5792   7.7804   10.206   7.7804   10.206   7.7804   10.206   11.163   6.5792   11.163   6.5792 0.000000 0.000000 
1 1 1    5    0 -132 o   58.445   3.1646  144.755   14.975  144.755   14.975  144.755   14.975   58.445   3.1646   58.445   3.1646 -0.000000 0.000000 
1 1 1    5    0 -131 o   7.8589   5.4012  -5.7243   11.271  -5.7243   11.271  -5.7243   11.271   7.8589   5.4012   7.8589   5.4012 0.000000 0.000000 
1 1 1    5    0 -130 o   28.734   5.8964   40.303   12.205   40.303   12.205   40.303   12.205   28.734   5.8964   28.734   5.8964 -0.000000 0.000000 
1 1 1    5    0 -129 o   12.573   7.0831   10.660   11.051   10.660   11.051   10.660   11.051   12.573   7.0831   12.573   7.0831 -0.000000 0.000000 
1 1 1    5    0 -128 o   11.126   6.3874   7.7892   9.2234   7.7892   9.2234   7.7892   9.2234   11.126   6.3874   11.126   6.3874 -0.000000 0.000000 
1 1 1    5    0 -127 o   13.764   6.8227   12.746   9.2251   12.746   9.2251   12.746   9.2251   13.764   6.8227   13.764   6.8227 0.000000 0.000000 
1 1 1    5    0 -126 o   7.8643   5.3529  -4.4289   10.496  -4.4289   10.496  -4.4289   10.496   7.8643   5.3529   7.8643   5.3529 -0.000000 0.000000 
1 1 1    5    0 -125 o   14.043   7.3159   13.344   10.914   13.344   10.914   13.344   10.914   14.043   7.3159   14.043   7.3159 0.000000 0.000000 
1 1 1    5    0 -124 o   45.941   3.4713   89.626   12.825   89.626   12.825   89.626   12.825   45.941   3.4713   45.941   3.4713 -0.000000 0.000000 
1 1 1    5    0 -123 o   14.043   6.9808   12.954   9.6700   12.954   9.6700   12.954   9.6700   14.043   6.9808   14.043   6.9808 0.000000 0.000000 
1 1 1    5    0 -122 o   10.330   5.8243   6.3637   7.4795   6.3637   7.4795   6.3637   7.4795   10.330   5.8243   10.330   5.8243 0.000000 0.000000 
1 1 1    5    0 -121 o   9.6989   5.6401   5.1467   7.3342   5.1467   7.3342   5.1467   7.3342   9.6989   5.6401   9.6989   5.6401 0.000000 0.000000 
1 1 1    5    0 -120 o   10.819   5.8357   7.2357   7.1475   7.2357   7.1475   7.2357   7.1475   10.819   5.8357   10.819   5.8357 -0.000000 0.000000 
1 1 1    5    0 -119 o   5.7852   4.0351  -6.2786   6.9053  -6.2786   6.9053  -6.2786   6.9053   5.7852   4.0351   5.7852   4.0351 0.000000 0.000000 
1 1 1    5    0 -118 o   57.852   2.1141  137.745   9.9395  137.745   9.9395  137.745   9.9395   57.852   2.1141   57.852   2.1141 0.000000 0.000000 
1 1 1    5    0 -117 o   19.571   5.3920   19.176   7.4377   19.176   7.4377   19.176   7.4377   19.571   5.3920   19.571   5.3920 -0.000000 0.000000 
1 1 1    5    0 -116 f   12.534   6.0810   9.7926   7.2672   9.7926   7.2672   9.7926   7.2672   12.534   6.0810   12.534   6.0810 0.000000 0.000000 
1 1 1    5    0 -115 o   29.422   3.3934   37.087   7.8576   37.087   7.8576   37.087   7.8576   29.422   3.3934   29.422   3.3934 0.000000 0.000000 
1 1 1    5    0 -114 o   31.723   3.1499   42.618   7.9475   42.618   7.9475   42.618   7.9475   31.723   3.1499   31.723   3.1499 -0.000000 0.000000 
1 1 1    5    0 -113 o   41.947   2.5110   72.912   8.5148   72.912   8.5148   72.912   8.5148   41.947   2.5110   41.947   2.5110 0.000000 0.000000 
1 1 1    5    0 -112 o   9.5352   5.9751   2.4249   9.6123   2.4249   9.6123   2.4249   9.6123   9.5352   5.9751   9.5352   5.9751 -0.000000 0.000000 
1 1 1    5    0 -111 o   46.982   2.9559   91.664   11.216   91.664   11.216   91.664   11.216   46.982   2.9559   46.982   2.9559 0.000000 0.000000 
1 1 1    5    0 -110 o   98.731   2.4226  399.781   19.471  399.781   19.471  399.781   19.471   98.731   2.4226   98.731   2.4226 0.000000 0.000000 
1 1 1    5    0 -109 o   9.9564   6.2696   2.2676   10.724   2.2676   10.724   2.2676   10.724   9.9564   6.2696   9.9564   6.2696 -0.000000 0.000000 
1 1 1    5    0 -108 o   98.563   3.0379  399.345   24.355  399.345   24.355  399.345   24.355   98.563   3.0379   98.563   3.0379 -0.000000 0.000000 
1 1 1    5    0 -107 o   93.493   3.0951  359.362   23.529  359.362   23.529  359.362   23.529   93.493   3.0951   93.493   3.0951 0.000000 0.000000 
1 1 1    5    0 -106 o   20.605   7.6184   23.618   11.859   23.618   11.859   23.618   11.859   20.605   7.6184   20.605   7.6184 0.000000 0.000000 
1 1 1    5    0 -105 f   16.887   7.1771   16.773   10.026   16.773   10.026   16.773   10.026   16.887   7.1771   16.887   7.1771 -0.000000 0.000000 
1 1 1    5    0 -104 o   24.719   3.9286   26.853   7.3181   26.853   7.3181   26.853   7.3181   24.719   3.9286   24.719   3.9286 -0.000000 0.000000 
1 1 1    5    0 -103 o   5.5977   3.9188  -6.8436   6.6838  -6.8436   6.6838  -6.8436   6.6838   5.5977   3.9188   5.5977   3.9188 -0.000000 0.000000 
1 1 1    5    0 -102 o   9.3672   5.5445   4.0441   7.3042   4.0441   7.3042   4.0441   7.3042   9.3672   5.5445   9.3672   5.5445 0.000000 0.000000 
1 1 1    5    0 -101 o   50.253   2.6370  103.993   10.734  103.993   10.734  103.993   10.734   50.253   2.6370   50.253   2.6370 -0.000000 0.000000 
1 1 1    5    0 -100 o   38.685   3.0968   62.316   9.6171   62.316   9.6171   62.316   9.6171   38.685   3.0968   38.685   3.0968 0.000000 0.000000 
1 1 1    5    0  -99 o   10.689   6.0273   6.2449   8.0115   6.2449   8.0115   6.2449   8.0115   10.689   6.0273   10.689   6.0273 -0.000000 0.000000 
1 1 1    5    0  -98 o   70.407   1.9908  202.708   11.405  202.708   11.405  202.708   11.405   70.407   1.9908   70.407   1.9908 0.000000 0.000000 
1 1 1    5    0  -97 o   45.814   2.6913   86.557   9.9706   86.557   9.9706   86.557   9.9706   45.814   2.6913   45.814   2.6913 -0.000000 0.000000 
1 1 1    5    0  -96 o  156.026   1.8350  993.257   23.331  993.257   23.331  993.257   23.331  156.026   1.8350  156.026   1.8350 0.000000 0.000000 
1 1 1    5    0  -95 o  121.368   1.7709  601.084   17.512  601.084   17.512  601.084   17.512  121.368   1.7709  121.368   1.7709 -0.000000 0.000000 
1 1 1    5    0  -94 o  126.496   1.7606  652.890   18.146  652.890   18.146  652.890   18.146  126.496   1.7606  126.496   1.7606 0.000000 0.000000 
1 1 1    5    0  -93 o   26.117   4.0728   29.814   8.0422   29.814   8.0422   29.814   8.0422   26.117   4.0728   26.117   4.0728 0.000000 0.000000 
1 1 1    5    0  -92 o   18.582   5.7356   17.614   7.6017   17.614   7.6017   17.614   7.6017   18.582   5.7356   18.582   5.7356 0.000000 0.000000 
1 1 1    5    0  -91 o   32.955   3.0867   45.473   8.1152   45.473   8.1152   45.473   8.1152   32.955   3.0867   32.955   3.0867 -0.000000 0.000000 
1 1 1    5    0  -90 o  183.508   1.9070  1373.58   28.519  1373.58   28.519  1373.58   28.519  183.508   1.9070  183.508   1.9070 0.000000 0.000000 
1 1 1    5    0  -89 o   50.198   2.4065  103.477   9.7951  103.477   9.7951  103.477   9.7951   50.198   2.4065   50.198   2.4065 -0.000000 0.000000 
1 1 1    5    0  -88 o   86.674   1.9175  306.760   13.532  306.760   13.532  306.760   13.532   86.674   1.9175   86.674   1.9175 0.000000 0.000000 
1 1 1    5    0  -87 o  194.516   2.9848  1544.58   47.302  1544.58   47.302  1544.58   47.302  194.516   2.9848  194.516   2.9848 0.000000 0.000000 
1 1 1    5    0  -86 o   94.277   2.2179  363.023   17.023  363.023   17.023  363.023   17.023   94.277   2.2179   94.277   2.2179 0.000000 0.000000 
1 1 1    5    0  -85 o   96.933   2.0701  383.621   16.340  383.621   16.340  383.621   16.340   96.933   2.0701   96.933   2.0701 -0.000000 0.000000 
1 1 1    5    0  -84 o  106.939   2.0217  466.766   17.609  466.766   17.609  466.766   17.609  106.939   2.0217  106.939   2.0217 -0.000000 0.000000 
1 1 1    5    0  -83 o   51.661   2.4919  109.587   10.438  109.587   10.438  109.587   10.438   51.661   2.4919   51.661   2.4919 -0.000000 0.000000 
1 1 1    5    0  -82 o   20.665   4.9933   20.192   7.2912   20.192   7.2912   20.192   7.2912   20.665   4.9933   20.665   4.9933 0.000000 0.000000 
1 1 1    5    0  -81 o   37.502   2.5760   58.156   7.7880   58.156   7.7880   58.156   7.7880   37.502   2.5760   37.502   2.5760 0.000000 0.000000 
1 1 1    5    0  -80 o   74.153   1.7512  224.533   10.572  224.533   10.572  224.533   10.572   74.153   1.7512   74.153   1.7512 0.000000 0.000000 
1 1 1    5    0  -79 o   26.948   4.5825   32.079   9.1926   32.079   9.1926   32.079   9.1926   26.948   4.5825   26.948   4.5825 -0.000000 0.000000 
1 1 1    5    0  -78 o  142.483   1.7009  827.941   19.749  827.941   19.749  827.941   19.749  142.483   1.7009  142.483   1.7009 -0.000000 0.000000 
1 1 1    5    0  -77 o  299.967   2.5073  3669.57   61.299  3669.57   61.299  3669.57   61.299  299.967   2.5073  299.967   2.5073 -0.000000 0.000000 
1 1 1    5    0  -76 o  115.151   1.6284  540.845   15.278  540.845   15.278  540.845   15.278  115.151   1.6284  115.151   1.6284 -0.000000 0.000000 
1 1 1    5    0  -75 o  112.924   1.6216  520.136   14.920  520.136   14.920  520.136   14.920  112.924   1.6216  112.924   1.6216 0.000000 0.000000 
1 1 1    5    0  -74 o  276.893   2.3617  3126.53   53.297  3126.53   53.297  3126.53   53.297  276.893   2.3617  276.893   2.3617 0.000000 0.000000 
1 1 1    5    0  -73 o  120.475   1.6170  591.960   15.873  591.960   15.873  591.960   15.873  120.475   1.6170  120.475   1.6170 0.000000 0.000000 
1 1 1    5    0  -72 o   44.527   2.0975   81.363   7.5745   81.363   7.5745   81.363   7.5745   44.527   2.0975   44.527   2.0975 -0.000000 0.000000 
1 1 1    5    0  -71 o  271.862   2.3252  3013.81   51.519  3013.81   51.519  3013.81   51.519  271.862   2.3252  271.862   2.3252 0.000000 0.000000 
1 1 1    5    0  -70 o   68.009   1.7077  188.893   9.4534  188.893   9.4534  188.893   9.4534   68.009   1.7077   68.009   1.7077 -0.000000 0.000000 
1 1 1    5    0  -69 o  290.510   2.4386  3441.41   57.740  3441.41   57.740  3441.41   57.740  290.510   2.4386  290.510   2.4386 0.000000 0.000000 
1 1 1    5    0  -68 o   80.780   1.7793  266.380   11.703  266.380   11.703  266.380   11.703   80.780   1.7793   80.780   1.7793 -0.000000 0.000000 
1 1 1    5    0  -67 o   95.363   1.7435  371.064   13.542  371.064   13.542  371.064   13.542   95.363   1.7435   95.363   1.7435 0.000000 0.000000 
1 1 1    5    0  -66 f   27.022   3.2207   31.017   6.8285   31.017   6.8285   31.017   6.8285   27.022   3.2207   27.022   3.2207 0.000000 0.000000 
1 1 1    5    0  -65 o  248.385   2.4198  2515.73   48.983  2515.73   48.983  2515.73   48.983  248.385   2.4198  248.385   2.4198 -0.000000 0.000000 
1 1 1    5    0  -64 o   63.410   1.7152  164.255   8.8512  164.255   8.8512  164.255   8.8512   63.410   1.7152   63.410   1.7152 -0.000000 0.000000 
1 1 1    5    0  -63 o  325.918   2.6526  4331.03   70.461  4331.03   70.461  4331.03   70.461  325.918   2.6526  325.918   2.6526 -0.000000 0.000000 
1 1 1    5    0  -62 f  129.405   1.8171  682.967   19.159  682.967   19.159  682.967   19.159  129.405   1.8171  129.405   1.8171 -0.000000 0.000000 
1 1 1    5    0  -61 f  446.382   3.8658  8125.75  140.640  8125.75  140.640  8125.75  140.640  446.382   3.8658  446.382   3.8658 -0.000000 0.000000 
1 1 1    5    0  -60 o  305.375   2.8165  3802.37   70.096  3802.37   70.096  3802.37   70.096  305.375   2.8165  305.375   2.8165 -0.000000 0.000000 
1 1 1    5    0  -59 o  131.667   1.8110  707.018   19.429  707.018   19.429  707.018   19.429  131.667   1.8110  131.667   1.8110 0.000000 0.000000 
1 1 1    5    0  -58 o  189.315   2.0716  1461.38   31.960  1461.38   31.960  1461.38   31.960  189.315   2.0716  189.315   2.0716 -0.000000 0.000000 
1 1 1    5    0  -57 o  904.657   6.6949 33384.44  493.644 33384.44  493.644 33384.44  493.644  904.657   6.6949  904.657   6.6949 0.000000 0.000000 
1 1 1    5    0  -56 o  403.927   3.1656  6652.01  104.215  6652.01  104.215  6652.01  104.215  403.927   3.1656  403.927   3.1656 0.000000 0.000000 
1 1 1    5    0  -55 o  368.966   2.9305  5550.20   88.127  5550.20   88.127  5550.20   88.127  368.966   2.9305  368.966   2.9305 -0.000000 0.000000 
1 1 1    5    0  -54 o   51.611   1.9248  109.022   8.0723  109.022   8.0723  109.022   8.0723   51.611   1.9248   51.611   1.9248 0.000000 0.000000 
1 1 1    5    0  -53 o   20.333   4.4367   19.068   6.4414   19.068   6.4414   19.068   6.4414   20.333   4.4367   20.333   4.4367 -0.000000 0.000000 
1 1 1    5    0  -52 o  788.534   5.8614 25355.00  376.706 25355.00  376.706 25355.00  376.706  788.534   5.8614  788.534   5.8614 -0.000000 0.000000 
1 1 1    5    0  -51 o   25.962   3.4180   28.870   6.8854   28.870   6.8854   28.870   6.8854   25.962   3.4180   25.962   3.4180 0.000000 0.000000 
1 1 1    5    0  -50 o  376.987   2.9954  5793.95   92.037  5793.95   92.037  5793.95   92.037  376.987   2.9954  376.987   2.9954 0.000000 0.000000 
1 1 1    5    0  -49 o   43.664   2.4631   78.450   8.7027   78.450   8.7027   78.450   8.7027   43.664   2.4631   43.664   2.4631 0.000000 0.000000 
1 1 1    5    0  -48 o   67.750   2.0207  187.586   11.137  187.586   11.137  187.586   11.137   67.750   2.0207   67.750   2.0207 -0.000000 0.000000 
1 1 1    5    0  -47 o  600.533   4.5316 14703.49  221.805 14703.49  221.805 14703.49  221.805  600.533   4.5316  600.533   4.5316 -0.000000 0.000000 
1 1 1    5    0  -46 o  921.906   7.6252 34661.72  572.934 34661.72  572.934 34661.72  572.934  921.906   7.6252  921.906   7.6252 -0.000000 0.000000 
1 1 1    5    0  -45 o  1022.72   8.4344 42660.25  703.040 42660.25  703.040 42660.25  703.040  1022.72   8.4344  1022.72   8.4344 -0.000000 0.000000 
1 1 1    5    0  -44 o  101.491   1.9020  420.269   15.723  420.269   15.723  420.269   15.723  101.491   1.9020  101.491   1.9020 -0.000000 0.000000 
1 1 1    5    0  -43 o  435.709   4.3373  7740.71  154.012  7740.71  154.012  7740.71  154.012  435.709   4.3373  435.709   4.3373 -0.000000 0.000000 
1 1 1    5    0  -42 o  1008.41   7.4399 41466.86  611.486 41466.86  611.486 41466.86  611.486  1008.41   7.4399  1008.41   7.4399 -0.000000 0.000000 
1 1 1    5    0  -41 o  338.184   2.7129  4662.47   74.775  4662.47   74.775  4662.47   74.775  338.184   2.7129  338.184   2.7129 0.000000 0.000000 
1 1 1    5    0  -40 o  1096.07   8.0713 48992.29  721.051 48992.29  721.051 48992.29  721.051  1096.07   8.0713  1096.07   8.0713 0.000000 0.000000 
1 1 1    5    0  -39 o  169.635   2.2197  1173.48   30.682  1173.48   30.682  1173.48   30.682  169.635   2.2197  169.635   2.2197 0.000000 0.000000 
1 1 1    5    0  -38 o  717.222   5.9773 20974.79  349.403 20974.79  349.403 20974.79  349.403  717.222   5.9773  717.222   5.9773 -0.000000 0.000000 
1 1 1    5    0  -37 o  430.715   3.3328  7563.00  116.997  7563.00  116.997  7563.00  116.997  430.715   3.3328  430.715   3.3328 0.000000 0.000000 
1 1 1    5    0  -36 o  332.286   2.6678  4501.26   72.250  4501.26   72.250  4501.26   72.250  332.286   2.6678  332.286   2.6678 -0.000000 0.000000 
1 1 1    5    0  -35 o  145.263   1.5848  860.356   18.761  860.356   18.761  860.356   18.761  145.263   1.5848  145.263   1.5848 -0.000000 0.000000 
1 1 1    5    0  -34 o  117.934   1.9750  567.359   18.974  567.359   18.974  567.359   18.974  117.934   1.9750  117.934   1.9750 -0.000000 0.000000 
1 1 1    5    0  -33 o  766.051   6.3636 23929.56  397.308 23929.56  397.308 23929.56  397.308  766.051   6.3636  766.051   6.3636 -0.000000 0.000000 
1 1 1    5    0  -32 o  274.194   2.9407  3065.48   65.710  3065.48   65.710  3065.48   65.710  274.194   2.9407  274.194   2.9407 -0.000000 0.000000 
1 1 1    5    0  -31 f  313.994   2.8434  4019.60   72.764  4019.60   72.764  4019.60   72.764  313.994   2.8434  313.994   2.8434 0.000000 0.000000 
1 1 1    5    0  -30 o  153.109   1.7967  955.873   22.417  955.873   22.417  955.873   22.417  153.109   1.7967  153.109   1.7967 -0.000000 0.000000 
1 1 1    5    0  -29 o  450.543   3.8703  8276.29  142.116  8276.29  142.116  8276.29  142.116  450.543   3.8703  450.543   3.8703 -0.000000 0.000000 
1 1 1    5    0  -28 o   29.023   2.2466   34.945   5.2397   34.945   5.2397   34.945   5.2397   29.023   2.2466   29.023   2.2466 -0.000000 0.000000 
1 1 1    5    0  -27 f   96.474   1.5806  379.656   12.423  379.656   12.423  379.656   12.423   96.474   1.5806   96.474   1.5806 0.000000 0.000000 
1 1 1    5    0  -26 o  670.311   5.0086 18321.30  273.638 18321.30  273.638 18321.30  273.638  670.311   5.0086  670.311   5.0086 0.000000 0.000000 
1 1 1    5    0  -25 o  678.298   5.0614 18760.89  279.814 18760.89  279.814 18760.89  279.814  678.298   5.0614  678.298   5.0614 0.000000 0.000000 
1 1 1    5    0  -24 o  194.336   1.8071  1539.73   28.620  1539.73   28.620  1539.73   28.620  194.336   1.8071  194.336   1.8071 0.000000 0.000000 
1 1 1    5    0  -23 f  538.020   4.0690 11802.43  178.430 11802.43  178.430 11802.43  178.430  538.020   4.0690  538.020   4.0690 -0.000000 0.000000 
1 1 1    5    0  -22 f   9.1161   4.7944   4.8985   4.7208   4.8985   4.7208   4.8985   4.7208   9.1161   4.7944   9.1161   4.7944 0.000000 0.000000 
1 1 1    5    0  -21 o  289.725   2.6468  3422.37   62.498  3422.37   62.498  3422.37   62.498  289.725   2.6468  289.725   2.6468 -0.000000 0.000000 
1 1 1    5    0  -20 o  634.599   5.3051 16423.44  274.388 16423.44  274.388 16423.44  274.388  634.599   5.3051  634.599   5.3051 -0.000000 0.000000 
1 1 1    5    0  -19 o   20.973   2.5499   18.710   4.1879   18.710   4.1879   18.710   4.1879   20.973   2.5499   20.973   2.5499 -0.000000 0.000000 
1 1 1    5    0  -18 o  565.160   4.7569 13024.80  219.110 13024.80  219.110 13024.80  219.110  565.160   4.7569  565.160   4.7569 0.000000 0.000000 
1 1 1    5    0  -17 o   79.579   1.5442  258.410   10.008  258.410   10.008  258.410   10.008   79.579   1.5442   79.579   1.5442 0.000000 0.000000 
1 1 1    5    0  -16 o  702.055   5.8466 20101.48  334.535 20101.48  334.535 20101.48  334.535  702.055   5.8466  702.055   5.8466 -0.000000 0.000000 
1 1 1    5    0  -15 o  142.846   1.7295  832.054   20.132  832.054   20.132  832.054   20.132  142.846   1.7295  142.846   1.7295 0.000000 0.000000 
1 1 1    5    0  -14 o  223.591   1.9606  2038.15   35.728  2038.15   35.728  2038.15   35.728  223.591   1.9606  223.591   1.9606 0.000000 0.000000 
1 1 1    5    0  -13 f  246.583   2.0992  2478.83   42.186  2478.83   42.186  2478.83   42.186  246.583   2.0992  246.583   2.0992 0.000000 0.000000 
1 1 1    5    0  -12 o  137.561   1.6851  771.623   18.889  771.623   18.889  771.623   18.889  137.561   1.6851  137.561   1.6851 0.000000 0.000000 
1 1 1    5    0  -11 o  371.100   3.2518  5614.83   98.350  5614.83   98.350  5614.83   98.350  371.100   3.2518  371.100   3.2518 -0.000000 0.000000 
1 1 1    5    0  -10 o  413.835   3.5776  6982.54  120.664  6982.54  120.664  6982.54  120.664  413.835   3.5776  413.835   3.5776 -0.000000 0.000000 
1 1 1    5    0   -9 o  941.084   7.7645 36125.14  595.540 36125.14  595.540 36125.14  595.540  941.084   7.7645  941.084   7.7645 -0.000000 0.000000 
1 1 1    5    0   -8 o  626.453   5.2427 16002.52  267.677 16002.52  267.677 16002.52  267.677  626.453   5.2427  626.453   5.2427 -0.000000 0.000000 
1 1 1    5    0   -7 o  301.639   3.1657  3709.94   77.820  3709.94   77.820  3709.94   77.820  301.639   3.1657  301.639   3.1657 0.000000 0.000000 
1 1 1    5    0   -6 o  183.265   2.2452  1369.55   33.529  1369.55   33.529  1369.55   33.529  183.265   2.2452  183.265   2.2452 0.000000 0.000000 
1 1 1    5    0   -5 o  178.796   2.2124  1303.59   32.233  1303.59   32.233  1303.59   32.233  178.796   2.2124  178.796   2.2124 0.000000 0.000000 
1 1 1    5    0   -4 o  474.919   4.6780  9197.24  181.061  9197.24  181.061  9197.24  181.061  474.919   4.6780  474.919   4.6780 -0.000000 0.000000 
1 1 1    5    0   -3 o  100.511   1.8062  412.157   14.788  412.157   14.788  412.157   14.788  100.511   1.8062  100.511   1.8062 -0.000000 0.000000 
1 1 1    5    0   -2 o  365.919   3.7139  5459.63  110.753  5459.63  110.753  5459.63  110.753  365.919   3.7139  365.919   3.7139 0.000000 0.000000 
1 1 1    5    0   -1 o  414.462   3.5833  7003.62  121.042  7003.62  121.042  7003.62  121.042  414.462   3.5833  414.462   3.5833 -0.000000 0.000000 
1 1 1    5    0    0 o  748.176   6.2143 22827.11  378.932 22827.11  378.932 22827.11  378.932  748.176   6.2143  748.176   6.2143 0.000000 0.000000 
1 1 1    5    0    1 o  239.212   2.6470  2333.24   51.600  2333.24   51.600  2333.24   51.600  239.212   2.6470  239.212   2.6470 -0.000000 0.000000 
1 1 1    5    0    2 o  1060.92   10.085 45928.29  871.962 45928.29  871.962 45928.29  871.962  1060.92   10.085  1060.92   10.085 0.000000 0.000000 
1 1 1    5    0    3 o  503.446   4.9306 10335.46  202.301 10335.46  202.301 10335.46  202.301  503.446   4.9306  503.446   4.9306 0.000000 0.000000 
1 1 1    5    0    4 o  773.161   7.4028 24382.56  466.457 24382.56  466.457 24382.56  466.457  773.161   7.4028  773.161   7.4028 0.000000 0.000000 
1 1 1    5    0    5 o   82.302   1.7570  276.460   11.776  276.460   11.776  276.460   11.776   82.302   1.7570   82.302   1.7570 -0.000000 0.000000 
1 1 1    5    0    6 o  751.310   7.2071 23023.59  441.291 23023.59  441.291 23023.59  441.291  751.310   7.2071  751.310   7.2071 -0.000000 0.000000 
1 1 1    5    0    7 o  461.862   4.5634  8698.46  171.767  8698.46  171.767  8698.46  171.767  461.862   4.5634  461.862   4.5634 0.000000 0.000000 
1 1 1    5    0    8 o  614.175   5.9420 15383.65  297.418 15383.65  297.418 15383.65  297.418  614.175   5.9420  614.175   5.9420 -0.000000 0.000000 
1 1 1    5    0    9 o  432.623   5.2695  7633.73  185.766  7633.73  185.766  7633.73  185.766  432.623   5.2695  432.623   5.2695 0.000000 0.000000 
1 1 1    5    0   10 o  161.383   2.5650  1062.39   33.724  1062.39   33.724  1062.39   33.724  161.383   2.5650  161.383   2.5650 -0.000000 0.000000 
1 1 1    5    0   11 o  640.148   7.5724 16718.97  395.016 16718.97  395.016 16718.97  395.016  640.148   7.5724  640.148   7.5724 0.000000 0.000000 
1 1 1    5    0   12 o   15.358   5.7704   12.965   6.7493   12.965   6.7493   12.965   6.7493   15.358   5.7704   15.358   5.7704 -0.000000 0.000000 
1 1 1    5    0   13 f   92.966   2.2092  352.868   16.720  352.868   16.720  352.868   16.720   92.966   2.2092   92.966   2.2092 -0.000000 0.000000 
1 1 1    5    0   14 o  224.988   3.1303  2064.56   57.384  2064.56   57.384  2064.56   57.384  224.988   3.1303  224.988   3.1303 -0.000000 0.000000 
1 1 1    5    0   15 o  266.839   3.5347  2904.03   76.855  2904.03   76.855  2904.03   76.855  266.839   3.5347  266.839   3.5347 -0.000000 0.000000 
1 1 1    5    0   16 o  550.398   6.5751 12359.05  294.901 12359.05  294.901 12359.05  294.901  550.398   6.5751  550.398   6.5751 0.000000 0.000000 
1 1 1    5    0   17 o  237.957   3.2571  2309.45   63.150  2309.45   63.150  2309.45   63.150  237.957   3.2571  237.957   3.2571 -0.000000 0.000000 
1 1 1    5    0   18 o  102.100   3.2151  426.194   26.698  426.194   26.698  426.194   26.698  102.100   3.2151  102.100   3.2151 0.000000 0.000000 
1 1 1    5    0   19 o  337.320   6.0345  4644.31  165.809  4644.31  165.809  4644.31  165.809  337.320   6.0345  337.320   6.0345 0.000000 0.000000 
1 1 1    5    0   20 o  477.136   8.1677  9295.41  317.463  9295.41  317.463  9295.41  317.463  477.136   8.1677  477.136   8.1677 -0.000000 0.000000 
1 1 1    5    0   21 o  689.360   11.524 19419.53  647.185 19419.53  647.185 19419.53  647.185  689.360   11.524  689.360   11.524 0.000000 0.000000 
1 1 1    5    0   22 f   52.864   2.5722  114.719   11.024  114.719   11.024  114.719   11.024   52.864   2.5722   52.864   2.5722 0.000000 0.000000 
1 1 1    5    0   23 f  981.406   11.463 39339.22  916.745 39339.22  916.745 39339.22  916.745  981.406   11.463  981.406   11.463 -0.000000 0.000000 
1 1 1    5    0   24 o  171.851   2.6998  1204.68   37.799  1204.68   37.799  1204.68   37.799  171.851   2.6998  171.851   2.6998 0.000000 0.000000 
1 1 1    5    0   25 o  345.452   4.3561  4867.30  122.623  4867.30  122.623  4867.30  122.623  345.452   4.3561  345.452   4.3561 -0.000000 0.000000 
1 1 1    5    0   26 o  232.947   3.2311  2213.20   61.328  2213.20   61.328  2213.20   61.328  232.947   3.2311  232.947   3.2311 -0.000000 0.000000 
1 1 1    5    0   27 f  202.734   2.9654  1676.41   48.982  1676.41   48.982  1676.41   48.982  202.734   2.9654  202.734   2.9654 0.000000 0.000000 
1 1 1    5    0   28 o   93.866   2.3263  359.786   17.775  359.786   17.775  359.786   17.775   93.866   2.3263   93.866   2.3263 -0.000000 0.000000 
1 1 1    5    0   29 o  332.930   4.2348  4520.59  114.886  4520.59  114.886  4520.59  114.886  332.930   4.2348  332.930   4.2348 0.000000 0.000000 
1 1 1    5    0   30 o  322.907   4.1319  4252.43  108.719  4252.43  108.719  4252.43  108.719  322.907   4.1319  322.907   4.1319 0.000000 0.000000 
1 1 1    5    0   31 f   54.664   2.6819  122.672   11.884  122.672   11.884  122.672   11.884   54.664   2.6819   54.664   2.6819 0.000000 0.000000 
1 1 1    5    0   32 o  424.460   5.2083  7347.92  180.145  7347.92  180.145  7347.92  180.145  424.460   5.2083  424.460   5.2083 0.000000 0.000000 
1 1 1    5    0   33 o  153.132   2.6146  956.617   32.616  956.617   32.616  956.617   32.616  153.132   2.6146  153.132   2.6146 -0.000000 0.000000 
1 1 1    5    0   34 o  325.078   4.1615  4309.68  110.233  4309.68  110.233  4309.68  110.233  325.078   4.1615  325.078   4.1615 0.000000 0.000000 
1 1 1    5    0   35 o  1299.39   12.322 68900.40  1304.83 68900.40  1304.83 68900.40  1304.83  1299.39   12.322  1299.39   12.322 0.000000 0.000000 
1 1 1    5    0   36 o  855.264   7.0814 29828.38  493.618 29828.38  493.618 29828.38  493.618  855.264   7.0814  855.264   7.0814 -0.000000 0.000000 
1 1 1    5    0   37 o  530.505   5.1933 11475.74  224.532 11475.74  224.532 11475.74  224.532  530.505   5.1933  530.505   5.1933 -0.000000 0.000000 
1 1 1    5    0   38 o  832.442   7.9693 28261.76  540.658 28261.76  540.658 28261.76  540.658  832.442   7.9693  832.442   7.9693 -0.000000 0.000000 
1 1 1    5    0   39 o  233.273   2.6443  2218.81   50.268  2218.81   50.268  2218.81   50.268  233.273   2.6443  233.273   2.6443 0.000000 0.000000 
1 1 1    5    0   40 o  256.125   2.8226  2674.78   58.913  2674.78   58.913  2674.78   58.913  256.125   2.8226  256.125   2.8226 -0.000000 0.000000 
1 1 1    5    0   41 o  742.079   8.7276 22464.25  527.771 22464.25  527.771 22464.25  527.771  742.079   8.7276  742.079   8.7276 -0.000000 0.000000 
1 1 1    5    0   42 o  292.979   3.8070  3500.57   90.885  3500.57   90.885  3500.57   90.885  292.979   3.8070  292.979   3.8070 0.000000 0.000000 
1 1 1    5    0   43 o  885.755   8.4674 32000.46  611.236 32000.46  611.236 32000.46  611.236  885.755   8.4674  885.755   8.4674 0.000000 0.000000 
1 1 1    5    0   44 o  649.810   7.6948 17224.04  407.459 17224.04  407.459 17224.04  407.459  649.810   7.6948  649.810   7.6948 0.000000 0.000000 
1 1 1    5    0   45 o  848.903   7.0421 29387.42  487.223 29387.42  487.223 29387.42  487.223  848.903   7.0421  848.903   7.0421 0.000000 0.000000 
1 1 1    5    0   46 o   76.257   2.2588  237.641   14.013  237.641   14.013  237.641   14.013   76.257   2.2588   76.257   2.2588 0.000000 0.000000 
1 1 1    5    0   47 o  470.119   4.0492  9010.96  155.146  9010.96  155.146  9010.96  155.146  470.119   4.0492  470.119   4.0492 0.000000 0.000000 
1 1 1    5    0   48 o  712.872   5.9533 20722.40  345.888 20722.40  345.888 20722.40  345.888  712.872   5.9533  712.872   5.9533 -0.000000 0.000000 
1 1 1    5    0   49 o  164.288   1.9966  1100.59   26.730  1100.59   26.730  1100.59   26.730  164.288   1.9966  164.288   1.9966 -0.000000 0.000000 
1 1 1    5    0   50 o  226.323   2.7034  2088.70   49.859  2088.70   49.859  2088.70   49.859  226.323   2.7034  226.323   2.7034 -0.000000 0.000000 
1 1 1    5    0   51 o  334.333   4.2996  4558.83  117.134  4558.83  117.134  4558.83  117.134  334.333   4.2996  334.333   4.2996 0.000000 0.000000 
1 1 1    5    0   52 o  364.659   3.7760  5422.25  112.214  5422.25  112.214  5422.25  112.214  364.659   3.7760  364.659   3.7760 0.000000 0.000000 
1 1 1    5    0   53 o  754.919   7.2626 23246.96  446.823 23246.96  446.823 23246.96  446.823  754.919   7.2626  754.919   7.2626 0.000000 0.000000 
1 1 1    5    0   54 o  317.697   3.3724  4115.61   87.313  4115.61   87.313  4115.61   87.313  317.697   3.3724  317.697   3.3724 -0.000000 0.000000 
1 1 1    5    0   55 o  506.565   5.0058 10465.02  206.656 10465.02  206.656 10465.02  206.656  506.565   5.0058  506.565   5.0058 0.000000 0.000000 
1 1 1    5    0   56 o  112.886   2.1704  519.991   19.956  519.991   19.956  519.991   19.956  112.886   2.1704  112.886   2.1704 0.000000 0.000000 
1 1 1    5    0   57 o  638.563   6.1999 16633.80  322.651 16633.80  322.651 16633.80  322.651  638.563   6.1999  638.563   6.1999 0.000000 0.000000 
1 1 1    5    0   58 o  183.328   2.0385  1370.43   30.454  1370.43   30.454  1370.43   30.454  183.328   2.0385  183.328   2.0385 -0.000000 0.000000 
1 1 1    5    0   59 o  107.092   1.7698  467.842   15.440  467.842   15.440  467.842   15.440  107.092   1.7698  107.092   1.7698 0.000000 0.000000 
1 1 1    5    0   60 o  234.035   2.3334  2233.28   44.504  2233.28   44.504  2233.28   44.504  234.035   2.3334  234.035   2.3334 0.000000 0.000000 
1 1 1    5    0   61 f  365.951   3.2571  5460.83   97.144  5460.83   97.144  5460.83   97.144  365.951   3.2571  365.951   3.2571 0.000000 0.000000 
1 1 1    5    0   62 f  108.067   2.0415  476.543   17.969  476.543   17.969  476.543   17.969  108.067   2.0415  108.067   2.0415 -0.000000 0.000000 
1 1 1    5    0   63 o  311.769   3.3065  3964.14   84.009  3964.14   84.009  3964.14   84.009  311.769   3.3065  311.769   3.3065 -0.000000 0.000000 
1 1 1    5    0   64 o  113.274   2.0417  523.529   18.838  523.529   18.838  523.529   18.838  113.274   2.0417  113.274   2.0417 0.000000 0.000000 
1 1 1    5    0   65 o  357.396   3.6904  5210.02  107.488  5210.02  107.488  5210.02  107.488  357.396   3.6904  357.396   3.6904 -0.000000 0.000000 
1 1 1    5    0   66 f  181.130   2.0320  1337.87   29.994  1337.87   29.994  1337.87   29.994  181.130   2.0320  181.130   2.0320 -0.000000 0.000000 
1 1 1    5    0   67 o  518.145   4.4221 10953.13  186.745 10953.13  186.745 10953.13  186.745  518.145   4.4221  518.145   4.4221 -0.000000 0.000000 
1 1 1    5    0   68 o   34.841   2.8424   50.472   7.9447   50.472   7.9447   50.472   7.9447   34.841   2.8424   34.841   2.8424 -0.000000 0.000000 
1 1 1    5    0   69 o   38.847   2.6182   62.358   8.2029   62.358   8.2029   62.358   8.2029   38.847   2.6182   38.847   2.6182 0.000000 0.000000 
1 1 1    5    0   70 o  126.503   1.8205  652.746   18.764  652.746   18.764  652.746   18.764  126.503   1.8205  126.503   1.8205 0.000000 0.000000 
1 1 1    5    0   71 o  112.770   1.8135  518.802   16.661  518.802   16.661  518.802   16.661  112.770   1.8135  112.770   1.8135 0.000000 0.000000 
1 1 1    5    0   72 o  422.667   3.6950  7288.00  127.282  7288.00  127.282  7288.00  127.282  422.667   3.6950  422.667   3.6950 -0.000000 0.000000 
1 1 1    5    0   73 o   67.060   1.9678  183.799   10.736  183.799   10.736  183.799   10.736   67.060   1.9678   67.060   1.9678 -0.000000 0.000000 
1 1 1    5    0   74 o   84.332   1.8475  290.332   12.686  290.332   12.686  290.332   12.686   84.332   1.8475   84.332   1.8475 -0.000000 0.000000 
1 1 1    5    0   75 o  156.621   1.9349  1000.46   24.694  1000.46   24.694  1000.46   24.694  156.621   1.9349  156.621   1.9349 -0.000000 0.000000 
1 1 1    5    0   76 o   74.856   1.9167  228.883   11.678  228.883   11.678  228.883   11.678   74.856   1.9167   74.856   1.9167 0.000000 0.000000 
1 1 1    5    0   77 o  121.212   1.8479  599.367   18.249  599.367   18.249  599.367   18.249  121.212   1.8479  121.212   1.8479 -0.000000 0.000000 
1 1 1    5    0   78 o   79.623   1.9211  258.907   12.452  258.907   12.452  258.907   12.452   79.623   1.9211   79.623   1.9211 -0.000000 0.000000 
1 1 1    5    0   79 o   71.259   2.0031  207.508   11.614  207.508   11.614  207.508   11.614   71.259   2.0031   71.259   2.0031 -0.000000 0.000000 
1 1 1    5    0   80 o  137.927   1.8989  776.000   21.341  776.000   21.341  776.000   21.341  137.927   1.8989  137.927   1.8989 0.000000 0.000000 
1 1 1    5    0   81 o   23.614   3.9866   24.603   7.0171   24.603   7.0171   24.603   7.0171   23.614   3.9866   23.614   3.9866 0.000000 0.000000 
1 1 1    5    0   82 o   5.5937   3.9248  -7.3713   6.8163  -7.3713   6.8163  -7.3713   6.8163   5.5937   3.9248   5.5937   3.9248 -0.000000 0.000000 
1 1 1    5    0   83 o  344.041   3.1218  4829.25   87.534  4829.25   87.534  4829.25   87.534  344.041   3.1218  344.041   3.1218 -0.000000 0.000000 
1 1 1    5    0   84 o  ?   ?  -42.4794   8.8224 -42.4794   8.8224 -42.4794   8.8224  ?   ?   ?   ?  0.000000 0.000000 
1 1 1    5    0   85 o  223.942   3.3932  2047.42   61.909  2047.42   61.909  2047.42   61.909  223.942   3.3932  223.942   3.3932 0.000000 0.000000 
1 1 1    5    0   86 o   49.290   3.1093  100.283   12.377  100.283   12.377  100.283   12.377   49.290   3.1093   49.290   3.1093 -0.000000 0.000000 
1 1 1    5    0   87 o  112.336   1.9632  515.000   17.965  515.000   17.965  515.000   17.965  112.336   1.9632  112.336   1.9632 0.000000 0.000000 
1 1 1    5    0   88 o  343.163   3.1367  4805.96   87.726  4805.96   87.726  4805.96   87.726  343.163   3.1367  343.163   3.1367 -0.000000 0.000000 
1 1 1    5    0   89 o   60.580   2.6247  150.540   12.906  150.540   12.906  150.540   12.906   60.580   2.6247   60.580   2.6247 -0.000000 0.000000 
1 1 1    5    0   90 o  132.560   1.9704  717.019   21.281  717.019   21.281  717.019   21.281  132.560   1.9704  132.560   1.9704 -0.000000 0.000000 
1 1 1    5    0   91 o  161.309   2.0519  1061.65   26.971  1061.65   26.971  1061.65   26.971  161.309   2.0519  161.309   2.0519 0.000000 0.000000 
1 1 1    5    0   92 o  107.588   1.7378  472.351   15.232  472.351   15.232  472.351   15.232  107.588   1.7378  107.588   1.7378 -0.000000 0.000000 
1 1 1    5    0   93 o  151.863   1.7854  940.818   22.095  940.818   22.095  940.818   22.095  151.863   1.7854  151.863   1.7854 -0.000000 0.000000 
1 1 1    5    0   94 o   17.213   6.2647   16.135   8.0865   16.135   8.0865   16.135   8.0865   17.213   6.2647   17.213   6.2647 -0.000000 0.000000 
1 1 1    5    0   95 o  100.198   1.9116  409.901   15.600  409.901   15.600  409.901   15.600  100.198   1.9116  100.198   1.9116 0.000000 0.000000 
1 1 1    5    0   96 o   80.234   2.0096  263.073   13.125  263.073   13.125  263.073   13.125   80.234   2.0096   80.234   2.0096 -0.000000 0.000000 
1 1 1    5    0   97 o   48.929   2.5678   98.512   10.177   98.512   10.177   98.512   10.177   48.929   2.5678   48.929   2.5678 0.000000 0.000000 
1 1 1    5    0   98 o   22.506   5.7110   24.344   9.0585   24.344   9.0585   24.344   9.0585   22.506   5.7110   22.506   5.7110 -0.000000 0.000000 
1 1 1    5    0   99 o  128.214   1.9585  671.114   20.459  671.114   20.459  671.114   20.459  128.214   1.9585  128.214   1.9585 -0.000000 0.000000 
1 1 1    5    0  100 o  188.204   1.9764  1445.70   30.313  1445.70   30.313  1445.70   30.313  188.204   1.9764  188.204   1.9764 -0.000000 0.000000 
1 1 1    5    0  101 o  104.021   1.8268  441.873   15.479  441.873   15.479  441.873   15.479  104.021   1.8268  104.021   1.8268 -0.000000 0.000000 
1 1 1    5    0  102 o   45.992   2.8917   87.470   10.742   87.470   10.742   87.470   10.742   45.992   2.8917   45.992   2.8917 -0.000000 0.000000 
1 1 1    5    0  103 o   15.130   6.7214   13.625   8.7593   13.625   8.7593   13.625   8.7593   15.130   6.7214   15.130   6.7214 0.000000 0.000000 
1 1 1    5    0  104 o   75.451   2.0896  232.977   12.830  232.977   12.830  232.977   12.830   75.451   2.0896   75.451   2.0896 0.000000 0.000000 
1 1 1    5    0  105 f   8.3159   5.2035   1.6725   7.2624   1.6725   7.2624   1.6725   7.2624   8.3159   5.2035   8.3159   5.2035 0.000000 0.000000 
1 1 1    5    0  106 o   20.664   5.1740   20.530   7.5389   20.530   7.5389   20.530   7.5389   20.664   5.1740   20.664   5.1740 0.000000 0.000000 
1 1 1    5    0  107 o   25.005   4.3546   27.914   8.0705   27.914   8.0705   27.914   8.0705   25.005   4.3546   25.005   4.3546 -0.000000 0.000000 
1 1 1    5    0  108 o  111.208   1.7233  505.353   15.614  505.353   15.614  505.353   15.614  111.208   1.7233  111.208   1.7233 -0.000000 0.000000 
1 1 1    5    0  109 o   31.411   3.1437   41.672   7.8505   41.672   7.8505   41.672   7.8505   31.411   3.1437   31.411   3.1437 0.000000 0.000000 
1 1 1    5    0  110 o   14.742   6.0926   12.675   7.2661   12.675   7.2661   12.675   7.2661   14.742   6.0926   14.742   6.0926 0.000000 0.000000 
1 1 1    5    0  111 o   23.625   4.3183   25.184   7.4948   25.184   7.4948   25.184   7.4948   23.625   4.3183   23.625   4.3183 0.000000 0.000000 
1 1 1    5    0  112 o   39.904   2.5626   66.068   8.2557   66.068   8.2557   66.068   8.2557   39.904   2.5626   39.904   2.5626 -0.000000 0.000000 
1 1 1    5    0  113 o   15.307   6.0249   13.438   7.2131   13.438   7.2131   13.438   7.2131   15.307   6.0249   15.307   6.0249 -0.000000 0.000000 
1 1 1    5    0  114 o   33.325   2.9086   46.670   7.7565   46.670   7.7565   46.670   7.7565   33.325   2.9086   33.325   2.9086 0.000000 0.000000 
1 1 1    5    0  115 o   41.834   2.4817   72.557   8.3942   72.557   8.3942   72.557   8.3942   41.834   2.4817   41.834   2.4817 -0.000000 0.000000 
1 1 1    5    0  116 f   12.689   6.4096   10.114   8.2176   10.114   8.2176   10.114   8.2176   12.689   6.4096   12.689   6.4096 0.000000 0.000000 
1 1 1    5    0  117 o   42.175   2.8204   74.153   9.5951   74.153   9.5951   74.153   9.5951   42.175   2.8204   42.175   2.8204 0.000000 0.000000 
1 1 1    5    0  118 o   7.3076   4.8859  -2.3947   8.0249  -2.3947   8.0249  -2.3947   8.0249   7.3076   4.8859   7.3076   4.8859 -0.000000 0.000000 
1 1 1    5    0  119 o   36.844   3.7114   58.005   10.867   58.005   10.867   58.005   10.867   36.844   3.7114   36.844   3.7114 -0.000000 0.000000 
1 1 1    5    0  120 o   25.944   5.6183   32.003   10.418   32.003   10.418   32.003   10.418   25.944   5.6183   25.944   5.6183 0.000000 0.000000 
1 1 1    5    0  121 o   29.273   5.8234   40.346   12.341   40.346   12.341   40.346   12.341   29.273   5.8234   29.273   5.8234 0.000000 0.000000 
1 1 1    5    0  122 o   8.8747   5.8655  -1.3003   11.018  -1.3003   11.018  -1.3003   11.018   8.8747   5.8655   8.8747   5.8655 -0.000000 0.000000 
1 1 1    5    0  123 o   16.536   7.7181   17.921   11.593   17.921   11.593   17.921   11.593   16.536   7.7181   16.536   7.7181 -0.000000 0.000000 
1 1 1    5    0  124 o   7.2292   4.9858  -6.3401   9.8042  -6.3401   9.8042  -6.3401   9.8042   7.2292   4.9858   7.2292   4.9858 0.000000 0.000000 
1 1 1    5    0  125 o   25.683   6.0124   32.578   10.939   32.578   10.939   32.578   10.939   25.683   6.0124   25.683   6.0124 -0.000000 0.000000 
1 1 1    5    0  126 o   44.059   3.4427   82.821   12.186   82.821   12.186   82.821   12.186   44.059   3.4427   44.059   3.4427 -0.000000 0.000000 
1 1 1    5    0  127 o   13.461   6.6308   12.097   8.6903   12.097   8.6903   12.097   8.6903   13.461   6.6308   13.461   6.6308 0.000000 0.000000 
1 1 1    5    0  128 o   11.801   6.7528   8.9986   10.260   8.9986   10.260   8.9986   10.260   11.801   6.7528   11.801   6.7528 0.000000 0.000000 
1 1 1    5    0  129 o   17.088   7.4608   19.097   10.801   19.097   10.801   19.097   10.801   17.088   7.4608   17.088   7.4608 -0.000000 0.000000 
1 1 1    5    0  130 o   42.894   3.6373   79.430   12.499   79.430   12.499   79.430   12.499   42.894   3.6373   42.894   3.6373 -0.000000 0.000000 
1 1 1    5    0  131 o   11.472   6.7745   8.2010   10.858   8.2010   10.858   8.2010   10.858   11.472   6.7745   11.472   6.7745 0.000000 0.000000 
1 1 1    5    0  132 o   25.281   8.1840   37.356   14.904   37.356   14.904   37.356   14.904   25.281   8.1840   25.281   8.1840 -0.000000 0.000000 
1 1 1    5    0  133 o   9.4291   6.3648  -2.7541   14.231  -2.7541   14.231  -2.7541   14.231   9.4291   6.3648   9.4291   6.3648 -0.000000 0.000000 
1 1 1    5    0  134 o   17.314   8.6959   22.569   15.080   22.569   15.080   22.569   15.080   17.314   8.6959   17.314   8.6959 0.000000 0.000000 
1 1 1    5    0  135 o   16.534   8.5324   20.772   14.750   20.772   14.750   20.772   14.750   16.534   8.5324   16.534   8.5324 0.000000 0.000000 
1 1 1    5    0  136 o   21.592   8.7024   31.137   14.928   31.137   14.928   31.137   14.928   21.592   8.7024   21.592   8.7024 0.000000 0.000000 
1 1 1    5    0  137 o   10.263   7.0688  -6.4538   19.550  -6.4538   19.550  -6.4538   19.550   10.263   7.0688   10.263   7.0688 0.000000 0.000000 
1 1 1    5    0  138 o   18.236   9.9092   28.315   20.756   28.315   20.756   28.315   20.756   18.236   9.9092   18.236   9.9092 0.000000 0.000000 
1 1 1    5    1 -138 o   12.645   5.3912   3.8181   9.7844  -4.6910   14.945   10.202   12.944   12.684   5.9118   15.539   6.3801 -2.854414 8.697942 
1 1 1    5    1 -137 o   26.517   5.3095   35.012   11.076   38.214   15.234   31.422   16.132   25.861   7.0395   22.773   7.5003 3.088247 10.28636 
1 1 1    5    1 -136 o   16.581   6.0136   13.919   10.477   6.1674   14.238   23.072   15.473   14.686   6.3839   19.854   7.2912 -5.167399 9.691023 
1 1 1    5    1 -135 o   22.538   4.8194   24.619   8.5858   25.941   10.289   21.587   15.580   22.507   5.6245   19.429   7.2821 3.078266 9.201300 
1 1 1    5    1 -134 o   19.047   5.0135   17.884   7.8888   20.416   10.268   14.236   12.325   19.767   5.9141   16.916   6.4461 2.850571 8.748103 
1 1 1    5    1 -133 o   12.190   4.9716   4.5924   7.7938   7.3944   10.092   0.4513   12.269   14.056   5.6848   12.792   5.7248 1.264030 8.067829 
1 1 1    5    1 -132 o   12.126   4.7916   5.1369   7.0023   21.317   10.027 -10.2660   9.7832   20.391   5.7728   9.3616   4.4848 11.02967 7.310164 
1 1 1    5    1 -131 o   12.509   4.7937   6.0280   6.8414   4.2654   9.6661   7.7973   9.6844   12.889   5.4202   14.168   5.6234 -1.278953 7.810329 
1 1 1    5    1 -130 o   16.495   4.8054   13.039   6.8537   22.401   9.8768   4.3440   9.5183   21.097   5.6362   12.889   5.3967 8.207870 7.803303 
1 1 1    5    1 -129 o   18.524   4.6052   16.255   6.9240   8.3763   9.9007   23.797   9.6868   14.544   5.7128   21.961   5.4396 -7.417165 7.888268 
1 1 1    5    1 -128 o   19.431   4.4619   17.672   6.9180   10.196   9.8148   25.053   9.7525   15.303   5.7704   22.646   5.3658 -7.343388 7.879694 
1 1 1    5    1 -127 o   54.352   1.9039  122.931   8.4223  117.714   11.990  128.012   11.833   52.554   2.8092   54.941   2.6500 -2.387398 3.861813 
1 1 1    5    1 -126 o   42.293   2.2558   75.026   7.7489   63.510   11.050   86.169   10.870   38.075   3.6031   44.864   2.9892 -6.788872 4.681641 
1 1 1    5    1 -125 o   13.432   4.9813   7.1751   7.2522   10.510   9.8136   3.1626   10.764   15.650   5.7963   13.281   5.6584 2.368670 8.100298 
1 1 1    5    1 -124 o   42.805   2.4043   76.813   8.3554   80.152   11.272   72.742   12.448   43.259   3.2197   40.828   3.7832 2.430668 4.967828 
1 1 1    5    1 -123 o   46.659   2.2357   90.758   8.4787   88.061   11.296   94.238   12.832   45.518   3.0622   46.886   3.3801 -1.368420 4.560957 
1 1 1    5    1 -122 f   34.778   2.4482   50.656   6.8962   42.239   12.257   54.555   8.3417   30.405   5.1277   35.920   2.8728 -5.514759 5.877671 
1 1 1    5    1 -121 o   28.245   2.5215   33.481   5.7445   31.828   8.3856   34.943   7.8852   26.993   3.9260   28.507   3.4643 -1.514067 5.235981 
1 1 1    5    1 -120 o   44.954   1.8521   83.409   6.7724   83.112   10.494   83.622   8.8656   44.468   2.9111   44.808   2.4364 -0.3394356 3.796172 
1 1 1    5    1 -119 o   13.823   4.3189   8.2342   5.3997   5.9629   8.1986   9.9742   7.1757   13.545   5.2329   15.239   5.0014 -1.694095 7.238597 
1 1 1    5    1 -118 o   61.224   1.4865  153.697   7.4188  154.943   10.813  152.588   10.197   61.227   2.1700   60.801   2.0605 0.4261436 2.992424 
1 1 1    5    1 -117 o   62.082   1.4782  157.959   7.4808  158.075   10.990  157.858   10.212   61.865   2.1826   61.879   2.0273 -0.1345062E-01 2.978881 
1 1 1    5    1 -116 o   22.178   2.9813   20.815   5.2533   19.816   7.5052   21.776   7.3557   21.183   4.4864   22.323   4.1963 -1.140690 6.142995 
1 1 1    5    1 -115 o   49.230   1.6638   99.520   6.6674   97.537   9.8716  101.183   9.0412   48.509   2.5050   49.490   2.2470 -0.9809341 3.365128 
1 1 1    5    1 -114 f   42.630   1.8017   74.719   6.2467   72.075   9.0843   77.091   8.6036   41.644   2.6905   43.142   2.4566 -1.498184 3.643294 
1 1 1    5    1 -113 o   36.683   2.0075   55.453   5.9798   52.854   8.6724   57.808   8.2563   35.563   3.0201   37.284   2.7357 -1.720505 4.074938 
1 1 1    5    1 -112 o   23.299   2.8856   22.795   5.3633   35.910   7.7968   11.015   7.3894   29.202   3.3352   16.079   5.0565 13.12309 6.057352 
1 1 1    5    1 -111 o   56.568   1.5427  131.056   7.1067  132.994   10.389  129.352   9.7428   56.831   2.2471   56.074   2.1354 0.7570763 3.099860 
1 1 1    5    1 -110 o   27.146   2.4284   30.555   5.3168   33.486   7.5393   27.656   7.4991   28.224   3.3418   25.518   3.7141 2.705622 4.996202 
1 1 1    5    1 -109 o   85.032   1.2794  295.410   8.8676  298.537   12.509  292.251   12.573   85.380   1.7973   84.470   1.8260 0.9101257 2.562136 
1 1 1    5    1 -108 o   38.338   2.1879   60.484   6.8092   69.605   8.7211   46.241   10.898   41.055   2.6196   33.067   4.1331 7.987823 4.893314 
1 1 1    5    1 -107 o   13.276   4.5299   6.8315   5.8793   1.1151   7.3240   17.191   9.8592   11.294   4.7318   19.900   5.7536 -8.606165 7.449422 
1 1 1    5    1 -106 o   85.645   1.4850  299.689   10.367  301.769   13.827  297.019   15.667   85.862   1.9756   85.097   2.2605 0.7643204 3.002173 
1 1 1    5    1 -105 o   80.718   1.6679  266.284   10.974  273.446   13.161  249.935   19.884   81.751   1.9749   77.868   3.1391 3.883530 3.708647 
1 1 1    5    1 -104 o   21.068   3.6558   18.814   6.0506   17.962   7.4256   20.498   10.438   20.413   4.5760   21.721   5.7900 -1.308434 7.379951 
1 1 1    5    1 -103 o   40.055   2.1947   65.838   7.1384   74.458   8.3761   42.965   13.645   42.573   2.4236   31.665   5.4848 10.90821 5.996455 
1 1 1    5    1 -102 o   92.195   1.4657  346.973   11.015  351.850   13.404  336.826   19.333   92.808   1.7718   90.646   2.6192 2.161713 3.162168 
1 1 1    5    1 -101 o  101.113   1.5568  417.365   12.831  411.101   14.692  437.502   26.342  100.325   1.7966  103.227   3.1342 -2.901360 3.612628 
1 1 1    5    1 -100 o   58.088   1.7789  137.911   8.4133  152.097   11.158  119.221   12.808   60.955   2.2496   53.868   2.9278 7.086670 3.692255 
1 1 1    5    1  -99 o   83.907   1.5177  287.305   10.381  298.021   13.258  270.325   16.689   85.427   1.9039   81.262   2.5224 4.164978 3.160320 
1 1 1    5    1  -98 o   51.182   1.7581  107.057   7.3241  108.981   9.8437  104.670   10.962   51.587   2.3470   50.518   2.6715 1.068779 3.556010 
1 1 1    5    1  -97 o   88.365   1.3611  318.512   9.8043  312.002   13.087  326.839   14.802   87.427   1.8364   89.467   2.0296 -2.039673 2.737051 
1 1 1    5    1  -96 o  131.639   1.2609  706.747   13.530  710.729   19.009  702.658   19.262  131.968   1.7670  131.213   1.8009 0.7547302 2.523036 
1 1 1    5    1  -95 o  187.691   1.5373  1437.09   23.520  1397.00   37.509  1463.07   30.193  184.919   2.4884  189.327   1.9564 -4.407318 3.165388 
1 1 1    5    1  -94 f   48.831   1.6699   97.394   6.6373  100.085   9.1588   94.418   9.6322   49.457   2.2780   48.016   2.4692 1.440506 3.359493 
1 1 1    5    1  -93 f  117.788   1.2439  565.758   11.944  566.078   16.742  565.427   17.044  117.792   1.7437  117.722   1.7761 0.7008362E-01 2.488959 
1 1 1    5    1  -92 o  133.292   1.2566  724.478   13.653  711.961   19.013  737.806   19.619  132.104   1.7656  134.478   1.7897 -2.374603 2.514064 
1 1 1    5    1  -91 o  177.201   1.4121  1280.53   20.396  1278.27   27.212  1283.42   30.812  177.005   1.8860  177.337   2.1315 -0.3313141 2.846097 
1 1 1    5    1  -90 f   95.693   1.3191  373.393   10.290  375.595   13.597  370.442   15.740   95.958   1.7383   95.284   2.0266 0.6742783 2.669945 
1 1 1    5    1  -89 o  133.752   1.3069  729.440   14.249  743.719   19.034  711.235   21.492  135.033   1.7292  132.035   1.9969 2.998260 2.641548 
1 1 1    5    1  -88 o   61.445   1.4936  153.958   7.4812  155.980   9.7308  151.035   11.699   61.806   1.9338   60.789   2.3655 1.016788 3.055333 
1 1 1    5    1  -87 o   64.278   1.5150  168.481   7.9380  172.305   9.9731  161.870   13.112   64.968   1.8852   62.924   2.5618 2.043938 3.180664 
1 1 1    5    1  -86 o   60.973   1.5026  151.593   7.4681  144.683   9.7307  161.498   11.649   59.523   2.0084   62.874   2.2767 -3.351276 3.035971 
1 1 1    5    1  -85 o   90.689   1.3430  335.320   9.9280  348.026   13.237  318.981   15.011   92.380   1.7578   88.431   2.0824 3.948959 2.725085 
1 1 1    5    1  -84 f  231.595   1.5401  2186.98   29.074  2233.84   41.252  2140.72   40.984  234.017   2.1625  229.085   2.1947 4.932068 3.081148 
1 1 1    5    1  -83 o   42.375   2.0013   73.399   6.8935   85.956   9.3696   58.581   10.178   45.830   2.5177   37.728   3.3442 8.101200 4.185969 
1 1 1    5    1  -82 o  211.609   1.5171  1825.74   26.170  1822.82   38.815  1828.17   35.434  211.392   2.2525  211.717   2.0532 -0.3249207 3.047893 
1 1 1    5    1  -81 o  138.166   1.2847  778.249   14.470  780.554   21.293  776.272   19.723  138.350   1.8881  137.975   1.7536 0.3747253 2.576841 
1 1 1    5    1  -80 o  174.753   1.3658  1245.02   19.456  1242.87   28.782  1246.82   26.401  174.574   2.0226  174.859   1.8522 -0.2853546 2.742581 
1 1 1    5    1  -79 o  400.681   2.2409  6548.04   73.192  6506.53  102.944  6590.48  104.084  399.270   3.1630  401.835   3.1776 -2.564819 4.483479 
1 1 1    5    1  -78 f  145.900   1.2962  867.788   15.416  850.160   20.110  892.907   24.006  144.398   1.7085  147.973   1.9902 -3.575302 2.622967 
1 1 1    5    1  -77 o  106.512   1.2282  462.474   10.663  454.758   15.534  469.350   14.663  105.607   1.8045  107.291   1.6766 -1.684074 2.463188 
1 1 1    5    1  -76 o  152.380   1.3978  946.600   17.362  950.129   28.723  944.568   21.795  152.631   2.3086  152.205   1.7567 0.4259186 2.900961 
1 1 1    5    1  -75 o  339.961   2.0606  4712.90   57.103  4642.63   84.506  4771.95   77.465  337.311   3.0734  342.013   2.7786 -4.701385 4.143265 
1 1 1    5    1  -74 f   65.928   1.3185  177.190   7.0857  185.076   10.139  169.662   9.9063   67.348   1.8487   64.478   1.8868 2.869308 2.641519 
1 1 1    5    1  -73 o   68.196   1.2253  189.583   6.8112  189.408   9.2569  189.789   10.058   68.160   1.6661   68.202   1.8107 -0.4254150E-01 2.460613 
1 1 1    5    1  -72 o   68.466   1.2135  191.087   6.7728  191.253   9.2190  190.892   9.9831   68.492   1.6512   68.402   1.7920 0.8992767E-01 2.436770 
1 1 1    5    1  -71 o  125.466   1.1554  641.678   11.816  651.122   16.593  631.962   16.831  126.378   1.6107  124.503   1.6584 1.874237 2.311912 
1 1 1    5    1  -70 o  104.080   1.1314  441.570   9.5991  438.084   13.268  445.399   13.905  103.663   1.5701  104.523   1.6320 -0.8607635 2.264699 
1 1 1    5    1  -69 o  206.665   1.3826  1741.07   23.291  1717.14   32.492  1766.37   33.403  205.221   1.9423  208.141   1.9688 -2.920120 2.765625 
1 1 1    5    1  -68 o  197.247   1.3474  1585.98   21.665  1604.51   30.672  1567.54   30.606  198.379   1.8967  196.080   1.9148 2.299438 2.695218 
1 1 1    5    1  -67 o  259.686   1.5915  2749.16   33.689  2736.65   47.370  2761.95   47.921  259.068   2.2431  260.261   2.2588 -1.193634 3.183367 
1 1 1    5    1  -66 o  194.109   1.4002  1535.90   22.155  1575.92   33.351  1504.30   29.639  196.602   2.0811  192.089   1.8929 4.513947 2.813185 
1 1 1    5    1  -65 o  329.816   1.9999  4434.83   53.767  4349.14   79.240  4507.95   73.194  326.556   2.9768  332.483   2.7007 -5.927734 4.019333 
1 1 1    5    1  -64 o  269.481   1.9557  2960.55   42.961  2954.04   80.694  2963.13   50.751  269.096   3.6787  269.584   2.3095 -0.4881592 4.343597 
1 1 1    5    1  -63 o  252.335   1.8684  2595.71   38.432  2538.14   71.118  2619.45   45.675  249.455   3.4975  253.476   2.2106 -4.021027 4.137494 
1 1 1    5    1  -62 o   61.393   1.5656  153.737   7.8287  165.594   12.804  146.659   9.8933   63.682   2.4713   59.945   2.0276 3.737278 3.196630 
1 1 1    5    1  -61 o  597.917   3.8181 14581.67  186.093 14167.35  277.809 14918.90  250.634  589.080   5.7854  604.619   5.0854 -15.53888 7.702733 
1 1 1    5    1  -60 o  314.346   2.1879  4028.25   56.063  4011.16   85.782  4040.99   74.070  313.632   3.3554  314.817   2.8864 -1.185181 4.426013 
1 1 1    5    1  -59 o  494.108   2.8267  9953.97  113.853  9746.65  150.331 10232.84  174.352  488.872   3.7724  500.875   4.2703 -12.00278 5.697955 
1 1 1    5    1  -58 o  439.726   2.4177  7882.55   86.660  7894.22  122.940  7871.03  122.175  440.002   3.4277  439.356   3.4114 0.6458740 4.835968 
1 1 1    5    1  -57 o  347.280   2.0873  4916.21   59.090  4949.97   89.229  4889.85   78.859  348.437   3.1416  346.327   2.7934 2.110321 4.203852 
1 1 1    5    1  -56 f  316.234   1.9376  4076.38   49.946  4171.86   76.349  4004.94   66.035  319.892   2.9280  313.436   2.5846 6.455566 3.905522 
1 1 1    5    1  -55 o  537.618   3.0477 11783.34  133.560 11803.68  200.681 11767.17  178.947  537.992   4.5761  537.192   4.0866 0.8002319 6.135200 
1 1 1    5    1  -54 o  240.443   1.5964  2356.45   31.290  2339.54   46.793  2370.13   42.081  239.568   2.3962  241.133   2.1409 -1.564835 3.213267 
1 1 1    5    1  -53 o  329.075   2.2610  4414.15   60.649  4429.06   92.749  4403.01   80.162  329.603   3.4521  328.644   2.9923 0.9594116 4.568467 
1 1 1    5    1  -52 o  305.158   2.1340  3795.76   53.084  3815.33   81.319  3781.23   70.074  305.924   3.2609  304.562   2.8226 1.361389 4.312829 
1 1 1    5    1  -51 o  1092.92   6.3658 48723.56  567.125 48488.63  798.274 48962.98  805.850  1089.85   8.9857  1095.16   9.0270 -5.309814 12.73689 
1 1 1    5    1  -50 o  614.681   3.6619 15403.35  183.483 15588.67  262.121 15225.31  256.925  618.289   5.2008  611.043   5.1582 7.245728 7.325016 
1 1 1    5    1  -49 o  585.229   3.7383 13962.57  178.335 14202.05  239.593 13665.06  267.042  590.170   4.9804  578.868   5.6593 11.30182 7.538693 
1 1 1    5    1  -48 o  357.401   2.1413  5206.55   62.384  5312.85   95.167  5126.45   82.608  361.013   3.2339  354.630   2.8577 6.382843 4.315599 
1 1 1    5    1  -47 o  153.341   1.4097  958.372   17.620  1054.61   29.989  907.630   21.775  160.852   2.2872  149.225   1.7902 11.62698 2.904452 
1 1 1    5    1  -46 o  248.543   1.7480  2517.85   35.413  2508.88   50.286  2526.69   49.881  248.094   2.4865  248.973   2.4578 -0.8796387 3.496228 
1 1 1    5    1  -45 f  148.596   1.3109  899.977   15.878  894.403   23.883  904.392   21.257  148.133   1.9779  148.959   1.7506 -0.8258209 2.641321 
1 1 1    5    1  -44 o  270.113   1.8364  2973.84   40.434  2988.78   57.485  2959.20   56.885  270.784   2.6043  269.441   2.5900 1.343201 3.672968 
1 1 1    5    1  -43 o  635.328   4.7726 16456.52  247.166 16177.59  314.306 16908.54  400.118  629.856   6.1217  643.837   7.6239 -13.98041 9.777481 
1 1 1    5    1  -42 o  150.779   1.5602  926.623   19.177  932.566   23.530  914.868   33.092  151.261   1.9084  149.815   2.7098 1.445938 3.314312 
1 1 1    5    1  -41 o  661.292   4.5198 17828.24  243.642 17805.54  344.254 17851.02  344.872  660.783   6.3912  661.626   6.3945 -0.8432617 9.040897 
1 1 1    5    1  -40 o  435.945   2.8597  7746.68  101.623  7808.81  135.497  7666.80  153.641  437.673   3.7979  433.662   4.3463 4.010193 5.771848 
1 1 1    5    1  -39 o  326.905   1.9724  4355.83   52.561  4342.90   70.204  4372.33   79.287  326.413   2.6385  327.514   2.9699 -1.100494 3.972628 
1 1 1    5    1  -38 o  457.587   2.7863  8534.82  103.929  8536.18  146.988  8533.45  146.969  457.602   3.9406  457.528   3.9407 0.7318115E-01 5.572879 
1 1 1    5    1  -37 o   99.065   1.2070  399.998   9.7469  395.417   13.374  405.188   14.235   98.496   1.6657   99.705   1.7515 -1.209236 2.417079 
1 1 1    5    1  -36 o  619.000   3.6786 15619.21  185.614 15657.66  263.022 15581.07  261.978  619.711   5.2067  618.194   5.1988 1.517273 7.357845 
1 1 1    5    1  -35 o  359.996   2.2595  5282.35   66.304  5339.84   84.428  5189.83  107.102  361.943   2.8616  356.811   3.6823 5.131744 4.663513 
1 1 1    5    1  -34 f  363.302   2.2765  5379.85   67.416  5458.00   86.080  5255.85  108.423  365.924   2.8859  359.072   3.7043 6.852295 4.695725 
1 1 1    5    1  -33 o  317.404   2.0373  4106.33   52.711  4103.43   66.456  4111.23   86.551  317.287   2.5695  317.579   3.3434 -0.2922058 4.216693 
1 1 1    5    1  -32 o  318.756   1.9237  4141.37   49.983  4129.69   66.871  4156.16   75.242  318.300   2.5773  319.315   2.8907 -1.014893 3.872813 
1 1 1    5    1  -31 o  430.827   2.4832  7565.71   87.207  7585.95  117.181  7540.58  130.559  431.388   3.3324  430.088   3.7240 1.300354 4.997300 
1 1 1    5    1  -30 o  667.211   3.7161 18147.63  202.110 18103.98  270.570 18202.74  303.993  666.354   4.9813  668.138   5.5816 -1.783936 7.481159 
1 1 1    5    1  -29 o  424.888   2.4509  7358.62   84.886  7290.75  112.954  7446.68  128.669  422.909   3.2766  427.398   3.6932 -4.489044 4.937197 
1 1 1    5    1  -28 o  667.701   3.5267 18174.42  191.950 18508.61  275.807 17860.52  267.309  673.740   5.0220  661.843   4.9548 11.89709 7.054794 
1 1 1    5    1  -27 o  366.475   2.0419  5474.27   60.997  5482.19   86.426  5466.42   86.101  366.726   2.8911  366.198   2.8844 0.5278015 4.083922 
1 1 1    5    1  -26 o  375.705   2.0864  5753.56   63.896  5712.98   89.926  5794.95   90.805  374.362   2.9468  377.038   2.9545 -2.676025 4.172890 
1 1 1    5    1  -25 o  877.507   4.5880 31397.43  328.175 31375.09  463.775 31419.83  464.446  877.006   6.4874  877.631   6.4921 -0.6245728 9.177888 
1 1 1    5    1  -24 o  283.245   1.6564  3270.06   38.245  3304.31   54.570  3237.00   53.615  284.715   2.3513  281.801   2.3340 2.914124 3.313057 
1 1 1    5    1  -23 o  702.644   3.7017 20128.60  212.018 19934.21  297.369 20329.59  302.372  699.134   5.2179  706.031   5.2539 -6.896301 7.404755 
1 1 1    5    1  -22 o  835.908   4.6116 28493.43  314.231 28708.81  474.581 28325.30  419.312  838.790   6.9410  833.269   6.1733 5.520691 9.289064 
1 1 1    5    1  -21 o  527.674   3.1595 11351.32  135.898 11444.64  193.467 11260.43  190.936  529.772   4.4801  525.492   4.4575 4.279541 6.319790 
1 1 1    5    1  -20 o  212.107   1.5123  1833.77   26.148  1851.77   37.166  1816.12   36.793  213.140   2.1392  211.078   2.1384 2.061646 3.024696 
1 1 1    5    1  -19 o  171.674   1.3336  1201.25   18.663  1215.67   30.850  1192.93   23.438  172.694   2.1915  171.076   1.6807 1.618225 2.761808 
1 1 1    5    1  -18 o  324.158   1.9390  4283.14   51.235  4249.62   76.447  4310.48   69.033  322.866   2.9047  325.177   2.6044 -2.310974 3.901277 
1 1 1    5    1  -17 o  230.807   1.7026  2171.40   32.033  2230.15   49.469  2128.98   42.036  233.896   2.5946  228.535   2.2565 5.361572 3.438565 
1 1 1    5    1  -16 o  368.152   2.6388  5525.14   79.190  5627.08  113.480  5428.38  110.561  371.496   3.7474  364.880   3.7172 6.616699 5.278294 
1 1 1    5    1  -15 o  207.367   1.8761  1752.78   31.713  1754.93   50.125  1751.34   40.951  207.479   2.9638  207.275   2.4237 0.2037659 3.828642 
1 1 1    5    1  -14 o  411.546   3.1876  6904.95  106.936  6985.23  170.623  6853.02  137.233  413.846   5.0578  409.958   4.1066 3.887329 6.515019 
1 1 1    5    1  -13 o  773.975   5.2417 24432.87  330.703 24924.92  475.746 23972.80  460.020  781.438   7.4687  766.383   7.3637 15.05481 10.48833 
1 1 1    5    1  -12 o   90.556   1.2023  334.238   8.8746  341.059   11.578  324.522   13.819   91.474   1.5527   89.227   1.8999 2.246689 2.453676 
1 1 1    5    1  -11 o  304.501   1.9563  3779.43   48.558  3763.16   68.414  3795.94   68.933  303.830   2.7623  305.150   2.7713 -1.320251 3.912852 
1 1 1    5    1  -10 o  792.797   5.3673 25635.83  346.859 25176.09  482.861 26126.01  498.582  785.376   7.5424  800.040   7.6452 -14.66351 10.73948 
1 1 1    5    1   -9 f  490.348   3.1546  9802.17  126.091  9831.43  193.316  9780.51  166.346  490.997   4.8301  489.760   4.1667 1.236877 6.378953 
1 1 1    5    1   -8 o  427.826   2.7880  7461.44   97.230  7597.72  150.846  7364.59  127.172  431.660   4.2870  425.011   3.6708 6.649078 5.643842 
1 1 1    5    1   -7 o  488.891   3.3971  9744.25  135.380  9513.08  187.778  9994.46  195.361  482.993   4.7694  495.059   4.8411 -12.06552 6.795873 
1 1 1    5    1   -6 o  456.124   3.1893  8481.53  118.580  8573.35  169.407  8393.32  166.039  458.532   4.5324  453.694   4.4896 4.837891 6.379604 
1 1 1    5    1   -5 o  506.712   3.2492 10467.25  134.208 10417.26  176.907 10535.04  205.992  505.456   4.2936  508.269   4.9719 -2.813263 6.569247 
1 1 1    5    1   -4 f  467.177   3.0158  8897.26  114.845  8793.06  150.518  9042.45  177.669  464.398   3.9762  470.908   4.6285 -6.510071 6.101876 
1 1 1    5    1   -3 o  252.897   1.8098  2606.90   37.309  2593.88   49.280  2624.38   57.106  252.258   2.3965  253.731   2.7611 -1.473648 3.656075 
1 1 1    5    1   -2 o  554.089   3.5308 12516.52  159.474 12406.01  209.501 12668.77  245.911  551.582   4.6595  557.346   5.4127 -5.764343 7.142040 
1 1 1    5    1   -1 o  218.418   1.6358  1944.50   29.125  1960.72   38.835  1923.65   44.030  219.322   2.1722  217.235   2.4865 2.087204 3.301678 
1 1 1    5    1    0 o  604.343   4.1362 14891.35  203.761 14715.04  285.229 15075.12  291.187  600.644   5.8256  607.945   5.8759 -7.300598 8.274258 
1 1 1    5    1    1 o  638.933   4.3596 16645.47  227.058 16770.03  323.192 16524.07  319.066  641.184   6.1836  636.468   6.1499 4.716309 8.721129 
1 1 1    5    1    2 o  235.539   1.8573  2261.33   35.660  2270.99   50.598  2251.80   50.264  236.032   2.6298  235.033   2.6236 0.9991760 3.714708 
1 1 1    5    1    3 o  653.812   4.4574 17430.20  237.559 17504.13  337.169 17357.32  334.762  655.052   6.3145  652.302   6.2958 2.750916 8.916813 
1 1 1    5    1    4 f  524.956   3.6260 11235.17  155.161 11051.53  216.409 11429.44  222.582  520.573   5.0999  529.396   5.1579 -8.822388 7.253453 
1 1 1    5    1    5 o  200.837   1.6742  1644.08   27.408  1673.63   39.194  1615.80   38.342  202.628   2.3729  199.096   2.3625 3.531754 3.348443 
1 1 1    5    1    6 o  126.523   1.3469  652.476   13.891  673.305   19.955  632.897   19.348  128.524   1.9048  124.608   1.9048 3.916260 2.693756 
1 1 1    5    1    7 o  383.141   2.7327  5984.10   85.347  6051.51  121.778  5919.03  119.648  385.258   3.8778  381.019   3.8523 4.239349 5.466029 
1 1 1    5    1    8 o  329.145   2.4039  4416.12   64.496  4374.45   90.627  4458.88   91.808  327.566   3.3941  330.711   3.4056 -3.145508 4.808104 
1 1 1    5    1    9 f  552.209   4.1659 12433.72  187.522 12837.61  304.630 12187.30  237.947  560.918   6.6625  546.634   5.3401 14.28387 8.538473 
1 1 1    5    1   10 o  368.242   2.8946  5527.97   86.889  5520.76  137.250  5532.79  112.246  367.943   4.5761  368.377   3.7380 -0.4334412 5.908769 
1 1 1    5    1   11 o  240.462   2.0694  2356.93   40.562  2381.94   64.648  2340.69   52.091  241.714   3.2811  239.624   2.6669 2.090973 4.228209 
1 1 1    5    1   12 o  263.146   2.2094  2822.64   47.391  2871.75   75.921  2791.28   60.661  265.400   3.5093  261.669   2.8439 3.730591 4.516999 
1 1 1    5    1   13 o  462.496   4.5697  8722.92  172.281  8571.12  294.438  8801.95  212.443  458.205   7.8831  464.522   5.6105 -6.316711 9.675801 
1 1 1    5    1   14 o  839.162   8.0317 28750.62  549.404 28302.96  937.921 28984.46  677.875  831.191   13.843  842.196   9.8742 -11.00482 17.00373 
1 1 1    5    1   15 o  164.235   2.1309  1099.49   28.528  1149.54   51.109  1076.83   34.382  167.910   3.7341  162.529   2.5951 5.380768 4.547354 
1 1 1    5    1   16 o  546.493   5.3298 12181.90  237.427 12292.03  414.975 12128.30  289.492  548.523   9.2809  545.184   6.5141 3.338257 11.33887 
1 1 1    5    1   17 o  445.167   3.4261  8079.62  124.326  8034.82  195.834  8109.86  160.912  443.825   5.4130  445.952   4.4265 -2.126465 6.992496 
1 1 1    5    1   18 o  604.104   4.5361 14882.29  223.372 14707.60  349.753 15002.63  290.284  600.303   7.1475  606.429   5.8723 -6.125793 9.250455 
1 1 1    5    1   19 o  452.604   3.4745  8351.82  128.188  8439.96  204.622  8294.88  164.460  454.875   5.5185  451.011   4.4734 3.864258 7.103895 
1 1 1    5    1   20 o  553.557   4.1777 12494.79  188.513 12401.37  296.232 12558.38  244.382  551.297   6.5919  554.879   5.4030 -3.581787 8.523219 
1 1 1    5    1   21 o  765.703   5.6880 23915.51  355.021 23863.53  560.289 23950.37  458.904  764.406   8.9919  766.053   7.3490 -1.647217 11.61301 
1 1 1    5    1   22 o  212.589   2.1549  1842.20   37.343  1911.67   54.111  1779.03   51.601  216.548   3.0655  208.901   3.0303 7.647064 4.310423 
1 1 1    5    1   23 o  507.760   4.3174 10512.57  178.698 10525.83  252.917 10499.36  252.518  507.971   6.1081  507.332   6.1061 0.6390991 8.636723 
1 1 1    5    1   24 o  541.156   4.5814 11941.28  202.095 11847.85  283.888 12037.27  287.762  538.912   6.4624  543.200   6.4989 -4.288269 9.165023 
1 1 1    5    1   25 o   77.669   1.6800  245.879   10.636  253.735   15.232  238.403   14.859   78.862   2.3722   76.439   2.3877 2.422379 3.365735 
1 1 1    5    1   26 o  111.584   1.6839  507.499   15.316  526.210   21.966  489.795   21.367  113.620   2.3717  109.618   2.3912 4.001999 3.367973 
1 1 1    5    1   27 o  305.494   2.7943  3804.27   69.584  3828.93   98.830  3780.03   97.988  306.461   3.9562  304.498   3.9478 1.963318 5.588939 
1 1 1    5    1   28 o  219.326   2.2093  1960.74   39.498  1980.82   56.190  1941.13   55.533  220.437   3.1271  218.217   3.1219 2.219742 4.418735 
1 1 1    5    1   29 o  537.050   4.5532 11759.14  199.327 11939.17  285.354 11587.60  278.551  541.056   6.4700  533.033   6.4108 8.022461 9.108253 
1 1 1    5    1   30 o  177.179   1.9725  1279.54   28.489  1303.54   40.686  1256.45   39.904  178.828   2.7911  175.568   2.7883 3.259613 3.945186 
1 1 1    5    1   31 o  644.521   5.4025 16937.79  283.837 16644.81  395.509 17248.92  407.573  638.796   7.5955  650.279   7.6890 -11.48242 10.80801 
1 1 1    5    1   32 o  489.252   4.1831  9758.22  166.825  9673.47  234.225  9845.49  237.666  487.067   5.8994  491.377   5.9336 -4.310181 8.367220 
1 1 1    5    1   33 o  301.087   2.7735  3695.15   68.069  3752.74   97.377  3640.12   95.189  303.409   3.9372  298.822   3.9079 4.586884 5.547345 
1 1 1    5    1   34 f  623.166   4.6798 15831.83  237.723 15894.48  307.969 15739.48  373.933  624.341   6.0513  621.221   7.3843 3.120361 9.547080 
1 1 1    5    1   35 o  453.238   3.4978  8373.82  129.229  8495.24  168.734  8201.57  200.980  456.489   4.5346  448.504   5.4973 7.985718 7.126210 
1 1 1    5    1   36 o  502.661   3.8424 10299.91  157.438 10067.27  199.487 10684.12  256.362  496.923   4.9248  511.879   6.1440 -14.95575 7.874164 
1 1 1    5    1   37 o  374.174   3.3147  5707.03  101.101  5853.41  145.938  5571.94  140.193  378.916   4.7249  369.695   4.6521 9.220795 6.630691 
1 1 1    5    1   38 o  1224.61   10.064 61198.15  1004.59 60857.77  1154.23 62261.49  2040.08  1220.95   11.597  1232.86   20.300 -11.91223 23.37924 
1 1 1    5    1   39 o  850.775   6.2977 29515.47  436.752 29430.05  562.581 29645.07  692.908  849.403   8.1252  852.323   9.9732 -2.919922 12.86406 
1 1 1    5    1   40 o  393.783   2.8171  6320.67   90.427  6215.61  109.504  6545.91  160.339  390.487   3.4402  400.696   4.9089 -10.20969 5.994397 
1 1 1    5    1   41 o  641.997   4.3920 16802.78  229.843 16817.81  281.890 16772.98  397.002  642.243   5.3845  641.266   7.5948 0.9766846 9.309896 
1 1 1    5    1   42 o  588.879   3.7517 14136.45  180.090 14119.28  238.108 14159.41  275.290  588.480   4.9637  589.283   5.7310 -0.8032227 7.581736 
1 1 1    5    1   43 o  305.653   2.1299  3807.95   53.068  3785.10   70.109  3838.60   81.208  304.728   2.8224  306.868   3.2465 -2.140686 4.301823 
1 1 1    5    1   44 o  581.350   3.7123 13777.37  175.922 13678.51  231.490 13912.51  270.657  579.218   4.9029  584.117   5.6844 -4.898987 7.506724 
1 1 1    5    1   45 f  351.817   2.3885  5045.19   68.497  4981.47   89.916  5133.30  105.734  349.578   3.1554  354.856   3.6553 -5.278503 4.828873 
1 1 1    5    1   46 o  895.767   5.6055 32719.38  409.306 33191.14  633.081 32380.55  536.521  901.906   8.6112  890.958   7.3874 10.94769 11.34576 
1 1 1    5    1   47 o  313.594   2.0471  4008.40   52.330  4060.06   74.831  3958.95   73.208  315.598   2.9088  311.644   2.8818 3.954071 4.094586 
1 1 1    5    1   48 o  386.454   2.5831  6087.65   81.373  5920.06  105.438  6334.48  127.961  381.082   3.3942  394.180   3.9824 -13.09836 5.232645 
1 1 1    5    1   49 o  652.719   3.8716 17368.95  205.991 17262.92  289.796 17477.24  292.858  650.638   5.4641  654.663   5.4879 -4.024902 7.744210 
1 1 1    5    1   50 o  314.932   2.0444  4042.71   52.483  4007.22   73.844  4078.94   74.607  313.534   2.8893  316.327   2.8934 -2.793121 4.088972 
1 1 1    5    1   51 o  329.525   2.1162  4426.10   56.844  4516.40   81.683  4341.30   79.157  332.854   3.0105  326.339   2.9757 6.515411 4.232934 
1 1 1    5    1   52 o  610.955   3.8851 15218.31  193.485 15200.20  255.835 15242.51  295.742  610.517   5.1407  611.308   5.9349 -0.7912598 7.851797 
1 1 1    5    1   53 o  261.153   1.7799  2779.89   37.889  2707.77   52.687  2857.14   54.527  257.733   2.5078  264.746   2.5266 -7.012817 3.559937 
1 1 1    5    1   54 o  361.092   2.4319  5315.05   71.581  5223.41  107.775  5387.38   95.750  357.929   3.6939  363.519   3.2313 -5.589813 4.907751 
1 1 1    5    1   55 o  541.492   3.2509 11954.23  143.492 11951.15  202.925 11957.31  202.932  541.341   4.5986  541.480   4.5976 -0.1395264 6.502724 
1 1 1    5    1   56 f  571.962   3.4200 13338.31  159.453 13367.95  225.883 13308.86  225.120  572.491   4.8404  571.224   4.8347 1.266296 6.841330 
1 1 1    5    1   57 o  240.703   1.7975  2361.66   35.269  2362.87   46.812  2360.08   53.639  240.754   2.3853  240.605   2.7349 0.1498108 3.628958 
1 1 1    5    1   58 o  377.655   2.5263  5814.35   77.772  5756.76  102.204  5893.58  119.868  375.746   3.3368  380.158   3.8681 -4.411591 5.108528 
1 1 1    5    1   59 o  315.789   2.3593  4065.38   60.732  4085.97   86.423  4045.30   85.364  316.550   3.3493  314.972   3.3248 1.578186 4.719300 
1 1 1    5    1   60 o  184.516   1.6674  1387.81   25.080  1374.03   35.565  1401.45   35.372  183.586   2.3765  185.409   2.3404 -1.823517 3.335488 
1 1 1    5    1   61 o  311.739   2.1665  3961.79   55.054  4054.24   85.653  3896.72   71.866  315.304   3.3326  309.141   2.8519 6.162811 4.386249 
1 1 1    5    1   62 o  432.637   2.8426  7632.19  100.247  7570.42  152.210  7679.50  133.220  430.755   4.3349  433.903   3.7665 -3.147766 5.742654 
1 1 1    5    1   63 o  329.980   2.2648  4439.33   60.920  4408.85   92.639  4462.55   80.864  328.777   3.4566  330.803   2.9988 -2.026093 4.576162 
1 1 1    5    1   64 o   43.754   1.6702   78.153   5.9458   90.165   8.7285   67.754   8.1215   46.971   2.2866   40.690   2.4601 6.280910 3.358649 
1 1 1    5    1   65 o  446.189   2.7342  8118.61   99.446  8047.56  139.725  8191.55  141.568  444.111   3.8597  448.064   3.8761 -3.953217 5.469990 
1 1 1    5    1   66 o  200.228   1.5131  1634.31   24.695  1658.40   35.391  1611.44   34.476  201.680   2.1528  198.804   2.1274 2.875397 3.026610 
1 1 1    5    1   67 o   92.756   1.3882  350.719   10.496  352.407   13.695  348.317   16.340   92.973   1.8070   92.427   2.1688 0.5467911 2.822904 
1 1 1    5    1   68 o  102.781   1.3833  430.636   11.589  420.923   15.064  444.721   18.141  101.609   1.8187  104.436   2.1309 -2.826950 2.801526 
1 1 1    5    1   69 o  354.546   2.4123  5126.20   69.716  5091.62   91.632  5173.71  107.428  353.276   3.1820  356.051   3.7014 -2.775299 4.881152 
1 1 1    5    1   70 o   27.695   2.7160   31.585   6.0528   30.490   7.6923   33.364   9.8082   27.102   3.5686   28.250   4.4027 -1.148565 5.667351 
1 1 1    5    1   71 o  347.950   2.3781  4937.36   67.451  4884.14   88.324  5011.82  104.477  345.995   3.1316  350.424   3.6575 -4.428497 4.815060 
1 1 1    5    1   72 o  161.880   1.4969  1068.31   19.752  1084.48   26.176  1046.92   30.102  163.086   1.9690  160.224   2.3048 2.861465 3.031344 
1 1 1    5    1   73 o  199.757   1.6401  1626.83   26.706  1628.71   35.235  1624.29   40.939  199.850   2.1629  199.560   2.5167 0.2904968 3.318393 
1 1 1    5    1   74 f  250.060   1.7404  2549.46   35.475  2577.46   50.673  2522.54   49.681  251.384   2.4729  248.693   2.4507 2.691010 3.481549 
1 1 1    5    1   75 o  144.105   1.3399  846.560   15.739  843.696   22.370  849.366   22.148  143.845   1.9078  144.328   1.8826 -0.4833832 2.680267 
1 1 1    5    1   76 o  261.192   1.7932  2781.64   38.180  2817.41   54.613  2747.45   53.397  262.812   2.5493  259.530   2.5240 3.281250 3.587402 
1 1 1    5    1   77 o  211.280   1.5762  1819.96   27.147  1818.39   38.507  1821.51   38.276  211.154   2.2372  211.336   2.2219 -0.1818542 3.153073 
1 1 1    5    1   78 f  239.598   1.8093  2340.81   35.338  2354.49   54.169  2330.68   46.625  240.226   2.7663  239.040   2.3928 1.186661 3.657585 
1 1 1    5    1   79 o   82.161   1.4155  275.207   9.4801  299.277   14.930  258.945   12.272   85.663   2.1381   79.688   1.8892 5.975357 2.853126 
1 1 1    5    1   80 o  211.477   1.6881  1823.53   29.100  1861.78   44.959  1795.95   38.176  213.623   2.5819  209.838   2.2319 3.784760 3.412819 
1 1 1    5    1   81 o  199.764   1.7696  1627.23   28.816  1592.14   40.465  1663.34   41.045  197.549   2.5128  201.920   2.4937 -4.370728 3.540194 
1 1 1    5    1   82 o   46.146   2.0603   87.025   7.7304   79.883   10.709   94.797   11.171   44.138   2.9941   48.111   2.8614 -3.972412 4.141499 
1 1 1    5    1   83 o  109.724   1.6695  490.927   14.932  479.857   18.177  513.899   26.187  108.466   2.0559  112.173   2.8662 -3.706398 3.527319 
1 1 1    5    1   84 f  185.162   1.6416  1398.02   24.777  1417.44   38.085  1383.77   32.625  186.386   2.5067  184.184   2.1730 2.202026 3.317443 
1 1 1    5    1   85 o   89.756   1.6717  328.516   12.231  334.290   21.628  325.801   14.830   90.445   2.9374   89.373   2.0356 1.072044 3.573805 
1 1 1    5    1   86 o   88.353   1.5334  318.308   11.043  328.582   16.993  310.796   14.530   89.710   2.3258   87.288   2.0420 2.421806 3.095030 
1 1 1    5    1   87 o  171.249   1.6789  1195.98   23.437  1210.14   33.572  1182.53   32.733  172.206   2.3916  170.232   2.3589 1.973160 3.359201 
1 1 1    5    1   88 o  113.345   1.4628  523.874   13.515  527.547   20.732  521.160   17.822  113.703   2.2369  113.030   1.9343 0.6737366 2.957225 
1 1 1    5    1   89 o  244.327   1.8638  2435.15   37.120  2475.20   57.285  2406.16   48.737  246.186   2.8546  242.791   2.4626 3.394974 3.769991 
1 1 1    5    1   90 f  130.844   1.3946  698.131   14.874  687.156   21.071  709.032   21.000  129.777   1.9918  131.829   1.9542 -2.052170 2.790402 
1 1 1    5    1   91 o   33.466   2.6542   46.025   7.1815   53.429   10.986   40.502   9.4895   35.933   3.8087   31.231   3.8060 4.701965 5.384457 
1 1 1    5    1   92 o   84.995   1.4515  294.631   10.056  304.138   14.455  285.715   14.000   86.327   2.0542   83.672   2.0526 2.655304 2.903945 
1 1 1    5    1   93 f   89.872   1.4340  329.422   10.506  324.835   15.017  333.819   14.702   89.211   2.0651   90.441   1.9942 -1.229576 2.870795 
1 1 1    5    1   94 f   83.911   1.4671  287.196   10.035  293.660   14.535  281.309   13.871   84.816   2.1023   83.017   2.0498 1.799553 2.936199 
1 1 1    5    1   95 o  165.113   1.4698  1112.06   19.782  1151.12   28.557  1076.03   27.430  167.918   2.0863  162.350   2.0727 5.567612 2.940876 
1 1 1    5    1   96 o  111.578   1.5345  507.912   13.957  525.229   18.421  484.570   21.386  113.427   1.9923  108.907   2.4090 4.519890 3.126115 
1 1 1    5    1   97 o   56.484   1.9253  130.402   8.8517  118.896   11.860  144.871   13.300   53.855   2.7104   59.455   2.7516 -5.600834 3.862324 
1 1 1    5    1   98 o   55.016   1.9917  123.765   8.9172  108.924   11.869  143.001   13.512   51.517   2.8373   59.052   2.8151 -7.534904 3.996889 
1 1 1    5    1   99 o   46.378   2.3271   88.141   8.7695   91.885   11.985   83.826   12.866   47.254   3.1290   45.064   3.5306 2.190197 4.717628 
1 1 1    5    1  100 o   86.533   1.6460  305.683   11.610  312.118   18.450  301.465   14.939   87.296   2.5957   85.886   2.1339 1.409439 3.360187 
1 1 1    5    1  101 o   90.738   1.5764  336.118   11.660  351.218   18.623  326.384   14.953   92.611   2.4691   89.363   2.0527 3.247765 3.210949 
1 1 1    5    1  102 o   82.573   1.7068  278.484   11.489  269.413   16.964  286.169   15.614   81.069   2.5704   83.603   2.2934 -2.533783 3.444761 
1 1 1    5    1  103 o   99.373   1.6258  403.340   13.170  394.035   19.202  411.604   18.097   98.097   2.4013  100.295   2.2136 -2.197952 3.265875 
1 1 1    5    1  104 o   84.391   1.5540  290.894   10.690  284.960   14.345  298.306   16.032   83.423   2.1112   85.318   2.3073 -1.894577 3.127436 
1 1 1    5    1  105 o   72.161   1.6193  212.785   9.5248  233.200   13.060  189.586   13.922   75.443   2.1258   67.943   2.5180 7.499870 3.295329 
1 1 1    5    1  106 o  121.953   1.4926  607.658   14.838  610.841   19.987  603.751   22.146  122.151   2.0073  121.374   2.2384 0.7764130 3.006639 
1 1 1    5    1  107 o  109.905   1.4789  493.618   13.249  506.155   18.045  478.956   19.515  111.172   1.9913  108.082   2.2151 3.089706 2.978551 
1 1 1    5    1  108 o   78.465   1.4796  251.673   9.4637  251.463   13.539  251.874   13.234   78.283   2.1236   78.359   2.0737 -0.7628632E-01 2.968153 
1 1 1    5    1  109 o   51.806   2.0529  110.239   8.6522  119.340   15.558  106.164   10.410   53.489   3.5891   50.736   2.5251 2.752640 4.388340 
1 1 1    5    1  110 o   72.023   1.6360  212.334   9.6049  201.025   15.295  219.698   12.342   69.771   2.6944   73.137   2.0723 -3.365685 3.399124 
1 1 1    5    1  111 o   47.961   2.0290   94.587   7.9144  114.323   13.127   83.316   9.9201   52.444   3.0843   44.845   2.7266 7.599609 4.116714 
1 1 1    5    1  112 o   8.8876   4.0227  -3.1753   6.2548   0.7868   10.063  -5.6697   7.9845   12.798   5.4623   9.5706   4.4117 3.227883 7.021409 
1 1 1    5    1  113 o   14.342   4.7708   8.4328   6.5223   3.9680   10.413   11.316   8.3672   14.006   5.7333   16.405   5.4015 -2.399069 7.877049 
1 1 1    5    1  114 f   20.952   4.0773   19.109   6.7130   40.122   10.723   5.5646   8.6089   30.451   4.4514   13.708   5.3438 16.74270 6.954931 
1 1 1    5    1  115 o   72.118   1.7592  213.491   10.342  214.552   17.990  212.967   12.639   71.712   3.0847   71.870   2.1599 -0.1579971 3.765739 
1 1 1    5    1  116 o   62.136   1.7421  158.630   8.8149  156.259   13.278  160.499   11.787   61.344   2.6617   62.308   2.3248 -0.9640961 3.534050 
1 1 1    5    1  117 o   49.453   1.9522  100.795   7.8542  101.811   12.033  100.041   10.368   49.329   3.0067   49.056   2.6020 0.2729607 3.976234 
1 1 1    5    1  118 o   19.488   4.2503   16.807   6.5612   10.169   8.9824   24.399   9.6068   15.811   5.5873   23.220   5.2045 -7.409426 7.635760 
1 1 1    5    1  119 o   45.809   2.0588   86.769   7.6682   83.635   10.608   90.199   11.098   44.647   2.9309   46.363   2.9519 -1.716110 4.159789 
1 1 1    5    1  120 o   37.882   2.3518   59.744   7.2263   67.671   10.103   51.441   10.340   40.015   3.1220   34.591   3.7259 5.424404 4.860979 
1 1 1    5    1  121 o   23.888   3.5745   24.749   6.7468   27.208   9.3299   22.054   9.7681   24.508   4.8420   21.739   5.5070 2.768959 7.332899 
1 1 1    5    1  122 f   24.303   3.3010   25.467   6.3707   23.871   9.2446   26.910   8.7916   22.714   5.1162   24.418   4.5852 -1.703657 6.870192 
1 1 1    5    1  123 o   11.803   4.5156   4.7376   6.0638   5.2275   8.9177   4.3163   8.2700   13.332   5.3609   12.680   5.1396 0.6525955 7.426648 
1 1 1    5    1  124 o   36.709   2.2716   56.379   6.7641   61.187   10.059   52.411   9.1386   37.719   3.3050   34.923   3.2474 2.796448 4.633454 
1 1 1    5    1  125 o   30.998   2.6064   40.697   6.5248   46.031   9.8008   36.452   8.7443   32.332   3.7906   28.710   3.8320 3.622021 5.390043 
1 1 1    5    1  126 o   19.076   4.5897   17.016   7.0499   4.7388   9.3643   33.077   10.711   13.132   5.4129   26.412   5.1601 -13.27957 7.478341 
1 1 1    5    1  127 o   16.770   4.8499   13.339   7.0045   26.277   9.4953  -2.1065   10.375   23.431   5.1153   11.520   5.2006 11.91101 7.294701 
1 1 1    5    1  128 o   24.228   4.2574   26.911   8.1012   29.890   11.710   24.177   11.219   24.345   5.9517   21.745   6.0890 2.599424 8.514616 
1 1 1    5    1  129 o   30.700   3.7974   42.096   9.3006   41.576   12.118   42.841   14.508   29.410   5.2475   28.871   6.3387 0.5388336 8.228891 
1 1 1    5    1  130 o   11.404   4.9583   1.1368   8.5937   10.969   11.012 -14.1776   13.743   15.729   6.0679   10.878   5.2381 4.851889 8.016053 
1 1 1    5    1  131 o   8.3479   4.0551 -12.3369   8.6983 -18.4580   11.207  -3.0623   13.795   8.9878   4.4158   12.720   5.8398 -3.731951 7.321394 
1 1 1    5    1  132 o   14.319   5.7601   7.8432   10.300   7.5972   11.709   8.6848   21.656   14.618   6.0417   17.034   7.6160 -2.416100 9.721392 
1 1 1    5    1  133 o   27.871   5.9455   39.793   13.095   48.198   16.047   23.036   22.659   29.867   6.7505   19.890   8.3272 9.976522 10.71969 
1 1 1    5    1  134 o   37.166   4.5268   64.566   13.432   64.334   16.492   65.022   23.148   35.634   5.8827   31.943   8.6699 3.691210 10.47731 
1 1 1    5    1  135 o   13.790   5.9457   4.8156   12.150  -2.7714   20.014   9.2429   15.289   14.590   6.8137   15.758   6.7293 -1.167457 9.576546 
1 1 1    5    1  136 o   10.172   4.8790 -11.0912   11.656 -15.3205   19.352  -8.6831   14.603   12.707   6.1430   11.880   5.6312 0.8273134 8.333482 
1 1 1    5    1  137 o   13.854   5.9626   5.1767   12.177   19.593   20.616  -2.5483   15.092   18.748   7.9017   13.097   6.0474 5.650362 9.950257 
1 1 1    5    1  138 o   23.819   5.8735   29.558   11.331   21.138   15.739   38.617   16.326   19.220   7.2938   25.570   7.4070 -6.350874 10.39531 
1 1 1    5    2 -137 o   32.370   3.6817   47.189   9.5423   45.908   12.920   48.726   14.155   30.359   5.4194   30.850   5.8424 -0.4910946 7.968977 
1 1 1    5    2 -136 o   18.956   5.4226   18.358   8.8016   20.414   12.008   15.972   12.939   19.274   6.4745   17.440   6.6143 1.834677 9.255653 
1 1 1    5    2 -135 o   17.578   5.4394   15.716   8.5876  -0.2472   11.524   35.654   12.878   12.224   5.5033   25.913   6.1834 -13.68824 8.277678 
1 1 1    5    2 -134 o   20.065   5.3061   20.269   8.8103   26.419   12.015   13.115   12.958   22.092   6.3405   16.524   6.5217 5.567785 9.095841 
1 1 1    5    2 -133 o   35.987   2.9910   56.261   8.6949   58.473   11.263   52.999   13.679   35.934   3.9080   32.925   5.2749 3.009087 6.564805 
1 1 1    5    2 -132 o   13.623   5.2979   7.4634   8.4460   4.0692   10.248   14.652   14.913   12.990   5.5271   17.346   6.9472 -4.356485 8.877599 
1 1 1    5    2 -131 o   27.190   4.0523   33.759   8.7074   32.845   10.532   35.733   15.479   25.991   5.1531   25.145   7.1906 0.8459854 8.846376 
1 1 1    5    2 -130 o   9.0319   4.2076  -4.9847   7.5574  -2.7891   9.6063  -8.5508   12.243   10.826   4.9334   11.007   5.1992 -0.1814852 7.167338 
1 1 1    5    2 -129 o   27.008   3.8206   32.797   8.1767   40.029   10.482   21.555   13.068   29.362   4.5246   20.048   6.7544 9.313435 8.129821 
1 1 1    5    2 -128 o   13.441   5.0015   7.4731   7.3226   14.936   10.048  -0.9782   10.693   17.405   5.9223   11.904   5.3347 5.500897 7.970762 
1 1 1    5    2 -127 o   25.990   3.3747   29.686   6.9809   37.207   10.156   22.950   9.6117   28.369   4.5450   21.593   5.4587 6.776442 7.103172 
1 1 1    5    2 -126 o   32.897   2.7665   46.221   7.3499   42.237   10.585   49.931   10.214   30.421   4.3960   33.545   3.8022 -3.124083 5.812141 
1 1 1    5    2 -125 o   10.878   4.5346   2.2889   6.6761  -0.5336   9.5244   5.0152   9.3607   11.537   5.1107   13.242   5.4300 -1.704858 7.456777 
1 1 1    5    2 -124 o   15.707   4.8256   11.370   6.7737   3.2818   9.6305   19.288   9.5292   12.831   5.4039   19.950   5.6207 -7.118723 7.797110 
1 1 1    5    2 -123 f   44.007   2.3217   81.004   8.2990   79.280   11.067   83.219   12.545   43.060   3.1752   43.879   3.5372 -0.8185234 4.753317 
1 1 1    5    2 -122 o   16.166   5.0780   11.902   7.4547   7.5162   9.8716   17.721   11.372   14.607   5.7142   19.252   6.2949 -4.644435 8.501642 
1 1 1    5    2 -121 o   39.755   2.2237   65.810   7.1775   40.935   10.905   84.826   9.5340   30.270   4.5609   44.975   2.6118 -14.70574 5.255804 
1 1 1    5    2 -120 o   20.472   3.9278   18.504   6.3160   8.7657   11.160   23.094   7.6612   15.679   6.0920   22.783   4.2825 -7.103977 7.446593 
1 1 1    5    2 -119 o   11.690   4.4956   4.3390   6.0313  -2.6898   10.699   7.6133   7.3022   11.940   5.3447   13.944   5.0254 -2.003980 7.336237 
1 1 1    5    2 -118 o   15.435   4.5381   10.522   6.0882  -1.2076   11.150   15.505   7.2670   12.625   5.5639   18.552   4.7769 -5.927206 7.333156 
1 1 1    5    2 -117 o   66.048   1.6219  179.068   8.7323  180.272   15.067  178.459   10.715   65.745   2.8180   65.785   2.0006 -0.4027557E-01 3.455909 
1 1 1    5    2 -116 o   9.3430   4.0662  -0.6138   5.7914  -0.0727   10.966  -0.8231   6.8200   12.915   5.6082   10.065   4.3959 2.850003 7.125734 
1 1 1    5    2 -115 f   29.367   2.5952   35.980   6.1486   45.528   10.407   30.859   7.6209   32.589   4.0014   26.899   3.5632 5.689816 5.357995 
1 1 1    5    2 -114 o   40.061   2.0598   66.214   6.7039   61.082   10.884   69.351   8.5098   38.016   3.5533   40.866   2.5676 -2.849537 4.383880 
1 1 1    5    2 -113 o   64.472   1.6507  170.518   8.6680  160.369   14.692  175.937   10.736   62.099   2.9104   65.386   2.0166 -3.286514 3.540832 
1 1 1    5    2 -112 o   43.181   2.1857   76.918   7.6683   85.174   16.057   74.478   8.7279   44.627   4.4742   42.401   2.5368 2.226318 5.143367 
1 1 1    5    2 -111 f   15.354   4.7537   10.045   6.5581   22.660   14.620   6.8670   7.3379   22.479   7.1180   13.795   5.0283 8.683139 8.714960 
1 1 1    5    2 -110 f   47.720   2.0580   93.663   7.9868   99.891   16.690   91.813   9.0959   48.583   4.2572   47.176   2.3729 1.407787 4.873916 
1 1 1    5    2 -109 o   70.764   1.6059  204.941   9.2632  231.490   16.695  193.133   11.134   74.865   2.7404   68.590   1.9935 6.274406 3.388821 
1 1 1    5    2 -108 o   93.749   1.4624  359.342   11.176  361.155   16.489  357.802   15.199   93.812   2.1562   93.421   1.9959 0.3909531 2.938184 
1 1 1    5    2 -107 o   52.815   1.7572  114.283   7.5546  120.459   12.124  110.362   9.6590   54.021   2.7624   51.805   2.2930 2.216293 3.590071 
1 1 1    5    2 -106 o   52.725   1.7659  113.854   7.5787  122.592   12.178  108.330   9.6822   54.528   2.7486   51.337   2.3197 3.190887 3.596669 
1 1 1    5    2 -105 o   33.455   2.8062   46.325   7.5821   35.757   11.774   53.814   9.9109   28.787   5.2092   35.949   3.4234 -7.162619 6.233408 
1 1 1    5    2 -104 o   87.174   1.4887  310.405   10.578  315.653   17.690  307.484   13.198   87.704   2.4769   86.709   1.8673 0.9956055 3.101938 
1 1 1    5    2 -103 o   60.038   1.7416  147.433   8.5145  168.383   14.491  136.388   10.522   63.995   2.7847   57.675   2.2424 6.319870 3.575275 
1 1 1    5    2 -102 o  102.970   1.3942  432.816   11.702  431.731   18.017  433.608   15.391  102.730   2.1515  103.005   1.8330 -0.2753448 2.826478 
1 1 1    5    2 -101 o   67.183   1.8096  184.529   9.9014  195.664   13.908  173.086   14.099   69.091   2.4735   64.946   2.6689 4.144730 3.638830 
1 1 1    5    2 -100 o   73.527   1.8532  220.979   11.098  225.602   16.427  217.098   15.053   74.169   2.7217   72.785   2.5411 1.384010 3.723540 
1 1 1    5    2  -99 o   66.933   1.9035  183.139   10.375  200.227   14.286  164.070   15.092   69.914   2.5109   63.217   2.9368 6.697067 3.863841 
1 1 1    5    2  -98 o   46.365   2.9013   88.357   10.910   97.406   15.052   78.341   15.837   48.546   3.8349   43.370   4.5471 5.175686 5.948361 
1 1 1    5    2  -97 o   23.906   4.7195   24.349   8.8703   37.054   13.404   14.451   11.832   29.419   5.7958   19.181   6.4266 10.23811 8.653993 
1 1 1    5    2  -96 o  184.102   1.6987  1383.21   25.492  1388.27   33.579  1376.32   39.165  184.351   2.2345  183.479   2.6187 0.8723602 3.442471 
1 1 1    5    2  -95 f  231.026   1.8641  2178.48   35.105  2153.49   45.929  2213.58   54.441  229.576   2.4543  232.650   2.8707 -3.074600 3.776814 
1 1 1    5    2  -94 o  142.425   1.7312  827.711   20.099  814.474   24.117  857.808   36.366  141.244   2.0947  144.811   3.0808 -3.567123 3.725434 
1 1 1    5    2  -93 o  172.108   1.7601  1208.62   24.693  1177.09   34.818  1240.52   35.024  169.751   2.5163  174.273   2.4655 -4.521393 3.522805 
1 1 1    5    2  -92 f   70.634   1.6614  203.531   9.5656  202.854   13.551  204.203   13.505   70.443   2.3633   70.679   2.3472 -0.2356033 3.330874 
1 1 1    5    2  -91 o  163.456   1.5967  1089.82   21.274  1073.93   28.055  1111.32   32.635  162.210   2.1218  164.974   2.4268 -2.763748 3.223527 
1 1 1    5    2  -90 o  124.591   1.5435  633.113   15.676  655.218   20.965  605.086   23.607  126.716   2.0297  121.745   2.3788 4.971169 3.127012 
1 1 1    5    2  -89 o  128.446   1.5099  672.839   15.809  690.006   21.395  652.193   23.462  130.043   2.0183  126.410   2.2770 3.632347 3.042702 
1 1 1    5    2  -88 o  141.916   1.5457  821.349   17.881  813.693   23.433  832.020   27.667  141.222   2.0356  142.776   2.3772 -1.554428 3.129639 
1 1 1    5    2  -87 o  119.359   1.3494  580.906   13.129  593.490   19.616  570.693   17.672  120.614   1.9951  118.284   1.8328 2.330437 2.709194 
1 1 1    5    2  -86 o  178.281   1.4368  1296.01   20.880  1299.55   31.214  1293.15   28.090  178.474   2.1455  178.051   1.9354 0.4238586 2.889484 
1 1 1    5    2  -85 o  243.879   1.8836  2425.85   37.445  2356.96   56.527  2479.72   49.984  240.275   2.8861  246.506   2.4875 -6.230911 3.810155 
1 1 1    5    2  -84 o   41.456   2.3760   70.348   7.9953   67.101   11.421   73.469   11.197   40.378   3.5045   42.289   3.2736 -1.910580 4.795601 
1 1 1    5    2  -83 o  134.436   1.4648  736.883   16.052  750.562   23.126  724.165   22.299  135.652   2.0914  133.247   2.0530 2.404922 2.930727 
1 1 1    5    2  -82 o  174.296   1.5320  1238.67   21.767  1262.67   31.341  1216.30   30.254  175.939   2.1853  172.680   2.1493 3.258682 3.065125 
1 1 1    5    2  -81 f   54.509   1.8031  121.296   8.0007  120.325   11.856  122.107   10.842   54.236   2.6901   54.654   2.4397 -0.4184608 3.631597 
1 1 1    5    2  -80 o  158.758   1.3663  1027.55   17.682  1024.93   26.479  1029.66   23.753  158.526   2.0491  158.902   1.8338 -0.3762054 2.749875 
1 1 1    5    2  -79 o  167.299   1.3788  1141.08   18.804  1147.59   28.228  1135.89   25.212  167.746   2.0644  166.899   1.8531 0.8469543 2.774162 
1 1 1    5    2  -78 o   75.348   1.5090  231.466   9.2683  222.230   12.716  241.934   13.537   73.787   2.1163   76.989   2.1592 -3.202156 3.023402 
1 1 1    5    2  -77 o  158.843   1.4181  1028.64   18.362  1062.98   30.319  1008.75   23.075  161.436   2.3040  157.286   1.7998 4.149933 2.923615 
1 1 1    5    2  -76 o   84.765   1.3849  292.922   9.5689  311.742   15.629  281.637   12.102   87.402   2.1954   83.109   1.7864 4.292236 2.830376 
1 1 1    5    2  -75 o  202.434   1.5573  1670.73   25.698  1653.84   41.514  1681.22   32.720  201.357   2.5293  203.049   1.9769 -1.691696 3.210179 
1 1 1    5    2  -74 o   89.530   1.3621  326.771   9.9404  344.570   16.245  316.118   12.568   91.920   2.1681   88.052   1.7510 3.867867 2.786844 
1 1 1    5    2  -73 o  390.847   2.3144  6230.13   73.737  6236.74  110.786  6224.88   98.800  390.898   3.4768  390.583   3.1032 0.3147583 4.660281 
1 1 1    5    2  -72 o  110.838   1.2535  500.800   11.325  499.138   17.005  502.125   15.182  110.642   1.8854  110.977   1.6783 -0.3352585 2.524172 
1 1 1    5    2  -71 o  231.040   1.5759  2176.21   29.679  2188.17   44.724  2166.79   39.674  231.635   2.3687  230.514   2.1114 1.120087 3.173094 
1 1 1    5    2  -70 f   8.8888   3.8745  -1.0866   5.2755  -2.2302   8.0431  -0.2232   6.9888   10.787   4.7407   10.670   4.5529 0.1172228 6.572906 
1 1 1    5    2  -69 o  259.222   1.6935  2739.54   35.784  2696.60   53.201  2775.01   48.358  257.136   2.5382  260.864   2.2741 -3.728546 3.407924 
1 1 1    5    2  -68 o  297.317   1.9772  3604.24   47.918  3613.19   78.633  3598.96   60.437  297.589   3.2416  297.065   2.4958 0.5239868 4.091063 
1 1 1    5    2  -67 o   39.769   1.9803   64.645   6.3996   56.998   10.740   68.855   7.9689   37.202   3.5860   41.021   2.3935 -3.819675 4.311388 
1 1 1    5    2  -66 o  202.529   1.5474  1672.13   25.546  1623.00   41.279  1702.63   32.523  199.495   2.5384  204.354   1.9524 -4.859695 3.202413 
1 1 1    5    2  -65 o   57.439   1.6878  134.614   7.8939  151.210   16.170  129.421   9.0449   60.795   3.2751   56.307   1.9737 4.487698 3.823807 
1 1 1    5    2  -64 o  265.824   1.8209  2880.75   39.457  2833.25   64.028  2909.84   50.100  263.567   2.9802  267.142   2.3007 -3.575745 3.764928 
1 1 1    5    2  -63 o   12.993   4.4930   6.1925   5.7897   7.6990   11.155   5.6370   6.7735   16.259   6.1472   13.173   4.8264 3.085986 7.815519 
1 1 1    5    2  -62 o  315.546   2.2022  4059.46   56.644  4094.39  106.973  4045.85   66.773  316.775   4.1427  314.997   2.6005 1.777466 4.891304 
1 1 1    5    2  -61 o  179.081   1.5540  1307.28   22.685  1269.15   42.015  1322.96   26.950  176.418   2.9217  180.147   1.8353 -3.728882 3.450264 
1 1 1    5    2  -60 o  115.619   1.2896  544.883   12.154  550.181   19.724  541.640   15.431  116.171   2.0828  115.271   1.6423 0.9001694 2.652399 
1 1 1    5    2  -59 o  284.707   1.7948  3304.22   41.654  3283.71   62.296  3320.81   56.017  283.793   2.6929  285.402   2.4078 -1.608795 3.612403 
1 1 1    5    2  -58 o  173.311   1.3488  1224.32   19.055  1219.85   28.547  1227.91   25.591  172.986   2.0245  173.559   1.8089 -0.5738831 2.714839 
1 1 1    5    2  -57 o  120.053   1.2386  587.460   12.121  585.161   18.250  589.275   16.213  119.813   1.8686  120.235   1.6542 -0.4223251 2.495626 
1 1 1    5    2  -56 o  694.059   4.1066 19645.82  232.337 19761.23  330.385 19532.90  326.793  695.875   5.8244  691.848   5.7946 4.027405 8.215942 
1 1 1    5    2  -55 o  584.313   3.7327 13922.01  177.791 14035.84  273.383 13838.58  234.045  586.510   5.7182  582.457   4.9295 4.053223 7.549664 
1 1 1    5    2  -54 o  233.162   1.7828  2215.97   33.885  2204.21   44.700  2231.86   51.955  232.533   2.3582  233.981   2.7240 -1.447678 3.602979 
1 1 1    5    2  -53 o  283.342   2.0284  3272.49   46.850  3241.80   61.530  3314.81   72.270  281.998   2.6767  285.146   3.1092 -3.147888 4.102722 
1 1 1    5    2  -52 o  354.875   2.2566  5133.49   65.277  5147.37   92.445  5119.69   92.186  355.331   3.1916  354.374   3.1913 0.9567871 4.513416 
1 1 1    5    2  -51 o  705.009   4.1673 20266.14  239.489 19827.79  332.197 20740.51  345.575  697.206   5.8452  713.063   5.9454 -15.85675 8.337479 
1 1 1    5    2  -50 o  272.710   1.8516  3031.38   41.160  3112.61   59.124  2954.99   57.336  276.330   2.6248  269.242   2.6125 7.087494 3.703336 
1 1 1    5    2  -49 o  394.386   2.8382  6340.44   91.244  6216.97  110.161  6610.25  162.843  390.512   3.4607  402.623   4.9617 -12.11166 6.049383 
1 1 1    5    2  -48 o  472.619   3.3275  9105.81  128.195  9082.34  156.596  9153.51  223.214  471.985   4.0702  473.755   5.7800 -1.770538 7.069319 
1 1 1    5    2  -47 o  533.308   3.4407 11594.56  149.574 11488.63  196.172 11741.68  231.171  530.825   4.5337  536.604   5.2850 -5.778992 6.963128 
1 1 1    5    2  -46 o  240.293   1.8491  2353.50   36.219  2327.81   47.424  2389.44   56.107  238.973   2.4345  242.111   2.8429 -3.138077 3.742874 
1 1 1    5    2  -45 o  639.111   4.3954 16653.07  228.984 16773.18  281.907 16420.15  392.578  641.361   5.3922  634.430   7.5911 6.931274 9.311355 
1 1 1    5    2  -44 o  239.070   1.8564  2329.60   36.176  2395.33   48.514  2247.26   54.295  242.415   2.4551  234.799   2.8368 7.615952 3.751654 
1 1 1    5    2  -43 o  280.147   2.4143  3199.02   55.132  3253.28   71.363  3118.70   86.830  282.505   3.0989  276.589   3.8512 5.915802 4.943200 
1 1 1    5    2  -42 o  783.940   5.8388 25060.25  373.115 24825.04  477.445 25429.25  598.010  780.127   7.5080  789.393   9.2935 -9.265869 11.94733 
1 1 1    5    2  -41 o  189.149   1.9064  1458.26   29.394  1407.86   36.696  1548.50   49.100  185.848   2.4223  194.905   3.0904 -9.056870 3.926618 
1 1 1    5    2  -40 o  290.955   2.7273  3450.65   64.685  3450.65   64.685   0.0000   0.0000  290.955   2.7273  ?   ?  0.000000 2.727337 
1 1 1    5    2  -39 o  510.639   5.0363 10631.15  209.635 10631.15  209.635   0.0000   0.0000  510.639   5.0363  ?   ?  0.000000 5.036315 
1 1 1    5    2  -38 o  333.562   2.4669  4535.17   67.075  4512.41   81.850  4581.71  117.040  332.717   3.0179  335.243   4.2829 -2.525024 5.239377 
1 1 1    5    2  -37 o  619.227   3.9423 15631.18  198.991 15599.78  235.254 15710.13  373.052  618.581   4.6656  620.637   7.3739 -2.056152 8.725923 
1 1 1    5    2  -36 o  580.223   3.7037 13723.65  175.175 13563.71  205.232 14152.89  336.216  576.813   4.3649  589.098   7.0016 -12.28516 8.250709 
1 1 1    5    2  -35 o  766.084   4.8212 23926.69  301.071 24008.09  399.332 23819.47  458.287  767.304   6.3846  764.221   7.3567 3.082520 9.740809 
1 1 1    5    2  -34 f  668.670   4.5718 18228.06  249.193 18730.46  360.722 17769.43  344.652  677.734   6.5295  660.124   6.4050 17.60925 9.146482 
1 1 1    5    2  -33 o  491.416   3.1737  9843.68  127.131  9864.77  168.165  9815.55  194.216  491.920   4.1938  490.673   4.8558 1.246704 6.416080 
1 1 1    5    2  -32 o  559.913   3.3445 12779.28  152.648 12906.03  217.483 12656.20  214.307  562.644   4.7419  557.173   4.7186 5.471619 6.689602 
1 1 1    5    2  -31 o  461.237   2.6427  8671.47   99.361  8401.96  129.862  9052.05  154.316  453.998   3.5091  471.223   4.0174 -17.22531 5.334171 
1 1 1    5    2  -30 o  321.341   1.9390  4208.80   50.791  4141.62   67.292  4297.74   77.428  318.760   2.5898  324.708   2.9253 -5.948486 3.906963 
1 1 1    5    2  -29 o  129.327   1.1522  681.696   12.147  648.825   15.916  727.547   18.797  126.169   1.5475  133.604   1.7260 -7.434601 2.318190 
1 1 1    5    2  -28 o  407.353   2.3642  6763.65   78.505  6753.21  105.173  6776.78  117.972  407.026   3.1699  407.728   3.5495 -0.7024841 4.758934 
1 1 1    5    2  -27 o  220.542   1.4745  1982.45   26.509  1989.21   35.598  1974.04   39.717  220.915   1.9768  220.069   2.2140 0.8457794 2.968097 
1 1 1    5    2  -26 o  979.212   5.7115 39099.86  455.895 38702.43  638.915 39512.11  650.713  973.984   8.0474  984.112   8.1116 -10.12756 11.42625 
1 1 1    5    2  -25 o   68.794   1.2135  192.894   6.8049  193.021   9.6278  192.767   9.6195   68.816   1.7163   68.771   1.7160 0.4522705E-01 2.427006 
1 1 1    5    2  -24 o  1393.95   8.0845 79284.63  918.622 80850.38  1321.86 77822.13  1277.53  1406.84   11.527  1380.29   11.354 26.55151 16.17984 
1 1 1    5    2  -23 o  233.747   1.6146  2226.99   30.764  2265.45   44.226  2190.94   42.821  235.751   2.3014  231.842   2.2658 3.908707 3.229623 
1 1 1    5    2  -22 f  796.674   4.6726 25879.09  303.439 26110.33  432.857 25655.65  425.491  800.054   6.6373  793.063   6.5818 6.990845 9.347394 
1 1 1    5    2  -21 o  238.803   1.6377  2324.39   31.879  2297.83   44.972  2351.21   45.195  237.428   2.3237  240.170   2.3085 -2.741913 3.275503 
1 1 1    5    2  -20 o  426.866   2.6076  7427.66   90.732  7308.84  126.821  7552.24  129.863  423.407   3.6745  430.399   3.7015 -6.991486 5.215655 
1 1 1    5    2  -19 o  398.422   2.4544  6470.70   79.713  6470.56  112.939  6470.85  112.525  398.390   3.4778  398.399   3.4649 -0.9429932E-02 4.909223 
1 1 1    5    2  -18 o  548.658   3.5049 12272.55  156.752 12223.57  206.771 12338.73  240.364  547.504   4.6331  550.030   5.3610 -2.526062 7.085603 
1 1 1    5    2  -17 o  239.758   1.7601  2343.07   34.398  2316.51   45.278  2379.32   52.900  238.389   2.3300  241.594   2.6862 -3.205170 3.555928 
1 1 1    5    2  -16 o  646.350   4.0870 17034.27  215.331 17181.20  287.100 16845.35  325.561  649.028   5.4267  642.580   6.2154 6.448486 8.251064 
1 1 1    5    2  -15 o  699.807   4.4100 19970.12  251.565 19859.82  331.333 20120.24  386.550  697.741   5.8255  702.195   6.7532 -4.454102 8.918668 
1 1 1    5    2  -14 o  470.810   2.8467  9036.30  109.251  9049.01  154.881  9023.70  154.130  471.091   4.0333  470.432   4.0193 0.6585388 5.694064 
1 1 1    5    2  -13 o  312.577   2.0018  3982.59   51.004  4023.12   72.878  3943.68   71.407  314.146   2.8459  311.030   2.8165 3.116425 4.003978 
1 1 1    5    2  -12 o  292.044   1.8974  3476.53   45.169  3462.03   63.873  3491.03   63.885  291.421   2.6888  292.639   2.6781 -1.218231 3.795014 
1 1 1    5    2  -11 o  485.567   3.3784  9612.55  133.720  9552.52  188.414  9673.46  189.811  483.974   4.7759  487.028   4.7811 -3.053711 6.757859 
1 1 1    5    2  -10 o  352.399   2.5435  5062.36   73.063  4967.19  101.929  5162.92  104.783  349.041   3.5825  355.850   3.6123 -6.809509 5.087554 
1 1 1    5    2   -9 f  468.502   3.2678  8948.62  124.799  8872.10  175.375  9027.12  177.630  466.427   4.6126  470.483   4.6317 -4.056122 6.536712 
1 1 1    5    2   -8 o  184.608   1.5952  1389.11   24.005  1376.85   33.918  1401.42   33.978  183.785   2.2640  185.418   2.2481 -1.633041 3.190542 
1 1 1    5    2   -7 o  737.287   5.0010 22170.73  300.561 22127.17  424.430 22214.55  425.688  736.308   7.0715  737.760   7.0785 -1.451355 10.00553 
1 1 1    5    2   -6 o  407.444   2.6712  6767.50   88.719  6753.08  135.291  6778.37  117.514  406.957   4.0783  407.742   3.5356 -0.7843018 5.397556 
1 1 1    5    2   -5 o   93.976   1.1848  359.961   9.0758  348.602   13.781  368.663   12.061   92.479   1.8281   95.104   1.5558 -2.624947 2.400455 
1 1 1    5    2   -4 o  302.638   2.0810  3733.40   51.338  3667.74   77.375  3785.03   68.617  299.942   3.1646  304.710   2.7625 -4.767731 4.200778 
1 1 1    5    2   -3 o  300.020   2.2329  3669.15   54.608  3430.49   89.913  3808.65   68.739  290.061   3.8027  305.659   2.7588 -15.59808 4.698078 
1 1 1    5    2   -2 o  386.539   2.5518  6090.73   80.404  6154.72  123.880  6044.15  105.692  388.519   3.9116  385.033   3.3675 3.485413 5.161446 
1 1 1    5    2   -1 o  608.961   3.8606 15120.23  191.637 15348.54  296.551 14956.52  251.112  613.374   5.9311  605.566   5.0871 7.808105 7.813892 
1 1 1    5    2    0 o  278.731   2.1101  3166.85   47.943  3212.44   68.510  3123.11   67.115  280.713   2.9940  276.783   2.9747 3.929901 4.220544 
1 1 1    5    2    1 o  620.656   4.2454 15707.92  214.787 15859.20  306.284 15561.55  301.286  623.485   6.0265  617.610   5.9845 5.874390 8.493092 
1 1 1    5    2    2 o  264.448   2.0275  2850.58   43.705  2809.38   61.218  2893.41   62.416  262.515   2.8608  266.412   2.8741 -3.896820 4.055218 
1 1 1    5    2    3 o  490.907   3.4123  9825.20  136.548  9611.77  189.625 10055.06  196.791  485.472   4.7918  496.536   4.8620 -11.06393 6.826453 
1 1 1    5    2    4 o  268.310   2.0504  2934.48   44.844  2900.03   62.908  2970.06   63.942  266.716   2.8935  269.917   2.9062 -3.200806 4.101005 
1 1 1    5    2    5 o  420.634   3.2531  7213.41  111.540  7006.12  172.271  7363.03  146.361  414.460   5.0991  424.932   4.2254 -10.47263 6.622316 
1 1 1    5    2    6 o  376.103   2.9502  5766.63   90.447  5822.52  144.196  5730.38  116.133  377.852   4.6816  374.889   3.8003 2.963287 6.029908 
1 1 1    5    2    7 o  641.106   4.7965 16762.61  250.665 16869.20  398.598 16692.87  322.394  642.831   7.6068  639.636   6.1833 3.195068 9.802865 
1 1 1    5    2    8 o   78.768   1.5811  252.894   10.152  265.087   14.773  241.985   13.974   80.611   2.2504   77.016   2.2282 3.594780 3.166930 
1 1 1    5    2    9 f  335.143   2.9922  4579.03   81.743  4565.65  115.479  4592.47  115.727  334.612   4.2337  335.593   4.2304 -0.9813843 5.985076 
1 1 1    5    2   10 o  228.303   2.2392  2124.65   41.672  2129.90   59.214  2119.51   58.656  228.568   3.1781  228.011   3.1559 0.5577240 4.478832 
1 1 1    5    2   11 o  231.226   2.0199  2179.34   38.071  2117.70   48.335  2280.09   61.792  227.924   2.6015  236.490   3.2054 -8.566071 4.128274 
1 1 1    5    2   12 o  312.919   2.5302  3991.58   64.540  3917.15   82.244  4110.88  104.124  309.970   3.2550  317.519   4.0229 -7.548584 5.174849 
1 1 1    5    2   13 o  150.484   1.5938  923.036   19.551  917.228   30.963  926.887   25.213  150.003   2.5322  150.795   2.0512 -0.7921753 3.258783 
1 1 1    5    2   14 o  456.356   3.5007  8490.89  130.226  8450.60  205.123  8518.09  168.552  455.162   5.5286  457.037   4.5242 -1.874725 7.143795 
1 1 1    5    2   15 o  530.425   4.0170 11471.90  173.686 11251.57  270.289 11626.87  226.683  525.146   6.3141  533.920   5.2084 -8.774048 8.185086 
1 1 1    5    2   16 o  130.391   1.7151  692.998   18.230  678.834   25.582  707.611   25.984  129.047   2.4319  131.754   2.4194 -2.706940 3.430394 
1 1 1    5    2   17 o  411.736   3.1955  6911.17  107.248  6977.58  171.071  6868.18  137.659  413.632   5.0737  410.420   4.1147 3.211731 6.532499 
1 1 1    5    2   18 o  231.551   2.0316  2185.46   38.346  2217.42   61.469  2165.10   49.064  233.221   3.2334  230.463   2.6117 2.757782 4.156405 
1 1 1    5    2   19 o  518.780   4.4059 10973.94  186.318 11106.04  266.169 10847.03  260.898  521.776   6.2580  515.660   6.2069 6.116516 8.814073 
1 1 1    5    2   20 o  205.928   1.8862  1728.50   31.662  1770.08   51.019  1702.46   40.377  208.378   3.0036  204.365   2.4238 4.012238 3.859587 
1 1 1    5    2   21 o  683.888   5.1034 19072.42  284.500 19223.16  453.230 18974.40  365.474  686.310   8.1015  682.010   6.5740 4.299866 10.43318 
1 1 1    5    2   22 f  549.889   4.1556 12328.20  186.271 12224.23  292.548 12399.09  241.566  547.430   6.5559  551.406   5.3744 -3.976135 8.477251 
1 1 1    5    2   23 o  398.563   3.1096  6475.54  101.027  6436.24  159.167  6502.05  130.740  397.299   4.9147  399.354   4.0162 -2.055176 6.346978 
1 1 1    5    2   24 o  881.892   6.5205 31721.45  468.742 32240.91  752.032 31391.42  599.428  888.588   10.382  877.084   8.3842 11.50360 13.34501 
1 1 1    5    2   25 o  243.730   2.1113  2421.33   41.946  2470.70   67.532  2390.32   53.523  246.188   3.3652  242.158   2.7115 4.029922 4.321638 
1 1 1    5    2   26 o  349.486   2.7831  4978.70   79.286  5060.41  127.233  4926.83  101.375  352.310   4.4304  347.647   3.5773 4.662872 5.694322 
1 1 1    5    2   27 o  411.013   3.1965  6886.24  107.094  6891.02  169.814  6883.08  137.996  411.110   5.0673  410.899   4.1200 0.2113037 6.530866 
1 1 1    5    2   28 o  334.511   2.6840  4561.10   73.186  4709.08  118.915  4470.88   92.856  339.868   4.2923  331.175   3.4397 8.692169 5.500460 
1 1 1    5    2   29 o  962.967   7.1087 37819.65  558.005 38220.48  890.942 37560.94  715.781  967.567   11.296  959.459   9.1520 8.108521 14.53836 
1 1 1    5    2   30 o  727.340   5.4155 21569.63  321.079 21600.29  508.461 21549.31  414.082  727.652   8.5723  726.906   6.9883 0.7451782 11.05988 
1 1 1    5    2   31 o  316.378   2.8668  4080.03   73.934  3982.41  145.326  4114.12   85.878  312.523   5.7046  317.692   3.3162 -5.168427 6.598444 
1 1 1    5    2   32 o  411.695   3.5787  6909.15  120.097  7166.83  247.421  6829.73  137.364  419.201   7.2407  409.312   4.1170 9.889343 8.329286 
1 1 1    5    2   33 o  414.456   3.6049  7002.15  121.788  7128.34  175.290  6884.39  169.333  418.140   5.1428  410.925   5.0552 7.215057 7.211373 
1 1 1    5    2   34 f  817.885   7.8283 27284.32  521.910 26589.47  883.638 27656.58  646.780  806.820   13.436  823.288   9.6376 -16.46771 16.53489 
1 1 1    5    2   35 o  264.164   2.5077  2844.37   53.999  2880.24   77.625  2810.74   75.166  265.813   3.5825  262.588   3.5117 3.225739 5.016614 
1 1 1    5    2   36 o  382.181   3.0152  5953.78   93.934  6164.18  125.016  5680.97  142.353  388.859   3.9440  373.292   4.6782 15.56705 6.118901 
1 1 1    5    2   37 o  131.214   1.4794  701.747   15.824  730.226   23.395  677.732   21.483  133.848   2.1443  128.948   2.0439 4.900360 2.962312 
1 1 1    5    2   38 o  820.445   5.5568 27445.96  371.626 27476.64  526.205 27415.42  524.915  820.739   7.8653  819.825   7.8547 0.9139404 11.11574 
1 1 1    5    2   39 o  171.643   1.4922  1200.80   20.878  1168.56   27.400  1245.44   32.239  169.321   1.9852  174.801   2.2625 -5.479797 3.009989 
1 1 1    5    2   40 o  439.572   2.8789  7876.17  103.156  7992.77  138.218  7729.57  154.987  442.795   3.8294  435.430   4.3666 7.364624 5.807832 
1 1 1    5    2   41 o  494.041   3.4598  9949.58  139.332  9951.39  170.579  9945.94  241.520  494.065   4.2355  493.868   5.9994 0.1977234 7.343846 
1 1 1    5    2   42 o  941.279   5.8819 36129.27  451.309 36558.52  603.203 35583.44  680.206  946.673   7.8168  933.836   8.9358 12.83630 11.87227 
1 1 1    5    2   43 o  112.552   1.4251  516.329   13.074  529.160   18.114  502.373   18.891  113.940   1.9503  111.019   2.0875 2.921913 2.856752 
1 1 1    5    2   44 o  326.083   2.2603  4334.08   60.080  4384.99   80.511  4270.10   90.254  327.983   3.0114  323.651   3.4210 4.331726 4.557608 
1 1 1    5    2   45 o  535.241   3.4444 11678.52  150.281 11778.14  200.413 11550.55  227.148  537.480   4.5743  532.234   5.2356 5.246155 6.952437 
1 1 1    5    2   46 o  391.203   2.8231  6238.35   90.027  6331.98  129.178  6149.92  125.535  394.101   4.0211  388.395   3.9651 5.705658 5.647225 
1 1 1    5    2   47 o  897.826   6.0700 32875.75  444.237 32824.66  627.398 32927.11  629.097  896.835   8.5821  898.232   8.5920 -1.397156 12.14392 
1 1 1    5    2   48 o  183.755   1.5617  1376.28   23.393  1367.65   31.146  1387.45   35.431  183.175   2.0859  184.494   2.3560 -1.319138 3.146698 
1 1 1    5    2   49 o  461.956   2.8175  8699.14  106.097  8628.62  149.087  8771.49  151.020  460.043   3.9756  463.836   3.9942 -3.792297 5.635567 
1 1 1    5    2   50 o  350.734   2.3780  5014.35   67.986  5005.25   89.951  5026.47  103.830  350.399   3.1493  351.129   3.6276 -0.7298584 4.803877 
1 1 1    5    2   51 o  677.688   4.2887 18726.28  236.914 18749.70  313.752 18695.22  361.364  678.002   5.6770  676.933   6.5488 1.069702 8.666917 
1 1 1    5    2   52 o  564.351   3.8987 12985.96  179.350 13019.44  220.243 12920.03  309.010  565.023   4.7819  562.699   6.7369 2.323486 8.261499 
1 1 1    5    2   53 o   91.186   1.3501  338.914   10.035  324.209   13.596  356.510   14.873   89.184   1.8702   93.521   1.9510 -4.336952 2.702598 
1 1 1    5    2   54 o  492.274   3.1867  9879.98  127.873  9905.58  169.647  9846.31  194.589  492.852   4.2227  491.332   4.8586 1.520630 6.437157 
1 1 1    5    2   55 o  578.726   3.9948 13658.01  188.454 13487.51  263.891 13835.46  269.216  574.949   5.6306  582.314   5.6716 -7.364563 7.991974 
1 1 1    5    2   56 o  192.115   1.7015  1504.45   26.646  1447.00   45.148  1535.15   33.009  188.392   2.9399  194.061   2.0867 -5.668869 3.605177 
1 1 1    5    2   57 o  225.778   1.7310  2077.88   31.857  2027.41   48.153  2117.17   42.483  223.000   2.6490  227.892   2.2869 -4.891785 3.499581 
1 1 1    5    2   58 o  185.374   1.5553  1400.71   23.502  1371.57   35.810  1422.76   31.149  183.422   2.3951  186.820   2.0454 -3.398026 3.149641 
1 1 1    5    2   59 o  328.917   2.1166  4410.35   56.749  4347.34   79.609  4475.44   80.916  326.523   2.9910  331.299   2.9962 -4.775635 4.233611 
1 1 1    5    2   60 o  156.027   1.3558  992.317   17.244  983.034   24.471  1001.47   24.304  155.288   1.9332  156.738   1.9022 -1.450104 2.712174 
1 1 1    5    2   61 o  152.101   1.3430  943.012   16.651  910.948   23.367  976.090   23.734  149.485   1.9177  154.738   1.8816 -5.253113 2.686638 
1 1 1    5    2   62 o   98.523   1.2587  395.663   10.109  388.681   14.544  402.188   14.060   97.644   1.8273   99.327   1.7365 -1.683151 2.520786 
1 1 1    5    2   63 o   78.229   1.2925  249.458   8.2419  250.193   11.969  248.796   11.366   78.339   1.8744   78.121   1.7848 0.2181854 2.588183 
1 1 1    5    2   64 o  167.937   1.3943  1149.64   19.087  1128.29   26.925  1171.22   27.061  166.357   1.9855  169.493   1.9586 -3.135818 2.789032 
1 1 1    5    2   65 o   69.867   1.3315  198.985   7.5831  201.423   11.092  196.845   10.391   70.262   1.9385   69.462   1.8367 0.7997055 2.670451 
1 1 1    5    2   66 o   89.072   1.2674  323.410   9.2021  343.991   13.584  305.955   12.510   91.856   1.8142   86.629   1.7716 5.226433 2.535668 
1 1 1    5    2   67 o   52.798   1.4931  113.733   6.4197  105.931   9.4861  120.325   8.7199   50.917   2.2914   54.289   1.9737 -3.371601 3.024276 
1 1 1    5    2   68 o  158.630   1.3683  1025.78   17.693  1010.33   25.110  1041.02   24.935  157.415   1.9569  159.789   1.9144 -2.374222 2.737565 
1 1 1    5    2   69 o  202.515   1.5311  1671.96   25.276  1709.55   36.461  1637.19   35.071  204.754   2.1846  200.375   2.1472 4.378479 3.063105 
1 1 1    5    2   70 f   59.272   1.4311  143.220   6.9146  133.606   10.052  151.855   9.5264   57.200   2.1598   60.997   1.9183 -3.797756 2.888689 
1 1 1    5    2   71 o   46.066   1.6199   86.623   6.0732   91.464   9.0524   82.661   8.1899   47.299   2.3553   44.967   2.2414 2.332500 3.251358 
1 1 1    5    2   72 o  364.978   2.3097  5432.60   68.717  5344.45   96.132  5524.70   98.265  361.895   3.2587  367.945   3.2763 -6.049805 4.620964 
1 1 1    5    2   73 o  194.993   1.6022  1550.17   25.467  1502.98   38.301  1587.56   34.095  191.964   2.4477  197.309   2.1199 -5.344833 3.238087 
1 1 1    5    2   74 o  225.376   1.8705  2071.14   34.363  2100.68   59.749  2056.54   42.006  226.882   3.2307  224.556   2.2948 2.325089 3.962760 
1 1 1    5    2   75 o  254.568   2.0240  2642.65   41.999  2653.48   72.598  2637.21   51.491  254.957   3.4932  254.272   2.4842 0.6852417 4.286466 
1 1 1    5    2   76 o  195.144   1.6107  1552.62   25.622  1481.69   38.311  1610.01   34.464  190.591   2.4659  198.692   2.1279 -8.101761 3.257106 
1 1 1    5    2   77 o  149.032   1.5457  905.540   18.777  888.899   26.774  921.648   26.342  147.630   2.2248  150.329   2.1496 -2.698303 3.093671 
1 1 1    5    2   78 o  163.106   1.5972  1084.68   21.236  1060.48   30.113  1108.63   29.952  161.245   2.2910  164.868   2.2287 -3.623291 3.196252 
1 1 1    5    2   79 o  195.114   1.6172  1552.21   25.722  1579.98   34.849  1518.99   38.123  196.820   2.1721  192.968   2.4236 3.852722 3.254552 
1 1 1    5    2   80 o  161.510   1.6654  1063.64   21.926  1077.16   27.022  1037.60   37.516  162.515   2.0398  159.451   2.8863 3.064163 3.534366 
1 1 1    5    2   81 f  156.855   1.4331  1003.11   18.324  1012.40   26.347  994.399   25.501  157.552   2.0515  156.147   2.0035 1.404770 2.867537 
1 1 1    5    2   82 o  108.982   1.4333  484.251   12.733  469.458   18.388  497.880   17.650  107.283   2.1027  110.488   1.9597 -3.205406 2.874303 
1 1 1    5    2   83 o  194.301   1.5699  1539.37   24.864  1535.91   35.497  1542.70   34.839  194.039   2.2442  194.471   2.1978 -0.4314575 3.141111 
1 1 1    5    2   84 o  188.417   1.6412  1447.66   25.207  1438.77   33.632  1459.04   38.077  187.801   2.1970  189.097   2.4702 -1.295761 3.305865 
1 1 1    5    2   85 o  107.670   1.3850  472.674   12.156  447.301   17.374  497.006   17.014  104.717   2.0354  110.388   1.8908 -5.671333 2.778085 
1 1 1    5    2   86 o  122.926   1.4778  616.174   14.808  612.469   23.404  618.646   19.121  122.512   2.3436  123.153   1.9047 -0.6412964 3.019989 
1 1 1    5    2   87 o   86.011   1.4443  301.666   10.126  288.956   14.728  313.059   13.944   84.127   2.1495   87.602   1.9528 -3.475349 2.904075 
1 1 1    5    2   88 o   86.565   1.4392  305.577   10.156  299.298   14.742  311.248   14.010   85.646   2.1117   87.345   1.9678 -1.699425 2.886376 
1 1 1    5    2   89 o   89.054   1.5838  323.446   11.497  337.198   15.185  304.973   17.600   90.907   2.0492   86.394   2.5018 4.512794 3.233850 
1 1 1    5    2   90 o  100.333   1.5471  410.575   12.653  410.676   16.536  410.432   19.653  100.321   2.0221  100.266   2.4046 0.5432129E-01 3.141832 
1 1 1    5    2   91 o   34.040   3.2526   47.811   8.9155   47.972   10.540   47.409   16.715   34.011   3.8705   33.354   6.3804 0.6573524 7.462587 
1 1 1    5    2   92 f  169.557   1.7403  1172.95   24.054  1166.21   29.170  1187.26   42.518  169.029   2.1171  170.408   3.0609 -1.379227 3.721729 
1 1 1    5    2   93 o  174.383   1.9099  1241.02   27.148  1235.18   34.506  1250.50   43.982  173.902   2.4342  174.866   3.0855 -0.9635620 3.930128 
1 1 1    5    2   94 o   96.214   1.7221  377.724   13.506  397.520   16.442  336.665   23.681   98.680   2.0441   90.650   3.2098 8.029327 3.805381 
1 1 1    5    2   95 f  100.475   1.5564  411.865   12.747  434.933   16.985  382.121   19.288  103.215   2.0188   96.676   2.4495 6.538513 3.174191 
1 1 1    5    2   96 o  116.289   1.5394  551.761   14.592  537.211   19.028  572.538   22.738  114.700   2.0351  118.374   2.3565 -3.673714 3.113620 
1 1 1    5    2   97 o  222.497   1.7982  2020.90   32.614  2008.31   49.963  2030.25   43.052  221.562   2.7664  222.881   2.3696 -1.318192 3.642534 
1 1 1    5    2   98 o   19.032   4.9882   15.507   7.8311  -5.7164   13.011   27.562   9.8061   13.100   5.8766   25.423   4.9097 -12.32253 7.657679 
1 1 1    5    2   99 o  148.897   1.7217  905.205   20.897  864.534   37.153  924.026   25.274  145.214   3.1387  150.379   2.0619 -5.164520 3.755342 
1 1 1    5    2  100 o   74.205   1.7195  224.863   10.401  203.645   16.425  239.066   13.438   70.438   2.8666   76.440   2.1588 -6.001518 3.588611 
1 1 1    5    2  101 o   37.529   2.5348   57.928   7.7089   57.848   12.424   57.978   9.8303   37.218   4.1664   37.436   3.2537 -0.2174034 5.286325 
1 1 1    5    2  102 o   61.410   1.8293  154.251   9.1466  151.297   14.680  156.125   11.694   60.640   2.9790   61.714   2.3287 -1.074131 3.781159 
1 1 1    5    2  103 o  113.944   1.6495  530.451   15.320  521.126   27.993  534.439   18.306  112.567   3.0535  114.314   1.9645 -1.746445 3.630826 
1 1 1    5    2  104 o  121.454   1.5133  602.576   14.982  614.828   23.677  594.394   19.348  122.481   2.3715  120.532   1.9692 1.949135 3.082515 
1 1 1    5    2  105 o   36.404   2.3653   54.570   6.9809   55.671   10.119   53.570   9.6434   36.567   3.4349   35.886   3.3347 0.6806831 4.787373 
1 1 1    5    2  106 o  130.558   1.5236  696.679   16.215  696.526   21.608  696.875   24.532  130.402   2.0328  130.340   2.3089 0.6141663E-01 3.076294 
1 1 1    5    2  107 o   40.054   2.3054   66.066   7.4954   65.717   10.418   66.441   10.792   39.750   3.2434   39.944   3.3452 -0.1945724 4.659426 
1 1 1    5    2  108 o   7.3898   3.5258  -7.6755   5.9154   1.4004   8.8872 -14.8950   7.9264   12.377   5.2006   7.7106   3.7728 4.666507 6.425040 
1 1 1    5    2  109 o  108.582   1.4098  482.072   12.478  476.397   17.958  487.369   17.350  107.752   2.0446  109.018   1.9524 -1.265900 2.827056 
1 1 1    5    2  110 f   62.162   1.7312  158.429   8.7635  168.336   13.825  151.774   11.331   63.824   2.6631   60.706   2.2939 3.117611 3.514888 
1 1 1    5    2  111 f   59.949   1.9056  147.614   9.3003  148.957   13.778  146.491   12.605   59.945   2.8277   59.521   2.6043 0.4234276 3.844245 
1 1 1    5    2  112 o   10.395   4.4725  -0.1149   6.8481  -7.9945   10.122   6.5368   9.2997   10.526   4.8921   14.462   5.5770 -3.936486 7.418533 
1 1 1    5    2  113 o   96.722   1.5278  383.210   12.046  368.394   16.232  401.371   17.971   94.622   2.1045   98.708   2.2335 -4.085403 3.068771 
1 1 1    5    2  114 o   36.218   2.5037   54.477   7.3462   63.188   10.268   45.341   10.515   38.772   3.2794   32.527   4.0536 6.245571 5.214020 
1 1 1    5    2  115 f   57.651   1.8357  136.690   8.6155  147.348   11.874  124.842   12.520   59.653   2.4471   54.760   2.8142 4.892780 3.729395 
1 1 1    5    2  116 o   11.137   4.5276   2.5416   6.4395  -1.3415   9.0074   6.6011   9.2096   11.398   5.0127   14.337   5.5441 -2.939023 7.474292 
1 1 1    5    2  117 o   75.411   1.6201  233.430   9.9591  220.388   13.688  248.101   14.517   72.976   2.3039   77.433   2.3026 -4.457230 3.257266 
1 1 1    5    2  118 o   34.142   2.6212   48.729   7.2392   39.056   10.151   58.739   10.327   29.912   4.2855   37.181   3.4465 -7.269039 5.499431 
1 1 1    5    2  119 o   23.897   3.3986   24.549   6.4338   36.785   9.9809   15.851   8.4155   28.914   4.3711   18.618   5.2947 10.29581 6.865850 
1 1 1    5    2  120 o   20.492   3.9272   18.540   6.3213   19.225   9.7758   18.047   8.2870   20.270   5.6867   19.805   5.1019 0.4647865 7.639843 
1 1 1    5    2  121 o   20.507   4.4045   18.984   7.1429   12.116   9.8611   26.565   10.361   16.652   5.8568   23.832   5.4517 -7.180248 8.001466 
1 1 1    5    2  122 o   18.706   4.8644   16.198   7.4857   12.036   10.820   20.018   10.367   16.702   6.1032   20.409   5.8997 -3.706913 8.488538 
1 1 1    5    2  123 f   13.378   5.0412   6.7585   7.4881   9.9552   10.596   3.5689   10.584   15.715   5.9795   13.423   5.6597 2.291803 8.233299 
1 1 1    5    2  124 o   43.107   2.4941   78.205   8.7266   81.557   12.090   74.559   12.609   43.415   3.4445   41.250   3.7922 2.165802 5.123043 
1 1 1    5    2  125 o   26.874   3.7856   32.067   8.0633   19.918   11.030   46.015   11.818   19.919   6.1645   31.603   4.7329 -11.68417 7.771829 
1 1 1    5    2  126 o   42.141   2.6223   75.339   8.9632   70.324   10.797   86.456   16.076   40.237   3.3215   43.457   4.6084 -3.220249 5.680647 
1 1 1    5    2  127 o   19.735   5.4372   19.183   9.0256   19.987   9.8387   14.917   22.673   19.980   5.7387   18.788   8.1113 1.192623 9.936121 
1 1 1    5    2  128 o   35.913   3.9338   57.766   11.328   59.308   12.698   51.760   25.066   35.982   4.4223   27.817   9.3544 8.165108 10.34707 
1 1 1    5    2  129 o   11.023   4.9103  -0.7217   8.9165   6.6795   11.230 -13.3486   14.668   14.276   5.9102   11.421   5.4766 2.855922 8.057494 
1 1 1    5    2  130 o   11.475   5.0339   0.7234   9.0312   5.4932   11.416  -7.2554   14.765   13.911   5.8724   12.353   5.7957 1.558059 8.250792 
1 1 1    5    2  131 o   19.123   5.7075   18.638   9.5717   21.323   12.131   14.210   15.580   19.939   6.5004   17.361   7.0481 2.578856 9.588075 
1 1 1    5    2  132 o   30.726   4.6515   44.467   11.286   46.264   15.597   42.493   16.351   29.339   6.6730   27.420   7.2181 1.918451 9.830071 
1 1 1    5    2  133 o   16.270   6.0466   12.897   10.697   27.420   15.181  -1.4239   15.074   21.700   7.2797   13.396   6.1333 8.304002 9.518966 
1 1 1    5    2  134 o   19.218   6.5851   20.210   12.427   16.250   20.485   22.516   15.633   18.114   7.7636   19.753   7.3157 -1.638962 10.66740 
1 1 1    5    2  135 o   12.921   5.5611   3.7609   10.593  -7.0796   14.630   15.706   15.357   12.151   5.7224   17.486   7.0337 -5.334731 9.067466 
1 1 1    5    2  136 o   23.128   5.7702   27.790   10.842   25.737   15.144   29.949   15.530   20.854   7.2636   22.367   7.3586 -1.513388 10.33967 
1 1 1    5    2  137 o   17.652   6.0993   16.329   10.669   34.778   15.297  -1.1461   14.887   24.429   7.1962   13.300   6.0915 11.12897 9.428231 
1 1 1    5    3 -136 o   13.034   5.3810   5.5706   9.2741   15.515   11.656 -11.5840   15.309   17.255   6.3299   11.732   5.6176 5.523331 8.463132 
1 1 1    5    3 -135 o   17.988   5.7533   16.843   9.5314   30.611   11.985  -6.8523   15.723   23.966   6.1154   12.576   5.9256 11.38931 8.515346 
1 1 1    5    3 -134 o   10.158   4.7129  -4.5225   9.3301   6.9063   11.701 -24.4721   15.460   14.220   5.9709   10.272   5.0732 3.948947 7.835083 
1 1 1    5    3 -133 o   10.788   4.9058  -2.2151   9.4367  -3.5849   12.019  -0.0133   15.238   11.731   5.4096   13.674   6.2243 -1.942403 8.246556 
1 1 1    5    3 -132 o   18.139   5.7784   16.939   9.6224   13.896   12.120   22.128   15.825   16.767   6.3916   19.675   7.3465 -2.908464 9.737720 
1 1 1    5    3 -131 f   16.649   5.4960   13.754   8.6605   11.418   10.405   19.022   15.625   15.673   5.9343   18.746   7.2288 -3.072826 9.352652 
1 1 1    5    3 -130 o   19.813   5.2823   19.520   8.6867   20.323   10.471   17.747   15.558   19.777   5.9847   18.418   7.1826 1.359653 9.349147 
1 1 1    5    3 -129 o   14.155   5.3280   8.5926   8.3592   6.7369   9.9831   12.946   15.291   13.853   5.6353   17.002   6.9522 -3.148283 8.949277 
1 1 1    5    3 -128 o   9.1900   4.3217  -6.5160   8.2918 -12.1586   9.9063   6.6885   15.154   9.1507   4.4167   15.387   6.6371 -6.236034 7.972362 
1 1 1    5    3 -127 o   28.332   3.8678   36.031   8.6997   31.893   10.397   45.695   15.887   25.768   5.1302   29.408   6.7679 -3.639069 8.492562 
1 1 1    5    3 -126 o   23.697   4.5516   26.166   8.4727   17.295   10.070   47.659   15.676   18.576   5.9107   30.389   6.5232 -11.81298 8.802773 
1 1 1    5    3 -125 o   18.458   5.5970   16.745   9.1513   23.970   11.574   4.6925   14.949   21.634   6.2274   15.044   6.5402 6.590341 9.030715 
1 1 1    5    3 -124 o   16.736   5.6371   13.238   9.1025   14.848   11.569   10.623   14.748   17.633   6.3292   16.677   6.8245 0.9561481 9.307706 
1 1 1    5    3 -123 o   34.684   4.5609   54.495   12.583   54.495   12.583   0.0000   0.0000   34.684   4.5609  ?   ?  0.000000 4.560938 
1 1 1    5    3 -122 o   24.204   6.0922   28.712   12.009   28.712   12.009   0.0000   0.0000   24.204   6.0922  ?   ?  0.000000 6.092166 
1 1 1    5    3 -121 o   46.265   2.7692   90.277   10.396   89.379   13.687   91.501   15.981   45.421   3.7296   45.474   4.3649 -0.5261230E-01 5.741309 
1 1 1    5    3 -120 o   25.968   3.6283   29.317   7.4709   30.715   10.511   27.891   10.620   25.818   5.1750   24.416   5.4719 1.402302 7.531437 
1 1 1    5    3 -119 o   13.233   4.8170   6.7371   6.7310   20.033   10.005  -4.2574   9.0979   20.658   5.7373   10.528   4.7989 10.13052 7.479703 
1 1 1    5    3 -118 o   43.600   2.1480   78.803   7.6104   64.054   11.340   90.889   10.265   38.683   3.6390   46.603   2.7140 -7.919918 4.539653 
1 1 1    5    3 -117 o   11.832   4.5903   4.2483   6.3284   3.5794   9.7626   4.7331   8.3110   13.350   5.5172   13.073   5.2027 0.2771444 7.583369 
1 1 1    5    3 -116 o   32.820   2.6344   45.003   6.9885   51.479   10.653   40.112   9.2591   34.664   3.8343   30.569   3.7974 4.095613 5.396506 
1 1 1    5    3 -115 o   51.768   1.9307  110.414   8.1331   96.428   11.916  122.612   11.128   47.978   3.0629   54.354   2.5185 -6.375977 3.965359 
1 1 1    5    3 -114 o   32.145   2.7689   43.193   7.1847   41.923   10.727   44.226   9.6756   31.112   4.3484   32.202   3.7565 -1.090054 5.746329 
1 1 1    5    3 -113 f   9.1120   4.1032  -2.7731   6.4114   3.2946   9.5921  -7.6731   8.6198   13.291   5.4784   9.5234   4.4553 3.767982 7.061357 
1 1 1    5    3 -112 f   34.006   2.7623   48.212   7.5913   50.691   12.183   46.638   9.7059   34.282   4.4656   33.168   3.6502 1.113697 5.767636 
1 1 1    5    3 -111 o   41.083   2.2415   69.694   7.4781   72.532   11.156   67.379   10.077   41.599   3.3176   40.155   3.1027 1.443756 4.542349 
1 1 1    5    3 -110 o   57.334   1.8267  134.958   8.5264  135.572   12.483  134.421   11.674   57.225   2.6835   57.035   2.5172 0.1908264 3.679345 
1 1 1    5    3 -109 o   49.004   1.9939   98.715   7.9481   98.650   11.529   98.773   10.972   48.754   2.9144   48.827   2.7680 -0.7322693E-01 4.019413 
1 1 1    5    3 -108 o   29.604   2.9578   36.574   7.0422   37.608   10.219   35.639   9.7181   29.634   4.3607   28.866   4.2578 0.7686501 6.094623 
1 1 1    5    3 -107 o   89.556   1.7532  328.393   12.798  326.357   18.036  330.459   18.164   89.037   2.4875   89.595   2.4895 -0.5575104 3.519267 
1 1 1    5    3 -106 o   73.341   1.7228  220.114   10.300  225.297   15.954  216.411   13.486   73.950   2.6510   72.576   2.2824 1.374023 3.498206 
1 1 1    5    3 -105 o   53.785   2.0228  118.665   8.8529  111.595   13.760  123.658   11.564   51.886   3.2701   54.794   2.5964 -2.908131 4.175477 
1 1 1    5    3 -104 o   91.881   1.5827  345.051   11.854  347.198   16.097  342.506   17.521   92.059   2.1451   91.357   2.3548 0.7020569 3.185368 
1 1 1    5    3 -103 f   41.515   2.6104   71.003   8.7890   90.080   15.601   62.134   10.638   46.429   4.1665   38.673   3.4093 7.756279 5.383569 
1 1 1    5    3 -102 o   80.218   1.8144  263.064   11.864  261.390   20.287  263.934   14.626   79.667   3.1300   80.257   2.2379 -0.5905533 3.847711 
1 1 1    5    3 -101 o   61.456   2.0686  154.650   10.348  165.365   17.624  149.013   12.784   63.301   3.4284   60.241   2.6095 3.059605 4.308492 
1 1 1    5    3 -100 o  105.638   1.5940  455.681   13.726  458.166   20.848  453.780   18.236  105.796   2.4175  105.340   2.1237 0.4557419 3.217864 
1 1 1    5    3  -99 o   97.280   1.7721  386.520   14.052  374.143   23.813  393.132   17.406   95.461   3.0642   98.056   2.1776 -2.594696 3.759184 
1 1 1    5    3  -98 o   88.382   1.6331  318.895   11.765  328.293   16.735  309.710   16.544   89.574   2.2939   86.994   2.3351 2.579948 3.273281 
1 1 1    5    3  -97 o  165.553   1.6479  1118.77   22.239  1118.80   29.720  1118.73   33.523  165.457   2.2036  165.391   2.4865 0.6626892E-01 3.322443 
1 1 1    5    3  -96 o   93.742   1.5836  358.609   12.101  360.124   16.902  357.016   17.332   93.883   2.2086   93.470   2.2748 0.4129410 3.170581 
1 1 1    5    3  -95 o   35.541   2.8182   51.992   8.0979   52.332   11.149   51.613   11.782   35.496   3.9183   35.201   4.1879 0.2946205 5.735124 
1 1 1    5    3  -94 o  107.680   1.6077  473.102   14.112  460.207   21.301  483.189   18.839  106.124   2.4624  108.777   2.1247 -2.653412 3.252318 
1 1 1    5    3  -93 f   77.758   1.6295  246.690   10.329  258.831   14.578  234.453   14.636   79.579   2.2496   75.724   2.3741 3.855598 3.270595 
1 1 1    5    3  -92 o   21.016   4.4980   18.820   7.4730   24.641   10.311   12.379   10.846   23.994   5.4021   18.026   6.1527 5.968449 8.187679 
1 1 1    5    3  -91 o  175.550   1.5475  1257.08   22.145  1247.67   31.042  1266.83   31.601  174.821   2.1783  176.155   2.2008 -1.334076 3.096520 
1 1 1    5    3  -90 o   38.514   2.8303   60.939   8.8236   58.234   11.031   65.743   14.703   37.544   3.6504   39.764   4.6221 -2.219696 5.889727 
1 1 1    5    3  -89 o  101.928   1.7577  423.836   14.604  426.666   17.159  416.399   27.816  102.250   2.0587  100.847   3.3886 1.403198 3.964957 
1 1 1    5    3  -88 o  148.180   1.7282  895.656   20.875  870.979   24.622  958.732   39.364  146.098   2.0675  153.161   3.1529 -7.063339 3.770326 
1 1 1    5    3  -87 o   56.172   2.2707  128.984   10.376  126.938   11.923  135.368   21.059   55.696   2.6338   57.301   4.5459 -1.605225 5.253712 
1 1 1    5    3  -86 o   87.815   1.6541  314.507   11.841  301.343   14.850  337.482   19.619   85.939   2.1199   90.880   2.6512 -4.940651 3.394471 
1 1 1    5    3  -85 o  147.469   1.5753  886.847   18.937  884.529   24.380  890.373   30.067  147.248   2.0312  147.699   2.4974 -0.4503326 3.219086 
1 1 1    5    3  -84 f   85.945   1.6745  301.234   11.731  293.922   14.895  313.180   19.039   84.852   2.1552   87.553   2.6709 -2.700577 3.431978 
1 1 1    5    3  -83 o  116.022   1.7310  548.958   16.371  536.686   19.272  580.767   31.028  114.704   2.0612  119.211   3.1959 -4.506516 3.802917 
1 1 1    5    3  -82 o  209.816   2.0924  1795.67   35.786  1798.16   39.906  1785.46   80.871  209.941   2.3319  208.876   4.7497 1.065399 5.291266 
1 1 1    5    3  -81 o   39.723   4.2501   65.245   13.548   65.245   13.548   0.0000   0.0000   39.723   4.2501  ?   ?  0.000000 4.250112 
1 1 1    5    3  -80 o  141.028   1.6704  811.007   19.202  799.826   23.516  833.381   33.266  140.035   2.0601  142.895   2.8560 -2.859467 3.521429 
1 1 1    5    3  -79 o   23.262   4.0308   22.746   7.3666   22.737   9.6297   22.758   11.438   23.113   5.2333   23.136   6.0112 -0.2250481E-01 7.970019 
1 1 1    5    3  -78 o  179.532   1.5164  1314.15   22.192  1314.97   31.087  1313.29   31.691  179.558   2.1239  179.440   2.1666 0.1175232 3.033977 
1 1 1    5    3  -77 o  148.485   1.5381  898.925   18.617  890.204   23.945  912.256   29.603  147.746   1.9882  149.543   2.4285 -1.797485 3.138510 
1 1 1    5    3  -76 o  133.042   1.3935  721.610   15.113  732.462   21.176  710.346   21.575  134.021   1.9384  131.980   2.0054 2.041275 2.789065 
1 1 1    5    3  -75 o  178.418   1.4936  1297.82   21.722  1296.80   30.397  1298.89   31.052  178.322   2.0912  178.463   2.1345 -0.1410675 2.988199 
1 1 1    5    3  -74 o   56.642   1.6652  130.923   7.6802  144.596   10.694  116.359   11.037   59.503   2.2086   53.348   2.5453 6.154724 3.369968 
1 1 1    5    3  -73 f  183.751   1.5020  1376.55   22.497  1378.97   31.651  1374.07   31.984  183.887   2.1115  183.559   2.1376 0.3282318 3.004609 
1 1 1    5    3  -72 o   93.414   1.3696  355.737   10.429  362.531   14.580  348.620   14.924   94.292   1.8969   92.463   1.9800 1.828636 2.742042 
1 1 1    5    3  -71 o  116.717   1.3519  555.353   12.862  557.990   18.048  552.631   18.336  116.982   1.8926  116.418   1.9322 0.5642471 2.704692 
1 1 1    5    3  -70 o   17.479   4.3556   12.971   6.1832   14.500   9.0493   11.633   8.4684   18.705   5.5414   17.041   5.4200 1.663960 7.751366 
1 1 1    5    3  -69 o  108.104   1.4288  476.419   12.591  458.962   18.575  491.260   17.126  106.090   2.1479  109.765   1.9141 -3.675140 2.876995 
1 1 1    5    3  -68 o  189.943   1.6167  1470.87   25.032  1503.32   38.256  1446.57   33.103  191.994   2.4444  188.348   2.1561 3.645844 3.259440 
1 1 1    5    3  -67 o  290.789   1.9524  3447.72   46.280  3326.87   63.633  3583.42   67.432  285.594   2.7334  296.397   2.7910 -10.80243 3.906506 
1 1 1    5    3  -66 o  133.385   1.4695  725.291   15.977  747.014   24.700  709.661   20.951  135.349   2.2388  131.929   1.9482 3.419434 2.967721 
1 1 1    5    3  -65 o  151.447   1.5012  935.010   18.533  955.850   28.461  919.667   24.420  153.104   2.2805  150.187   1.9947 2.917221 3.029741 
1 1 1    5    3  -64 o  186.759   1.6147  1421.90   24.581  1442.60   37.750  1406.66   32.388  188.085   2.4622  185.739   2.1392 2.345703 3.261682 
1 1 1    5    3  -63 o  340.292   2.3472  4721.80   65.109  4807.98  100.897  4660.31   85.230  343.276   3.6058  338.012   3.0933 5.264557 4.750810 
1 1 1    5    3  -62 o   94.264   1.4753  362.217   11.336  396.233   17.667  338.412   14.780   98.581   2.1986   91.107   1.9901 7.473267 2.965491 
1 1 1    5    3  -61 o  365.597   2.4849  5450.05   74.052  5435.76  112.938  5460.83   98.079  365.010   3.7958  365.898   3.2884 -0.8876953 5.022063 
1 1 1    5    3  -60 o  113.296   1.5842  523.244   14.630  525.074   25.755  522.372   17.777  113.474   2.7844  113.197   1.9266 0.2774734 3.385932 
1 1 1    5    3  -59 o   87.771   1.6077  314.029   11.502  315.412   19.255  313.262   14.343   87.910   2.6902   87.659   2.0072 0.2508087 3.356531 
1 1 1    5    3  -58 o  269.416   2.3280  2959.24   51.126  3128.74  116.657  2918.94   56.880  276.865   5.1690  267.565   2.6079 9.299500 5.789644 
1 1 1    5    3  -57 o  522.056   4.4656 11119.07  190.034   0.0000   0.0000 11119.07  190.034  ?   ?   522.056   4.4656 0.000000 4.465577 
1 1 1    5    3  -56 f   93.944   1.6062  359.743   12.300  353.726   20.259  363.256   15.480   93.107   2.6721   94.398   2.0117 -1.291306 3.344684 
1 1 1    5    3  -55 o  278.300   2.0158  3157.22   45.729  3153.19   69.407  3160.31   60.788  278.091   3.0618  278.418   2.6785 -0.3266602 4.068048 
1 1 1    5    3  -54 o  606.651   3.6216 15007.21  179.091 15004.64  253.157 15009.79  253.389  606.449   5.1210  606.553   5.1249 -0.1035767 7.244955 
1 1 1    5    3  -53 o  470.745   3.0790  9034.86  118.148  9220.45  158.624  8803.60  177.068  475.496   4.0925  464.582   4.6757 10.91412 6.213694 
1 1 1    5    3  -52 f  627.659   4.3178 16066.17  220.916 16124.61  271.162 15950.81  380.968  628.705   5.2911  625.028   7.4774 3.676636 9.160112 
1 1 1    5    3  -51 o  289.382   2.0769  3413.53   48.992  3532.06   65.970  3267.77   73.156  294.349   2.7494  283.113   3.1700 11.23685 4.196217 
1 1 1    5    3  -50 o  183.303   1.7196  1369.56   25.694  1355.74   30.946  1400.24   46.102  182.373   2.0817  185.330   3.0517 -2.956863 3.694059 
1 1 1    5    3  -49 o  237.801   1.9680  2305.02   38.147  2368.46   47.214  2185.72   64.742  241.046   2.4029  231.543   3.4302 9.502853 4.188098 
1 1 1    5    3  -48 o  333.139   3.0343  4524.24   82.399  4524.24   82.399   0.0000   0.0000  333.139   3.0343  ?   ?  0.000000 3.034327 
1 1 1    5    3  -47 o  423.118   3.0304  7298.13  104.520  7550.07  131.221  6860.88  172.870  430.337   3.7407  410.172   5.1703 20.16550 6.381650 
1 1 1    5    3  -46 o  319.809   2.4140  4169.05   62.931  4273.54   90.024  4069.19   88.006  323.774   3.4110  315.938   3.4172 7.836243 4.828283 
1 1 1    5    3  -45 o  261.580   1.9494  2788.98   41.567  2715.77   53.668  2898.74   65.714  258.117   2.5507  266.664   3.0231 -8.546997 3.955415 
1 1 1    5    3  -44 o  873.165   5.4742 31090.44  389.632 31002.65  513.963 31209.07  597.461  871.760   7.2327  874.520   8.3812 -2.759827 11.07047 
1 1 1    5    3  -43 f   95.490   1.6175  371.658   12.590  360.461   16.055  389.540   20.290   94.039   2.0945   97.724   2.5493 -3.684700 3.299356 
1 1 1    5    3  -42 o  390.409   3.4738  6213.42  110.551  6148.70  154.926  6280.57  157.798  388.333   4.8942  392.475   4.9324 -4.141052 6.948488 
1 1 1    5    3  -41 o  278.016   2.0432  3150.46   46.304  3103.04   60.344  3218.36   72.210  275.909   2.6831  280.984   3.1527 -5.074432 4.139829 
1 1 1    5    3  -40 o  375.109   2.7404  5735.47   83.794  5740.35  102.685  5725.75  144.968  375.258   3.3569  374.749   4.7457 0.5092163 5.812943 
1 1 1    5    3  -39 o   94.473   1.4239  363.772   10.965  383.796   15.838  345.336   15.197   97.036   2.0022   92.046   2.0254 4.990295 2.848050 
1 1 1    5    3  -38 o  257.544   2.0642  2703.56   43.335  2678.70   52.767  2755.05   75.947  256.354   2.5252  259.970   3.5839 -3.615662 4.384148 
1 1 1    5    3  -37 o  960.189   5.9997 37595.38  469.594 37001.52  547.882 39239.39  911.588  952.485   7.0566  980.325   11.408 -27.83997 13.41370 
1 1 1    5    3  -36 o  510.530   3.0774 10624.40  128.069 10656.41  162.488 10571.89  208.092  511.279   3.8988  509.214   5.0132 2.065552 6.350816 
1 1 1    5    3  -35 o  527.823   3.1718 11356.41  136.467 11336.25  172.492 11390.13  223.122  527.334   4.0128  528.549   5.1787 -1.214417 6.551448 
1 1 1    5    3  -34 o  481.329   3.1149  9443.73  122.216  9334.49  143.272  9735.59  234.192  478.525   3.6730  488.632   5.8797 -10.10678 6.932647 
1 1 1    5    3  -33 o  233.643   1.7419  2224.98   33.176  2195.73   39.043  2300.98   62.926  232.100   2.0636  237.588   3.2492 -5.488220 3.849106 
1 1 1    5    3  -32 o  361.610   2.6178  5329.96   77.165  5326.42   94.644  5336.98  133.270  361.482   3.2119  361.818   4.5186 -0.3355103 5.543873 
1 1 1    5    3  -31 o  215.145   1.7824  1886.62   31.259  1865.08   38.210  1930.20   54.357  213.911   2.1913  217.607   3.0644 -3.696365 3.767281 
1 1 1    5    3  -30 o  378.961   2.7242  5853.74   84.154  5780.98  102.223  6006.77  148.240  376.590   3.3300  383.847   4.7378 -7.257416 5.790952 
1 1 1    5    3  -29 o  740.441   5.0353 22352.28  303.915 21872.77  365.425 23428.02  547.335  732.402   6.1209  757.804   8.8605 -25.40167 10.76914 
1 1 1    5    3  -28 o  668.634   4.5611 18226.08  248.594 17997.39  347.811 18464.91  355.442  664.343   6.4227  672.914   6.4800 -8.570496 9.123639 
1 1 1    5    3  -27 o  543.925   3.4774 12060.08  154.179 12223.70  238.345 11942.35  202.175  547.547   5.3401  541.234   4.5825 6.312744 7.036787 
1 1 1    5    3  -26 f  822.596   5.1500 27588.36  345.325 27613.64  528.159 27569.48  456.390  822.787   7.8748  822.211   6.8095 0.5764160 10.41070 
1 1 1    5    3  -25 o  748.738   4.4046 22854.67  268.826 22279.77  372.206 23481.61  388.685  739.170   6.1774  758.839   6.2837 -19.66827 8.811588 
1 1 1    5    3  -24 o  560.996   3.3483 12828.94  153.114 12808.95  216.462 12848.95  216.609  560.516   4.7376  561.391   4.7334 -0.8746338 6.697018 
1 1 1    5    3  -23 o  488.368   2.9473  9721.93  117.330  9630.81  164.810  9815.58  167.072  486.044   4.1598  490.684   4.1770 -4.639832 5.895024 
1 1 1    5    3  -22 o  486.839   2.9386  9661.20  116.615  9588.27  164.142  9735.53  165.707  484.967   4.1521  488.677   4.1599 -3.709747 5.877492 
1 1 1    5    3  -21 f  138.621   1.2464  783.203   14.084  789.701   20.272  777.139   19.581  139.193   1.7866  138.082   1.7397 1.111343 2.493706 
1 1 1    5    3  -20 o  266.033   1.7775  2884.69   38.545  2871.25   54.595  2898.05   54.428  265.406   2.5235  266.642   2.5041 -1.236084 3.555112 
1 1 1    5    3  -19 o  822.149   5.1495 27561.29  345.107 27102.07  519.833 27923.19  461.472  815.035   7.8244  827.389   6.8423 -12.35382 10.39412 
1 1 1    5    3  -18 o  303.163   2.0995  3746.20   51.884  3667.75   78.513  3807.01   69.130  299.956   3.2111  305.605   2.7750 -5.648468 4.244030 
1 1 1    5    3  -17 f  689.441   4.3483 19379.83  244.372 19090.22  368.831 19606.44  326.260  684.115   6.6140  693.369   5.7725 -9.253845 8.778746 
1 1 1    5    3  -16 f  213.030   1.7657  1849.75   30.661  1888.67   54.494  1831.72   37.088  215.246   3.1058  211.986   2.1463 3.259659 3.775304 
1 1 1    5    3  -15 o  335.310   2.4595  4583.01   67.224  4635.39   83.060  4483.54  114.455  337.210   3.0217  331.612   4.2342 5.597992 5.201828 
1 1 1    5    3  -14 o  829.838   5.1974 28082.36  351.572 28649.99  546.996 27682.82  458.916  837.863   8.0089  823.747   6.8345 14.11627 10.52867 
1 1 1    5    3  -13 o  417.145   2.7325  7093.33   92.914  7077.99  141.747  7104.89  123.032  416.650   4.1736  417.460   3.6155 -0.8103027 5.521811 
1 1 1    5    3  -12 o  450.993   2.9300  8291.40  107.716  8122.78  161.890  8425.35  144.290  446.328   4.4497  454.588   3.8939 -8.260162 5.912872 
1 1 1    5    3  -11 o  530.378   3.3954 11468.09  146.797 11577.46  226.105 11388.40  193.006  532.807   5.2060  528.481   4.4803 4.326050 6.868440 
1 1 1    5    3  -10 o   71.099   1.1603  206.040   6.7249  209.057   9.5439  203.064   9.4773   71.617   1.6348   70.583   1.6472 1.033981 2.320765 
1 1 1    5    3   -9 o  172.699   1.4454  1215.64   20.347  1194.18   30.881  1232.10   27.048  171.162   2.2134  173.861   1.9086 -2.699371 2.922590 
1 1 1    5    3   -8 o  580.879   3.4563 13756.28  163.658 13890.92  233.359 13625.97  229.583  583.630   4.9051  578.039   4.8724 5.590698 6.913830 
1 1 1    5    3   -7 f  379.356   2.3531  5866.22   72.766  5783.86  101.812  5952.23  104.036  376.658   3.3160  382.101   3.3402 -5.442108 4.706666 
1 1 1    5    3   -6 o  878.919   5.4931 31508.44  393.551 32291.91  614.124 30962.48  512.650  889.324   8.4715  871.036   7.2202 18.28827 11.13092 
1 1 1    5    3   -5 o  224.727   1.9875  2058.54   36.408  2147.23   59.294  2004.88   46.127  229.499   3.1695  221.771   2.5516 7.728073 4.069001 
1 1 1    5    3   -4 o  386.818   3.0253  6099.85   95.391  6095.32  150.849  6102.86  123.137  386.607   4.7867  386.884   3.9046 -0.2763367 6.177240 
1 1 1    5    3   -3 o  131.557   1.5263  705.436   16.367  688.709   25.773  716.742   21.188  129.982   2.4324  132.604   1.9602 -2.622391 3.123978 
1 1 1    5    3   -2 o  230.860   2.0246  2172.44   38.101  2190.00   60.628  2160.98   48.981  231.773   3.2090  230.242   2.6098 1.530548 4.136303 
1 1 1    5    3   -1 o  364.204   2.6251  5407.21   77.934  5667.15  140.031  5290.56   93.805  372.788   4.6081  360.239   3.1945 12.54858 5.607100 
1 1 1    5    3    0 o  313.854   2.3215  4015.32   59.392  4163.19  105.749  3947.19   71.783  319.535   4.0599  311.169   2.8300 8.366119 4.948948 
1 1 1    5    3    1 o  570.323   3.9233 13262.30  182.392 13393.28  318.483 13198.38  222.492  572.905   6.8197  568.892   4.7979 4.013184 8.338360 
1 1 1    5    3    2 o  336.077   2.4528  4604.17   67.195  4502.69   93.397  4713.05   96.747  332.328   3.4477  340.001   3.4908 -7.672913 4.906353 
1 1 1    5    3    3 o  376.124   2.6965  5766.97   82.673  5716.81  116.115  5818.53  117.735  374.450   3.8041  377.766   3.8234 -3.316040 5.393497 
1 1 1    5    3    4 o  289.172   2.1757  3408.55   51.285  3349.97   71.649  3470.09   73.440  286.659   3.0663  291.753   3.0880 -5.093536 4.351780 
1 1 1    5    3    5 o  268.940   2.2573  2948.31   49.487  2778.69   75.078  3078.62   65.805  261.065   3.5280  274.807   2.9376 -13.74173 4.590899 
1 1 1    5    3    6 o  568.805   4.2862 13192.60  198.735 13155.69  256.023 13248.55  315.234  567.924   5.5304  569.816   6.7868 -1.892395 8.754705 
1 1 1    5    3    7 f  154.266   1.6242  970.001   20.425  980.224   26.475  954.973   32.101  155.073   2.0944  153.059   2.5729 2.014526 3.317602 
1 1 1    5    3    8 o  165.894   1.6788  1121.76   22.703  1144.42   29.576  1089.25   35.421  167.558   2.1654  163.464   2.6583 4.093384 3.428636 
1 1 1    5    3    9 o  811.535   5.4911 26861.43  363.250 26421.90  506.236 27327.92  521.531  804.589   7.7187  818.253   7.8191 -13.66357 10.98709 
1 1 1    5    3   10 o  641.280   4.8024 16770.02  251.042 16557.50  392.480 16917.17  326.586  636.953   7.5592  643.971   6.2215 -7.018372 9.790212 
1 1 1    5    3   11 o  302.123   2.2556  3720.69   55.550  3672.53   77.802  3770.77   79.340  300.144   3.1800  304.132   3.2003 -3.987549 4.511581 
1 1 1    5    3   12 o  504.464   3.5034 10374.92  144.066 10387.58  203.989 10362.32  203.491  504.703   4.9583  504.090   4.9522 0.6134949 7.007826 
1 1 1    5    3   13 o  422.036   2.9837  7260.85  102.647  7281.88  145.541  7240.04  144.793  422.606   4.2249  421.391   4.2153 1.215393 5.968080 
1 1 1    5    3   14 o  254.706   1.9841  2644.35   41.194  2722.36   59.430  2572.21   57.150  258.425   2.8212  251.197   2.7910 7.227249 3.968529 
1 1 1    5    3   15 o  296.020   2.2204  3571.82   53.577  3592.37   76.082  3551.59   75.462  296.855   3.1441  295.166   3.1364 1.689392 4.440972 
1 1 1    5    3   16 f  369.984   2.9201  5580.10   88.068  5652.98  114.739  5475.60  137.394  372.372   3.7801  366.459   4.5995 5.912720 5.953488 
1 1 1    5    3   17 f  541.977   3.7450 11975.09  165.450 12001.45  234.493 11948.96  233.473  542.503   5.3026  541.316   5.2911 1.187073 7.490938 
1 1 1    5    3   18 o  404.097   2.8754  6656.40   94.716  6522.17  131.876  6799.42  136.121  399.973   4.0448  408.385   4.0890 -8.411652 5.751577 
1 1 1    5    3   19 o  599.780   4.5092 14666.89  220.458 15157.25  358.619 14369.00  279.510  609.563   7.2174  593.594   5.7766 15.96887 9.244428 
1 1 1    5    3   20 o  481.197   3.6798  9439.42  144.338  9624.07  232.096  9322.98  184.316  485.800   5.8610  478.186   4.7286 7.613983 7.530676 
1 1 1    5    3   21 f  124.178   1.5306  628.504   15.493  693.518   25.821  591.931   19.366  130.439   2.4284  120.509   1.9715 9.929573 3.127931 
1 1 1    5    3   22 o  616.274   4.6258 15484.23  232.378 15677.14  371.586 15360.32  297.794  619.953   7.3530  613.740   5.9524 6.212830 9.460345 
1 1 1    5    3   23 o  216.729   1.9578  1914.53   34.588  1938.21   55.363  1899.37   44.296  218.056   3.1147  215.865   2.5173 2.190964 4.004796 
1 1 1    5    3   24 o  471.668   3.2977  9068.64  126.790  9008.71  178.390  9129.81  180.241  470.073   4.6555  473.221   4.6725 -3.148468 6.595962 
1 1 1    5    3   25 o   51.285   2.5817  107.478   10.758   0.0000   0.0000  107.478   10.758  ?   ?    51.285   2.5817 0.000000 2.581696 
1 1 1    5    3   26 f  334.044   2.9984  4548.44   81.646  4626.45  165.397  4523.31   93.882  336.838   6.0238  333.113   3.4574 3.724365 6.945503 
1 1 1    5    3   27 o  657.949   6.3508 17652.59  340.609 17132.14  575.026 17933.90  422.754  647.862   10.889  663.085   7.8214 -15.22278 13.40648 
1 1 1    5    3   28 o  666.057   6.4271 18090.42  348.951 17567.03  589.468 18372.78  432.965  656.030   11.023  671.148   7.9140 -15.11761 13.56977 
1 1 1    5    3   29 o  301.053   2.7685  3694.31   67.941  3487.23   92.480  3937.14  100.143  292.481   3.8790  310.775   3.9531 -18.29404 5.538347 
1 1 1    5    3   30 o  182.277   1.9940  1354.23   29.628  1359.34   42.584  1349.44   41.249  182.616   2.8607  181.951   2.7811 0.6653442 3.989777 
1 1 1    5    3   31 o  347.277   2.7812  4915.87   78.732  5049.03  104.148  4738.28  120.272  351.938   3.6304  340.924   4.3278 11.01370 5.648874 
1 1 1    5    3   32 o  533.365   3.6991 11596.55  160.825 11720.54  229.769 11477.45  225.182  536.162   5.2573  530.575   5.2066 5.587585 7.399130 
1 1 1    5    3   33 o  148.660   1.6703  900.756   20.241  965.292   27.693  826.731   29.659  153.891   2.2076  142.417   2.5548 11.47414 3.376440 
1 1 1    5    3   34 o  873.372   5.9035 31102.76  420.288 30918.64  591.516 31290.49  597.279  870.590   8.3352  875.806   8.3663 -5.216553 11.80977 
1 1 1    5    3   35 o  834.624   5.6503 28403.33  384.410 28155.72  539.832 28658.04  547.526  830.806   7.9712  838.181   8.0137 -7.374756 11.30304 
1 1 1    5    3   36 o  118.660   1.6817  573.889   16.266  602.312   21.674  537.232   24.614  121.561   2.1873  114.804   2.6302 6.756737 3.420840 
1 1 1    5    3   37 o  329.537   2.6750  4426.46   71.856  4546.45  116.585  4352.95   91.247  333.948   4.2828  326.779   3.4255 7.168732 5.484227 
1 1 1    5    3   38 o  690.708   4.7167 19450.52  265.563 19482.15  376.540 19419.22  374.592  691.160   6.6834  690.045   6.6596 1.115479 9.434901 
1 1 1    5    3   39 o  622.477   4.2807 15796.79  217.206 15702.67  306.005 15892.36  308.358  620.538   6.0496  624.274   6.0596 -3.736267 8.562477 
1 1 1    5    3   40 o  750.434   4.7320 22960.23  289.462 23611.39  392.382 22182.75  428.753  760.901   6.3262  737.462   7.1323 23.43860 9.533694 
1 1 1    5    3   41 o  120.061   1.4788  587.524   14.473  602.182   20.135  571.855   20.818  121.548   2.0322  118.447   2.1561 3.100647 2.962924 
1 1 1    5    3   42 o  315.453   2.3916  4056.16   61.497  4008.12   87.026  4104.07   86.914  313.564   3.4048  317.296   3.3604 -3.731812 4.783783 
1 1 1    5    3   43 f   82.397   1.8007  276.725   12.095  252.260   14.427  334.575   22.185   78.637   2.2530   90.546   3.0099 -11.90983 3.759738 
1 1 1    5    3   44 o  537.738   3.7452 11788.39  164.167 11723.82  199.993 11921.78  287.444  536.231   4.5754  540.636   6.5225 -4.405640 7.967224 
1 1 1    5    3   45 o  323.600   2.2415  4268.38   59.126  4206.26   77.662  4354.03   91.193  321.225   2.9659  326.810   3.4232 -5.584839 4.529353 
1 1 1    5    3   46 o  428.113   3.0468  7471.39  106.324  7446.98  130.204  7520.23  184.205  427.394   3.7373  429.433   5.2622 -2.039001 6.454349 
1 1 1    5    3   47 o  532.608   4.0557 11565.65  176.079 11612.18  228.283 11497.31  276.657  533.616   5.2482  530.897   6.3929 2.719543 8.271170 
1 1 1    5    3   48 o  421.528   2.7792  7243.26   95.494  7350.80  128.155  7109.01  143.191  424.617   3.7026  417.556   4.2069 7.060730 5.604196 
1 1 1    5    3   49 o  298.566   2.0920  3633.58   50.914  3616.49   67.666  3655.87   77.298  297.851   2.7870  299.460   3.1666 -1.608795 4.218373 
1 1 1    5    3   50 o  178.163   1.4234  1293.80   20.672  1227.44   29.155  1360.88   29.316  173.529   2.0611  182.719   1.9682 -9.189819 2.849967 
1 1 1    5    3   51 o  960.448   7.1059 37652.52  556.328 38162.03  726.585 36930.55  864.903  966.437   9.2231  950.167   11.167 16.26996 14.48325 
1 1 1    5    3   52 f  393.180   3.4859  6303.14  111.724  6568.76  132.760  5658.45  206.829  401.351   4.0579  372.326   6.8148 29.02518 7.931467 
1 1 1    5    3   53 o  365.584   3.2757  5449.31   97.618  5573.56  114.611  5121.00  186.304  369.704   3.8031  354.210   6.4525 15.49463 7.489850 
1 1 1    5    3   54 o  208.442   1.8197  1771.06   30.918  1761.17   43.408  1781.24   44.048  207.847   2.5621  209.027   2.5852 -1.180435 3.639691 
1 1 1    5    3   55 o  207.709   1.6767  1758.61   28.389  1781.67   37.640  1728.19   43.236  209.058   2.2088  205.889   2.5762 3.168900 3.393417 
1 1 1    5    3   56 f  340.703   2.3383  4732.22   64.941  4806.58   86.782  4637.59   97.900  343.337   3.1008  337.224   3.5615 6.113159 4.722186 
1 1 1    5    3   57 o  229.598   1.7735  2148.88   33.192  2223.94   44.692  2056.54   49.567  233.561   2.3474  224.588   2.7075 8.972580 3.583412 
1 1 1    5    3   58 o  400.666   2.8816  6545.85   94.113  6532.44  132.589  6559.46  133.608  400.166   4.0647  400.991   4.0875 -0.8246155 5.764553 
1 1 1    5    3   59 o  195.774   1.7506  1562.41   27.937  1583.10   39.390  1541.47   39.628  197.049   2.4523  194.439   2.5002 2.609222 3.502143 
1 1 1    5    3   60 o  129.261   1.4324  681.083   15.093  650.495   19.415  727.803   23.995  126.319   1.8855  133.609   2.2032 -7.289818 2.899880 
1 1 1    5    3   61 o  352.915   2.4072  5078.38   69.248  5170.55   92.747  4962.25  104.098  356.048   3.1956  348.763   3.6616 7.285095 4.859987 
1 1 1    5    3   62 o   83.311   1.4594  282.932   9.9106  278.833   12.872  288.901   15.531   82.701   1.9094   84.145   2.2664 -1.444473 2.963496 
1 1 1    5    3   63 o  187.280   1.5937  1429.82   24.330  1441.18   32.178  1414.65   37.177  188.008   2.0996  186.257   2.4486 1.750702 3.225567 
1 1 1    5    3   64 o  328.144   2.4542  4391.02   65.646  4426.50   93.063  4355.90   92.615  329.379   3.4661  326.741   3.4773 2.638306 4.909749 
1 1 1    5    3   65 o  164.468   1.6338  1102.76   21.904  1131.78   31.032  1073.94   30.922  166.599   2.2851  162.284   2.3375 4.315033 3.268869 
1 1 1    5    3   66 o  405.850   2.9204  6718.94   96.615  6705.60  136.188  6732.46  137.087  405.278   4.1224  406.086   4.1413 -0.8076477 5.843344 
1 1 1    5    3   67 o  236.267   2.1265  2276.21   40.954  2308.38   64.469  2254.44   53.029  237.851   3.3251  235.097   2.7671 2.754776 4.325902 
1 1 1    5    3   68 o  337.971   2.7486  4659.18   75.722  4752.71  120.672  4598.43   97.252  341.144   4.3394  335.671   3.5543 5.473572 5.609224 
1 1 1    5    3   69 o   90.548   1.5386  334.253   11.356  318.018   15.492  353.107   16.695   88.311   2.1521   93.054   2.2010 -4.743340 3.078341 
1 1 1    5    3   70 o  311.230   2.3587  3950.44   59.840  3907.82   83.638  3995.13   85.651  309.450   3.3157  312.883   3.3583 -3.432770 4.719315 
1 1 1    5    3   71 o  266.411   1.9602  2894.05   42.569  2841.46   55.485  2969.31   66.369  263.935   2.5790  269.768   3.0181 -5.833344 3.969901 
1 1 1    5    3   72 o   91.137   1.4496  338.613   10.769  351.257   14.160  321.266   16.586   92.815   1.8716   88.725   2.2952 4.089821 2.961609 
1 1 1    5    3   73 f  136.022   1.5573  754.326   17.267  743.219   21.039  777.244   30.221  135.007   1.9118  138.031   2.6859 -3.024734 3.296835 
1 1 1    5    3   74 o  151.935   1.6019  941.167   19.839  932.828   24.176  958.357   34.713  151.247   1.9609  153.264   2.7785 -2.016647 3.400793 
1 1 1    5    3   75 o   73.742   1.6563  221.719   9.9565  222.505   12.184  220.140   17.274   73.838   2.0262   73.395   2.8929 0.4438324 3.531943 
1 1 1    5    3   76 o  150.069   1.6022  918.214   19.600  904.935   23.823  946.033   34.481  148.966   1.9619  152.270   2.7780 -3.303558 3.400918 
1 1 1    5    3   77 o  207.417   1.6967  1754.19   28.688  1745.80   37.734  1765.68   44.160  206.887   2.2375  208.035   2.6041 -1.147873 3.433334 
1 1 1    5    3   78 o  108.445   1.4699  479.479   12.994  479.278   17.020  479.760   20.119  108.409   1.9260  108.452   2.2758 -0.4222107E-01 2.981358 
1 1 1    5    3   79 o  199.272   1.6897  1619.20   27.446  1599.08   35.906  1647.48   42.568  197.997   2.2247  200.942   2.5988 -2.944824 3.421002 
1 1 1    5    3   80 o   42.327   2.5042   73.354   8.6018   78.062   11.205   66.598   13.423   43.612   3.1735   40.150   4.1617 3.461151 5.233618 
1 1 1    5    3   81 o  109.477   1.7482  488.745   15.601  495.074   18.952  475.443   27.475  110.170   2.1104  107.868   3.1280 2.301552 3.773308 
1 1 1    5    3   82 o  115.743   1.5656  546.245   14.771  549.474   19.386  541.774   22.808  116.066   2.0490  115.232   2.4282 0.8337708 3.177205 
1 1 1    5    3   83 o  112.234   1.5415  513.633   14.103  530.716   18.640  490.762   21.568  114.067   2.0047  109.670   2.4126 4.396805 3.136741 
1 1 1    5    3   84 f   80.306   1.6468  262.998   10.780  254.645   13.937  275.436   17.008   78.975   2.1669   82.112   2.5441 -3.137123 3.341866 
1 1 1    5    3   85 o  127.814   1.5139  666.180   15.773  667.778   20.751  663.995   24.273  127.943   1.9897  127.559   2.3344 0.3844147 3.067318 
1 1 1    5    3   86 o  200.190   2.0228  1635.03   33.008  1633.08   42.642  1637.96   52.138  200.003   2.6156  200.220   3.1946 -0.2167053 4.128725 
1 1 1    5    3   87 o   72.977   2.1013  217.486   12.487  225.208   16.140  205.971   19.709   74.218   2.6722   70.900   3.4203 3.318008 4.340424 
1 1 1    5    3   88 o   90.590   1.9227  334.819   14.198  339.959   18.317  327.083   22.471   91.219   2.4657   89.412   3.0877 1.807137 3.951398 
1 1 1    5    3   89 o  106.493   1.6861  462.614   14.637  478.338   20.963  447.656   20.446  108.242   2.3759  104.712   2.3953 3.530457 3.373795 
1 1 1    5    3   90 o   60.219   2.1205  148.197   10.393  161.423   14.847  135.491   14.552   62.780   2.9090   57.483   3.1174 5.297432 4.263847 
1 1 1    5    3   91 o   20.705   4.9910   18.323   8.3243   21.007   11.741   15.610   11.804   22.242   6.2291   19.745   6.4106 2.497252 8.938553 
1 1 1    5    3   92 o   43.578   2.6084   77.866   9.2230   73.937   13.145   81.676   12.944   42.305   3.8542   44.517   3.5975 -2.212311 5.272286 
1 1 1    5    3   93 f  131.202   1.6672  702.367   17.831  674.510   24.879  731.789   25.568  128.502   2.3751  133.851   2.3434 -5.348938 3.336523 
1 1 1    5    3   94 o   19.171   5.2369   15.639   8.4137   17.198   11.940   14.103   11.857   20.458   6.4268   19.060   6.4339 1.398312 9.093900 
1 1 1    5    3   95 o  171.056   1.9194  1194.61   26.763  1177.23   41.822  1206.66   34.828  169.593   3.0253  171.818   2.4867 -2.224976 3.916111 
1 1 1    5    3   96 o   31.662   3.3469   41.540   8.5075   44.288   11.346   38.011   12.858   32.521   4.3922   29.862   5.4844 2.658892 7.026446 
1 1 1    5    3   97 o  106.623   1.6507  464.054   14.347  454.632   18.944  476.728   21.971  105.472   2.2034  107.964   2.4965 -2.491241 3.329794 
1 1 1    5    3   98 o   90.617   1.6708  335.254   12.342  335.556   16.293  334.848   18.904   90.600   2.2062   90.421   2.5674 0.1795197 3.385098 
1 1 1    5    3   99 o   36.148   2.8256   53.866   8.2600   48.930   10.840   60.698   12.754   34.248   3.9556   38.149   4.1692 -3.900688 5.747122 
1 1 1    5    3  100 o   66.836   1.8136  182.640   9.8716  173.433   13.081  194.819   15.045   65.039   2.4719   68.902   2.6839 -3.863266 3.648735 
1 1 1    5    3  101 o  133.008   1.5576  722.484   16.887  731.227   22.464  711.122   25.608  133.710   2.0610  131.781   2.3839 1.928696 3.151304 
1 1 1    5    3  102 o  103.817   1.5680  440.268   13.270  439.055   17.601  441.866   20.198  103.584   2.0845  103.852   2.3859 -0.2672882 3.168253 
1 1 1    5    3  103 f   35.298   3.0037   51.606   8.5606   66.183   12.428   38.444   11.809   39.815   3.8783   29.960   5.0124 9.855135 6.337625 
1 1 1    5    3  104 o   41.417   2.5721   70.698   8.6407   59.363   12.269   81.854   12.171   37.610   4.0665   44.405   3.3882 -6.794819 5.293002 
1 1 1    5    3  105 o  100.045   1.6748  409.354   13.658  426.812   19.559  392.739   19.081  101.985   2.3527   97.818   2.3930 4.166924 3.355891 
1 1 1    5    3  106 o   53.764   2.1583  118.747   9.4395  110.137   13.356  127.342   13.343   51.532   3.1952   55.490   2.9607 -3.958286 4.356004 
1 1 1    5    3  107 o   38.487   2.5335   61.208   7.9039   54.352   10.437   70.428   12.103   35.999   3.6051   41.006   3.6592 -5.006901 5.136782 
1 1 1    5    3  108 o   72.542   1.8825  215.863   11.122  231.260   13.486  183.118   19.667   74.997   2.2084   66.215   3.6579 8.781624 4.272851 
1 1 1    5    3  109 o   30.423   3.0090   38.673   7.3643   36.414   9.7687   41.649   11.209   29.163   4.2328   31.116   4.5538 -1.952639 6.217213 
1 1 1    5    3  110 o   14.083   4.8498   7.8316   6.7432   4.4543   9.0445   12.058   10.118   13.524   5.4123   17.210   5.9402 -3.686320 8.036088 
1 1 1    5    3  111 o   12.085   4.7543   3.9079   6.8665   14.282   9.3718  -8.1150   10.089   18.114   5.6942   10.476   4.8740 7.638155 7.495318 
1 1 1    5    3  112 f   21.859   4.9571   21.249   8.6288   25.620   12.396   17.140   12.019   23.641   6.3135   19.754   6.4722 3.887575 9.041515 
1 1 1    5    3  113 f   31.629   3.3029   42.215   8.3902   51.920   11.286   30.224   12.545   34.831   4.0505   25.693   6.0843 9.137619 7.309250 
1 1 1    5    3  114 o   96.698   1.8033  384.099   14.214  400.351   18.838  362.614   21.660   98.456   2.3473   93.371   2.8492 5.085793 3.691566 
1 1 1    5    3  115 o   89.702   1.7164  330.423   12.550  345.339   17.730  315.444   17.768   91.358   2.3829   87.246   2.5009 4.112869 3.454396 
1 1 1    5    3  116 o   54.070   2.0150  120.642   8.8655  113.277   11.868  129.943   13.336   52.090   2.8053   55.734   2.9459 -3.643452 4.067868 
1 1 1    5    3  117 o   34.032   2.8207   48.615   7.7547   38.358   10.480   61.025   11.528   29.539   4.4940   37.736   3.7994 -8.196987 5.884882 
1 1 1    5    3  118 o   51.025   2.0864  107.762   8.6597   96.592   11.660  121.501   12.931   47.910   3.0008   53.775   2.9615 -5.864529 4.216023 
1 1 1    5    3  119 o   42.224   2.3548   74.281   8.0728   72.950   11.036   75.812   11.840   41.416   3.2960   42.127   3.4789 -0.7105446 4.792329 
1 1 1    5    3  120 o   11.700   4.8595   2.5515   7.6271   1.2081   9.5506   4.9165   12.672   12.292   5.2853   14.838   6.2209 -2.545980 8.162952 
1 1 1    5    3  121 o   7.3201   3.5995 -14.3531   7.4979 -11.3165   9.3045 -19.9771   12.663   9.0997   4.3632   9.8310   4.8014 -0.7313757 6.487764 
1 1 1    5    3  122 o   20.360   5.4728   19.795   9.2771   19.981   10.170   18.872   22.645   20.312   5.8346   20.492   8.4290 -0.1801758 10.25135 
1 1 1    5    3  123 o   31.746   3.4056   43.743   8.6750   39.467   10.487   53.012   15.441   29.489   4.5053   33.113   5.9386 -3.624653 7.454152 
1 1 1    5    3  124 o   35.170   3.1215   53.293   8.8560   63.645   10.826   32.359   15.396   38.186   3.5176   24.516   7.2190 13.67033 8.030416 
1 1 1    5    3  125 o   25.246   4.2505   29.076   8.4369   27.683   10.230   32.036   14.917   23.883   5.3841   24.339   7.0889 -0.4564400 8.901752 
1 1 1    5    3  126 o   13.785   5.2846   7.5463   8.3162   16.297   9.9294 -13.0142   15.221   18.097   5.8797   11.778   5.6294 6.318925 8.140149 
1 1 1    5    3  127 o   34.792   3.2766   52.791   9.1833   47.312   10.889   66.290   17.091   32.230   4.2478   36.546   5.9411 -4.316044 7.303502 
1 1 1    5    3  128 o   18.279   5.7835   16.836   9.6533   19.469   12.232   12.488   15.718   19.248   6.5345   17.027   7.0150 2.220745 9.586906 
1 1 1    5    3  129 o   21.533   6.0527   24.114   11.064   30.950   15.603   17.202   15.690   23.226   7.3534   18.313   7.1920 4.912878 10.28580 
1 1 1    5    3  130 o   11.025   5.0797  -4.0219   10.566   0.1504   14.339  -8.9794   15.630   13.539   6.1129   12.388   5.8583 1.150691 8.466817 
1 1 1    5    3  131 f   12.251   5.4426   0.5851   10.880   8.2122   14.653  -8.7866   16.242   15.474   6.5974   12.611   5.9661 2.863583 8.894958 
1 1 1    5    3  132 o   10.276   4.7423  -4.0176   9.2621   1.0101   11.700 -12.4560   15.158   12.667   5.6348   11.620   5.5709 1.046662 7.923734 
1 1 1    5    3  133 o   14.976   5.7039   10.204   9.6471   4.2797   12.292   19.707   15.568   13.691   5.9416   18.810   7.2255 -5.118697 9.354670 
1 1 1    5    3  134 o   11.530   5.0878   0.8074   9.3510  -2.3764   11.623   6.6486   15.744   11.779   5.3901   15.168   6.6505 -3.389356 8.560504 
1 1 1    5    3  135 o   11.975   5.2094   2.1312   9.4965   1.8819   11.871   2.5743   15.827   12.863   5.7014   14.290   6.4397 -1.427089 8.600916 
1 1 1    5    3  136 o   13.650   6.0098   3.4508   12.980 -17.7556   20.357   17.979   16.850   12.756   6.1978   18.200   7.3510 -5.444324 9.615122 
1 1 1    5    4 -135 o   11.016   4.9657  -1.1532   9.4180  -2.6535   11.660   1.6629   15.974   11.724   5.3776   14.155   6.4157 -2.431188 8.371403 
1 1 1    5    4 -134 o   11.488   5.1096   0.2813   9.6164  -2.1365   12.179   4.2846   15.672   12.046   5.5142   14.588   6.5033 -2.542012 8.526366 
1 1 1    5    4 -133 o   15.055   5.7311   10.504   9.7362   22.086   12.431  -7.8767   15.660   19.908   6.5851   12.397   5.8631 7.510816 8.816990 
1 1 1    5    4 -132 o   12.240   5.6202  -2.6292   12.782 -17.5476   23.579   3.5802   15.212   13.744   6.6765   14.387   6.4109 -0.6424789 9.256086 
1 1 1    5    4 -131 f   17.599   6.7247   16.046   13.437   12.766   24.652   17.432   16.028   17.920   8.0597   18.153   7.2248 -0.2334576 10.82383 
1 1 1    5    4 -130 o   19.019   6.3414   19.273   11.522   15.869   16.347   22.634   16.244   17.793   7.2211   19.869   7.4380 -2.075539 10.36665 
1 1 1    5    4 -129 o   26.860   4.7398   34.244   9.9985   33.942   12.733   34.730   16.148   25.474   6.1928   24.435   7.4401 1.039061 9.680160 
1 1 1    5    4 -128 o   13.007   5.4289   4.7584   9.5861   18.491   12.110 -18.2845   15.687   18.737   6.4972   11.166   5.4290 7.571082 8.466861 
1 1 1    5    4 -127 o   10.819   4.9189  -2.6021   9.4801  -6.0568   12.013   3.1020   15.436   11.371   5.3000   14.609   6.4870 -3.237649 8.376768 
1 1 1    5    4 -126 o   10.187   4.7230  -5.0648   9.3455  -9.4668   11.750   2.5163   15.419   10.653   5.0501   14.550   6.4709 -3.897149 8.208332 
1 1 1    5    4 -125 o   9.2847   4.3467  -6.0323   8.2286  -8.6798   9.7934   0.3240   15.175   9.7248   4.6102   14.050   6.3209 -4.325014 7.823568 
1 1 1    5    4 -124 o   21.537   5.1056   22.315   8.8261   22.082   10.707   22.811   15.589   20.890   5.9825   20.562   7.3509 0.3282871 9.477696 
1 1 1    5    4 -123 o   38.690   3.0546   64.334   9.5556   58.849   11.583   76.025   16.908   36.360   3.9725   40.141   5.2966 -3.781052 6.620814 
1 1 1    5    4 -122 f   37.626   3.1036   60.755   9.4345   61.828   11.518   58.566   16.446   37.485   3.8230   34.693   6.0345 2.791191 7.143617 
1 1 1    5    4 -121 o   30.196   3.8022   40.063   9.1519   46.111   11.417   29.190   15.308   31.983   4.5038   23.630   7.2534 8.352909 8.537902 
1 1 1    5    4 -120 o   51.300   2.1034  109.426   8.7771  106.363   12.255  112.652   12.577   50.056   3.0175   51.527   3.0074 -1.470123 4.260226 
1 1 1    5    4 -119 o   12.561   4.8440   5.2981   7.0159   6.5142   10.113   4.1699   9.7409   14.359   5.7310   13.354   5.5141 1.004887 7.953002 
1 1 1    5    4 -118 o   11.837   4.7379   3.7305   6.9320   7.2488   10.078   0.5711   9.5501   14.703   5.7670   12.135   5.2517 2.567737 7.799942 
1 1 1    5    4 -117 o   21.990   4.5038   21.660   7.8014   31.458   10.234   8.0656   12.054   26.408   4.9354   15.774   6.2695 10.63489 7.979008 
1 1 1    5    4 -116 o   21.821   4.5581   21.282   7.8460   28.190   10.205   11.297   12.270   24.917   5.1931   17.086   6.4499 7.830730 8.280644 
1 1 1    5    4 -115 f   13.346   5.0469   6.1148   7.5200   10.870   9.7389  -0.9069   11.835   16.319   5.8128   13.094   5.7527 3.225667 8.178128 
1 1 1    5    4 -114 o   40.465   2.7360   68.335   8.9718   61.644   12.545   75.340   12.836   37.861   4.1319   42.063   3.7840 -4.202492 5.602815 
1 1 1    5    4 -113 o   81.832   1.7600  275.012   11.740  276.732   15.107  272.390   18.656   81.853   2.2663   80.908   2.8330 0.9453735 3.627968 
1 1 1    5    4 -112 o   80.470   1.7628  265.856   11.563  265.176   14.806  266.918   18.515   80.146   2.2686   80.121   2.8394 0.2487946E-01 3.634367 
1 1 1    5    4 -111 o   36.283   2.6147   54.743   7.6812   56.544   10.602   52.753   11.144   36.558   3.6045   35.169   3.9558 1.389160 5.351693 
1 1 1    5    4 -110 o   11.123   4.6180   1.7095   6.8833  -3.9410   9.4789   8.0135   10.012   11.045   4.9799   15.348   5.8189 -4.303521 7.658961 
1 1 1    5    4 -109 o   59.809   2.0207  147.119   9.8373  152.286   12.286  137.888   16.422   60.711   2.4878   57.370   3.5286 3.340694 4.317428 
1 1 1    5    4 -108 o   15.052   4.9038   9.4040   6.9042   2.7257   9.4919   16.907   10.061   13.136   5.4354   19.585   5.8529 -6.449633 7.987508 
1 1 1    5    4 -107 o   75.165   1.6839  231.369   10.317  234.719   13.998  227.384   15.265   75.526   2.2764   74.254   2.5257 1.272247 3.400148 
1 1 1    5    4 -106 o   28.612   3.2202   34.308   7.3801   44.585   9.9387   21.675   11.019   32.499   3.8249   22.075   5.9775 10.42350 7.096517 
1 1 1    5    4 -105 o  103.428   1.5554  437.502   13.113  443.894   17.604  429.533   19.654  104.042   2.0758  102.254   2.3580 1.787407 3.141478 
1 1 1    5    4 -104 o   79.738   1.6663  260.071   10.831  256.666   14.436  264.456   16.382   79.070   2.2420   80.189   2.5093 -1.119171 3.364991 
1 1 1    5    4 -103 o   41.328   2.3982   70.316   8.0446   81.785   10.934   56.783   11.878   44.455   3.0357   36.769   4.0287 7.685619 5.044389 
1 1 1    5    4 -102 o   31.706   2.9646   41.705   7.5731   43.091   10.062   39.893   11.502   32.024   3.9372   30.580   4.7699 1.443169 6.184967 
1 1 1    5    4 -101 o   30.038   4.2915   38.135   10.210   39.296   14.304   36.929   14.577   30.033   6.0521   29.024   6.3393 1.009706 8.764409 
1 1 1    5    4 -100 o   98.671   1.8163  397.954   14.609  431.183   23.281  376.371   18.763  102.472   2.7897   95.826   2.4039 6.646461 3.682582 
1 1 1    5    4  -99 o   50.911   2.4419  106.372   10.104  115.503   15.845  100.114   13.118   52.827   3.7030   49.247   3.2866 3.579723 4.951149 
1 1 1    5    4  -98 o   74.147   1.8670  224.771   11.275  220.418   15.698  229.410   16.205   73.314   2.6311   74.791   2.6623 -1.476799 3.743039 
1 1 1    5    4  -97 o   91.903   1.7529  344.926   13.132  352.585   18.643  337.384   18.500   92.795   2.4669   90.765   2.5028 2.029953 3.514195 
1 1 1    5    4  -96 o   60.780   2.0618  151.115   10.200  156.801   13.832  144.338   15.102   61.827   2.7514   59.256   3.1377 2.571167 4.173185 
1 1 1    5    4  -95 o  106.901   1.7387  466.520   15.151  458.679   21.578  474.146   21.280  105.907   2.4994  107.689   2.4242 -1.781471 3.481939 
1 1 1    5    4  -94 o   78.738   1.8567  253.105   11.917  276.462   17.154  231.319   16.567   82.188   2.5636   75.153   2.7088 7.035019 3.729530 
1 1 1    5    4  -93 o   20.092   5.0935   17.284   8.3519   14.884   11.758   19.728   11.866   19.369   6.4043   21.607   6.3307 -2.237938 9.005195 
1 1 1    5    4  -92 o  142.047   1.6867  823.349   19.530  840.337   28.071  807.414   27.189  143.418   2.4011  140.585   2.3725 2.833542 3.375551 
1 1 1    5    4  -91 o   73.203   1.8787  218.848   11.201  191.939   15.617  247.357   16.075   68.464   2.8043   77.766   2.5393 -9.302292 3.783091 
1 1 1    5    4  -90 o   80.200   1.6795  262.416   10.980  263.780   14.486  260.573   16.833   80.348   2.2138   79.821   2.5905 0.5272141 3.407601 
1 1 1    5    4  -89 o  165.837   1.6055  1121.89   21.704  1125.12   28.793  1117.64   33.028  166.021   2.1276  165.427   2.4493 0.5941772 3.244337 
1 1 1    5    4  -88 o  132.701   1.6818  718.365   18.192  700.594   25.705  736.199   25.751  130.988   2.4074  134.281   2.3526 -3.292770 3.366029 
1 1 1    5    4  -87 o  161.145   1.5883  1059.16   20.863  1062.34   27.639  1054.95   31.807  161.342   2.1016  160.746   2.4274 0.5967712 3.210749 
1 1 1    5    4  -86 o   87.458   1.6131  311.973   11.500  318.364   15.321  303.726   17.403   88.327   2.1280   86.218   2.4788 2.108833 3.266923 
1 1 1    5    4  -85 o  290.831   2.1105  3451.29   50.034  3430.73   66.043  3479.00   76.656  289.839   2.7953  291.775   3.2230 -1.936188 4.266343 
1 1 1    5    4  -84 o  206.620   1.7212  1741.25   28.989  1754.49   38.563  1724.06   43.958  207.348   2.2816  205.500   2.6242 1.847916 3.477324 
1 1 1    5    4  -83 o   25.940   3.9270   28.134   8.0439   27.891   9.9014   28.605   13.795   25.667   4.9113   25.873   6.5391 -0.2053013 8.178022 
1 1 1    5    4  -82 o  124.288   1.6317  629.948   16.531  640.818   20.530  609.908   27.876  125.338   2.0095  122.230   2.7978 3.108200 3.444675 
1 1 1    5    4  -81 o   54.020   2.2160  119.249   9.7371  114.764   12.046  127.701   16.538   52.950   2.8009   55.785   3.6570 -2.834373 4.606421 
1 1 1    5    4  -80 o   50.302   2.2752  103.436   9.3052  114.052   12.470   90.099   13.977   52.779   2.9098   46.816   3.6925 5.963665 4.701214 
1 1 1    5    4  -79 o   90.554   1.8579  334.414   13.714  395.606   20.745  286.913   18.278   98.429   2.5878   83.806   2.6790 14.62267 3.724720 
1 1 1    5    4  -78 o  121.269   1.5447  599.631   15.269  617.460   20.490  577.364   22.899  123.040   2.0429  118.964   2.3614 4.076157 3.122441 
1 1 1    5    4  -77 o  196.460   1.8287  1573.95   29.285  1588.73   35.868  1544.40   50.719  197.355   2.2296  194.499   3.1990 2.855331 3.899318 
1 1 1    5    4  -76 o  202.863   2.0047  1678.34   33.150  1675.98   42.370  1682.06   53.228  202.681   2.5645  202.989   3.2168 -0.3081360 4.113986 
1 1 1    5    4  -75 o  213.093   1.8581  1851.67   32.276  1825.37   39.241  1906.67   56.749  211.547   2.2756  216.124   3.2212 -4.576675 3.943935 
1 1 1    5    4  -74 o  103.081   1.9301  433.305   16.218  433.305   16.218   0.0000   0.0000  103.081   1.9301  ?   ?  0.000000 1.930091 
1 1 1    5    4  -73 o  200.852   1.7969  1644.94   29.420  1655.62   36.234  1624.28   50.402  201.481   2.2062  199.500   3.0993 1.980637 3.804362 
1 1 1    5    4  -72 o  107.245   1.5565  468.919   13.607  474.421   16.657  457.885   23.590  107.864   1.8945  105.905   2.7349 1.958832 3.326942 
1 1 1    5    4  -71 o  130.783   1.7329  697.387   18.474  695.734   20.519  704.458   42.447  130.622   1.9271  131.278   3.9712 -0.6561584 4.414077 
1 1 1    5    4  -70 o  188.796   1.7540  1453.31   26.994  1471.50   33.110  1417.25   46.615  189.957   2.1383  186.367   3.0684 3.590057 3.740026 
1 1 1    5    4  -69 o  193.780   1.7742  1531.04   28.025  1536.31   34.230  1520.32   48.808  194.095   2.1635  193.026   3.1020 1.069473 3.781916 
1 1 1    5    4  -68 o  219.540   1.8865  1965.23   33.760  1953.07   41.029  1990.71   59.406  218.838   2.3000  220.865   3.2997 -2.026978 4.022178 
1 1 1    5    4  -67 o  178.761   1.7088  1302.84   24.900  1316.37   30.467  1275.63   43.209  179.673   2.0802  176.824   2.9978 2.848434 3.648852 
1 1 1    5    4  -66 o   50.289   2.0155  103.287   8.2454   99.721   9.8739  111.503   14.988   49.387   2.4604   52.150   3.5469 -2.762669 4.316729 
1 1 1    5    4  -65 o   81.193   1.6317  268.762   10.799  260.728   13.077  285.991   19.150   79.940   2.0084   83.686   2.8112 -3.745956 3.454927 
1 1 1    5    4  -64 o  310.703   2.9030  3937.87   73.525  3898.40  103.103  3978.72  104.880  309.013   4.0931  312.177   4.1215 -3.163269 5.808651 
1 1 1    5    4  -63 o  184.370   2.1211  1386.03   31.878  1336.51   43.973  1440.89   46.279  181.008   2.9802  187.941   3.0208 -6.933350 4.243477 
1 1 1    5    4  -62 o  210.190   2.2576  1801.49   38.680  1793.83   54.355  1809.34   55.056  209.695   3.1799  210.598   3.2071 -0.9024811 4.516327 
1 1 1    5    4  -61 o  410.365   3.6210  6871.19  121.125  6759.58  168.936  6989.26  173.759  406.797   5.0946  413.639   5.1533 -6.842712 7.246487 
1 1 1    5    4  -60 o  185.650   2.1211  1405.24   32.099  1393.13   45.105  1417.67   45.690  184.816   2.9940  186.435   3.0065 -1.619781 4.242964 
1 1 1    5    4  -59 o  178.951   1.8773  1305.53   27.385  1318.75   35.571  1286.30   42.910  179.839   2.4265  177.594   2.9641 2.245117 3.830615 
1 1 1    5    4  -58 o  163.950   1.8213  1095.79   24.340  1083.98   31.323  1113.79   38.671  163.052   2.3567  165.263   2.8706 -2.211533 3.714073 
1 1 1    5    4  -57 o  283.617   2.4286  3279.68   56.146  3251.58   72.090  3322.99   89.512  282.366   3.1320  285.405   3.8476 -3.039001 4.961187 
1 1 1    5    4  -56 o  535.151   3.7294 11681.63  162.687 11703.62  199.504 11637.97  281.070  535.547   4.5700  533.726   6.4604 1.821533 7.913397 
1 1 1    5    4  -55 f  305.409   2.8502  3803.25   70.956  3803.25   70.956   0.0000   0.0000  305.409   2.8502  ?   ?  0.000000 2.850175 
1 1 1    5    4  -54 o   75.846   2.0119  234.671   12.428  240.541   14.324  216.802   24.991   76.779   2.2913   72.780   4.2307 3.999260 4.811357 
1 1 1    5    4  -53 o  614.055   4.6357 15382.77  232.039 15247.37  297.194 15594.20  371.368  611.156   5.9656  617.810   7.3742 -6.654785 9.485071 
1 1 1    5    4  -52 o  317.435   2.6229  4108.08   67.869  3969.27   85.187  4349.30  112.299  311.999   3.3495  326.550   4.2188 -14.55099 5.386792 
1 1 1    5    4  -51 o  199.357   1.9573  1620.07   31.807  1579.10   40.108  1689.50   52.214  196.812   2.5000  203.561   3.1467 -6.749725 4.018955 
1 1 1    5    4  -50 o  171.531   2.3750  1199.43   33.208  1148.08   39.377  1325.88   61.793  167.811   2.8787  180.309   4.2042 -12.49774 5.095324 
1 1 1    5    4  -49 o  138.881   2.2574  786.253   25.556  786.253   25.556   0.0000   0.0000  138.881   2.2574  ?   ?  0.000000 2.257415 
1 1 1    5    4  -48 o  334.033   2.7313  4548.61   74.371  4587.27   96.628  4492.42  116.484  335.425   3.5341  331.910   4.3054 3.514984 5.570088 
1 1 1    5    4  -47 o  417.612   3.2778  7110.13  111.583  7058.12  143.178  7190.57  178.072  416.043   4.2218  419.876   5.2028 -3.833344 6.700241 
1 1 1    5    4  -46 o  229.790   1.9252  2152.32   36.062  2118.90   43.682  2223.85   63.901  227.994   2.3504  233.555   3.3565 -5.561539 4.097601 
1 1 1    5    4  -45 o  308.470   2.5698  3878.79   64.617  3828.95   82.691  3956.97  103.555  306.466   3.3101  311.527   4.0779 -5.060913 5.252249 
1 1 1    5    4  -44 o  292.259   2.4541  3481.75   58.466  3453.55   75.667  3523.54   92.100  291.060   3.1893  293.980   3.8433 -2.920074 4.994238 
1 1 1    5    4  -43 o  350.018   2.5742  4993.96   73.446  5068.90   91.413  4857.47  123.362  352.623   3.1802  345.159   4.3846 7.464050 5.416497 
1 1 1    5    4  -42 o  279.866   2.6747  3192.74   61.019  3218.89   70.853  3117.68  120.059  281.003   3.0932  276.501   5.3267 4.501953 6.159729 
1 1 1    5    4  -41 o  866.252   7.1835 30612.49  507.243 30412.37  582.371 31241.49  1032.47  863.284   8.2758  873.859   14.494 -10.57452 16.69062 
1 1 1    5    4  -40 o  337.496   2.5112  4642.91   69.084  4585.29   84.404  4759.87  120.248  335.386   3.0873  341.684   4.3174 -6.298431 5.307656 
1 1 1    5    4  -39 o  201.320   1.6803  1651.96   27.574  1604.39   36.535  1714.92   42.031  198.396   2.2591  205.115   2.5138 -6.718216 3.379791 
1 1 1    5    4  -38 o  308.075   2.1781  3868.59   54.698  3852.69   72.686  3889.34   83.057  307.432   2.9004  308.885   3.2987 -1.452942 4.392478 
1 1 1    5    4  -37 o  437.803   3.1204  7813.22  111.359  7827.67  158.473  7799.12  156.515  438.175   4.4368  437.376   4.3900 0.7986450 6.241602 
1 1 1    5    4  -36 o  971.809   6.0704 38512.98  480.881 37621.93  623.157 39824.78  756.097  960.311   7.9607  987.843   9.3897 -27.53162 12.31013 
1 1 1    5    4  -35 o  426.995   2.8188  7431.94   98.111  7213.18  126.977  7756.03  154.551  420.646   3.7032  436.171   4.3469 -15.52496 5.710422 
1 1 1    5    4  -34 o  165.855   1.6247  1121.19   21.965  1104.02   27.090  1154.16   37.528  164.578   2.0193  168.270   2.7360 -3.692108 3.400504 
1 1 1    5    4  -33 o  405.189   2.6874  6692.13   88.762  6489.08  114.741  6994.72  140.070  398.980   3.5280  414.219   4.1484 -15.23935 5.445727 
1 1 1    5    4  -32 o  706.146   4.4562 20328.85  256.507 20056.30  335.556 20712.01  397.862  701.327   5.8696  712.639   6.8490 -11.31213 9.020026 
1 1 1    5    4  -31 o  124.566   1.3641  632.437   13.851  636.597   18.670  627.345   20.657  124.974   1.8327  124.062   2.0426 0.9122009 2.744286 
1 1 1    5    4  -30 o  168.486   1.4801  1157.03   20.328  1134.96   26.852  1186.67   31.112  166.869   1.9741  170.627   2.2369 -3.757980 2.983374 
1 1 1    5    4  -29 o  584.328   3.7247 13918.62  177.414 13888.27  234.453 13959.27  271.381  583.651   4.9279  585.111   5.6899 -1.459656 7.527265 
1 1 1    5    4  -28 o  299.252   2.0884  3650.10   50.944  3612.64   67.064  3701.22   78.333  297.707   2.7635  301.329   3.1891 -3.622894 4.219878 
1 1 1    5    4  -27 o  609.464   3.8730 15141.98  192.409 15155.39  254.887 15124.21  293.368  609.690   5.1286  609.030   5.9093 0.6602173 7.824522 
1 1 1    5    4  -26 o  184.268   1.5296  1383.94   22.975  1334.69   29.970  1454.14   35.780  180.957   2.0318  188.880   2.3239 -7.922668 3.086813 
1 1 1    5    4  -25 f  308.056   2.3107  3868.06   58.025  3932.44   83.558  3808.09   80.640  310.598   3.3003  305.649   3.2366 4.949249 4.622525 
1 1 1    5    4  -24 o  352.321   2.5683  5059.62   73.760  5014.74  104.180  5104.72  104.444  350.740   3.6439  353.873   3.6208 -3.132935 5.136892 
1 1 1    5    4  -23 o  396.108   3.1018  6395.65  100.153  6492.42  161.046  6334.62  127.892  399.057   4.9509  394.198   3.9801 4.858398 6.352321 
1 1 1    5    4  -22 o  198.434   1.8629  1604.94   30.134  1519.29   46.652  1666.25   39.473  193.061   2.9644  202.186   2.3950 -9.125534 3.811030 
1 1 1    5    4  -21 o  527.448   3.6535 11340.65  157.080 11207.41  220.165 11478.80  224.179  524.297   5.1515  530.606   5.1831 -6.308899 7.307694 
1 1 1    5    4  -20 o  827.372   6.1291 27913.58  413.362 28336.28  662.117 27643.60  529.149  833.308   9.7475  823.232   7.8853 10.07599 12.53763 
1 1 1    5    4  -19 o  512.883   3.8973 10723.27  162.936 10541.54  253.938 10850.45  212.430  508.444   6.1270  515.880   5.0516 -7.435974 7.940983 
1 1 1    5    4  -18 o  590.530   3.7570 14215.76  180.850 14203.29  276.227 14225.12  239.259  590.197   5.7416  590.683   4.9691 -0.4854736 7.593278 
1 1 1    5    4  -17 o   82.663   1.2659  278.506   8.5302  279.959   13.019  277.413   11.292   82.877   1.9271   82.500   1.6791 0.3772430 2.555960 
1 1 1    5    4  -16 o  149.130   1.3680  906.452   16.630  935.618   25.813  885.755   21.744  151.507   2.0901  147.416   1.8095 4.091324 2.764585 
1 1 1    5    4  -15 o  356.583   2.5856  5182.86   75.155  5200.75  106.609  5165.19  105.965  357.181   3.6616  355.958   3.6520 1.222778 5.171472 
1 1 1    5    4  -14 o  197.893   1.5690  1596.18   25.310  1663.99   39.675  1549.64   32.867  202.047   2.4089  194.984   2.0679 7.063614 3.174771 
1 1 1    5    4  -13 o  381.373   2.7398  5928.63   85.174  5984.57  121.276  5874.19  119.648  383.146   3.8831  379.596   3.8668 3.549500 5.479972 
1 1 1    5    4  -12 o  547.723   3.7833 12229.94  168.914 12252.28  239.243 12207.74  238.521  548.162   5.3542  547.165   5.3478 0.9970093 7.567421 
1 1 1    5    4  -11 o  156.798   1.5122  1002.08   19.328  971.483   26.891  1034.77   27.801  154.383   2.1368  159.332   2.1405 -4.949493 3.024514 
1 1 1    5    4  -10 o  431.515   2.8204  7590.20   99.208  7534.55  150.666  7632.81  131.817  429.893   4.2995  432.703   3.7372 -2.809906 5.696711 
1 1 1    5    4   -9 o  520.157   3.3384 11029.48  141.550 11013.83  215.978 11041.26  187.411  519.723   5.0980  520.398   4.4180 -0.6748047 6.745994 
1 1 1    5    4   -8 o  260.521   1.8729  2766.42   39.774  2788.06   61.126  2750.53   52.379  261.528   2.8673  259.766   2.4736 1.761353 3.786868 
1 1 1    5    4   -7 o  245.756   1.9435  2461.75   38.935  2505.69   68.490  2440.76   47.325  247.923   3.3890  244.703   2.3726 3.220886 4.136954 
1 1 1    5    4   -6 o  153.023   1.3836  954.404   17.258  954.516   26.404  954.320   22.803  153.028   2.1168  153.014   1.8282 0.1419067E-01 2.796931 
1 1 1    5    4   -5 o  533.773   3.1986 11614.43  139.171 11839.42  200.070 11403.49  193.717  538.867   4.5547  528.856   4.4936 10.01111 6.398292 
1 1 1    5    4   -4 o  422.893   2.7715  7290.00   95.539  7272.57  126.155  7313.45  146.295  422.365   3.6642  423.534   4.2375 -1.168152 5.602011 
1 1 1    5    4   -3 o  413.916   2.7191  6983.77   91.742  7045.10  122.255  6904.70  138.801  415.709   3.6078  411.530   4.1377 4.178528 5.489657 
1 1 1    5    4   -2 o  544.008   3.7596 12065.03  166.716 12125.96  236.833 12005.17  234.725  545.308   5.3280  542.587   5.3071 2.721558 7.520135 
1 1 1    5    4   -1 o  344.312   2.5099  4832.36   70.445  4799.16   99.110  4866.27  100.148  343.107   3.5437  345.497   3.5560 -2.390076 5.020209 
1 1 1    5    4    0 f   61.176   1.3466  152.541   6.7152  163.470   10.266  144.368   8.8778   63.297   1.9922   59.486   1.8330 3.811554 2.707203 
1 1 1    5    4    1 o  251.337   1.9713  2574.84   40.387  2568.35   56.993  2581.39   57.240  251.011   2.7854  251.647   2.7905 -0.6361694 3.942738 
1 1 1    5    4    2 o  531.572   3.6787 11519.62  159.403 11346.65  222.591 11701.69  228.379  527.502   5.1766  535.689   5.2301 -8.186646 7.358752 
1 1 1    5    4    3 o  334.924   2.4553  4572.42   67.033  4570.75   94.751  4574.09   94.849  334.845   3.4714  334.967   3.4737 -0.1222229 4.910924 
1 1 1    5    4    4 o  442.344   3.1152  7976.32  112.326  7973.47  158.759  7979.18  158.948  442.226   4.4041  442.385   4.4078 -0.1582947 6.230931 
1 1 1    5    4    5 o  414.983   2.7269  7019.77   92.243  7139.68  142.804  6933.93  120.833  418.474   4.1863  412.417   3.5943 6.057129 5.517642 
1 1 1    5    4    6 o  520.253   3.3393 11033.68  141.616 10978.58  215.480 11075.57  187.892  518.885   5.0945  521.201   4.4225 -2.316223 6.746264 
1 1 1    5    4    7 o  433.893   3.0623  7674.36  108.309  7615.03  186.562  7704.53  133.021  432.143   5.2961  434.728   3.7538 -2.584564 6.491527 
1 1 1    5    4    8 o  294.253   2.0515  3529.22   49.207  3493.55   74.590  3556.71   65.476  292.749   3.1257  295.389   2.7193 -2.640076 4.142997 
1 1 1    5    4    9 o  651.871   4.1232 17324.16  219.096 17320.79  334.634 17326.69  289.863  651.685   6.2994  651.849   5.4552 -0.1647949 8.333134 
1 1 1    5    4   10 o  303.873   2.1045  3763.75   52.128  3862.13   81.191  3694.76   67.994  307.803   3.2359  301.067   2.7706 6.736481 4.259963 
1 1 1    5    4   11 o  536.258   3.4344 11722.91  150.129 11702.90  228.982 11738.00  198.826  535.734   5.2435  536.565   4.5458 -0.8318481 6.939628 
1 1 1    5    4   12 o  362.309   2.4266  5350.62   71.666  5450.49  111.039  5279.31   93.825  365.652   3.7254  359.875   3.1984 5.777252 4.910009 
1 1 1    5    4   13 o  230.040   1.8626  2156.92   34.927  2218.28   50.251  2099.58   48.579  233.283   2.6426  226.956   2.6258 6.327118 3.725344 
1 1 1    5    4   14 o  730.831   4.9667 21776.99  295.884 22122.95  424.216 21449.24  412.900  736.477   7.0663  725.182   6.9849 11.29456 9.935883 
1 1 1    5    4   15 o  326.438   2.4059  4343.53   64.021  4409.51   91.553  4280.39   89.558  328.894   3.4149  324.043   3.3905 4.850800 4.812202 
1 1 1    5    4   16 o  681.831   4.6472 18953.55  258.287 19242.75  370.117 18679.01  360.616  686.907   6.6100  676.775   6.5368 10.13220 9.296354 
1 1 1    5    4   17 o  569.207   3.9201 13207.99  181.887 13225.96  257.535 13190.10  256.922  569.534   5.5473  568.762   5.5416 0.7723389 7.841006 
1 1 1    5    4   18 o  507.550   3.5277 10501.12  145.953 10813.08  211.413 10217.05  201.743  514.990   5.0361  500.599   4.9439 14.39139 7.057275 
1 1 1    5    4   19 o  431.936   3.7301  7605.42  131.332  7662.15  186.712  7549.87  184.767  433.505   5.2838  430.317   5.2674 3.187469 7.460830 
1 1 1    5    4   20 o  303.548   2.7756  3755.81   68.678  3813.43   98.044  3700.30   96.231  305.853   3.9325  301.282   3.9184 4.570618 5.551435 
1 1 1    5    4   21 o  664.817   5.5544 18020.99  301.008 18335.28  431.894 17724.12  419.745  670.457   7.9026  659.194   7.8115 11.26270 11.11176 
1 1 1    5    4   22 o  594.287   4.9954 14398.97  241.995 14688.37  347.960 14127.87  336.778  600.134   7.1129  588.577   7.0195 11.55695 9.993288 
1 1 1    5    4   23 o  189.348   1.8157  1461.32   28.025  1437.11   35.978  1498.67   44.692  187.771   2.3506  191.747   2.8593 -3.976273 3.701475 
1 1 1    5    4   24 o  332.349   2.6812  4502.30   72.637  4628.99  117.626  4424.21   92.349  336.970   4.2823  329.445   3.4388 7.524597 5.492155 
1 1 1    5    4   25 f  395.947   3.1029  6390.46  100.148  6640.04  163.563  6240.77  126.669  403.568   4.9720  391.268   3.9715 12.29990 6.363505 
1 1 1    5    4   26 o  491.803   3.7598  9859.72  150.726  9978.78  241.091  9783.32  193.119  494.698   5.9787  489.866   4.8363 4.831543 7.689887 
1 1 1    5    4   27 o  157.209   1.6840  1007.34   21.580  1031.85   35.039  992.355   27.391  159.105   2.7017  156.033   2.1535 3.071899 3.454967 
1 1 1    5    4   28 o   54.720   1.6387  122.153   7.3011  114.422   10.578  129.187   10.090   52.926   2.4586   56.255   2.2046 -3.329132 3.302295 
1 1 1    5    4   29 o  717.339   4.5205 20978.25  264.333 21048.19  350.881 20886.48  401.947  718.463   5.9913  715.645   6.8903 2.818420 9.130772 
1 1 1    5    4   30 o   27.707   2.6630   31.579   5.9405   24.649   8.4101   38.480   8.3921   24.211   4.4243   30.532   3.4312 -6.320711 5.598897 
1 1 1    5    4   31 o  717.921   4.8908 21013.47  286.215 21116.77  407.038 20912.43  402.538  719.568   6.9395  716.081   6.8962 3.487122 9.783345 
1 1 1    5    4   32 o  406.314   2.9121  6729.45   96.449  6976.41  140.898  6511.68  132.307  413.677   4.1784  399.664   4.0612 14.01321 5.826813 
1 1 1    5    4   33 o  248.967   2.0051  2526.47   40.692  2589.03   59.223  2470.52   56.006  252.023   2.8828  246.188   2.7908 5.834824 4.012382 
1 1 1    5    4   34 o  345.556   2.5539  4867.26   71.938  4848.89  102.137  4885.33  101.341  344.888   3.6330  346.182   3.5912 -1.294250 5.108401 
1 1 1    5    4   35 o  610.919   4.2076 15215.45  209.532 15257.27  297.489 15174.28  295.171  611.678   5.9664  610.014   5.9361 1.664246 8.416325 
1 1 1    5    4   36 o  472.673   3.3326  9107.53  128.404  9184.71  183.474  9033.44  179.764  474.632   4.7422  470.709   4.6850 3.923065 6.666208 
1 1 1    5    4   37 o  408.590   2.9406  6805.18   97.941  6856.97  139.995  6755.54  137.071  410.114   4.1877  407.071   4.1309 3.042969 5.882207 
1 1 1    5    4   38 o  454.990   3.2278  8438.82  119.715  8299.20  167.612  8584.22  171.044  451.173   4.5575  458.854   4.5730 -7.681488 6.456216 
1 1 1    5    4   39 o  365.202   2.9288  5436.67   87.189  5435.04  138.329  5437.75  112.306  365.108   4.6479  365.221   3.7724 -0.1130066 5.986104 
1 1 1    5    4   40 o  320.828   2.6506  4195.70   69.319  4137.98   89.424  4282.58  109.724  318.601   3.4433  324.105   4.1532 -5.503754 5.394912 
1 1 1    5    4   41 o  425.855   3.3316  7392.95  115.652  7270.83  148.018  7584.35  185.307  422.296   4.2999  431.268   5.2712 -8.972504 6.802561 
1 1 1    5    4   42 o  391.072   2.8219  6234.25   89.958  6314.45  111.698  6086.19  151.760  393.564   3.4817  386.344   4.8189 7.219543 5.945082 
1 1 1    5    4   43 o  299.450   2.2802  3655.10   55.660  3546.47   67.155  3893.48   99.480  294.959   2.7930  309.028   3.9491 -14.06952 4.837007 
1 1 1    5    4   44 o  363.662   2.9214  5391.15   86.603  5450.16  112.754  5306.27  135.238  365.625   3.7832  360.740   4.5991 4.885040 5.955175 
1 1 1    5    4   45 o  326.480   2.6811  4345.01   71.351  4407.94   93.072  4255.30  111.122  328.818   3.4724  323.053   4.2198 5.764557 5.464787 
1 1 1    5    4   46 o  491.452   3.7792  9847.39  151.395  9846.84  195.476  9848.22  239.330  491.380   4.8802  491.343   5.9755 0.3735352E-01 7.715149 
1 1 1    5    4   47 o  105.721   1.4910  455.569   12.849  446.203   19.168  463.211   17.316  104.625   2.2476  106.602   1.9927 -1.976868 3.003742 
1 1 1    5    4   48 o  677.265   4.6555 18706.71  257.016 18387.16  356.650 19051.94  370.708  671.252   6.5181  683.261   6.6559 -12.00854 9.315948 
1 1 1    5    4   49 o  493.620   3.4659  9934.77  139.458  9702.31  167.405 10461.95  252.101  487.767   4.2104  506.344   6.1079 -18.57727 7.418476 
1 1 1    5    4   50 o  412.248   2.9582  6928.75   99.409  6937.26  121.790  6911.77  172.072  412.470   3.6223  411.618   5.1284 0.8518982 6.278615 
1 1 1    5    4   51 o  271.202   2.1386  2998.24   47.279  2974.27   57.517  3048.18   83.020  270.105   2.6123  273.404   3.7251 -3.299530 4.549807 
1 1 1    5    4   52 o  259.925   2.5393  2754.34   53.801  2754.34   53.801   0.0000   0.0000  259.925   2.5393  ?   ?  0.000000 2.539273 
1 1 1    5    4   53 o  195.226   1.9316  1553.65   30.739  1552.69   34.258  1557.62   69.629  195.162   2.1534  195.408   4.3713 -0.2464447 4.872937 
1 1 1    5    4   54 o  153.849   1.7523  964.848   21.975  962.368   28.050  968.790   35.358  153.644   2.2397  154.145   2.8140 -0.5010834 3.596483 
1 1 1    5    4   55 f  237.628   2.3899  2302.13   46.293  2311.60   53.475  2273.81   92.478  238.104   2.7552  236.054   4.8061 2.050644 5.539814 
1 1 1    5    4   56 o  289.341   2.4475  3413.29   57.725  3443.34   74.732  3368.84   90.889  290.578   3.1551  287.376   3.8799 3.202728 5.000847 
1 1 1    5    4   57 o   89.719   1.7215  328.134   12.590  336.551   15.988  314.394   20.426   90.857   2.1587   87.759   2.8592 3.097862 3.582584 
1 1 1    5    4   58 o  148.351   1.5973  897.142   19.316  873.556   26.576  923.556   28.124  146.376   2.2273  150.505   2.2924 -4.129288 3.196267 
1 1 1    5    4   59 o  457.466   3.0013  8535.19  111.918  8503.15  147.519  8578.64  171.792  456.494   3.9644  458.424   4.5973 -1.929993 6.070539 
1 1 1    5    4   60 o  219.737   1.7452  1968.42   31.260  1953.23   41.082  1989.32   48.178  218.868   2.3027  220.864   2.6760 -1.996704 3.530336 
1 1 1    5    4   61 o  298.353   2.2877  3629.60   55.638  3565.91   77.327  3697.97   80.114  295.659   3.2085  301.080   3.2643 -5.420410 4.577136 
1 1 1    5    4   62 o  175.004   1.6778  1248.58   23.934  1297.82   34.104  1200.79   33.597  178.400   2.3452  171.600   2.4019 6.800629 3.356895 
1 1 1    5    4   63 o  302.603   2.3115  3734.00   57.017  3816.89   81.564  3654.79   79.735  305.865   3.2714  299.300   3.2682 6.564728 4.624182 
1 1 1    5    4   64 o  217.122   1.8618  1922.05   32.951  1940.19   46.455  1903.68   46.745  218.107   2.6129  216.044   2.6543 2.063721 3.724626 
1 1 1    5    4   65 o  225.252   1.7661  2068.64   32.428  2016.28   42.097  2145.06   50.855  222.357   2.3225  229.324   2.7205 -6.967361 3.577032 
1 1 1    5    4   66 o  147.034   1.4814  881.337   17.755  924.737   23.801  826.874   26.662  150.598   1.9388  142.395   2.2970 8.203064 3.005876 
1 1 1    5    4   67 o  242.337   1.8461  2394.48   36.468  2411.45   48.359  2372.10   55.529  243.160   2.4398  241.141   2.8250 2.019363 3.732691 
1 1 1    5    4   68 o  220.948   1.7561  1990.41   31.628  2068.64   42.564  1893.95   47.262  225.219   2.3185  215.476   2.6908 9.742508 3.551843 
1 1 1    5    4   69 o   79.000   1.6508  254.447   10.630  248.455   12.854  267.411   18.908   78.031   2.0226   80.910   2.8715 -2.878288 3.512289 
1 1 1    5    4   70 o  174.053   1.6870  1235.16   23.934  1222.51   29.144  1261.36   41.948  173.145   2.0649  175.828   2.9268 -2.683548 3.581886 
1 1 1    5    4   71 o   57.798   1.8729  136.356   8.8123  129.870   10.606  150.820   15.838   56.382   2.3125   60.707   3.2120 -4.324886 3.957843 
1 1 1    5    4   72 o   85.506   1.6552  298.094   11.536  323.284   16.685  275.020   15.969   89.000   2.3017   82.079   2.3893 6.921394 3.317638 
1 1 1    5    4   73 o  132.158   1.6005  712.109   17.242  744.038   24.940  682.881   23.863  135.065   2.2653  129.395   2.2624 5.669846 3.201550 
1 1 1    5    4   74 o   86.222   1.6534  303.116   11.621  313.448   16.620  293.232   16.255   87.631   2.3287   84.755   2.3550 2.876564 3.311942 
1 1 1    5    4   75 o  118.648   1.5948  573.974   15.424  580.631   22.098  567.648   21.540  119.311   2.2721  117.971   2.2399 1.340126 3.190563 
1 1 1    5    4   76 o  185.104   1.7629  1397.16   26.599  1389.87   37.714  1404.37   37.521  184.576   2.5066  185.538   2.4809 -0.9617767 3.526750 
1 1 1    5    4   77 o  104.814   1.6520  447.959   14.115  442.894   20.174  452.816   19.755  104.195   2.3753  105.359   2.3002 -1.163689 3.306514 
1 1 1    5    4   78 o  120.221   1.6841  589.358   16.504  585.361   23.547  593.217   23.138  119.783   2.4116  120.586   2.3539 -0.8039246 3.369951 
1 1 1    5    4   79 o  220.993   1.9684  1991.86   35.460  2060.93   44.183  1866.85   59.440  224.754   2.4116  213.801   3.4106 10.95294 4.177133 
1 1 1    5    4   80 o  106.641   1.7325  463.752   15.060  480.287   18.490  431.160   25.959  108.512   2.0904  102.718   3.1039 5.794357 3.742176 
1 1 1    5    4   81 o  219.369   1.9315  1962.76   34.539  1951.94   42.151  1984.86   60.257  218.725   2.3642  220.442   3.3533 -1.717514 4.102915 
1 1 1    5    4   82 o   97.442   1.6819  387.218   13.360  392.149   16.278  377.042   23.383   98.047   2.0367   96.046   2.9903 2.000900 3.618030 
1 1 1    5    4   83 o  100.871   1.5289  414.921   12.572  431.136   16.644  393.382   19.183  102.805   1.9862   98.181   2.3969 4.624016 3.112867 
1 1 1    5    4   84 o  307.123   2.1922  3848.89   54.882  3813.29   72.138  3897.81   84.566  305.568   2.8961  308.828   3.3593 -3.260040 4.435341 
1 1 1    5    4   85 o  124.269   1.5181  629.774   15.378  651.661   20.480  601.482   23.285  126.383   1.9880  121.395   2.3531 4.987915 3.080460 
1 1 1    5    4   86 o  190.399   1.8097  1478.85   28.087  1484.93   39.956  1472.91   39.491  190.704   2.5703  189.933   2.5507 0.7711639 3.621111 
1 1 1    5    4   87 o   77.853   2.0485  247.510   12.989  233.779   16.607  269.142   20.845   75.607   2.6990   81.083   3.1598 -5.475609 4.155604 
1 1 1    5    4   88 o  169.370   1.6093  1170.13   22.218  1112.88   28.704  1255.72   35.094  165.123   2.1325  175.359   2.4551 -10.23648 3.251956 
1 1 1    5    4   89 o   37.218   2.9170   56.962   8.7789   62.962   12.296   50.724   12.537   39.009   3.9201   34.874   4.5163 4.135742 5.980343 
1 1 1    5    4   90 o   62.437   2.0280  159.289   10.308  138.347   14.406  181.260   14.756   58.085   3.0533   66.544   2.7261 -8.458862 4.093209 
1 1 1    5    4   91 o   26.686   3.9058   29.802   8.2448   29.294   11.666   30.309   11.653   26.160   5.6374   26.630   5.5486 -0.4699841 7.909927 
1 1 1    5    4   92 o   32.813   3.0081   44.414   7.9565   41.608   10.353   48.463   12.435   31.579   4.1201   34.034   4.6001 -2.454916 6.175450 
1 1 1    5    4   93 o  162.334   1.6062  1075.30   21.255  1098.25   28.486  1046.46   31.924  163.985   2.1310  160.020   2.4474 3.965317 3.245162 
1 1 1    5    4   94 o   77.787   1.7591  246.987   11.154  252.441   14.876  239.984   16.857   78.563   2.3254   76.550   2.7057 2.012520 3.567719 
1 1 1    5    4   95 o   31.821   3.4012   41.989   8.6856   50.384   11.552   31.071   13.174   34.758   4.1597   26.821   6.1562 7.937201 7.429762 
1 1 1    5    4   96 o   36.845   3.1627   56.058   9.4069   41.022   13.064   72.246   13.556   31.043   5.3563   41.713   4.0372 -10.66911 6.707384 
1 1 1    5    4   97 o   56.165   2.0957  129.115   9.5777  130.658   12.635  127.030   14.685   56.414   2.7559   55.543   3.2577 0.8709183 4.267059 
1 1 1    5    4   98 o   40.294   2.7560   66.835   8.9978   65.136   12.655   68.573   12.796   39.563   3.9781   40.617   3.9131 -1.053505 5.580078 
1 1 1    5    4   99 o   29.997   3.4744   37.500   8.3388   38.406   11.759   36.583   11.827   30.032   4.9773   29.254   5.1477 0.7785244 7.160511 
1 1 1    5    4  100 o  133.482   1.6695  727.957   18.165  704.175   25.463  752.607   25.923  131.120   2.3823  135.564   2.3459 -4.444229 3.343430 
1 1 1    5    4  101 o   27.079   3.5303   30.735   7.6074   33.729   10.274   27.101   11.318   28.130   4.6425   24.929   5.6948 3.201345 7.347394 
1 1 1    5    4  102 o   39.945   2.6312   65.789   8.5197   75.213   12.162   56.709   11.938   42.533   3.5400   36.771   4.0498 5.762493 5.378912 
1 1 1    5    4  103 o   27.658   4.0560   32.411   8.8727   44.502   13.782   23.853   11.595   32.084   5.4656   23.267   6.0558 8.816999 8.157535 
1 1 1    5    4  104 o  107.247   1.6617  470.455   14.527  475.896   20.524  464.992   20.564  107.679   2.3383  106.427   2.3704 1.251122 3.329607 
1 1 1    5    4  105 o   65.713   1.9039  177.055   10.188  181.530   14.306  172.449   14.512   66.355   2.6501   64.640   2.7604 1.715080 3.826659 
1 1 1    5    4  106 o   30.931   3.0053   39.897   7.4820   36.642   10.050   43.943   11.206   29.269   4.3439   32.085   4.4006 -2.816010 6.183429 
1 1 1    5    4  107 o   48.574   2.1088   97.063   8.3300   97.893   11.002   95.948   12.751   48.615   2.7880   47.981   3.2799 0.6338463 4.304769 
1 1 1    5    4  108 o   22.433   4.2690   21.823   7.5212   17.710   9.3810   29.224   12.584   19.978   5.5582   25.453   6.1372 -5.474606 8.280037 
1 1 1    5    4  109 o   28.764   3.3227   34.873   7.6478   36.664   9.6154   31.790   12.617   29.245   4.1500   26.552   5.9745 2.692829 7.274420 
1 1 1    5    4  110 o   35.541   3.1599   52.945   9.0593   50.592   10.139   62.256   20.171   34.577   3.6525   36.800   6.9796 -2.222851 7.877527 
1 1 1    5    4  111 o   55.283   2.0911  125.953   9.4063  132.198   11.795  115.043   15.590   56.481   2.5687   52.223   3.6858 4.258080 4.492575 
1 1 1    5    4  112 o   57.471   1.9198  135.934   8.9809  140.906   12.157  129.960   13.325   58.294   2.5646   55.831   2.9383 2.463890 3.900128 
1 1 1    5    4  113 o   39.084   2.4746   63.438   7.8434   67.933   10.605   58.012   11.653   40.179   3.2662   36.844   3.9412 3.335609 5.118746 
1 1 1    5    4  114 o   53.779   2.1791  119.530   9.5328  124.209   13.965  115.448   13.045   54.413   3.1621   52.499   3.0615 1.913254 4.401338 
1 1 1    5    4  115 f   49.931   2.3444  103.388   9.5154  111.593   11.779   87.979   16.144   51.689   2.8062   45.046   4.4548 6.643150 5.264964 
1 1 1    5    4  116 o   65.386   2.0357  176.605   10.837  178.152   13.282  173.525   18.742   65.455   2.4939   63.908   3.6125 1.547283 4.389750 
1 1 1    5    4  117 o   8.8540   4.1003  -5.0746   7.0144 -16.4794   9.5956   8.0134   10.279   8.5394   4.1726   15.143   5.8569 -6.603551 7.191251 
1 1 1    5    4  118 o   37.523   2.6524   59.092   8.0605   54.088   11.007   64.878   11.836   35.313   3.8881   38.760   3.7949 -3.446491 5.433140 
1 1 1    5    4  119 o   49.166   2.1887  100.544   8.7498  103.532   12.097   97.266   12.671   49.452   3.0153   47.769   3.2740 1.683750 4.450919 
1 1 1    5    4  120 o   46.860   2.2445   91.586   8.5487   87.279   11.745   96.438   12.467   45.210   3.2078   47.513   3.2382 -2.302200 4.558067 
1 1 1    5    4  121 o   32.851   3.0165   46.118   7.9877   51.746   11.063   39.988   11.545   34.211   4.0452   29.441   4.9886 4.769306 6.422613 
1 1 1    5    4  122 f   22.171   4.3997   22.503   7.6708   20.275   10.438   25.119   11.311   20.269   5.9373   22.481   6.0431 -2.211725 8.471751 
1 1 1    5    4  123 o   29.269   3.8082   38.040   8.8704   38.001   10.845   38.118   15.418   28.580   4.8268   26.843   6.9816 1.737448 8.487671 
1 1 1    5    4  124 o   39.481   2.9084   66.809   9.2942   57.111   11.085   89.763   17.054   35.833   3.8557   44.008   4.8335 -8.175194 6.182936 
1 1 1    5    4  125 o   12.611   5.1831   4.5107   8.5538   2.6929   10.249   8.6827   15.527   12.726   5.4736   16.096   6.8242 -3.369682 8.748149 
1 1 1    5    4  126 o   31.180   4.0766   43.999   10.113   46.578   12.820   39.749   16.456   31.151   5.2341   26.700   7.3361 4.450449 9.011910 
1 1 1    5    4  127 o   17.313   5.8719   14.937   9.8771   6.3896   12.447   29.471   16.231   14.531   6.1329   22.585   7.5265 -8.054502 9.708755 
1 1 1    5    4  128 o   16.760   6.1894   13.725   11.175   16.596   15.872   10.903   15.737   18.112   7.1958   16.488   6.9239 1.624002 9.985952 
1 1 1    5    4  129 o   33.162   3.9848   49.886   10.556   55.598   13.548   41.061   16.840   34.065   5.0300   26.677   7.4563 7.388493 8.994312 
1 1 1    5    4  130 o   14.622   5.9312   8.3422   11.023   3.1205   15.559   13.603   15.618   14.488   6.4680   17.080   7.0099 -2.592019 9.537971 
1 1 1    5    4  131 f   17.940   6.2441   16.883   11.190   17.269   15.673   16.481   15.983   18.089   7.1620   17.870   7.1799 0.2193260 10.14127 
1 1 1    5    4  132 o   9.8407   4.7243 -11.0692   10.984  -1.6863   15.328 -20.9725   15.747   13.366   6.1436   10.775   5.2819 2.590909 8.101995 
1 1 1    5    4  133 o   21.496   5.6624   23.945   10.058   25.908   12.799   20.775   16.264   21.488   6.6390   19.007   7.3629 2.480694 9.914122 
1 1 1    5    4  134 o   11.206   5.0304  -0.6532   9.5529  -1.1711   12.033   0.2298   15.711   12.195   5.5433   13.782   6.2916 -1.587497 8.385258 
1 1 1    5    4  135 o   13.850   5.5918   7.4312   9.7457   1.9971   12.229   16.888   16.133   13.026   5.7796   17.841   7.1977 -4.815469 9.230949 
1 1 1    5    5    0 o  514.578   4.3792 10793.53  183.689 10612.57  256.155 10985.09  263.553  510.215   6.1591  519.091   6.2286 -8.876068 8.759517 
1 1 1    5    5    1 o  372.850   2.3303  5666.38   70.824  5692.12  100.541  5641.03   99.784  373.683   3.3007  372.002   3.2906 1.680725 4.660767 
1 1 1    5    5    2 o  490.811   3.1720  9819.57  126.907 10180.85  199.806  9575.27  164.305  499.712   4.9051  484.644   4.1590 15.06845 6.431016 
1 1 1    5    5    3 o  237.603   1.7661  2301.06   34.205  2355.09   53.064  2262.65   44.742  240.370   2.7082  235.608   2.3296 4.761932 3.572332 
1 1 1    5    5    4 o  426.268   3.0188  7406.68  104.895  7410.62  181.869  7404.72  128.403  426.330   5.2333  426.199   3.6960 0.1312561 6.406847 
1 1 1    5    5    5 o  197.126   1.7046  1583.83   27.391  1513.69   46.207  1621.83   34.011  192.704   2.9416  199.474   2.0917 -6.769897 3.609425 
1 1 1    5    5    6 o  284.517   2.0072  3299.49   46.552  3358.22   72.011  3257.32   61.017  287.028   3.0778  282.688   2.6479 4.340057 4.060076 
1 1 1    5    5    7 o  605.833   4.1625 14962.66  205.560 15483.80  299.113 14496.26  282.970  616.221   5.9547  596.252   5.8220 19.96869 8.327956 
1 1 1    5    5    8 o  233.505   2.0691  2222.40   39.383  2203.23   50.515  2252.11   62.887  232.492   2.6655  235.051   3.2822 -2.559311 4.228166 
1 1 1    5    5    9 o  419.554   3.2627  7175.30  111.585  7113.93  143.038  7270.72  178.352  417.737   4.2006  422.291   5.1812 -4.553680 6.670076 
1 1 1    5    5   10 o  586.457   4.4203 14021.24  211.314 13947.63  271.539 14134.27  336.484  584.868   5.6956  588.706   7.0118 -3.837891 9.033554 
1 1 1    5    5   11 o  539.774   4.0951 11877.39  180.181 11928.89  233.411 11801.45  283.442  540.904   5.2938  537.961   6.4636 2.943542 8.354798 
1 1 1    5    5   12 o  858.298   5.8031 30037.55  406.011 29539.51  566.041 30565.32  582.693  850.979   8.1601  865.620   8.2580 -14.64099 11.60955 
1 1 1    5    5   13 o  824.910   6.1140 27747.30  411.120 27716.92  649.266 27767.63  531.176  824.172   9.6643  825.084   7.8978 -0.9123535 12.48089 
1 1 1    5    5   14 o  648.842   5.4324 17164.96  287.320 17143.35  405.779 17186.70  406.888  648.315   7.6783  649.133   7.6896 -0.8185425 10.86679 
1 1 1    5    5   15 o  275.467   2.1146  3092.93   47.483  3090.15   81.954  3094.33   58.258  275.328   3.6516  275.526   2.5939 -0.1975708 4.479123 
1 1 1    5    5   16 o  333.659   2.6824  4537.84   72.957  4557.17  115.652  4525.07   94.026  334.346   4.2435  333.179   3.4621 1.167175 5.476594 
1 1 1    5    5   17 o  271.528   1.9408  3005.07   42.956  2957.90   64.930  3041.79   57.284  269.380   2.9570  273.177   2.5725 -3.796997 3.919333 
1 1 1    5    5   18 o  737.608   4.6404 22180.63  279.010 22138.76  425.525 22212.20  369.532  736.781   7.0852  738.059   6.1422 -1.278259 9.376913 
1 1 1    5    5   19 o  611.493   3.8854 15243.00  193.672 15574.88  301.427 15009.66  252.746  618.034   5.9832  606.752   5.1102 11.28137 7.868471 
1 1 1    5    5   20 o   79.986   1.4592  260.763   9.5142  243.061   16.829  269.078   11.534   77.174   2.6793   81.251   1.7415 -4.076447 3.195506 
1 1 1    5    5   21 o  309.000   2.1397  3891.77   53.895  3874.05   82.127  3905.17   71.427  308.284   3.2681  309.524   2.8309 -1.240753 4.323764 
1 1 1    5    5   22 f  662.748   4.1913 17906.09  226.431 17896.05  345.748 17913.63  299.624  662.462   6.4027  662.831   5.5455 -0.3687744 8.470339 
1 1 1    5    5   23 o  1107.24   7.4410 50004.25  671.602 50361.36  955.821 49656.00  943.870  1110.79   10.556  1102.99   10.498 7.797485 14.88764 
1 1 1    5    5   24 o  407.493   2.9097  6768.54   96.650  6878.73  138.493  6663.94  134.943  410.773   4.1361  404.310   4.0945 6.463379 5.819965 
1 1 1    5    5   25 o  506.173   3.5271 10444.23  145.529 10488.51  206.601 10400.63  205.026  507.202   4.9971  505.073   4.9799 2.128662 7.054763 
1 1 1    5    5   26 o  470.741   3.3055  9033.04  126.839  9015.57  179.221  9050.57  179.533  470.250   4.6755  471.162   4.6745 -0.9118042 6.611447 
1 1 1    5    5   27 o  343.478   2.3450  4808.81   65.658  4793.57   86.914  4829.07  100.206  342.924   3.1093  344.184   3.5716 -1.260132 4.735419 
1 1 1    5    5   28 o  526.368   3.3910 11294.19  145.497 11306.83  192.859 11277.49  221.660  526.630   4.4926  525.922   5.1705 0.7081299 6.849628 
1 1 1    5    5   29 o  270.684   2.1406  2986.48   47.232  2962.05   67.283  3010.22   66.320  269.565   3.0620  271.749   2.9939 -2.183807 4.282457 
1 1 1    5    5   30 o  696.156   4.7586 19758.99  270.034 19882.05  384.590 19639.33  379.238  698.203   6.7574  693.931   6.7044 4.271362 9.519011 
1 1 1    5    5   31 o  1121.49   7.5409 51306.55  689.377 51631.15  980.943 50989.79  969.018  1124.55   10.701  1117.55   10.637 6.994873 15.08853 
1 1 1    5    5   32 o  981.682   6.6223 39304.54  529.923 39292.13  749.750 39316.94  749.098  981.192   9.3740  981.503   9.3629 -0.3113403 13.24903 
1 1 1    5    5   33 o  395.213   2.6482  6366.73   85.313  6374.64  113.318  6356.38  129.620  395.441   3.5154  394.862   4.0271 0.5788269 5.345630 
1 1 1    5    5   34 o  443.926   3.1528  8033.39  114.088  8110.85  141.286  7888.25  193.411  446.042   3.8859  439.828   5.3946 6.213928 6.648465 
1 1 1    5    5   35 o  135.693   1.6038  750.480   17.739  773.855   22.907  715.461   28.038  137.788   2.0395  132.484   2.5962 5.303558 3.301512 
1 1 1    5    5   36 o  154.821   1.8064  976.997   22.798  949.724   30.535  1011.35   34.269  152.641   2.4541  157.514   2.6689 -4.872635 3.625728 
1 1 1    5    5   37 o  113.250   1.7430  522.766   16.090  492.755   22.229  555.797   23.320  109.948   2.4803  116.770   2.4500 -6.821732 3.486300 
1 1 1    5    5   38 o  563.619   4.2844 12951.81  196.839 13723.20  327.989 12517.60  246.081  579.994   6.9374  554.030   5.4489 25.96387 8.821484 
1 1 1    5    5   39 o  356.756   2.8745  5188.24   83.593  5336.25  136.609  5099.65  105.690  361.760   4.6326  353.678   3.6660 8.082275 5.907638 
1 1 1    5    5   40 o  238.171   2.1518  2312.20   41.776  2273.60   67.303  2336.39   53.284  236.155   3.4962  239.406   2.7304 -3.250854 4.436061 
1 1 1    5    5   41 o  420.924   3.6757  7223.50  126.119  7501.81  261.571  7139.19  143.958  428.749   7.4843  418.440   4.2205 10.30841 8.592298 
1 1 1    5    5   42 o  113.511   1.6857  525.185   15.598  466.889   26.089  557.613   19.458  106.976   2.9948  116.961   2.0409 -9.985115 3.624113 
1 1 1    5    5   43 o  437.379   3.1036  7798.89  110.652  7727.86  155.633  7871.50  157.352  435.328   4.3858  439.354   4.3936 -4.026764 6.207997 
1 1 1    5    5   44 o  233.822   1.9193  2228.55   36.582  2233.83   52.268  2223.48   51.218  234.086   2.7392  233.544   2.6904 0.5420685 3.839490 
1 1 1    5    5   45 o  188.588   1.8690  1449.71   28.732  1393.24   36.842  1537.38   45.902  184.871   2.4448  194.192   2.8998 -9.320953 3.792825 
1 1 1    5    5   46 o  565.498   3.9149 13040.41  180.464 13113.61  256.518 12968.68  253.932  566.936   5.5507  563.798   5.5253 3.138794 7.831948 
1 1 1    5    5   47 o  155.698   2.0127  988.175   25.544  940.549   34.972  1042.64   37.399  151.889   2.8246  159.919   2.8690 -8.030243 4.026125 
1 1 1    5    5   48 o  529.385   3.6981 11428.26  159.581 11177.91  191.810 11991.23  287.629  523.488   4.4950  541.966   6.5107 -18.47748 7.911614 
1 1 1    5    5   49 o  246.783   1.8556  2482.55   37.328  2450.11   49.250  2526.34   57.222  245.151   2.4645  248.926   2.8201 -3.774811 3.745236 
1 1 1    5    5   50 o  406.951   2.9328  6752.45   97.289  6731.22  118.794  6795.70  169.545  406.272   3.5871  408.091   5.0967 -1.819122 6.232487 
1 1 1    5    5   51 o   57.914   1.9863  136.887   9.3629  136.163   11.219  138.550   16.997   57.742   2.3886   58.174   3.6019 -0.4321365 4.321913 
1 1 1    5    5   52 o  326.530   2.6957  4347.31   71.752  4371.73   93.108  4311.62  112.592  327.402   3.4888  325.092   4.2488 2.309723 5.497591 
1 1 1    5    5   53 o  225.462   2.3574  2072.50   43.325  2032.38   49.390  2206.40   90.235  223.258   2.7139  232.516   4.7609 -9.258316 5.480082 
1 1 1    5    5   54 o  146.705   1.7802  877.375   21.288  885.587   27.672  865.466   33.322  147.380   2.3034  145.685   2.8059 1.695755 3.630237 
1 1 1    5    5   55 o  269.022   2.6193  2951.10   57.440  2965.19   81.445  2937.16   81.021  269.599   3.7060  268.322   3.7043 1.276978 5.239881 
1 1 1    5    5   56 o  130.489   1.9347  694.185   20.579  700.200   29.110  688.175   29.096  131.035   2.7253  129.905   2.7478 1.130569 3.870060 
1 1 1    5    5   57 o  169.724   2.3692  1174.59   32.778  1160.36   39.914  1204.06   57.443  168.674   2.9030  171.763   4.1027 -3.089569 5.025895 
1 1 1    5    5   58 o  307.970   2.8864  3868.39   72.459  3878.57  102.537  3858.24  102.409  308.265   4.0806  307.456   4.0862 0.8094177 5.774776 
1 1 1    5    5   59 o  219.815   2.0838  1970.12   37.339  1922.12   47.540  2047.40   60.324  217.093   2.6865  224.018   3.3035 -6.925507 4.257930 
1 1 1    5    5   60 o  157.932   1.8229  1016.92   23.468  994.112   29.993  1052.92   37.685  156.135   2.3566  160.666   2.8775 -4.530670 3.719319 
1 1 1    5    5   61 o  262.047   2.3133  2800.24   49.413  2764.53   63.272  2856.06   79.113  260.325   2.9817  264.539   3.6688 -4.214203 4.727618 
1 1 1    5    5   62 o  249.303   2.0395  2534.24   41.445  2564.25   51.005  2475.91   71.107  250.748   2.4954  246.311   3.5415 4.437119 4.332389 
1 1 1    5    5   63 o  115.908   1.7048  547.732   16.108  536.753   20.101  567.432   26.925  114.730   2.1494  117.943   2.8006 -3.213028 3.530332 
1 1 1    5    5   64 o  115.385   1.5877  542.786   14.933  541.459   18.000  545.714   26.745  115.237   1.9163  115.661   2.8367 -0.4240875 3.423309 
1 1 1    5    5   65 o  353.300   2.6186  5091.36   75.414  5078.12   92.102  5118.31  131.370  352.771   3.2029  353.953   4.5532 -1.181183 5.566861 
1 1 1    5    5   66 o   56.298   2.0041  129.402   9.1821  133.680   11.034  119.770   16.558   57.202   2.3716   54.031   3.7833 3.170845 4.465136 
1 1 1    5    5   67 o  243.661   1.8633  2420.82   37.008  2453.89   49.271  2378.01   56.058  245.280   2.4643  241.428   2.8485 3.852112 3.766508 
1 1 1    5    5   68 o  129.885   1.4721  687.769   15.586  665.154   20.186  721.149   24.524  127.719   1.9389  132.975   2.2625 -5.256004 2.979667 
1 1 1    5    5   69 o  197.430   1.6653  1589.24   26.800  1619.22   35.650  1550.29   40.639  199.257   2.1949  194.948   2.5573 4.309006 3.370089 
1 1 1    5    5   70 o  244.713   1.8695  2441.89   37.292  2446.57   49.252  2435.60   57.089  244.905   2.4671  244.320   2.8666 0.5849915 3.782024 
1 1 1    5    5   71 o  128.906   1.4711  677.458   15.458  664.670   20.184  695.601   24.041  127.669   1.9395  130.594   2.2584 -2.924553 2.976858 
1 1 1    5    5   72 o   77.160   1.5836  242.743   9.9605  238.654   12.913  248.751   15.652   76.469   2.0734   78.050   2.4632 -1.580795 3.219717 
1 1 1    5    5   73 o   60.547   1.7750  149.612   8.7509  137.566   11.301  167.650   13.829   58.023   2.3946   64.047   2.6546 -6.024296 3.575068 
1 1 1    5    5   74 o   64.587   1.8743  170.253   9.8571  160.640   11.864  191.678   17.712   62.711   2.3250   68.450   3.1831 -5.738865 3.941735 
1 1 1    5    5   75 o  190.301   1.8020  1476.79   27.953  1487.09   34.344  1456.58   48.111  190.938   2.2066  188.892   3.1246 2.045425 3.825218 
1 1 1    5    5   76 o   70.932   2.1528  205.417   12.433  207.848   13.805  194.981   28.606   71.337   2.3774   68.820   5.1363 2.517448 5.659827 
1 1 1    5    5   77 o  201.991   1.8898  1663.97   31.117  1692.09   38.459  1610.66   52.947  203.659   2.3167  198.604   3.2705 5.055069 4.007889 
1 1 1    5    5   78 o  204.534   1.7419  1705.99   29.042  1698.69   38.311  1715.85   44.529  204.053   2.3033  205.048   2.6641 -0.9950104 3.521735 
1 1 1    5    5   79 o  181.135   1.6534  1337.96   24.413  1325.20   32.127  1355.38   37.555  180.234   2.1868  182.246   2.5280 -2.012329 3.342528 
1 1 1    5    5   80 o   79.821   1.6617  259.832   10.812  253.970   14.225  267.851   16.639   78.867   2.2149   80.974   2.5239 -2.106880 3.357960 
1 1 1    5    5   81 o  173.925   1.6053  1233.62   22.758  1240.41   30.208  1224.70   34.609  174.365   2.1254  173.228   2.4509 1.136292 3.244109 
1 1 1    5    5   82 o  105.259   1.5255  451.830   13.089  455.849   17.394  446.582   19.876  105.704   2.0187  104.607   2.3310 1.097206 3.083574 
1 1 1    5    5   83 o  140.233   1.5345  801.991   17.541  787.146   23.093  822.237   26.968  138.897   2.0396  141.936   2.3309 -3.039047 3.097292 
1 1 1    5    5   84 o  146.439   1.6777  874.693   20.026  883.012   28.639  866.733   28.015  147.076   2.3888  145.717   2.3585 1.359177 3.356906 
1 1 1    5    5   85 o   57.830   2.1124  136.666   9.9411  130.617   14.109  142.630   14.009   56.449   3.0780   59.011   2.9214 -2.562176 4.243629 
1 1 1    5    5   86 o   17.601   5.5903   12.526   9.0118   23.497   15.068   6.4174   11.244   23.726   7.1794   15.737   6.1149 7.988977 9.430568 
1 1 1    5    5   87 o   38.016   2.8417   59.393   8.7426   67.626   12.648   51.861   12.098   40.447   3.8838   35.306   4.2917 5.140747 5.788179 
1 1 1    5    5   88 o   31.976   3.0779   42.198   7.9237   38.344   10.501   47.294   12.075   30.262   4.3845   33.648   4.5164 -3.386204 6.294521 
1 1 1    5    5   89 o   49.039   2.1658   98.381   8.6364  102.543   11.403   92.781   13.227   50.005   2.8087   47.481   3.4407 2.524239 4.441545 
1 1 1    5    5   90 o  106.233   1.5570  460.428   13.483  444.024   17.661  483.345   20.874  104.283   2.0776  108.775   2.3542 -4.491989 3.139884 
1 1 1    5    5   91 o   66.353   1.8296  179.850   9.8862  167.239   12.995  197.176   15.232   63.919   2.4989   69.389   2.6981 -5.470158 3.677552 
1 1 1    5    5   92 o   85.372   1.6768  297.458   11.669  296.841   15.400  298.291   17.881   85.211   2.2190   85.375   2.5723 -0.1633987 3.397158 
1 1 1    5    5   93 o   27.745   4.3805   32.441   9.5786   20.979   14.469   41.382   12.780   22.484   7.0763   31.241   5.2012 -8.757505 8.782169 
1 1 1    5    5   94 o   66.954   2.2372  183.447   12.193  187.371   19.001  180.700   15.898   67.480   3.4660   66.353   2.9466 1.127022 4.549288 
1 1 1    5    5   95 o   56.498   2.4045  130.813   11.048  135.608   16.662  127.051   14.760   57.338   3.5827   55.548   3.2743 1.790115 4.853556 
1 1 1    5    5   96 f   75.135   1.8405  230.633   11.272  241.962   15.832  218.983   16.054   76.837   2.5311   73.065   2.7001 3.771843 3.700947 
1 1 1    5    5   97 f   45.530   2.2656   85.029   8.3821   79.470   11.081   92.465   12.816   43.886   3.1178   47.313   3.3445 -3.427738 4.572357 
1 1 1    5    5   98 o   42.412   2.5154   73.960   8.6572   71.731   12.062   76.330   12.433   41.575   3.5944   42.897   3.5885 -1.322582 5.079044 
1 1 1    5    5   99 o   99.116   1.5580  401.310   12.588  390.781   16.647  415.370   19.237   97.718   2.0899  100.693   2.3437 -2.974548 3.140127 
1 1 1    5    5  100 o   30.978   3.0707   39.869   7.6521   40.151   10.068   39.484   11.775   30.863   4.1035   30.388   4.9220 0.4750290 6.408142 
1 1 1    5    5  101 o   64.352   1.8130  169.551   9.5006  183.343   12.710  152.087   14.302   66.821   2.3371   60.727   2.8976 6.093613 3.722592 
1 1 1    5    5  102 o   17.693   4.8664   13.553   7.2368   18.456   9.4935   6.7524   11.181   20.536   5.5432   15.564   6.0834 4.972307 8.230094 
1 1 1    5    5  103 o   98.881   1.6964  400.087   13.673  404.441   19.543  395.911   19.138   99.216   2.4164   98.172   2.3915 1.043808 3.399758 
1 1 1    5    5  104 o   49.367   2.2079  100.259   8.8624   99.860   11.124  100.954   14.665   49.133   2.7888   49.134   3.6884 -0.1453400E-02 4.624019 
1 1 1    5    5  105 o   49.058   2.2381   99.100   8.9264   99.502   11.079   98.357   15.071   49.021   2.7839   48.394   3.8523 0.6271477 4.752907 
1 1 1    5    5  106 o   33.864   2.9376   47.789   8.0290   48.247   9.9936   46.957   13.485   33.818   3.6848   32.820   5.2146 0.9983025 6.385160 
1 1 1    5    5  107 o   40.193   2.4507   66.834   7.9913   66.100   10.602   67.800   12.160   39.733   3.3034   40.087   3.7654 -0.3542557 5.009025 
1 1 1    5    5  108 o   69.135   1.7911  196.217   10.085  204.982   13.430  184.884   15.271   70.486   2.3407   66.756   2.8127 3.729469 3.659277 
1 1 1    5    5  109 o   64.460   1.9938  170.980   10.464  170.429   12.817  172.082   18.121   64.199   2.4536   64.048   3.4841 0.1519394 4.261359 
1 1 1    5    5  110 o   27.896   3.7272   33.253   8.2634   36.608   10.036   26.191   14.560   29.054   4.3732   23.700   7.0311 5.353626 8.280144 
1 1 1    5    5  111 o   7.8670   3.8070 -11.5599   7.4796  -5.5633   9.0331 -24.6382   13.340   10.292   4.7255   9.8534   4.8364 0.4390984 6.761704 
1 1 1    5    5  112 o   53.622   2.0708  118.643   9.0343  106.756   11.875  134.978   13.920   50.564   2.8932   56.817   3.0163 -6.252918 4.179585 
1 1 1    5    5  113 o   41.508   2.4487   71.604   8.2484   69.497   10.959   74.357   12.527   40.555   3.3449   41.788   3.7163 -1.233116 4.999951 
1 1 1    5    5  114 o   29.616   3.2326   37.226   7.6772   30.217   10.269   46.106   11.559   25.923   5.0414   32.444   4.4911 -6.520487 6.751687 
1 1 1    5    5  115 o   60.727   1.9184  152.200   9.4843  153.183   12.977  151.073   13.896   60.590   2.6337   60.054   2.8468 0.5364571 3.878216 
1 1 1    5    5  116 o   23.499   4.3947   24.628   8.1087   29.443   12.309   20.936   10.778   24.883   6.1134   21.046   5.9940 3.837484 8.561621 
1 1 1    5    5  117 o   33.435   2.9217   47.335   7.8832   49.125   10.944   45.406   11.364   33.484   4.0948   31.960   4.4855 1.524389 6.073480 
1 1 1    5    5  118 o   23.772   4.0788   25.135   7.6192   29.164   10.594   20.818   10.966   24.955   5.3674   20.744   6.0883 4.210297 8.116426 
1 1 1    5    5  119 o   12.901   4.9786   5.8012   7.4152   1.1205   10.224   10.996   10.771   12.511   5.4241   16.184   6.0572 -3.673525 8.130799 
1 1 1    5    5  120 f   29.544   3.7646   38.394   8.8605   34.257   10.875   46.564   15.283   27.081   5.1136   30.723   6.3137 -3.641727 8.124772 
1 1 1    5    5  121 o   17.431   5.7441   14.561   9.4614   15.336   12.407   13.484   14.626   17.935   6.5381   17.566   6.9301 0.3681583 9.527551 
1 1 1    5    5  122 o   34.587   3.7179   52.872   10.318   55.694   13.403   48.768   16.166   34.578   4.8915   30.755   6.6428 3.822573 8.249467 
1 1 1    5    5  123 o   27.191   4.6688   34.454   9.9757   34.988   12.904   33.662   15.727   26.238   6.1424   24.640   7.3067 1.597363 9.545465 
1 1 1    5    5  124 o   41.088   3.6215   74.500   12.005   61.165   16.444   89.721   17.568   35.054   5.9684   43.646   5.0296 -8.591908 7.805035 
1 1 1    5    5  125 o   9.2711   4.4293  -9.6803   9.4015  -6.4608   11.845 -15.1626   15.456   11.229   5.2432   11.517   5.5483 -0.2882824 7.633739 
1 1 1    5    5  126 o   14.964   5.7156   9.7852   9.7041   7.2584   12.281   13.986   15.834   14.706   6.1418   17.378   7.0866 -2.672261 9.377733 
1 1 1    5    5  127 o   24.250   4.8400   28.175   9.2321   26.154   11.047   32.858   16.812   22.491   5.9387   23.537   7.6512 -1.045874 9.685464 
1 1 1    5    5  128 o   10.892   4.9752  -2.8496   9.8421   9.9071   12.553 -23.2020   15.856   15.506   6.3148   10.647   5.2353 4.858439 8.202736 
1 1 1    5    5  129 o   18.606   5.9244   18.038   10.116   17.744   12.945   18.498   16.212   18.236   6.6737   18.501   7.2970 -0.2642384 9.888563 
1 1 1    5    5  130 o   12.417   5.3576   2.9023   9.8796  -6.3898   12.456   18.663   16.222   11.386   5.3360   18.484   7.2964 -7.097939 9.039394 
1 1 1    5    5  131 o   12.450   5.3656   3.1125   9.8860   1.6365   12.539   5.5370   16.071   13.064   5.8210   14.998   6.6416 -1.934530 8.831532 
1 1 1    5    5  132 o   17.870   5.9811   16.866   10.249   26.049   13.117   2.4722   16.421   21.402   6.7377   14.398   6.5174 7.003900 9.374103 
1 1 1    5    5  133 o   22.824   5.9971   27.692   11.301   22.848   15.409   33.329   16.623   19.693   7.2686   23.223   7.6119 -3.530844 10.52489 
1 1 1    5    5  134 f   15.518   6.0263   11.265   10.916   2.6499   14.651   22.015   16.366   13.961   6.2514   19.378   7.4173 -5.416744 9.700333 
1 1 1    6    0 -137 f   7.4937   5.2468  -9.3786   11.994  -9.3786   11.994  -9.3786   11.994   7.4937   5.2468   7.4937   5.2468 0.000000 0.000000 
1 1 1    6    0 -136 o   12.620   7.7363   10.302   15.267   10.302   15.267   10.302   15.267   12.620   7.7363   12.620   7.7363 0.000000 0.000000 
1 1 1    6    0 -135 o   12.692   7.6871   10.692   14.681   10.692   14.681   10.692   14.681   12.692   7.6871   12.692   7.6871 -0.000000 0.000000 
1 1 1    6    0 -134 o   26.298   8.2027   40.268   15.415   40.268   15.415   40.268   15.415   26.298   8.2027   26.298   8.2027 0.000000 0.000000 
1 1 1    6    0 -133 o   10.333   6.2872   5.8437   9.9190   5.8437   9.9190   5.8437   9.9190   10.333   6.2872   10.333   6.2872 -0.000000 0.000000 
1 1 1    6    0 -132 o   23.235   6.5201   28.866   10.688   28.866   10.688   28.866   10.688   23.235   6.5201   23.235   6.5201 -0.000000 0.000000 
1 1 1    6    0 -131 o   52.809   2.8387  117.498   12.138  117.498   12.138  117.498   12.138   52.809   2.8387   52.809   2.8387 0.000000 0.000000 
1 1 1    6    0 -130 o   38.427   3.5288   63.914   10.828   63.914   10.828   63.914   10.828   38.427   3.5288   38.427   3.5288 0.000000 0.000000 
1 1 1    6    0 -129 o   5.7023   4.1041 -14.9861   9.3997 -14.9861   9.3997 -14.9861   9.3997   5.7023   4.1041   5.7023   4.1041 -0.000000 0.000000 
1 1 1    6    0 -128 o   20.656   6.6236   23.712   9.8338   23.712   9.8338   23.712   9.8338   20.656   6.6236   20.656   6.6236 0.000000 0.000000 
1 1 1    6    0 -127 o   22.721   7.4139   29.340   12.159   29.340   12.159   29.340   12.159   22.721   7.4139   22.721   7.4139 0.000000 0.000000 
1 1 1    6    0 -126 o   8.9956   5.9477  -0.6529   11.346  -0.6529   11.346  -0.6529   11.346   8.9956   5.9477   8.9956   5.9477 -0.000000 0.000000 
1 1 1    6    0 -125 o   21.593   7.5656   27.130   12.059   27.130   12.059   27.130   12.059   21.593   7.5656   21.593   7.5656 -0.000000 0.000000 
1 1 1    6    0 -124 f   8.0395   5.5056  -5.7915   11.474  -5.7915   11.474  -5.7915   11.474   8.0395   5.5056   8.0395   5.5056 -0.000000 0.000000 
1 1 1    6    0 -123 o   9.2425   5.8722   2.1987   9.6485   2.1987   9.6485   2.1987   9.6485   9.2425   5.8722   9.2425   5.8722 -0.000000 0.000000 
1 1 1    6    0 -122 o   8.3035   5.4959  -1.3175   9.7287  -1.3175   9.7287  -1.3175   9.7287   8.3035   5.4959   8.3035   5.4959 0.000000 0.000000 
1 1 1    6    0 -121 o   43.818   3.2272   80.979   11.380   80.979   11.380   80.979   11.380   43.818   3.2272   43.818   3.2272 -0.000000 0.000000 
1 1 1    6    0 -120 o   38.851   2.6946   63.139   8.4377   63.139   8.4377   63.139   8.4377   38.851   2.6946   38.851   2.6946 -0.000000 0.000000 
1 1 1    6    0 -119 o   7.5743   4.9376  -0.2906   7.4124  -0.2906   7.4124  -0.2906   7.4124   7.5743   4.9376   7.5743   4.9376 0.000000 0.000000 
1 1 1    6    0 -118 o   45.722   2.5610   86.784   9.4758   86.784   9.4758   86.784   9.4758   45.722   2.5610   45.722   2.5610 -0.000000 0.000000 
1 1 1    6    0 -117 o   35.674   3.0203   53.582   8.6326   53.582   8.6326   53.582   8.6326   35.674   3.0203   35.674   3.0203 -0.000000 0.000000 
1 1 1    6    0 -116 o   24.644   4.1651   27.221   7.6497   27.221   7.6497   27.221   7.6497   24.644   4.1651   24.644   4.1651 -0.000000 0.000000 
1 1 1    6    0 -115 o   13.624   6.0438   11.263   7.0824   11.263   7.0824   11.263   7.0824   13.624   6.0438   13.624   6.0438 0.000000 0.000000 
1 1 1    6    0 -114 o   48.996   2.2620   99.021   8.9901   99.021   8.9901   99.021   8.9901   48.996   2.2620   48.996   2.2620 0.000000 0.000000 
1 1 1    6    0 -113 o   13.173   6.0516   10.625   7.1113   10.625   7.1113   10.625   7.1113   13.173   6.0516   13.173   6.0516 0.000000 0.000000 
1 1 1    6    0 -112 o   5.3424   3.7710  -7.7511   6.5937  -7.7511   6.5937  -7.7511   6.5937   5.3424   3.7710   5.3424   3.7710 0.000000 0.000000 
1 1 1    6    0 -111 o   10.394   5.6567   6.4308   6.7749   6.4308   6.7749   6.4308   6.7749   10.394   5.6567   10.394   5.6567 -0.000000 0.000000 
1 1 1    6    0 -110 o   17.447   5.6131   15.976   7.0445   15.976   7.0445   15.976   7.0445   17.447   5.6131   17.447   5.6131 -0.000000 0.000000 
1 1 1    6    0 -109 o   47.993   2.3070   94.914   8.9778   94.914   8.9778   94.914   8.9778   47.993   2.3070   47.993   2.3070 0.000000 0.000000 
1 1 1    6    0 -108 o   89.003   1.8063  324.010   13.092  324.010   13.092  324.010   13.092   89.003   1.8063   89.003   1.8063 -0.000000 0.000000 
1 1 1    6    0 -107 o   6.4758   4.3795  -3.2034   6.7998  -3.2034   6.7998  -3.2034   6.7998   6.4758   4.3795   6.4758   4.3795 0.000000 0.000000 
1 1 1    6    0 -106 o   74.583   1.8830  227.622   11.431  227.622   11.431  227.622   11.431   74.583   1.8830   74.583   1.8830 -0.000000 0.000000 
1 1 1    6    0 -105 o   43.640   2.3954   78.554   8.4620   78.554   8.4620   78.554   8.4620   43.640   2.3954   43.640   2.3954 0.000000 0.000000 
1 1 1    6    0 -104 o   44.233   2.5610   80.789   9.1627   80.789   9.1627   80.789   9.1627   44.233   2.5610   44.233   2.5610 0.000000 0.000000 
1 1 1    6    0 -103 o   6.3867   4.3485  -3.9366   6.9370  -3.9366   6.9370  -3.9366   6.9370   6.3867   4.3485   6.3867   4.3485 -0.000000 0.000000 
1 1 1    6    0 -102 o   35.580   3.0231   52.881   8.6165   52.881   8.6165   52.881   8.6165   35.580   3.0231   35.580   3.0231 -0.000000 0.000000 
1 1 1    6    0 -101 o   74.247   2.2999  225.740   13.889  225.740   13.889  225.740   13.889   74.247   2.2999   74.247   2.2999 -0.000000 0.000000 
1 1 1    6    0 -100 o   62.778   2.2633  161.511   11.548  161.511   11.548  161.511   11.548   62.778   2.2633   62.778   2.2633 -0.000000 0.000000 
1 1 1    6    0  -99 o   53.232   2.5373  116.488   10.953  116.488   10.953  116.488   10.953   53.232   2.5373   53.232   2.5373 0.000000 0.000000 
1 1 1    6    0  -98 o  111.304   2.0032  505.942   18.161  505.942   18.161  505.942   18.161  111.304   2.0032  111.304   2.0032 0.000000 0.000000 
1 1 1    6    0  -97 f  109.308   2.5454  488.518   22.652  488.518   22.652  488.518   22.652  109.308   2.5454  109.308   2.5454 -0.000000 0.000000 
1 1 1    6    0  -96 o  153.606   1.8397  962.784   23.028  962.784   23.028  962.784   23.028  153.606   1.8397  153.606   1.8397 0.000000 0.000000 
1 1 1    6    0  -95 o   7.5262   4.8763  -0.3347   7.0777  -0.3347   7.0777  -0.3347   7.0777   7.5262   4.8763   7.5262   4.8763 0.000000 0.000000 
1 1 1    6    0  -94 o  146.299   1.8078  873.272   21.551  873.272   21.551  873.272   21.551  146.299   1.8078  146.299   1.8078 0.000000 0.000000 
1 1 1    6    0  -93 o  211.484   2.2979  1825.21   39.604  1825.21   39.604  1825.21   39.604  211.484   2.2979  211.484   2.2979 -0.000000 0.000000 
1 1 1    6    0  -92 o   95.350   2.2116  371.447   17.169  371.447   17.169  371.447   17.169   95.350   2.2116   95.350   2.2116 0.000000 0.000000 
1 1 1    6    0  -91 o  254.186   2.2807  2636.08   47.246  2636.08   47.246  2636.08   47.246  254.186   2.2807  254.186   2.2807 -0.000000 0.000000 
1 1 1    6    0  -90 o   65.224   1.9851  173.967   10.532  173.967   10.532  173.967   10.532   65.224   1.9851   65.224   1.9851 0.000000 0.000000 
1 1 1    6    0  -89 o   28.636   3.3401   34.809   7.5200   34.809   7.5200   34.809   7.5200   28.636   3.3401   28.636   3.3401 0.000000 0.000000 
1 1 1    6    0  -88 o  139.799   1.7669  797.239   20.128  797.239   20.128  797.239   20.128  139.799   1.7669  139.799   1.7669 -0.000000 0.000000 
1 1 1    6    0  -87 o  148.152   1.7832  895.297   21.528  895.297   21.528  895.297   21.528  148.152   1.7832  148.152   1.7832 -0.000000 0.000000 
1 1 1    6    0  -86 o  102.697   1.7426  430.363   14.578  430.363   14.578  430.363   14.578  102.697   1.7426  102.697   1.7426 0.000000 0.000000 
1 1 1    6    0  -85 o  222.032   2.1037  2010.68   38.068  2010.68   38.068  2010.68   38.068  222.032   2.1037  222.032   2.1037 0.000000 0.000000 
1 1 1    6    0  -84 o  228.535   2.1401  2130.13   39.861  2130.13   39.861  2130.13   39.861  228.535   2.1401  228.535   2.1401 0.000000 0.000000 
1 1 1    6    0  -83 o   54.226   2.3182  120.555   10.204  120.555   10.204  120.555   10.204   54.226   2.3182   54.226   2.3182 0.000000 0.000000 
1 1 1    6    0  -82 o  101.004   1.7802  416.295   14.647  416.295   14.647  416.295   14.647  101.004   1.7802  101.004   1.7802 -0.000000 0.000000 
1 1 1    6    0  -81 o  305.351   2.8599  3803.69   71.170  3803.69   71.170  3803.69   71.170  305.351   2.8599  305.351   2.8599 0.000000 0.000000 
1 1 1    6    0  -80 o  141.090   2.1709  812.196   24.954  812.196   24.954  812.196   24.954  141.090   2.1709  141.090   2.1709 -0.000000 0.000000 
1 1 1    6    0  -79 o   55.282   2.3089  125.259   10.363  125.259   10.363  125.259   10.363   55.282   2.3089   55.282   2.3089 0.000000 0.000000 
1 1 1    6    0  -78 o  166.424   2.0117  1129.67   27.282  1129.67   27.282  1129.67   27.282  166.424   2.0117  166.424   2.0117 0.000000 0.000000 
1 1 1    6    0  -77 o  322.027   2.9662  4230.17   77.849  4230.17   77.849  4230.17   77.849  322.027   2.9662  322.027   2.9662 0.000000 0.000000 
1 1 1    6    0  -76 o  289.746   2.7668  3424.32   65.333  3424.32   65.333  3424.32   65.333  289.746   2.7668  289.746   2.7668 -0.000000 0.000000 
1 1 1    6    0  -75 o  355.178   2.8647  5145.22   82.926  5145.22   82.926  5145.22   82.926  355.178   2.8647  355.178   2.8647 -0.000000 0.000000 
1 1 1    6    0  -74 o  117.641   1.6338  564.474   15.660  564.474   15.660  564.474   15.660  117.641   1.6338  117.641   1.6338 0.000000 0.000000 
1 1 1    6    0  -73 o  203.847   1.9532  1694.46   32.448  1694.46   32.448  1694.46   32.448  203.847   1.9532  203.847   1.9532 0.000000 0.000000 
1 1 1    6    0  -72 o  216.906   2.0204  1918.49   35.716  1918.49   35.716  1918.49   35.716  216.906   2.0204  216.906   2.0204 0.000000 0.000000 
1 1 1    6    0  -71 o   87.927   1.6285  315.471   11.663  315.471   11.663  315.471   11.663   87.927   1.6285   87.927   1.6285 -0.000000 0.000000 
1 1 1    6    0  -70 o  222.057   2.0466  2010.67   37.038  2010.67   37.038  2010.67   37.038  222.057   2.0466  222.057   2.0466 -0.000000 0.000000 
1 1 1    6    0  -69 o   24.738   3.3947   26.327   6.4797   26.327   6.4797   26.327   6.4797   24.738   3.3947   24.738   3.3947 -0.000000 0.000000 
1 1 1    6    0  -68 o  601.757   4.5494 14775.88  223.128 14775.88  223.128 14775.88  223.128  601.757   4.5494  601.757   4.5494 0.000000 0.000000 
1 1 1    6    0  -67 o  115.548   1.6111  544.544   15.168  544.544   15.168  544.544   15.168  115.548   1.6111  115.548   1.6111 -0.000000 0.000000 
1 1 1    6    0  -66 o  227.433   2.0666  2109.11   38.305  2109.11   38.305  2109.11   38.305  227.433   2.0666  227.433   2.0666 -0.000000 0.000000 
1 1 1    6    0  -65 o   10.362   5.3195   6.4057   5.7136   6.4057   5.7136   6.4057   5.7136   10.362   5.3195   10.362   5.3195 -0.000000 0.000000 
1 1 1    6    0  -64 o  141.107   1.6635  811.948   19.128  811.948   19.128  811.948   19.128  141.107   1.6635  141.107   1.6635 0.000000 0.000000 
1 1 1    6    0  -63 o  331.543   2.6971  4482.07   72.880  4482.07   72.880  4482.07   72.880  331.543   2.6971  331.543   2.6971 0.000000 0.000000 
1 1 1    6    0  -62 o  329.810   2.6863  4435.22   72.209  4435.22   72.209  4435.22   72.209  329.810   2.6863  329.810   2.6863 -0.000000 0.000000 
1 1 1    6    0  -61 o   81.924   2.0873  274.113   13.919  274.113   13.919  274.113   13.919   81.924   2.0873   81.924   2.0873 -0.000000 0.000000 
1 1 1    6    0  -60 o   10.787   5.5363   6.9389   6.1882   6.9389   6.1882   6.9389   6.1882   10.787   5.5363   10.787   5.5363 -0.000000 0.000000 
1 1 1    6    0  -59 o   25.491   3.4815   27.934   6.8523   27.934   6.8523   27.934   6.8523   25.491   3.4815   25.491   3.4815 0.000000 0.000000 
1 1 1    6    0  -58 o  436.227   3.7862  7759.96  134.611  7759.96  134.611  7759.96  134.611  436.227   3.7862  436.227   3.7862 -0.000000 0.000000 
1 1 1    6    0  -57 o  234.169   2.3308  2235.83   44.481  2235.83   44.481  2235.83   44.481  234.169   2.3308  234.169   2.3308 0.000000 0.000000 
1 1 1    6    0  -56 o  127.439   1.7694  662.352   18.373  662.352   18.373  662.352   18.373  127.439   1.7694  127.439   1.7694 0.000000 0.000000 
1 1 1    6    0  -55 o   85.599   1.6152  298.971   11.261  298.971   11.261  298.971   11.261   85.599   1.6152   85.599   1.6152 0.000000 0.000000 
1 1 1    6    0  -54 o  210.355   2.1974  1804.20   37.670  1804.20   37.670  1804.20   37.670  210.355   2.1974  210.355   2.1974 -0.000000 0.000000 
1 1 1    6    0  -53 f  255.686   2.4827  2665.49   51.733  2665.49   51.733  2665.49   51.733  255.686   2.4827  255.686   2.4827 -0.000000 0.000000 
1 1 1    6    0  -52 o  472.863   4.6880  9118.40  180.661  9118.40  180.661  9118.40  180.661  472.863   4.6880  472.863   4.6880 -0.000000 0.000000 
1 1 1    6    0  -51 o   49.474   2.2003  100.355   8.8335  100.355   8.8335  100.355   8.8335   49.474   2.2003   49.474   2.2003 0.000000 0.000000 
1 1 1    6    0  -50 f  210.677   2.2088  1809.70   37.923  1809.70   37.923  1809.70   37.923  210.677   2.2088  210.677   2.2088 -0.000000 0.000000 
1 1 1    6    0  -49 o  110.843   1.6176  501.085   14.609  501.085   14.609  501.085   14.609  110.843   1.6176  110.843   1.6176 -0.000000 0.000000 
1 1 1    6    0  -48 o  274.963   2.1231  3082.12   47.579  3082.12   47.579  3082.12   47.579  274.963   2.1231  274.963   2.1231 0.000000 0.000000 
1 1 1    6    0  -47 o  117.541   1.8141  563.515   17.372  563.515   17.372  563.515   17.372  117.541   1.8141  117.541   1.8141 0.000000 0.000000 
1 1 1    6    0  -46 o   6.0440   4.0840  -2.8675   5.8884  -2.8675   5.8884  -2.8675   5.8884   6.0440   4.0840   6.0440   4.0840 0.000000 0.000000 
1 1 1    6    0  -45 o  727.397   4.9570 21572.13  293.890 21572.13  293.890 21572.13  293.890  727.397   4.9570  727.397   4.9570 0.000000 0.000000 
1 1 1    6    0  -44 o  534.787   3.7153 11659.38  161.945 11659.38  161.945 11659.38  161.945  534.787   3.7153  534.787   3.7153 0.000000 0.000000 
1 1 1    6    0  -43 o  764.737   5.6947 23845.41  354.951 23845.41  354.951 23845.41  354.951  764.737   5.6947  764.737   5.6947 0.000000 0.000000 
1 1 1    6    0  -42 o  572.630   4.3304 13368.60  202.109 13368.60  202.109 13368.60  202.109  572.630   4.3304  572.630   4.3304 -0.000000 0.000000 
1 1 1    6    0  -41 o  331.345   2.6827  4475.83   72.447  4475.83   72.447  4475.83   72.447  331.345   2.6827  331.345   2.6827 0.000000 0.000000 
1 1 1    6    0  -40 o   89.615   2.2114  327.923   16.132  327.923   16.132  327.923   16.132   89.615   2.2114   89.615   2.2114 0.000000 0.000000 
1 1 1    6    0  -39 o   83.698   1.6944  285.875   11.550  285.875   11.550  285.875   11.550   83.698   1.6944   83.698   1.6944 -0.000000 0.000000 
1 1 1    6    0  -38 o  550.101   4.6537 12337.97  208.645 12337.97  208.645 12337.97  208.645  550.101   4.6537  550.101   4.6537 -0.000000 0.000000 
1 1 1    6    0  -37 o  499.787   4.2572 10184.00  173.412 10184.00  173.412 10184.00  173.412  499.787   4.2572  499.787   4.2572 0.000000 0.000000 
1 1 1    6    0  -36 o  483.675   4.1329  9537.92  162.921  9537.92  162.921  9537.92  162.921  483.675   4.1329  483.675   4.1329 -0.000000 0.000000 
1 1 1    6    0  -35 o  209.231   2.1310  1784.86   36.336  1784.86   36.336  1784.86   36.336  209.231   2.1310  209.231   2.1310 -0.000000 0.000000 
1 1 1    6    0  -34 o   98.187   1.6679  393.278   13.340  393.278   13.340  393.278   13.340   98.187   1.6679   98.187   1.6679 -0.000000 0.000000 
1 1 1    6    0  -33 o  363.301   2.8791  5380.76   85.250  5380.76   85.250  5380.76   85.250  363.301   2.8791  363.301   2.8791 0.000000 0.000000 
1 1 1    6    0  -32 o  163.645   1.9180  1091.95   25.577  1091.95   25.577  1091.95   25.577  163.645   1.9180  163.645   1.9180 -0.000000 0.000000 
1 1 1    6    0  -31 o  600.952   4.5199 14723.66  221.385 14723.66  221.385 14723.66  221.385  600.952   4.5199  600.952   4.5199 -0.000000 0.000000 
1 1 1    6    0  -30 o  1234.70   9.0701 62178.02  912.758 62178.02  912.758 62178.02  912.758  1234.70   9.0701  1234.70   9.0701 -0.000000 0.000000 
1 1 1    6    0  -29 o  390.590   3.0593  6219.50   97.390  6219.50   97.390  6219.50   97.390  390.590   3.0593  390.590   3.0593 0.000000 0.000000 
1 1 1    6    0  -28 o  880.121   7.2785 31589.92  522.102 31589.92  522.102 31589.92  522.102  880.121   7.2785  880.121   7.2785 -0.000000 0.000000 
1 1 1    6    0  -27 o  221.626   2.2204  2002.60   40.104  2002.60   40.104  2002.60   40.104  221.626   2.2204  221.626   2.2204 -0.000000 0.000000 
1 1 1    6    0  -26 o  860.833   7.1233 30221.41  499.769 30221.41  499.769 30221.41  499.769  860.833   7.1233  860.833   7.1233 0.000000 0.000000 
1 1 1    6    0  -25 f   22.267   2.5971   21.020   4.5466   21.020   4.5466   21.020   4.5466   22.267   2.5971   22.267   2.5971 -0.000000 0.000000 
1 1 1    6    0  -24 o  382.327   2.9946  5959.25   93.315  5959.25   93.315  5959.25   93.315  382.327   2.9946  382.327   2.9946 0.000000 0.000000 
1 1 1    6    0  -23 o  210.258   1.9015  1802.33   32.585  1802.33   32.585  1802.33   32.585  210.258   1.9015  210.258   1.9015 -0.000000 0.000000 
1 1 1    6    0  -22 o  230.341   2.0174  2163.05   37.872  2163.05   37.872  2163.05   37.872  230.341   2.0174  230.341   2.0174 -0.000000 0.000000 
1 1 1    6    0  -21 o  333.722   2.6691  4540.40   72.598  4540.40   72.598  4540.40   72.598  333.722   2.6691  333.722   2.6691 -0.000000 0.000000 
1 1 1    6    0  -20 o  274.172   2.5625  3064.77   57.258  3064.77   57.258  3064.77   57.258  274.172   2.5625  274.172   2.5625 -0.000000 0.000000 
1 1 1    6    0  -19 o  455.784   3.4975  8469.63  129.926  8469.63  129.926  8469.63  129.926  455.784   3.4975  455.784   3.4975 -0.000000 0.000000 
1 1 1    6    0  -18 o  285.293   2.3537  3318.23   54.729  3318.23   54.729  3318.23   54.729  285.293   2.3537  285.293   2.3537 -0.000000 0.000000 
1 1 1    6    0  -17 o   34.242   1.8573   48.212   5.1492   48.212   5.1492   48.212   5.1492   34.242   1.8573   34.242   1.8573 -0.000000 0.000000 
1 1 1    6    0  -16 o   49.558   2.1207  100.654   8.5312  100.654   8.5312  100.654   8.5312   49.558   2.1207   49.558   2.1207 -0.000000 0.000000 
1 1 1    6    0  -15 o  362.689   3.2051  5363.34   94.739  5363.34   94.739  5363.34   94.739  362.689   3.2051  362.689   3.2051 -0.000000 0.000000 
1 1 1    6    0  -14 f  273.428   2.9521  3048.57   65.781  3048.57   65.781  3048.57   65.781  273.428   2.9521  273.428   2.9521 -0.000000 0.000000 
1 1 1    6    0  -12 o   79.984   2.2455  261.379   14.614  261.379   14.614  261.379   14.614   79.984   2.2455   79.984   2.2455 0.000000 0.000000 
1 1 1    6    0  -11 o  376.788   3.8107  5789.22  117.015  5789.22  117.015  5789.22  117.015  376.788   3.8107  376.788   3.8107 -0.000000 0.000000 
1 1 1    6    0  -10 o  275.792   2.9532  3101.48   66.374  3101.48   66.374  3101.48   66.374  275.792   2.9532  275.792   2.9532 -0.000000 0.000000 
1 1 1    6    0   -9 o  129.858   1.9231  687.786   20.347  687.786   20.347  687.786   20.347  129.858   1.9231  129.858   1.9231 -0.000000 0.000000 
1 1 1    6    0   -8 o  319.327   3.3137  4157.96   86.235  4157.96   86.235  4157.96   86.235  319.327   3.3137  319.327   3.3137 0.000000 0.000000 
1 1 1    6    0   -7 o  102.729   1.5950  430.446   13.349  430.446   13.349  430.446   13.349  102.729   1.5950  102.729   1.5950 -0.000000 0.000000 
1 1 1    6    0   -6 o  162.402   1.8397  1075.42   24.347  1075.42   24.347  1075.42   24.347  162.402   1.8397  162.402   1.8397 0.000000 0.000000 
1 1 1    6    0   -5 o  307.018   2.7874  3843.12   69.747  3843.12   69.747  3843.12   69.747  307.018   2.7874  307.018   2.7874 -0.000000 0.000000 
1 1 1    6    0   -4 o  261.753   2.4660  2793.45   52.606  2793.45   52.606  2793.45   52.606  261.753   2.4660  261.753   2.4660 -0.000000 0.000000 
1 1 1    6    0   -3 o  152.457   1.7882  947.756   22.215  947.756   22.215  947.756   22.215  152.457   1.7882  152.457   1.7882 -0.000000 0.000000 
1 1 1    6    0   -2 o  541.611   4.5775 11961.66  202.061 11961.66  202.061 11961.66  202.061  541.611   4.5775  541.611   4.5775 0.000000 0.000000 
1 1 1    6    0   -1 o   91.000   1.5893  337.831   11.781  337.831   11.781  337.831   11.781   91.000   1.5893   91.000   1.5893 -0.000000 0.000000 
1 1 1    6    0    0 o   22.027   3.1343   20.944   5.2989   20.944   5.2989   20.944   5.2989   22.027   3.1343   22.027   3.1343 -0.000000 0.000000 
1 1 1    6    0    1 o  234.740   2.6322  2246.89   50.351  2246.89   50.351  2246.89   50.351  234.740   2.6322  234.740   2.6322 -0.000000 0.000000 
1 1 1    6    0    2 o  252.642   2.7732  2602.65   57.096  2602.65   57.096  2602.65   57.096  252.642   2.7732  252.642   2.7732 -0.000000 0.000000 
1 1 1    6    0    3 o  132.117   1.9517  711.917   21.008  711.917   21.008  711.917   21.008  132.117   1.9517  132.117   1.9517 0.000000 0.000000 
1 1 1    6    0    4 o  344.431   3.5350  4837.46   99.226  4837.46   99.226  4837.46   99.226  344.431   3.5350  344.431   3.5350 -0.000000 0.000000 
1 1 1    6    0    5 o  685.269   6.5989 19155.59  368.532 19155.59  368.532 19155.59  368.532  685.269   6.5989  685.269   6.5989 -0.000000 0.000000 
1 1 1    6    0    6 o  710.657   6.8337 20602.19  395.790 20602.19  395.790 20602.19  395.790  710.657   6.8337  710.657   6.8337 -0.000000 0.000000 
1 1 1    6    0    7 o  387.065   3.9075  6109.33  123.259  6109.33  123.259  6109.33  123.259  387.065   3.9075  387.065   3.9075 0.000000 0.000000 
1 1 1    6    0    8 o  197.662   2.3649  1593.20   38.092  1593.20   38.092  1593.20   38.092  197.662   2.3649  197.662   2.3649 0.000000 0.000000 
1 1 1    6    0    9 o  252.779   3.4070  2606.11   70.174  2606.11   70.174  2606.11   70.174  252.779   3.4070  252.779   3.4070 -0.000000 0.000000 
1 1 1    6    0   10 o   68.344   2.3373  191.053   12.987  191.053   12.987  191.053   12.987   68.344   2.3373   68.344   2.3373 0.000000 0.000000 
1 1 1    6    0   11 o  382.847   4.7437  5978.50  147.988  5978.50  147.988  5978.50  147.988  382.847   4.7437  382.847   4.7437 -0.000000 0.000000 
1 1 1    6    0   12 o  383.127   6.7202  5991.84  209.730  5991.84  209.730  5991.84  209.730  383.127   6.7202  383.127   6.7202 0.000000 0.000000 
1 1 1    6    0   13 o  338.297   6.0518  4671.26  166.765  4671.26  166.765  4671.26  166.765  338.297   6.0518  338.297   6.0518 0.000000 0.000000 
1 1 1    6    0   14 f  506.260   6.0872 10455.81  251.123 10455.81  251.123 10455.81  251.123  506.260   6.0872  506.260   6.0872 0.000000 0.000000 
1 1 1    6    0   15 o  208.880   3.0021  1779.59   51.093  1779.59   51.093  1779.59   51.093  208.880   3.0021  208.880   3.0021 -0.000000 0.000000 
1 1 1    6    0   16 o  384.899   4.7697  6042.68  149.597  6042.68  149.597  6042.68  149.597  384.899   4.7697  384.899   4.7697 0.000000 0.000000 
1 1 1    6    0   17 o   8.1979   5.1914   0.9391   7.4699   0.9391   7.4699   0.9391   7.4699   8.1979   5.1914   8.1979   5.1914 0.000000 0.000000 
1 1 1    6    0   18 o  1137.50   13.252 52874.10  1228.39 52874.10  1228.39 52874.10  1228.39  1137.50   13.252  1137.50   13.252 -0.000000 0.000000 
1 1 1    6    0   19 o  237.864   3.2818  2307.63   63.605  2307.63   63.605  2307.63   63.605  237.864   3.2818  237.864   3.2818 -0.000000 0.000000 
1 1 1    6    0   20 o  529.266   6.3503 11427.34  273.884 11427.34  273.884 11427.34  273.884  529.266   6.3503  529.266   6.3503 0.000000 0.000000 
1 1 1    6    0   21 o  292.168   3.8144  3481.47   90.809  3481.47   90.809  3481.47   90.809  292.168   3.8144  292.168   3.8144 0.000000 0.000000 
1 1 1    6    0   22 o  108.949   2.3523  484.486   20.868  484.486   20.868  484.486   20.868  108.949   2.3523  108.949   2.3523 0.000000 0.000000 
1 1 1    6    0   23 o  749.682   8.8216 22933.78  538.924 22933.78  538.924 22933.78  538.924  749.682   8.8216  749.682   8.8216 0.000000 0.000000 
1 1 1    6    0   24 o  370.191   4.6254  5589.19  139.526  5589.19  139.526  5589.19  139.526  370.191   4.6254  370.191   4.6254 -0.000000 0.000000 
1 1 1    6    0   25 f  139.106   2.5219  789.493   28.575  789.493   28.575  789.493   28.575  139.106   2.5219  139.106   2.5219 -0.000000 0.000000 
1 1 1    6    0   26 o   77.904   2.3934  248.068   15.166  248.068   15.166  248.068   15.166   77.904   2.3934   77.904   2.3934 -0.000000 0.000000 
1 1 1    6    0   27 o  310.848   4.0158  3940.71  101.717  3940.71  101.717  3940.71  101.717  310.848   4.0158  310.848   4.0158 0.000000 0.000000 
1 1 1    6    0   28 o  838.804   9.8439 28708.77  672.864 28708.77  672.864 28708.77  672.864  838.804   9.8439  838.804   9.8439 -0.000000 0.000000 
1 1 1    6    0   29 o  472.982   5.7375  9124.01  221.134  9124.01  221.134  9124.01  221.134  472.982   5.7375  472.982   5.7375 -0.000000 0.000000 
1 1 1    6    0   30 o  717.021   8.4579 20972.80  494.190 20972.80  494.190 20972.80  494.190  717.021   8.4579  717.021   8.4579 -0.000000 0.000000 
1 1 1    6    0   31 o  532.133   6.3901 11549.10  277.093 11549.10  277.093 11549.10  277.093  532.133   6.3901  532.133   6.3901 -0.000000 0.000000 
1 1 1    6    0   32 o  276.065   3.6761  3108.10   82.692  3108.10   82.692  3108.10   82.692  276.065   3.6761  276.065   3.6761 0.000000 0.000000 
1 1 1    6    0   33 o  145.666   2.6008  865.670   30.860  865.670   30.860  865.670   30.860  145.666   2.6008  145.666   2.6008 -0.000000 0.000000 
1 1 1    6    0   34 o  404.495   7.0699  6676.71  232.952  6676.71  232.952  6676.71  232.952  404.495   7.0699  404.495   7.0699 0.000000 0.000000 
1 1 1    6    0   35 o  146.986   3.6581  882.259   43.768  882.259   43.768  882.259   43.768  146.986   3.6581  146.986   3.6581 0.000000 0.000000 
1 1 1    6    0   36 o  763.744   12.722 23817.24  791.512 23817.24  791.512 23817.24  791.512  763.744   12.722  763.744   12.722 -0.000000 0.000000 
1 1 1    6    0   37 o  473.812   8.1384  9161.80  314.118  9161.80  314.118  9161.80  314.118  473.812   8.1384  473.812   8.1384 0.000000 0.000000 
1 1 1    6    0   38 o  308.503   4.0167  3881.42  100.971  3881.42  100.971  3881.42  100.971  308.503   4.0167  308.503   4.0167 -0.000000 0.000000 
1 1 1    6    0   39 o  467.393   5.6936  8909.51  216.851  8909.51  216.851  8909.51  216.851  467.393   5.6936  467.393   5.6936 0.000000 0.000000 
1 1 1    6    0   40 o  603.161   7.1953 14839.08  353.655 14839.08  353.655 14839.08  353.655  603.161   7.1953  603.161   7.1953 0.000000 0.000000 
1 1 1    6    0   41 o  902.591   8.6318 33229.77  634.948 33229.77  634.948 33229.77  634.948  902.591   8.6318  902.591   8.6318 -0.000000 0.000000 
1 1 1    6    0   42 o  802.629   7.7084 26274.63  504.224 26274.63  504.224 26274.63  504.224  802.629   7.7084  802.629   7.7084 -0.000000 0.000000 
1 1 1    6    0   43 o  916.599   8.7635 34270.85  654.643 34270.85  654.643 34270.85  654.643  916.599   8.7635  916.599   8.7635 0.000000 0.000000 
1 1 1    6    0   44 o  1156.86   11.003 54611.16  1037.40 54611.16  1037.40 54611.16  1037.40  1156.86   11.003  1156.86   11.003 -0.000000 0.000000 
1 1 1    6    0   45 o  748.912   7.2189 22875.21  440.601 22875.21  440.601 22875.21  440.601  748.912   7.2189  748.912   7.2189 -0.000000 0.000000 
1 1 1    6    0   46 o  239.885   3.4986  2347.10   68.379  2347.10   68.379  2347.10   68.379  239.885   3.4986  239.885   3.4986 -0.000000 0.000000 
1 1 1    6    0   47 o  197.801   2.5610  1595.53   41.276  1595.53   41.276  1595.53   41.276  197.801   2.5610  197.801   2.5610 -0.000000 0.000000 
1 1 1    6    0   48 o   79.285   3.2003  257.478   20.606  257.478   20.606  257.478   20.606   79.285   3.2003   79.285   3.2003 -0.000000 0.000000 
1 1 1    6    0   49 o   47.192   3.4297   92.209   13.030   92.209   13.030   92.209   13.030   47.192   3.4297   47.192   3.4297 -0.000000 0.000000 
1 1 1    6    0   50 f  237.507   2.7800  2300.24   53.806  2300.24   53.806  2300.24   53.806  237.507   2.7800  237.507   2.7800 0.000000 0.000000 
1 1 1    6    0   51 o  232.220   2.7344  2198.99   51.745  2198.99   51.745  2198.99   51.745  232.220   2.7344  232.220   2.7344 0.000000 0.000000 
1 1 1    6    0   52 o  187.891   2.4488  1439.69   37.490  1439.69   37.490  1439.69   37.490  187.891   2.4488  187.891   2.4488 0.000000 0.000000 
1 1 1    6    0   53 f   64.774   2.5849  171.838   13.599  171.838   13.599  171.838   13.599   64.774   2.5849   64.774   2.5849 -0.000000 0.000000 
1 1 1    6    0   54 o  1000.08   11.702 40862.12  953.656 40862.12  953.656 40862.12  953.656  1000.08   11.702  1000.08   11.702 0.000000 0.000000 
1 1 1    6    0   55 o  108.854   2.7616  483.929   24.469  483.929   24.469  483.929   24.469  108.854   2.7616  108.854   2.7616 0.000000 0.000000 
1 1 1    6    0   56 o   31.789   5.8624   45.170   13.669   45.170   13.669   45.170   13.669   31.789   5.8624   31.789   5.8624 -0.000000 0.000000 
1 1 1    6    0   57 o  123.672   2.7355  624.377   27.547  624.377   27.547  624.377   27.547  123.672   2.7355  123.672   2.7355 0.000000 0.000000 
1 1 1    6    0   58 o  215.319   2.5638  1890.67   44.984  1890.67   44.984  1890.67   44.984  215.319   2.5638  215.319   2.5638 0.000000 0.000000 
1 1 1    6    0   59 o  158.832   1.9247  1028.74   24.911  1028.74   24.911  1028.74   24.911  158.832   1.9247  158.832   1.9247 0.000000 0.000000 
1 1 1    6    0   60 o  430.583   3.7469  7560.89  131.488  7560.89  131.488  7560.89  131.488  430.583   3.7469  430.583   3.7469 0.000000 0.000000 
1 1 1    6    0   61 o  493.889   4.2324  9948.94  170.367  9948.94  170.367  9948.94  170.367  493.889   4.2324  493.889   4.2324 0.000000 0.000000 
1 1 1    6    0   62 o  202.186   2.1521  1666.94   35.459  1666.94   35.459  1666.94   35.459  202.186   2.1521  202.186   2.1521 -0.000000 0.000000 
1 1 1    6    0   63 o  210.866   2.2019  1813.15   37.839  1813.15   37.839  1813.15   37.839  210.866   2.2019  210.866   2.2019 0.000000 0.000000 
1 1 1    6    0   64 o  196.829   2.1258  1579.81   34.098  1579.81   34.098  1579.81   34.098  196.829   2.1258  196.829   2.1258 0.000000 0.000000 
1 1 1    6    0   65 o  236.466   2.3644  2280.18   45.565  2280.18   45.565  2280.18   45.565  236.466   2.3644  236.466   2.3644 0.000000 0.000000 
1 1 1    6    0   66 o   71.834   1.8953  210.784   11.081  210.784   11.081  210.784   11.081   71.834   1.8953   71.834   1.8953 0.000000 0.000000 
1 1 1    6    0   67 o  110.518   2.3977  498.652   21.578  498.652   21.578  498.652   21.578  110.518   2.3977  110.518   2.3977 0.000000 0.000000 
1 1 1    6    0   68 o  474.086   4.0890  9169.90  157.993  9169.90  157.993  9169.90  157.993  474.086   4.0890  474.086   4.0890 -0.000000 0.000000 
1 1 1    6    0   69 o  124.059   1.8294  627.794   18.491  627.794   18.491  627.794   18.491  124.059   1.8294  124.059   1.8294 0.000000 0.000000 
1 1 1    6    0   70 o  192.027   2.1076  1503.79   32.981  1503.79   32.981  1503.79   32.981  192.027   2.1076  192.027   2.1076 -0.000000 0.000000 
1 1 1    6    0   71 o   38.390   2.6034   60.914   8.0596   60.914   8.0596   60.914   8.0596   38.390   2.6034   38.390   2.6034 0.000000 0.000000 
1 1 1    6    0   72 o  135.000   1.8532  743.367   20.385  743.367   20.385  743.367   20.385  135.000   1.8532  135.000   1.8532 -0.000000 0.000000 
1 1 1    6    0   73 o  208.104   2.2037  1766.18   37.374  1766.18   37.374  1766.18   37.374  208.104   2.2037  208.104   2.2037 0.000000 0.000000 
1 1 1    6    0   74 o   78.532   1.8701  251.840   11.956  251.840   11.956  251.840   11.956   78.532   1.8701   78.532   1.8701 0.000000 0.000000 
1 1 1    6    0   75 o   74.868   1.9161  228.952   11.676  228.952   11.676  228.952   11.676   74.868   1.9161   74.868   1.9161 0.000000 0.000000 
1 1 1    6    0   76 o  324.014   3.4202  4283.59   90.312  4283.59   90.312  4283.59   90.312  324.014   3.4202  324.014   3.4202 -0.000000 0.000000 
1 1 1    6    0   77 o   97.553   2.0703  388.509   16.446  388.509   16.446  388.509   16.446   97.553   2.0703   97.553   2.0703 -0.000000 0.000000 
1 1 1    6    0   78 o  194.561   2.4464  1544.20   38.785  1544.20   38.785  1544.20   38.785  194.561   2.4464  194.561   2.4464 -0.000000 0.000000 
1 1 1    6    0   79 o  152.679   2.2199  951.032   27.615  951.032   27.615  951.032   27.615  152.679   2.2199  152.679   2.2199 0.000000 0.000000 
1 1 1    6    0   80 o   63.213   2.1529  163.484   11.064  163.484   11.064  163.484   11.064   63.213   2.1529   63.213   2.1529 0.000000 0.000000 
1 1 1    6    0   81 o  202.548   2.2237  1673.38   36.705  1673.38   36.705  1673.38   36.705  202.548   2.2237  202.548   2.2237 0.000000 0.000000 
1 1 1    6    0   82 o  170.691   2.0991  1188.46   29.197  1188.46   29.197  1188.46   29.197  170.691   2.0991  170.691   2.0991 0.000000 0.000000 
1 1 1    6    0   83 o  262.556   3.0611  2813.05   65.495  2813.05   65.495  2813.05   65.495  262.556   3.0611  262.556   3.0611 0.000000 0.000000 
1 1 1    6    0   84 o   87.791   2.0779  314.775   14.851  314.775   14.851  314.775   14.851   87.791   2.0779   87.791   2.0779 0.000000 0.000000 
1 1 1    6    0   85 o   92.748   2.0002  351.230   15.106  351.230   15.106  351.230   15.106   92.748   2.0002   92.748   2.0002 -0.000000 0.000000 
1 1 1    6    0   86 o   11.894   6.4181   8.2120   8.6490   8.2120   8.6490   8.2120   8.6490   11.894   6.4181   11.894   6.4181 0.000000 0.000000 
1 1 1    6    0   87 o   58.951   2.3592  142.411   11.295  142.411   11.295  142.411   11.295   58.951   2.3592   58.951   2.3592 -0.000000 0.000000 
1 1 1    6    0   88 o  344.779   3.1629  4852.10   88.875  4852.10   88.875  4852.10   88.875  344.779   3.1629  344.779   3.1629 -0.000000 0.000000 
1 1 1    6    0   89 o  176.272   2.4047  1268.07   34.538  1268.07   34.538  1268.07   34.538  176.272   2.4047  176.272   2.4047 0.000000 0.000000 
1 1 1    6    0   90 o   9.9288   6.0219   3.7333   9.0360   3.7333   9.0360   3.7333   9.0360   9.9288   6.0219   9.9288   6.0219 0.000000 0.000000 
1 1 1    6    0   91 o   42.725   3.2676   75.814   11.223   75.814   11.223   75.814   11.223   42.725   3.2676   42.725   3.2676 -0.000000 0.000000 
1 1 1    6    0   92 o  316.003   3.3998  4079.06   87.553  4079.06   87.553  4079.06   87.553  316.003   3.3998  316.003   3.3998 0.000000 0.000000 
1 1 1    6    0   93 o  129.655   2.2336  686.344   23.591  686.344   23.591  686.344   23.591  129.655   2.2336  129.655   2.2336 0.000000 0.000000 
1 1 1    6    0   94 o  206.181   2.5895  1735.59   43.505  1735.59   43.505  1735.59   43.505  206.181   2.5895  206.181   2.5895 0.000000 0.000000 
1 1 1    6    0   95 o   69.153   2.6099  196.002   14.665  196.002   14.665  196.002   14.665   69.153   2.6099   69.153   2.6099 0.000000 0.000000 
1 1 1    6    0   96 o   34.994   4.3048   52.320   11.782   52.320   11.782   52.320   11.782   34.994   4.3048   34.994   4.3048 -0.000000 0.000000 
1 1 1    6    0   97 f   78.754   2.5348  253.950   16.234  253.950   16.234  253.950   16.234   78.754   2.5348   78.754   2.5348 0.000000 0.000000 
1 1 1    6    0   98 o  167.631   2.1239  1147.19   29.011  1147.19   29.011  1147.19   29.011  167.631   2.1239  167.631   2.1239 -0.000000 0.000000 
1 1 1    6    0   99 o   74.203   2.3205  225.420   14.005  225.420   14.005  225.420   14.005   74.203   2.3205   74.203   2.3205 0.000000 0.000000 
1 1 1    6    0  100 o   61.059   2.4756  152.995   12.275  152.995   12.275  152.995   12.275   61.059   2.4756   61.059   2.4756 -0.000000 0.000000 
1 1 1    6    0  101 o   93.609   2.0379  358.164   15.534  358.164   15.534  358.164   15.534   93.609   2.0379   93.609   2.0379 -0.000000 0.000000 
1 1 1    6    0  102 o  113.014   1.9789  521.819   18.218  521.819   18.218  521.819   18.218  113.014   1.9789  113.014   1.9789 0.000000 0.000000 
1 1 1    6    0  103 o   63.681   2.3163  166.319   11.988  166.319   11.988  166.319   11.988   63.681   2.3163   63.681   2.3163 0.000000 0.000000 
1 1 1    6    0  104 o  147.414   2.0341  887.943   24.433  887.943   24.433  887.943   24.433  147.414   2.0341  147.414   2.0341 -0.000000 0.000000 
1 1 1    6    0  105 o   39.091   3.6840   64.354   11.485   64.354   11.485   64.354   11.485   39.091   3.6840   39.091   3.6840 0.000000 0.000000 
1 1 1    6    0  106 o   30.356   3.9069   39.690   9.2282   39.690   9.2282   39.690   9.2282   30.356   3.9069   30.356   3.9069 -0.000000 0.000000 
1 1 1    6    0  107 o   87.755   2.0291  315.202   14.497  315.202   14.497  315.202   14.497   87.755   2.0291   87.755   2.0291 0.000000 0.000000 
1 1 1    6    0  108 o   33.113   3.4902   46.526   9.1583   46.526   9.1583   46.526   9.1583   33.113   3.4902   33.113   3.4902 0.000000 0.000000 
1 1 1    6    0  109 o   22.036   6.2087   24.398   9.6543   24.398   9.6543   24.398   9.6543   22.036   6.2087   22.036   6.2087 -0.000000 0.000000 
1 1 1    6    0  110 o   26.652   4.4264   31.641   8.8198   31.641   8.8198   31.641   8.8198   26.652   4.4264   26.652   4.4264 0.000000 0.000000 
1 1 1    6    0  111 o   60.263   2.3258  149.400   11.386  149.400   11.386  149.400   11.386   60.263   2.3258   60.263   2.3258 0.000000 0.000000 
1 1 1    6    0  112 o   9.1040   5.6349   2.7489   8.2851   2.7489   8.2851   2.7489   8.2851   9.1040   5.6349   9.1040   5.6349 0.000000 0.000000 
1 1 1    6    0  113 o   31.179   4.1080   42.275   9.9374   42.275   9.9374   42.275   9.9374   31.179   4.1080   31.179   4.1080 0.000000 0.000000 
1 1 1    6    0  114 o   48.135   3.3665   96.987   13.058   96.987   13.058   96.987   13.058   48.135   3.3665   48.135   3.3665 0.000000 0.000000 
1 1 1    6    0  115 o   93.420   2.2454  358.423   17.076  358.423   17.076  358.423   17.076   93.420   2.2454   93.420   2.2454 0.000000 0.000000 
1 1 1    6    0  116 o   15.770   6.6127   14.857   8.5322   14.857   8.5322   14.857   8.5322   15.770   6.6127   15.770   6.6127 -0.000000 0.000000 
1 1 1    6    0  117 o   42.299   2.9175   74.762   9.9476   74.762   9.9476   74.762   9.9476   42.299   2.9175   42.299   2.9175 0.000000 0.000000 
1 1 1    6    0  118 o   17.468   6.8837   17.879   9.4119   17.879   9.4119   17.879   9.4119   17.468   6.8837   17.468   6.8837 0.000000 0.000000 
1 1 1    6    0  119 o   9.6552   5.8553   4.1607   8.5411   4.1607   8.5411   4.1607   8.5411   9.6552   5.8553   9.6552   5.8553 0.000000 0.000000 
1 1 1    6    0  120 o   10.086   5.9440   5.3889   8.3301   5.3889   8.3301   5.3889   8.3301   10.086   5.9440   10.086   5.9440 0.000000 0.000000 
1 1 1    6    0  121 o   11.037   6.2291   7.3649   8.5673   7.3649   8.5673   7.3649   8.5673   11.037   6.2291   11.037   6.2291 0.000000 0.000000 
1 1 1    6    0  122 o   7.7791   5.1449  -1.2147   8.5001  -1.2147   8.5001  -1.2147   8.5001   7.7791   5.1449   7.7791   5.1449 0.000000 0.000000 
1 1 1    6    0  123 o   39.400   3.0971   65.701   9.8015   65.701   9.8015   65.701   9.8015   39.400   3.0971   39.400   3.0971 0.000000 0.000000 
1 1 1    6    0  124 f   8.0983   5.2875  -0.0260   8.5486  -0.0260   8.5486  -0.0260   8.5486   8.0983   5.2875   8.0983   5.2875 0.000000 0.000000 
1 1 1    6    0  125 o   9.1360   5.6891   3.2084   8.5735   3.2084   8.5735   3.2084   8.5735   9.1360   5.6891   9.1360   5.6891 0.000000 0.000000 
1 1 1    6    0  126 o   40.263   3.8870   70.456   12.466   70.456   12.466   70.456   12.466   40.263   3.8870   40.263   3.8870 0.000000 0.000000 
1 1 1    6    0  127 o   9.1964   6.0018   0.7588   10.997   0.7588   10.997   0.7588   10.997   9.1964   6.0018   9.1964   6.0018 0.000000 0.000000 
1 1 1    6    0  128 o   8.8516   5.8701  -0.8668   11.187  -0.8668   11.187  -0.8668   11.187   8.8516   5.8701   8.8516   5.8701 0.000000 0.000000 
1 1 1    6    0  129 o   24.265   7.0641   32.041   12.128   32.041   12.128   32.041   12.128   24.265   7.0641   24.265   7.0641 0.000000 0.000000 
1 1 1    6    0  130 o   13.024   7.7003   11.403   14.060   11.403   14.060   11.403   14.060   13.024   7.7003   13.024   7.7003 0.000000 0.000000 
1 1 1    6    0  131 o   11.682   7.8589  -0.4368   21.354  -0.4368   21.354  -0.4368   21.354   11.682   7.8589   11.682   7.8589 0.000000 0.000000 
1 1 1    6    0  132 o   22.862   11.171   43.357   24.589   43.357   24.589   43.357   24.589   22.862   11.171   22.862   11.171 0.000000 0.000000 
1 1 1    6    0  133 o   9.6684   6.5413  -2.9261   15.200  -2.9261   15.200  -2.9261   15.200   9.6684   6.5413   9.6684   6.5413 0.000000 0.000000 
1 1 1    6    0  134 o   8.9088   6.1276  -6.2376   14.573  -6.2376   14.573  -6.2376   14.573   8.9088   6.1276   8.9088   6.1276 0.000000 0.000000 
1 1 1    6    0  135 o   9.7793   6.5613  -1.2805   14.699  -1.2805   14.699  -1.2805   14.699   9.7793   6.5613   9.7793   6.5613 0.000000 0.000000 
1 1 1    6    0  136 o   11.540   7.3042   6.6514   14.767   6.6514   14.767   6.6514   14.767   11.540   7.3042   11.540   7.3042 0.000000 0.000000 
1 1 1    6    0  137 f   9.3851   6.3769  -3.5200   14.760  -3.5200   14.760  -3.5200   14.760   9.3851   6.3769   9.3851   6.3769 0.000000 0.000000 
1 1 1    6    1 -137 o   14.965   6.5430   6.3465   15.145   40.908   21.210 -29.6068   21.633   24.492   8.5915   12.059   5.9642 12.43364 10.45877 
1 1 1    6    1 -136 o   28.015   5.1635   38.649   11.357   47.614   16.289   30.169   15.843   29.141   6.9545   22.351   7.4355 6.790892 10.18096 
1 1 1    6    1 -135 o   17.140   5.6259   15.048   9.0794   12.864   11.423   18.795   14.961   16.191   6.1970   18.405   7.0799 -2.214622 9.408877 
1 1 1    6    1 -134 o   17.598   5.6578   15.880   9.2092   24.176   11.708   2.4189   14.914   21.107   6.3154   14.051   6.2984 7.055359 8.919291 
1 1 1    6    1 -133 o   14.575   5.3484   9.7218   8.3231   7.4355   11.208   12.533   12.428   14.331   5.9158   16.296   6.4006 -1.965314 8.715773 
1 1 1    6    1 -132 o   10.508   4.6291   0.0748   7.7111  -0.5693   9.8986   1.0690   12.298   11.483   5.1405   12.937   5.7646 -1.453599 7.723661 
1 1 1    6    1 -131 o   9.8787   4.4712  -2.1155   7.7267   3.4421   10.043 -10.1778   12.096   12.733   5.4461   10.628   5.0627 2.104609 7.435849 
1 1 1    6    1 -130 o   13.530   5.1082   7.6125   7.6968  -2.7347   10.019   22.515   12.023   11.053   5.0374   20.526   6.4492 -9.473460 8.183357 
1 1 1    6    1 -129 o   13.812   5.2843   7.8083   8.3039   3.7320   9.9838   16.958   14.958   12.861   5.4633   18.256   7.0640 -5.394780 8.930131 
1 1 1    6    1 -128 o   14.720   5.0809   9.9368   7.4024   4.1826   9.7897   17.619   11.312   12.975   5.4556   18.563   6.2840 -5.587891 8.321742 
1 1 1    6    1 -127 o   26.627   3.4736   31.286   7.3597   42.514   10.456   20.263   10.361   30.503   4.3266   19.996   5.9308 10.50683 7.341243 
1 1 1    6    1 -126 o   61.404   1.8335  156.670   9.1670  147.507   12.849  166.170   13.083   58.942   2.6813   62.671   2.5663 -3.728832 3.711512 
1 1 1    6    1 -125 o   36.413   2.6107   56.242   7.6976   60.235   11.082   52.519   10.700   36.961   3.7290   34.384   3.8858 2.577461 5.385582 
1 1 1    6    1 -124 f   37.929   2.5213   60.705   7.7511   50.477   11.176   70.185   10.759   33.596   4.1704   40.317   3.3028 -6.721031 5.319830 
1 1 1    6    1 -123 o   14.550   4.9448   9.2954   7.0047   10.261   10.140   8.4141   9.6876   15.696   5.8766   14.810   5.6970 0.8855820 8.184750 
1 1 1    6    1 -122 o   30.693   3.0267   40.215   7.4740   39.148   10.653   41.250   10.488   29.456   4.5860   30.386   4.3592 -0.9291496 6.327270 
1 1 1    6    1 -121 o   21.268   4.3509   20.389   7.2883   3.3841   10.276   37.606   10.339   13.326   5.5953   28.974   4.5256 -15.64763 7.196409 
1 1 1    6    1 -120 o   31.225   2.5069   40.875   6.3272   31.392   10.547   46.207   7.9084   26.200   5.1220   33.033   2.9686 -6.833218 5.920126 
1 1 1    6    1 -119 o   35.282   2.2693   51.798   6.4919   46.627   10.954   54.598   8.0599   32.661   4.2123   36.051   2.7637 -3.390182 5.038032 
1 1 1    6    1 -118 o   17.953   4.0534   14.286   5.7911   17.771   10.186   12.622   7.0394   19.636   5.8942   16.780   4.8647 2.855196 7.642457 
1 1 1    6    1 -117 o   28.637   2.7110   34.394   6.2531   28.915   10.306   37.586   7.8666   25.325   5.1674   29.754   3.2987 -4.429544 6.130575 
1 1 1    6    1 -116 o   31.501   2.6989   41.494   6.8634   31.743   12.747   45.476   8.1449   26.216   6.0827   32.867   3.0758 -6.651571 6.816168 
1 1 1    6    1 -115 o   67.867   1.4589  188.705   8.0707  179.294   11.352  198.323   11.476   65.932   2.1150   69.377   2.0315 -3.445244 2.932604 
1 1 1    6    1 -114 o   55.165   1.5352  124.809   6.8964  128.873   9.9877  121.105   9.5342   55.875   2.1971   54.173   2.1634 1.702240 3.083485 
1 1 1    6    1 -113 o   53.493   1.5497  117.346   6.7501  118.276   9.6858  116.468   9.4123   53.531   2.2245   53.134   2.1777 0.3974304 3.113051 
1 1 1    6    1 -112 o   54.582   1.5090  122.089   6.7073  120.493   9.5871  123.619   9.3873   54.064   2.1799   54.782   2.1061 -0.7184830 3.031103 
1 1 1    6    1 -111 o   10.677   3.9287   3.8836   4.4957  -2.9478   6.0421   12.356   6.7289   8.7742   3.9643   16.803   4.7193 -8.029239 6.163393 
1 1 1    6    1 -110 o   36.857   1.7991   55.816   5.3888   51.088   7.3595   61.281   7.9124   35.102   2.5903   38.474   2.5371 -3.371613 3.625773 
1 1 1    6    1 -109 o   42.797   1.6859   75.118   5.8700   66.410   8.2605   84.000   8.3429   40.073   2.5419   45.148   2.2743 -5.075245 3.410815 
1 1 1    6    1 -108 o   25.355   2.4215   26.673   4.9441   23.566   6.8248   30.104   7.1721   23.539   3.6769   26.747   3.3638 -3.207500 4.983462 
1 1 1    6    1 -107 o   38.521   1.8477   60.907   5.7848   55.169   7.9467   67.374   8.4372   36.511   2.6890   40.390   2.5760 -3.879852 3.723808 
1 1 1    6    1 -106 o   51.331   1.5628  107.822   6.5317  107.872   9.2936  107.774   9.1819   51.237   2.2305   51.219   2.2044 0.1850891E-01 3.135994 
1 1 1    6    1 -105 o   62.213   1.5739  158.301   7.9752  147.561   11.330  168.850   11.228   59.939   2.3232   64.158   2.1500 -4.218494 3.165446 
1 1 1    6    1 -104 o   78.486   1.3410  251.542   8.5797  252.372   12.498  250.801   11.800   78.533   1.9522   78.305   1.8486 0.2286530 2.688611 
1 1 1    6    1 -103 o   20.969   2.7833   18.360   4.6400   19.980   6.1482   16.215   7.0722   21.732   3.5963   19.380   4.5543 2.352268 5.803023 
1 1 1    6    1 -102 o   21.508   2.7932   19.291   4.7815   12.327   6.4042   28.062   7.1876   16.952   4.5428   25.880   3.4965 -8.927402 5.732550 
1 1 1    6    1 -101 o   96.033   1.2541  376.325   9.8175  385.098   13.735  367.162   14.038   97.093   1.7355   94.794   1.8167 2.298401 2.512391 
1 1 1    6    1 -100 o  133.594   1.3356  728.310   14.545  712.995   19.274  748.568   22.167  132.118   1.7896  135.335   2.0094 -3.216980 2.690822 
1 1 1    6    1  -99 o   44.992   1.8323   82.813   6.7058   78.746   8.9075   88.134   10.188   43.798   2.5054   46.317   2.7102 -2.518692 3.690860 
1 1 1    6    1  -98 o  108.014   1.3623  476.019   11.995  477.428   17.293  474.712   16.651  108.112   1.9623  107.812   1.8947 0.2999649 2.727735 
1 1 1    6    1  -97 o   59.275   1.5523  143.481   7.4942  126.958   10.321  161.911   10.900   55.691   2.2782   62.919   2.1283 -7.227921 3.117706 
1 1 1    6    1  -96 o  132.409   1.2762  715.108   13.774  699.084   19.106  732.451   19.877  130.868   1.7910  133.952   1.8204 -3.083389 2.553712 
1 1 1    6    1  -95 o  113.781   1.6682  528.289   15.472  508.984   23.076  544.055   20.853  111.594   2.5368  115.413   2.2166 -3.818710 3.368760 
1 1 1    6    1  -94 o   83.204   1.4015  282.382   9.5057  277.036   11.942  291.628   15.704   82.393   1.7780   84.470   2.2829 -2.076782 2.893597 
1 1 1    6    1  -93 o  171.886   1.4778  1205.15   20.705  1184.61   25.992  1240.81   34.253  170.374   1.8715  174.294   2.4109 -3.919937 3.052039 
1 1 1    6    1  -92 o  146.663   1.4047  877.290   16.794  874.676   21.193  881.702   27.531  146.415   1.7757  146.947   2.2984 -0.5328979 2.904426 
1 1 1    6    1  -91 o  137.968   1.3227  776.268   14.876  769.887   19.663  784.809   22.748  137.370   1.7560  138.673   2.0124 -1.302979 2.670838 
1 1 1    6    1  -90 o   85.376   1.3246  297.242   9.2186  294.184   12.075  301.515   14.274   84.919   1.7443   85.956   2.0372 -1.037148 2.681925 
1 1 1    6    1  -89 o  224.289   1.5924  2051.77   29.114  2055.54   44.082  2048.85   38.773  224.392   2.4100  224.068   2.1228 0.3243713 3.211623 
1 1 1    6    1  -88 o   90.441   1.3962  333.549   10.293  346.702   16.090  324.437   13.392   92.175   2.1414   89.180   1.8422 2.994919 2.824732 
1 1 1    6    1  -87 o  138.704   1.3502  784.478   15.266  756.316   23.007  806.635   20.407  136.151   2.0730  140.626   1.7802 -4.475723 2.732462 
1 1 1    6    1  -86 o  248.825   1.7827  2525.27   36.159  2477.38   50.912  2574.03   51.365  246.362   2.5352  251.126   2.5092 -4.763748 3.566977 
1 1 1    6    1  -85 o   86.443   1.4159  304.686   9.9767  301.720   15.452  306.806   13.065   85.967   2.2069   86.731   1.8480 -0.7633286 2.878430 
1 1 1    6    1  -84 f  106.383   1.3645  461.437   11.832  448.282   18.197  471.073   15.574  104.829   2.1296  107.475   1.7777 -2.646141 2.774050 
1 1 1    6    1  -83 o  150.585   1.4864  924.576   18.245  939.656   26.393  910.774   25.250  151.776   2.1333  149.428   2.0730 2.347321 2.974631 
1 1 1    6    1  -82 o  189.361   1.5909  1462.10   24.557  1434.40   34.749  1489.74   34.709  187.516   2.2734  191.102   2.2281 -3.586243 3.183223 
1 1 1    6    1  -81 o  117.923   1.4517  566.969   13.955  566.431   20.110  567.470   19.380  117.844   2.0935  117.955   2.0155 -0.1112976 2.906045 
1 1 1    6    1  -80 o   45.308   2.0698   83.898   7.6240   93.640   11.346   75.879   10.294   47.810   2.9254   43.016   2.9537 4.793652 4.157211 
1 1 1    6    1  -79 o  106.419   1.4575  461.728   12.643  466.499   17.403  456.395   18.400  106.952   1.9961  105.783   2.1339 1.169304 2.921986 
1 1 1    6    1  -78 o  197.718   1.5469  1593.86   24.932  1589.24   35.678  1598.27   34.855  197.395   2.2173  197.958   2.1600 -0.5632324 3.095478 
1 1 1    6    1  -77 o  171.894   1.4506  1204.64   20.326  1213.81   29.275  1196.12   28.242  172.520   2.0817  171.261   2.0230 1.258759 2.902806 
1 1 1    6    1  -76 o  267.310   1.8390  2913.64   40.071  2976.17   66.344  2877.72   50.277  270.059   3.0137  265.621   2.3221 4.438110 3.804555 
1 1 1    6    1  -75 o  159.103   1.6472  1032.09   21.362  1058.45   36.540  1018.40   26.331  161.069   2.7831  158.029   2.0441 3.039749 3.453074 
1 1 1    6    1  -74 o  176.308   1.4605  1267.26   20.989  1278.11   34.453  1260.86   26.468  177.021   2.3876  175.848   1.8465 1.173859 3.018334 
1 1 1    6    1  -73 o   86.041   1.3490  301.797   9.4617  306.555   15.695  299.081   11.859   86.672   2.2233   85.648   1.6986 1.024284 2.797927 
1 1 1    6    1  -72 o  154.243   1.3161  969.847   16.547  985.739   25.303  957.971   21.873  155.480   1.9964  153.283   1.7505 2.197235 2.655200 
1 1 1    6    1  -71 o  108.607   1.3274  480.849   11.752  479.914   19.635  481.371   14.669  108.482   2.2204  108.660   1.6561 -0.1781921 2.770033 
1 1 1    6    1  -70 f   70.811   1.4472  204.413   8.3536  195.509   14.196  209.128   10.332   69.190   2.5212   71.619   1.7697 -2.429337 3.080364 
1 1 1    6    1  -69 o  320.851   2.0960  4197.71   54.819  4199.65   89.877  4196.57   69.176  320.801   3.4370  320.764   2.6457 0.3707886E-01 4.337314 
1 1 1    6    1  -68 o  139.092   1.3583  788.658   15.400  779.241   25.562  794.024   19.295  138.236   2.2685  139.557   1.6962 -1.321091 2.832495 
1 1 1    6    1  -67 o  164.734   1.4198  1106.26   19.066  1104.07   31.629  1107.51   23.895  164.542   2.3582  164.818   1.7785 -0.2760468 2.953681 
1 1 1    6    1  -66 o  144.781   1.2858  854.470   15.175  829.746   22.849  873.982   20.299  142.657   1.9649  146.417   1.7007 -3.759903 2.598733 
1 1 1    6    1  -65 o  193.806   1.5278  1531.19   24.137  1525.30   34.041  1537.14   34.228  193.413   2.1592  194.162   2.1626 -0.7489014 3.055971 
1 1 1    6    1  -64 o  153.763   1.3011  963.760   16.308  962.836   24.751  964.470   21.679  153.675   1.9758  153.811   1.7291 -0.1361084 2.625562 
1 1 1    6    1  -63 o  149.049   1.3835  905.585   16.809  905.186   23.698  905.988   23.844  149.006   1.9511  149.072   1.9622 -0.6573486E-01 2.767161 
1 1 1    6    1  -62 o  203.371   1.4564  1685.96   24.145  1701.52   36.636  1674.01   32.103  204.288   2.2000  202.637   1.9435 1.650879 2.935522 
1 1 1    6    1  -61 o  317.534   1.9516  4110.47   50.514  4110.54   75.988  4110.41   67.617  317.488   2.9362  317.501   2.6126 -0.1312256E-01 3.930244 
1 1 1    6    1  -60 o  364.242   2.1752  5408.86   64.585  5500.92   98.360  5339.08   85.632  367.265   3.2855  361.847   2.9032 5.418091 4.384398 
1 1 1    6    1  -59 o  500.649   2.8626 10220.24  116.824 10250.98  175.793 10195.92  156.341  501.264   4.3023  499.967   3.8361 1.297791 5.764168 
1 1 1    6    1  -58 o  552.304   3.3170 12439.22  149.332 12403.96  243.367 12460.51  189.122  551.278   5.4157  552.689   4.1978 -1.411133 6.852131 
1 1 1    6    1  -57 o   35.740   2.0932   52.250   6.0715   56.916   10.411   49.845   7.4742   37.198   3.4735   34.865   2.6497 2.332619 4.368801 
1 1 1    6    1  -56 f  410.492   2.5453  6869.55   85.168  6771.95  137.593  6930.18  108.439  407.478   4.1424  412.267   3.2268 -4.789093 5.250905 
1 1 1    6    1  -55 o  152.252   1.5763  944.874   19.563  906.110   34.200  963.728   23.851  149.082   2.8142  153.761   1.9030 -4.679001 3.397237 
1 1 1    6    1  -54 o  347.741   3.1279  4930.17   88.664   0.0000   0.0000  4930.17   88.664  ?   ?   347.741   3.1279 0.000000 3.127904 
1 1 1    6    1  -53 o   88.713   1.4289  320.780   10.333  320.993   16.460  320.641   13.275   88.709   2.2782   88.692   1.8362 0.1698303E-01 2.926049 
1 1 1    6    1  -52 o  277.634   2.1624  3142.01   48.937  3340.62   72.566  2976.32   66.277  286.254   3.1099  270.198   3.0092 16.05627 4.327402 
1 1 1    6    1  -51 o  237.238   1.7976  2294.09   34.763  2309.41   53.872  2283.16   45.504  238.015   2.7767  236.665   2.3587 1.350113 3.643290 
1 1 1    6    1  -50 o  489.814   2.9743  9780.42  118.754  9732.61  193.473  9809.33  150.425  488.531   4.8584  490.507   3.7622 -1.975464 6.144735 
1 1 1    6    1  -49 o  579.475   4.0070 13690.69  189.276 13518.00  265.022 13870.46  270.412  575.711   5.6473  583.165   5.6885 -7.454163 8.015684 
1 1 1    6    1  -48 o  250.193   1.7570  2551.43   35.833  2516.61   50.034  2588.09   51.341  248.472   2.4703  251.976   2.4996 -3.503845 3.514322 
1 1 1    6    1  -47 o  291.370   1.9481  3460.40   46.270  3425.58   64.874  3496.45   66.012  289.890   2.7454  292.873   2.7651 -2.983185 3.896503 
1 1 1    6    1  -46 o  427.870   2.8280  7462.61   98.635  7377.67  149.128  7528.68  131.511  425.388   4.3007  429.736   3.7542 -4.348419 5.708787 
1 1 1    6    1  -45 o  330.275   2.0136  4446.18   54.209  4500.15   82.040  4404.35   72.222  332.259   3.0291  328.709   2.6954 3.549927 4.054698 
1 1 1    6    1  -44 o  990.585   5.4688 40012.92  441.592 39845.02  539.590 40353.43  768.425  988.385   6.6973  994.307   9.4808 -5.922729 11.60774 
1 1 1    6    1  -43 o  598.082   3.5770 14581.91  174.389 14628.38  221.306 14505.79  283.249  598.998   4.5324  596.421   5.8261 2.577515 7.381512 
1 1 1    6    1  -42 o  152.101   1.3950  942.938   17.296  966.413   21.895  903.968   28.210  153.981   1.7443  148.921   2.3238 5.060486 2.905683 
1 1 1    6    1  -41 o  603.912   3.6050 14867.42  177.465 15094.29  227.388 14513.91  283.846  608.467   4.5845  596.598   5.8367 11.86920 7.421910 
1 1 1    6    1  -40 o  472.550   2.8778  9102.32  110.852  9217.60  141.621  8919.96  178.120  475.516   3.6536  467.747   4.6716 7.768250 5.930674 
1 1 1    6    1  -39 o  785.695   4.3549 25166.77  278.913 25541.62  378.934 24723.60  412.027  791.441   5.8737  778.623   6.4918 12.81769 8.754593 
1 1 1    6    1  -38 f  466.103   2.6753  8855.47  101.646  8866.91  136.498  8841.23  152.293  466.386   3.5904  465.700   4.0118 0.6857910 5.383813 
1 1 1    6    1  -37 o  658.801   4.1734 17693.46  224.117 17727.84  342.767 17667.79  296.206  659.340   6.3775  658.266   5.5202 1.073853 8.434793 
1 1 1    6    1  -36 o  493.460   2.8155  9925.54  113.251  9764.72  149.861 10139.68  172.926  489.427   3.7563  498.722   4.2537 -9.295746 5.674855 
1 1 1    6    1  -35 o  399.775   2.4715  6514.35   80.540  6478.85  101.558  6574.51  132.213  398.675   3.1251  401.591   4.0388 -2.915924 5.106655 
1 1 1    6    1  -34 f  420.260   2.5803  7199.08   88.394  7164.44  111.490  7257.71  145.046  419.237   3.2624  421.939   4.2172 -2.701599 5.331790 
1 1 1    6    1  -33 o  397.667   2.6262  6445.88   85.130  6479.60  113.148  6401.90  129.232  398.693   3.4815  396.286   4.0006 2.406952 5.303394 
1 1 1    6    1  -32 o  454.599   2.9535  8423.83  109.446  8557.98  146.673  8255.31  164.399  458.186   3.9271  449.998   4.4818 8.187988 5.958921 
1 1 1    6    1  -31 o  349.953   2.1980  4991.73   62.702  5032.54   89.400  4952.23   87.966  351.370   3.1213  348.555   3.0960 2.814789 4.396353 
1 1 1    6    1  -30 o  349.631   2.0753  4982.53   59.147  5066.68   89.793  4918.03   78.611  352.560   3.1245  347.354   2.7764 5.205902 4.179762 
1 1 1    6    1  -29 o  372.802   2.1886  5664.84   66.510  5649.73   99.582  5677.01   89.365  372.290   3.2814  373.193   2.9376 -0.9025269 4.404252 
1 1 1    6    1  -28 o  445.260   2.4256  8081.03   88.038  7990.22  123.452  8175.00  125.584  442.735   3.4207  447.824   3.4403 -5.089813 4.851476 
1 1 1    6    1  -27 o  312.482   1.7967  3979.93   45.765  4033.79   65.466  3928.45   64.001  314.583   2.5530  310.448   2.5291 4.134369 3.593577 
1 1 1    6    1  -26 o  563.005   3.1705 12920.85  145.503 13121.19  197.799 12684.62  214.793  567.320   4.2772  557.786   4.7241 9.533508 6.372705 
1 1 1    6    1  -25 o  322.625   1.9456  4242.53   51.166  4271.44   69.038  4207.29   76.213  323.715   2.6163  321.271   2.9102 2.443756 3.913351 
1 1 1    6    1  -24 o  712.798   3.9590 20713.01  230.030 20810.01  309.915 20594.00  343.258  714.396   5.3219  710.641   5.9256 3.754395 7.964651 
1 1 1    6    1  -23 f  319.151   1.9276  4151.68   50.148  4208.50   67.967  4083.78   74.295  321.319   2.5949  316.519   2.8795 4.800964 3.876248 
1 1 1    6    1  -22 o  308.063   1.9883  3868.26   49.929  3899.33   71.020  3837.90   70.206  309.288   2.8170  306.842   2.8069 2.445496 3.976681 
1 1 1    6    1  -21 o  507.242   3.0503 10488.41  126.121 10538.87  179.000 10438.67  177.732  508.418   4.3191  505.996   4.3091 2.422302 6.101050 
1 1 1    6    1  -20 o  365.367   2.1503  5441.29   64.042  5329.63   94.516  5536.07   87.078  361.579   3.2068  368.522   2.8987 -6.943054 4.322728 
1 1 1    6    1  -19 o   91.517   1.2250  341.369   9.1386  347.185   14.391  337.438   11.830   92.292   1.9129   90.988   1.5950 1.303711 2.490635 
1 1 1    6    1  -18 o  282.535   1.8563  3253.74   42.752  3373.08   71.791  3188.15   53.218  287.652   3.0617  279.667   2.3344 7.984924 3.850168 
1 1 1    6    1  -17 o  457.613   2.9727  8536.66  110.888  8661.47  171.509  8447.01  145.355  460.885   4.5652  455.172   3.9176 5.713867 6.015667 
1 1 1    6    1  -16 o  782.199   4.5897 24948.78  292.640 24792.16  475.319 25044.38  371.369  779.430   7.4812  783.582   5.8141 -4.152832 9.474844 
1 1 1    6    1  -15 f  230.457   1.6039  2164.77   30.130  2182.44   49.655  2154.48   37.906  231.384   2.6327  229.904   2.0227 1.479309 3.319967 
1 1 1    6    1  -14 o  331.973   2.1069  4492.19   57.014  4531.88   93.869  4468.99   71.768  333.406   3.4539  331.104   2.6591 2.301941 4.358924 
1 1 1    6    1  -13 o  369.707   2.3045  5571.57   69.449  5618.18   98.752  5525.95   97.689  371.225   3.2634  368.166   3.2551 3.059265 4.609296 
1 1 1    6    1  -12 o  345.745   2.0522  4872.63   57.839  4775.65   85.410  4954.78   78.606  342.264   3.0613  348.632   2.7660 -6.367767 4.125823 
1 1 1    6    1  -11 o   73.860   1.1645  222.350   7.0113  213.825   11.545  227.331   8.8252   72.401   1.9579   74.682   1.4497 -2.280434 2.436205 
1 1 1    6    1  -10 o  528.266   3.1630 11376.98  136.204 11243.64  190.787 11515.57  194.512  525.094   4.4573  531.403   4.4904 -6.309814 6.327051 
1 1 1    6    1   -9 o  420.632   2.5735  7212.51   88.241  7224.55  125.059  7200.58  124.524  420.945   3.6446  420.247   3.6351 0.6986694 5.147539 
1 1 1    6    1   -8 o  598.588   4.1037 14610.22  200.234 14764.08  247.633 14319.63  340.319  601.661   5.0492  592.345   7.0481 9.316406 8.670097 
1 1 1    6    1   -7 o  152.287   1.4632  945.270   18.164  933.646   22.338  967.957   31.205  151.345   1.8106  154.095   2.4843 -2.749863 3.074096 
1 1 1    6    1   -6 o  481.182   3.6682  9440.24  143.879  9383.20  184.951  9527.67  228.978  479.669   4.7302  483.273   5.8125 -3.604004 7.494014 
1 1 1    6    1   -5 o  497.307   3.7808 10083.78  153.266 10115.38  198.476 10037.09  241.226  498.021   4.8891  496.011   5.9662 2.009644 7.713500 
1 1 1    6    1   -4 o  510.208   3.8706 10613.95  160.974 10649.73  208.514 10561.17  253.257  510.997   5.0059  508.783   6.1065 2.213837 7.896093 
1 1 1    6    1   -3 o  577.775   3.9704 13611.63  186.997 13915.01  269.398 13329.54  259.772  584.049   5.6586  571.637   5.5749 12.41162 7.943482 
1 1 1    6    1   -2 o  221.876   1.7949  2006.62   32.463  1967.97   45.378  2047.14   46.460  219.719   2.5336  224.095   2.5434 -4.376038 3.590000 
1 1 1    6    1   -1 o  271.171   2.0684  2997.40   45.721  2990.18   64.593  3004.64   64.725  270.829   2.9259  271.483   2.9248 -0.6542969 4.137042 
1 1 1    6    1    0 o  380.431   2.5216  5899.73   78.198  5837.98  102.683  5985.00  120.656  378.410   3.3289  383.125   3.8634 -4.715240 5.099756 
1 1 1    6    1    1 o  100.609   1.2265  412.573   10.059  422.995   13.574  399.879   14.980  101.871   1.6346   99.047   1.8554 2.823723 2.472791 
1 1 1    6    1    2 o  437.916   2.8521  7817.81  101.812  7866.83  135.446  7754.12  154.370  439.250   3.7828  436.065   4.3429 3.185242 5.759375 
1 1 1    6    1    3 o  249.405   1.9460  2535.48   39.563  2506.36   55.543  2565.48   56.368  247.956   2.7480  250.863   2.7565 -2.907074 3.892298 
1 1 1    6    1    4 o  799.287   5.9279 26063.12  386.227 26211.51  613.744 25965.82  496.969  800.980   9.4000  797.541   7.6444 3.438904 12.11597 
1 1 1    6    1    5 o  380.658   2.9862  5907.20   92.661  6042.38  149.127  5822.19  118.261  384.918   4.7528  377.879   3.8393 7.038361 6.109805 
1 1 1    6    1    6 o  301.932   2.7596  3716.32   67.920  3762.87   96.913  3671.39   95.215  303.785   3.9136  300.070   3.8927 3.715088 5.519902 
1 1 1    6    1    7 o  207.174   2.1129  1749.56   35.682  1783.17   51.127  1717.64   49.822  209.142   2.9990  205.263   2.9777 3.878479 4.226151 
1 1 1    6    1    8 o  669.884   5.5953 18304.94  305.535 18135.66  428.600 18479.85  435.669  666.504   7.8888  672.791   7.9440 -6.286926 11.19560 
1 1 1    6    1    9 o  468.925   4.0118  8966.00  153.347  8748.37  212.423  9202.83  221.600  463.104   5.6271  474.973   5.7235 -11.86926 8.026430 
1 1 1    6    1   10 o  191.348   1.8001  1492.42   28.077  1506.40   44.687  1483.31   36.089  192.230   2.8518  190.758   2.3209 1.472427 3.676913 
1 1 1    6    1   11 o  373.079   2.9337  5674.21   89.219  5771.73  142.988  5612.04  114.170  376.207   4.6627  371.002   3.7752 5.204651 5.999400 
1 1 1    6    1   12 o  307.020   2.4976  3842.46   62.508  3853.29   99.027  3835.29   80.592  307.416   3.9518  306.717   3.2234 0.6986694 5.099697 
1 1 1    6    1   13 o  484.851   3.7004  9584.52  146.249  9681.03  233.243  9522.00  187.739  487.160   5.8735  483.213   4.7663 3.947083 7.564117 
1 1 1    6    1   14 o  466.519   3.5734  8873.18  135.889  9027.23  217.969  8775.24  173.799  470.440   5.6840  463.891   4.5962 6.549957 7.309744 
1 1 1    6    1   15 f  252.327   2.1590  2595.26   44.407  2517.92   68.798  2650.50   58.141  248.519   3.3961  254.988   2.7972 -6.469604 4.399759 
1 1 1    6    1   16 o  388.078   3.0382  6139.53   96.111  6062.54  150.526  6192.53  124.880  385.577   4.7892  389.721   3.9310 -4.144836 6.195915 
1 1 1    6    1   17 o  574.381   4.3288 13451.97  202.678 13419.51  319.852 13473.75  261.991  573.511   6.8418  574.767   5.5919 -1.255981 8.836269 
1 1 1    6    1   18 o  466.637   3.5770  8877.29  136.059  8894.81  215.690  8865.72  175.349  467.003   5.6660  466.291   4.6133 0.7116089 7.306539 
1 1 1    6    1   19 o  137.783   1.7631  773.792   19.802  745.172   27.615  804.086   28.410  135.207   2.5056  140.450   2.4815 -5.243317 3.526453 
1 1 1    6    1   20 o  259.730   2.4735  2749.80   52.369  2785.11   74.715  2715.71   73.422  261.377   3.5068  258.100   3.4898 3.276703 4.947352 
1 1 1    6    1   21 o  270.320   2.2757  2978.54   50.145  3125.83   82.209  2891.27   63.281  276.903   3.6421  266.323   2.9149 10.58035 4.664966 
1 1 1    6    1   22 o  371.134   2.9283  5614.75   88.591  5675.57  141.444  5575.50  113.643  373.097   4.6508  369.816   3.7698 3.280304 5.986759 
1 1 1    6    1   23 f  342.095   2.7368  4770.36   76.318  4839.00  122.192  4726.46   97.722  344.515   4.3511  340.503   3.5207 4.011841 5.597103 
1 1 1    6    1   24 o  945.941   6.9828 36497.11  538.431 36192.28  845.215 36705.30  698.503  941.459   11.014  948.396   9.0353 -6.936951 14.24556 
1 1 1    6    1   25 o  766.495   5.6983 23956.88  356.031 24590.94  575.656 23564.09  453.080  776.287   9.0971  760.068   7.3128 16.21838 11.67200 
1 1 1    6    1   26 o  454.818   3.5025  8432.48  129.854  8762.49  211.874  8233.96  164.335  463.570   5.6070  449.407   4.4859 14.16269 7.180646 
1 1 1    6    1   27 o  434.359   3.7604  7691.06  133.142  7818.29  190.811  7570.33  185.868  437.895   5.3456  430.897   5.2917 6.998535 7.521812 
1 1 1    6    1   28 o  1245.80   10.236 63341.89  1039.52 62205.27  1446.48 64555.92  1494.93  1233.77   14.383  1256.81   14.592 -23.04614 20.48875 
1 1 1    6    1   29 o  239.638   2.7192  2340.76   53.117  2579.89   97.699  2240.42   63.288  251.557   4.7645  234.440   3.3117 17.11679 5.802415 
1 1 1    6    1   30 o  631.927   7.4955 16286.94  386.103 16616.82  555.128 15977.82  537.370  638.069   10.673  625.691   10.536 12.37750 14.99742 
1 1 1    6    1   31 o  551.009   6.5937 12380.92  296.158 12237.55  414.625 12530.26  423.167  547.667   9.2876  554.173   9.3676 -6.506104 13.19137 
1 1 1    6    1   32 o  611.351   7.2654 15242.83  362.066 15180.21  509.930 15306.50  514.174  609.899   10.257  612.428   10.300 -2.528442 14.53567 
1 1 1    6    1   33 o  226.306   2.6289  2087.54   48.496  2098.42   59.628  2066.28   83.352  226.890   3.2240  225.132   4.5419 1.758179 5.569859 
1 1 1    6    1   34 f  355.328   3.1752  5146.58   91.968  5302.80  133.008  5003.48  127.304  360.657   4.5243  350.332   4.4578 10.32529 6.351483 
1 1 1    6    1   35 o  391.999   3.4504  6263.84  110.254  6350.69  157.560  6180.50  154.335  394.677   4.8974  389.354   4.8628 5.323700 6.901553 
1 1 1    6    1   36 o  129.163   1.8314  679.987   19.282  686.312   27.338  673.726   27.201  129.760   2.5846  128.564   2.5956 1.195313 3.662955 
1 1 1    6    1   37 o   75.245   1.9231  230.924   11.786  219.265   16.522  243.003   16.818   73.291   2.7706   77.165   2.6777 -3.874313 3.853097 
1 1 1    6    1   38 f  415.385   3.6331  7033.72  123.016  7101.90  175.248  6967.50  172.720  417.356   5.1512  413.389   5.1256 3.967285 7.266851 
1 1 1    6    1   39 o  288.522   2.4414  3393.12   57.418  3404.82   74.422  3375.91   90.252  289.011   3.1590  287.772   3.8474 1.238892 4.978161 
1 1 1    6    1   40 o  928.406   6.8699 35153.68  519.905 34848.95  665.970 35629.19  831.929  924.172   8.8403  934.189   10.925 -10.01727 14.05357 
1 1 1    6    1   41 o  264.511   2.3249  2851.85   50.129  2853.21   64.865  2849.84   78.991  264.567   3.0077  264.402   3.6650 0.1644897 4.741192 
1 1 1    6    1   42 o  493.589   3.4727  9931.51  139.722 10104.04  173.556  9613.75  235.538  497.834   4.2768  485.543   5.9511 12.29095 7.328484 
1 1 1    6    1   43 o  516.532   3.6103 10876.49  152.010 10967.67  187.330 10700.71  260.107  518.666   4.4308  512.238   6.2294 6.427673 7.644414 
1 1 1    6    1   44 o  621.223   3.9540 15733.00  200.228 15850.16  266.736 15581.76  303.061  623.472   5.2484  618.127   6.0147 5.344666 7.982663 
1 1 1    6    1   45 o  255.229   1.8941  2655.17   39.406  2615.35   51.854  2709.61   60.626  253.302   2.5114  257.822   2.8847 -4.519943 3.824727 
1 1 1    6    1   46 o  800.719   5.0300 26143.41  328.308 25960.59  431.820 26393.84  505.412  797.780   6.6402  804.299   7.7089 -6.519287 10.17447 
1 1 1    6    1   47 o  281.683   1.8904  3234.13   43.406  3322.19   62.610  3152.63   60.230  285.482   2.6905  278.102   2.6569 7.380096 3.781224 
1 1 1    6    1   48 o  158.006   1.3931  1017.59   17.943  1012.07   25.368  1023.11   25.382  157.574   1.9750  158.431   1.9654 -0.8569794 2.786287 
1 1 1    6    1   49 o  521.366   3.3602 11081.44  142.805 11202.35  220.165 10993.64  187.628  524.116   5.1533  519.249   4.4329 4.866882 6.797564 
1 1 1    6    1   50 o  165.465   1.4960  1115.94   20.178  1075.12   26.287  1174.49   31.482  162.407   1.9856  169.745   2.2753 -7.337341 3.019856 
1 1 1    6    1   51 o  348.640   2.5572  4954.87   72.673  4865.40  101.481  5049.04  104.120  345.449   3.6038  351.908   3.6297 -6.458069 5.114919 
1 1 1    6    1   52 o  365.572   2.9111  5448.23   86.748  5305.01  109.992  5683.91  141.098  360.707   3.7409  373.328   4.6366 -12.62024 5.957493 
1 1 1    6    1   53 o  304.466   2.2996  3778.80   57.073  3833.24   81.665  3726.83   79.794  306.626   3.2673  302.341   3.2377 4.285095 4.599784 
1 1 1    6    1   54 o  324.899   2.4177  4303.16   64.030  4293.18   90.508  4313.16   90.596  324.490   3.4218  325.244   3.4171 -0.7542725 4.835826 
1 1 1    6    1   55 o  196.457   1.7254  1573.21   27.631  1469.92   37.648  1693.80   40.679  189.888   2.4323  203.836   2.4483 -13.94829 3.451072 
1 1 1    6    1   56 f  224.587   1.7236  2056.02   31.555  2040.36   47.826  2068.09   41.992  223.713   2.6226  225.235   2.2871 -1.522598 3.479815 
1 1 1    6    1   57 o  203.076   1.5283  1681.00   25.299  1615.29   35.075  1752.24   36.526  199.057   2.1617  207.324   2.1613 -8.266785 3.056815 
1 1 1    6    1   58 o  203.933   1.5296  1695.24   25.427  1684.26   35.893  1706.30   36.026  203.260   2.1663  204.586   2.1602 -1.325836 3.059345 
1 1 1    6    1   59 o  203.563   1.5328  1689.11   25.434  1665.28   35.794  1713.42   36.147  202.109   2.1726  205.010   2.1630 -2.900604 3.065768 
1 1 1    6    1   60 o  383.561   2.4011  5998.19   75.074  5939.63  105.483  6058.31  106.872  381.621   3.3909  385.414   3.4017 -3.793030 4.803116 
1 1 1    6    1   61 o   98.447   1.2741  395.052   10.225  364.779   14.367  426.118   14.554   94.594   1.8633  102.240   1.7463 -7.645721 2.553706 
1 1 1    6    1   62 o  245.992   1.7159  2466.82   34.407  2434.60   48.294  2500.02   49.031  244.355   2.4246  247.616   2.4291 -3.260910 3.432100 
1 1 1    6    1   63 o  285.454   1.9030  3321.98   44.280  3301.70   62.420  3342.52   62.823  284.542   2.6912  286.296   2.6920 -1.753723 3.806455 
1 1 1    6    1   64 o  325.487   2.1032  4319.48   55.803  4300.55   78.740  4338.58   79.097  324.715   2.9748  326.147   2.9752 -1.432648 4.207246 
1 1 1    6    1   65 o  146.667   1.3402  876.878   16.023  852.599   22.507  901.826   22.815  144.611   1.9094  148.727   1.8819 -4.116776 2.680905 
1 1 1    6    1   66 o  329.823   2.1277  4435.59   57.204  4405.38   80.551  4466.33   81.250  328.629   3.0070  330.894   3.0123 -2.265076 4.256274 
1 1 1    6    1   67 o  126.921   1.2973  656.665   13.422  657.362   19.139  655.992   18.827  126.978   1.8491  126.846   1.8208 0.1317062 2.595119 
1 1 1    6    1   68 o  178.989   1.4436  1306.03   21.062  1321.75   30.139  1291.02   29.447  180.044   2.0536  177.939   2.0302 2.104279 2.887691 
1 1 1    6    1   69 o  235.803   1.8036  2267.00   34.668  2294.73   46.036  2230.68   52.689  237.211   2.3808  233.853   2.7640 3.358093 3.648044 
1 1 1    6    1   70 f  125.342   1.4136  640.464   14.443  641.208   18.831  639.403   22.508  125.405   1.8422  125.219   2.2051 0.1865921 2.873323 
1 1 1    6    1   71 o  160.057   1.6067  1044.45   20.962  1016.71   28.720  1076.07   30.666  157.896   2.2314  162.437   2.3160 -4.541016 3.216042 
1 1 1    6    1   72 o   82.363   1.5369  276.560   10.319  281.417   14.048  270.868   15.206   83.073   2.0745   81.465   2.2922 1.608627 3.091548 
1 1 1    6    1   73 o  143.323   1.6891  837.503   19.733  877.024   25.723  780.983   30.762  146.649   2.1518  138.363   2.7274 8.286011 3.474077 
1 1 1    6    1   74 o  290.259   2.4466  3436.42   57.888  3386.38   73.738  3516.79   93.453  288.068   3.1402  293.463   3.9066 -5.395020 5.012267 
1 1 1    6    1   75 o  224.997   1.8955  2064.26   34.764  2040.28   42.219  2114.77   61.267  223.661   2.3157  227.624   3.3020 -3.963577 4.033057 
1 1 1    6    1   76 o  177.846   1.6853  1289.61   24.431  1283.90   29.782  1301.37   42.721  177.434   2.0591  178.584   2.9347 -1.149887 3.585035 
1 1 1    6    1   77 o  102.861   1.4314  431.353   12.002  419.218   15.522  449.391   18.924  101.393   1.8781  104.969   2.2117 -3.575325 2.901506 
1 1 1    6    1   78 o  147.512   1.4839  887.154   17.844  863.864   23.093  921.661   28.109  145.546   1.9465  150.319   2.2940 -4.773804 3.008522 
1 1 1    6    1   79 o  117.854   1.5587  566.312   14.974  542.936   20.384  593.710   22.068  115.376   2.1674  120.647   2.2440 -5.271057 3.119801 
1 1 1    6    1   80 o  162.521   1.6764  1077.02   22.209  1066.88   30.768  1088.05   32.090  161.719   2.3340  163.311   2.4105 -1.591995 3.355335 
1 1 1    6    1   81 o  233.401   1.8207  2221.56   34.641  2272.62   53.645  2185.05   45.367  235.978   2.7889  231.426   2.4049 4.551682 3.682554 
1 1 1    6    1   82 o   52.639   2.2351  113.236   9.5686   89.826   13.518  136.745   13.547   46.759   3.5736   57.810   2.8838 -11.05117 4.592040 
1 1 1    6    1   83 o  305.938   2.3625  3818.67   58.918  3690.62  100.259  3886.22   72.818  300.460   4.0935  308.553   2.8951 -8.092987 5.013872 
1 1 1    6    1   84 f   47.040   1.9509   90.408   7.4645   82.023   10.847   97.950   10.288   44.722   2.9928   48.923   2.5890 -4.200859 3.957189 
1 1 1    6    1   85 o  134.495   1.3802  737.547   15.132  729.398   21.447  745.626   21.353  133.722   1.9675  135.203   1.9375 -1.481064 2.761371 
1 1 1    6    1   86 o   49.463   1.9330   99.952   7.7789   79.020   10.623  124.154   11.423   43.886   2.9873   55.092   2.5504 -11.20642 3.927929 
1 1 1    6    1   87 o  177.868   1.4906  1290.15   21.612  1305.87   30.931  1275.16   30.209  178.898   2.1210  176.785   2.0963 2.113464 2.982144 
1 1 1    6    1   88 o  227.381   1.6775  2108.78   31.093  2125.51   44.259  2092.49   43.690  228.196   2.3794  226.418   2.3672 1.777954 3.356350 
1 1 1    6    1   89 o   85.587   1.4476  298.727   10.099  291.509   14.369  305.774   14.198   84.520   2.0856   86.567   2.0120 -2.046982 2.897891 
1 1 1    6    1   90 o  223.296   1.9091  2034.45   34.748  2028.41   48.969  2040.58   49.316  222.841   2.6958  223.507   2.7068 -0.6653442 3.820254 
1 1 1    6    1   91 o   42.849   2.2226   75.153   7.7367   77.613   10.429   72.141   11.538   43.476   2.9604   41.855   3.4114 1.621086 4.516753 
1 1 1    6    1   92 o   32.831   3.0125   44.436   7.9722   39.605   11.721   48.594   10.875   30.684   4.8470   34.210   3.9736 -3.526430 6.267606 
1 1 1    6    1   93 o  142.787   1.5131  831.671   17.612  864.141   27.698  809.633   22.818  145.463   2.3359  140.839   1.9876 4.623260 3.067072 
1 1 1    6    1   94 o  179.853   1.6177  1319.77   23.717  1341.79   36.810  1304.13   31.011  181.218   2.4919  178.716   2.1287 2.501266 3.277367 
1 1 1    6    1   95 o  144.441   1.5254  851.185   17.960  838.520   27.543  860.554   23.689  143.262   2.3585  145.180   2.0017 -1.918991 3.093466 
1 1 1    6    1   96 o  140.322   1.5164  803.397   17.345  800.822   23.298  806.600   25.979  140.036   2.0410  140.508   2.2683 -0.4719391 3.051348 
1 1 1    6    1   97 o  101.546   1.5209  420.774   12.590  430.606   17.276  409.641   18.385  102.674   2.0642  100.122   2.2526 2.551659 3.055328 
1 1 1    6    1   98 o   40.900   2.7384   68.772   9.0770   55.128   12.306   85.052   13.442   36.354   4.2318   45.363   3.6665 -9.008389 5.599220 
1 1 1    6    1   99 o   64.859   1.7485  171.908   9.2357  165.712   12.708  178.843   13.446   63.596   2.4560   66.065   2.5013 -2.468864 3.505432 
1 1 1    6    1  100 o   23.313   3.6731   22.884   6.7494   19.915   9.4752   25.942   9.6165   21.478   5.4144   24.597   4.9675 -3.119068 7.347901 
1 1 1    6    1  101 o  113.904   1.4749  529.663   13.694  512.078   18.288  552.110   20.662  111.919   2.0046  116.178   2.1818 -4.259720 2.962874 
1 1 1    6    1  102 o   53.824   1.7508  118.503   7.6713  127.669   11.128  110.202   10.590   55.773   2.4536   51.800   2.5155 3.972843 3.513991 
1 1 1    6    1  103 o   92.962   1.4157  352.885   10.728  349.716   15.333  355.923   15.015   92.451   2.0346   93.278   1.9747 -0.8272476 2.835344 
1 1 1    6    1  104 o  121.082   1.3962  598.758   13.781  619.819   19.981  579.653   19.031  123.064   1.9919  119.017   1.9616 4.046829 2.795611 
1 1 1    6    1  105 o   87.447   1.5370  312.519   10.956  320.990   17.397  306.951   14.105   88.414   2.4162   86.583   1.9985 1.831818 3.135582 
1 1 1    6    1  106 o   36.913   2.2242   56.080   6.6614   50.026   9.6552   61.579   9.2024   34.607   3.4694   38.549   2.9510 -3.942402 4.554676 
1 1 1    6    1  107 o   23.079   3.4223   22.518   6.2436   29.235   9.0220   16.345   8.6495   26.103   4.3962   19.334   5.3211 6.768852 6.902244 
1 1 1    6    1  108 o  117.351   1.4798  563.168   14.155  550.076   21.395  573.360   18.877  115.717   2.2682  118.259   1.9583 -2.541885 2.996591 
1 1 1    6    1  109 o  121.508   1.5787  604.241   15.637  604.188   22.357  604.292   21.879  121.239   2.2622  121.271   2.2132 -0.3231049E-01 3.164785 
1 1 1    6    1  110 o   27.925   2.9242   32.604   6.5578   44.929   10.287   24.166   8.5114   32.530   3.9612   23.541   4.6004 8.988649 6.070812 
1 1 1    6    1  111 o   64.594   1.7709  171.215   9.3156  169.336   13.635  172.859   12.757   63.982   2.6200   64.713   2.4226 -0.7318001 3.568384 
1 1 1    6    1  112 o   28.900   2.9158   34.971   6.7751   28.729   9.4356   41.615   9.7343   25.619   4.6911   31.244   3.9073 -5.624796 6.105243 
1 1 1    6    1  113 o   63.784   1.7010  166.999   8.8360  167.298   12.050  166.653   12.996   63.645   2.3266   63.451   2.5176 0.1941566 3.427974 
1 1 1    6    1  114 o   43.415   2.0313   77.729   7.1689   72.241   10.236   83.013   10.043   41.549   3.0435   44.649   2.7732 -3.100174 4.117428 
1 1 1    6    1  115 o   61.086   1.6628  153.226   8.2719  160.912   11.842  145.904   11.559   62.377   2.3332   59.370   2.3934 3.006863 3.342451 
1 1 1    6    1  116 o   47.474   1.9269   92.897   7.4415   93.107   10.589   92.692   10.460   47.252   2.7612   47.157   2.7327 0.9480667E-01 3.884868 
1 1 1    6    1  117 o   35.952   2.3414   53.702   6.8244   42.853   9.6049   64.762   9.6982   31.595   3.8060   39.245   3.0557 -7.650009 4.880857 
1 1 1    6    1  118 o   14.582   4.6580   9.1841   6.2494   20.086   9.0011  -0.9617   8.6835   20.944   5.2758   11.235   4.9321 9.709252 7.222136 
1 1 1    6    1  119 o   15.343   4.6382   10.444   6.2914   15.446   9.2237   6.0931   8.6033   18.360   5.6294   13.712   5.3430 4.648109 7.761250 
1 1 1    6    1  120 o   33.329   2.7925   46.833   7.5169   44.717   12.090   48.167   9.5973   31.545   4.8575   33.457   3.5744 -1.911831 6.030870 
1 1 1    6    1  121 o   18.550   4.6170   15.741   6.9535   28.251   11.427   8.3848   8.7626   24.336   5.8357   14.650   5.4673 9.685912 7.996705 
1 1 1    6    1  122 o   20.719   4.2819   19.413   6.9924   7.7384   11.428   26.399   8.8404   15.176   6.0803   24.044   4.6791 -8.867522 7.672246 
1 1 1    6    1  123 o   13.852   4.8503   8.1451   6.7580   8.5081   11.274   7.9416   8.4432   15.319   6.0714   14.228   5.3549 1.091130 8.095510 
1 1 1    6    1  124 f   33.560   3.6160   49.293   9.7359   50.023   12.703   48.254   15.158   32.930   4.8796   31.299   6.1606 1.630915 7.859019 
1 1 1    6    1  125 o   12.406   5.2120   3.2838   8.9240   0.5402   11.634   7.2061   13.910   12.825   5.6665   15.443   6.4986 -2.617186 8.622080 
1 1 1    6    1  126 o   30.893   3.8488   42.559   9.4824   42.205   12.413   43.055   14.694   29.664   5.3294   29.034   6.3829 0.6299591 8.315305 
1 1 1    6    1  127 o   19.660   5.4670   19.098   9.0780   37.016   14.830   8.3587   11.480   26.329   6.8466   14.991   6.0631 11.33769 9.145384 
1 1 1    6    1  128 o   17.352   5.5698   14.820   8.9272   11.110   14.821   16.932   11.184   16.543   6.8134   18.264   6.2472 -1.720707 9.243911 
1 1 1    6    1  129 o   34.657   4.7489   56.296   13.063   32.517   22.988   67.637   15.876   22.502   8.7434   37.391   5.3620 -14.88895 10.25663 
1 1 1    6    1  130 o   20.016   6.0207   20.801   10.620   15.724   14.960   25.958   15.078   17.793   7.0120   21.384   7.2551 -3.591879 10.08982 
1 1 1    6    1  131 o   21.109   6.0290   23.275   10.889   12.586   15.152   34.692   15.659   16.806   6.9018   24.605   7.2895 -7.798672 10.03850 
1 1 1    6    1  132 o   14.716   5.8784   8.8601   10.649   0.6173   14.979   17.283   15.143   13.787   6.2343   18.145   7.0832 -4.357667 9.436024 
1 1 1    6    1  133 o   9.8178   4.6793  -9.3290   10.363 -15.6384   14.877  -3.3820   14.443   11.071   5.3602   12.786   5.9079 -1.714618 7.977162 
1 1 1    6    1  134 o   14.267   5.8265   7.7629   10.723 -20.5431   14.974   37.557   15.363   10.496   5.1462   25.598   7.1096 -15.10149 8.776690 
1 1 1    6    1  135 o   13.807   5.7593   6.4714   10.780   11.363   15.147   1.4513   15.344   16.195   6.7962   13.926   6.3022 2.269279 9.268567 
1 1 1    6    1  136 o   13.510   5.7197   5.4259   10.881   13.374   15.276  -2.7615   15.503   16.773   6.9135   13.187   6.1029 3.586684 9.221823 
1 1 1    6    1  137 o   12.651   5.9244  -5.5867   15.303 -17.2540   21.041   7.5140   22.296   13.030   6.3241   16.604   7.5469 -3.574636 9.846299 
1 1 1    6    2 -136 o   19.117   5.4246   18.657   8.8434   21.493   12.285   15.606   12.740   19.708   6.5473   17.315   6.5642 2.393175 9.271278 
1 1 1    6    2 -135 o   24.744   4.6491   29.359   9.0329   44.387   12.543   13.167   13.020   29.870   5.3477   16.448   6.5227 13.42251 8.434708 
1 1 1    6    2 -134 o   14.073   5.5555   8.2438   9.4047   3.5931   13.997   12.072   12.698   13.985   6.1953   16.052   6.4167 -2.067218 8.919405 
1 1 1    6    2 -133 o   9.7680   4.5069  -3.8228   8.3603  -9.6318   11.396   2.9469   12.302   10.293   4.9062   13.329   5.8604 -3.036172 7.643009 
1 1 1    6    2 -132 o   11.376   4.9383   1.5212   8.4975   13.307   11.667 -11.7922   12.400   16.493   6.2749   10.475   5.0263 6.018499 8.039797 
1 1 1    6    2 -131 o   27.390   3.8463   34.016   8.3511   39.474   10.889   26.220   13.014   28.767   4.8135   21.790   6.6877 6.977106 8.239872 
1 1 1    6    2 -130 o   25.326   4.0983   29.458   8.1718   42.787   10.679   10.623   12.694   30.319   4.4534   15.798   6.3807 14.52125 7.781147 
1 1 1    6    2 -129 o   34.098   3.0783   50.547   8.4640   46.811   10.930   56.144   13.378   31.882   4.3163   34.403   4.9096 -2.520550 6.537188 
1 1 1    6    2 -128 o   19.323   4.6553   17.808   7.2453   14.945   10.234   20.684   10.259   17.312   5.9742   20.092   5.8864 -2.779964 8.386932 
1 1 1    6    2 -127 o   25.239   3.8364   28.671   7.6449   22.130   10.320   36.627   11.381   20.887   5.8366   27.534   5.2626 -6.647598 7.858803 
1 1 1    6    2 -126 o   16.425   5.0286   12.899   7.3635   11.332   9.9491   14.798   10.950   15.792   5.8385   17.385   6.1665 -1.592523 8.492024 
1 1 1    6    2 -125 o   12.384   4.8966   5.1538   7.3165   9.6588   10.054   0.0825   10.667   15.164   5.8112   12.215   5.4099 2.949005 7.939615 
1 1 1    6    2 -124 o   32.603   2.9035   45.551   7.6358   41.814   10.815   49.265   10.782   30.213   4.5309   33.165   4.0738 -2.952406 6.093029 
1 1 1    6    2 -123 o   29.102   3.4163   36.889   7.9499   40.272   10.713   32.744   11.860   29.715   4.5689   25.946   5.7580 3.769854 7.350530 
1 1 1    6    2 -122 o   31.224   3.2149   41.954   8.0657   34.556   10.902   50.899   11.988   27.259   5.0938   33.635   4.4840 -6.376059 6.786218 
1 1 1    6    2 -121 o   28.223   3.6187   34.706   8.1340   44.990   10.883   21.690   12.244   31.785   4.3113   20.973   6.4956 10.81287 7.796142 
1 1 1    6    2 -120 o   10.402   4.5180  -0.0627   7.1201  -1.7554   10.150   1.5770   9.9902   11.749   5.2360   12.618   5.4151 -0.8691378 7.532577 
1 1 1    6    2 -119 o   28.771   2.7016   34.893   6.2618   37.202   10.630   33.666   7.7490   28.820   4.6854   27.959   3.4749 0.8616734 5.833361 
1 1 1    6    2 -118 o   40.451   2.0545   67.782   6.7521   66.134   11.282   68.702   8.4280   39.332   3.5575   40.545   2.5632 -1.213360 4.384681 
1 1 1    6    2 -117 o   24.947   2.9918   26.392   5.9628   17.255   10.528   30.708   7.2353   19.384   6.0265   26.797   3.3880 -7.412651 6.913507 
1 1 1    6    2 -116 o   14.975   4.4030   9.8423   5.7310   3.0565   9.9870   13.174   6.9978   13.314   5.5478   17.164   4.8099 -3.849922 7.342566 
1 1 1    6    2 -115 o   14.318   4.4424   8.8232   5.7238  -6.9661   9.8763   16.809   7.0236   10.508   4.8661   19.436   4.5191 -8.927532 6.640867 
1 1 1    6    2 -114 o   12.207   4.4280   5.4435   5.6810  -6.5624   9.7961   11.527   6.9733   10.567   4.8765   16.216   4.8790 -5.649677 6.898155 
1 1 1    6    2 -113 f   40.636   2.1197   68.188   6.9970   57.289   11.212   75.142   8.9548   36.698   3.8030   42.527   2.5955 -5.829388 4.604300 
1 1 1    6    2 -112 o   13.140   4.5548   6.7794   5.9516   9.4460   11.612   5.8294   6.9312   16.453   6.2599   13.029   4.8625 3.423408 7.926581 
1 1 1    6    2 -111 o   50.518   1.9775  105.019   8.1274   86.711   16.210  111.166   9.3935   45.000   4.4785   51.912   2.2250 -6.912292 5.000729 
1 1 1    6    2 -110 o   13.491   4.5936   7.2437   6.0453   5.5691   11.219   7.9289   7.1763   14.963   6.0142   14.278   4.9983 0.6849213 7.820060 
1 1 1    6    2 -109 o   11.267   4.4318   3.2789   5.9661   6.0305   11.014   2.1363   7.0975   15.076   5.9928   11.478   4.7198 3.598407 7.628255 
1 1 1    6    2 -108 o   22.683   3.5525   21.891   6.3533   37.074   11.940   15.895   7.5037   29.118   5.2225   19.021   4.8311 10.09639 7.114297 
1 1 1    6    2 -107 o   80.922   1.7665  268.185   11.653  231.042   20.889  284.964   14.040   74.533   3.4476   83.342   2.0667 -8.808167 4.019544 
1 1 1    6    2 -106 o   65.822   1.8225  177.546   9.7689  183.874   19.087  175.300   11.371   66.494   3.5342   65.337   2.1379 1.156380 4.130499 
1 1 1    6    2 -105 o   9.2333   4.1167  -2.3281   6.2813   12.641   14.715  -5.6636   6.9460   18.972   7.0840   8.8014   4.0774 10.17104 8.173641 
1 1 1    6    2 -104 o   31.330   2.6992   40.637   6.8263   37.031   12.654   42.118   8.1071   29.193   5.5197   31.809   3.1688 -2.615889 6.364653 
1 1 1    6    2 -103 o   56.491   1.7033  130.582   7.8344  124.100   12.462  134.817   10.074   54.885   2.7947   57.333   2.1594 -2.447392 3.531811 
1 1 1    6    2 -102 o   63.477   1.6185  164.739   8.3677  177.901   13.433  156.394   10.696   65.824   2.5082   61.776   2.1273 4.047737 3.288818 
1 1 1    6    2 -101 o  123.171   1.4449  619.436   14.508  628.588   24.256  614.338   18.102  123.882   2.4020  122.600   1.8114 1.281952 3.008447 
1 1 1    6    2 -100 o   33.508   2.5176   46.241   6.8263   40.488   11.131   49.708   8.6422   30.961   4.5459   34.661   3.0912 -3.700922 5.497276 
1 1 1    6    2  -99 o  113.437   1.3835  525.161   12.793  507.328   19.461  538.729   16.976  111.390   2.1433  114.838   1.8135 -3.447609 2.807581 
1 1 1    6    2  -98 o   34.399   2.6393   48.723   7.3442   58.452   11.675   42.352   9.4474   37.497   3.8756   31.888   3.7034 5.609207 5.360493 
1 1 1    6    2  -97 o  145.061   1.6132  858.941   19.076  958.811   37.851  824.940   22.086  152.969   3.0356  142.118   1.9064 10.85080 3.584596 
1 1 1    6    2  -96 o   63.538   1.8202  164.960   9.4178  180.618   15.875  156.457   11.699   66.354   2.9424   61.826   2.3254 4.528175 3.750358 
1 1 1    6    2  -95 o  106.379   1.4827  461.713   12.857  462.925   21.240  461.013   16.153  106.422   2.4484  106.265   1.8647 0.1561508 3.077625 
1 1 1    6    2  -94 o  173.820   1.5305  1232.69   21.685  1275.50   36.170  1208.66   27.095  176.658   2.5117  172.064   1.9318 4.593521 3.168700 
1 1 1    6    2  -93 o  151.137   1.4856  931.837   18.303  900.759   29.852  950.556   23.168  148.479   2.4665  152.609   1.8624 -4.130051 3.090618 
1 1 1    6    2  -92 o   94.995   1.4185  368.075   10.984  349.021   16.521  383.171   14.705   92.455   2.1922   96.897   1.8618 -4.441994 2.876118 
1 1 1    6    2  -91 o   58.942   1.7348  141.870   8.3259  141.566   12.795  142.094   10.965   58.801   2.6765   58.947   2.2862 -0.1459389 3.520024 
1 1 1    6    2  -90 o   49.213   1.9262   98.982   7.7120   97.890   11.815   99.793   10.179   48.846   2.9817   49.364   2.5382 -0.5187912 3.915740 
1 1 1    6    2  -89 o  102.200   1.4545  425.987   12.117  416.197   17.276  435.468   17.000  100.983   2.0987  103.300   2.0189 -2.316757 2.912154 
1 1 1    6    2  -88 o   45.718   2.2709   85.523   8.4364   76.305   11.357   96.872   12.601   43.082   3.2582   48.577   3.2002 -5.495449 4.566962 
1 1 1    6    2  -87 o  142.779   1.4446  831.329   16.813  805.081   23.539  858.663   24.022  140.467   2.0558  145.068   2.0314 -4.600952 2.890159 
1 1 1    6    2  -86 o   70.519   1.6452  202.818   9.4572  197.979   13.293  207.778   13.457   69.608   2.3461   71.314   2.3180 -1.705887 3.298138 
1 1 1    6    2  -85 o  139.163   1.5423  789.766   17.495  778.694   22.959  805.100   27.018  138.156   2.0387  140.455   2.3598 -2.299713 3.118474 
1 1 1    6    2  -84 o  197.154   1.6989  1585.21   27.303  1539.12   35.463  1652.31   42.784  194.221   2.2400  201.197   2.6087 -6.975876 3.438441 
1 1 1    6    2  -83 o  147.111   1.5751  882.496   18.888  871.047   24.794  898.329   29.157  146.126   2.0816  148.375   2.4107 -2.248718 3.185037 
1 1 1    6    2  -82 o  265.753   2.0101  2880.64   43.544  2813.82   56.704  2976.67   67.981  262.579   2.6492  270.008   3.0887 -7.428101 4.069189 
1 1 1    6    2  -81 o  138.945   1.4955  787.153   16.938  788.547   24.044  785.779   23.865  139.040   2.1215  138.796   2.1094 0.2435913 2.991663 
1 1 1    6    2  -80 o  176.939   1.5559  1276.54   22.441  1273.15   31.691  1279.96   31.782  176.666   2.2006  177.138   2.2011 -0.4720459 3.112455 
1 1 1    6    2  -79 o   96.234   1.3972  377.574   10.960  359.834   16.219  392.484   14.869   93.926   2.1184   98.103   1.8594 -4.177155 2.818685 
1 1 1    6    2  -78 o  233.192   1.6158  2217.23   30.714  2204.65   45.841  2227.49   41.375  232.470   2.4191  233.692   2.1720 -1.222061 3.251078 
1 1 1    6    2  -77 o  199.572   1.5608  1623.92   25.390  1576.19   35.514  1673.83   36.314  196.581   2.2163  202.579   2.1991 -5.998306 3.122175 
1 1 1    6    2  -76 o  130.615   1.3652  695.524   14.535  717.293   21.112  675.907   20.041  132.625   1.9529  128.744   1.9096 3.881363 2.731379 
1 1 1    6    2  -75 o  226.423   1.7845  2090.46   32.936  2081.72   43.451  2102.26   50.495  225.912   2.3595  226.995   2.7290 -1.082474 3.607594 
1 1 1    6    2  -74 o   64.912   1.5222  171.786   8.0545  166.928   11.721  176.134   11.087   63.936   2.2525   65.687   2.0732 -1.750851 3.061354 
1 1 1    6    2  -73 o  239.207   1.6180  2332.93   31.549  2309.97   47.061  2351.67   42.518  237.977   2.4260  240.133   2.1721 -2.156631 3.256323 
1 1 1    6    2  -72 o  120.515   1.2709  592.077   12.485  587.699   18.741  595.570   16.740  120.054   1.9151  120.861   1.6992 -0.8070908 2.560232 
1 1 1    6    2  -71 o  156.885   1.3311  1003.38   17.023  1030.66   25.940  982.738   22.560  158.983   2.0016  155.250   1.7827 3.732620 2.680359 
1 1 1    6    2  -70 f  206.964   1.5715  1746.30   26.511  1764.46   43.502  1735.57   33.438  207.987   2.5659  206.309   1.9883 1.677856 3.246133 
1 1 1    6    2  -69 o  180.166   1.4701  1323.30   21.590  1329.07   35.282  1319.84   27.297  180.522   2.3976  179.917   1.8612 0.6049652 3.035265 
1 1 1    6    2  -68 o  185.568   1.4896  1403.84   22.533  1307.50   35.337  1469.85   29.251  179.053   2.4211  189.867   1.8900 -10.81459 3.071455 
1 1 1    6    2  -67 o  208.826   1.6879  1777.89   28.732  1730.78   43.042  1815.74   38.587  206.001   2.5632  211.014   2.2433 -5.012482 3.406286 
1 1 1    6    2  -66 o  115.397   1.3303  542.843   12.513  542.621   17.758  543.061   17.636  115.363   1.8884  115.410   1.8746 -0.4709625E-01 2.660860 
1 1 1    6    2  -65 o  222.255   1.6371  2013.82   29.660  1998.90   41.810  2028.95   42.083  221.401   2.3166  223.059   2.3144 -1.658188 3.274666 
1 1 1    6    2  -64 f   59.782   1.5617  145.793   7.6035  151.327   10.823  140.400   10.684   60.881   2.1845   58.636   2.2394 2.244827 3.128413 
1 1 1    6    2  -63 f  248.843   1.7506  2524.48   35.510  2576.40   50.910  2475.28   49.554  251.355   2.4847  246.374   2.4675 4.980621 3.501747 
1 1 1    6    2  -62 o   65.758   1.5171  176.273   8.1318  173.195   11.691  179.157   11.318   65.138   2.2051   66.255   2.0983 -1.117645 3.043872 
1 1 1    6    2  -61 o   62.171   1.6686  157.682   8.4486  171.457   13.168  148.044   11.015   64.796   2.4977   60.215   2.2479 4.581062 3.360342 
1 1 1    6    2  -60 o  228.606   1.7772  2130.48   33.119  2172.88   51.353  2100.28   43.335  230.836   2.7291  226.962   2.3423 3.873459 3.596482 
1 1 1    6    2  -59 o  312.834   2.1952  3989.93   55.978  4029.70   86.257  3961.00   73.576  314.325   3.3665  311.663   2.8961 2.662109 4.440817 
1 1 1    6    2  -58 o  381.869   2.5725  5945.65   80.077  5918.27  122.033  5966.35  106.119  380.892   3.9304  382.479   3.4037 -1.586334 5.199351 
1 1 1    6    2  -57 o   36.934   2.3985   55.849   7.1821   52.107   10.509   59.127   9.8378   35.554   3.6793   37.943   3.2109 -2.388893 4.883386 
1 1 1    6    2  -56 o  496.108   3.0137 10035.69  121.873 10031.51  172.304 10039.87  172.406  495.896   4.2625  496.103   4.2633 -0.2062988 6.028671 
1 1 1    6    2  -55 o  279.787   1.8912  3191.03   43.132  3140.58   60.352  3243.70   61.663  277.545   2.6676  282.064   2.6819 -4.518921 3.782704 
1 1 1    6    2  -54 o  114.379   1.5632  533.261   14.574  533.417   25.227  533.183   17.856  114.384   2.7056  114.368   1.9153 0.1661682E-01 3.314928 
1 1 1    6    2  -53 o  398.500   3.1584  6474.72  102.595  6604.84  164.514  6391.92  131.242  402.371   5.0158  395.895   4.0668 6.476044 6.457364 
1 1 1    6    2  -52 o  243.418   2.1970  2415.37   43.593  2555.27   71.108  2331.13   55.177  250.338   3.4846  239.123   2.8308 11.21500 4.489535 
1 1 1    6    2  -51 o  151.176   2.2621  931.631   27.876  946.369   34.626  904.483   46.995  152.361   2.7880  148.884   3.8755 3.477112 4.774150 
1 1 1    6    2  -50 o  512.018   3.5860 10688.97  149.670 10909.47  215.142 10482.16  208.352  517.176   5.1033  506.951   5.0419 10.22510 7.173885 
1 1 1    6    2  -49 o  197.064   1.9563  1582.95   31.426  1554.33   40.060  1628.74   50.673  195.268   2.5168  199.880   3.1101 -4.610992 4.000867 
1 1 1    6    2  -48 o  210.473   2.0221  1805.69   34.693  1794.85   44.535  1822.41   55.329  209.834   2.6037  211.430   3.2104 -1.595917 4.133454 
1 1 1    6    2  -47 o  193.466   1.7659  1525.62   27.849  1532.26   34.025  1512.13   48.474  193.884   2.1529  192.596   3.0876 1.288193 3.764085 
1 1 1    6    2  -46 o  224.968   1.9097  2062.91   35.021  2103.58   43.252  1985.49   59.674  227.171   2.3357  220.690   3.3172 6.480713 4.056987 
1 1 1    6    2  -45 o  457.784   3.5536  8543.46  132.607  8728.23  173.703  8285.35  205.302  462.669   4.6058  450.735   5.5877 11.93481 7.241247 
1 1 1    6    2  -44 o  277.326   2.0264  3134.87   45.808  3116.96   60.140  3159.62   70.700  276.525   2.6680  278.404   3.1153 -1.879456 4.101672 
1 1 1    6    2  -43 o   91.215   1.6271  339.121   12.098  328.189   15.581  355.721   19.198   89.731   2.1301   93.383   2.5244 -3.652428 3.303049 
1 1 1    6    2  -42 o  182.691   1.5074  1360.36   22.449  1359.45   27.813  1362.07   38.024  182.627   1.8683  182.799   2.5518 -0.1713715 3.162667 
1 1 1    6    2  -41 o  208.299   1.6064  1768.48   27.276  1758.98   33.871  1786.01   46.004  207.737   2.0002  209.321   2.6962 -1.584534 3.357111 
1 1 1    6    2  -40 o  251.575   1.9023  2579.68   39.012  2623.62   51.620  2521.16   59.572  253.703   2.4961  248.696   2.9386 5.007538 3.855595 
1 1 1    6    2  -39 o  156.741   1.5518  1001.35   19.827  1096.05   31.756  940.852   25.382  163.981   2.3757  151.930   2.0495 12.05078 3.137599 
1 1 1    6    2  -38 o  248.196   1.6431  2510.81   33.243  2529.63   44.590  2487.26   49.878  249.121   2.1958  247.023   2.4770 2.097672 3.310161 
1 1 1    6    2  -37 o  555.642   2.9814 12584.93  135.038 12385.74  188.370 12795.51  193.685  551.194   4.1925  560.236   4.2412 -9.042114 5.963621 
1 1 1    6    2  -36 o  754.891   3.9745 23231.03  244.567 23474.33  349.043 22996.37  342.781  758.750   5.6434  750.988   5.5995 7.761597 7.950015 
1 1 1    6    2  -35 o  382.675   2.2525  5968.92   70.264  6056.99  106.694  5901.46   93.370  385.471   3.3956  380.496   3.0104 4.974976 4.537867 
1 1 1    6    2  -34 o  453.066   2.7644  8367.04  102.094  8344.24  144.167  8389.98  144.599  452.425   3.9092  453.663   3.9102 -1.238190 5.529097 
1 1 1    6    2  -33 o  646.944   3.6145 17061.30  190.610 16913.86  253.912 17251.68  288.518  644.099   4.8361  650.474   5.4414 -6.374512 7.279851 
1 1 1    6    2  -32 o  230.946   1.5307  2173.91   28.816  2187.64   38.887  2157.17   42.915  231.672   2.0592  230.051   2.2885 1.620560 3.078531 
1 1 1    6    2  -31 o  197.403   1.3942  1588.27   22.434  1581.05   30.062  1597.34   33.702  196.952   1.8725  197.963   2.0885 -1.011139 2.805039 
1 1 1    6    2  -30 o  350.301   2.2091  5001.67   63.080  5015.64   80.243  4979.05  102.057  350.784   2.8063  349.491   3.5824 1.292480 4.550681 
1 1 1    6    2  -29 o  624.356   3.7021 15890.71  188.414 15714.14  236.229 16199.42  312.359  620.847   4.6678  630.302   6.0795 -9.454956 7.664793 
1 1 1    6    2  -28 o  563.816   3.1739 12957.90  145.872 12784.14  193.691 13185.61  221.728  559.996   4.2432  568.704   4.7830 -8.708130 6.393842 
1 1 1    6    2  -27 o  253.760   1.8335  2624.65   37.927  2581.95   57.542  2657.44   50.432  251.681   2.8048  255.337   2.4230 -3.655609 3.706465 
1 1 1    6    2  -26 o  157.095   1.3911  1005.87   17.813  1056.21   28.170  972.322   22.994  160.976   2.1468  154.452   1.8264 6.523972 2.818585 
1 1 1    6    2  -25 f  730.987   4.5979 21784.22  273.974 21745.85  417.917 21813.14  362.816  730.214   7.0211  731.399   6.0855 -1.185486 9.291330 
1 1 1    6    2  -24 o  534.277   3.4202 11636.02  148.956 11764.49  229.857 11543.02  195.580  537.163   5.2495  532.108   4.5091 5.055359 6.920183 
1 1 1    6    2  -23 o  694.831   4.0968 19681.61  232.037 19582.08  326.939 19782.62  329.375  692.995   5.7876  696.534   5.8011 -3.538696 8.194495 
1 1 1    6    2  -22 o  550.336   3.2895 12346.00  147.568 12143.42  206.061 12559.27  211.429  545.762   4.6319  555.027   4.6732 -9.264648 6.579743 
1 1 1    6    2  -21 o  381.562   2.5357  5934.38   78.867  5960.50  121.413  5915.32  103.733  382.376   3.8953  380.936   3.3406 1.440796 5.131560 
1 1 1    6    2  -20 o  528.912   3.3914 11403.71  146.219 11468.55  224.792 11356.15  192.510  530.352   5.1997  527.774   4.4748 2.577881 6.860075 
1 1 1    6    2  -19 o  762.410   4.7891 23699.33  297.629 23364.50  449.421 23960.89  397.217  756.829   7.2848  766.502   6.3574 -9.672974 9.668771 
1 1 1    6    2  -18 o  159.379   1.3205  1035.33   17.156  987.555   24.010  1085.18   24.523  155.656   1.8923  163.168   1.8438 -7.512695 2.642005 
1 1 1    6    2  -17 o  817.501   4.5159 27247.73  300.935 27148.02  402.542 27374.06  453.102  815.893   6.0526  819.218   6.7852 -3.325256 9.092436 
1 1 1    6    2  -16 o  454.678   2.7622  8426.98  102.375  8540.56  146.543  8318.71  143.078  457.701   3.9278  451.719   3.8857 5.982605 5.525046 
1 1 1    6    2  -15 o  1170.54   7.2741 55897.70  694.063 56594.36  928.372 55014.90  1045.06  1177.38   9.6732  1160.53   11.047 16.84448 14.68365 
1 1 1    6    2  -14 o  310.132   2.1365  3920.45   54.012  3895.51   71.153  3954.38   82.972  309.134   2.8236  311.453   3.2681 -2.319031 4.318998 
1 1 1    6    2  -13 o  831.732   5.2069 28209.87  353.020 28340.92  468.996 28038.55  536.223  833.495   6.9029  828.914   7.9360 4.581360 10.51804 
1 1 1    6    2  -12 o  145.062   1.2640  857.687   14.946  853.671   21.293  861.588   20.985  144.720   1.8050  145.389   1.7707 -0.6696625 2.528510 
1 1 1    6    2  -11 o  427.750   2.6161  7458.42   91.217  7530.65  130.146  7388.68  127.883  429.785   3.7149  425.715   3.6852 4.069458 5.232661 
1 1 1    6    2  -10 o  478.241   2.8920  9323.46  112.742  9157.74  157.160  9499.17  161.824  473.931   4.0681  482.683   4.1129 -8.752075 5.784917 
1 1 1    6    2   -9 o  751.409   4.7209 23023.44  289.157 22904.74  439.893 23113.76  383.701  749.227   7.2027  752.743   6.2533 -3.515808 9.538528 
1 1 1    6    2   -8 o  523.659   3.3578 11179.25  143.331 11288.43  220.977 11099.96  188.318  526.120   5.1526  521.750   4.4278 4.369934 6.793764 
1 1 1    6    2   -7 o  284.520   1.8661  3299.65   43.280  3303.57   61.425  3295.77   60.990  284.678   2.6470  284.342   2.6314 0.3361206 3.732401 
1 1 1    6    2   -6 o  350.330   2.2033  5002.76   62.920  4992.30   88.991  5013.21   88.975  349.944   3.1197  350.677   3.1126 -0.7324829 4.406887 
1 1 1    6    2   -5 o  792.543   5.3679 25617.87  346.787 25445.68  597.145 25705.49  425.982  789.349   9.2806  793.763   6.5836 -4.414001 11.37860 
1 1 1    6    2   -4 o  261.612   2.0212  2789.72   43.103  2800.54   75.012  2784.39   52.666  262.093   3.5111  261.355   2.4721 0.7376404 4.294039 
1 1 1    6    2   -3 o  503.776   3.4995 10346.81  143.706 10504.91  252.162 10270.76  174.885  507.461   6.0959  501.885   4.2748 5.575592 7.445406 
1 1 1    6    2   -2 o  467.495   4.0027  8910.99  152.533  8903.90  215.775  8918.06  215.654  467.220   5.6656  467.592   5.6579 -0.3718567 8.006886 
1 1 1    6    2   -1 o  369.957   3.2572  5579.78   98.227  5568.18  138.848  5591.40  138.980  369.525   4.6096  370.295   4.6044 -0.7698059 6.515238 
1 1 1    6    2    0 o  497.909   4.2413 10108.62  172.142 10364.82  248.719  9873.05  238.495  504.067   6.0532  491.971   5.9471 12.09601 8.485800 
1 1 1    6    2    1 o  217.944   2.1838  1936.17   38.796  1898.89   44.304  2058.79   80.338  215.831   2.5182  224.700   4.3861 -8.869232 5.057629 
1 1 1    6    2    2 o  702.412   5.2354 20122.04  299.761 20013.35  385.213 20288.91  477.284  700.362   6.7475  704.971   8.3056 -4.609131 10.70099 
1 1 1    6    2    3 o  334.690   2.6824  4566.31   73.180  4455.54   92.679  4749.73  119.262  330.587   3.4392  341.301   4.2868 -10.71320 5.495872 
1 1 1    6    2    4 o  638.442   4.7800 16621.94  248.764 16496.19  319.056 16816.92  397.280  635.910   6.1551  641.914   7.5925 -6.003540 9.773999 
1 1 1    6    2    5 o  180.129   1.6007  1322.51   23.504  1360.09   33.825  1287.43   32.683  182.665   2.2717  177.719   2.2561 4.946182 3.201615 
1 1 1    6    2    6 o  508.019   3.5257 10521.82  146.003 10419.97  204.822 10627.04  208.178  505.483   4.9709  510.479   5.0029 -4.996002 7.052557 
1 1 1    6    2    7 o  335.966   2.4569  4601.05   67.286  4571.51   94.754  4631.10   95.565  334.863   3.4713  337.038   3.4784 -2.175323 4.914214 
1 1 1    6    2    8 o  322.249   2.3750  4232.95   62.388  4299.90   89.331  4169.20   87.168  324.766   3.3744  319.793   3.3439 4.972992 4.750585 
1 1 1    6    2    9 o  368.198   2.6521  5526.32   79.599  5462.59  111.606  5592.31  113.561  366.041   3.7404  370.361   3.7616 -4.320007 5.304725 
1 1 1    6    2   10 o  395.054   3.0858  6362.21   99.371  6354.97  157.054  6367.04  128.323  394.770   4.8806  395.178   3.9836 -0.4081421 6.299921 
1 1 1    6    2   11 o  488.409   3.4066  9724.72  135.627  9452.99  187.458 10023.20  196.469  481.481   4.7763  495.786   4.8614 -14.30469 6.815151 
1 1 1    6    2   12 o  298.724   2.2388  3637.40   54.516  3594.02   76.464  3682.24   77.747  296.923   3.1592  300.545   3.1735 -3.621796 4.477909 
1 1 1    6    2   13 o  300.313   2.2482  3676.18   55.035  3669.12   77.771  3683.27   77.892  300.009   3.1801  300.588   3.1790 -0.5781250 4.496583 
1 1 1    6    2   14 o  170.572   1.5654  1185.88   21.766  1209.67   31.193  1163.31   30.387  172.270   2.2213  168.937   2.2066 3.333511 3.131027 
1 1 1    6    2   15 o  417.241   2.9576  7096.56  100.593  7189.17  143.728  7007.63  140.837  419.921   4.1989  414.586   4.1674 5.334900 5.915929 
1 1 1    6    2   16 o  265.147   2.2461  2865.61   48.546  2918.58   63.406  2790.57   75.467  267.578   2.9070  261.635   3.5386 5.942963 4.579519 
1 1 1    6    2   17 o  417.232   3.2430  7096.38  110.296  6993.53  172.366  7167.69  143.529  414.143   5.1058  419.298   4.1993 -5.154358 6.610876 
1 1 1    6    2   18 o  245.626   2.1280  2459.16   42.607  2432.56   67.030  2477.19   55.193  244.281   3.3662  246.519   2.7466 -2.238510 4.344567 
1 1 1    6    2   19 o  505.878   3.8538 10432.69  158.917 10230.94  247.182 10574.84  207.481  500.879   6.0541  509.273   4.9980 -8.394318 7.850573 
1 1 1    6    2   20 o  696.904   5.1996 19802.79  295.378 19707.95  465.210 19866.85  382.333  695.026   8.2113  697.937   6.7203 -2.911072 10.61075 
1 1 1    6    2   21 o  315.951   2.5673  4068.99   66.120  4101.68  105.372  4047.75   84.920  317.195   4.0753  315.116   3.3060 2.079620 5.247658 
1 1 1    6    2   22 o   95.904   1.7083  374.880   13.355  402.931   19.350  349.366   18.455   99.425   2.3876   92.548   2.4484 6.876846 3.419838 
1 1 1    6    2   23 o  633.618   6.1323 16371.07  316.729   0.0000   0.0000 16371.07  316.729  ?   ?   633.618   6.1323 0.000000 6.132321 
1 1 1    6    2   24 o  502.859   4.9431 10309.44  202.620  9916.00  339.739 10526.64  252.427  493.021   8.4536  508.087   6.0948 -15.06586 10.42166 
1 1 1    6    2   25 f  963.675   9.1804 37890.41  721.152 37892.88  1248.99 37889.18  883.255  962.680   15.916  963.403   11.247 -0.7227173 19.48912 
1 1 1    6    2   26 o  1149.19   10.914 53905.11  1022.41 54754.56  1795.14 53497.27  1243.86  1156.47   19.043  1144.42   13.334 12.05029 23.24679 
1 1 1    6    2   27 o  274.885   2.9744  3080.03   66.648  2989.71  113.246  3127.89   82.436  270.795   5.1304  277.005   3.6508 -6.209320 6.296753 
1 1 1    6    2   28 o  558.405   4.7193 12712.28  214.812 12853.88  307.028 12576.50  300.654  561.429   6.7088  555.341   6.6416 6.087708 9.440288 
1 1 1    6    2   29 o  1069.03   7.8715 46613.53  685.938 46666.99  1085.81 46578.02  884.865  1069.03   12.460  1068.35   10.161 0.6802979 16.07794 
1 1 1    6    2   30 o  575.959   4.3477 13523.53  204.122 13529.56  323.294 13519.54  263.223  575.986   6.8857  575.830   5.6078 0.1568604 8.880353 
1 1 1    6    2   31 o  475.514   3.6465  9217.34  141.343  9226.92  223.898  9210.99  182.249  475.702   5.7740  475.324   4.7037 0.3777466 7.447423 
1 1 1    6    2   32 o  325.526   2.6415  4319.32   70.093  4502.81  114.689  4209.92   88.556  332.345   4.2335  321.368   3.3805 10.97757 5.417548 
1 1 1    6    2   33 o  421.885   3.6801  7255.55  126.557  7354.43  180.814  7160.58  177.197  424.713   5.2228  419.079   5.1871 5.633728 7.360939 
1 1 1    6    2   34 o  478.024   3.6686  9314.98  142.950  9328.69  226.577  9305.92  184.249  478.312   5.8112  477.763   4.7310 0.5484619 7.493537 
1 1 1    6    2   35 o  542.518   4.1182 11998.66  182.119 11906.16  286.355 12061.49  235.997  540.330   6.5014  543.895   5.3230 -3.564148 8.402558 
1 1 1    6    2   36 o  352.920   2.8302  5076.98   81.419  5173.13  131.067  5016.57  103.897  356.215   4.5138  350.801   3.6333 5.414368 5.794457 
1 1 1    6    2   37 o  352.019   2.8326  5051.11   81.281  5152.87  131.132  4987.62  103.579  355.516   4.5249  349.787   3.6327 5.729095 5.802733 
1 1 1    6    2   38 o  105.673   1.6172  455.142   13.930  468.520   21.048  444.714   18.583  107.212   2.4084  104.453   2.1825 2.758530 3.250152 
1 1 1    6    2   39 o   28.844   3.8233   34.510   8.7682   32.257   14.031   35.954   11.231   27.574   6.3704   29.305   4.8728 -1.731049 8.020368 
1 1 1    6    2   40 o  463.682   3.2835  8764.34  124.107  8899.08  178.238  8637.53  172.910  467.193   4.6802  460.278   4.6085 6.914246 6.568360 
1 1 1    6    2   41 o  170.824   1.7276  1189.39   24.056  1252.63   35.959  1138.16   32.366  175.302   2.5164  167.101   2.3761 8.201157 3.460952 
1 1 1    6    2   42 o  174.460   1.7292  1240.57   24.591  1274.76   36.230  1211.36   33.485  176.843   2.5133  172.390   2.3829 4.453003 3.463334 
1 1 1    6    2   43 o  467.813   3.3095  8921.41  126.204  9003.46  180.230  8842.47  176.779  469.914   4.7052  465.695   4.6569 4.218536 6.620039 
1 1 1    6    2   44 o  860.868   5.3959 30221.11  378.646 30693.49  507.747 29629.27  568.334  867.392   7.1812  852.102   8.1823 15.28967 10.88666 
1 1 1    6    2   45 o  790.891   5.3684 25508.30  346.098 25257.38  420.345 26036.48  609.852  786.884   6.5533  798.581   9.3685 -11.69781 11.43303 
1 1 1    6    2   46 o   88.423   2.1744  318.698   15.673  318.698   15.673   0.0000   0.0000   88.423   2.1744  ?   ?  0.000000 2.174443 
1 1 1    6    2   47 o  443.083   3.4328  8003.67  123.985  8014.02  160.669  7988.43  194.942  443.331   4.4460  442.576   5.4036 0.7542114 6.997532 
1 1 1    6    2   48 o  253.517   2.2089  2619.82   45.647  2612.43   59.372  2630.50   71.383  253.149   2.8772  254.012   3.4475 -0.8630371 4.490390 
1 1 1    6    2   49 o  462.986   3.2605  8738.99  123.051  8917.76  177.156  8572.35  171.045  467.630   4.6475  458.488   4.5766 9.141968 6.522621 
1 1 1    6    2   50 o  478.352   3.3594  9329.12  130.991  9041.06  180.710  9648.06  190.149  470.836   4.7084  486.379   4.7960 -15.54318 6.720966 
1 1 1    6    2   51 o  255.822   2.0320  2667.71   42.374  2716.53   61.013  2622.22   58.896  258.135   2.8996  253.616   2.8489 4.519501 4.064940 
1 1 1    6    2   52 o  521.092   3.1449 11070.85  133.586 11115.11  189.611 11027.23  188.235  522.044   4.4557  519.978   4.4410 2.066589 6.290952 
1 1 1    6    2   53 o  383.639   2.5682  6000.10   80.312  5910.67  105.125  6125.46  124.467  380.736   3.3872  387.563   3.9398 -6.827301 5.195731 
1 1 1    6    2   54 o  126.667   1.3050  653.980   13.474  653.602   19.230  654.345   18.886  126.626   1.8630  126.698   1.8286 -0.7231903E-01 2.610485 
1 1 1    6    2   55 o  156.307   1.5636  995.891   19.922  991.326   24.865  1004.08   33.294  155.944   1.9561  156.933   2.6026 -0.9893951 3.255759 
1 1 1    6    2   56 o  150.030   1.3500  917.483   16.510  947.342   23.871  890.101   22.859  152.445   1.9209  147.768   1.8978 4.677048 2.700299 
1 1 1    6    2   57 o   99.191   1.2768  401.038   10.324  399.260   14.890  402.683   14.326   98.966   1.8458   99.390   1.7683 -0.4241486 2.556117 
1 1 1    6    2   58 o  506.552   3.2750 10464.57  135.228 10529.74  207.441 10416.40  178.327  507.918   5.0103  505.269   4.3297 2.648926 6.621917 
1 1 1    6    2   59 o  422.941   2.7921  7294.20   96.260  7515.71  150.555  7141.04  125.191  429.170   4.3036  418.402   3.6706 10.76791 5.656366 
1 1 1    6    2   60 o  410.446   2.5476  6869.30   85.237  6843.93  120.285  6894.88  120.802  409.596   3.6026  411.118   3.6047 -1.521545 5.096377 
1 1 1    6    2   61 o  187.908   1.4753  1439.36   22.598  1417.62   31.869  1461.34   32.048  186.468   2.0967  189.323   2.0766 -2.854645 2.950998 
1 1 1    6    2   62 o  119.271   1.2876  579.878   12.518  547.784   17.609  612.674   17.800  115.915   1.8636  122.590   1.7813 -6.674995 2.577964 
1 1 1    6    2   63 f   91.161   1.2864  338.753   9.5594  337.944   13.825  339.494   13.232   91.045   1.8629   91.254   1.7788 -0.2097626 2.575782 
1 1 1    6    2   64 f  376.951   2.3715  5794.27   72.871  5802.31  103.265  5786.31  102.845  377.114   3.3593  376.595   3.3502 0.5192566 4.744333 
1 1 1    6    2   65 o  263.414   1.8034  2828.92   38.723  2783.54   54.341  2875.74   55.194  261.252   2.5517  265.544   2.5499 -4.291412 3.607370 
1 1 1    6    2   66 o  388.630   2.5998  6159.90   82.358  6033.56  123.654  6260.62  110.412  384.453   3.9457  391.692   3.4581 -7.238464 5.246636 
1 1 1    6    2   67 o  177.252   1.5338  1280.84   22.162  1240.42   33.194  1313.35   29.768  174.405   2.3348  179.471   2.0348 -5.066208 3.097072 
1 1 1    6    2   68 o  101.396   1.4334  419.128   11.848  377.665   19.524  443.298   14.906   96.197   2.4919  104.273   1.7537 -8.076584 3.047123 
1 1 1    6    2   69 o  187.444   1.6914  1432.48   25.843  1367.32   36.030  1501.52   37.087  183.100   2.4140  191.878   2.3712 -8.777435 3.383802 
1 1 1    6    2   70 f  128.393   1.4738  672.049   15.425  636.773   21.789  707.486   21.839  124.961   2.1391  131.720   2.0339 -6.759140 2.951716 
1 1 1    6    2   71 o   27.053   2.4977   30.106   5.4459   33.656   8.6982   27.817   6.9842   28.454   3.8488   25.887   3.3912 2.566792 5.129645 
1 1 1    6    2   72 o   70.415   1.5146  202.145   8.6933  211.085   12.989  194.891   11.700   71.910   2.2186   69.100   2.0795 2.809273 3.040834 
1 1 1    6    2   73 o  202.599   1.5436  1673.45   25.492  1663.54   36.113  1683.31   35.991  201.966   2.1935  203.164   2.1732 -1.197678 3.087808 
1 1 1    6    2   74 o  139.100   1.3369  788.794   15.159  751.473   21.306  827.051   21.572  135.752   1.9254  142.417   1.8582 -6.665451 2.675862 
1 1 1    6    2   75 o   34.461   2.0384   48.599   5.7005   48.784   8.8305   48.466   7.4641   34.427   3.1827   34.362   2.6861 0.6446838E-01 4.164725 
1 1 1    6    2   76 o  228.796   1.6567  2134.40   30.898  2142.92   44.056  2126.15   43.345  229.206   2.3580  228.310   2.3290 0.8964081 3.314272 
1 1 1    6    2   77 o  122.707   1.3186  613.846   13.189  598.514   18.841  628.578   18.468  121.148   1.9079  124.156   1.8248 -3.008293 2.640063 
1 1 1    6    2   78 o  172.721   1.5824  1216.37   22.279  1205.20   29.156  1232.04   34.536  171.901   2.0807  173.783   2.4380 -1.881332 3.205196 
1 1 1    6    2   79 o  296.049   1.9872  3574.53   47.956  3540.39   67.659  3609.00   67.983  294.534   2.8181  297.377   2.8045 -2.842255 3.975779 
1 1 1    6    2   80 o   69.361   1.5973  196.171   9.0311  199.544   13.639  193.537   12.052   69.895   2.3974   68.848   2.1501 1.046387 3.220312 
1 1 1    6    2   81 o  209.357   1.6281  1787.24   27.785  1714.31   38.666  1865.11   39.953  204.993   2.3140  213.820   2.2923 -8.827759 3.257131 
1 1 1    6    2   82 o  131.019   1.4026  699.894   14.979  690.790   21.567  708.380   20.821  130.137   2.0330  131.789   1.9381 -1.651077 2.808851 
1 1 1    6    2   83 o   21.076   4.0411   18.772   6.6900   15.424   12.075   20.255   8.0363   19.782   6.4875   21.833   4.6575 -2.051117 7.986277 
1 1 1    6    2   84 o   88.088   1.3967  316.391   10.029  315.201   14.726  317.420   13.696   87.901   2.0552   88.215   1.9047 -0.3146057 2.802054 
1 1 1    6    2   85 o  197.423   1.6588  1589.57   26.694  1586.80   35.641  1593.11   40.287  197.200   2.2172  197.561   2.5017 -0.3606110 3.342793 
1 1 1    6    2   86 o   86.563   1.4920  305.572   10.527  299.185   14.523  312.642   15.282   85.631   2.0807   87.533   2.1417 -1.901840 2.985987 
1 1 1    6    2   87 o  120.318   1.4579  590.353   14.298  571.103   19.185  614.405   21.445  118.311   1.9893  122.704   2.1440 -4.392944 2.924737 
1 1 1    6    2   88 o   81.793   1.4262  272.828   9.5092  270.218   13.894  275.129   13.043   81.346   2.0970   82.116   1.9485 -0.7701263 2.862563 
1 1 1    6    2   89 o  153.908   1.5205  966.140   19.076  930.583   29.147  992.782   25.230  150.972   2.3685  155.976   1.9844 -5.004196 3.089895 
1 1 1    6    2   90 o  167.255   1.5665  1141.09   21.357  1087.38   32.392  1182.39   28.406  163.177   2.4352  170.206   2.0474 -7.028763 3.181535 
1 1 1    6    2   91 o   89.854   1.5266  329.335   11.182  344.680   18.247  320.107   14.150   91.833   2.4397   88.563   1.9600 3.270264 3.129501 
1 1 1    6    2   92 o   63.353   1.6883  163.875   8.7107  150.694   13.802  172.600   11.230   60.652   2.7992   64.986   2.1227 -4.333656 3.513067 
1 1 1    6    2   93 o  115.791   1.3928  546.886   13.147  580.313   19.406  518.535   17.872  119.227   1.9968  112.707   1.9453 6.520180 2.787735 
1 1 1    6    2   94 o   49.745   1.8910  101.163   7.6542   92.515   11.480  108.085   10.270   47.458   2.9826   51.370   2.4598 -3.911842 3.866058 
1 1 1    6    2   95 o  156.639   1.4645  1001.04   18.700  982.899   26.653  1018.63   26.243  155.128   2.1077  157.933   2.0385 -2.805542 2.932236 
1 1 1    6    2   96 o  118.907   1.5226  576.964   14.758  568.141   20.225  587.013   21.584  117.929   2.1039  119.857   2.2092 -1.928352 3.050732 
1 1 1    6    2   97 o   97.020   1.5005  384.144   11.867  366.387   17.257  400.075   16.345   94.675   2.2361   98.958   2.0263 -4.282494 3.017630 
1 1 1    6    2   98 o   64.252   1.6909  168.682   8.8483  171.781   13.346  166.252   11.819   64.739   2.5339   63.722   2.2791 1.017658 3.408098 
1 1 1    6    2   99 o   50.093   1.9089  102.680   7.7805  102.427   11.735  102.879   10.393   49.902   2.8973   50.063   2.5553 -0.1605988 3.863160 
1 1 1    6    2  100 o   95.576   1.4269  372.892   11.116  363.127   16.098  381.792   15.369   94.231   2.0958   96.644   1.9509 -2.413200 2.863297 
1 1 1    6    2  101 o   62.511   1.6312  159.736   8.3048  159.092   12.284  160.278   11.271   62.274   2.4245   62.540   2.2144 -0.2656059 3.283563 
1 1 1    6    2  102 o   90.123   1.5315  331.776   11.251  310.536   17.754  346.030   14.545   86.993   2.5063   91.977   1.9399 -4.983864 3.169350 
1 1 1    6    2  103 o   32.293   2.5920   43.074   6.7659   43.202   10.652   42.988   8.7600   32.008   4.1825   32.109   3.3984 -0.1012115 5.389099 
1 1 1    6    2  104 o  142.507   1.7861  830.787   20.748  829.177   34.398  831.709   26.013  141.903   2.9737  142.434   2.2404 -0.5311737 3.723260 
1 1 1    6    2  105 o   18.524   5.2839   14.863   8.3687 -11.1496   24.202   18.395   8.9189   17.215   7.8393   20.500   5.2989 -3.285574 9.462230 
1 1 1    6    2  106 o  107.241   1.6126  470.456   14.097  479.273   21.030  463.260   18.997  108.005   2.3887  106.252   2.1933 1.752899 3.242925 
1 1 1    6    2  107 o   60.487   1.8937  150.090   9.3257  128.358   13.911  167.828   12.568   55.631   3.0797   63.837   2.4196 -8.205746 3.916513 
1 1 1    6    2  108 o   27.136   4.1395   31.509   8.8671   35.317   11.313   25.442   14.279   28.459   5.0622   23.736   6.9420 4.722620 8.591690 
1 1 1    6    2  109 o   29.703   3.3059   37.086   7.8687   37.998   11.383   36.250   10.889   29.563   4.8950   28.897   4.7906 0.6658497 6.849103 
1 1 1    6    2  110 o   15.690   4.9303   10.484   7.0267   6.4123   11.099   13.208   9.0775   15.211   6.0256   17.544   5.6150 -2.333160 8.236215 
1 1 1    6    2  111 o  100.557   1.5314  414.138   12.553  434.357   20.297  401.615   15.974  102.605   2.4267   98.862   1.9822 3.743248 3.133395 
1 1 1    6    2  112 o   42.963   2.0364   76.090   7.1115   90.736   10.695   64.482   9.5215   46.690   2.8233   39.277   2.9965 7.412380 4.117051 
1 1 1    6    2  113 f   77.310   1.5033  244.894   9.4734  235.273   13.850  253.354   12.987   75.496   2.2530   78.438   2.0329 -2.941093 3.034565 
1 1 1    6    2  114 o   42.097   2.3465   73.421   8.0202   76.870   10.605   68.813   12.259   42.838   3.0570   40.230   3.7827 2.608006 4.863519 
1 1 1    6    2  115 o   7.2591   3.5324 -11.2939   6.6804 -10.0129   8.7768 -13.0582   10.300   9.1193   4.3351   9.6058   4.6018 -0.4865208 6.322154 
1 1 1    6    2  116 o   44.595   2.2629   82.415   8.1993   80.654   10.827   84.783   12.555   43.822   3.0500   44.743   3.4695 -0.9213028 4.619512 
1 1 1    6    2  117 o   9.1259   4.1798  -4.1334   7.0104  -4.2226   9.3534  -4.0191   10.590   10.760   4.8895   11.573   5.2366 -0.8132019 7.164432 
1 1 1    6    2  118 o   37.926   2.7104   60.322   8.3241   58.572   11.766   62.074   11.778   36.779   3.9884   37.940   3.8621 -1.161278 5.551866 
1 1 1    6    2  119 o   45.851   2.6943   88.182   10.026   88.115   12.516   88.302   16.748   45.455   3.4026   44.655   4.6700 0.8008804 5.778077 
1 1 1    6    2  120 o   9.5361   4.4423  -6.2918   8.4221   4.0354   10.570 -24.2493   13.938   13.676   5.7038   10.028   4.9265 3.648086 7.536802 
1 1 1    6    2  121 o   13.396   5.3399   5.5828   8.7690   13.730   11.043  -8.3254   14.428   17.421   6.1912   12.479   5.8135 4.942025 8.492818 
1 1 1    6    2  122 o   37.979   2.6993   60.990   8.3021   58.062   11.158   64.621   12.426   36.409   3.8163   38.268   4.0446 -1.859325 5.560816 
1 1 1    6    2  123 o   27.375   3.7024   33.043   8.0500   21.025   10.629   49.213   12.328   20.605   5.9788   32.759   4.7557 -12.15401 7.639542 
1 1 1    6    2  124 o   36.586   2.8562   57.197   8.4505   64.691   11.429   48.158   12.552   38.339   3.7030   32.131   4.9510 6.207859 6.182591 
1 1 1    6    2  125 o   13.572   5.2659   6.9916   8.3292  -8.3947   11.798   22.278   11.760   10.923   5.1423   20.769   6.3543 -9.845909 8.174386 
1 1 1    6    2  126 o   28.769   4.3721   37.971   9.9306   36.565   16.183   38.820   12.577   25.627   7.3596   28.059   5.6938 -2.431505 9.305053 
1 1 1    6    2  127 o   18.977   6.1406   18.437   10.836   28.250   15.246   8.4189   15.405   22.462   7.2850   15.941   6.7794 6.520669 9.951432 
1 1 1    6    2  128 o   17.317   5.7905   14.933   9.6060   22.072   12.148   3.0178   15.693   20.366   6.4930   14.667   6.5251 5.699795 9.205200 
1 1 1    6    2  129 o   10.076   4.6987  -5.6557   9.4627 -10.8661   12.000   2.9103   15.387   10.488   5.0090   14.495   6.4541 -4.006724 8.169772 
1 1 1    6    2  130 o   32.760   4.0270   48.793   10.528   55.819   13.498   37.881   16.822   34.171   4.9932   25.433   7.5606 8.738594 9.060633 
1 1 1    6    2  131 o   9.7368   4.6078  -7.8123   9.7017 -13.0980   12.163   1.4323   16.085   10.181   4.9089   14.296   6.4627 -4.114988 8.115708 
1 1 1    6    2  132 o   11.376   5.0843  -0.4154   9.6424   5.8630   12.407  -9.9919   15.323   14.190   6.0610   12.030   5.7215 2.159887 8.334949 
1 1 1    6    2  133 o   21.354   5.6507   23.509   9.9875   7.7864   12.461   51.755   16.702   14.712   6.1685   30.659   6.8552 -15.94699 9.221913 
1 1 1    6    2  134 o   22.413   5.9622   26.575   11.082   19.376   14.890   35.515   16.593   18.601   7.0858   24.143   7.5749 -5.542637 10.37249 
1 1 1    6    2  135 o   18.024   6.6263   17.590   12.785   20.575   22.139   16.097   15.660   18.956   8.0966   17.574   7.0907 1.382799 10.76259 
1 1 1    6    2  136 o   20.269   6.8074   23.270   13.275   57.514   22.807   5.7247   16.325   29.207   8.8314   15.100   6.6899 14.10729 11.07919 
1 1 1    6    3 -135 o   11.773   5.3217  -0.9708   10.903 -27.3352   15.048   28.172   15.821   9.8122   4.8741   21.612   7.4292 -11.80015 8.885382 
1 1 1    6    3 -134 o   17.127   6.2149   15.289   11.192   0.6349   15.517   31.183   16.160   13.798   6.2809   22.594   7.5093 -8.795712 9.789784 
1 1 1    6    3 -133 o   12.245   5.2478   3.2066   9.3582   8.1600   11.767  -5.3197   15.438   14.598   6.0471   12.712   5.9519 1.886086 8.484823 
1 1 1    6    3 -132 o   13.043   5.7512   2.3881   11.928   19.425   18.704  -9.2877   15.484   18.688   7.6709   12.149   5.7703 6.539228 9.598864 
1 1 1    6    3 -131 o   14.464   5.8117   8.4096   10.472   30.646   14.265 -17.5861   15.423   23.211   6.9769   11.051   5.3752 12.15986 8.807399 
1 1 1    6    3 -130 o   20.515   5.6456   21.565   9.7369   22.334   11.991   20.077   16.685   20.294   6.4487   19.018   7.4320 1.276039 9.839724 
1 1 1    6    3 -129 f   16.438   5.7492   13.305   9.4932   10.456   11.816   18.491   15.943   15.563   6.2004   18.614   7.2676 -3.050544 9.553144 
1 1 1    6    3 -128 o   8.8799   4.2345  -8.5852   8.5088 -11.5676   10.242  -1.9425   15.286   9.4150   4.5308   13.467   6.1696 -4.051990 7.654539 
1 1 1    6    3 -127 o   10.333   4.6887  -2.4285   8.5620  -4.9459   10.222   3.4910   15.674   10.673   4.9451   14.747   6.5433 -4.074608 8.201743 
1 1 1    6    3 -126 o   13.888   5.3479   7.7478   8.5427   11.129   10.112  -0.6802   15.965   15.675   5.8685   14.058   6.3884 1.617002 8.674700 
1 1 1    6    3 -125 o   11.757   5.0017   2.3817   8.3895  -4.9907   9.9784   20.162   15.496   10.584   4.8977   19.513   7.2728 -8.928250 8.768205 
1 1 1    6    3 -124 o   17.420   5.4425   14.758   8.5749   21.347   10.319   0.0566   15.414   20.592   5.8651   14.124   6.3611 6.468008 8.652380 
1 1 1    6    3 -123 o   18.705   5.4484   17.058   8.8112   15.069   10.589   21.535   15.888   17.618   6.0770   20.212   7.3939 -2.594099 9.570791 
1 1 1    6    3 -122 o   45.372   2.7489   87.323   10.119   86.632   12.163   88.878   18.239   44.766   3.3576   43.649   5.2302 1.116554 6.215154 
1 1 1    6    3 -121 o   9.5553   4.4430  -5.7523   8.3638  -6.6424   10.184  -3.9083   14.659   10.511   4.8926   13.321   6.0796 -2.810295 7.803788 
1 1 1    6    3 -120 o   9.9675   4.5456  -3.7059   8.1750  -5.2711   10.013  -0.5767   14.158   10.748   4.9495   13.889   6.1872 -3.140379 7.923273 
1 1 1    6    3 -119 o   30.752   3.6085   40.989   8.8736   44.173   10.966   34.951   15.103   31.510   4.3883   26.385   6.9330 5.125078 8.205118 
1 1 1    6    3 -118 o   30.559   2.8856   39.523   7.1029   36.191   10.944   41.948   9.3366   28.270   4.9280   31.104   3.7585 -2.833847 6.197761 
1 1 1    6    3 -117 o   28.455   3.2716   34.576   7.4505   33.567   10.576   35.570   10.498   27.280   4.9376   28.205   4.7336 -0.9245739 6.840078 
1 1 1    6    3 -116 f   11.040   4.5773   2.0001   6.7503  -4.6183   9.9079   7.7334   9.2217   11.006   5.0136   14.700   5.5819 -3.693218 7.502890 
1 1 1    6    3 -115 o   43.032   2.4188   76.954   8.4504   68.473   12.953   83.238   11.150   39.901   4.0381   44.493   3.0935 -4.592232 5.086837 
1 1 1    6    3 -114 o   54.878   1.9397  124.120   8.6631  121.698   14.073  125.598   10.993   53.817   3.2228   55.020   2.4572 -1.203178 4.052691 
1 1 1    6    3 -113 o   67.203   1.8521  185.782   10.136  175.085   15.850  193.184   13.185   64.749   3.0112   68.330   2.3707 -3.581009 3.832454 
1 1 1    6    3 -112 o   12.699   4.8356   5.2122   6.9326   4.0832   11.258   5.9017   8.7986   14.366   5.9296   13.897   5.4066 0.4689837 8.024404 
1 1 1    6    3 -111 o   30.310   3.1201   38.644   7.5989   35.633   11.966   40.678   9.8368   28.260   5.3912   30.806   4.0126 -2.545353 6.720570 
1 1 1    6    3 -110 o   25.048   3.4210   26.649   6.8026   28.430   10.125   25.184   9.1840   25.332   5.0804   23.874   4.8840 1.458141 7.047246 
1 1 1    6    3 -109 o   61.479   2.1554  155.656   10.785  154.533   12.755  158.472   20.202   61.125   2.5655   61.234   4.0704 -0.1083336 4.811422 
1 1 1    6    3 -108 o   12.026   4.9156   2.6502   7.6407  -8.3174   9.7348   20.248   12.331   10.219   4.7657   21.312   6.5040 -11.09230 8.063111 
1 1 1    6    3 -107 o   65.358   1.9087  175.334   10.158  173.738   12.941  177.895   16.396   64.913   2.4500   65.468   3.0810 -0.5553741 3.936412 
1 1 1    6    3 -106 o   32.168   3.2890   43.319   8.5029   47.861   10.373   34.016   14.845   33.672   3.8483   27.419   6.6999 6.253044 7.726410 
1 1 1    6    3 -105 o   47.931   2.3018   94.568   8.9669   93.595   11.270   96.247   14.802   47.540   2.9224   47.947   3.8188 -0.4070969 4.808730 
1 1 1    6    3 -104 o   48.567   2.4311   97.124   9.5939   92.528   11.283  109.124   18.230   47.289   2.9415   50.909   4.4373 -3.619663 5.323732 
1 1 1    6    3 -103 o   81.936   1.7387  274.622   11.613  281.200   15.002  264.788   18.342   82.787   2.2251   80.175   2.8110 2.612633 3.585042 
1 1 1    6    3 -102 o   88.521   1.6929  320.373   12.215  320.839   15.701  319.660   19.442   88.495   2.1766   88.167   2.7085 0.3277283 3.474660 
1 1 1    6    3 -101 o   25.499   4.7627   27.912   9.5356   17.796   13.606   37.676   13.368   20.793   6.8898   29.457   5.7737 -8.663565 8.989137 
1 1 1    6    3 -100 o   71.672   2.0158  210.288   11.765  217.974   16.074  201.419   17.267   72.843   2.7118   69.947   3.0356 2.895042 4.070476 
1 1 1    6    3  -99 o   69.264   2.2555  196.536   12.718  217.662   19.770  181.621   16.611   72.677   3.3461   66.433   3.0758 6.244339 4.544977 
1 1 1    6    3  -98 o   60.211   2.2390  148.500   10.970  134.735   14.657  166.032   16.542   57.205   3.1554   63.511   3.2056 -6.305454 4.498046 
1 1 1    6    3  -97 f  109.889   1.7932  493.219   16.063  488.376   22.100  498.643   23.387  109.242   2.4818  110.362   2.5997 -1.120461 3.594136 
1 1 1    6    3  -96 o   82.918   1.9916  280.898   13.461  278.538   18.290  283.688   19.884   82.439   2.7255   83.161   2.9378 -0.7222137 4.007410 
1 1 1    6    3  -95 o  105.884   1.8491  457.809   15.960  435.979   21.596  484.078   23.690  103.239   2.5662  108.769   2.6719 -5.529488 3.704680 
1 1 1    6    3  -94 o   73.882   2.0248  223.100   12.183  215.332   16.229  233.128   18.441   72.497   2.7512   75.401   3.0063 -2.903275 4.075184 
1 1 1    6    3  -93 o   45.754   2.3510   85.765   8.7389   84.615   12.941   86.728   11.849   45.299   3.5326   45.914   3.1856 -0.6146011 4.756783 
1 1 1    6    3  -92 o   80.974   1.6940  267.562   11.181  305.041   17.135  239.769   14.756   86.369   2.4363   76.573   2.3669 9.796722 3.396739 
1 1 1    6    3  -91 o   43.995   2.4923   79.333   8.9014   80.580   13.618   78.403   11.762   44.176   3.8193   43.639   3.3316 0.5368233 5.068223 
1 1 1    6    3  -90 o   97.704   1.5077  389.392   12.008  365.199   16.578  416.089   17.415   94.579   2.1503  100.957   2.1162 -6.377533 3.016978 
1 1 1    6    3  -89 o   79.231   1.6226  256.085   10.479  263.170   14.736  248.837   14.905   80.254   2.2548   78.028   2.3461 2.226082 3.253974 
1 1 1    6    3  -88 o  174.508   1.5403  1242.14   21.911  1231.16   30.583  1253.71   31.408  173.670   2.1603  175.249   2.1986 -1.579025 3.082333 
1 1 1    6    3  -87 o  155.878   1.4974  990.992   19.026  991.657   26.605  990.295   27.220  155.881   2.0938  155.769   2.1438 0.1119995 2.996621 
1 1 1    6    3  -86 o  198.399   1.6060  1605.45   25.972  1587.79   36.250  1624.08   37.231  197.236   2.2547  199.474   2.2897 -2.237442 3.213476 
1 1 1    6    3  -85 o  145.910   1.4691  868.195   17.473  881.714   24.569  854.363   24.853  147.002   2.0504  144.700   2.1070 2.302383 2.940018 
1 1 1    6    3  -84 o  115.217   1.5246  541.365   14.319  562.007   19.302  516.098   21.355  117.368   2.0175  112.453   2.3297 4.914650 3.081792 
1 1 1    6    3  -83 o  296.119   2.1490  3577.63   51.873  3606.16   68.840  3540.14   78.904  297.180   2.8417  294.355   3.2884 2.824768 4.346198 
1 1 1    6    3  -82 o   58.523   1.9971  139.870   9.5133  136.439   12.314  144.952   14.984   57.757   2.6223   59.496   3.1003 -1.738396 4.060525 
1 1 1    6    3  -81 o  172.399   1.6403  1212.00   23.051  1206.55   30.270  1219.53   35.564  171.977   2.1593  172.871   2.5238 -0.8941650 3.321404 
1 1 1    6    3  -80 f   89.161   1.6832  324.175   12.233  325.287   16.166  322.685   18.712   89.297   2.2209   88.887   2.5853 0.4096146 3.408292 
1 1 1    6    3  -79 o  118.748   1.6864  575.007   16.324  599.627   21.300  539.969   25.410  121.244   2.1552  115.027   2.7100 6.216721 3.462510 
1 1 1    6    3  -78 o  162.551   1.5257  1077.35   20.216  1101.25   28.760  1054.02   28.422  164.311   2.1473  160.747   2.1691 3.563248 3.052142 
1 1 1    6    3  -77 o  269.225   2.0213  2956.16   44.360  2953.42   58.438  2959.88   68.142  269.033   2.6647  269.271   3.1045 -0.2376404 4.091296 
1 1 1    6    3  -76 o   75.333   1.6845  231.401   10.344  225.086   13.421  240.640   16.234   74.252   2.2199   76.754   2.5984 -2.502090 3.417531 
1 1 1    6    3  -75 o  312.422   2.2167  3981.15   56.452  3988.02   74.580  3971.92   86.385  312.607   2.9268  311.906   3.3977 0.7008362 4.484426 
1 1 1    6    3  -74 o  267.967   2.1634  2928.59   47.255  2956.68   57.677  2871.23   82.417  269.206   2.6283  265.142   3.8133 4.063507 4.631370 
1 1 1    6    3  -73 o  375.366   2.7491  5748.72   84.116  5675.83  102.140  5902.33  148.288  372.883   3.3604  379.944   4.7879 -7.061646 5.849481 
1 1 1    6    3  -72 o  183.235   1.6028  1368.90   23.940  1362.53   31.737  1377.31   36.465  182.784   2.1301  183.755   2.4345 -0.9710693 3.234782 
1 1 1    6    3  -71 o   50.663   1.8869  104.805   7.7788  124.091   10.394   80.245   11.729   55.110   2.3188   44.220   3.2772 10.89014 4.014557 
1 1 1    6    3  -70 o   67.354   1.6001  184.957   8.7851  199.282   11.760  166.869   13.215   69.876   2.0669   63.910   2.5417 5.965775 3.276012 
1 1 1    6    3  -69 o  144.056   1.3967  846.000   16.401  864.523   23.184  827.441   23.206  145.608   1.9533  142.449   1.9985 3.158508 2.794499 
1 1 1    6    3  -68 o   89.123   1.4085  323.809   10.233  325.672   14.214  321.806   14.743   89.370   1.9512   88.836   2.0359 0.5338058 2.819950 
1 1 1    6    3  -67 o  138.026   1.3872  776.646   15.608  808.784   22.206  745.267   21.942  140.839   1.9342  135.193   1.9911 5.645096 2.775919 
1 1 1    6    3  -66 o  246.811   1.7553  2483.59   35.315  2494.22   49.875  2472.90   50.012  247.298   2.4741  246.237   2.4916 1.060471 3.511341 
1 1 1    6    3  -65 o  270.379   1.8616  2980.64   41.029  3051.72   58.791  2913.15   57.286  273.534   2.6367  267.252   2.6296 6.282135 3.723866 
1 1 1    6    3  -64 o  233.299   1.8088  2219.10   34.398  2274.26   52.936  2178.78   45.255  236.130   2.7502  231.141   2.4019 4.989258 3.651367 
1 1 1    6    3  -63 o   69.672   1.6101  197.896   9.1445  215.067   13.515  183.396   12.419   72.587   2.2870   67.024   2.2764 5.562485 3.226800 
1 1 1    6    3  -62 o   97.199   1.4648  385.138   11.605  402.465   17.328  371.042   15.629   99.350   2.1396   95.395   2.0099 3.954918 2.935538 
1 1 1    6    3  -61 o  181.843   1.5919  1348.02   23.596  1330.06   35.231  1362.62   31.775  180.602   2.3931  182.809   2.1323 -2.207016 3.205292 
1 1 1    6    3  -60 o  153.095   1.5098  955.455   18.841  967.493   28.357  945.942   25.210  154.039   2.2584  152.320   2.0304 1.719193 3.036927 
1 1 1    6    3  -59 o  161.833   1.4397  1067.60   18.993  1076.38   26.711  1058.62   27.011  162.484   2.0167  161.138   2.0564 1.346359 2.880265 
1 1 1    6    3  -58 f  313.896   2.2131  4017.25   56.628  3999.40   74.336  4041.92   87.410  313.159   2.9120  314.784   3.4065 -1.625641 4.481577 
1 1 1    6    3  -57 o  568.622   3.6555 13189.51  169.436 13216.27  224.252 13153.91  258.650  569.014   4.8348  567.525   5.5910 1.488647 7.391541 
1 1 1    6    3  -56 o  216.546   1.7448  1911.55   30.798  1907.49   40.322  1917.24   47.714  216.302   2.2869  216.841   2.6994 -0.5386200 3.537920 
1 1 1    6    3  -55 o  393.088   2.6427  6300.15   84.679  6323.73  112.072  6268.77  129.270  393.767   3.4916  392.008   4.0455 1.759216 5.343858 
1 1 1    6    3  -54 f  411.893   2.9662  6917.77   99.590  6850.16  120.779  7061.38  176.025  409.831   3.6153  415.957   5.1915 -6.125946 6.326285 
1 1 1    6    3  -53 o   26.988   3.4056   30.174   7.3256   33.081   9.2329   25.233   12.036   28.179   4.1431   24.384   6.0771 3.794724 7.355034 
1 1 1    6    3  -52 o  318.097   2.6539  4125.30   68.815  4139.06  108.984  4116.17   88.744  318.556   4.1970  317.714   3.4266 0.8422852 5.418190 
1 1 1    6    3  -51 o  147.713   1.8330  889.408   22.071  958.433   35.504  845.933   28.177  153.324   2.8407  144.051   2.3996 9.272812 3.718545 
1 1 1    6    3  -50 o  197.125   2.2166  1584.04   35.618  1565.60   50.808  1601.85   49.947  195.956   3.1808  198.214   3.0913 -2.257385 4.435461 
1 1 1    6    3  -49 o  135.103   2.3923  744.081   26.346  718.470   44.040  758.356   32.879  132.671   4.0771  136.386   2.9574 -3.714920 5.036759 
1 1 1    6    3  -48 o  346.442   3.6630  4893.78  103.444  4874.36  178.168  4903.65  127.052  345.613   6.3242  346.755   4.4949 -1.141632 7.758836 
1 1 1    6    3  -47 o  430.453   3.3727  7554.34  118.343  7791.45  191.424  7407.66  150.563  437.049   5.3732  426.209   4.3337 10.83978 6.903033 
1 1 1    6    3  -46 o  277.044   2.3915  3128.73   54.007  3173.26   85.817  3099.54   69.495  278.978   3.7737  275.735   3.0919 3.243011 4.878584 
1 1 1    6    3  -45 o  829.015   6.1618 28036.25  416.394 28216.31  661.721 27918.22  535.764  831.109   9.7675  827.021   7.9473 4.087097 12.59218 
1 1 1    6    3  -44 o  289.850   2.4717  3424.60   58.399  3543.81   94.211  3350.21   74.423  294.821   3.9202  286.672   3.1848 8.149841 5.050821 
1 1 1    6    3  -43 o  358.979   2.8920  5253.15   84.626  5206.84   94.074  5449.59  193.749  357.386   3.2292  365.501   6.5030 -8.115692 7.260640 
1 1 1    6    3  -42 o  619.205   4.6683 15633.62  235.630 15598.27  263.032 15777.23  530.208  618.472   5.2174  621.510   10.466 -3.038513 11.69396 
1 1 1    6    3  -41 o  695.566   4.3999 19725.94  249.469 19908.43  297.717 19295.75  457.103  698.724   5.2271  687.640   8.1549 11.08459 9.686316 
1 1 1    6    3  -40 o  312.497   2.1787  3980.47   55.499  3998.46   66.233  3938.07  101.689  313.197   2.5943  310.797   4.0139 2.399750 4.779279 
1 1 1    6    3  -39 o  329.155   2.1283  4416.11   57.103  4391.80   72.097  4457.05   93.539  328.240   2.6946  330.656   3.4704 -2.415924 4.393683 
1 1 1    6    3  -38 o  571.222   3.4237 13301.46  159.420 13043.50  198.434 13771.04  267.729  565.625   4.3038  581.122   5.6519 -15.49701 7.103957 
1 1 1    6    3  -37 o  497.002   2.8422 10068.82  115.144 10061.70  154.609 10077.68  172.540  496.801   3.8178  497.182   4.2573 -0.3803711 5.718451 
1 1 1    6    3  -36 o  544.696   3.0885 12094.23  137.133 11854.66  181.208 12415.32  209.786  539.244   4.1224  551.828   4.6638 -12.58423 6.224577 
1 1 1    6    3  -35 o  627.476   3.5186 16050.19  179.969 15962.67  240.619 16161.30  271.134  625.717   4.7175  629.572   5.2833 -3.854553 7.082945 
1 1 1    6    3  -34 o  128.652   1.3514  674.604   14.172  677.104   20.973  672.503   19.225  128.888   1.9963  128.450   1.8361 0.4380035 2.712283 
1 1 1    6    3  -33 o  229.735   1.6396  2151.18   30.705  2100.85   43.156  2202.78   43.696  227.027   2.3320  232.470   2.3059 -5.442780 3.279512 
1 1 1    6    3  -32 o  412.017   2.5453  6919.52   85.484  6879.09  120.675  6960.24  121.112  410.793   3.6038  413.210   3.5957 -2.416199 5.090788 
1 1 1    6    3  -31 o  605.919   3.6047 14966.18  178.043 14775.02  249.350 15165.02  254.305  601.984   5.0814  609.876   5.1154 -7.891785 7.210282 
1 1 1    6    3  -30 o  547.158   3.2777 12203.74  146.189 12257.65  207.818 12150.92  205.685  548.325   4.6495  545.934   4.6220 2.391479 6.555961 
1 1 1    6    3  -29 o  274.715   1.8333  3076.02   41.054  3144.13   59.280  3013.24   56.910  277.733   2.6184  271.891   2.5678 5.842041 3.667387 
1 1 1    6    3  -28 f  225.256   1.7187  2068.12   31.559  2058.85   48.955  2074.71   41.282  224.745   2.6722  225.612   2.2447 -0.8672180 3.489907 
1 1 1    6    3  -27 o  234.836   1.7499  2247.77   33.498  2224.60   51.127  2265.20   44.342  233.616   2.6848  235.741   2.3075 -2.124771 3.540135 
1 1 1    6    3  -26 o  323.726   2.2213  4271.56   58.616  4261.94   90.075  4278.63   77.199  323.347   3.4174  323.986   2.9231 -0.6386108 4.497054 
1 1 1    6    3  -25 o  330.677   2.2598  4456.99   60.914  4449.97   93.513  4462.17   80.283  330.402   3.4721  330.862   2.9768 -0.4592896 4.573455 
1 1 1    6    3  -24 o  431.167   3.0526  7577.87  107.288  7491.23  150.915  7666.39  152.555  428.671   4.3189  433.653   4.3157 -4.982666 6.105550 
1 1 1    6    3  -23 o  405.915   2.8964  6716.17   95.836  6803.88  137.600  6633.54  133.555  408.535   4.1319  403.390   4.0616 5.144928 5.793913 
1 1 1    6    3  -22 o  445.031   2.9029  8072.93  105.309  7965.90  138.096  8221.66  162.790  442.054   3.8324  449.080   4.4470 -7.026215 5.870541 
1 1 1    6    3  -21 o  457.838   3.2115  8544.48  119.855  8523.95  169.432  8565.04  169.571  457.259   4.5457  458.360   4.5385 -1.100891 6.423438 
1 1 1    6    3  -20 o  336.695   2.4672  4620.76   67.714  4653.52   96.522  4589.01   95.020  337.874   3.5046  335.524   3.4742 2.349731 4.934773 
1 1 1    6    3  -19 o  957.591   6.4525 37393.48  503.671 37829.97  719.939 36975.04  704.894  962.904   9.1723  951.971   9.0837 10.93274 12.90910 
1 1 1    6    3  -18 o  193.102   1.6775  1519.82   26.406  1496.90   37.310  1542.82   37.376  191.636   2.3884  194.554   2.3568 -2.917282 3.355448 
1 1 1    6    3  -17 o  847.690   4.9647 29296.83  343.056 29671.18  490.432 28938.16  480.044  852.948   7.0537  842.351   6.9912 10.59705 9.931376 
1 1 1    6    3  -16 o   35.364   1.7441   51.098   5.0123   53.362   7.5979   49.353   6.6694   36.089   2.6002   34.716   2.3710 1.372780 3.518932 
1 1 1    6    3  -15 o  581.086   3.4627 13764.44  164.019 13840.84  233.227 13689.67  230.708  582.648   4.9106  579.458   4.8843 3.189514 6.926105 
1 1 1    6    3  -14 o  364.603   2.2842  5418.50   67.889  5423.63   96.298  5413.42   95.723  364.762   3.2387  364.419   3.2224 0.3432312 4.568722 
1 1 1    6    3  -13 o  475.794   2.8830  9227.74  111.816  9505.41  162.219  8976.39  154.338  482.869   4.1213  469.242   4.0350 13.62692 5.767697 
1 1 1    6    3  -12 o  517.082   4.3983 10900.58  185.389 11033.53  264.778 10772.72  259.658  520.151   6.2448  513.969   6.1977 6.182190 8.798196 
1 1 1    6    3  -11 o  1016.93   6.8430 42178.90  567.249 42336.78  986.227 42100.85  693.430  1018.11   11.884  1015.81   8.3744 2.296692 14.53789 
1 1 1    6    3  -10 o  416.606   2.9549  7074.82  100.347  7147.45  175.343  7039.45  122.367  418.682   5.1377  415.549   3.6125 3.132416 6.280586 
1 1 1    6    3   -9 o  186.320   1.5182  1414.95   23.058  1379.31   34.672  1443.22   30.876  183.954   2.3122  188.170   2.0130 -4.215332 3.065683 
1 1 1    6    3   -8 o  105.972   1.2654  457.720   10.931  434.646   16.410  476.124   14.655  103.265   1.9495  108.080   1.6635 -4.815971 2.562722 
1 1 1    6    3   -7 o  122.708   1.2958  613.712   12.961  591.033   19.497  631.673   17.351  120.417   1.9862  124.490   1.7098 -4.072235 2.620792 
1 1 1    6    3   -6 f  792.252   5.3677 25594.12  346.644 25922.51  607.165 25435.32  422.220  796.931   9.3465  789.697   6.5591 7.234192 11.41835 
1 1 1    6    3   -5 o  222.498   1.6871  2017.81   30.599  2088.18   47.745  1968.76   39.861  226.337   2.5878  219.774   2.2250 6.563919 3.412862 
1 1 1    6    3   -4 o  313.452   2.3284  4004.86   59.493  4073.80   85.208  3939.29   83.104  316.123   3.3066  310.861   3.2796 5.262512 4.657219 
1 1 1    6    3   -3 o  386.345   2.7671  6084.34   87.143  6067.33  122.955  6101.51  123.526  385.779   3.9100  386.864   3.9171 -1.085052 5.534554 
1 1 1    6    3   -2 o  369.141   2.6618  5554.48   80.094  5534.95  112.957  5574.24  113.585  368.469   3.7608  369.774   3.7683 -1.305298 5.323881 
1 1 1    6    3   -1 o  324.276   2.3925  4286.25   63.241  4186.02   87.830  4394.17   91.135  320.446   3.3624  328.316   3.4053 -7.869812 4.785604 
1 1 1    6    3    0 o  309.419   2.1335  3902.41   53.811  4006.00   83.775  3829.66   70.210  313.481   3.2784  306.512   2.8100 6.969513 4.317915 
1 1 1    6    3    1 o  219.919   1.6715  1971.30   29.964  1951.66   45.493  1986.35   39.823  218.814   2.5505  220.753   2.2131 -1.939041 3.376813 
1 1 1    6    3    2 o  301.623   2.0906  3708.23   51.402  3654.19   77.693  3750.30   68.549  299.402   3.1834  303.320   2.7724 -3.918213 4.221439 
1 1 1    6    3    3 o  321.235   2.3753  4206.24   62.198  4134.39   86.924  4281.63   89.037  318.465   3.3484  324.085   3.3703 -5.620667 4.750915 
1 1 1    6    3    4 o  491.078   3.4223  9830.90  136.997  9833.33  193.825  9828.47  193.659  491.090   4.8419  490.968   4.8389 0.1213074 6.845359 
1 1 1    6    3    5 o   39.889   1.9994   65.019   6.4805   63.030   8.3165   68.093   10.340   39.236   2.6152   40.750   3.1370 -1.514355 4.084126 
1 1 1    6    3    6 f  190.194   1.8184  1474.43   28.192  1478.34   36.510  1468.66   44.368  190.443   2.3518  189.814   2.8675 0.6289368 3.708607 
1 1 1    6    3    7 o  372.899   2.9446  5668.27   89.505  5884.66  145.702  5537.12  113.430  379.909   4.7049  368.543   3.7758 11.36545 6.032630 
1 1 1    6    3    8 o  449.603   3.1630  8240.11  115.920  8104.11  161.842  8383.39  166.112  445.841   4.4532  453.457   4.4939 -7.615753 6.326676 
1 1 1    6    3    9 o  473.308   3.3109  9132.06  127.738  9131.26  180.632  9132.85  180.666  473.246   4.6824  473.288   4.6829 -0.4110718E-01 6.622292 
1 1 1    6    3   10 o  596.029   4.0938 14482.81  198.897 14493.33  281.509 14472.33  281.057  596.168   5.7928  595.736   5.7877 0.4318848 8.188621 
1 1 1    6    3   11 o  836.953   5.6586 28563.95  386.053 28536.93  545.513 28591.06  546.410  836.355   8.0016  837.148   8.0072 -0.7922363 11.31995 
1 1 1    6    3   12 o  565.748   3.9008 13048.16  179.892 13082.63  254.906 13013.95  253.908  566.431   5.5208  564.942   5.5136 1.488586 7.802477 
1 1 1    6    3   13 o  233.462   2.0608  2221.60   39.218  2233.24   50.791  2204.42   61.719  234.068   2.6620  232.547   3.2559 1.521271 4.205617 
1 1 1    6    3   14 o  272.652   2.0961  3030.06   46.586  3071.59   66.510  2990.07   65.273  274.506   2.9723  270.839   2.9566 3.667053 4.192386 
1 1 1    6    3   15 o  304.850   2.2796  3787.99   56.648  3752.85   79.678  3823.90   80.554  303.422   3.2215  306.280   3.2265 -2.858521 4.559431 
1 1 1    6    3   16 o  644.713   4.8293 16946.28  253.799 17399.67  410.522 16665.77  322.903  653.122   7.7109  639.290   6.1964 13.83203 9.892092 
1 1 1    6    3   17 o  256.387   2.1934  2679.31   45.841  2661.85   58.982  2705.96   72.850  255.544   2.8315  257.646   3.4687 -2.101868 4.477654 
1 1 1    6    3   18 o  494.626   4.2164  9973.77  170.000  9908.11  239.003 10041.02  241.855  492.939   5.9481  496.233   5.9791 -3.294098 8.433784 
1 1 1    6    3   19 o  326.911   2.9467  4356.25   78.525  4277.09  109.390  4440.41  112.791  323.909   4.1430  330.035   4.1926 -6.125305 5.894236 
1 1 1    6    3   20 o  281.623   2.6233  3232.81   60.221  3146.19   83.518  3326.62   86.914  277.813   3.6880  285.667   3.7324 -7.854218 5.247142 
1 1 1    6    3   21 o  379.676   3.3361  5876.13  103.249  5853.29  145.556  5899.26  146.480  378.911   4.7126  380.396   4.7240 -1.484802 6.672630 
1 1 1    6    3   22 o  554.212   4.7020 12522.05  212.420 13789.77  324.748 11574.05  280.829  581.500   6.8511  532.755   6.4666 48.74506 9.420982 
1 1 1    6    3   23 o  187.741   1.8189  1436.63   27.836  1443.78   44.496  1432.03   35.679  188.202   2.9004  187.438   2.3352 0.7636719 3.723666 
1 1 1    6    3   24 o  376.345   2.9711  5773.30   91.146  5789.65  144.732  5762.56  117.337  376.846   4.7115  375.980   3.8285 0.8654480 6.070940 
1 1 1    6    3   25 o  487.236   3.7279  9677.40  148.059  9774.50  236.324  9614.66  189.961  489.610   5.9214  485.626   4.7987 3.983551 7.621701 
1 1 1    6    3   26 o  456.589   3.5177  8498.13  130.923  8653.75  210.355  8399.73  167.269  460.696   5.6015  453.915   4.5207 6.781006 7.198140 
1 1 1    6    3   27 o  549.714   4.1644 12318.99  186.606 12054.87  290.015 12505.60  243.770  543.702   6.5437  553.821   5.3998 -10.11890 8.483954 
1 1 1    6    3   28 f  570.780   4.3126 13281.51  200.652 13058.43  313.111 13436.95  261.376  565.867   6.7881  574.065   5.5856 -8.197449 8.790732 
1 1 1    6    3   29 o  258.084   2.2268  2714.92   46.846  2755.28   75.284  2689.42   59.843  259.983   3.5524  256.864   2.8581 3.118896 4.559401 
1 1 1    6    3   30 o  231.087   2.6606  2176.70   50.117   0.0000   0.0000  2176.70   50.117  ?   ?   231.087   2.6606 0.000000 2.660586 
1 1 1    6    3   31 o  514.653   3.9232 10797.56  164.583 10811.94  260.918 10788.06  212.103  514.915   6.2163  514.391   5.0585 0.5234985 8.014393 
1 1 1    6    3   32 o  521.619   3.9760 11091.93  169.056 11330.87  272.427 10942.29  215.588  527.118   6.3402  518.051   5.1052 9.066895 8.140143 
1 1 1    6    3   33 o  877.636   6.5006 31411.85  465.051 31439.97  736.289 31393.19  599.847  877.634   10.292  877.201   8.3889 0.4334106 13.27775 
1 1 1    6    3   34 o  769.775   5.7301 24162.38  359.551 24310.85  571.871 24065.33  462.369  771.859   9.0892  768.107   7.3847 3.751892 11.71095 
1 1 1    6    3   35 o  411.494   3.2321  6902.40  108.415  6987.81  173.680  6847.87  138.772  413.983   5.1467  409.844   4.1538 4.138275 6.613845 
1 1 1    6    3   36 o  609.531   4.5985 15147.37  228.479 15464.44  368.177 14948.80  291.370  615.723   7.3356  605.458   5.9037 10.26453 9.416194 
1 1 1    6    3   37 o  196.653   2.0253  1576.29   32.465  1613.34   42.794  1526.05   49.831  198.946   2.6388  193.485   3.1595 5.461334 4.116505 
1 1 1    6    3   38 o  126.247   1.6521  649.632   17.002  685.159   25.875  622.636   22.555  129.650   2.4483  123.594   2.2387 6.055992 3.317547 
1 1 1    6    3   39 o  775.418   5.7786 24520.21  365.254 24944.25  479.056 23931.45  564.487  781.941   7.5158  765.738   9.0435 16.20325 11.75895 
1 1 1    6    3   40 o  653.584   4.9127 17417.87  261.733 17532.93  340.422 17251.53  409.320  655.644   6.3696  650.252   7.7223 5.392639 10.01028 
1 1 1    6    3   41 o  199.697   1.9619  1625.48   31.937  1617.18   42.120  1636.72   48.984  199.181   2.5942  200.377   2.9990 -1.195541 3.965285 
1 1 1    6    3   42 o  316.055   2.9171  4071.96   75.154  4080.50  107.920  4063.92  104.720  316.358   4.1849  315.718   4.0691 0.6405334 5.837006 
1 1 1    6    3   43 o  373.884   2.9823  5698.50   90.891  5892.86  148.624  5582.38  114.876  380.151   4.7962  370.034   3.8085 10.11734 6.124371 
1 1 1    6    3   44 o  195.857   1.9246  1563.57   30.727  1621.57   51.208  1530.94   38.411  199.442   3.1498  193.797   2.4315 5.645065 3.979117 
1 1 1    6    3   45 o  624.371   4.2897 15895.71  218.327 15940.91  309.842 15851.15  307.690  625.120   6.0805  623.360   6.0553 1.760132 8.581361 
1 1 1    6    3   46 o  409.006   2.9287  6819.64   97.644  6947.88  140.565  6700.04  135.741  412.787   4.1775  405.361   4.1080 7.426361 5.858938 
1 1 1    6    3   47 o  409.912   2.7178  6849.78   90.811  6796.01  119.643  6922.86  139.480  408.268   3.5951  412.036   4.1528 -3.767487 5.492739 
1 1 1    6    3   48 o  429.564   2.8314  7522.59   99.143  7432.10  130.191  7647.50  152.965  426.933   3.7410  433.044   4.3333 -6.111084 5.724757 
1 1 1    6    3   49 o  507.622   3.5473 10506.74  146.783 10752.72  211.932 10279.96  203.490  513.419   5.0639  502.013   4.9727 11.40594 7.097260 
1 1 1    6    3   50 o  385.656   2.4115  6063.13   75.809  6089.98  108.186  6037.23  106.261  386.468   3.4342  384.793   3.3877 1.675232 4.823937 
1 1 1    6    3   51 o  531.799   3.2014 11531.19  138.779 11481.71  195.818 11581.13  196.710  530.551   4.5278  532.843   4.5289 -2.291931 6.404050 
1 1 1    6    3   52 o  279.425   1.8679  3182.74   42.546  3174.38   60.619  3190.87   59.728  279.036   2.6651  279.762   2.6191 -0.7253723 3.736645 
1 1 1    6    3   53 o  351.206   2.3918  5028.56   68.472  5102.05   91.789  4936.35  102.814  353.727   3.1834  347.911   3.6253 5.815430 4.824615 
1 1 1    6    3   54 f  282.297   2.0216  3248.69   46.519  3228.59   61.562  3275.44   71.023  281.401   2.6838  283.419   3.0742 -2.018250 4.080891 
1 1 1    6    3   55 o   66.691   1.6346  181.305   8.8864  186.409   11.410  173.434   14.168   67.589   2.0734   65.165   2.6729 2.423729 3.382771 
1 1 1    6    3   56 o  200.971   1.7914  1646.48   29.347  1728.84   36.808  1502.78   48.620  205.926   2.1928  191.964   3.1071 13.96236 3.802966 
1 1 1    6    3   57 o  384.421   2.4107  6025.36   75.542  6167.05  125.565  5944.98   94.571  388.790   3.9620  381.806   3.0386 6.984406 4.993089 
1 1 1    6    3   58 f  247.267   1.7210  2492.46   34.689  2510.87   57.183  2481.74   43.634  248.134   2.8271  246.719   2.1696 1.415024 3.563699 
1 1 1    6    3   59 o  327.565   2.4581  4375.22   65.636  4392.63   92.668  4357.70   92.979  328.141   3.4644  326.831   3.4900 1.309662 4.917556 
1 1 1    6    3   60 o  109.397   1.5606  487.867   13.917  481.505   18.922  495.362   20.540  108.672   2.1361  110.221   2.2861 -1.549568 3.128763 
1 1 1    6    3   61 o  139.458   1.7094  792.870   19.432  763.190   28.807  817.653   26.323  136.800   2.5833  141.606   2.2804 -4.806152 3.445877 
1 1 1    6    3   62 o  159.685   1.6299  1039.53   21.215  1057.30   29.687  1020.99   30.330  161.025   2.2617  158.233   2.3514 2.792084 3.262595 
1 1 1    6    3   63 o  219.419   1.8739  1962.92   33.516  1950.31   46.699  1976.31   48.131  218.677   2.6198  220.127   2.6823 -1.449265 3.749435 
1 1 1    6    3   64 o  175.538   1.5639  1256.19   22.377  1273.31   29.584  1233.31   34.210  176.714   2.0538  173.902   2.4133 2.811356 3.168928 
1 1 1    6    3   65 o   67.062   1.7271  183.477   9.4335  196.221   11.395  155.722   16.817   69.341   2.0182   61.685   3.3572 7.656933 3.917115 
1 1 1    6    3   66 o  125.524   1.5465  642.351   15.823  637.839   19.163  652.021   28.052  125.075   1.8796  126.431   2.7219 -1.356277 3.307811 
1 1 1    6    3   67 o  192.298   1.7502  1507.66   27.434  1532.83   33.782  1458.92   47.014  193.880   2.1376  189.097   3.0501 4.782867 3.724517 
1 1 1    6    3   68 o  110.297   1.5363  495.967   13.813  489.651   16.659  509.861   24.709  109.585   1.8649  111.798   2.7113 -2.213234 3.290787 
1 1 1    6    3   69 o  165.507   1.5339  1116.76   20.694  1126.98   27.282  1102.92   31.756  166.245   2.0132  164.445   2.3690 1.800247 3.108892 
1 1 1    6    3   70 o   9.9752   4.2680  -0.3234   6.1712  -1.7250   7.8941   1.8793   9.8962   10.834   4.7307   13.414   5.5501 -2.579502 7.292668 
1 1 1    6    3   71 o  115.866   1.4407  547.313   13.607  567.463   17.982  520.313   20.814  117.969   1.8699  112.950   2.2607 5.019012 2.933815 
1 1 1    6    3   72 o   73.137   1.5705  218.087   9.3628  218.217   12.099  217.891   14.782   73.123   2.0318   73.044   2.4863 0.7868195E-01 3.210914 
1 1 1    6    3   73 o  104.662   1.4543  446.589   12.408  444.806   16.098  449.198   19.473  104.442   1.8909  104.945   2.2764 -0.5026398 2.959279 
1 1 1    6    3   74 o  139.740   1.4797  796.135   16.855  793.859   22.017  799.357   26.197  139.525   1.9358  139.992   2.2957 -0.4670563 3.002949 
1 1 1    6    3   75 o   36.583   2.4653   54.841   7.3085   60.052   9.4132   46.933   11.597   38.238   3.0451   33.612   4.3333 4.625896 5.296244 
1 1 1    6    3   76 o  133.712   1.4917  728.953   16.259  711.643   21.141  754.017   25.440  132.098   1.9633  135.959   2.2954 -3.860855 3.020537 
1 1 1    6    3   77 o   43.651   2.3314   77.950   8.2657   87.314   10.617   63.538   13.171   46.168   2.8347   39.206   4.1859 6.961624 5.055427 
1 1 1    6    3   78 o   99.495   1.5993  403.649   12.971  398.890   16.938  410.399   20.170   98.891   2.1012  100.293   2.4671 -1.401917 3.240600 
1 1 1    6    3   79 o   50.901   2.5797  105.992   10.669   90.820   12.602  144.376   20.045   47.044   3.3073   59.281   4.1748 -12.23695 5.326043 
1 1 1    6    3   80 f   85.426   1.8142  297.610   12.633  300.470   15.200  291.223   22.716   85.797   2.1752   84.381   3.3090 1.415810 3.959900 
1 1 1    6    3   81 o   89.909   1.8917  329.696   13.864  323.561   15.205  359.953   33.766   89.061   2.0944   93.693   4.4338 -4.631790 4.903557 
1 1 1    6    3   82 o  148.731   1.5476  902.050   18.763  938.770   24.906  853.867   28.530  151.702   2.0141  144.652   2.4196 7.049988 3.148221 
1 1 1    6    3   83 o   75.492   1.8220  232.454   11.212  217.600   15.743  247.742   15.972   72.961   2.6514   77.868   2.5196 -4.906136 3.657608 
1 1 1    6    3   84 o  132.566   1.5158  716.661   16.380  734.522   21.696  692.984   24.980  134.180   1.9836  130.306   2.3517 3.874756 3.076578 
1 1 1    6    3   85 o  143.775   1.6605  843.108   19.461  831.600   27.251  855.084   27.800  142.740   2.3421  144.740   2.3563 -2.000198 3.322284 
1 1 1    6    3   86 o  124.998   1.6457  637.289   16.768  644.638   23.732  629.962   23.695  125.670   2.3167  124.229   2.3399 1.440544 3.292725 
1 1 1    6    3   87 o   78.967   1.8103  254.402   11.653  276.628   16.597  232.793   16.365   82.272   2.4777   75.449   2.6651 6.823013 3.638909 
1 1 1    6    3   88 o   47.880   2.7595   93.976   10.725   76.791   17.394  104.517   13.622   42.938   5.0670   50.440   3.3318 -7.502193 6.064216 
1 1 1    6    3   89 o  168.584   1.7501  1159.57   24.049  1152.56   33.974  1166.61   34.049  167.985   2.4810  169.007   2.4715 -1.022415 3.501983 
1 1 1    6    3   90 o  102.953   1.6940  432.450   14.216  424.010   20.069  440.949   20.140  101.888   2.4164  103.907   2.3779 -2.018768 3.390154 
1 1 1    6    3   91 o   56.363   2.1885  129.917   10.036  129.732   14.236  130.100   14.150   56.226   3.1184   56.309   3.0947 -0.8277512E-01 4.393352 
1 1 1    6    3   92 o   94.887   1.7420  367.429   13.473  368.033   19.194  366.843   18.918   94.869   2.4842   94.720   2.4522 0.1496735 3.490605 
1 1 1    6    3   93 o   74.908   1.9135  229.233   11.675  226.167   16.693  232.169   16.334   74.312   2.7606   75.305   2.6651 -0.9931641 3.837108 
1 1 1    6    3   94 o  148.111   1.8954  895.701   22.883  897.252   36.100  894.659   29.587  148.042   2.9915  147.936   2.4535 0.1061554 3.868962 
1 1 1    6    3   95 o   17.862   5.4814   13.243   8.7428   5.0344   11.783   23.298   13.041   15.436   6.1775   23.312   6.5780 -7.875863 9.023933 
1 1 1    6    3   96 o   17.081   5.3270   12.028   8.2187   2.3566   10.681   26.062   12.867   13.931   5.7653   24.535   6.3763 -10.60395 8.596234 
1 1 1    6    3   97 f  109.114   1.7053  486.188   15.167  492.371   21.273  479.797   21.631  109.705   2.3789  108.283   2.4506 1.422241 3.415328 
1 1 1    6    3   98 o  105.133   1.6960  451.428   14.535  436.953   20.353  466.493   20.763  103.323   2.4165  106.764   2.3858 -3.441071 3.395812 
1 1 1    6    3   99 o   52.871   2.2533  114.600   9.6889  103.738   13.692  125.493   13.712   50.112   3.3715   55.199   3.0595 -5.086861 4.552718 
1 1 1    6    3  100 o   94.873   1.7050  367.804   13.186  373.284   18.546  362.203   18.751   95.459   2.3834   93.987   2.4496 1.472275 3.417790 
1 1 1    6    3  101 o   13.323   4.9313   5.8698   7.1011   12.023   9.3504  -2.5149   10.915   17.254   5.7114   12.525   5.5131 4.728309 7.938143 
1 1 1    6    3  102 o  115.002   1.5449  540.437   14.482  538.452   19.002  543.188   22.368  114.681   2.0327  115.087   2.3843 -0.4060440 3.133196 
1 1 1    6    3  103 o   34.692   2.7468   49.798   7.7042   51.585   10.182   47.404   11.783   35.127   3.6072   33.442   4.4314 1.684982 5.713979 
1 1 1    6    3  104 o   13.811   4.9811   6.8536   7.1755   12.990   9.5989  -0.9179   10.803   17.700   5.7831   12.833   5.5696 4.867198 8.028991 
1 1 1    6    3  105 o   69.678   2.0459  199.250   11.607  191.530   15.144  210.245   18.072   68.129   2.7325   71.255   3.1190 -3.125397 4.146642 
1 1 1    6    3  106 o   23.229   4.1663   23.226   7.5990   22.704   9.5334   24.135   12.584   22.684   5.2585   23.205   6.4307 -0.5213871 8.306964 
1 1 1    6    3  107 o   23.508   4.1408   23.804   7.6451   28.592   9.5868   15.441   12.670   25.625   4.7649   19.319   6.6482 6.306292 8.179403 
1 1 1    6    3  108 o   17.505   4.9801   13.416   7.4438  -0.9945   10.042   30.987   11.089   12.255   5.3437   26.476   5.3230 -14.22111 7.542544 
1 1 1    6    3  109 o   49.600   2.3466  101.587   9.4610  106.273   12.139   94.336   15.100   50.543   2.9594   47.230   3.9584 3.312748 4.942347 
1 1 1    6    3  110 o   35.116   3.2586   51.800   9.2212   55.084   11.329   45.353   15.872   35.987   3.9256   31.560   6.3892 4.426865 7.498802 
1 1 1    6    3  111 o   62.795   1.9527  162.253   9.9829  168.528   13.963  155.693   14.278   63.728   2.6941   61.174   2.8712 2.553528 3.937262 
1 1 1    6    3  112 o   53.515   2.1554  118.196   9.3833  113.246   11.598  127.576   15.966   52.181   2.7361   55.009   3.5800 -2.828197 4.505846 
1 1 1    6    3  113 o   37.377   2.7514   58.310   8.3242   57.503   10.405   59.744   13.874   36.850   3.5061   37.034   4.7018 -0.1839027 5.865111 
1 1 1    6    3  114 o   28.440   4.7160   35.662   10.550   31.019   11.816   53.908   23.423   26.048   5.7219   32.641   8.6611 -6.593384 10.38049 
1 1 1    6    3  115 o   36.132   3.3381   55.307   9.7205   55.924   10.679   52.324   23.473   36.193   3.6704   31.894   8.7610 4.299845 9.498789 
1 1 1    6    3  116 f   80.532   1.8427  267.093   12.096  269.306   14.983  262.949   20.500   80.611   2.2824   79.034   3.1885 1.577034 3.921263 
1 1 1    6    3  117 o   38.831   2.8153   63.385   8.8507   63.007   11.173   64.022   14.502   38.340   3.6178   37.974   4.7914 0.3665657 6.003810 
1 1 1    6    3  118 o   21.407   4.8195   20.923   8.2067   9.4261   10.265   41.287   13.662   15.616   5.8984   29.666   5.8576 -14.04999 8.312807 
1 1 1    6    3  119 o   8.1189   3.9053 -10.1248   7.5894   1.2363   9.7210 -27.8599   12.145   12.361   5.3237   8.6719   4.3194 3.689042 6.855586 
1 1 1    6    3  120 o   24.814   4.0904   27.430   7.9856   22.647   10.251   34.810   12.735   21.706   5.7161   26.857   5.9716 -5.151299 8.266434 
1 1 1    6    3  121 o   24.690   4.2929   27.506   8.3265   24.370   11.946   30.469   11.612   22.107   6.3152   25.094   5.7940 -2.986927 8.570404 
1 1 1    6    3  122 o   27.237   3.9655   33.091   8.5458   26.492   12.065   39.734   12.106   22.913   6.2761   28.965   5.3235 -6.051998 8.229736 
1 1 1    6    3  123 o   12.388   5.0852   4.1321   8.2207   3.6172   11.660   4.6411   11.592   13.665   5.8570   13.939   5.9026 -0.2747078 8.315349 
1 1 1    6    3  124 o   23.248   4.7251   25.397   8.6489   26.213   10.459   23.632   15.381   23.019   5.6231   20.846   7.3160 2.173027 9.227253 
1 1 1    6    3  125 o   16.145   5.5368   12.391   8.7859   8.4068   10.513   21.615   15.997   14.733   5.8555   20.000   7.4018 -5.266431 9.437827 
1 1 1    6    3  126 o   28.951   4.5370   38.900   10.356   27.586   13.092   57.808   16.925   22.693   6.6502   33.525   6.4273 -10.83109 9.248487 
1 1 1    6    3  127 o   13.647   5.5647   6.3075   9.7629   12.540   12.580  -3.1296   15.480   16.516   6.4537   13.362   6.1535 3.154376 8.917124 
1 1 1    6    3  128 o   16.296   5.8799   12.851   10.000   9.7787   12.769   17.724   16.081   15.576   6.3593   18.455   7.2710 -2.879032 9.659625 
1 1 1    6    3  129 f   39.234   4.0014   69.742   12.618   71.050   17.919   68.455   17.771   37.318   6.1013   36.515   6.1916 0.8027916 8.692610 
1 1 1    6    3  130 o   14.099   5.8907   6.5623   11.304  -8.9432   15.680   23.337   16.309   12.348   5.8478   20.072   7.4651 -7.724253 9.482846 
1 1 1    6    3  131 o   11.854   5.3673  -1.3060   11.148  -2.7594   15.654   0.1895   15.880   13.317   6.1524   13.934   6.3473 -0.6175966 8.839643 
1 1 1    6    3  132 o   13.352   5.5120   5.9918   9.7302   10.936   12.567  -1.4080   15.374   15.703   6.3463   13.421   6.1628 2.282057 8.846254 
1 1 1    6    3  133 o   23.384   5.4345   27.740   10.161   26.209   12.786   30.363   16.742   21.605   6.6284   22.144   7.6411 -0.5385437 10.11541 
1 1 1    6    3  134 o   9.9287   4.6831  -6.9770   9.8682 -14.2363   12.442   5.3334   16.202   10.081   4.8858   14.940   6.6393 -4.858956 8.243282 
1 1 1    6    3  135 o   15.802   6.0714   11.941   10.993   5.8261   14.841   19.376   16.365   14.747   6.4617   18.589   7.3314 -3.842456 9.772569 
1 1 1    6    4 -134 o   14.015   5.7328   7.4338   10.401   14.355   13.245  -3.7004   16.799   16.859   6.6118   13.435   6.2636 3.424909 9.107587 
1 1 1    6    4 -133 o   21.127   5.7428   23.372   10.147   14.610   12.747   38.529   16.765   16.887   6.5246   25.163   7.5638 -8.276489 9.989102 
1 1 1    6    4 -132 o   19.378   5.7892   19.781   9.8440   25.798   12.510   9.9991   15.952   21.469   6.5509   15.926   6.8390 5.542789 9.470245 
1 1 1    6    4 -131 o   15.474   5.8137   11.410   9.9428   9.6335   12.564   14.387   16.264   15.261   6.2779   17.172   7.1111 -1.911497 9.485744 
1 1 1    6    4 -130 o   15.910   5.8903   12.282   10.133   29.864   12.997 -14.9726   16.181   23.299   6.5641   11.664   5.6332 11.63538 8.649913 
1 1 1    6    4 -129 o   28.200   4.5345   37.448   10.070   40.223   12.587   32.511   16.786   28.226   5.6677   23.178   7.6516 5.047318 9.522075 
1 1 1    6    4 -128 o   31.406   4.0495   45.011   10.126   26.986   12.479   79.757   17.326   22.321   6.4789   40.375   5.3996 -18.05444 8.433977 
1 1 1    6    4 -127 f   19.221   6.1206   19.316   10.797   15.169   14.421   24.605   16.287   17.516   6.8901   20.650   7.4965 -3.133875 10.18193 
1 1 1    6    4 -126 o   9.7889   4.6964 -11.3164   10.815  -0.0030   15.624 -21.7224   14.984   13.978   6.3390   10.473   5.1376 3.504303 8.159566 
1 1 1    6    4 -125 o   28.509   5.1917   39.176   11.620   29.635   16.327   48.970   16.542   22.674   7.5485   30.258   6.8650 -7.584005 10.20337 
1 1 1    6    4 -124 o   17.779   5.4480   15.556   8.6407   16.773   10.394   12.834   15.546   18.245   6.0209   17.182   7.0162 1.062447 9.245468 
1 1 1    6    4 -123 o   10.726   4.7891  -1.1610   8.5327  -2.2311   10.255   1.2468   15.382   11.390   5.1535   14.329   6.4116 -2.938853 8.226054 
1 1 1    6    4 -122 o   12.555   5.2027   4.0475   8.7136   2.5353   10.546   7.3013   15.469   12.863   5.5426   15.835   6.7658 -2.972013 8.746272 
1 1 1    6    4 -121 o   44.029   2.7486   82.334   9.8157   74.021   11.952   99.554   17.203   41.152   3.5993   46.846   4.5627 -5.693687 5.811482 
1 1 1    6    4 -120 o   25.782   4.4691   30.234   9.0522   33.142   11.010   24.167   15.902   26.505   5.2815   21.503   7.4457 5.002214 9.128706 
1 1 1    6    4 -119 o   62.317   2.4233  162.580   12.286  137.063   15.506  205.621   20.138   56.504   3.3821   69.024   3.5916 -12.51981 4.933346 
1 1 1    6    4 -118 o   36.195   2.9762   55.661   8.7036   50.900   13.360   59.172   11.472   33.367   5.0713   36.818   3.8809 -3.451191 6.385849 
1 1 1    6    4 -117 o   8.3201   3.9578  -8.2517   7.3404   1.9464   11.584 -15.0931   9.4883   13.524   5.8181   8.6329   4.2030 4.891397 7.177383 
1 1 1    6    4 -116 f   25.857   3.7829   29.099   7.7374   13.248   11.843   40.904   10.220   17.599   6.3920   30.519   4.2211 -12.92018 7.659952 
1 1 1    6    4 -115 o   45.301   2.5717   85.663   9.4573   68.431   16.353   94.323   11.593   39.020   5.2763   47.334   3.0203 -8.313427 6.079598 
1 1 1    6    4 -114 o   30.578   3.2163   39.656   7.8968   26.623   11.838   50.106   10.600   23.857   6.0726   34.125   3.8794 -10.26830 7.205971 
1 1 1    6    4 -113 o   50.679   2.0533  106.060   8.4648  107.992   11.767  103.989   12.186   50.835   2.8511   49.809   3.0155 1.026630 4.149914 
1 1 1    6    4 -112 o   30.976   2.9924   40.351   7.4618   39.549   10.367   41.213   10.748   30.166   4.3410   30.775   4.4103 -0.6091442 6.188296 
1 1 1    6    4 -111 o   13.462   5.0358   6.3022   7.4428   4.2019   9.4389   9.7546   12.102   13.517   5.4866   16.663   6.3782 -3.145687 8.413349 
1 1 1    6    4 -110 o   56.670   2.2682  132.666   10.457  138.657   12.281  116.872   19.940   57.812   2.6128   52.012   4.7556 5.800083 5.426084 
1 1 1    6    4 -109 f   43.385   2.6418   78.166   9.2985   75.250   10.901   85.956   17.817   42.389   3.1779   44.484   4.9999 -2.094902 5.924375 
1 1 1    6    4 -108 o   31.696   3.0368   42.084   7.7504   35.890   9.8749   52.020   12.507   28.839   4.3347   34.746   4.5232 -5.907406 6.264836 
1 1 1    6    4 -107 o   48.189   2.2060   95.724   8.6425  105.900   11.092   80.001   13.788   50.551   2.7016   43.502   3.9305 7.049129 4.769456 
1 1 1    6    4 -106 o   31.742   3.0613   42.115   7.8226   43.575   9.8115   39.566   12.960   32.073   3.8283   29.953   5.5110 2.119732 6.710194 
1 1 1    6    4 -105 o   97.078   1.5602  385.657   12.346  401.150   16.602  366.490   18.466   98.860   2.0602   94.344   2.4031 4.516342 3.165324 
1 1 1    6    4 -104 o   65.192   1.7901  174.199   9.5039  168.968   12.639  181.006   14.417   64.054   2.4250   66.226   2.6762 -2.171822 3.611450 
1 1 1    6    4 -103 o   81.659   1.6299  272.790   10.849  265.823   14.471  281.733   16.395   80.455   2.2086   82.764   2.4328 -2.308533 3.285855 
1 1 1    6    4 -102 o   15.696   4.9729   10.249   7.1348   6.6758   9.3661   15.188   11.013   14.717   5.6166   19.049   6.1926 -4.332641 8.360233 
1 1 1    6    4 -101 o   13.369   5.1162   5.3063   7.7857   4.0190   11.084   6.5601   10.939   14.571   5.9338   15.410   6.0189 -0.8395672 8.452095 
1 1 1    6    4 -100 o   77.472   1.7832  245.439   11.261  271.173   16.248  221.650   15.622   81.274   2.4553   73.436   2.6139 7.838684 3.586232 
1 1 1    6    4  -99 o   49.108   2.1483   98.908   8.5789  104.019   11.608   92.756   12.735   50.247   2.8456   47.345   3.3210 2.901863 4.373356 
1 1 1    6    4  -98 o  105.914   1.5568  458.162   13.441  456.476   18.064  460.254   20.118  105.630   2.0979  106.020   2.3279 -0.3899918 3.133716 
1 1 1    6    4  -97 o   57.251   1.9519  134.139   9.0959  143.233   12.402  123.553   13.381   59.074   2.5818   54.786   3.0078 4.287701 3.963859 
1 1 1    6    4  -96 o   93.361   1.6209  355.908   12.336  375.177   16.746  333.049   18.240   95.788   2.1447   90.167   2.4840 5.621399 3.281821 
1 1 1    6    4  -95 o   46.074   2.5678   87.155   9.6058   83.363   13.803   90.716   13.377   44.858   3.8107   46.860   3.5278 -2.001755 5.192984 
1 1 1    6    4  -94 o   25.920   4.4159   28.443   8.9959   23.204   13.114   33.099   12.363   23.256   6.6081   27.755   5.6568 -4.498966 8.698646 
1 1 1    6    4  -93 o   39.787   2.8733   65.137   9.2560   58.032   13.521   71.403   12.698   37.262   4.5454   41.527   3.7930 -4.265202 5.920072 
1 1 1    6    4  -92 o   17.092   5.1406   12.174   7.7425   9.5174   10.693   15.102   11.226   16.681   6.0714   19.327   6.2497 -2.646544 8.713225 
1 1 1    6    4  -91 o   60.724   2.0291  150.733   10.030  133.994   14.172  167.531   14.197   57.137   3.0539   63.947   2.7298 -6.810757 4.096104 
1 1 1    6    4  -90 o  104.794   1.6743  448.116   14.303  452.595   20.485  443.855   19.978  105.253   2.3876  104.235   2.3513 1.017456 3.351013 
1 1 1    6    4  -89 o   41.114   2.8710   69.449   9.5613   74.182   15.203   66.352   12.298   42.267   4.4807   40.058   3.8121 2.209438 5.882972 
1 1 1    6    4  -88 o  220.109   2.3707  1978.62   42.536  1866.61   84.023  2017.22   49.323  213.106   4.8369  222.174   2.7234 -9.067856 5.550943 
1 1 1    6    4  -87 o   88.463   1.7507  319.293   12.625  328.651   18.310  310.813   17.430   89.666   2.5076   87.202   2.4545 2.463905 3.508926 
1 1 1    6    4  -86 o   95.999   1.5737  375.908   12.315  376.048   16.509  375.733   18.491   95.986   2.1099   95.928   2.3647 0.5783844E-01 3.169124 
1 1 1    6    4  -85 o  113.834   1.5287  528.507   14.185  526.279   18.971  531.332   21.361  113.562   2.0494  114.088   2.2970 -0.5256577 3.078313 
1 1 1    6    4  -84 o  117.173   1.5312  559.943   14.625  580.388   19.749  535.116   21.763  119.264   2.0314  114.497   2.3318 4.766617 3.092572 
1 1 1    6    4  -83 o  195.041   1.6872  1551.59   26.824  1551.93   35.613  1551.15   40.778  195.007   2.2404  194.918   2.5665 0.8880615E-01 3.406775 
1 1 1    6    4  -82 o   81.357   1.6321  269.950   10.823  265.612   14.405  275.576   16.403   80.650   2.1931   82.130   2.4528 -1.480316 3.290310 
1 1 1    6    4  -81 o  131.664   1.5156  706.916   16.266  691.524   21.558  727.262   24.786  130.196   2.0313  133.501   2.2776 -3.305756 3.051851 
1 1 1    6    4  -80 o   91.700   1.5717  342.902   11.748  339.233   15.709  347.559   17.698   91.189   2.1133   92.260   2.3552 -1.071747 3.164340 
1 1 1    6    4  -79 o   89.079   1.6195  323.578   11.760  345.774   15.938  297.058   17.422   92.066   2.1238   85.283   2.5088 6.783356 3.287004 
1 1 1    6    4  -78 o  151.548   1.5839  936.504   19.567  979.598   26.640  886.020   28.834  154.968   2.1089  147.363   2.4004 7.605377 3.195190 
1 1 1    6    4  -77 f  138.721   1.7407  784.740   19.684  775.492   24.222  802.719   33.774  137.882   2.1551  140.231   2.9546 -2.348877 3.657103 
1 1 1    6    4  -76 o  103.636   1.9137  438.034   16.167  447.319   18.138  402.150   35.658  104.721   2.1249   99.064   4.4269 5.656548 4.910468 
1 1 1    6    4  -75 o   67.147   2.1484  184.092   11.744  186.158   13.187  176.172   25.819   67.508   2.4002   65.437   4.8755 2.071220 5.434290 
1 1 1    6    4  -74 o   98.767   1.8050  397.789   14.532  398.055   16.219  396.703   32.729   98.794   2.0139   98.443   4.0875 0.3505478 4.556691 
1 1 1    6    4  -73 f   63.656   1.8867  165.384   9.7789  163.533   11.753  169.546   17.628   63.277   2.2823   64.354   3.3721 -1.076801 4.071908 
1 1 1    6    4  -72 o  109.717   1.6087  490.814   14.387  500.952   17.596  470.365   24.991  110.835   1.9476  107.326   2.8591 3.508995 3.459463 
1 1 1    6    4  -71 o  266.405   2.1408  2894.48   46.490  2856.58   56.328  2975.47   82.339  264.613   2.6114  269.928   3.7421 -5.314331 4.563240 
1 1 1    6    4  -70 o  237.309   1.9900  2296.51   38.496  2290.13   46.959  2309.57   67.220  236.948   2.4312  237.853   3.4670 -0.9047699 4.234492 
1 1 1    6    4  -69 o  144.599   1.6237  852.483   19.139  868.145   23.515  821.751   32.939  145.909   1.9771  141.917   2.8474 3.991440 3.466489 
1 1 1    6    4  -68 o  246.906   2.2271  2486.23   44.824  2469.26   49.748  2559.45  103.336  246.043   2.4804  250.188   5.0670 -4.145020 5.641529 
1 1 1    6    4  -67 o  102.777   1.7428  430.683   14.600  429.430   16.141  436.320   34.241  102.623   1.9296  103.281   4.0751 -0.6582336 4.508886 
1 1 1    6    4  -66 o  220.118   2.0810  1975.80   37.340  1995.86   41.888  1898.19   82.395  221.219   2.3229  215.525   4.6899 5.694168 5.233694 
1 1 1    6    4  -65 o  280.527   2.4214  3209.59   55.370  3199.04   61.660  3253.53  125.844  280.042   2.7011  282.049   5.4736 -2.006927 6.103756 
1 1 1    6    4  -64 o  101.728   1.5957  421.896   13.232  439.410   16.235  387.246   22.835  103.811   1.9186   97.387   2.8797 6.423927 3.460285 
1 1 1    6    4  -63 o  122.242   1.7153  609.235   17.093  596.797   21.554  630.313   28.058  120.976   2.1857  124.308   2.7690 -3.331451 3.527661 
1 1 1    6    4  -62 o  241.938   2.1874  2386.88   43.139  2377.96   55.278  2400.78   68.992  241.447   2.8086  242.549   3.4895 -1.101837 4.479412 
1 1 1    6    4  -61 o  208.245   1.8407  1768.09   31.246  1754.88   38.036  1795.51   54.795  207.448   2.2493  209.782   3.2043 -2.333344 3.915006 
1 1 1    6    4  -60 o  283.780   2.2226  3283.78   51.415  3280.01   62.863  3291.41   89.359  283.583   2.7194  283.973   3.8603 -0.3897095 4.722020 
1 1 1    6    4  -59 o  178.837   1.7200  1303.88   25.073  1318.01   30.787  1276.03   43.209  179.791   2.1007  176.867   2.9970 2.923889 3.659921 
1 1 1    6    4  -58 o  245.171   2.2034  2450.90   44.036  2466.18   56.888  2428.06   69.558  245.900   2.8381  243.949   3.4979 1.951233 4.504472 
1 1 1    6    4  -57 o  247.909   2.4744  2506.14   50.004  2512.18   57.750  2488.03   99.955  248.187   2.8545  246.827   4.9680 1.360504 5.729664 
1 1 1    6    4  -56 o  204.034   2.5431  1697.55   42.296  1697.55   42.296   0.0000   0.0000  204.034   2.5431  ?   ?  0.000000 2.543059 
1 1 1    6    4  -55 o  279.759   2.4017  3191.16   54.770  3128.23   69.470  3294.52   89.034  276.951   3.0772  284.164   3.8437 -7.213074 4.923757 
1 1 1    6    4  -54 o  283.905   2.2187  3286.18   51.347  3267.66   62.579  3324.33   89.827  283.082   2.7119  285.457   3.8604 -2.374695 4.717736 
1 1 1    6    4  -53 o  222.952   1.9054  2026.38   34.629  1998.91   41.963  2085.03   61.314  221.424   2.3249  226.106   3.3267 -4.681717 4.058560 
1 1 1    6    4  -52 o  400.103   2.8922  6527.53   94.328  6487.47  114.943  6610.14  165.072  398.829   3.5356  402.441   5.0319 -3.612030 6.149847 
1 1 1    6    4  -51 o  364.835   2.9383  5427.36   87.384  5408.58   97.345  5505.28  198.301  364.184   3.2791  367.119   6.6265 -2.934692 7.393432 
1 1 1    6    4  -50 o  110.951   1.5821  501.786   14.309  517.658   17.639  471.234   24.472  112.689   1.9202  107.471   2.7958 5.218300 3.391738 
1 1 1    6    4  -49 o  148.946   1.6211  904.303   19.682  909.349   24.084  894.157   34.152  149.357   1.9782  148.091   2.8292 1.265915 3.452147 
1 1 1    6    4  -48 f  404.164   2.9148  6659.91   96.029  6630.69  117.226  6719.54  167.431  403.243   3.5663  405.832   5.0612 -2.588776 6.191478 
1 1 1    6    4  -47 o  121.081   1.6514  597.584   16.299  681.642   29.515  560.704   19.550  129.304   2.8002  117.282   2.0449 12.02247 3.467401 
1 1 1    6    4  -46 o  246.113   2.2179  2469.16   44.495  2482.76   57.772  2449.32   69.761  246.776   2.8720  245.092   3.4918 1.684433 4.521151 
1 1 1    6    4  -45 o  603.769   5.1083 14869.86  251.411 14711.86  352.814 15032.85  358.347  600.307   7.2100  606.816   7.2445 -6.508850 10.22095 
1 1 1    6    4  -44 o  276.543   3.0177  3117.80   68.027   0.0000   0.0000  3117.80   68.027  ?   ?   276.543   3.0177 0.000000 3.017732 
1 1 1    6    4  -43 o  146.600   1.9020  876.019   22.728  822.099   47.928  891.664   25.816  141.930   4.1471  147.901   2.1413 -5.971191 4.667279 
1 1 1    6    4  -42 o  501.639   3.8346 10260.05  156.799 10224.13  247.298 10284.19  202.768  500.622   6.0600  502.167   4.9535 -1.544891 7.826959 
1 1 1    6    4  -41 o  343.095   2.7594  4798.56   77.174  4810.10  122.232  4790.92   99.518  343.461   4.3659  342.801   3.5614 0.6600037 5.634244 
1 1 1    6    4  -40 o  286.692   2.3998  3350.35   56.083  3332.48   88.288  3362.44   72.617  285.899   3.7884  287.196   3.1019 -1.297119 4.896238 
1 1 1    6    4  -39 o  590.443   4.4544 14214.77  214.389 14405.55  342.821 14092.23  274.741  594.207   7.0777  587.814   5.7339 6.393311 9.108866 
1 1 1    6    4  -38 o  452.673   2.9680  8353.14  109.516  8040.02  140.636  8835.57  174.564  444.080   3.8851  465.505   4.6004 -21.42471 6.021399 
1 1 1    6    4  -37 o  295.197   2.2609  3551.98   54.404  3586.74   67.580  3487.97   91.706  296.630   2.7949  292.498   3.8463 4.131836 4.754502 
1 1 1    6    4  -36 o  508.398   3.5525 10536.89  147.222 10547.18  180.923 10516.72  253.286  508.617   4.3638  507.798   6.1190 0.8187866 7.515689 
1 1 1    6    4  -35 o  545.776   3.5087 12143.06  156.097 12100.64  206.388 12199.75  238.610  544.779   4.6476  546.972   5.3516 -2.193115 7.088034 
1 1 1    6    4  -34 o  787.563   4.9526 25290.28  317.944 25353.97  421.943 25206.61  483.622  788.432   6.5653  786.046   7.5478 2.385437 10.00364 
1 1 1    6    4  -33 o  312.340   2.0537  3976.41   52.289  4081.75   75.856  3881.04   72.177  316.439   2.9408  308.562   2.8696 7.877075 4.108845 
1 1 1    6    4  -32 o  313.274   2.0569  4000.22   52.526  4010.95   74.914  3989.85   73.669  313.683   2.9298  312.858   2.8887 0.8256531 4.114388 
1 1 1    6    4  -31 o  451.108   2.9646  8295.18  109.012  8366.01  168.680  8244.37  142.852  452.988   4.5682  449.703   3.8970 3.285736 6.004530 
1 1 1    6    4  -30 o  468.539   3.0618  8948.67  116.939  8855.33  178.035  9019.50  155.083  466.046   4.6864  470.365   4.0448 -4.319855 6.190533 
1 1 1    6    4  -29 o  479.861   3.1248  9386.40  122.228  9459.12  188.810  9333.93  160.365  481.670   4.8088  478.493   4.1115 3.176422 6.326853 
1 1 1    6    4  -28 o  539.263   3.4693 11854.45  152.502 11663.21  230.475 12003.39  203.395  534.835   5.2865  542.605   4.5986 -7.770020 7.006692 
1 1 1    6    4  -27 o  486.246   2.9508  9637.66  116.958  9560.74  164.634  9716.04  166.184  484.273   4.1706  488.190   4.1760 -3.917023 5.901937 
1 1 1    6    4  -26 o  323.735   2.0894  4271.81   55.137  4282.29   78.475  4261.59   77.485  324.122   2.9702  323.338   2.9398 0.7842712 4.179083 
1 1 1    6    4  -25 o  287.098   1.9053  3359.61   44.590  3331.78   63.020  3387.50   63.100  285.900   2.7041  288.281   2.6852 -2.381287 3.810869 
1 1 1    6    4  -24 o  511.669   3.0868 10671.85  128.744 10828.11  184.605 10523.88  179.640  515.368   4.3943  508.078   4.3375 7.289948 6.174420 
1 1 1    6    4  -23 o  897.159   5.2462 32817.23  383.667 32557.12  539.136 33084.11  546.105  893.437   7.4028  900.635   7.4386 -7.198669 10.49452 
1 1 1    6    4  -22 o  418.465   2.5788  7137.74   87.965  7112.47  124.339  7163.06  124.463  417.705   3.6518  419.188   3.6425 -1.482880 5.157792 
1 1 1    6    4  -21 o  132.471   1.3745  715.245   14.843  663.301   22.561  754.882   19.708  127.567   2.1697  136.090   1.7766 -8.523232 2.804216 
1 1 1    6    4  -20 o  835.751   4.8969 28476.85  333.609 28299.84  469.505 28657.36  474.118  833.024   6.9143  838.268   6.9385 -5.243713 9.795442 
1 1 1    6    4  -19 o  363.697   2.2874  5391.54   67.815  5473.85   97.285  5313.75   94.582  366.450   3.2568  361.052   3.2137 5.398315 4.575447 
1 1 1    6    4  -18 o  634.966   4.0247 16435.95  208.316 16630.90  321.503 16294.87  273.492  638.633   6.1759  632.188   5.3072 6.445496 8.142920 
1 1 1    6    4  -17 o  143.728   1.4878  841.981   17.431  771.221   29.176  881.256   21.736  137.552   2.6021  147.041   1.8135 -9.488892 3.171667 
1 1 1    6    4  -16 o  315.618   2.1747  4060.26   55.950  4022.12   84.976  4089.46   74.338  314.119   3.3187  316.743   2.8792 -2.623871 4.393556 
1 1 1    6    4  -15 o  837.473   5.6632 28596.99  386.609 28656.43  670.718 28567.41  473.112  838.008   9.8187  836.956   6.9347 1.051941 12.02069 
1 1 1    6    4  -14 o  721.401   4.9058 21217.25  288.486 21281.27  500.878 21185.46  352.898  722.272   8.5074  720.807   6.0061 1.465454 10.41387 
1 1 1    6    4  -13 o  781.635   5.8043 24911.25  369.822 25279.93  592.235 24675.60  473.485  787.146   9.2300  777.823   7.4677 9.323547 11.87269 
1 1 1    6    4  -12 o  402.001   3.5109  6587.58  115.048  6584.91  162.551  6590.27  162.854  401.888   4.9619  402.052   4.9691 -0.1632690 7.022296 
1 1 1    6    4  -11 o  279.990   2.3491  3195.36   53.615  3425.54   88.789  3063.25   67.263  289.884   3.7575  274.135   3.0101 15.74896 4.814485 
1 1 1    6    4  -10 o  577.336   4.3557 13588.36  204.988 13742.46  267.188 13367.89  319.592  580.554   5.6460  572.533   6.8479 8.020508 8.875311 
1 1 1    6    4   -9 o  552.095   3.8141 12425.49  171.651 12348.06  209.105 12585.47  300.564  550.347   4.6611  555.534   6.6373 -5.186951 8.110455 
1 1 1    6    4   -8 o  772.413   5.2429 24325.25  330.109 23800.10  396.626 25509.08  595.502  763.966   6.3690  790.694   9.2393 -26.72778 11.22179 
1 1 1    6    4   -7 o  477.826   3.3428  9306.95  130.202  9260.80  183.275  9353.97  185.003  476.606   4.7175  478.997   4.7382 -2.391144 6.686151 
1 1 1    6    4   -6 o  391.464   2.8046  6246.46   89.496  6246.99  126.513  6245.93  126.620  391.461   3.9647  391.428   3.9684 0.3323364E-01 5.609558 
1 1 1    6    4   -5 o  136.602   1.3586  760.551   15.128  761.335   23.042  759.958   20.056  136.670   2.0683  136.547   1.8018 0.1227417 2.743092 
1 1 1    6    4   -4 o  695.892   4.7413 19743.17  268.955 20077.38  472.758 19583.25  327.036  701.549   8.2670  693.018   5.7891 8.530151 10.09241 
1 1 1    6    4   -3 o  444.963   3.1366  8070.66  113.768  8269.74  201.118  7976.98  137.963  450.358   5.4785  442.359   3.8261 7.999023 6.682237 
1 1 1    6    4   -2 o  716.460   4.5137 20926.90  263.609 20895.69  402.162 20950.41  349.053  715.798   6.8925  716.790   5.9740 -0.9920044 9.121097 
1 1 1    6    4   -1 o  586.612   3.7364 14027.70  178.667 14256.95  276.700 13863.77  233.983  591.312   5.7406  583.135   4.9224 8.177551 7.562057 
1 1 1    6    4    0 o  560.315   3.5810 12798.06  163.559 12866.01  251.010 12747.92  215.618  561.738   5.4818  559.182   4.7304 2.555847 7.240603 
1 1 1    6    4    1 o  118.204   1.3154  569.479   12.675  556.358   19.271  579.481   16.826  116.832   2.0236  119.236   1.7311 -2.404030 2.662997 
1 1 1    6    4    2 o  234.700   1.7542  2245.17   33.560  2234.54   51.133  2253.21   44.481  234.137   2.6792  235.116   2.3209 -0.9785156 3.544622 
1 1 1    6    4    3 o  611.363   3.8844 15236.64  193.581 15091.76  293.267 15348.51  257.699  608.370   5.9137  613.557   5.1525 -5.186890 7.843503 
1 1 1    6    4    4 o  302.823   2.2738  3737.78   56.128  3710.74   96.674  3751.52   68.936  301.706   3.9309  303.374   2.7876 -1.668518 4.818993 
1 1 1    6    4    5 o  621.422   4.2600 15742.80  215.792 15548.81  369.825 15842.94  265.715  617.439   7.3480  623.359   5.2293 -5.919861 9.018752 
1 1 1    6    4    6 o  811.720   5.0888 26863.57  336.713 26434.61  507.165 27201.67  450.265  805.038   7.7285  816.708   6.7634 -11.67004 10.27004 
1 1 1    6    4    7 o  880.094   5.5035 31581.46  394.823 31314.65  598.516 31787.02  525.341  876.144   8.3804  882.823   7.3001 -6.679016 11.11409 
1 1 1    6    4    8 o  449.066   3.1641  8220.20  115.825  8339.11  165.709  8106.62  161.956  452.273   4.4948  445.925   4.4555 6.348175 6.328905 
1 1 1    6    4    9 o  999.897   7.3752 40777.00  601.125 41032.77  780.266 40403.52  942.869  1002.80   9.5454  994.800   11.627 7.995728 15.04358 
1 1 1    6    4   10 o  599.449   4.5159 14649.45  220.663 14785.28  287.167 14453.61  344.812  602.169   5.8503  595.316   7.1056 6.853149 9.204092 
1 1 1    6    4   11 o  453.972   3.4996  8401.00  129.502  8317.37  165.760  8532.02  207.469  451.685   4.5020  457.445   5.5639 -5.760956 7.157174 
1 1 1    6    4   12 o  267.808   2.9368  2923.48   64.112  2947.59   78.742  2876.08  110.425  268.903   3.5923  265.600   5.1004 3.303162 6.238490 
1 1 1    6    4   13 o  770.038   6.3990 24179.73  401.661 24709.92  578.721 23686.96  557.919  778.231   9.1227  761.964   8.9826 16.26709 12.80277 
1 1 1    6    4   14 o  679.982   5.6795 18852.74  314.809 18607.54  439.974 19109.97  450.632  675.413   7.9914  684.465   8.0767 -9.052063 11.36201 
1 1 1    6    4   15 o  426.273   3.3076  7406.98  114.932  7347.98  180.353  7447.33  149.137  424.529   5.2117  427.413   4.2806 -2.883636 6.744264 
1 1 1    6    4   16 o  471.205   3.6167  9051.00  138.918  9104.33  220.534  9015.92  178.865  472.534   5.7254  470.266   4.6660 2.267944 7.385928 
1 1 1    6    4   17 o  239.971   1.9282  2347.17   37.718  2353.92   53.491  2340.49   53.194  240.311   2.7307  239.624   2.7233 0.6867676 3.856534 
1 1 1    6    4   18 o  818.617   5.5426 27323.39  369.853 27531.31  526.421 27120.71  519.745  821.567   7.8606  815.421   7.8194 6.146118 11.08744 
1 1 1    6    4   19 o  170.900   1.5987  1190.44   22.272  1201.72   31.694  1179.43   31.305  171.706   2.2644  170.106   2.2576 1.599716 3.197560 
1 1 1    6    4   20 o  312.815   2.3362  3988.51   59.572  4004.10   84.503  3973.11   83.994  313.415   3.3076  312.199   3.3005 1.215302 4.672668 
1 1 1    6    4   21 o  264.190   2.0608  2844.88   44.380  2828.09   62.574  2861.86   62.953  263.403   2.9143  264.971   2.9146 -1.568085 4.121705 
1 1 1    6    4   22 o  1042.18   7.0088 44295.99  595.420 43803.50  833.862 44808.30  850.485  1036.04   9.8737  1047.85   9.9571 -11.80432 14.02263 
1 1 1    6    4   23 o  641.819   4.3962 16793.51  230.000 16885.29  326.707 16703.33  323.850  643.488   6.2285  640.013   6.2075 3.475281 8.793611 
1 1 1    6    4   24 o  423.490   3.0097  7310.46  103.895  7361.05  147.772  7261.00  146.102  424.927   4.2662  422.030   4.2470 2.897064 6.019739 
1 1 1    6    4   25 o  397.737   2.8525  6448.31   92.482  6423.58  130.412  6473.33  131.170  396.952   4.0304  398.486   4.0382 -1.534027 5.705319 
1 1 1    6    4   26 o  611.734   4.2029 15255.85  209.578 15364.45  298.120 15149.74  294.687  613.832   5.9581  609.529   5.9310 4.302734 8.406883 
1 1 1    6    4   27 o  690.917   4.7158 19462.27  265.592 19186.54  370.959 19752.26  380.427  685.901   6.6348  695.935   6.7060 -10.03394 9.433542 
1 1 1    6    4   28 o  537.389   3.7305 11772.54  163.415 11696.26  229.865 11850.49  232.363  535.593   5.2650  539.112   5.2875 -3.518921 7.461800 
1 1 1    6    4   29 o  470.513   3.3103  9024.41  126.962  8959.95  178.533  9090.36  180.588  468.793   4.6720  472.191   4.6917 -3.398560 6.621182 
1 1 1    6    4   30 o  541.965   4.1241 11974.52  182.197 11848.92  285.886 12060.43  236.431  539.013   6.5066  543.859   5.3331 -4.845581 8.413007 
1 1 1    6    4   31 o  411.237   3.2331  6893.81  108.381  7082.47  175.520  6777.54  137.786  416.774   5.1664  407.733   4.1457 9.041077 6.624076 
1 1 1    6    4   32 o  683.267   5.1182 19035.55  285.064 19116.07  452.733 18982.66  366.936  684.498   8.1140  682.224   6.5982 2.273560 10.45817 
1 1 1    6    4   33 o   88.635   3.1434  320.653   22.675  320.653   22.675   0.0000   0.0000   88.635   3.1434  ?   ?  0.000000 3.143409 
1 1 1    6    4   34 o  246.228   2.4461  2471.29   49.095  2582.72   72.487  2376.86   66.732  251.704   3.5329  241.467   3.3903 10.23775 4.896512 
1 1 1    6    4   35 o  423.973   3.7205  7328.01  128.579  7605.79  188.976  7088.55  175.453  431.878   5.3680  416.942   5.1624 14.93594 7.447486 
1 1 1    6    4   36 o  680.143   5.7042 18865.13  316.251 19388.17  459.240 18393.37  436.146  689.295   8.1733  671.398   7.9692 17.89679 11.41542 
1 1 1    6    4   37 o  170.672   1.8647  1187.30   25.942  1318.87   45.442  1123.69   31.597  179.870   3.0993  166.034   2.3346 13.83601 3.880178 
1 1 1    6    4   38 o  488.705   4.1966  9737.55  167.177  9914.03  340.626  9681.55  191.877  492.852   8.4786  487.271   4.8308 5.581329 9.758256 
1 1 1    6    4   39 o  327.851   2.9905  4381.67   79.921  4263.23  158.083  4422.34   92.631  323.300   5.9985  329.359   3.4502 -6.059235 6.920005 
1 1 1    6    4   40 o  219.999   1.8767  1972.79   33.655  1965.44   48.431  1979.64   46.800  219.580   2.7058  220.373   2.6053 -0.7930450 3.756176 
1 1 1    6    4   41 o  415.114   2.9729  7024.75  100.595  7000.26  142.537  7049.05  141.992  414.347   4.2201  415.789   4.1894 -1.442413 5.946497 
1 1 1    6    4   42 o  295.604   2.2662  3561.92   54.607  3478.65   76.649  3647.74   77.815  292.109   3.2190  299.126   3.1914 -7.016144 4.532864 
1 1 1    6    4   43 o  491.679   3.4495  9856.18  138.254 10046.67  199.162  9679.00  192.071  496.324   4.9227  487.164   4.8367 9.160919 6.901232 
1 1 1    6    4   44 o  110.617   1.5382  498.747   13.870  489.427   20.708  506.331   18.679  109.574   2.3184  111.452   2.0560 -1.878143 3.098766 
1 1 1    6    4   45 o  372.838   2.7280  5666.94   82.909  5404.88  113.872  5962.59  120.951  364.073   3.8370  382.394   3.8803 -18.32047 5.457028 
1 1 1    6    4   46 o  287.344   3.1124  3366.30   72.902   0.0000   0.0000  3366.30   72.902  ?   ?   287.344   3.1124 0.000000 3.112440 
1 1 1    6    4   47 o  525.648   3.6589 11267.02  156.778 11242.44  221.459 11291.71  221.977  524.945   5.1754  526.094   5.1762 -1.148804 7.319661 
1 1 1    6    4   48 f  358.152   2.6209  5229.50   76.516  5173.02  107.529  5287.43  108.903  356.165   3.7037  360.081   3.7103 -3.916748 5.242471 
1 1 1    6    4   49 o  363.223   2.6542  5378.79   78.587  5394.83  111.678  5363.06  110.606  363.708   3.7669  362.637   3.7417 1.070953 5.309385 
1 1 1    6    4   50 o  201.693   2.4805  1658.49   40.782   0.0000   0.0000  1658.49   40.782  ?   ?   201.693   2.4805 0.000000 2.480501 
1 1 1    6    4   51 o  157.866   1.4845  1015.86   19.103  1005.67   25.639  1028.57   28.640  157.065   2.0025  158.840   2.2119 -1.775146 2.983768 
1 1 1    6    4   52 o  332.071   2.2917  4495.65   62.033  4598.94   83.785  4370.32   92.286  335.826   3.0607  327.350   3.4585 8.476624 4.618322 
1 1 1    6    4   53 o  270.289   1.9670  2978.27   43.339  2983.99   57.718  2970.87   65.621  270.525   2.6174  269.913   2.9825 0.6119080 3.968115 
1 1 1    6    4   54 o  139.807   1.5481  796.767   17.642  766.000   25.403  825.432   24.520  137.069   2.2736  142.290   2.1140 -5.221329 3.104573 
1 1 1    6    4   55 o  189.112   2.1273  1458.08   32.792  1461.02   37.728  1448.97   66.313  189.293   2.4451  188.427   4.3174 0.8658600 4.961698 
1 1 1    6    4   56 o   54.954   2.1451  123.317   9.5909  123.081   11.985  123.736   15.994   54.873   2.6876   54.956   3.5899 -0.8319092E-01 4.484499 
1 1 1    6    4   57 o  166.482   1.8214  1129.94   24.718  1180.10   32.165  1057.61   38.629  170.122   2.3195  161.031   2.9428 9.091675 3.747038 
1 1 1    6    4   58 o   81.926   1.7999  273.635   12.020  266.109   13.304  307.088   28.048   80.763   2.0224   86.652   3.9816 -5.888283 4.465748 
1 1 1    6    4   59 o  246.105   2.0182  2469.51   40.488  2497.21   49.849  2415.79   69.405  247.459   2.4712  243.323   3.4992 4.135895 4.283886 
1 1 1    6    4   60 o  318.539   2.6410  4138.30   68.576  4143.99   76.699  4115.61  153.114  318.731   2.9521  317.237   5.9210 1.494080 6.616109 
1 1 1    6    4   61 o  138.763   1.7366  785.030   19.644  788.754   21.923  769.862   44.242  139.087   1.9337  137.272   3.9579 1.814621 4.405011 
1 1 1    6    4   62 o  261.337   2.1001  2784.89   44.739  2837.05   55.307  2686.15   76.095  263.743   2.5725  256.545   3.6388 7.197968 4.456329 
1 1 1    6    4   63 o  110.587   1.7110  498.593   15.423  487.387   19.213  518.898   25.864  109.327   2.1560  112.786   2.8132 -3.459236 3.544317 
1 1 1    6    4   64 o   40.777   2.2171   68.007   7.3416   65.709   9.2847   71.841   11.993   40.032   2.8642   41.805   3.5529 -1.772591 4.563668 
1 1 1    6    4   65 o  180.857   1.5979  1333.54   23.557  1363.34   31.271  1294.43   35.821  182.847   2.0981  178.149   2.4667 4.698425 3.238280 
1 1 1    6    4   66 o  116.060   1.4656  549.137   13.866  575.451   18.413  514.669   21.074  118.798   1.9014  112.337   2.3014 6.460327 2.985250 
1 1 1    6    4   67 o   78.181   1.5721  249.195   10.019  240.651   12.970  261.836   15.776   76.792   2.0739   80.086   2.4194 -3.293953 3.186603 
1 1 1    6    4   68 o  228.460   1.7975  2128.16   33.474  2138.83   44.246  2113.87   51.187  228.998   2.3703  227.629   2.7587 1.369125 3.637141 
1 1 1    6    4   69 o  175.315   1.7273  1253.18   24.685  1261.83   34.989  1244.61   34.831  175.885   2.4404  174.680   2.4462 1.204971 3.455341 
1 1 1    6    4   70 o  244.256   2.0297  2432.98   40.412  2396.31   56.571  2471.20   57.751  242.341   2.8637  246.098   2.8788 -3.756668 4.060616 
1 1 1    6    4   71 o   37.261   2.7335   56.951   8.2448   45.034   11.433   69.866   11.902   32.911   4.3694   41.211   3.5783 -8.300663 5.647622 
1 1 1    6    4   72 o   75.152   1.7563  230.294   10.759  223.971   15.090  236.832   15.344   74.054   2.5035   76.154   2.4751 -2.100456 3.520422 
1 1 1    6    4   73 f  137.809   1.6399  774.345   18.421  826.457   26.676  726.838   25.470  142.342   2.2990  133.486   2.3407 8.856201 3.280938 
1 1 1    6    4   74 o   80.869   1.9622  266.706   12.935  260.222   16.533  276.938   20.769   79.823   2.5442   82.310   3.1010 -2.486923 4.011108 
1 1 1    6    4   75 o  250.835   2.2941  2566.62   46.907  2531.40   60.087  2621.58   75.055  249.035   2.9599  253.339   3.6345 -4.303741 4.687273 
1 1 1    6    4   76 o  196.269   2.0518  1571.19   32.826  1550.60   42.255  1602.52   52.129  194.930   2.6593  198.108   3.2280 -3.178360 4.182366 
1 1 1    6    4   77 f  118.857   1.7611  576.094   17.062  592.039   24.597  561.307   23.688  120.457   2.5051  117.290   2.4776 3.166641 3.523328 
1 1 1    6    4   78 o   81.261   2.0689  269.524   13.693  276.154   18.056  260.549   21.008   82.215   2.6978   79.812   3.2358 2.402451 4.212939 
1 1 1    6    4   79 o  154.917   1.5824  978.622   19.982  991.216   26.390  961.697   30.592  155.883   2.0769  153.519   2.4446 2.363708 3.207705 
1 1 1    6    4   80 o  169.848   1.6065  1176.42   22.242  1164.53   29.121  1193.07   34.458  168.953   2.1145  170.981   2.4724 -2.028152 3.253234 
1 1 1    6    4   81 o   87.927   1.7428  315.322   12.491  294.817   17.123  338.650   18.263   84.955   2.4752   91.057   2.4628 -6.102661 3.491708 
1 1 1    6    4   82 o   91.567   1.7121  341.976   12.779  345.456   17.898  338.357   18.252   91.969   2.3894   91.013   2.4625 0.9564285 3.431204 
1 1 1    6    4   83 o  108.879   1.8544  483.591   16.459  470.714   26.342  491.837   21.079  107.299   3.0148  109.773   2.3557 -2.474319 3.825995 
1 1 1    6    4   84 o   58.853   1.9337  141.467   9.2640  144.332   12.183  137.540   14.264   59.403   2.5218   57.939   3.0307 1.463760 3.942673 
1 1 1    6    4   85 o  125.920   1.5253  646.693   15.656  647.066   20.578  646.180   24.124  125.925   2.0047  125.810   2.3523 0.1145554 3.090695 
1 1 1    6    4   86 o   60.269   1.9167  148.368   9.4044  138.624   12.337  161.888   14.531   58.198   2.6071   62.878   2.8424 -4.680275 3.856920 
1 1 1    6    4   87 o   84.958   1.6291  294.450   11.282  284.363   14.659  309.107   17.671   83.434   2.1572   86.959   2.4955 -3.524361 3.298622 
1 1 1    6    4   88 o  118.730   1.5353  575.043   14.859  582.405   19.648  565.206   22.712  119.451   2.0179  117.642   2.3684 1.809532 3.111473 
1 1 1    6    4   89 o   67.970   1.7857  188.657   9.8850  201.289   13.140  172.186   15.004   70.166   2.3004   64.834   2.8459 5.332657 3.659414 
1 1 1    6    4   90 o   92.422   1.7140  348.568   12.912  368.026   15.922  311.186   22.070   94.941   2.0574   87.148   3.1117 7.792839 3.730361 
1 1 1    6    4   91 o  103.199   1.5649  434.549   13.165  452.861   17.574  411.138   19.872  105.310   2.0473  100.302   2.4304 5.007240 3.177784 
1 1 1    6    4   92 o   91.332   1.9454  340.607   14.483  371.973   18.890  295.871   22.560   95.364   2.4320   84.918   3.2652 10.44550 4.071367 
1 1 1    6    4   93 o   97.278   1.7799  386.340   14.113  396.170   19.917  376.426   20.002   98.397   2.4852   95.900   2.5610 2.496597 3.568573 
1 1 1    6    4   94 o   43.438   2.8494   77.597   10.033   74.766   13.689   80.885   14.749   42.447   4.0035   44.136   4.1483 -1.689461 5.765100 
1 1 1    6    4   95 o  129.310   1.5861  682.615   16.719  662.052   21.890  711.403   25.900  127.268   2.1101  131.868   2.4095 -4.600548 3.202832 
1 1 1    6    4   96 o   95.281   1.7118  370.782   13.295  378.675   18.705  362.723   18.901   96.197   2.3854   94.104   2.4662 2.092804 3.431095 
1 1 1    6    4   97 o   85.832   1.6432  300.893   11.497  317.798   15.356  279.332   17.342   88.146   2.1371   82.534   2.5809 5.612854 3.350867 
1 1 1    6    4   98 o   81.297   1.7556  270.086   11.634  285.853   16.351  253.921   16.557   83.505   2.4047   78.663   2.5855 4.842026 3.530939 
1 1 1    6    4   99 o   84.792   1.7436  293.877   12.051  307.468   16.862  279.685   17.230   86.588   2.3913   82.542   2.5639 4.046051 3.505989 
1 1 1    6    4  100 o   55.008   2.1274  124.096   9.5210  139.124   13.216  107.882   13.728   58.120   2.7978   51.050   3.3169 7.070580 4.339303 
1 1 1    6    4  101 o   78.633   1.9157  253.082   12.279  244.358   15.767  266.527   19.574   77.108   2.5118   80.395   2.9921 -3.287231 3.906674 
1 1 1    6    4  102 o   48.468   2.2515   96.567   8.8712  100.427   11.012   89.431   14.973   49.328   2.7495   46.208   4.0151 3.119690 4.866287 
1 1 1    6    4  103 o   26.667   3.6393   30.033   7.7048   33.918   9.5592   22.827   13.017   28.190   4.2955   22.700   6.6252 5.490049 7.895813 
1 1 1    6    4  104 o   52.397   2.0172  112.761   8.5998  116.576   11.482  107.886   12.980   53.129   2.6596   50.973   3.1390 2.156017 4.114270 
1 1 1    6    4  105 o   65.627   1.9523  176.806   10.432  189.486   14.959  164.800   14.556   67.717   2.7155   63.105   2.8369 4.612144 3.927119 
1 1 1    6    4  106 o   26.471   3.5020   29.651   7.3714   31.501   9.9973   27.448   10.912   26.920   4.7283   24.840   5.5311 2.079929 7.276700 
1 1 1    6    4  107 o   72.165   1.7323  213.478   10.190  217.156   13.540  208.673   15.476   72.593   2.2910   71.018   2.6782 1.575775 3.524378 
1 1 1    6    4  108 o   29.790   3.5705   37.604   8.4979   37.729   10.180   37.317   15.434   29.576   4.3525   28.440   6.7580 1.135401 8.038308 
1 1 1    6    4  109 f  113.095   2.0572  526.165   18.965  526.165   18.965   0.0000   0.0000  113.095   2.0572  ?   ?  0.000000 2.057229 
1 1 1    6    4  110 o   67.954   1.9705  190.070   10.903  193.655   13.071  181.866   19.772   68.454   2.3459   65.659   3.7093 2.794945 4.388839 
1 1 1    6    4  111 o   77.278   1.7049  245.125   10.740  263.757   14.194  220.170   16.426   79.955   2.1798   72.769   2.7743 7.185829 3.528184 
1 1 1    6    4  112 o   25.213   3.7866   27.387   7.5424   22.540   9.7762   34.514   11.855   22.273   5.4337   27.667   5.4504 -5.394373 7.696213 
1 1 1    6    4  113 o   27.596   3.4415   32.488   7.5739   39.087   10.152   24.202   11.375   29.970   4.2765   22.838   6.0243 7.132563 7.387852 
1 1 1    6    4  114 o   45.138   2.3169   84.562   8.4964   84.012   11.387   85.253   12.761   44.653   3.1486   44.801   3.5227 -0.1479416 4.724744 
1 1 1    6    4  115 o   38.673   2.5921   62.523   8.1241   77.952   11.109   44.789   11.911   42.930   3.1976   31.755   4.7469 11.17508 5.723413 
1 1 1    6    4  116 f   16.781   5.3141   12.674   8.1484   11.515   11.853   13.712   11.220   16.917   6.3495   17.682   6.2449 -0.7653751 8.905873 
1 1 1    6    4  117 o   26.103   3.7254   29.706   7.7023   21.568   10.238   40.317   11.691   21.320   5.7572   29.790   4.9910 -8.469837 7.619398 
1 1 1    6    4  118 o   13.442   5.2302   6.1673   8.2342   19.811   12.202  -5.2413   11.158   20.179   6.5149   11.439   5.2518 8.739869 8.368147 
1 1 1    6    4  119 o   16.301   5.4321   12.116   8.4549  -5.5901   12.288   28.034   11.651   11.915   5.4853   23.988   5.9797 -12.07344 8.114547 
1 1 1    6    4  120 o   16.984   5.3963   13.543   8.3963   11.973   11.975   15.061   11.776   16.710   6.3572   17.900   6.3900 -1.190323 9.013697 
1 1 1    6    4  121 o   12.658   4.9908   5.3722   7.5815   0.2639   10.113   11.926   11.455   12.073   5.3106   16.464   6.2283 -4.391331 8.185033 
1 1 1    6    4  122 o   37.148   3.0901   59.513   9.2726   60.271   11.138   57.801   16.736   36.915   3.7537   33.926   6.2830 2.988926 7.318961 
1 1 1    6    4  123 o   22.493   4.8783   24.060   8.6863   18.002   10.451   37.598   15.623   18.878   6.0228   26.278   7.1186 -7.399244 9.324614 
1 1 1    6    4  124 o   15.132   5.6707   10.073   9.4466  -2.8122   11.917   31.864   15.497   12.043   5.4906   23.870   7.2927 -11.82702 9.128489 
1 1 1    6    4  125 o   23.668   5.2728   27.385   9.9120   21.680   12.404   37.463   16.487   20.185   6.5727   25.669   7.4458 -5.484039 9.931819 
1 1 1    6    4  126 o   10.392   4.7900  -4.1230   9.4086  -4.2841   11.951  -3.8604   15.258   11.668   5.3853   13.123   6.0669 -1.455441 8.112255 
1 1 1    6    4  127 f   14.303   5.6959   8.0567   9.9682   11.306   12.727   2.9007   16.033   16.040   6.4199   14.648   6.5507 1.392053 9.172091 
1 1 1    6    4  128 o   20.722   5.8931   22.318   10.425   30.438   13.412   9.9192   16.572   23.551   6.6795   16.291   6.9826 7.260906 9.662910 
1 1 1    6    4  129 o   21.314   5.8174   23.589   10.387   7.4535   13.128   50.607   16.987   14.837   6.2820   30.176   7.0361 -15.33880 9.432420 
1 1 1    6    4  130 o   14.361   5.7181   8.4586   10.044   2.4565   12.704   18.465   16.404   13.360   5.9112   18.420   7.3162 -5.060289 9.405769 
1 1 1    6    4  131 o   20.540   5.8383   22.174   10.235   38.297   13.101  -3.0859   16.397   26.968   6.1024   13.434   6.2378 13.53428 8.726352 
1 1 1    6    4  132 o   12.768   5.4220   4.3167   9.8281   2.1663   12.652   7.5890   15.607   13.183   5.8621   15.284   6.6630 -2.101204 8.874713 
1 1 1    6    4  133 o   15.009   5.8076   10.325   10.110   14.061   12.959   4.5143   16.161   16.709   6.5439   14.738   6.5850 1.970554 9.283600 
1 1 1    6    4  134 o   9.9998   4.8042 -11.2871   11.405 -13.0081   13.183  -6.1674   22.738   10.608   5.1138   14.701   6.9852 -4.092741 8.656986 
1 1 1    6    5 -132 o   21.423   5.7494   24.052   10.249   15.089   12.802   40.044   17.101   17.044   6.5510   25.573   7.6280 -8.528736 10.05494 
1 1 1    6    5 -131 o   12.810   5.4396   4.4072   9.8919   6.6844   12.440   0.4921   16.312   14.284   6.0841   13.969   6.3896 0.3153381 8.822923 
1 1 1    6    5 -130 o   11.065   5.0223  -1.7316   9.8315  -4.9781   12.476   3.5873   15.969   11.600   5.4046   14.514   6.5108 -2.914844 8.461722 
1 1 1    6    5 -129 o   15.170   5.8202   10.586   10.093   9.0955   12.883   12.955   16.240   15.180   6.3112   16.815   7.0456 -1.635697 9.458920 
1 1 1    6    5 -128 o   14.958   5.7770   10.016   9.9897   7.4403   12.676   14.238   16.228   14.685   6.1931   17.216   7.1137 -2.530733 9.431831 
1 1 1    6    5 -127 o   19.087   5.5533   18.577   9.1586   12.064   10.935   33.883   16.763   15.958   6.0740   23.741   7.6334 -7.782676 9.755085 
1 1 1    6    5 -126 o   29.762   4.3184   41.012   10.171   33.076   12.499   56.567   17.500   25.144   6.1499   32.344   6.8508 -7.200367 9.206232 
1 1 1    6    5 -125 o   11.211   5.0017  -0.5581   9.2879   3.5479   11.539  -8.1114   15.651   13.344   5.7739   12.524   5.9044 0.8194847 8.258267 
1 1 1    6    5 -124 o   21.649   5.4172   23.318   9.5357   26.739   11.803   16.889   16.181   22.588   6.2156   18.279   7.2644 4.309134 9.560580 
1 1 1    6    5 -123 o   30.867   4.1730   43.381   10.231   48.779   13.214   35.300   16.167   31.820   5.2792   24.965   7.4094 6.855497 9.097762 
1 1 1    6    5 -122 o   37.536   3.5017   61.940   10.590   67.674   13.797   53.715   16.523   38.380   4.4952   32.257   6.5087 6.123249 7.910114 
1 1 1    6    5 -121 o   34.504   3.8263   52.977   10.581   28.942   13.345   93.659   17.363   23.382   6.6735   44.943   4.8143 -21.56124 8.228756 
1 1 1    6    5 -120 o   22.022   6.0918   24.537   11.304   42.289   16.261   7.9331   15.726   28.180   7.0867   16.109   6.8503 12.07108 9.856421 
1 1 1    6    5 -119 o   18.321   6.7620   16.029   13.336   17.626   28.326   15.575   15.116   20.453   8.9453   18.354   7.1014 2.099190 11.42143 
1 1 1    6    5 -118 o   31.111   4.6382   43.973   11.403   51.407   17.087   38.004   15.312   31.951   6.7713   27.236   6.8923 4.714886 9.662021 
1 1 1    6    5 -117 o   21.118   5.7371   21.464   10.130   68.495   27.904   14.325   10.872   33.917   9.6398   17.635   6.1535 16.28172 11.43644 
1 1 1    6    5 -116 o   10.379   4.5411  -0.4679   7.3060   5.6288   9.9466  -7.6115   10.767   13.946   5.6425   10.736   5.0083 3.210279 7.544639 
1 1 1    6    5 -115 o   34.316   2.8856   49.768   7.9970   51.480   10.831   47.716   11.858   34.396   3.9335   32.751   4.5655 1.644886 6.026312 
1 1 1    6    5 -114 o   13.290   5.0202   6.2720   7.4362   7.3896   10.098   4.9480   10.991   14.809   5.7834   14.282   5.8732 0.5271406 8.242688 
1 1 1    6    5 -113 o   12.234   4.9890   3.3397   7.8476  -2.1830   9.5650   14.713   13.727   11.416   5.0856   18.651   6.8645 -7.235141 8.543098 
1 1 1    6    5 -112 o   27.128   3.5308   31.527   7.6228   29.668   10.049   34.048   11.699   25.721   4.9727   27.379   5.4338 -1.657591 7.365741 
1 1 1    6    5 -111 o   8.3079   3.9183  -7.0989   6.9061  -6.1207   9.1398  -8.4005   10.543   10.199   4.7081   10.620   4.9548 -0.4207067 6.834911 
1 1 1    6    5 -110 o   30.090   3.1751   38.228   7.6706   35.255   9.9917   42.494   11.970   28.413   4.4608   31.055   4.8901 -2.641409 6.619025 
1 1 1    6    5 -109 o   14.736   4.9565   8.9810   7.0374   5.4935   9.1507   14.030   11.010   13.881   5.4799   18.130   6.1986 -4.249031 8.273562 
1 1 1    6    5 -108 o   6.8095   3.3581 -14.0684   6.6837 -21.5013   8.7163  -3.4612   10.413   7.3453   3.6587   11.726   5.2589 -4.380787 6.406422 
1 1 1    6    5 -107 o   20.310   4.4799   18.171   7.2174   16.180   9.3162   21.160   11.415   19.060   5.6163   21.584   6.1755 -2.524210 8.347437 
1 1 1    6    5 -106 o   19.671   4.6029   17.066   7.2490   14.114   9.6360   20.915   11.003   18.064   5.7855   21.525   6.0309 -3.460997 8.357278 
1 1 1    6    5 -105 o   58.648   2.0473  141.468   9.7722  158.668   12.163  110.145   16.414   62.008   2.4109   51.086   3.9727 10.92138 4.647043 
1 1 1    6    5 -104 o   35.748   2.8872   53.176   8.3419   55.685   10.256   48.271   14.340   36.417   3.4979   33.175   5.4949 3.242390 6.513719 
1 1 1    6    5 -103 o   65.345   2.1320  175.515   11.341  196.867   14.998  147.004   17.331   69.047   2.6698   59.326   3.6007 9.721050 4.482516 
1 1 1    6    5 -102 o   35.108   2.6727   51.061   7.5912   49.747   10.073   52.790   11.549   34.412   3.6465   35.329   4.0854 -0.9178696 5.476065 
1 1 1    6    5 -101 o   49.289   2.2372   99.900   8.9649  108.242   11.306   85.770   14.714   51.204   2.7184   45.201   4.0358 6.002567 4.865970 
1 1 1    6    5 -100 o   27.302   3.8361   31.508   8.3022   32.360   10.722   30.233   13.120   27.364   4.9907   26.110   6.2480 1.253914 7.996511 
1 1 1    6    5  -99 o   55.069   2.1018  124.405   9.4176  128.048   11.721  117.768   15.820   55.779   2.5848   53.223   3.6689 2.555405 4.487977 
1 1 1    6    5  -98 o   55.661   1.9963  126.959   9.0429  139.444   11.984  110.447   13.781   58.245   2.5301   51.665   3.2894 6.579395 4.149863 
1 1 1    6    5  -97 o   37.141   2.5969   56.850   7.8125   57.957   10.337   55.375   11.931   37.350   3.4336   36.354   4.0973 0.9957199 5.345780 
1 1 1    6    5  -96 o   82.928   1.6433  280.935   11.108  283.125   14.857  278.159   16.728   83.147   2.1940   82.356   2.4947 0.7906036 3.322208 
1 1 1    6    5  -95 o   48.199   2.1797   95.223   8.5415   87.171   11.270  106.089   13.092   45.988   3.0233   50.723   3.1825 -4.735630 4.389567 
1 1 1    6    5  -94 o   10.950   4.6721  -0.0279   7.3582  -8.1870   9.9019   10.034   10.996   10.509   4.8684   16.948   6.1587 -6.439659 7.850562 
1 1 1    6    5  -93 o   16.812   5.1556   11.745   7.7362   4.9579   10.373   20.254   11.614   14.672   5.8209   21.751   6.2310 -7.079746 8.526893 
1 1 1    6    5  -92 o   43.623   2.6006   78.145   9.2057   86.841   12.585   68.137   13.501   45.881   3.3889   40.476   4.1507 5.405190 5.358462 
1 1 1    6    5  -91 o  102.823   1.6135  431.511   13.524  433.814   18.284  428.728   20.095  103.037   2.1769  102.402   2.4074 0.6349030 3.245641 
1 1 1    6    5  -90 o   75.692   1.7380  233.858   10.724  239.961   14.502  226.492   15.930   76.593   2.3254   74.373   2.6318 2.220451 3.511945 
1 1 1    6    5  -89 o  107.330   1.6795  470.118   14.694  494.062   21.344  448.546   20.259  109.958   2.3813  104.772   2.3722 5.186302 3.361203 
1 1 1    6    5  -88 o  133.758   1.6609  730.054   18.109  740.110   25.954  720.514   25.279  134.596   2.3656  132.806   2.3351 1.789764 3.323994 
1 1 1    6    5  -87 o   65.265   2.1500  174.112   11.423  200.174   15.154  139.820   17.382   69.933   2.6631   58.302   3.6763 11.63109 4.539527 
1 1 1    6    5  -86 o   64.774   2.1870  171.497   11.531  176.023   18.739  168.738   14.628   65.475   3.5240   64.191   2.8024 1.284821 4.502442 
1 1 1    6    5  -85 o   52.437   2.2354  112.467   9.5332  117.574   13.509  107.401   13.455   53.531   3.1092   51.138   3.2445 2.392311 4.493801 
1 1 1    6    5  -84 o   65.692   1.9441  176.256   10.399  189.780   14.952  163.587   14.472   68.103   2.6988   63.209   2.8157 4.893627 3.900253 
1 1 1    6    5  -83 o   69.388   1.9031  196.597   10.754  217.585   15.289  176.046   15.129   72.947   2.5753   65.581   2.8368 7.365707 3.831370 
1 1 1    6    5  -82 o  157.679   1.5759  1014.05   20.255  1011.82   26.851  1016.99   30.856  157.464   2.0919  157.835   2.3983 -0.3714600 3.182432 
1 1 1    6    5  -81 o   93.014   1.7111  352.893   12.974  336.528   18.060  370.342   18.649   90.763   2.4433   95.220   2.4046 -4.457291 3.428095 
1 1 1    6    5  -80 o   26.316   4.0269   28.985   8.3638   41.400   11.854   16.677   11.803   31.431   4.7769   20.263   6.3929 11.16801 7.980446 
1 1 1    6    5  -79 o  150.225   1.6881  920.409   20.672  911.230   29.074  929.795   29.399  149.424   2.3870  150.938   2.3894 -1.514267 3.377424 
1 1 1    6    5  -78 o  141.601   1.6807  817.721   19.400  780.405   26.889  858.227   28.015  138.289   2.3854  145.021   2.3699 -6.732407 3.362507 
1 1 1    6    5  -77 o   86.073   1.7003  302.130   11.930  301.944   15.641  302.390   18.448   85.999   2.2330   86.034   2.6336 -0.3520203E-01 3.452848 
1 1 1    6    5  -76 o  177.886   1.6723  1290.39   24.249  1324.78   32.503  1247.22   36.416  180.205   2.2127  174.823   2.5554 5.381668 3.380277 
1 1 1    6    5  -75 o   44.896   2.7321   82.565   9.9512   87.871   13.038   75.162   15.401   46.252   3.4839   42.632   4.4996 3.619682 5.690692 
1 1 1    6    5  -74 o  135.026   1.7526  743.494   19.290  729.622   23.440  772.596   33.952  133.742   2.1501  137.568   3.0277 -3.826324 3.713459 
1 1 1    6    5  -73 o  136.296   1.7106  757.509   19.005  750.739   23.042  771.914   33.612  135.669   2.0836  137.514   2.9985 -1.845306 3.651368 
1 1 1    6    5  -72 o   79.599   1.7073  258.361   11.078  257.067   14.413  260.228   17.317   79.355   2.2303   79.815   2.6655 -0.4597626 3.475505 
1 1 1    6    5  -71 o  102.979   1.5587  432.378   13.084  440.570   17.117  420.865   20.292  103.936   2.0204  101.570   2.4509 2.366096 3.176328 
1 1 1    6    5  -70 o  211.757   1.8802  1828.58   32.455  1824.98   39.618  1835.91   56.591  211.521   2.2977  212.068   3.2737 -0.5464630 3.999581 
1 1 1    6    5  -69 o   11.882   4.8978   1.6403   7.6673  -6.7373   9.0312   23.264   14.510   10.283   4.7225   23.652   7.0193 -13.36888 8.460088 
1 1 1    6    5  -68 o  105.534   1.6392  454.106   14.102  447.709   17.009  468.171   25.222  104.779   1.9914  107.075   2.8923 -2.295891 3.511595 
1 1 1    6    5  -67 o  173.692   1.6037  1230.03   22.705  1273.41   30.354  1174.93   34.212  176.706   2.1073  169.716   2.4730 6.989792 3.249046 
1 1 1    6    5  -66 o  332.635   2.5079  4513.34   68.000  4552.63   83.691  4437.01  116.648  334.010   3.0739  329.539   4.3425 4.471283 5.320297 
1 1 1    6    5  -65 o  210.152   2.6098  1801.55   44.707  1801.55   44.707   0.0000   0.0000  210.152   2.6098  ?   ?  0.000000 2.609824 
1 1 1    6    5  -64 o  251.670   2.0654  2582.84   42.371  2579.63   51.767  2589.34   73.751  251.481   2.5253  251.852   3.5924 -0.3715668 4.391165 
1 1 1    6    5  -63 o  259.689   2.1063  2750.06   44.587  2783.53   54.990  2685.84   76.179  261.229   2.5824  256.502   3.6434 4.726715 4.465801 
1 1 1    6    5  -62 o  132.805   1.6091  719.064   17.420  712.122   21.215  733.431   30.519  132.153   1.9694  134.085   2.7923 -1.932266 3.416916 
1 1 1    6    5  -61 o  276.637   2.1916  3120.74   49.420  3148.02   60.834  3067.80   84.750  277.806   2.6864  274.134   3.7926 3.671539 4.647646 
1 1 1    6    5  -60 o  220.303   1.9110  1978.87   34.317  2081.31   43.136  1802.25   56.640  225.911   2.3424  210.160   3.3063 15.75113 4.051974 
1 1 1    6    5  -59 o  117.942   1.9401  567.176   18.652  567.176   18.652   0.0000   0.0000  117.942   1.9401  ?   ?  0.000000 1.940100 
1 1 1    6    5  -58 o  155.622   1.8115  987.397   22.980  979.195   25.483  1023.11   53.173  154.968   2.0173  158.247   4.1256 -3.279449 4.592399 
1 1 1    6    5  -57 o  242.820   2.2088  2404.26   43.719  2391.01   48.586  2460.63  100.220  242.136   2.4616  245.409   5.0099 -3.272949 5.581975 
1 1 1    6    5  -56 o  396.824   3.1584  6423.99  102.164  6413.86  113.992  6465.33  230.324  396.466   3.5272  397.350   7.1110 -0.8844299 7.937732 
1 1 1    6    5  -55 o   14.428   5.1309   7.2800   7.5853   8.3078   9.0361   4.8277   13.958   15.572   5.5931   16.585   6.6935 -1.013092 8.722696 
1 1 1    6    5  -54 o   58.652   1.9858  140.414   9.4806  142.024   11.345  136.688   17.261   58.970   2.3649   57.762   3.6853 1.207989 4.378843 
1 1 1    6    5  -53 o  165.536   1.8391  1117.13   24.816  1125.30   27.727  1084.26   55.637  166.134   2.0474  162.938   4.1924 3.195999 4.665679 
1 1 1    6    5  -52 o  185.199   1.9102  1398.29   28.836  1384.35   36.778  1420.52   46.460  184.258   2.4486  186.627   3.0540 -2.369095 3.914439 
1 1 1    6    5  -51 o  129.585   1.5218  684.511   16.075  673.968   23.401  693.932   22.120  128.571   2.2328  130.464   2.0800 -1.893204 3.051524 
1 1 1    6    5  -50 o  302.760   2.5442  3737.47   62.790  3753.20   81.194  3714.08   99.038  303.356   3.2835  301.720   4.0268 1.636139 5.195833 
1 1 1    6    5  -49 o  198.724   1.7633  1609.85   28.563  1631.88   41.347  1589.74   39.505  200.060   2.5354  197.462   2.4543 2.597580 3.528723 
1 1 1    6    5  -48 o  190.645   1.7378  1481.59   27.007  1472.01   38.881  1490.53   37.541  190.011   2.5103  191.205   2.4086 -1.193970 3.478936 
1 1 1    6    5  -47 o  350.719   2.5887  5014.98   74.006  5141.08  107.335  4900.70  102.177  355.039   3.7088  346.645   3.6160 8.393890 5.179830 
1 1 1    6    5  -46 o  484.285   3.1530  9563.31  124.469  9464.11  163.659  9699.41  191.701  481.685   4.1681  487.570   4.8234 -5.884705 6.374806 
1 1 1    6    5  -45 o  186.435   1.5975  1416.80   24.277  1412.15   32.622  1422.58   36.345  186.121   2.1502  186.802   2.3868 -0.6813507 3.212543 
1 1 1    6    5  -44 o  559.851   3.8799 12782.33  177.064 12930.34  253.172 12640.62  247.729  562.910   5.5175  556.575   5.4603 6.335205 7.762570 
1 1 1    6    5  -43 o  473.997   3.6550  9161.61  141.220  9273.71  226.268  9090.09  180.745  476.707   5.8229  472.067   4.6971 4.639557 7.481184 
1 1 1    6    5  -42 o  156.261   1.6231  995.289   20.674  987.354   30.222  1002.27   28.344  155.629   2.3823  156.802   2.2175 -1.173019 3.254639 
1 1 1    6    5  -41 o  369.170   2.4926  5555.80   75.009  5550.49   99.441  5562.81  114.252  368.965   3.3063  369.354   3.7948 -0.3884277 5.033099 
1 1 1    6    5  -40 o  162.701   1.5075  1078.99   19.993  1058.94   26.633  1104.87   30.261  161.178   2.0271  164.634   2.2549 -3.455750 3.032127 
1 1 1    6    5  -39 o  348.216   2.3779  4942.79   67.496  5034.92   90.832  4829.19  100.860  351.424   3.1708  344.156   3.5953 7.268280 4.793751 
1 1 1    6    5  -38 o  128.196   1.5744  669.861   16.453  659.867   24.367  678.234   22.304  127.231   2.3495  128.992   2.1213 -1.760368 3.165403 
1 1 1    6    5  -37 o  617.875   4.2526 15566.82  214.184 15688.97  305.541 15448.81  300.329  620.155   6.0441  615.395   5.9870 4.759583 8.507369 
1 1 1    6    5  -36 o  460.530   3.2589  8646.27  122.337  8585.69  172.865  8707.06  173.158  458.858   4.6216  462.091   4.5970 -3.233063 6.518597 
1 1 1    6    5  -35 f  108.986   1.6867  484.144   14.985  488.558   24.937  481.649   18.747  109.440   2.7976  108.703   2.1157 0.7372055 3.507526 
1 1 1    6    5  -34 f  255.190   2.2340  2654.48   46.471  2648.09   74.128  2658.61   59.648  254.862   3.5681  255.380   2.8653 -0.5180206 4.576208 
1 1 1    6    5  -33 o  401.369   3.1538  6567.20  103.184  6481.59  161.538  6626.20  134.109  398.686   4.9706  403.141   4.0810 -4.455017 6.431248 
1 1 1    6    5  -32 o  369.730   2.6867  5572.32   80.974  5617.68  141.138  5550.06   98.863  371.181   4.6647  368.979   3.2870 2.202087 5.706460 
1 1 1    6    5  -31 o  185.531   2.3821  1403.09   36.026   0.0000   0.0000  1403.09   36.026  ?   ?   185.531   2.3821 0.000000 2.382112 
1 1 1    6    5  -30 o  740.157   5.5157 22340.27  332.782 22685.22  533.499 22120.57  425.767  745.542   8.7786  736.379   7.0931 9.162476 11.28608 
1 1 1    6    5  -29 o  298.571   2.2972  3633.62   55.908  3522.49   78.285  3749.30   79.870  293.956   3.2671  303.273   3.2308 -9.316650 4.594804 
1 1 1    6    5  -28 o  962.517   6.4939 37785.84  509.509 37642.42  718.715 37930.73  722.408  960.351   9.1810  964.020   9.1931 -3.668823 12.99243 
1 1 1    6    5  -27 o  305.481   2.1645  3803.72   53.899  3824.19   72.174  3777.91   81.043  306.293   2.8907  304.428   3.2659 1.864685 4.361428 
1 1 1    6    5  -26 o  418.915   2.6025  7153.26   88.870  7226.24  127.142  7083.53  124.271  421.023   3.7046  416.846   3.6573 4.176849 5.205767 
1 1 1    6    5  -25 o  667.921   3.9642 18187.04  215.831 18421.82  308.900 17963.09  301.689  672.134   5.6380  663.716   5.5762 8.417847 7.929785 
1 1 1    6    5  -24 o  327.744   2.2708  4378.35   60.668  4402.95   93.218  4360.27   79.907  328.646   3.4796  327.058   2.9972 1.588715 4.592531 
1 1 1    6    5  -23 o  161.330   1.6380  1060.85   21.541  1146.34   38.933  1023.13   25.859  167.698   2.8481  158.434   2.0023 9.263748 3.481526 
1 1 1    6    5  -22 o  253.624   1.8850  2621.86   38.970  2619.78   59.684  2623.40   51.452  253.514   2.8882  253.694   2.4880 -0.1792450 3.812055 
1 1 1    6    5  -21 o   59.569   1.9488  144.787   9.4502  147.605   13.210  141.832   13.525   60.116   2.7026   58.920   2.8243 1.195869 3.909052 
1 1 1    6    5  -20 o  161.935   1.6083  1068.81   21.230  1113.13   37.400  1047.74   25.787  165.252   2.7765  160.329   1.9731 4.922729 3.406181 
1 1 1    6    5  -19 o  844.925   5.2944 29108.08  364.648 29138.99  557.539 29084.98  482.042  845.150   8.0929  844.464   7.0027 0.6857300 10.70203 
1 1 1    6    5  -18 o  324.929   2.2413  4303.40   59.364  4349.57   91.532  4269.89   77.991  326.651   3.4376  323.652   2.9562 2.998657 4.533854 
1 1 1    6    5  -17 o  116.669   1.6794  554.798   15.971  498.665   24.515  596.188   21.051  110.606   2.7191  120.941   2.1353 -10.33528 3.457340 
1 1 1    6    5  -16 f  992.812   6.6948 40198.06  541.799 40579.63  772.413 39828.50  760.173  997.204   9.5023  987.940   9.4394 9.264160 13.39391 
1 1 1    6    5  -15 o  594.881   4.0964 14426.64  198.643 14327.74  279.181 14528.05  282.698  592.773   5.7778  596.900   5.8101 -4.127808 8.193925 
1 1 1    6    5  -14 o  505.570   3.5270 10419.35  145.351 10445.78  205.942 10393.11  205.174  506.168   4.9913  504.891   4.9853 1.277344 7.054500 
1 1 1    6    5  -13 o  674.320   4.2658 18537.13  234.477 18780.60  362.167 18361.43  307.661  678.623   6.5470  671.057   5.6244 7.565979 8.631205 
1 1 1    6    5  -12 o  395.371   2.6300  6371.71   84.760  6481.28  131.355  6293.54  110.950  398.732   4.0414  392.925   3.4640 5.806396 5.322788 
1 1 1    6    5  -11 o  588.548   4.0532 14120.92  194.454 13999.48  273.017 14245.95  277.026  585.950   5.7160  591.084   5.7496 -5.133911 8.107445 
1 1 1    6    5  -10 o  338.061   2.3066  4658.28   63.564  4561.37   95.530  4735.28   85.149  334.511   3.5034  340.834   3.0648 -6.323639 4.654775 
1 1 1    6    5   -9 o  359.276   2.6146  5261.38   76.571  5168.06  130.775  5310.06   94.455  356.044   4.5059  360.926   3.2105 -4.881561 5.532681 
1 1 1    6    5   -8 o  403.162   2.8821  6625.40   94.716  6669.95  164.846  6603.44  115.726  404.472   4.9998  402.483   3.5274 1.989166 6.118845 
1 1 1    6    5   -7 o  439.161   3.4025  7861.72  121.803  7842.01  192.083  7874.98  157.523  438.561   5.3731  439.509   4.3968 -0.9478149 6.942755 
1 1 1    6    5   -6 o  905.936   6.1170 33466.39  451.725 33519.98  783.001 33439.67  553.039  906.228   10.600  905.466   7.4929 0.7614746 12.98053 
1 1 1    6    5   -5 o  749.048   4.7163 22874.32  287.971 22735.97  437.453 22980.12  382.551  746.639   7.1876  750.697   6.2516 -4.058350 9.525949 
1 1 1    6    5   -4 o  595.526   3.5518 14456.96  172.417 14688.15  246.994 14237.23  240.794  600.219   5.0483  590.936   4.9988 9.283203 7.104443 
1 1 1    6    5   -3 o  171.061   1.9734  1192.70   27.517  1233.12   39.557  1154.81   38.304  173.931   2.7900  168.318   2.7918 5.613434 3.946949 
1 1 1    6    5   -2 o  633.832   4.3433 16377.89  224.405 16521.08  319.772 16238.96  314.994  636.519   6.1630  631.063   6.1234 5.456238 8.687865 
1 1 1    6    5   -1 o  137.001   1.8312  765.014   20.450  821.966   29.759  714.059   28.149  142.006   2.5708  132.357   2.6090 9.649109 3.662781 
1 1 1    6    5    0 o  539.274   4.5790 11856.06  201.286 12029.35  288.112 11690.83  281.331  543.127   6.5076  535.433   6.4458 7.693970 9.159565 
1 1 1    6    5    1 o  1025.90   8.4576 42934.86  707.279 42731.69  996.121 43141.43  1004.42  1023.01   11.945  1027.90   11.988 -4.886475 16.92308 
1 1 1    6    5    2 o  401.912   3.5245  6584.71  115.469  6843.15  168.296  6354.85  158.720  409.690   5.0394  394.805   4.9319 14.88504 7.051207 
1 1 1    6    5    3 o  107.280   2.0434  469.104   17.869  469.104   17.869   0.0000   0.0000  107.280   2.0434  ?   ?  0.000000 2.043412 
1 1 1    6    5    4 o  843.100   5.7034 28983.06  391.968 29131.20  556.828 28837.55  551.859  845.076   8.0833  840.808   8.0518 4.267212 11.40930 
1 1 1    6    5    5 o   80.904   1.4919  266.780   9.8386  269.408   13.925  264.160   13.903   81.273   2.1037   80.476   2.1211 0.7963943 2.987453 
1 1 1    6    5    6 o  108.077   1.5872  476.084   13.983  500.229   22.204  460.216   18.000  110.781   2.4588  106.259   2.0782 4.521736 3.219389 
1 1 1    6    5    7 o  697.593   5.8269 19842.62  331.344 20195.11  475.620 19510.22  461.865  703.605   8.2927  691.578   8.1929 12.02649 11.65728 
1 1 1    6    5    8 o  306.020   2.3058  3817.12   57.519  4099.21  104.850  3695.68   68.796  317.104   4.0563  301.108   2.8029 15.99597 4.930478 
1 1 1    6    5    9 o  406.959   2.9068  6750.78   96.427  6620.87  164.383  6818.94  119.063  402.981   5.0042  408.996   3.5713 -6.015900 6.147867 
1 1 1    6    5   10 o  510.866   3.2951 10638.51  137.216 10455.48  206.680 10782.77  183.489  506.405   5.0069  514.290   4.3769 -7.884827 6.650252 
1 1 1    6    5   11 o  632.958   4.0187 16332.30  207.349 16517.59  319.861 16198.00  272.314  636.447   6.1654  630.301   5.3001 6.146362 8.130424 
1 1 1    6    5   12 o  519.211   3.3436 10988.97  141.512 10983.49  216.141 10993.08  187.217  519.030   5.1087  519.279   4.4229 -0.2485962 6.757279 
1 1 1    6    5   13 o  538.085   3.7313 11802.86  163.664 11855.52  232.393 11751.04  230.529  539.234   5.2870  536.853   5.2679 2.380676 7.463433 
1 1 1    6    5   14 o  425.257   3.3159  7371.77  114.943  7715.88  153.822  6936.69  172.965  435.046   4.3376  412.474   5.1443 22.57208 6.728908 
1 1 1    6    5   15 o  304.581   2.3027  3781.30   57.171  3805.83   81.165  3757.15   80.542  305.556   3.2587  303.595   3.2545 1.960693 4.605558 
1 1 1    6    5   16 f  142.397   1.6932  826.460   19.654  878.399   31.723  794.109   25.037  146.799   2.6511  139.580   2.2005 7.218781 3.445359 
1 1 1    6    5   17 o  460.424   3.2452  8641.43  121.798  8619.75  171.871  8663.31  172.629  459.813   4.5855  460.973   4.5941 -1.160278 6.490966 
1 1 1    6    5   18 o  579.705   4.0005 13699.88  189.042 13684.48  267.114 13715.34  267.579  579.315   5.6565  579.967   5.6599 -0.6525879 8.001921 
1 1 1    6    5   19 o  308.718   2.1580  3884.70   54.305  4022.30   85.215  3790.61   70.468  314.123   3.3280  304.949   2.8348 9.174377 4.371712 
1 1 1    6    5   20 o  482.789   3.1372  9501.25  123.461  9575.75  189.900  9446.71  162.488  484.632   4.8070  481.376   4.1410 3.256073 6.344702 
1 1 1    6    5   21 o  278.398   2.1699  3159.14   49.242  3220.10   70.766  3101.91   68.564  281.062   3.0888  275.856   3.0491 5.205902 4.340258 
1 1 1    6    5   22 o  419.700   2.9988  7180.28  102.593  7147.21  144.669  7213.73  145.512  418.705   4.2387  420.649   4.2437 -1.943848 5.997941 
1 1 1    6    5   23 o  637.043   4.3746 16545.05  227.163 16704.05  324.096 16391.50  318.492  640.004   6.2123  633.991   6.1628 6.012878 8.750638 
1 1 1    6    5   24 o  469.683   3.3125  8992.65  126.823  9163.29  182.266  8832.49  176.580  474.077   4.7165  465.444   4.6541 8.633789 6.626187 
1 1 1    6    5   25 o  697.636   4.7670 19843.49  271.088 19768.06  382.254 19919.80  384.507  696.187   6.7358  698.853   6.7497 -2.666016 9.535693 
1 1 1    6    5   26 o  556.599   3.8604 12629.70  175.151 12473.49  245.283 12792.23  250.193  553.081   5.4405  560.101   5.4799 -7.020264 7.721971 
1 1 1    6    5   27 o  501.538   4.2936 10255.19  175.535 10370.90  250.954 10144.35  245.618  504.282   6.1050  498.746   6.0415 5.535187 8.588988 
1 1 1    6    5   28 o  663.058   5.5579 17928.07  300.400 17803.89  422.723 18054.75  426.969  660.588   7.8503  665.224   7.8740 -4.635620 11.11877 
1 1 1    6    5   29 o  389.224   3.4388  6175.79  109.104  6158.48  154.335  6193.09  154.258  388.638   4.8717  389.729   4.8557 -1.091034 6.878309 
1 1 1    6    5   30 o  457.861   3.9542  8546.59  147.579  8491.66  207.932  8602.36  209.494  456.324   5.5900  459.288   5.5957 -2.964355 7.909454 
1 1 1    6    5   31 o  432.882   3.7629  7639.36  132.779  7547.35  186.304  7734.34  189.286  430.211   5.3126  435.507   5.3320 -5.296082 7.526835 
1 1 1    6    5   32 o  331.960   2.7007  4491.97   73.081  4561.61  117.019  4447.44   93.572  334.487   4.2918  330.295   3.4754 4.192535 5.522516 
1 1 1    6    5   33 o  482.388   3.3846  9486.31  133.089  9254.39  184.508  9737.85  192.156  476.402   4.7512  488.684   4.8238 -12.28226 6.770760 
1 1 1    6    5   34 f  573.887   3.9646 13427.68  185.464 13218.39  258.876 13648.36  265.832  569.307   5.5784  578.488   5.6374 -9.181030 7.930864 
1 1 1    6    5   35 f  328.324   2.6840  4394.20   71.832  4339.51  113.010  4431.28   93.046  326.236   4.2496  329.689   3.4622 -3.452972 5.481433 
1 1 1    6    5   36 o  273.729   2.3437  3054.24   52.294  3182.02   85.648  2978.28   66.031  279.369   3.7610  270.293   2.9969 9.075409 4.809019 
1 1 1    6    5   37 o  426.117   3.3262  7402.54  115.535  7521.98  185.680  7327.08  147.584  429.451   5.3042  423.902   4.2711 5.548920 6.810008 
1 1 1    6    5   38 o  433.407   3.3772  7658.22  119.314  7884.33  193.581  7519.70  151.516  439.657   5.4015  429.428   4.3284 10.22845 6.921800 
1 1 1    6    5   39 o  448.612   3.1838  8204.89  116.427  8336.77  167.435  8081.43  162.006  452.137   4.5430  445.163   4.4645 6.973602 6.369505 
1 1 1    6    5   40 o  210.962   1.8434  1814.10   31.699  1806.56   45.559  1821.17   44.134  210.512   2.6550  211.363   2.5616 -0.8508453 3.689266 
1 1 1    6    5   41 o  375.329   2.9895  5743.23   91.463  5718.28  144.723  5759.81  118.019  374.431   4.7416  375.835   3.8523 -1.403931 6.109287 
1 1 1    6    5   42 o  217.768   1.8672  1933.06   33.145  1964.02   48.173  1905.23   45.676  219.490   2.6925  216.182   2.5920 3.307968 3.737355 
1 1 1    6    5   43 o  377.060   2.7483  5796.27   84.472  5818.14  120.481  5775.13  118.467  377.716   3.9131  376.321   3.8619 1.395935 5.497877 
1 1 1    6    5   44 o   51.095   2.1039  106.603   8.7441  100.285   15.436  109.589   10.611   49.439   3.8609   51.786   2.5212 -2.347145 4.611144 
1 1 1    6    5   45 o  308.578   2.3478  3881.84   59.056  3875.93   84.219  3887.56   82.834  308.305   3.3512  308.770   3.2911 -0.4650574 4.696958 
1 1 1    6    5   46 o  200.599   1.7907  1640.32   29.281  1722.14   43.629  1573.27   39.497  205.524   2.6042  196.443   2.4666 9.081085 3.586880 
1 1 1    6    5   47 o  245.602   2.0035  2459.00   40.110  2461.04   57.610  2457.07   55.879  245.678   2.8767  245.484   2.7925 0.1949158 4.009161 
1 1 1    6    5   48 o   80.504   1.6137  264.183   10.589  243.042   16.445  279.157   13.841   77.163   2.6184   82.751   2.0519 -5.587875 3.326561 
1 1 1    6    5   49 o  100.801   2.0325  414.230   16.701   0.0000   0.0000  414.230   16.701  ?   ?   100.801   2.0325 0.000000 2.032535 
1 1 1    6    5   50 o  359.747   3.2364  5278.17   94.905  5159.95  189.242  5317.89  109.698  355.341   6.5333  361.060   3.7272 -5.719360 7.521742 
1 1 1    6    5   51 o  480.059   3.7070  9401.47  145.063  9230.96  226.703  9519.69  188.768  475.359   5.8506  482.918   4.7953 -7.559021 7.564703 
1 1 1    6    5   52 o   62.495   2.1639  159.428   11.007  152.450   14.073  170.420   17.663   61.076   2.8345   64.549   3.3686 -3.473492 4.402497 
1 1 1    6    5   53 o  205.553   1.8396  1722.53   30.823  1693.14   37.337  1785.42   54.616  203.778   2.2477  209.216   3.2025 -5.437485 3.912583 
1 1 1    6    5   54 o  332.752   2.4904  4515.14   67.551  4461.10   82.234  4627.26  118.450  330.712   3.0505  336.685   4.3159 -5.972931 5.285127 
1 1 1    6    5   55 o  158.873   1.8198  1029.04   23.568  1032.34   26.257  1015.36   53.459  159.122   2.0243  157.662   4.1633 1.459885 4.629389 
1 1 1    6    5   56 o  184.784   1.9176  1392.15   28.884  1374.22   31.956  1472.21   67.520  183.583   2.1354  189.888   4.3622 -6.304916 4.856794 
1 1 1    6    5   57 o  107.980   1.7518  475.362   15.419  471.871   17.026  491.285   36.362  107.579   1.9415  109.626   4.0762 -2.046906 4.514969 
1 1 1    6    5   58 o  188.555   1.7644  1449.49   27.118  1487.82   33.558  1377.38   46.036  191.016   2.1552  183.745   3.0736 7.270905 3.753945 
1 1 1    6    5   59 o   73.021   1.7429  217.387   10.374  217.160   12.569  217.874   18.373   72.946   2.1161   73.012   3.0942 -0.6570435E-01 3.748561 
1 1 1    6    5   60 o  107.205   1.7299  468.568   15.117  472.427   16.954  453.604   33.388  107.641   1.9322  105.338   3.8951 2.302460 4.347995 
1 1 1    6    5   61 o  114.662   1.5872  536.006   14.835  532.941   18.035  542.419   26.087  114.326   1.9352  115.313   2.7753 -0.9866409 3.383352 
1 1 1    6    5   62 o  103.027   1.5957  432.749   13.401  427.513   16.277  443.766   23.612  102.394   1.9502  104.262   2.7807 -1.867638 3.396394 
1 1 1    6    5   63 o  163.354   1.6785  1087.95   22.350  1098.12   27.418  1067.82   38.583  164.102   2.0497  161.780   2.9258 2.321915 3.572309 
1 1 1    6    5   64 o   93.610   1.6222  357.265   12.378  351.444   15.043  369.469   21.782   92.837   1.9879   95.123   2.8122 -2.286392 3.443897 
1 1 1    6    5   65 o   69.931   1.9183  199.560   10.925  195.411   13.715  206.764   18.072   69.174   2.4360   71.113   3.1253 -1.939369 3.962530 
1 1 1    6    5   66 o  126.448   1.6043  651.890   16.536  655.838   20.212  643.898   28.758  126.820   1.9551  125.627   2.8083 1.193085 3.421861 
1 1 1    6    5   67 o  146.419   1.5287  874.060   18.246  887.305   24.010  855.954   28.071  147.508   1.9968  144.863   2.3772 2.645645 3.104541 
1 1 1    6    5   68 o  109.772   1.6297  491.306   14.582  509.561   17.685  452.531   25.774  111.784   1.9408  105.262   3.0069 6.522507 3.578877 
1 1 1    6    5   69 o   43.358   2.4919   76.940   8.7698   77.516   10.301   75.424   16.716   43.486   2.9231   42.668   4.8945 0.8182335 5.700976 
1 1 1    6    5   70 o   91.102   1.6802  338.411   12.478  347.645   15.009  317.747   22.453   92.329   1.9942   88.176   3.1288 4.153030 3.710273 
1 1 1    6    5   71 o  199.586   1.6961  1624.27   27.595  1641.27   36.513  1601.64   42.139  200.594   2.2330  198.130   2.6091 2.464417 3.434222 
1 1 1    6    5   72 o   85.896   1.6557  300.846   11.593  302.329   15.071  298.698   18.142   86.094   2.1476   85.521   2.6055 0.5731430 3.376485 
1 1 1    6    5   73 o   59.571   2.0304  144.906   9.8451  128.467   12.566  171.031   15.842   56.039   2.7595   64.659   3.0140 -8.620407 4.086405 
1 1 1    6    5   74 o  138.688   1.6271  784.314   18.394  781.662   24.088  788.024   28.491  138.430   2.1347  138.970   2.5151 -0.5401917 3.298826 
1 1 1    6    5   75 o   94.103   1.8346  361.143   14.073  354.100   17.095  375.951   24.789   93.167   2.2510   95.903   3.1753 -2.736183 3.892195 
1 1 1    6    5   76 o   18.217   5.6133   13.577   9.1571   23.399   12.767   3.1723   13.141   23.505   6.4632   15.631   6.4243 7.873637 9.112914 
1 1 1    6    5   77 o   15.526   5.5225   8.4874   8.7877   2.0717   12.033   15.819   12.864   14.696   6.1040   20.152   6.6999 -5.455436 9.063517 
1 1 1    6    5   78 o   37.668   3.0142   58.312   9.1779   64.688   12.693   51.326   13.286   39.572   3.9894   35.083   4.7693 4.488491 6.217845 
1 1 1    6    5   79 o   56.171   2.0259  128.886   9.2610  142.332   12.084  109.752   14.416   58.997   2.5186   51.707   3.4399 7.290108 4.263324 
1 1 1    6    5   80 o  160.782   1.5797  1054.27   20.703  1044.96   27.069  1067.40   32.136  160.034   2.0751  161.710   2.4379 -1.675995 3.201451 
1 1 1    6    5   81 o   83.693   1.6308  285.688   11.126  291.282   14.493  277.662   17.361   84.489   2.1044   82.425   2.5871 2.063919 3.334909 
1 1 1    6    5   82 o   45.659   2.3272   85.318   8.6331   84.371   11.144   86.740   13.652   45.339   3.0328   45.899   3.6797 -0.5604134 4.768431 
1 1 1    6    5   83 o   77.095   1.8686  242.505   11.743  230.904   16.591  254.152   16.623   75.136   2.7133   78.844   2.5900 -3.708244 3.750986 
1 1 1    6    5   84 o   57.707   1.9877  136.061   9.3359  127.948   12.105  147.969   14.666   55.901   2.6643   60.091   3.0036 -4.189369 4.014949 
1 1 1    6    5   85 o   37.838   2.6511   58.780   8.1252   60.740   10.678   56.084   12.523   38.372   3.4506   36.739   4.2605 1.633480 5.482561 
1 1 1    6    5   86 o   62.441   2.0114  159.309   10.225  151.898   14.167  167.367   14.772   60.890   2.8622   63.924   2.8420 -3.034012 4.033465 
1 1 1    6    5   87 o  148.899   1.8236  904.808   22.134  942.469   35.117  879.986   28.510  151.825   2.8375  146.775   2.3829 5.050827 3.705368 
1 1 1    6    5   88 o  107.481   1.8152  471.490   15.903  511.574   24.967  444.122   20.630  111.857   2.7382  104.257   2.4275 7.599579 3.659318 
1 1 1    6    5   89 o   53.716   2.2180  118.063   9.6909  108.200   13.434  128.765   13.993   51.302   3.2287   56.004   3.0771 -4.701286 4.460200 
1 1 1    6    5   90 o  122.860   1.6794  616.077   16.819  613.049   23.617  619.193   23.959  122.475   2.3656  123.084   2.3880 -0.6089325 3.361355 
1 1 1    6    5   91 o  156.453   1.7398  999.267   22.189  1015.96   31.456  982.737   31.304  157.628   2.4481  155.024   2.4772 2.604645 3.482781 
1 1 1    6    5   92 o   65.362   1.9779  174.686   10.526  160.322   13.900  193.993   16.116   62.521   2.7341   68.762   2.8816 -6.241295 3.972263 
1 1 1    6    5   93 o   27.437   3.6788   31.487   8.0206   38.007   10.594   22.732   12.277   30.031   4.4632   22.963   6.3471 7.068081 7.759267 
1 1 1    6    5   94 o   36.577   2.7108   55.107   8.0250   57.779   10.555   51.447   12.354   37.330   3.5100   35.022   4.4261 2.307941 5.648936 
1 1 1    6    5   95 o  143.431   1.5644  840.070   18.290  851.101   24.303  825.659   27.777  144.268   2.0666  142.014   2.3995 2.254013 3.166741 
1 1 1    6    5   96 o   74.150   1.8165  224.726   10.979  226.324   13.541  221.658   18.758   74.326   2.2376   73.371   3.1437 0.9550705 3.858717 
1 1 1    6    5   97 o   8.5148   4.0532  -9.7524   7.7258  -9.2207   9.8479 -10.6034   12.459   10.218   4.7744   11.658   5.4215 -1.440028 7.224089 
1 1 1    6    5   98 o   50.958   2.1830  106.552   9.0466   95.628   11.061  128.618   15.721   48.157   2.8303   55.721   3.4786 -7.564449 4.484548 
1 1 1    6    5   99 o   23.413   3.8702   23.295   7.1285   18.496   9.3966   29.801   10.941   20.587   5.4963   26.183   5.3083 -5.595856 7.641207 
1 1 1    6    5  100 o   15.819   4.8804   10.528   6.9194   22.540   9.1396  -5.6037   10.591   22.732   5.0623   11.487   5.2133 11.24526 7.266716 
1 1 1    6    5  101 o   29.839   3.0601   37.126   7.3377   34.042   9.5592   41.548   11.448   28.251   4.2853   31.157   4.6498 -2.906427 6.323296 
1 1 1    6    5  102 o   25.151   3.6283   26.798   7.2237   20.001   9.3368   36.933   11.401   21.289   5.3791   29.201   4.9675 -7.912096 7.321914 
1 1 1    6    5  103 o   28.113   3.5289   33.349   7.9091   36.559   9.6263   26.682   13.875   29.274   4.1503   24.292   6.7600 4.981459 7.932420 
1 1 1    6    5  104 o   29.468   3.3977   36.556   8.0124   39.572   9.7766   30.384   13.983   30.486   4.0330   25.849   6.6108 4.637356 7.743865 
1 1 1    6    5  105 o   38.787   2.7568   62.499   8.6593   64.070   12.167   60.886   12.326   38.918   3.8873   37.869   4.0563 1.049530 5.618230 
1 1 1    6    5  106 o   32.599   2.9257   44.402   7.6920   43.687   10.124   45.379   11.831   32.011   3.9643   32.393   4.6106 -0.3817139 6.080592 
1 1 1    6    5  107 o   39.088   2.5146   63.379   7.9697   70.935   10.497   53.095   12.246   41.163   3.1524   35.136   4.3697 6.027405 5.388094 
1 1 1    6    5  108 o  108.563   1.5734  483.109   13.924  485.550   18.425  479.859   21.261  108.605   2.0812  107.779   2.4200 0.8262558 3.191805 
1 1 1    6    5  109 o   50.126   2.1453  103.733   8.7455  104.871   11.490  102.168   13.483   50.169   2.8211   49.285   3.3766 0.8839836 4.400009 
1 1 1    6    5  110 o   48.600   2.1896   97.626   8.6522  109.592   11.422   81.517   13.252   51.299   2.7416   43.806   3.7473 7.492664 4.643074 
1 1 1    6    5  111 o   21.941   4.3167   21.226   7.4451   27.343   9.9480   13.436   11.225   24.656   5.1173   17.818   6.2503 6.838646 8.077928 
1 1 1    6    5  112 o   64.357   1.8912  170.686   9.9108  155.275   12.943  192.527   15.409   61.078   2.6057   67.921   2.7890 -6.842991 3.816864 
1 1 1    6    5  113 o   27.530   4.4528   33.463   9.6515   38.988   12.195   24.200   15.789   29.329   5.2958   22.428   7.4216 6.901478 9.117374 
1 1 1    6    5  114 o   32.447   3.4473   45.065   8.9785   50.534   13.180   40.329   12.265   33.572   4.9655   29.777   5.2444 3.794880 7.222191 
1 1 1    6    5  115 o   32.809   3.3824   46.122   8.9166   39.575   13.177   51.651   12.111   29.079   5.7627   34.159   4.4555 -5.079494 7.284241 
1 1 1    6    5  116 o   35.728   3.1320   54.414   9.0293   68.868   13.453   42.566   12.180   39.540   4.2402   30.505   5.0767 9.035400 6.614516 
1 1 1    6    5  117 o   15.304   5.1936   10.366   7.7272   4.0944   10.385   18.145   11.566   13.529   5.6489   19.373   6.3492 -5.844092 8.498364 
1 1 1    6    5  118 o   17.805   5.3774   15.006   8.4594   8.8862   12.191   20.688   11.748   15.695   6.2828   20.409   6.3695 -4.714275 8.946697 
1 1 1    6    5  119 o   13.459   5.2454   6.5140   8.2929   10.257   12.200   3.2989   11.307   16.052   6.3303   13.519   5.7806 2.532168 8.572493 
1 1 1    6    5  120 o   56.115   2.5491  133.031   11.630  120.830   14.931  151.849   18.543   52.662   3.4981   58.603   3.9039 -5.940598 5.241835 
1 1 1    6    5  121 o   18.586   5.4740   16.987   8.8519   14.682   10.710   21.956   15.724   17.360   6.1039   20.209   7.3615 -2.848274 9.562952 
1 1 1    6    5  122 o   20.462   5.2209   20.452   8.7353   15.241   10.483   32.286   15.799   17.538   6.0467   23.966   7.3712 -6.427414 9.534044 
1 1 1    6    5  123 o   34.692   3.3902   52.807   9.4649   48.276   11.343   63.193   17.173   32.392   4.4105   35.331   6.1881 -2.939114 7.599010 
1 1 1    6    5  124 o   11.267   4.9342   0.6781   8.6443   10.835   10.406 -21.9320   15.526   15.534   5.9222   10.700   5.2450 4.833507 7.910879 
1 1 1    6    5  125 o   13.588   5.3953   6.9898   8.9184   4.8443   10.673   11.955   16.236   13.415   5.6713   16.810   7.0441 -3.395253 9.043427 
1 1 1    6    5  126 o   13.692   5.6267   6.3685   10.078   7.3295   12.783   4.7899   16.383   14.780   6.2253   15.099   6.6949 -0.3187895 9.142006 
1 1 1    6    5  127 o   32.994   4.1444   49.961   10.901   41.642   13.775   63.902   17.832   28.263   6.1540   34.740   6.5367 -6.477747 8.977735 
1 1 1    6    5  128 o   27.484   4.9854   36.637   10.758   38.253   13.652   33.990   17.472   26.762   6.3536   23.441   7.8087 3.321262 10.06696 
1 1 1    6    5  129 o   19.731   6.2147   20.995   11.158   17.062   15.055   25.789   16.621   17.897   7.0400   20.665   7.5622 -2.768272 10.33196 
1 1 1    6    5  130 o   10.685   5.0782  -8.9623   12.031  -5.6155   14.553 -16.1880   21.383   12.330   5.7751   13.195   6.3976 -0.8648911 8.618641 
1 1 1    6    5  131 o   19.309   6.6587   20.975   12.713   22.150   15.297   18.350   22.859   19.426   7.2287   18.429   8.0485 0.9966412 10.81821 
1 1 1    6    5  132 o   11.602   5.4052  -4.8679   12.473  -4.8679   12.473   0.0000   0.0000   11.602   5.4052  ?   ?  0.000000 5.405244 
1 1 1    6    6    0 o  378.879   4.7666  5851.66  147.211   0.0000   0.0000  5851.66  147.211  ?   ?   378.879   4.7666 0.000000 4.766552 
1 1 1    6    6    1 o  569.026   4.3128 13200.41  200.047 13099.75  444.466 13225.99  224.020  566.549   9.6242  569.558   4.8252 -3.008545 10.76604 
1 1 1    6    6    2 o  537.838   3.7387 11792.25  163.910 11780.94  283.776 11797.91  200.792  537.471   6.4771  537.940   4.5791 -0.4688110 7.932294 
1 1 1    6    6    3 o  670.393   4.5892 18323.06  250.786 18849.06  445.083 18078.38  303.563  679.734   8.0328  665.853   5.5929 13.88074 9.788046 
1 1 1    6    6    4 o  613.004   4.2213 15319.50  210.931 15720.63  304.941 14951.50  292.078  620.894   6.0251  605.521   5.9174 15.37341 8.444966 
1 1 1    6    6    5 o  408.822   2.7198  6812.75   90.637  6991.88  141.450  6687.96  118.059  414.132   4.1901  405.045   3.5757 9.086731 5.508432 
1 1 1    6    6    6 o  449.276   2.9513  8227.86  108.086  8262.27  165.746  8202.40  142.572  450.175   4.5167  448.558   3.8992 1.617035 5.966973 
1 1 1    6    6    7 o  587.696   3.7573 14079.97  179.998 14200.18  277.007 13992.13  236.805  590.117   5.7586  585.815   4.9590 4.302002 7.599552 
1 1 1    6    6    8 o  859.552   5.3906 30125.70  377.698 30319.24  580.246 29983.39  497.534  862.060   8.2573  857.383   7.1189 4.677063 10.90237 
1 1 1    6    6    9 o  270.894   2.1412  2991.12   47.282  2987.81   66.789  2994.45   66.944  270.735   3.0264  271.035   3.0300 -0.3002014 4.282540 
1 1 1    6    6   10 o  225.150   2.0930  2066.23   38.412  2067.39   49.659  2064.49   60.609  225.208   2.7051  225.044   3.3039 0.1640625 4.270059 
1 1 1    6    6   11 o  532.813   3.4388 11572.65  149.353 11892.08  233.330 11350.94  194.395  540.050   5.3003  527.650   4.5196 12.39990 6.965656 
1 1 1    6    6   12 o  188.790   1.7731  1452.73   27.286  1555.91   49.686  1408.18   32.650  195.369   3.1199  185.871   2.1550 9.498535 3.791797 
1 1 1    6    6   13 o  746.036   4.7076 22692.02  286.285 23159.39  445.017 22362.03  373.934  753.503   7.2453  740.499   6.1949 13.00464 9.532618 
1 1 1    6    6   14 o  256.316   2.2819  2677.90   47.677  2835.83   78.767  2586.58   59.895  263.749   3.6637  251.902   2.9169 11.84781 4.683070 
1 1 1    6    6   15 o  434.474   3.1010  7694.84  109.825  7666.05  154.935  7723.92  155.701  433.628   4.3832  435.261   4.3884 -1.633392 6.202478 
1 1 1    6    6   16 o  593.621   4.1001 14366.17  198.400 14425.16  281.637 14308.06  279.535  594.758   5.8092  592.340   5.7893 2.417786 8.201393 
1 1 1    6    6   17 o  281.812   2.4203  3237.18   55.599  3199.26   87.318  3263.04   72.105  280.137   3.8238  282.927   3.1265 -2.789703 4.939290 
1 1 1    6    6   18 o  407.967   3.2193  6784.69  107.059  6907.49  171.862  6706.83  136.856  411.588   5.1225  405.596   4.1394 5.991821 6.585914 
1 1 1    6    6   19 o  390.928   3.1036  6229.74   98.900  6398.65  159.896  6125.08  125.865  396.143   4.9516  387.610   3.9836 8.533051 6.355131 
1 1 1    6    6   20 o  310.623   2.5851  3932.99   65.455  4124.50  107.214  3819.19   82.645  318.068   4.1352  306.085   3.3124 11.98288 5.298259 
1 1 1    6    6   21 o  147.374   2.3069  885.293   27.714  894.577   34.055  867.088   47.687  148.141   2.8201  145.782   4.0167 2.359512 4.907879 
1 1 1    6    6   22 o  611.815   5.9594 15265.87  297.207 15422.39  367.229 14968.70  506.002  614.844   7.3272  605.455   10.253 9.388672 12.60171 
1 1 1    6    6   23 o  250.684   2.5047  2561.58   51.181  2554.38   59.110  2583.18  102.308  250.326   2.8968  251.695   4.9865 -1.369354 5.766887 
1 1 1    6    6   24 o  104.510   1.9724  445.198   16.803  512.505   24.690  387.122   22.934  112.129   2.7012   97.408   2.8916 14.72028 3.956999 
1 1 1    6    6   25 o  312.400   2.1850  3978.02   55.641  3985.29   85.130  3972.60   73.518  312.665   3.3402  312.176   2.8891 0.4898376 4.416258 
1 1 1    6    6   26 o  495.669   3.2124 10015.65  129.795  9992.13  197.998 10033.36  171.877  495.019   4.9069  496.069   4.2505 -1.049896 6.491831 
1 1 1    6    6   27 o  198.639   1.6330  1608.27   26.441  1610.56   40.558  1606.58   34.870  198.773   2.5031  198.531   2.1547 0.2420654 3.302809 
1 1 1    6    6   28 o  279.099   2.0080  3175.11   45.684  3097.43   68.712  3236.66   61.158  275.647   3.0581  281.781   2.6626 -6.133789 4.054766 
1 1 1    6    6   29 o  160.980   1.4195  1056.26   18.627  1044.20   26.770  1067.57   25.936  160.055   2.0518  161.837   1.9660 -1.782074 2.841687 
1 1 1    6    6   30 o   73.678   1.4982  221.259   8.9981  231.093   13.607  213.617   11.995   75.262   2.2203   72.364   2.0356 2.898140 3.012226 
1 1 1    6    6   31 o  402.267   2.5100  6596.35   82.306  6491.90  115.258  6705.03  117.572  399.039   3.5434  405.536   3.5566 -6.496887 5.020484 
1 1 1    6    6   32 o  465.007   3.0410  8815.14  115.269  8945.40  154.595  8652.06  172.978  468.386   4.0491  460.613   4.6070 7.772644 6.133481 
1 1 1    6    6   33 o  333.849   2.3072  4543.28   62.787  4595.24   84.093  4477.83   94.386  335.733   3.0728  331.403   3.4939 4.329437 4.652888 
1 1 1    6    6   34 o  655.388   4.1620 17515.56  222.347 17335.23  291.779 17765.30  343.379  651.882   5.4910  659.816   6.3843 -7.933838 8.420815 
1 1 1    6    6   35 o   47.745   2.2197   93.124   8.6152   57.425   13.236  119.364   11.348   37.261   4.4455   54.050   2.5831 -16.78893 5.141490 
1 1 1    6    6   36 o  407.453   2.7132  6768.10   90.115  6841.75  120.546  6674.80  135.676  409.625   3.6102  404.570   4.1141 5.054962 5.473508 
1 1 1    6    6   37 o  531.213   3.4275 11506.00  148.418 11671.14  198.968 11298.85  222.847  534.926   4.5630  526.268   5.1947 8.658081 6.914223 
1 1 1    6    6   38 o  332.402   2.2994  4504.21   62.304  4599.83   84.081  4387.77   92.783  335.885   3.0709  328.036   3.4699 7.849640 4.633635 
1 1 1    6    6   39 o  125.602   1.4515  643.040   14.861  651.169   20.313  633.677   21.800  126.389   1.9716  124.678   2.1450 1.710884 2.913485 
1 1 1    6    6   40 o  205.824   1.8242  1726.86   30.606  1729.98   44.330  1724.02   42.309  205.993   2.6400  205.641   2.5240 0.3527222 3.652418 
1 1 1    6    6   41 o  321.523   2.6589  4214.73   69.687  4374.76  114.931  4121.70   87.633  327.484   4.3054  317.923   3.3815 9.561249 5.474552 
1 1 1    6    6   42 o  245.206   2.0154  2451.07   40.283  2425.91   57.628  2475.11   56.333  243.919   2.8984  246.383   2.8049 -2.464539 4.033337 
1 1 1    6    6   43 o   89.190   1.8555  324.280   13.490  298.118   27.726  332.393   15.441   85.396   3.9942   90.297   2.0978 -4.900978 4.511541 
1 1 1    6    6   44 o  311.288   2.5904  3950.86   65.731  3796.55  102.195  4059.74   85.844  305.061   4.1097  315.509   3.3378 -10.44745 5.294374 
1 1 1    6    6   45 o  259.703   2.2769  2749.76   48.200  2761.30   77.805  2742.57   61.402  260.184   3.6685  259.338   2.9046 0.8454285 4.679152 
1 1 1    6    6   46 o  268.219   2.1318  2933.00   46.609  2895.64   66.296  2969.52   65.541  266.465   3.0522  269.847   2.9796 -3.382050 4.265428 
1 1 1    6    6   47 o  263.467   2.3069  2830.21   49.545  2809.56   64.632  2859.63   77.154  262.470   3.0208  264.765   3.5749 -2.295013 4.680290 
1 1 1    6    6   48 o  277.974   2.1827  3150.42   49.457  3145.21   61.055  3160.36   84.341  277.719   2.6970  278.320   3.7176 -0.6010437 4.592852 
1 1 1    6    6   49 o  346.714   2.5702  4902.01   72.641  4929.39   89.788  4850.14  123.585  347.634   3.1686  344.703   4.3983 2.931366 5.420771 
1 1 1    6    6   50 o  287.758   2.4463  3376.59   57.382  3357.45   74.591  3404.33   89.813  286.892   3.1896  288.835   3.8147 -1.943176 4.972435 
1 1 1    6    6   51 o  157.092   1.6208  1006.04   20.754  982.988   25.838  1047.97   34.844  155.271   2.0414  160.301   2.6666 -5.029495 3.358299 
1 1 1    6    6   52 o  504.387   3.2790 10379.29  134.814 10258.60  176.900 10546.51  208.219  501.260   4.3294  508.091   5.0274 -6.831421 6.634633 
1 1 1    6    6   53 o  227.938   1.7818  2118.24   33.106  2078.25   43.769  2171.69   50.610  225.750   2.3785  230.751   2.6906 -5.001358 3.591195 
1 1 1    6    6   54 f   44.771   2.4029   81.977   8.7373   84.904   10.575   75.682   15.509   45.533   2.8638   42.812   4.5117 2.721001 5.343842 
1 1 1    6    6   55 f  136.666   1.6330  761.464   18.193  773.176   22.280  738.034   31.513  137.704   1.9849  134.508   2.8742 3.196136 3.492942 
1 1 1    6    6   56 o  144.247   1.7986  848.343   21.148  845.028   23.489  862.532   48.595  143.959   2.0017  145.285   4.1074 -1.325470 4.569226 
1 1 1    6    6   57 o  202.744   1.8387  1675.97   30.388  1683.38   37.163  1661.00   52.789  203.174   2.2439  201.760   3.2097 1.413925 3.916327 
1 1 1    6    6   58 o  217.051   1.9010  1920.92   33.635  1917.86   41.022  1927.20   58.754  216.856   2.3206  217.314   3.3168 -0.4579773 4.047993 
1 1 1    6    6   59 o   50.800   2.1884  105.433   9.0407  109.602   10.821   95.797   16.452   51.773   2.5721   48.247   4.2259 3.526173 4.947123 
1 1 1    6    6   60 o  112.185   1.6089  513.114   14.713  504.014   17.822  532.581   26.068  111.177   1.9666  114.257   2.7990 -3.079674 3.420767 
1 1 1    6    6   61 o  118.817   1.6257  575.584   15.746  594.789   19.307  537.441   27.209  120.774   1.9611  114.734   2.9116 6.040031 3.510481 
1 1 1    6    6   62 f  306.861   2.5902  3841.17   64.792  3878.96   72.962  3700.25  140.911  308.333   2.9030  300.672   5.7493 7.660706 6.440632 
1 1 1    6    6   63 o  120.919   1.7705  596.176   17.452  609.876   19.697  546.160   37.635  122.294   1.9759  115.568   4.0011 6.726128 4.462361 
1 1 1    6    6   64 o   71.185   1.9658  206.794   11.396  199.982   12.740  234.059   25.488   69.988   2.2360   75.578   4.1532 -5.590538 4.716839 
1 1 1    6    6   65 o   84.807   1.7108  293.258   11.827  296.066   14.365  287.348   20.839   85.204   2.0683   83.855   3.0538 1.349159 3.688269 
1 1 1    6    6   66 o   22.604   4.4291   21.606   7.8689   18.229   9.5060   28.956   14.025   20.742   5.5240   26.071   6.5958 -5.328619 8.603388 
1 1 1    6    6   67 o   96.410   1.6847  378.995   13.240  374.610   16.050  388.336   23.423   95.840   2.0544   97.503   2.9505 -1.662575 3.595247 
1 1 1    6    6   68 o  131.528   1.8169  705.453   19.479  674.562   24.531  758.174   32.047  128.594   2.3403  136.301   2.8844 -7.706558 3.714383 
1 1 1    6    6   69 o   98.309   1.7447  394.107   13.981  391.668   16.937  399.323   24.771   97.993   2.1203   98.858   3.0776 -0.8649750 3.737318 
1 1 1    6    6   70 o   37.750   3.4785   58.693   10.584   73.181   13.803   38.020   16.488   42.119   4.0709   29.831   6.9156 12.28867 8.024860 
1 1 1    6    6   71 o  152.597   1.8077  949.633   22.486  964.478   31.759  934.713   31.841  153.742   2.5342  151.347   2.5810 2.394211 3.617118 
1 1 1    6    6   72 o  144.112   1.9727  847.057   23.174  863.644   30.236  823.436   36.080  145.482   2.5496  142.014   3.1168 3.468201 4.026738 
1 1 1    6    6   73 o   89.489   1.9612  326.632   14.306  326.311   19.752  326.986   20.748   89.374   2.7143   89.456   2.8490 -0.8205414E-01 3.935003 
1 1 1    6    6   74 o   34.369   3.2212   48.663   8.9192   48.699   11.495   48.609   14.140   34.252   4.2050   34.048   5.2642 0.2038345 6.737501 
1 1 1    6    6   75 o   75.979   1.7948  235.447   11.116  250.747   14.479  213.483   17.348   78.360   2.2692   72.246   2.9521 6.113968 3.723428 
1 1 1    6    6   76 o   85.461   1.6882  297.872   11.760  296.880   15.297  299.307   18.390   85.271   2.2026   85.586   2.6391 -0.3149948 3.437505 
1 1 1    6    6   77 o  146.024   1.5756  869.601   18.755  871.674   24.633  866.741   28.929  146.165   2.0674  145.721   2.4354 0.4440765 3.194593 
1 1 1    6    6   78 o  171.246   1.7549  1196.18   24.496  1200.17   34.238  1192.00   35.063  171.466   2.4496  170.874   2.5173 0.5919952 3.512434 
1 1 1    6    6   79 o   76.299   1.8595  237.500   11.565  237.421   16.012  237.587   16.724   76.209   2.5812   76.226   2.6957 -0.1640320E-01 3.732207 
1 1 1    6    6   80 o   66.784   2.0082  182.162   10.920  167.596   15.045  198.379   15.874   63.981   2.8923   69.629   2.8026 -5.648125 4.027374 
1 1 1    6    6   81 o   44.917   2.8212   82.762   10.278   75.125   15.290   89.056   13.881   42.568   4.4733   46.499   3.6925 -3.931320 5.800456 
1 1 1    6    6   82 o  143.546   1.6917  840.640   19.795  827.521   27.644  854.446   28.358  142.353   2.3823  144.648   2.4051 -2.294647 3.385262 
1 1 1    6    6   83 o   35.883   3.4844   53.195   10.064   50.578   16.084   54.879   12.901   34.542   5.9257   36.300   4.4530 -1.757988 7.412345 
1 1 1    6    6   84 o   30.333   3.3840   38.125   8.2248   17.397   10.777   67.035   12.728   20.377   6.0501   40.249   3.9293 -19.87282 7.214142 
1 1 1    6    6   85 o  136.573   1.5594  760.971   17.361  768.565   23.072  751.058   26.358  137.202   2.0630  135.591   2.3848 1.611115 3.153256 
1 1 1    6    6   86 o   52.564   2.1422  113.026   9.1597  122.153   12.119  100.865   13.989   54.589   2.7322   49.494   3.4897 5.094440 4.431988 
1 1 1    6    6   87 o  151.529   1.5962  936.962   19.716  957.262   26.370  911.229   29.689  153.093   2.1131  149.314   2.4393 3.778580 3.227258 
1 1 1    6    6   88 f  203.898   1.7590  1697.15   29.236  1679.60   38.471  1721.13   44.978  202.721   2.3281  205.117   2.6901 -2.395874 3.557588 
1 1 1    6    6   89 o   40.653   2.7471   67.946   9.0499   55.436   11.953   84.748   13.853   36.489   4.0891   45.264   3.7891 -8.775452 5.574763 
1 1 1    6    6   90 o   35.798   3.0705   52.909   8.8734   40.046   11.841   69.383   13.401   30.761   4.8856   40.855   4.0783 -10.09483 6.364067 
1 1 1    6    6   91 o   98.130   1.7393  393.267   13.912  403.323   17.287  374.778   23.440   99.326   2.1351   95.557   3.0130 3.769501 3.692809 
1 1 1    6    6   92 o   24.786   4.1948   26.030   8.1733   21.994   10.075   33.802   13.980   22.544   5.5258   27.874   6.3012 -5.330198 8.380933 
1 1 1    6    6   93 o  103.429   1.6822  436.985   14.183  430.891   17.478  448.735   24.270  102.643   2.0889  104.554   2.8503 -1.910408 3.533840 
1 1 1    6    6   94 o   78.544   1.6694  252.055   10.688  273.146   14.477  226.789   15.846   81.666   2.1767   74.326   2.6195 7.340050 3.405883 
1 1 1    6    6   95 o   45.568   2.2391   85.243   8.2915   82.261   11.030   89.118   12.572   44.624   3.0507   46.394   3.3469 -1.769508 4.528668 
1 1 1    6    6   96 o   31.272   2.9735   40.585   7.4888   43.522   10.039   36.899   11.245   32.194   3.9050   29.360   4.8692 2.833994 6.241620 
1 1 1    6    6   97 o   24.124   4.0852   24.810   7.7471   15.338   9.4027   44.833   13.671   18.908   5.6601   32.230   5.3938 -13.32289 7.818581 
1 1 1    6    6   98 f   44.828   2.3708   82.715   8.6325   88.041   10.640   72.455   14.767   46.155   2.8418   41.426   4.4424 4.729397 5.273553 
1 1 1    6    6   99 o   39.736   2.8101   65.378   9.0434   68.030   11.479   61.038   14.683   40.361   3.5244   37.795   4.8798 2.566036 6.019454 
1 1 1    6    6  100 o   26.218   3.4362   28.978   7.1670   48.515   9.7068   5.5610   10.627   34.000   3.5549   14.798   5.8851 19.20141 6.875457 
1 1 1    6    6  101 o   17.820   4.7514   13.896   7.0276   17.183   9.3323   9.5912   10.681   19.738   5.5628   16.363   6.0494 3.374809 8.218296 
1 1 1    6    6  102 o   23.482   3.8030   23.588   7.0306   24.891   9.4295   21.956   10.550   23.779   5.0224   22.156   5.7815 1.623293 7.658350 
1 1 1    6    6  103 o   15.751   4.9612   10.549   7.1108   12.716   9.3750   7.6127   10.911   17.357   5.7177   15.590   6.0331 1.766777 8.312100 
1 1 1    6    6  104 o   48.593   2.1321   97.316   8.4247   92.358   11.144  103.930   12.871   47.108   2.9163   49.887   3.1816 -2.778606 4.315922 
1 1 1    6    6  105 o   13.314   5.0820   5.6890   7.6687  -6.3693   10.549   19.203   11.168   11.135   5.1101   20.639   6.1662 -9.504737 8.008437 
1 1 1    6    6  106 o   53.708   1.9961  118.813   8.7236  129.150   11.629  105.511   13.192   55.811   2.5631   50.173   3.2428 5.637589 4.133449 
1 1 1    6    6  107 o   87.018   1.6408  310.643   11.639  301.198   15.370  323.339   17.820   85.431   2.2090   88.378   2.4760 -2.946716 3.318156 
1 1 1    6    6  108 o   28.778   3.3202   35.118   7.6462   33.170   10.041   37.807   11.797   27.464   4.6509   29.136   5.1559 -1.671919 6.943604 
1 1 1    6    6  109 o   40.310   2.7547   67.878   8.9973   58.773   12.580   77.414   12.874   36.872   4.2639   42.638   3.7419 -5.766575 5.672962 
1 1 1    6    6  110 o   22.394   4.6477   22.392   8.2062   29.381   11.482   15.095   11.732   25.263   5.7103   18.559   6.3969 6.704842 8.574899 
1 1 1    6    6  111 o   60.401   2.1136  150.934   10.390  167.736   14.862  134.872   14.532   63.275   2.8891   56.571   3.1638 6.703960 4.284509 
1 1 1    6    6  112 o   14.256   5.1223   8.1021   7.5799   13.757   9.8762  -0.0034   11.824   17.543   5.8714   13.199   5.7760 4.343525 8.236221 
1 1 1    6    6  113 o   59.163   2.1641  145.272   10.419  134.386   14.711  156.230   14.760   56.290   3.2195   60.870   2.9837 -4.580208 4.389513 
1 1 1    6    6  114 o   53.719   2.3216  120.324   10.142  138.938   14.509  102.537   14.182   57.220   3.1224   48.820   3.5889 8.399532 4.757047 
1 1 1    6    6  115 o   15.485   5.3413   10.558   8.1802   6.0692   9.7209   21.449   15.141   13.957   5.6023   20.749   7.2604 -6.791795 9.170609 
1 1 1    6    6  116 o   14.763   5.1697   9.4600   7.6775  -3.5311   10.029   27.854   11.933   11.125   5.0585   23.760   6.1231 -12.63468 7.942314 
1 1 1    6    6  117 o   17.792   5.4797   15.145   8.7279   21.214   10.595   2.3345   15.394   20.706   5.9578   14.828   6.5361 5.878421 8.843953 
1 1 1    6    6  118 o   26.750   4.3128   32.580   9.0846   37.062   11.205   23.980   15.519   28.019   5.0934   21.131   7.3535 6.888058 8.945175 
1 1 1    6    6  119 o   20.899   5.5925   21.664   9.7144   10.130   12.342   40.444   15.749   15.833   6.3271   27.457   7.0126 -11.62398 9.445035 
1 1 1    6    6  120 o   15.283   5.8748   10.017   10.297   7.5779   13.949   12.937   15.263   15.375   6.4909   17.174   6.9746 -1.798648 9.527717 
1 1 1    6    6  121 f   9.5500   4.5834 -11.2631   10.321 -37.9980   13.997   20.590   15.279   8.5625   4.3162   19.555   7.2342 -10.99239 8.423996 
1 1 1    6    6  122 o   18.113   6.1624   16.781   10.879   17.708   14.714   15.664   16.159   18.469   7.0420   17.925   7.2133 0.5442543 10.08074 
1 1 1    6    6  123 o   18.123   5.9846   16.863   10.268   33.851   13.093 -10.2782   16.550   25.296   6.3580   12.543   5.9599 12.75246 8.714656 
1 1 1    6    6  124 o   14.177   5.7396   7.5499   10.300   9.2552   13.265   4.9610   16.344   15.461   6.4141   15.125   6.6979 0.3355083 9.273692 
1 1 1    6    6  125 o   36.765   3.7611   60.756   11.113   45.672   13.937   87.086   18.414   29.875   5.9323   41.994   5.5120 -12.11908 8.097827 
1 1 1    6    6  126 o   15.365   6.0844   10.482   11.313   19.459   13.176 -14.6982   22.068   18.825   6.7548   13.645   6.5873 5.180346 9.435021 
1 1 1    6    6  127 o   22.764   6.6755   28.968   13.188   28.968   13.188   0.0000   0.0000   22.764   6.6755  ?   ?  0.000000 6.675460 
1 1 1    6    6  128 o   11.041   5.2407  -8.7786   12.731  -8.7786   12.731   0.0000   0.0000   11.041   5.2407  ?   ?  0.000000 5.240722 
1 1 1    6    6  129 o   13.288   5.5550   5.7330   10.061  -1.1288   12.783   16.905   16.311   12.459   5.6829   17.729   7.2064 -5.269749 9.177512 
1 1 1    6    6  130 o   10.978   4.9891  -1.7896   9.7399  -9.7137   12.309   11.479   15.929   10.666   5.0880   16.243   6.9003 -5.577141 8.573312 
1 1 1    6    6  131 o   7.6671   3.8359 -23.5996   10.053 -36.9438   12.683  -1.0493   16.487   7.9086   4.0011   13.750   6.3388 -5.841560 7.495924 
1 1 1    7    0 -136 o   31.489   6.0076   48.695   13.792   48.695   13.792   48.695   13.792   31.489   6.0076   31.489   6.0076 -0.000000 0.000000 
1 1 1    7    0 -135 o   11.869   7.1302   9.0917   12.423   9.0917   12.423   9.0917   12.423   11.869   7.1302   11.869   7.1302 -0.000000 0.000000 
1 1 1    7    0 -134 o   8.8517   5.9533  -2.0185   12.236  -2.0185   12.236  -2.0185   12.236   8.8517   5.9533   8.8517   5.9533 -0.000000 0.000000 
1 1 1    7    0 -133 o   10.361   6.2817   6.0455   9.8249   6.0455   9.8249   6.0455   9.8249   10.361   6.2817   10.361   6.2817 -0.000000 0.000000 
1 1 1    7    0 -132 o   9.6209   6.0774   3.5927   10.165   3.5927   10.165   3.5927   10.165   9.6209   6.0774   9.6209   6.0774 -0.000000 0.000000 
1 1 1    7    0 -131 o   11.474   6.6500   8.5948   10.142   8.5948   10.142   8.5948   10.142   11.474   6.6500   11.474   6.6500 -0.000000 0.000000 
1 1 1    7    0 -130 o   31.864   4.3577   45.900   10.719   45.900   10.719   45.900   10.719   31.864   4.3577   31.864   4.3577 -0.000000 0.000000 
1 1 1    7    0 -129 o   49.741   3.3802  105.769   13.558  105.769   13.558  105.769   13.558   49.741   3.3802   49.741   3.3802 -0.000000 0.000000 
1 1 1    7    0 -128 o   29.534   5.6041   41.869   12.079   41.869   12.079   41.869   12.079   29.534   5.6041   29.534   5.6041 0.000000 0.000000 
1 1 1    7    0 -127 o   29.158   5.6990   40.970   12.066   40.970   12.066   40.970   12.066   29.158   5.6990   29.158   5.6990 -0.000000 0.000000 
1 1 1    7    0 -126 o   8.6432   5.6323   0.5944   9.6318   0.5944   9.6318   0.5944   9.6318   8.6432   5.6323   8.6432   5.6323 0.000000 0.000000 
1 1 1    7    0 -125 o   15.118   7.1641   15.340   10.019   15.340   10.019   15.340   10.019   15.118   7.1641   15.118   7.1641 -0.000000 0.000000 
1 1 1    7    0 -124 o   31.236   4.3845   43.806   10.533   43.806   10.533   43.806   10.533   31.236   4.3845   31.236   4.3845 -0.000000 0.000000 
1 1 1    7    0 -123 o   12.537   6.9035   10.365   10.216   10.365   10.216   10.365   10.216   12.537   6.9035   12.537   6.9035 -0.000000 0.000000 
1 1 1    7    0 -122 o   8.0604   5.3752  -1.9600   9.6026  -1.9600   9.6026  -1.9600   9.6026   8.0604   5.3752   8.0604   5.3752 0.000000 0.000000 
1 1 1    7    0 -121 o   13.256   7.4289   11.420   12.076   11.420   12.076   11.420   12.076   13.256   7.4289   13.256   7.4289 0.000000 0.000000 
1 1 1    7    0 -120 o   63.446   3.6984  169.922   18.977  169.922   18.977  169.922   18.977   63.446   3.6984   63.446   3.6984 0.000000 0.000000 
1 1 1    7    0 -119 o   21.100   7.8206   25.989   12.481   25.989   12.481   25.989   12.481   21.100   7.8206   21.100   7.8206 0.000000 0.000000 
1 1 1    7    0 -118 o   7.3404   4.6869   0.7758   6.2381   0.7758   6.2381   0.7758   6.2381   7.3404   4.6869   7.3404   4.6869 0.000000 0.000000 
1 1 1    7    0 -117 o   49.385   2.1628  100.651   8.6686  100.651   8.6686  100.651   8.6686   49.385   2.1628   49.385   2.1628 0.000000 0.000000 
1 1 1    7    0 -116 o   37.811   2.5051   59.524   7.6422   59.524   7.6422   59.524   7.6422   37.811   2.5051   37.811   2.5051 0.000000 0.000000 
1 1 1    7    0 -115 o   56.848   2.0318  132.911   9.3879  132.911   9.3879  132.911   9.3879   56.848   2.0318   56.848   2.0318 0.000000 0.000000 
1 1 1    7    0 -114 o   80.161   1.8093  263.332   11.809  263.332   11.809  263.332   11.809   80.161   1.8093   80.161   1.8093 -0.000000 0.000000 
1 1 1    7    0 -113 o   58.593   2.0051  141.063   9.5512  141.063   9.5512  141.063   9.5512   58.593   2.0051   58.593   2.0051 0.000000 0.000000 
1 1 1    7    0 -112 o   14.620   5.8685   12.385   6.7970   12.385   6.7970   12.385   6.7970   14.620   5.8685   14.620   5.8685 0.000000 0.000000 
1 1 1    7    0 -111 f   13.226   5.8809   10.563   6.7055   10.563   6.7055   10.563   6.7055   13.226   5.8809   13.226   5.8809 -0.000000 0.000000 
1 1 1    7    0 -110 o   15.264   5.6705   12.992   6.5539   12.992   6.5539   12.992   6.5539   15.264   5.6705   15.264   5.6705 -0.000000 0.000000 
1 1 1    7    0 -109 o   28.889   3.1767   35.513   7.2505   35.513   7.2505   35.513   7.2505   28.889   3.1767   28.889   3.1767 -0.000000 0.000000 
1 1 1    7    0 -108 o   27.812   3.1021   32.918   6.8089   32.918   6.8089   32.918   6.8089   27.812   3.1021   27.812   3.1021 0.000000 0.000000 
1 1 1    7    0 -107 o   20.179   4.5293   19.090   6.5036   19.090   6.5036   19.090   6.5036   20.179   4.5293   20.179   4.5293 -0.000000 0.000000 
1 1 1    7    0 -106 o   53.597   2.0982  117.966   9.1348  117.966   9.1348  117.966   9.1348   53.597   2.0982   53.597   2.0982 -0.000000 0.000000 
1 1 1    7    0 -105 o   31.463   2.8984   41.564   7.2806   41.564   7.2806   41.564   7.2806   31.463   2.8984   31.463   2.8984 -0.000000 0.000000 
1 1 1    7    0 -104 o  164.344   2.0749  1104.01   27.787  1104.01   27.787  1104.01   27.787  164.344   2.0749  164.344   2.0749 -0.000000 0.000000 
1 1 1    7    0 -103 o   29.623   3.0577   37.055   7.1875   37.055   7.1875   37.055   7.1875   29.623   3.0577   29.623   3.0577 -0.000000 0.000000 
1 1 1    7    0 -102 f   61.083   1.9682  152.815   9.7767  152.815   9.7767  152.815   9.7767   61.083   1.9682   61.083   1.9682 0.000000 0.000000 
1 1 1    7    0 -101 f   57.533   2.0354  135.642   9.5182  135.642   9.5182  135.642   9.5182   57.533   2.0354   57.533   2.0354 -0.000000 0.000000 
1 1 1    7    0 -100 o  105.664   1.7831  455.979   15.348  455.979   15.348  455.979   15.348  105.664   1.7831  105.664   1.7831 0.000000 0.000000 
1 1 1    7    0  -99 o  109.567   1.7912  490.214   15.988  490.214   15.988  490.214   15.988  109.567   1.7912  109.567   1.7912 0.000000 0.000000 
1 1 1    7    0  -98 o   13.640   6.0881   11.046   7.1862   11.046   7.1862   11.046   7.1862   13.640   6.0881   13.640   6.0881 0.000000 0.000000 
1 1 1    7    0  -97 o   43.347   2.7159   77.634   9.5091   77.634   9.5091   77.634   9.5091   43.347   2.7159   43.347   2.7159 -0.000000 0.000000 
1 1 1    7    0  -96 o   12.351   6.0210   9.2240   7.1365   9.2240   7.1365   9.2240   7.1365   12.351   6.0210   12.351   6.0210 0.000000 0.000000 
1 1 1    7    0  -95 o   8.8000   5.2579   3.3322   6.6840   3.3322   6.6840   3.3322   6.6840   8.8000   5.2579   8.8000   5.2579 -0.000000 0.000000 
1 1 1    7    0  -94 o   66.047   2.2848  178.625   12.267  178.625   12.267  178.625   12.267   66.047   2.2848   66.047   2.2848 0.000000 0.000000 
1 1 1    7    0  -93 o  174.319   2.3955  1240.60   34.025  1240.60   34.025  1240.60   34.025  174.319   2.3955  174.319   2.3955 -0.000000 0.000000 
1 1 1    7    0  -92 o  117.961   1.9026  567.944   18.284  567.944   18.284  567.944   18.284  117.961   1.9026  117.961   1.9026 0.000000 0.000000 
1 1 1    7    0  -91 o   84.349   1.9266  290.616   13.231  290.616   13.231  290.616   13.231   84.349   1.9266   84.349   1.9266 -0.000000 0.000000 
1 1 1    7    0  -90 o  141.892   1.7759  821.386   20.533  821.386   20.533  821.386   20.533  141.892   1.7759  141.892   1.7759 0.000000 0.000000 
1 1 1    7    0  -89 o  200.257   1.9985  1635.95   32.615  1635.95   32.615  1635.95   32.615  200.257   1.9985  200.257   1.9985 0.000000 0.000000 
1 1 1    7    0  -88 o   21.622   3.9860   20.920   6.3221   20.920   6.3221   20.920   6.3221   21.622   3.9860   21.622   3.9860 0.000000 0.000000 
1 1 1    7    0  -87 o  237.292   2.1805  2296.94   42.169  2296.94   42.169  2296.94   42.169  237.292   2.1805  237.292   2.1805 -0.000000 0.000000 
1 1 1    7    0  -86 o   26.802   3.1504   30.503   6.6338   30.503   6.6338   30.503   6.6338   26.802   3.1504   26.802   3.1504 0.000000 0.000000 
1 1 1    7    0  -85 o  117.400   1.7222  562.303   16.474  562.303   16.474  562.303   16.474  117.400   1.7222  117.400   1.7222 0.000000 0.000000 
1 1 1    7    0  -84 o   12.834   5.4981   9.5747   5.8772   9.5747   5.8772   9.5747   5.8772   12.834   5.4981   12.834   5.4981 0.000000 0.000000 
1 1 1    7    0  -83 o   4.1920   3.0327 -10.6946   5.4578 -10.6946   5.4578 -10.6946   5.4578   4.1920   3.0327   4.1920   3.0327 -0.000000 0.000000 
1 1 1    7    0  -82 o  456.522   3.5754  8505.73  133.035  8505.73  133.035  8505.73  133.035  456.522   3.5754  456.522   3.5754 0.000000 0.000000 
1 1 1    7    0  -81 o  240.507   2.2271  2359.18   43.654  2359.18   43.654  2359.18   43.654  240.507   2.2271  240.507   2.2271 0.000000 0.000000 
1 1 1    7    0  -80 o   65.698   1.9052  176.414   10.184  176.414   10.184  176.414   10.184   65.698   1.9052   65.698   1.9052 0.000000 0.000000 
1 1 1    7    0  -79 f   60.473   1.9160  149.542   9.4233  149.542   9.4233  149.542   9.4233   60.473   1.9160   60.473   1.9160 0.000000 0.000000 
1 1 1    7    0  -78 o  221.603   2.0764  2002.70   37.500  2002.70   37.500  2002.70   37.500  221.603   2.0764  221.603   2.0764 -0.000000 0.000000 
1 1 1    7    0  -77 o   40.233   2.1557   66.563   7.0232   66.563   7.0232   66.563   7.0232   40.233   2.1557   40.233   2.1557 0.000000 0.000000 
1 1 1    7    0  -76 f  139.824   1.6964  797.356   19.329  797.356   19.329  797.356   19.329  139.824   1.6964  139.824   1.6964 0.000000 0.000000 
1 1 1    7    0  -75 o  148.748   1.7293  902.342   20.961  902.342   20.961  902.342   20.961  148.748   1.7293  148.748   1.7293 0.000000 0.000000 
1 1 1    7    0  -74 o  352.670   3.1762  5073.83   91.293  5073.83   91.293  5073.83   91.293  352.670   3.1762  352.670   3.1762 -0.000000 0.000000 
1 1 1    7    0  -73 o  261.942   3.6367  2800.46   77.618  2800.46   77.618  2800.46   77.618  261.942   3.6367  261.942   3.6367 0.000000 0.000000 
1 1 1    7    0  -72 o   55.608   2.1020  126.606   9.4974  126.606   9.4974  126.606   9.4974   55.608   2.1020   55.608   2.1020 -0.000000 0.000000 
1 1 1    7    0  -71 o  285.914   3.1030  3334.86   72.301  3334.86   72.301  3334.86   72.301  285.914   3.1030  285.914   3.1030 0.000000 0.000000 
1 1 1    7    0  -70 o   83.696   1.8131  285.959   12.357  285.959   12.357  285.959   12.357   83.696   1.8131   83.696   1.8131 -0.000000 0.000000 
1 1 1    7    0  -69 o   95.724   1.7850  373.920   13.918  373.920   13.918  373.920   13.918   95.724   1.7850   95.724   1.7850 0.000000 0.000000 
1 1 1    7    0  -68 o  283.805   2.4099  3284.52   55.743  3284.52   55.743  3284.52   55.743  283.805   2.4099  283.805   2.4099 -0.000000 0.000000 
1 1 1    7    0  -67 f  225.743   1.8704  2077.78   34.412  2077.78   34.412  2077.78   34.412  225.743   1.8704  225.743   1.8704 -0.000000 0.000000 
1 1 1    7    0  -66 o  234.695   1.9159  2245.84   36.648  2245.84   36.648  2245.84   36.648  234.695   1.9159  234.695   1.9159 0.000000 0.000000 
1 1 1    7    0  -65 o   71.626   1.4184  209.365   8.2744  209.365   8.2744  209.365   8.2744   71.626   1.4184   71.626   1.4184 0.000000 0.000000 
1 1 1    7    0  -64 o   44.478   1.6435   80.971   5.9403   80.971   5.9403   80.971   5.9403   44.478   1.6435   44.478   1.6435 0.000000 0.000000 
1 1 1    7    0  -63 o   98.931   1.4034  399.181   11.313  399.181   11.313  399.181   11.313   98.931   1.4034   98.931   1.4034 0.000000 0.000000 
1 1 1    7    0  -62 o  142.381   1.6079  826.649   18.656  826.649   18.656  826.649   18.656  142.381   1.6079  142.381   1.6079 -0.000000 0.000000 
1 1 1    7    0  -61 o  263.822   2.0684  2837.74   44.475  2837.74   44.475  2837.74   44.475  263.822   2.0684  263.822   2.0684 -0.000000 0.000000 
1 1 1    7    0  -60 o  114.171   1.4216  531.559   13.226  531.559   13.226  531.559   13.226  114.171   1.4216  114.171   1.4216 0.000000 0.000000 
1 1 1    7    0  -59 o  306.401   2.3077  3827.62   57.630  3827.62   57.630  3827.62   57.630  306.401   2.3077  306.401   2.3077 0.000000 0.000000 
1 1 1    7    0  -58 o   72.435   1.4309  214.108   8.4414  214.108   8.4414  214.108   8.4414   72.435   1.4309   72.435   1.4309 0.000000 0.000000 
1 1 1    7    0  -57 f   74.004   1.4279  223.471   8.6067  223.471   8.6067  223.471   8.6067   74.004   1.4279   74.004   1.4279 0.000000 0.000000 
1 1 1    7    0  -56 o  187.820   1.8122  1438.27   27.739  1438.27   27.739  1438.27   27.739  187.820   1.8122  187.820   1.8122 -0.000000 0.000000 
1 1 1    7    0  -55 o  573.307   3.9635 13402.45  185.207 13402.45  185.207 13402.45  185.207  573.307   3.9635  573.307   3.9635 0.000000 0.000000 
1 1 1    7    0  -54 f   29.467   2.2798   36.024   5.3987   36.024   5.3987   36.024   5.3987   29.467   2.2798   29.467   2.2798 -0.000000 0.000000 
1 1 1    7    0  -53 o  324.406   2.6300  4290.63   69.537  4290.63   69.537  4290.63   69.537  324.406   2.6300  324.406   2.6300 0.000000 0.000000 
1 1 1    7    0  -52 o  118.185   1.5342  569.597   14.775  569.597   14.775  569.597   14.775  118.185   1.5342  118.185   1.5342 -0.000000 0.000000 
1 1 1    7    0  -51 o  205.392   1.9087  1719.92   31.950  1719.92   31.950  1719.92   31.950  205.392   1.9087  205.392   1.9087 -0.000000 0.000000 
1 1 1    7    0  -50 o   5.6978   3.8224  -1.9967   4.9859  -1.9967   4.9859  -1.9967   4.9859   5.6978   3.8224   5.6978   3.8224 -0.000000 0.000000 
1 1 1    7    0  -49 o   24.312   3.3868   25.458   6.3398   25.458   6.3398   25.458   6.3398   24.312   3.3868   24.312   3.3868 0.000000 0.000000 
1 1 1    7    0  -48 o  596.698   5.0319 14518.83  244.709 14518.83  244.709 14518.83  244.709  596.698   5.0319  596.698   5.0319 -0.000000 0.000000 
1 1 1    7    0  -47 o   26.105   3.2059   29.010   6.5466   29.010   6.5466   29.010   6.5466   26.105   3.2059   26.105   3.2059 -0.000000 0.000000 
1 1 1    7    0  -46 o   92.184   2.0260  346.870   15.208  346.870   15.208  346.870   15.208   92.184   2.0260   92.184   2.0260 -0.000000 0.000000 
1 1 1    7    0  -45 o  188.521   2.1128  1449.13   32.458  1449.13   32.458  1449.13   32.458  188.521   2.1128  188.521   2.1128 -0.000000 0.000000 
1 1 1    7    0  -44 o  345.904   3.1354  4878.23   88.391  4878.23   88.391  4878.23   88.391  345.904   3.1354  345.904   3.1354 -0.000000 0.000000 
1 1 1    7    0  -43 f  1057.01   8.7244 45575.57  751.595 45575.57  751.595 45575.57  751.595  1057.01   8.7244  1057.01   8.7244 0.000000 0.000000 
1 1 1    7    0  -42 o  260.205   2.5647  2760.50   54.387  2760.50   54.387  2760.50   54.387  260.205   2.5647  260.205   2.5647 -0.000000 0.000000 
1 1 1    7    0  -41 o   7.2551   4.9145  -4.4721   8.6316  -4.4721   8.6316  -4.4721   8.6316   7.2551   4.9145   7.2551   4.9145 0.000000 0.000000 
1 1 1    7    0  -40 o  874.942   7.2535 31219.40  517.244 31219.40  517.244 31219.40  517.244  874.942   7.2535  874.942   7.2535 -0.000000 0.000000 
1 1 1    7    0  -39 o  1023.53   8.4504 42729.11  704.937 42729.11  704.937 42729.11  704.937  1023.53   8.4504  1023.53   8.4504 -0.000000 0.000000 
1 1 1    7    0  -38 o   68.537   1.8564  191.877   10.354  191.877   10.354  191.877   10.354   68.537   1.8564   68.537   1.8564 0.000000 0.000000 
1 1 1    7    0  -37 o  276.412   2.3442  3114.79   52.809  3114.79   52.809  3114.79   52.809  276.412   2.3442  276.412   2.3442 -0.000000 0.000000 
1 1 1    7    0  -36 o  778.371   6.4732 24705.39  410.652 24705.39  410.652 24705.39  410.652  778.371   6.4732  778.371   6.4732 -0.000000 0.000000 
1 1 1    7    0  -35 o  238.364   2.3603  2316.49   45.851  2316.49   45.851  2316.49   45.851  238.364   2.3603  238.364   2.3603 0.000000 0.000000 
1 1 1    7    0  -34 o  284.951   2.6681  3310.39   61.960  3310.39   61.960  3310.39   61.960  284.951   2.6681  284.951   2.6681 -0.000000 0.000000 
1 1 1    7    0  -33 o  272.698   2.5799  3031.83   57.336  3031.83   57.336  3031.83   57.336  272.698   2.5799  272.698   2.5799 0.000000 0.000000 
1 1 1    7    0  -32 o  133.186   1.7915  723.385   19.442  723.385   19.442  723.385   19.442  133.186   1.7915  133.186   1.7915 -0.000000 0.000000 
1 1 1    7    0  -31 o  575.697   4.8602 13512.93  228.040 13512.93  228.040 13512.93  228.040  575.697   4.8602  575.697   4.8602 0.000000 0.000000 
1 1 1    7    0  -30 o  469.297   4.6460  8980.22  177.692  8980.22  177.692  8980.22  177.692  469.297   4.6460  469.297   4.6460 -0.000000 0.000000 
1 1 1    7    0  -29 o  128.100   1.9822  669.306   20.687  669.306   20.687  669.306   20.687  128.100   1.9822  128.100   1.9822 -0.000000 0.000000 
1 1 1    7    0  -28 o  451.295   3.8762  8303.54  142.570  8303.54  142.570  8303.54  142.570  451.295   3.8762  451.295   3.8762 0.000000 0.000000 
1 1 1    7    0  -27 o  665.453   5.5607 18055.75  301.587 18055.75  301.587 18055.75  301.587  665.453   5.5607  665.453   5.5607 -0.000000 0.000000 
1 1 1    7    0  -26 o  555.825   4.6928 12596.09  212.588 12596.09  212.588 12596.09  212.588  555.825   4.6928  555.825   4.6928 -0.000000 0.000000 
1 1 1    7    0  -25 o  1020.06   8.4089 42437.39  699.091 42437.39  699.091 42437.39  699.091  1020.06   8.4089  1020.06   8.4089 -0.000000 0.000000 
1 1 1    7    0  -24 o  481.817   4.1241  9464.88  161.949  9464.88  161.949  9464.88  161.949  481.817   4.1241  481.817   4.1241 0.000000 0.000000 
1 1 1    7    0  -23 o   82.183   1.6873  275.628   11.293  275.628   11.293  275.628   11.293   82.183   1.6873   82.183   1.6873 0.000000 0.000000 
1 1 1    7    0  -22 f  573.990   4.8410 13433.26  226.469 13433.26  226.469 13433.26  226.469  573.990   4.8410  573.990   4.8410 0.000000 0.000000 
1 1 1    7    0  -21 o  200.214   2.0955  1634.37   34.190  1634.37   34.190  1634.37   34.190  200.214   2.0955  200.214   2.0955 0.000000 0.000000 
1 1 1    7    0  -20 o  458.849   3.5251  8583.51  131.831  8583.51  131.831  8583.51  131.831  458.849   3.5251  458.849   3.5251 0.000000 0.000000 
1 1 1    7    0  -19 o  244.633   2.1179  2439.78   42.226  2439.78   42.226  2439.78   42.226  244.633   2.1179  244.633   2.1179 -0.000000 0.000000 
1 1 1    7    0  -18 o  188.148   1.7990  1443.23   27.585  1443.23   27.585  1443.23   27.585  188.148   1.7990  188.148   1.7990 0.000000 0.000000 
1 1 1    7    0  -17 o  102.339   1.6890  427.226   14.081  427.226   14.081  427.226   14.081  102.339   1.6890  102.339   1.6890 0.000000 0.000000 
1 1 1    7    0  -16 o  170.577   2.2338  1186.56   31.048  1186.56   31.048  1186.56   31.048  170.577   2.2338  170.577   2.2338 0.000000 0.000000 
1 1 1    7    0  -15 o  409.659   3.5629  6842.33  118.956  6842.33  118.956  6842.33  118.956  409.659   3.5629  409.659   3.5629 0.000000 0.000000 
1 1 1    7    0  -14 o  962.716   7.9420 37806.99  623.154 37806.99  623.154 37806.99  623.154  962.716   7.9420  962.716   7.9420 -0.000000 0.000000 
1 1 1    7    0  -13 o  335.874   3.0099  4599.44   82.392  4599.44   82.392  4599.44   82.392  335.874   3.0099  335.874   3.0099 0.000000 0.000000 
1 1 1    7    0  -12 o  526.982   4.4693 11323.66  191.956 11323.66  191.956 11323.66  191.956  526.982   4.4693  526.982   4.4693 -0.000000 0.000000 
1 1 1    7    0  -11 o  388.164   3.9327  6143.92  124.407  6143.92  124.407  6143.92  124.407  388.164   3.9327  388.164   3.9327 0.000000 0.000000 
1 1 1    7    0  -10 o  439.711   4.3830  7884.38  157.064  7884.38  157.064  7884.38  157.064  439.711   4.3830  439.711   4.3830 -0.000000 0.000000 
1 1 1    7    0   -9 o  180.875   1.9687  1333.94   29.019  1333.94   29.019  1333.94   29.019  180.875   1.9687  180.875   1.9687 -0.000000 0.000000 
1 1 1    7    0   -8 o  944.953   7.7989 36427.67  600.641 36427.67  600.641 36427.67  600.641  944.953   7.7989  944.953   7.7989 -0.000000 0.000000 
1 1 1    7    0   -7 o  139.905   1.7713  798.175   20.193  798.175   20.193  798.175   20.193  139.905   1.7713  139.905   1.7713 -0.000000 0.000000 
1 1 1    7    0   -6 o  289.905   2.6779  3426.62   63.270  3426.62   63.270  3426.62   63.270  289.905   2.6779  289.905   2.6779 -0.000000 0.000000 
1 1 1    7    0   -5 o  474.207   4.0568  9169.07  156.790  9169.07  156.790  9169.07  156.790  474.207   4.0568  474.207   4.0568 0.000000 0.000000 
1 1 1    7    0   -4 o  236.371   2.3134  2277.97   44.565  2277.97   44.565  2277.97   44.565  236.371   2.3134  236.371   2.3134 -0.000000 0.000000 
1 1 1    7    0   -3 o  640.234   6.1879 16719.23  322.871 16719.23  322.871 16719.23  322.871  640.234   6.1879  640.234   6.1879 0.000000 0.000000 
1 1 1    7    0   -2 o  322.545   3.3585  4242.19   88.280  4242.19   88.280  4242.19   88.280  322.545   3.3585  322.545   3.3585 -0.000000 0.000000 
1 1 1    7    0   -1 o  446.076   5.4191  8116.69  196.983  8116.69  196.983  8116.69  196.983  446.076   5.4191  446.076   5.4191 -0.000000 0.000000 
1 1 1    7    0    0 o  204.229   2.9419  1701.21   48.952  1701.21   48.952  1701.21   48.952  204.229   2.9419  204.229   2.9419 0.000000 0.000000 
1 1 1    7    0    1 o  445.982   7.6759  8119.94  278.863  8119.94  278.863  8119.94  278.863  445.982   7.6759  445.982   7.6759 0.000000 0.000000 
1 1 1    7    0    2 o  135.742   3.4360  752.544   37.964  752.544   37.964  752.544   37.964  135.742   3.4360  135.742   3.4360 -0.000000 0.000000 
1 1 1    7    0    3 o  296.418   3.8585  3583.57   93.196  3583.57   93.196  3583.57   93.196  296.418   3.8585  296.418   3.8585 -0.000000 0.000000 
1 1 1    7    0    4 o  190.121   2.8659  1474.37   44.391  1474.37   44.391  1474.37   44.391  190.121   2.8659  190.121   2.8659 0.000000 0.000000 
1 1 1    7    0    5 o  273.192   3.6271  3043.99   80.740  3043.99   80.740  3043.99   80.740  273.192   3.6271  273.192   3.6271 -0.000000 0.000000 
1 1 1    7    0    6 o  898.898   8.5784 32971.54  628.439 32971.54  628.439 32971.54  628.439  898.898   8.5784  898.898   8.5784 -0.000000 0.000000 
1 1 1    7    0    7 o  214.725   2.5052  1880.10   43.837  1880.10   43.837  1880.10   43.837  214.725   2.5052  214.725   2.5052 -0.000000 0.000000 
1 1 1    7    0    8 o  500.771   4.9248 10226.74  200.988 10226.74  200.988 10226.74  200.988  500.771   4.9248  500.771   4.9248 -0.000000 0.000000 
1 1 1    7    0    9 o  145.686   2.0682  865.621   24.550  865.621   24.550  865.621   24.550  145.686   2.0682  145.686   2.0682 -0.000000 0.000000 
1 1 1    7    0   10 o  219.690   2.5454  1968.05   45.569  1968.05   45.569  1968.05   45.569  219.690   2.5454  219.690   2.5454 -0.000000 0.000000 
1 1 1    7    0   11 o  237.649   2.6820  2302.93   51.941  2302.93   51.941  2302.93   51.941  237.649   2.6820  237.649   2.6820 0.000000 0.000000 
1 1 1    7    0   12 o  116.802   1.9526  556.526   18.579  556.526   18.579  556.526   18.579  116.802   1.9526  116.802   1.9526 -0.000000 0.000000 
1 1 1    7    0   13 o  190.808   2.3512  1484.64   36.557  1484.64   36.557  1484.64   36.557  190.808   2.3512  190.808   2.3512 -0.000000 0.000000 
1 1 1    7    0   14 o  290.290   3.1027  3436.07   73.401  3436.07   73.401  3436.07   73.401  290.290   3.1027  290.290   3.1027 0.000000 0.000000 
1 1 1    7    0   15 o  371.691   4.6412  5634.64  140.571  5634.64  140.571  5634.64  140.571  371.691   4.6412  371.691   4.6412 -0.000000 0.000000 
1 1 1    7    0   16 o  516.371   6.2109 10876.20  261.341 10876.20  261.341 10876.20  261.341  516.371   6.2109  516.371   6.2109 -0.000000 0.000000 
1 1 1    7    0   17 o  106.741   2.3698  465.089   20.597  465.089   20.597  465.089   20.597  106.741   2.3698  106.741   2.3698 -0.000000 0.000000 
1 1 1    7    0   18 o  148.261   2.5716  896.758   31.058  896.758   31.058  896.758   31.058  148.261   2.5716  148.261   2.5716 -0.000000 0.000000 
1 1 1    7    0   19 o  154.110   2.6170  968.873   32.854  968.873   32.854  968.873   32.854  154.110   2.6170  154.110   2.6170 0.000000 0.000000 
1 1 1    7    0   20 o  422.101   5.1903  7266.56  178.525  7266.56  178.525  7266.56  178.525  422.101   5.1903  422.101   5.1903 0.000000 0.000000 
1 1 1    7    0   21 o  672.673   7.9667 18458.91  436.700 18458.91  436.700 18458.91  436.700  672.673   7.9667  672.673   7.9667 -0.000000 0.000000 
1 1 1    7    0   22 f  317.179   4.0821  4102.84  105.504  4102.84  105.504  4102.84  105.504  317.179   4.0821  317.179   4.0821 -0.000000 0.000000 
1 1 1    7    0   23 o   42.219   3.2071   73.901   10.887   73.901   10.887   73.901   10.887   42.219   3.2071   42.219   3.2071 -0.000000 0.000000 
1 1 1    7    0   24 o  571.054   6.8224 13300.95  317.478 13300.95  317.478 13300.95  317.478  571.054   6.8224  571.054   6.8224 0.000000 0.000000 
1 1 1    7    0   25 o  239.977   3.3315  2348.71   65.142  2348.71   65.142  2348.71   65.142  239.977   3.3315  239.977   3.3315 -0.000000 0.000000 
1 1 1    7    0   26 o  404.338   7.0663  6671.60  232.742  6671.60  232.742  6671.60  232.742  404.338   7.0663  404.338   7.0663 0.000000 0.000000 
1 1 1    7    0   27 o  429.670   7.4544  7533.88  260.910  7533.88  260.910  7533.88  260.910  429.670   7.4544  429.670   7.4544 0.000000 0.000000 
1 1 1    7    0   28 o   13.894   7.7085   10.734   12.846   10.734   12.846   10.734   12.846   13.894   7.7085   13.894   7.7085 -0.000000 0.000000 
1 1 1    7    0   29 o  615.831   10.362 15480.37  519.809 15480.37  519.809 15480.37  519.809  615.831   10.362  615.831   10.362 -0.000000 0.000000 
1 1 1    7    0   30 o  978.900   11.432 39102.66  911.965 39102.66  911.965 39102.66  911.965  978.900   11.432  978.900   11.432 0.000000 0.000000 
1 1 1    7    0   31 o  494.786   5.9909  9984.51  241.547  9984.51  241.547  9984.51  241.547  494.786   5.9909  494.786   5.9909 0.000000 0.000000 
1 1 1    7    0   32 o  188.448   2.9162  1448.52   44.773  1448.52   44.773  1448.52   44.773  188.448   2.9162  188.448   2.9162 -0.000000 0.000000 
1 1 1    7    0   33 o  585.293   6.9880 13972.42  333.289 13972.42  333.289 13972.42  333.289  585.293   6.9880  585.293   6.9880 -0.000000 0.000000 
1 1 1    7    0   34 o   58.608   2.9617  141.073   14.066  141.073   14.066  141.073   14.066   58.608   2.9617   58.608   2.9617 -0.000000 0.000000 
1 1 1    7    0   35 o  118.817   2.5566  576.213   24.736  576.213   24.736  576.213   24.736  118.817   2.5566  118.817   2.5566 -0.000000 0.000000 
1 1 1    7    0   36 o  451.028   5.5251  8296.55  203.065  8296.55  203.065  8296.55  203.065  451.028   5.5251  451.028   5.5251 0.000000 0.000000 
1 1 1    7    0   37 o  148.045   2.7314  894.247   32.937  894.247   32.937  894.247   32.937  148.045   2.7314  148.045   2.7314 -0.000000 0.000000 
1 1 1    7    0   38 o  202.916   3.1407  1679.51   51.921  1679.51   51.921  1679.51   51.921  202.916   3.1407  202.916   3.1407 0.000000 0.000000 
1 1 1    7    0   39 o  394.847   4.9591  6358.39  159.557  6358.39  159.557  6358.39  159.557  394.847   4.9591  394.847   4.9591 0.000000 0.000000 
1 1 1    7    0   40 o  1185.67   13.811 57402.64  1334.44 57402.64  1334.44 57402.64  1334.44  1185.67   13.811  1185.67   13.811 -0.000000 0.000000 
1 1 1    7    0   41 o  1346.03   15.655 74013.49  1717.18 74013.49  1717.18 74013.49  1717.18  1346.03   15.655  1346.03   15.655 0.000000 0.000000 
1 1 1    7    0   42 o  179.422   3.0829  1313.34   45.059  1313.34   45.059  1313.34   45.059  179.422   3.0829  179.422   3.0829 -0.000000 0.000000 
1 1 1    7    0   43 f  1086.09   12.677 48161.93  1121.95 48161.93  1121.95 48161.93  1121.95  1086.09   12.677  1086.09   12.677 -0.000000 0.000000 
1 1 1    7    0   44 o  462.754   5.6886  8734.25  214.507  8734.25  214.507  8734.25  214.507  462.754   5.6886  462.754   5.6886 0.000000 0.000000 
1 1 1    7    0   45 o  782.017   9.2140 24955.05  587.172 24955.05  587.172 24955.05  587.172  782.017   9.2140  782.017   9.2140 0.000000 0.000000 
1 1 1    7    0   46 o  539.885   4.5944 11884.82  202.161 11884.82  202.161 11884.82  202.161  539.885   4.5944  539.885   4.5944 0.000000 0.000000 
1 1 1    7    0   47 o  436.454   5.3982  7769.88  191.986  7769.88  191.986  7769.88  191.986  436.454   5.3982  436.454   5.3982 -0.000000 0.000000 
1 1 1    7    0   48 o   18.975   6.7525   19.350   9.5160   19.350   9.5160   19.350   9.5160   18.975   6.7525   18.975   6.7525 -0.000000 0.000000 
1 1 1    7    0   49 o  910.831   8.7064 33853.37  646.286 33853.37  646.286 33853.37  646.286  910.831   8.7064  910.831   8.7064 -0.000000 0.000000 
1 1 1    7    0   50 o  112.862   2.9119  520.256   26.749  520.256   26.749  520.256   26.749  112.862   2.9119  112.862   2.9119 -0.000000 0.000000 
1 1 1    7    0   51 o  182.979   2.8629  1365.77   42.678  1365.77   42.678  1365.77   42.678  182.979   2.8629  182.979   2.8629 0.000000 0.000000 
1 1 1    7    0   52 o  561.327   4.7620 12849.59  217.855 12849.59  217.855 12849.59  217.855  561.327   4.7620  561.327   4.7620 -0.000000 0.000000 
1 1 1    7    0   53 o  463.087   3.9983  8744.77  150.906  8744.77  150.906  8744.77  150.906  463.087   3.9983  463.087   3.9983 0.000000 0.000000 
1 1 1    7    0   54 f   79.195   1.8865  256.077   12.163  256.077   12.163  256.077   12.163   79.195   1.8865   79.195   1.8865 0.000000 0.000000 
1 1 1    7    0   55 o   27.366   3.5596   32.045   7.5700   32.045   7.5700   32.045   7.5700   27.366   3.5596   27.366   3.5596 0.000000 0.000000 
1 1 1    7    0   56 o   47.431   2.3126   92.356   8.8927   92.356   8.8927   92.356   8.8927   47.431   2.3126   47.431   2.3126 0.000000 0.000000 
1 1 1    7    0   57 f  356.134   3.6793  5172.71  106.786  5172.71  106.786  5172.71  106.786  356.134   3.6793  356.134   3.6793 0.000000 0.000000 
1 1 1    7    0   58 o  436.035   3.7918  7753.82  134.750  7753.82  134.750  7753.82  134.750  436.035   3.7918  436.035   3.7918 -0.000000 0.000000 
1 1 1    7    0   59 o  438.240   3.8116  7832.77  136.139  7832.77  136.139  7832.77  136.139  438.240   3.8116  438.240   3.8116 0.000000 0.000000 
1 1 1    7    0   60 o  177.925   2.3313  1291.16   33.798  1291.16   33.798  1291.16   33.798  177.925   2.3313  177.925   2.3313 -0.000000 0.000000 
1 1 1    7    0   61 o  228.953   2.3250  2137.55   43.382  2137.55   43.382  2137.55   43.382  228.953   2.3250  228.953   2.3250 0.000000 0.000000 
1 1 1    7    0   62 o  300.563   2.8031  3684.01   68.663  3684.01   68.663  3684.01   68.663  300.563   2.8031  300.563   2.8031 -0.000000 0.000000 
1 1 1    7    0   63 o  245.108   2.4293  2449.94   48.526  2449.94   48.526  2449.94   48.526  245.108   2.4293  245.108   2.4293 -0.000000 0.000000 
1 1 1    7    0   64 o  227.730   2.3239  2114.88   43.128  2114.88   43.128  2114.88   43.128  227.730   2.3239  227.730   2.3239 0.000000 0.000000 
1 1 1    7    0   65 o   67.815   1.9507  187.938   10.763  187.938   10.763  187.938   10.763   67.815   1.9507   67.815   1.9507 0.000000 0.000000 
1 1 1    7    0   66 o   89.326   1.8387  325.676   13.376  325.676   13.376  325.676   13.376   89.326   1.8387   89.326   1.8387 -0.000000 0.000000 
1 1 1    7    0   67 f  255.948   2.5007  2671.60   52.162  2671.60   52.162  2671.60   52.162  255.948   2.5007  255.948   2.5007 0.000000 0.000000 
1 1 1    7    0   68 o   65.802   1.9706  176.983   10.549  176.983   10.549  176.983   10.549   65.802   1.9706   65.802   1.9706 -0.000000 0.000000 
1 1 1    7    0   69 o  104.946   2.0281  449.487   17.335  449.487   17.335  449.487   17.335  104.946   2.0281  104.946   2.0281 -0.000000 0.000000 
1 1 1    7    0   70 o  145.015   2.1575  857.897   25.490  857.897   25.490  857.897   25.490  145.015   2.1575  145.015   2.1575 -0.000000 0.000000 
1 1 1    7    0   71 o  128.943   2.0931  678.359   21.987  678.359   21.987  678.359   21.987  128.943   2.0931  128.943   2.0931 -0.000000 0.000000 
1 1 1    7    0   72 o  351.869   3.6559  5052.00  104.835  5052.00  104.835  5052.00  104.835  351.869   3.6559  351.869   3.6559 -0.000000 0.000000 
1 1 1    7    0   73 o   20.156   5.2912   19.640   7.5111   19.640   7.5111   19.640   7.5111   20.156   5.2912   20.156   5.2912 0.000000 0.000000 
1 1 1    7    0   74 o  255.984   2.5111  2672.62   52.386  2672.62   52.386  2672.62   52.386  255.984   2.5111  255.984   2.5111 0.000000 0.000000 
1 1 1    7    0   75 o   77.337   1.9266  244.285   12.128  244.285   12.128  244.285   12.128   77.337   1.9266   77.337   1.9266 -0.000000 0.000000 
1 1 1    7    0   76 f   19.891   5.5118   19.440   7.7292   19.440   7.7292   19.440   7.7292   19.891   5.5118   19.891   5.5118 0.000000 0.000000 
1 1 1    7    0   77 o  287.027   2.7295  3360.51   63.850  3360.51   63.850  3360.51   63.850  287.027   2.7295  287.027   2.7295 -0.000000 0.000000 
1 1 1    7    0   78 o   42.904   2.7009   75.954   9.3589   75.954   9.3589   75.954   9.3589   42.904   2.7009   42.904   2.7009 0.000000 0.000000 
1 1 1    7    0   79 f   38.079   3.0594   60.279   9.3509   60.279   9.3509   60.279   9.3509   38.079   3.0594   38.079   3.0594 -0.000000 0.000000 
1 1 1    7    0   80 o   95.148   2.0193  369.611   15.646  369.611   15.646  369.611   15.646   95.148   2.0193   95.148   2.0193 0.000000 0.000000 
1 1 1    7    0   81 o   32.410   4.6943   45.496   11.645   45.496   11.645   45.496   11.645   32.410   4.6943   32.410   4.6943 -0.000000 0.000000 
1 1 1    7    0   82 o   26.869   4.8582   32.203   9.6086   32.203   9.6086   32.203   9.6086   26.869   4.8582   26.869   4.8582 0.000000 0.000000 
1 1 1    7    0   83 o  211.299   2.2933  1821.28   39.490  1821.28   39.490  1821.28   39.490  211.299   2.2933  211.299   2.2933 -0.000000 0.000000 
1 1 1    7    0   84 o   64.663   2.5055  171.297   13.162  171.297   13.162  171.297   13.162   64.663   2.5055   64.663   2.5055 0.000000 0.000000 
1 1 1    7    0   85 o   30.383   4.2682   39.858   9.9722   39.858   9.9722   39.858   9.9722   30.383   4.2682   30.383   4.2682 -0.000000 0.000000 
1 1 1    7    0   86 o   37.368   3.4993   58.477   10.432   58.477   10.432   58.477   10.432   37.368   3.4993   37.368   3.4993 -0.000000 0.000000 
1 1 1    7    0   87 o  242.124   3.4394  2394.45   67.851  2394.45   67.851  2394.45   67.851  242.124   3.4394  242.124   3.4394 -0.000000 0.000000 
1 1 1    7    0   88 o  147.734   2.7570  891.406   33.175  891.406   33.175  891.406   33.175  147.734   2.7570  147.734   2.7570 0.000000 0.000000 
1 1 1    7    0   89 o  108.384   2.2834  479.787   20.153  479.787   20.153  479.787   20.153  108.384   2.2834  108.384   2.2834 -0.000000 0.000000 
1 1 1    7    0   90 o   98.230   2.2784  394.236   18.222  394.236   18.222  394.236   18.222   98.230   2.2784   98.230   2.2784 0.000000 0.000000 
1 1 1    7    0   91 o   11.541   6.3572   7.5671   8.6665   7.5671   8.6665   7.5671   8.6665   11.541   6.3572   11.541   6.3572 -0.000000 0.000000 
1 1 1    7    0   92 o   40.596   2.9956   68.369   9.7862   68.369   9.7862   68.369   9.7862   40.596   2.9956   40.596   2.9956 -0.000000 0.000000 
1 1 1    7    0   93 o  238.244   2.4449  2316.86   47.469  2316.86   47.469  2316.86   47.469  238.244   2.4449  238.244   2.4449 -0.000000 0.000000 
1 1 1    7    0   94 o  171.869   2.1054  1205.61   29.486  1205.61   29.486  1205.61   29.486  171.869   2.1054  171.869   2.1054 0.000000 0.000000 
1 1 1    7    0   95 o   50.316   2.7205  104.263   11.083  104.263   11.083  104.263   11.083   50.316   2.7205   50.316   2.7205 -0.000000 0.000000 
1 1 1    7    0   96 o   71.652   2.2735  210.155   13.249  210.155   13.249  210.155   13.249   71.652   2.2735   71.652   2.2735 -0.000000 0.000000 
1 1 1    7    0   97 o   85.369   2.1891  298.015   15.211  298.015   15.211  298.015   15.211   85.369   2.1891   85.369   2.1891 -0.000000 0.000000 
1 1 1    7    0   98 o   63.899   2.3954  167.408   12.437  167.408   12.437  167.408   12.437   63.899   2.3954   63.899   2.3954 0.000000 0.000000 
1 1 1    7    0   99 o   83.311   2.1017  283.844   14.252  283.844   14.252  283.844   14.252   83.311   2.1017   83.311   2.1017 -0.000000 0.000000 
1 1 1    7    0  100 o   51.376   2.6111  108.679   10.870  108.679   10.870  108.679   10.870   51.376   2.6111   51.376   2.6111 0.000000 0.000000 
1 1 1    7    0  101 f  108.945   1.9699  484.998   17.481  484.998   17.481  484.998   17.481  108.945   1.9699  108.945   1.9699 0.000000 0.000000 
1 1 1    7    0  102 f   21.899   5.7029   23.322   8.7961   23.322   8.7961   23.322   8.7961   21.899   5.7029   21.899   5.7029 0.000000 0.000000 
1 1 1    7    0  103 o  154.924   2.0404  980.801   25.757  980.801   25.757  980.801   25.757  154.924   2.0404  154.924   2.0404 0.000000 0.000000 
1 1 1    7    0  104 o   7.3865   4.9423  -2.8223   8.2379  -2.8223   8.2379  -2.8223   8.2379   7.3865   4.9423   7.3865   4.9423 0.000000 0.000000 
1 1 1    7    0  105 o   49.393   2.6015  100.671   10.408  100.671   10.408  100.671   10.408   49.393   2.6015   49.393   2.6015 -0.000000 0.000000 
1 1 1    7    0  106 o   73.390   2.3813  221.060   14.212  221.060   14.212  221.060   14.212   73.390   2.3813   73.390   2.3813 0.000000 0.000000 
1 1 1    7    0  107 o  117.649   2.7306  568.193   26.155  568.193   26.155  568.193   26.155  117.649   2.7306  117.649   2.7306 0.000000 0.000000 
1 1 1    7    0  108 o   8.9924   5.7006   1.4693   9.0342   1.4693   9.0342   1.4693   9.0342   8.9924   5.7006   8.9924   5.7006 -0.000000 0.000000 
1 1 1    7    0  109 o   5.2049   3.7518 -14.2129   7.9930 -14.2129   7.9930 -14.2129   7.9930   5.2049   3.7518   5.2049   3.7518 0.000000 0.000000 
1 1 1    7    0  110 o   66.229   2.7344  180.942   14.705  180.942   14.705  180.942   14.705   66.229   2.7344   66.229   2.7344 0.000000 0.000000 
1 1 1    7    0  111 f   26.352   4.8983   31.626   9.4546   31.626   9.4546   31.626   9.4546   26.352   4.8983   26.352   4.8983 0.000000 0.000000 
1 1 1    7    0  112 o   6.9290   4.7176  -4.3352   8.1639  -4.3352   8.1639  -4.3352   8.1639   6.9290   4.7176   6.9290   4.7176 0.000000 0.000000 
1 1 1    7    0  113 o   47.486   2.7014   93.557   10.378   93.557   10.378   93.557   10.378   47.486   2.7014   47.486   2.7014 0.000000 0.000000 
1 1 1    7    0  114 o   9.9138   5.8899   4.8192   8.2984   4.8192   8.2984   4.8192   8.2984   9.9138   5.8899   9.9138   5.8899 0.000000 0.000000 
1 1 1    7    0  115 o   78.912   2.1132  255.789   13.571  255.789   13.571  255.789   13.571   78.912   2.1132   78.912   2.1132 0.000000 0.000000 
1 1 1    7    0  116 o   10.270   6.0562   5.4566   8.6572   5.4566   8.6572   5.4566   8.6572   10.270   6.0562   10.270   6.0562 -0.000000 0.000000 
1 1 1    7    0  117 o   11.570   6.3006   8.2850   8.4098   8.2850   8.4098   8.2850   8.4098   11.570   6.3006   11.570   6.3006 -0.000000 0.000000 
1 1 1    7    0  118 o   56.905   2.4536  133.975   11.333  133.975   11.333  133.975   11.333   56.905   2.4536   56.905   2.4536 0.000000 0.000000 
1 1 1    7    0  119 o   49.185   2.6972  100.716   10.739  100.716   10.739  100.716   10.739   49.185   2.6972   49.185   2.6972 -0.000000 0.000000 
1 1 1    7    0  120 o   20.326   6.1751   21.825   8.9290   21.825   8.9290   21.825   8.9290   20.326   6.1751   20.326   6.1751 -0.000000 0.000000 
1 1 1    7    0  121 o   30.593   3.9683   41.153   9.4375   41.153   9.4375   41.153   9.4375   30.593   3.9683   30.593   3.9683 0.000000 0.000000 
1 1 1    7    0  122 o   13.698   7.1124   12.563   10.292   12.563   10.292   12.563   10.292   13.698   7.1124   13.698   7.1124 -0.000000 0.000000 
1 1 1    7    0  123 o   6.6640   4.6840  -9.6222   9.8384  -9.6222   9.8384  -9.6222   9.8384   6.6640   4.6840   6.6640   4.6840 -0.000000 0.000000 
1 1 1    7    0  124 o   37.526   5.8612   65.809   16.625   65.809   16.625   65.809   16.625   37.526   5.8612   37.526   5.8612 -0.000000 0.000000 
1 1 1    7    0  125 o   17.380   7.7864   20.111   11.755   20.111   11.755   20.111   11.755   17.380   7.7864   17.380   7.7864 0.000000 0.000000 
1 1 1    7    0  126 o   37.549   4.4957   62.948   13.239   62.948   13.239   62.948   13.239   37.549   4.4957   37.549   4.4957 0.000000 0.000000 
1 1 1    7    0  127 o   9.9148   6.3587   2.7532   11.640   2.7532   11.640   2.7532   11.640   9.9148   6.3587   9.9148   6.3587 -0.000000 0.000000 
1 1 1    7    0  128 o   22.379   7.5989   29.269   12.417   29.269   12.417   29.269   12.417   22.379   7.5989   22.379   7.5989 0.000000 0.000000 
1 1 1    7    0  129 o   57.398   3.2288  139.872   14.997  139.872   14.997  139.872   14.997   57.398   3.2288   57.398   3.2288 0.000000 0.000000 
1 1 1    7    0  130 o   28.604   8.2497   46.125   16.681   46.125   16.681   46.125   16.681   28.604   8.2497   28.604   8.2497 -0.000000 0.000000 
1 1 1    7    0  131 o   7.8738   5.5767 -14.7801   14.831 -14.7801   14.831 -14.7801   14.831   7.8738   5.5767   7.8738   5.5767 0.000000 0.000000 
1 1 1    7    0  132 o   14.417   8.2990   15.604   15.632   15.604   15.632   15.604   15.632   14.417   8.2990   14.417   8.2990 0.000000 0.000000 
1 1 1    7    0  133 o   7.1049   5.1187 -22.0237   14.789 -22.0237   14.789 -22.0237   14.789   7.1049   5.1187   7.1049   5.1187 -0.000000 0.000000 
1 1 1    7    0  134 o   10.607   7.0254   1.3343   15.945   1.3343   15.945   1.3343   15.945   10.607   7.0254   10.607   7.0254 0.000000 0.000000 
1 1 1    7    0  135 o   9.2422   6.3359  -5.3053   15.287  -5.3053   15.287  -5.3053   15.287   9.2422   6.3359   9.2422   6.3359 0.000000 0.000000 
1 1 1    7    0  136 o   19.661   9.1597   28.821   16.323   28.821   16.323   28.821   16.323   19.661   9.1597   19.661   9.1597 0.000000 0.000000 
1 1 1    7    1 -135 o   19.131   5.1761   18.418   8.2662   25.824   10.736   7.6354   12.955   22.170   5.8549   14.728   6.2383 7.442133 8.555478 
1 1 1    7    1 -134 o   12.864   5.0991   6.3065   7.9525   8.4165   10.369   3.2927   12.393   14.354   5.7776   13.393   5.8854 0.9604921 8.247326 
1 1 1    7    1 -133 o   16.039   5.3260   12.764   8.1295   3.9597   10.403   26.577   13.030   12.911   5.5331   21.751   6.6947 -8.839526 8.685298 
1 1 1    7    1 -132 o   16.767   5.2659   14.009   8.0168   9.2854   10.103   22.041   13.174   14.699   5.7716   19.873   6.7807 -5.173755 8.904468 
1 1 1    7    1 -131 o   13.497   5.1247   7.6628   7.7723   13.150   10.421   0.7832   11.668   16.349   5.9870   12.598   5.6143 3.750799 8.207641 
1 1 1    7    1 -130 o   18.675   5.0426   17.167   7.8547   13.565   10.412   21.926   11.966   16.579   5.9973   20.169   6.4459 -3.589462 8.804424 
1 1 1    7    1 -129 o   11.318   4.7535   2.7503   7.4199   7.6173   10.094  -2.9699   10.944   14.182   5.7033   11.452   5.2365 2.730452 7.742651 
1 1 1    7    1 -128 o   16.627   4.8998   13.359   7.0905   15.883   10.053   10.859   10.002   17.723   5.9236   15.467   5.8268 2.255891 8.309023 
1 1 1    7    1 -127 o   11.864   4.8371   4.0509   7.3754   3.8847   11.038   4.1850   9.9133   13.344   5.7086   13.001   5.4795 0.3422709 7.912832 
1 1 1    7    1 -126 o   21.993   4.3218   22.397   7.4714   13.667   11.055   29.736   10.137   16.886   6.1692   24.828   5.1767 -7.942291 8.053403 
1 1 1    7    1 -125 o   13.421   5.2091   6.8339   8.1526   17.197   10.959  -6.0079   12.200   18.472   6.1849   11.551   5.3694 6.920053 8.190499 
1 1 1    7    1 -124 o   24.891   4.1405   28.120   8.1058   38.766   10.681   13.662   12.447   28.919   4.6916   17.163   6.4925 11.75591 8.010185 
1 1 1    7    1 -123 o   31.253   3.4823   42.679   8.7209   47.119   10.687   33.825   15.089   32.427   4.1370   25.252   7.0580 7.174503 8.181046 
1 1 1    7    1 -122 o   14.125   5.2951   7.9266   8.2381   14.789   10.079  -5.8855   14.299   17.665   5.9316   12.753   5.8877 4.911753 8.357565 
1 1 1    7    1 -121 o   53.120   2.1766  117.567   9.4050  116.653   12.664  118.691   14.044   52.421   2.9758   52.648   3.2890 -0.2267227 4.435431 
1 1 1    7    1 -120 o   8.7821   4.0960  -5.6576   7.1950  -1.9226   10.345  -9.1568   10.013   11.783   5.2663   9.9602   4.7039 1.822664 7.061141 
1 1 1    7    1 -119 o   7.9427   3.8050  -8.9454   7.0413 -10.4928   9.8182  -7.3066   10.104   9.6211   4.5769   10.429   4.8608 -0.8080606 6.676421 
1 1 1    7    1 -118 o   61.199   1.8648  154.610   9.2921  154.405   13.088  154.819   13.195   60.768   2.6485   60.839   2.6671 -0.7083893E-01 3.758727 
1 1 1    7    1 -117 o   23.250   3.0780   23.046   5.6902   24.469   10.488   22.452   6.7738   22.953   5.6454   22.694   3.7957 0.2595768 6.802793 
1 1 1    7    1 -116 o   16.302   4.0985   11.786   5.4398   22.805   10.377   7.6101   6.3878   22.214   5.7022   13.685   4.7200 8.529436 7.402286 
1 1 1    7    1 -115 o   35.278   2.1894   51.573   6.2649   50.930   11.019   51.880   7.6153   34.408   4.0035   35.243   2.6707 -0.8348808 4.812579 
1 1 1    7    1 -114 o   40.620   1.9841   68.078   6.5498   61.303   11.236   71.566   8.0613   37.978   3.6753   41.537   2.3909 -3.559536 4.384552 
1 1 1    7    1 -113 o   27.555   2.6287   31.730   5.8329   23.877   10.455   35.279   7.0283   22.918   5.6363   28.958   3.0219 -6.039452 6.395288 
1 1 1    7    1 -112 o   22.366   3.1649   21.239   5.6092   8.8858   10.177   26.629   6.7225   15.717   5.8867   25.026   3.3818 -9.309238 6.788937 
1 1 1    7    1 -111 o   20.102   3.7581   17.474   5.9318   26.113   14.668   15.785   6.4858   23.749   7.0598   18.952   4.2976 4.797195 8.264965 
1 1 1    7    1 -110 o   35.798   2.3228   53.017   6.7414   56.255   12.792   51.771   7.9323   36.203   4.4267   35.260   2.7824 0.9431000 5.228505 
1 1 1    7    1 -109 o   47.799   1.9336   93.926   7.5185   83.460   13.614   98.519   9.0184   44.507   3.7886   48.878   2.2697 -4.370838 4.416478 
1 1 1    7    1 -108 o   45.753   1.9796   86.061   7.3658   69.975   13.388   93.043   8.8207   40.658   4.0954   47.510   2.2843 -6.852085 4.689394 
1 1 1    7    1 -107 o   40.598   1.9813   67.764   6.5371   52.358   11.256   75.606   8.0303   35.180   3.9957   42.824   2.3090 -7.643909 4.614853 
1 1 1    7    1 -106 o   34.881   2.4032   50.246   6.7912   40.427   12.492   54.365   8.0913   30.506   5.2106   36.215   2.7617 -5.708998 5.897213 
1 1 1    7    1 -105 o   59.470   1.7010  144.826   8.2376  135.964   15.179  148.526   9.8075   57.256   3.2658   60.171   2.0024 -2.914742 3.830811 
1 1 1    7    1 -104 o   51.530   1.8847  108.842   7.9034  115.299   17.373  107.157   8.8749   52.501   4.0918   51.088   2.1358 1.412598 4.615657 
1 1 1    7    1 -103 o   71.587   1.5063  209.400   8.7897  199.801   14.469  215.014   11.065   69.716   2.5504   72.466   1.8748 -2.749374 3.165345 
1 1 1    7    1 -102 o   52.519   1.7104  112.868   7.3124  111.518   12.602  113.553   8.9786   51.991   2.9860   52.625   2.0972 -0.6339722 3.648935 
1 1 1    7    1 -101 o   49.030   1.7764   98.388   7.0878   96.702   12.017   99.288   8.7773   48.408   3.0609   49.200   2.1941 -0.7919846 3.766082 
1 1 1    7    1 -100 o   70.859   1.6837  205.121   9.7254  212.127   16.911  201.659   11.888   71.838   2.8937   70.185   2.0802 1.653442 3.563854 
1 1 1    7    1  -99 f  171.764   1.5547  1204.62   21.767  1170.65   35.769  1224.61   27.432  169.055   2.5956  173.096   1.9442 -4.041580 3.242988 
1 1 1    7    1  -98 o  140.809   1.4889  809.321   17.089  822.125   29.068  802.558   21.126  141.722   2.5162  140.163   1.8491 1.559189 3.122512 
1 1 1    7    1  -97 o   77.900   1.6255  247.736   10.322  237.654   18.515  252.282   12.433   76.093   2.9908   78.584   1.9409 -2.491455 3.565378 
1 1 1    7    1  -96 o   23.882   3.5728   23.918   6.7420   27.936   12.564   22.293   7.9897   25.417   6.1347   22.881   4.4438 2.536081 7.575125 
1 1 1    7    1  -95 o  114.239   1.5795  532.583   14.709  535.220   30.051  531.753   16.867  114.246   3.2301  114.127   1.8131 0.1193161 3.704152 
1 1 1    7    1  -94 o   79.741   1.4800  259.427   9.6202  251.831   15.346  264.345   12.348   78.463   2.4022   80.468   1.8824 -2.004974 3.051934 
1 1 1    7    1  -93 o   30.409   2.5968   38.070   6.3754   30.895   11.269   41.449   7.7318   26.912   5.3254   31.685   3.0305 -4.772686 6.127272 
1 1 1    7    1  -92 o   43.998   2.0241   79.195   7.2402   80.132   13.205   78.793   8.6576   44.067   3.7105   43.850   2.4316 0.2167282 4.436261 
1 1 1    7    1  -91 o  140.603   1.4423  806.355   16.530  859.673   28.012  777.865   20.476  145.082   2.3686  138.065   1.8194 7.017303 2.986690 
1 1 1    7    1  -90 o   77.360   1.5529  244.117   9.7926  243.452   16.462  244.482   12.182   77.151   2.6215   77.400   1.9309 -0.2491989 3.255822 
1 1 1    7    1  -89 o  123.050   1.4214  617.527   14.257  619.875   23.783  616.210   17.812  123.212   2.3680  122.896   1.7780 0.3157501 2.961213 
1 1 1    7    1  -88 o  118.321   1.5088  570.989   14.552  556.314   19.785  588.286   21.480  116.754   2.0789  120.053   2.1949 -3.299103 3.023141 
1 1 1    7    1  -87 o  125.804   1.5112  645.462   15.497  635.525   21.045  657.236   22.907  124.797   2.0687  126.899   2.2145 -2.102684 3.030444 
1 1 1    7    1  -86 o  173.064   1.6091  1221.55   22.700  1192.34   30.097  1260.10   34.572  170.935   2.1600  175.698   2.4139 -4.763245 3.239232 
1 1 1    7    1  -85 o   60.747   1.7902  150.653   8.8548  144.983   12.648  156.103   12.400   59.535   2.6127   61.792   2.4668 -2.256744 3.593230 
1 1 1    7    1  -84 o  210.460   1.5372  1806.27   26.371  1814.37   39.901  1799.99   35.140  210.858   2.3215  210.050   2.0523 0.8083496 3.098559 
1 1 1    7    1  -83 o  170.425   1.4184  1184.30   19.705  1196.85   30.030  1174.81   26.113  171.279   2.1509  169.713   1.8876 1.565735 2.861730 
1 1 1    7    1  -82 o  178.365   1.4498  1297.19   21.079  1273.18   31.670  1316.29   28.245  176.658   2.1993  179.644   1.9288 -2.986115 2.925229 
1 1 1    7    1  -81 f  196.769   1.5138  1578.71   24.280  1583.70   36.793  1574.86   32.317  197.026   2.2909  196.497   2.0176 0.5292969 3.052668 
1 1 1    7    1  -80 o  109.380   1.4274  487.794   12.727  483.585   19.591  490.866   16.740  108.880   2.2074  109.710   1.8718 -0.8297653 2.894186 
1 1 1    7    1  -79 o  123.713   1.3775  623.991   13.891  652.966   21.509  603.258   18.194  126.525   2.0854  121.624   1.8352 4.900894 2.777923 
1 1 1    7    1  -78 o   38.227   2.2632   59.816   7.0206   53.997   11.132   63.660   9.0466   36.153   3.8357   39.393   2.8362 -3.240120 4.770442 
1 1 1    7    1  -77 o  119.387   1.3186  581.079   12.833  582.890   19.611  579.722   16.971  119.551   2.0124  119.235   1.7461 0.3159256 2.664277 
1 1 1    7    1  -76 o   69.028   1.4400  194.266   8.1024  191.219   12.596  196.417   10.582   68.432   2.2612   69.377   1.8729 -0.9447708 2.936135 
1 1 1    7    1  -75 f  169.491   1.3758  1171.16   19.007  1169.22   28.736  1172.67   25.344  169.321   2.0820  169.582   1.8334 -0.2609100 2.774174 
1 1 1    7    1  -74 o  109.820   1.4585  491.691   13.056  478.798   17.400  508.307   19.753  108.357   1.9699  111.640   2.1706 -3.282814 2.931191 
1 1 1    7    1  -73 o  145.779   1.5208  866.419   18.072  889.000   23.939  836.497   27.557  147.650   1.9890  143.208   2.3606 4.441696 3.086885 
1 1 1    7    1  -72 o  132.268   1.4379  713.233   15.503  727.964   21.260  696.503   22.656  133.612   1.9520  130.687   2.1267 2.925140 2.886755 
1 1 1    7    1  -71 o  175.926   1.5599  1261.82   22.369  1250.96   29.974  1275.47   33.607  175.146   2.0994  176.842   2.3314 -1.696289 3.137331 
1 1 1    7    1  -70 o  216.032   1.7190  1902.82   30.272  1889.08   40.282  1920.64   45.884  215.221   2.2961  216.992   2.5941 -1.771194 3.464304 
1 1 1    7    1  -69 o  172.359   1.4485  1211.10   20.351  1215.91   29.427  1206.70   28.174  172.678   2.0906  172.026   2.0092 0.6520691 2.899574 
1 1 1    7    1  -68 o  207.393   1.5693  1753.54   26.529  1830.56   44.563  1711.26   33.018  211.849   2.5805  204.861   1.9772 6.988159 3.250932 
1 1 1    7    1  -67 o  174.864   1.4505  1246.54   20.676  1228.31   33.636  1257.61   26.213  173.548   2.3777  175.627   1.8310 -2.079910 3.000960 
1 1 1    7    1  -66 o   15.467   4.1910   10.090   5.4144   2.0964   9.5360   13.893   6.5774   13.274   5.4658   18.089   4.4835 -4.815077 7.069438 
1 1 1    7    1  -65 o  201.612   1.4647  1657.04   24.072  1617.47   35.931  1689.27   32.424  199.163   2.2132  203.546   1.9542 -4.383423 2.952516 
1 1 1    7    1  -64 o  203.551   1.4693  1689.04   24.379  1691.99   36.916  1686.77   32.465  203.701   2.2232  203.397   1.9581 0.3034973 2.962583 
1 1 1    7    1  -63 o   81.587   1.3730  271.344   9.1314  276.019   15.755  268.978   11.206   82.239   2.3525   81.227   1.6924 1.012558 2.898041 
1 1 1    7    1  -62 o  251.342   1.7594  2575.44   36.047  2623.20   60.086  2548.58   45.056  253.603   2.9066  250.009   2.2108 3.594727 3.651836 
1 1 1    7    1  -61 o  221.527   1.5277  2000.52   27.587  1951.76   47.877  2024.76   33.754  218.768   2.6848  222.855   1.8581 -4.087219 3.265031 
1 1 1    7    1  -60 o  150.708   1.2805  925.838   15.731  969.152   28.860  907.530   18.763  154.173   2.2965  149.207   1.5427 4.965790 2.766516 
1 1 1    7    1  -59 o  136.157   1.2491  755.674   13.863  785.253   25.361  743.069   16.556  138.780   2.2419  135.014   1.5043 3.766235 2.699781 
1 1 1    7    1  -58 o  257.962   1.5919  2712.61   33.474  2706.61   53.341  2716.51   42.993  257.645   2.5398  258.134   2.0432 -0.4891357 3.259682 
1 1 1    7    1  -57 o  449.317   2.5978  8231.52   95.147  8379.01  167.573  8161.35  115.587  453.143   4.5366  447.355   3.1697 5.788361 5.534258 
1 1 1    7    1  -56 o  191.313   1.3365  1491.89   20.843  1520.93   33.887  1474.22   26.434  193.151   2.1523  190.171   1.7052 2.979996 2.745939 
1 1 1    7    1  -55 o  172.975   1.2806  1219.58   18.057  1213.99   28.991  1223.11   23.080  172.568   2.0610  173.222   1.6346 -0.6537476 2.630480 
1 1 1    7    1  -54 o  469.839   3.0647  9000.92  117.375  9000.14  155.616  9001.94  178.769  469.745   4.0640  469.736   4.6688 0.8392334E-02 6.189815 
1 1 1    7    1  -53 o   20.138   3.6190   17.044   5.7226   19.556   9.3376   15.533   7.2419   21.472   5.3536   19.134   4.6820 2.338106 7.112086 
1 1 1    7    1  -52 o  312.430   2.0470  3979.05   52.133  3957.87   73.676  4000.29   73.779  311.573   2.9009  313.238   2.8895 -1.665833 4.094429 
1 1 1    7    1  -51 o  286.318   2.0463  3341.70   47.758  3332.74   63.389  3353.46   72.632  285.918   2.7198  286.795   3.1069 -0.8766174 4.129132 
1 1 1    7    1  -50 o  332.107   2.1397  4495.98   57.925  4600.31   83.302  4398.31   80.602  335.913   3.0423  328.456   3.0104 7.456665 4.279959 
1 1 1    7    1  -49 o  252.728   1.7471  2603.45   35.992  2575.75   50.275  2632.57   51.549  251.369   2.4536  254.126   2.4885 -2.756866 3.494664 
1 1 1    7    1  -48 o  201.108   1.5213  1648.51   24.939  1673.06   35.235  1623.85   35.302  202.594   2.1336  199.592   2.1698 3.002197 3.043062 
1 1 1    7    1  -47 o  364.844   2.4586  5426.08   73.119  5441.80   96.904  5405.29  111.421  365.352   3.2538  364.109   3.7541 1.243317 4.967940 
1 1 1    7    1  -46 o  553.778   3.5527 12502.63  160.372 12364.35  210.035 12695.96  248.352  550.649   4.6793  557.935   5.4607 -7.285400 7.191306 
1 1 1    7    1  -45 o  275.096   1.8533  3084.65   41.560  3054.47   52.221  3136.79   68.637  273.741   2.3403  277.394   3.0355 -3.653107 3.832878 
1 1 1    7    1  -44 o  168.706   1.4117  1160.06   19.414  1183.52   24.787  1122.83   31.226  170.401   1.7845  165.971   2.3081 4.430038 2.917510 
1 1 1    7    1  -43 o  206.092   1.5662  1731.20   26.311  1755.97   33.472  1691.14   42.562  207.558   1.9784  203.686   2.5635 3.872391 3.238114 
1 1 1    7    1  -42 o  505.801   3.2790 10429.15  135.193 10375.27  178.021 10502.58  207.797  504.457   4.3292  507.513   5.0229 -3.056091 6.631132 
1 1 1    7    1  -41 o  192.551   1.5319  1511.17   24.044  1529.12   34.127  1493.48   33.882  193.687   2.1615  191.417   2.1715 2.270065 3.063888 
1 1 1    7    1  -40 o  223.429   1.6573  2034.72   30.184  2038.57   42.628  2030.86   42.746  223.635   2.3384  223.212   2.3493 0.4238129 3.314719 
1 1 1    7    1  -39 o  1018.13   5.9435 42272.32  493.269 42819.84  705.321 41748.18  690.102  1024.41   8.4465  1011.52   8.3695 12.89001 11.89085 
1 1 1    7    1  -38 o  433.361   2.8695  7655.28  101.366  7617.47  133.150  7707.41  156.328  432.270   3.7788  434.797   4.4108 -2.527313 5.808097 
1 1 1    7    1  -37 o  120.950   1.7750  596.260   17.500  654.613   22.521  507.323   27.803  126.728   2.1801  111.518   3.0614 15.21024 3.758324 
1 1 1    7    1  -36 o  880.281   5.5172 31596.44  395.891 31773.88  526.279 31365.16  600.849  882.602   7.3150  876.799   8.4068 5.803040 11.14376 
1 1 1    7    1  -35 o  372.951   2.3528  5669.48   71.526  5730.51   91.037  5571.03  115.620  374.944   2.9786  369.675   3.8369 5.269501 4.857345 
1 1 1    7    1  -34 f  499.922   3.0250 10187.44  123.270 10227.88  156.414 10121.13  200.262  500.894   3.8308  498.241   4.9309 2.653656 6.244103 
1 1 1    7    1  -33 o  394.897   2.4566  6356.38   79.077  6364.58  100.084  6342.76  129.005  395.142   3.1072  394.447   4.0122 0.6950378 5.074701 
1 1 1    7    1  -32 o  367.874   2.3126  5516.13   69.349  5522.73   87.766  5505.17  113.149  368.086   2.9251  367.487   3.7772 0.5997314 4.777407 
1 1 1    7    1  -31 o  712.611   4.2045 20701.90  244.235 20837.35  310.690 20482.80  395.143  714.889   5.3315  708.697   6.8400 6.191895 8.672435 
1 1 1    7    1  -30 o  708.218   3.9383 20446.76  227.359 20427.04  304.954 20471.45  341.151  707.820   5.2854  708.558   5.9066 -0.7379150 7.926083 
1 1 1    7    1  -29 o  567.561   3.3912 13130.88  156.891 13204.56  223.079 13058.77  220.694  569.110   4.8087  565.960   4.7838 3.149780 6.782903 
1 1 1    7    1  -28 o  318.524   2.0492  4135.35   53.205  4138.84   75.409  4131.90   75.080  318.650   2.9032  318.383   2.8929 0.2672729 4.098470 
1 1 1    7    1  -27 o  718.586   4.2355 21050.32  248.093 21005.94  350.519 21094.87  351.195  717.749   5.9910  719.266   5.9899 -1.517639 8.471838 
1 1 1    7    1  -26 o  733.049   4.3192 21906.43  258.089 22781.75  436.304 21435.29  320.098  747.401   7.1614  725.076   5.4158 22.32550 8.978693 
1 1 1    7    1  -25 o  704.338   4.7933 20225.12  275.203 20357.88  480.128 20160.16  335.850  706.444   8.3376  703.157   5.8594 3.287109 10.19065 
1 1 1    7    1  -24 o  330.766   2.2466  4459.37   60.575  4437.55   92.417  4475.81   80.206  329.941   3.4362  331.367   2.9693 -1.425659 4.541433 
1 1 1    7    1  -23 o  677.888   4.2769 18733.60  236.332 18730.45  361.193 18735.96  312.515  677.727   6.5381  677.872   5.6557 -0.1453857 8.644834 
1 1 1    7    1  -22 o  676.770   4.2700 18671.92  235.560 18267.39  353.088 18996.37  316.217  669.297   6.4718  682.563   5.6834 -13.26569 8.613101 
1 1 1    7    1  -21 o  322.694   2.1988  4244.39   57.839  4221.02   87.976  4262.18   76.761  321.791   3.3539  323.362   2.9121 -1.571167 4.441776 
1 1 1    7    1  -20 f  412.909   2.3937  6949.39   80.568  7001.65  121.589  6908.49  107.574  414.438   3.5991  411.679   3.2056 2.759186 4.819737 
1 1 1    7    1  -19 o  504.624   2.8649 10379.84  117.847 10461.42  177.898 10316.04  157.315  506.567   4.3082  503.048   3.8364 3.518646 5.768776 
1 1 1    7    1  -18 o  195.184   1.3748  1552.77   21.873  1568.11   33.010  1540.76   29.205  196.143   2.0646  194.426   1.8428 1.717377 2.767379 
1 1 1    7    1  -17 o  432.896   2.4960  7638.57   88.077  7607.06  131.728  7664.05  118.447  431.977   3.7409  433.601   3.3512 -1.624115 5.022461 
1 1 1    7    1  -16 o  1347.44   7.8176 74067.24  858.654 74475.06  1409.13 73826.38  1082.93  1350.09   12.804  1344.87   9.8783 5.216187 16.17183 
1 1 1    7    1  -15 o  1002.16   5.5084 40953.42  449.987 41526.55  683.171 40514.21  598.047  1008.84   8.3075  996.589   7.3618 12.25684 11.10000 
1 1 1    7    1  -14 o  669.653   3.9579 18281.67  216.048 18424.50  307.530 18142.48  303.586  672.177   5.6126  667.015   5.5835 5.162415 7.916926 
1 1 1    7    1  -13 o  628.934   3.5161 16125.24  180.262 16131.19  270.448 16120.49  241.808  628.969   5.2750  628.789   4.7177 0.1792603 7.076848 
1 1 1    7    1  -12 o  454.747   2.7647  8429.54  102.484  8441.10  145.185  8418.05  144.684  455.029   3.9142  454.408   3.9061 0.6214905 5.529800 
1 1 1    7    1  -11 o  469.337   2.8451  8979.23  108.849  8986.91  154.159  8971.58  153.714  469.504   4.0280  469.104   4.0198 0.4002991 5.690707 
1 1 1    7    1  -10 o  551.555   3.8078 12402.21  171.196 12342.53  208.886 12524.33  298.783  550.190   4.6576  554.116   6.6148 -3.925659 8.090063 
1 1 1    7    1   -9 o  347.510   2.3417  4922.48   66.335  4885.32   87.393  4973.00  101.891  346.182   3.0969  349.264   3.5789 -3.082092 4.732795 
1 1 1    7    1   -8 o  548.261   3.7859 12254.60  169.199 12163.44  238.060 12347.67  240.527  546.143   5.3474  550.263   5.3624 -4.119568 7.572962 
1 1 1    7    1   -7 o  362.526   2.4261  5357.17   71.695  5292.79   94.101  5446.25  110.690  360.326   3.2038  365.500   3.7152 -5.174103 4.905818 
1 1 1    7    1   -6 o   97.437   1.2650  386.962   10.047  362.676   13.283  419.430   15.359   94.329   1.7275  101.441   1.8574 -7.112045 2.536600 
1 1 1    7    1   -5 o  648.372   4.4326 17140.60  234.269 17317.95  334.581 16970.03  328.127  651.587   6.2993  645.013   6.2408 6.573608 8.867262 
1 1 1    7    1   -4 o  471.992   3.3016  9081.80  127.028  9144.08  180.897  9021.23  178.419  473.555   4.6862  470.364   4.6534 3.190430 6.604167 
1 1 1    7    1   -3 o  514.130   3.5724 10776.18  149.717 11005.15  215.475 10562.46  208.178  519.493   5.0884  508.941   5.0180 10.55219 7.146480 
1 1 1    7    1   -2 o  318.250   2.5848  4128.59   67.054  4066.40   85.748  4226.47  107.579  315.829   3.3307  321.967   4.0990 -6.137299 5.281626 
1 1 1    7    1   -1 o  290.961   2.4101  3450.86   57.162  3425.91   73.530  3488.98   90.875  289.896   3.1116  292.537   3.8109 -2.641266 4.919872 
1 1 1    7    1    0 o   55.096   1.5425  123.827   6.9207  121.556   8.6146  127.960   11.622   54.575   1.9395   55.970   2.5541 -1.394714 3.207024 
1 1 1    7    1    1 o  254.843   1.9950  2647.20   41.443  2684.73   51.279  2576.52   70.370  256.638   2.4512  251.397   3.4339 5.240112 4.219030 
1 1 1    7    1    2 o  235.140   1.8839  2253.67   36.109  2280.00   44.694  2204.17   61.273  236.505   2.3183  232.527   3.2327 3.978394 3.978047 
1 1 1    7    1    3 o  493.334   3.4353  9921.88  138.149  9909.42  169.095  9946.87  239.570  492.995   4.2078  493.836   5.9513 -0.8410950 7.288598 
1 1 1    7    1    4 o  124.488   1.4079  631.653   14.287  621.170   17.570  652.109   24.545  123.449   1.7460  126.483   2.3806 -3.033691 2.952276 
1 1 1    7    1    5 o  232.520   1.8725  2203.72   35.491  2186.32   43.386  2238.90   61.703  231.596   2.2982  234.352   3.2300 -2.756088 3.964146 
1 1 1    7    1    6 o  212.050   1.9291  1832.79   33.345  1860.44   43.588  1793.80   51.774  213.637   2.5030  209.770   3.0278 3.867203 3.928431 
1 1 1    7    1    7 o  210.046   1.7554  1798.29   30.055  1838.94   43.165  1760.03   41.874  212.400   2.4931  207.793   2.4722 4.606659 3.510989 
1 1 1    7    1    8 o  507.259   3.8601 10490.31  159.611 10249.03  247.374 10662.40  208.916  501.287   6.0538  511.352   5.0120 -10.06537 7.859366 
1 1 1    7    1    9 o  371.573   2.9304  5628.15   88.758  5591.19  139.559  5653.24  115.016  370.307   4.6234  372.381   3.7891 -2.073456 5.977700 
1 1 1    7    1   10 o  208.719   1.9130  1775.65   32.548  1757.69   51.112  1787.90   42.214  207.650   3.0196  209.432   2.4727 -1.782227 3.902859 
1 1 1    7    1   11 o  215.567   1.9536  1894.09   34.328  1875.82   53.902  1906.55   44.525  214.514   3.0826  216.270   2.5257 -1.755722 3.985119 
1 1 1    7    1   12 o  234.693   2.0643  2245.11   39.493  2232.69   62.165  2253.52   51.138  234.030   3.2586  235.126   2.6681 -1.096481 4.211621 
1 1 1    7    1   13 o  561.167   4.2387 12838.68  193.892 12584.13  301.365 13018.47  253.273  555.453   6.6559  565.024   5.4990 -9.571106 8.633708 
1 1 1    7    1   14 o  461.484   3.5456  8681.76  133.376  8613.30  209.591  8728.35  172.902  459.591   5.5946  462.689   4.5843 -3.097809 7.232925 
1 1 1    7    1   15 o  377.685   2.9753  5814.69   91.599  5654.73  141.691  5929.55  120.061  372.416   4.6674  381.379   3.8620 -8.962982 6.058026 
1 1 1    7    1   16 o  323.502   2.6202  4265.85   69.096  4373.02  111.219  4198.50   88.176  327.514   4.1660  320.927   3.3706 6.587219 5.358747 
1 1 1    7    1   17 o  439.033   3.7928  7857.64  135.736  7762.16  189.984  7957.19  193.999  436.312   5.3418  441.758   5.3874 -5.445892 7.586719 
1 1 1    7    1   18 o  556.709   4.2082 12634.92  190.968 12500.56  299.352 12727.12  247.982  553.638   6.6332  558.689   5.4452 -5.051636 8.581892 
1 1 1    7    1   19 o  637.941   4.7823 16592.21  248.689 16432.01  389.935 16702.05  322.877  634.705   7.5368  639.981   6.1892 -5.275757 9.752376 
1 1 1    7    1   20 f  569.860   4.3022 13238.84  199.845 13266.86  316.633 13220.28  257.647  570.357   6.8104  569.414   5.5509 0.9429932 8.785997 
1 1 1    7    1   21 o  667.559   6.4429 18172.70  350.598 17567.25  589.649 18503.81  436.050  656.002   11.027  673.518   7.9424 -17.51587 13.58945 
1 1 1    7    1   22 o  352.436   3.6231  5063.38  104.086  5352.54  188.275  4936.10  124.911  362.297   6.3752  347.965   4.4038 14.33182 7.748328 
1 1 1    7    1   23 o   99.775   1.9541  405.760   15.893  427.352   27.879  395.366   19.343  102.336   3.3466   98.487   2.4094 3.848381 4.123702 
1 1 1    7    1   24 o  692.335   6.6688 19546.82  376.358 19559.03  652.315 19540.73  460.786  692.171   11.561  692.132   8.1672 0.3900146E-01 14.15513 
1 1 1    7    1   25 o   82.866   1.7555  279.880   11.858  269.962   16.972  289.341   16.576   81.342   2.5628   84.219   2.4170 -2.876488 3.522762 
1 1 1    7    1   26 o  277.924   2.3397  3148.38   53.005  3260.55   86.179  3080.13   67.224  282.817   3.7382  274.889   3.0001 7.927979 4.793165 
1 1 1    7    1   27 o  1101.55   8.1070 49495.39  727.948 49513.14  1151.54 49483.58  939.474  1101.08   12.830  1101.12   10.467 -0.4223633E-01 16.55779 
1 1 1    7    1   28 o  428.491   3.3264  7484.28  116.184  7469.95  183.658  7493.84  150.018  428.037   5.2637  428.746   4.2925 -0.7084961 6.792057 
1 1 1    7    1   29 o  735.281   5.4767 22043.25  328.251 22260.55  523.593 21902.55  421.330  738.686   8.6956  732.840   7.0530 5.845642 11.19636 
1 1 1    7    1   30 o  392.800   3.0900  6289.27   98.937  6542.92  161.639  6137.32  125.112  400.604   4.9499  388.010   3.9557 12.59375 6.336297 
1 1 1    7    1   31 o  241.594   2.3953  2379.10   47.173  2469.25   68.407  2297.36   65.137  246.120   3.4097  237.400   3.3660 8.720291 4.791255 
1 1 1    7    1   32 o  443.540   3.8464  8019.67  139.067  8111.49  198.475  7931.12  194.913  446.028   5.4589  441.043   5.4215 4.985779 7.693716 
1 1 1    7    1   33 o  392.267   3.4624  6272.47  110.711  6413.20  159.295  6140.99  153.977  396.610   4.9272  388.103   4.8671 8.506897 6.925786 
1 1 1    7    1   34 f  398.740   3.5142  6481.25  114.224  6584.06  163.626  6383.52  159.526  401.855   4.9951  395.689   4.9458 6.166168 7.029422 
1 1 1    7    1   35 o  478.917   4.1270  9350.40  161.114  9445.17  229.833  9258.82  225.916  481.280   5.8584  476.510   5.8162 4.769653 8.255245 
1 1 1    7    1   36 o  778.104   6.4808 24691.26  411.055 25200.14  591.551 24216.12  571.601  785.837   9.2347  770.355   9.1026 15.48224 12.96678 
1 1 1    7    1   37 o  698.739   5.8540 19909.33  333.430 19767.98  468.294 20054.67  474.856  696.081   8.2532  701.105   8.3089 -5.024658 11.71124 
1 1 1    7    1   38 o  613.895   5.1842 15366.39  259.424 15571.09  371.049 15170.65  362.850  617.841   7.3675  609.849   7.2991 7.991394 10.37094 
1 1 1    7    1   39 o  127.422   2.9443  661.838   30.582  661.838   30.582   0.0000   0.0000  127.422   2.9443  ?   ?  0.000000 2.944320 
1 1 1    7    1   40 o  302.511   2.8606  3730.32   70.540  3744.23   99.983  3716.54   99.535  303.054   4.0473  301.931   4.0442 1.122864 5.721588 
1 1 1    7    1   41 o  269.329   2.6436  2956.81   58.039  3025.51   83.249  2891.84   80.958  272.423   3.7488  266.338   3.7290 6.085419 5.287649 
1 1 1    7    1   42 o  215.887   3.2734  1899.95   57.605   0.0000   0.0000  1899.95   57.605  ?   ?   215.887   3.2734 0.000000 3.273384 
1 1 1    7    1   43 o  670.412   6.5043 18333.05  355.451 18099.31  430.765 18831.81  629.236  665.996   7.9347  678.917   11.370 -12.92126 13.86496 
1 1 1    7    1   44 o  368.421   3.8316  5533.78  115.071  5421.88  138.956  5777.98  205.277  364.651   4.6748  376.351   6.6913 -11.69916 8.162575 
1 1 1    7    1   45 o  494.634   4.9173  9976.90  198.267  9917.09  241.808 10099.60  346.346  493.087   6.0160  497.411   8.5420 -4.323975 10.44789 
1 1 1    7    1   46 o  337.394   3.0899  4640.60   84.981  4863.68  124.668  4446.98  116.147  345.369   4.4283  330.246   4.3145 15.12256 6.182634 
1 1 1    7    1   47 o  254.038   2.2359  2630.62   46.300  2630.32   59.734  2631.06   73.279  254.014   2.8849  254.036   3.5387 -0.2279663E-01 4.565653 
1 1 1    7    1   48 o  504.315   3.5265 10369.41  144.971 10243.93  175.656 10637.46  256.735  501.214   4.2994  510.617   6.1681 -9.403107 7.518661 
1 1 1    7    1   49 o  552.013   3.8297 12424.81  172.327 12318.90  209.483 12646.50  303.082  549.598   4.6759  556.673   6.6792 -7.075745 8.153273 
1 1 1    7    1   50 o  389.172   2.8132  6174.44   89.243  6163.58  109.056  6196.46  155.272  388.805   3.4410  389.766   4.8871 -0.9611206 5.976981 
1 1 1    7    1   51 o  118.086   1.4061  568.374   13.535  568.450   20.834  568.319   17.805  118.089   2.1643  118.078   1.8498 0.1098633E-01 2.847140 
1 1 1    7    1   52 o  465.314   3.2869  8828.21  124.672  8778.10  175.195  8879.63  177.452  463.898   4.6330  466.571   4.6658 -2.672607 6.575288 
1 1 1    7    1   53 o   26.267   2.8539   28.462   6.0125   29.987   8.2432   26.729   8.7889   26.840   3.8802   25.229   4.4355 1.610983 5.893168 
1 1 1    7    1   54 o   68.925   1.4200  193.642   7.9783  190.040   11.354  197.155   11.213   68.247   2.0432   69.516   1.9809 -1.269142 2.845798 
1 1 1    7    1   55 o   34.023   2.1006   47.369   5.7974   38.498   8.3505   55.623   8.0551   30.535   3.4131   36.837   2.7014 -6.301472 4.352797 
1 1 1    7    1   56 o   74.517   1.4314  226.339   8.6946  219.801   13.116  231.464   11.613   73.394   2.1947   75.329   1.8927 -1.934288 2.898169 
1 1 1    7    1   57 o  182.929   1.5544  1364.06   23.179  1415.16   31.547  1304.12   34.168  186.314   2.0772  178.849   2.3437 7.465027 3.131719 
1 1 1    7    1   58 o  323.461   2.0971  4265.51   55.294  4354.72   79.493  4181.88   76.964  326.780   2.9843  320.231   2.9484 6.548462 4.195095 
1 1 1    7    1   59 o  105.084   1.3697  450.128   11.733  453.824   17.846  447.313   15.572  105.506   2.0750  104.750   1.8237 0.7559433 2.762540 
1 1 1    7    1   60 o  327.749   2.1196  4379.59   56.627  4297.62   79.008  4466.18   81.203  324.613   2.9858  330.916   3.0104 -6.302856 4.240000 
1 1 1    7    1   61 o   56.900   1.5736  132.086   7.2915  133.685   10.122  130.361   10.512   57.219   2.1741   56.497   2.2874 0.7224731 3.155776 
1 1 1    7    1   62 o  258.115   1.7800  2716.13   37.452  2724.70   53.132  2707.66   52.800  258.486   2.5217  257.677   2.5138 0.8091736 3.560579 
1 1 1    7    1   63 o  272.802   1.8487  3034.16   41.110  3001.95   57.819  3067.08   58.464  271.308   2.6144  274.235   2.6154 -2.927368 3.697996 
1 1 1    7    1   64 o   95.870   1.3566  374.669   10.601  397.221   16.392  358.454   13.899   98.702   2.0374   93.766   1.8185 4.936226 2.730916 
1 1 1    7    1   65 o  206.460   1.6587  1737.79   27.915  1836.16   43.782  1670.41   36.235  212.184   2.5313  202.396   2.1963 9.787476 3.351311 
1 1 1    7    1   66 o  369.553   2.6912  5570.41   81.070  5755.25  117.609  5403.06  111.904  375.488   3.8424  363.828   3.7732 11.66040 5.385311 
1 1 1    7    1   67 o  133.084   1.6757  722.088   18.178  722.408   23.082  721.567   29.499  133.101   2.1274  133.003   2.7208 0.9806824E-01 3.453811 
1 1 1    7    1   68 o  308.672   2.3459  3885.70   59.026  3871.68   71.954  3914.54  103.212  308.068   2.8653  309.621   4.0895 -1.552765 4.993376 
1 1 1    7    1   69 o   60.175   1.6542  147.743   8.1062  155.646   10.388  135.433   12.963   61.747   2.0667   57.552   2.7714 4.194458 3.457146 
1 1 1    7    1   70 o  222.770   1.7517  2023.40   31.809  1993.44   41.416  2066.49   49.672  221.086   2.2981  225.072   2.7074 -3.986130 3.551244 
1 1 1    7    1   71 o  145.157   1.4731  859.012   17.431  861.426   22.835  855.641   26.982  145.347   1.9273  144.845   2.2853 0.5024414 2.989502 
1 1 1    7    1   72 o  148.468   1.5888  898.696   19.228  887.278   26.506  911.380   27.936  147.500   2.2046  149.486   2.2926 -1.986115 3.180568 
1 1 1    7    1   73 o  112.985   1.5303  520.451   14.094  533.735   19.481  505.864   20.415  114.402   2.0891  111.370   2.2487 3.032234 3.069362 
1 1 1    7    1   74 o  129.071   1.5541  679.212   16.351  684.889   22.597  672.973   23.690  129.589   2.1392  128.452   2.2625 1.137115 3.113635 
1 1 1    7    1   75 f  199.155   1.7910  1617.29   29.076  1613.43   40.544  1621.37   41.719  198.874   2.5010  199.358   2.5672 -0.4840851 3.584085 
1 1 1    7    1   76 o  374.506   2.7431  5722.84   83.741  5690.94  117.485  5755.78  119.393  373.256   3.8613  375.367   3.9020 -2.111481 5.489573 
1 1 1    7    1   77 o   50.609   1.9661  104.609   8.0955   92.031   10.293  125.013   13.109   47.417   2.6737   55.269   2.9201 -7.851944 3.959296 
1 1 1    7    1   78 o  103.102   1.5177  433.418   12.756  437.961   16.619  426.906   19.899  103.628   1.9674  102.296   2.3864 1.331589 3.092799 
1 1 1    7    1   79 o   89.769   1.6179  328.589   11.839  324.738   15.247  334.438   18.789   89.227   2.0962   90.498   2.5496 -1.270454 3.300696 
1 1 1    7    1   80 o  218.930   1.9721  1954.85   35.194  1959.78   49.857  1949.97   49.686  219.131   2.7912  218.582   2.7886 0.5488892 3.945472 
1 1 1    7    1   81 f  206.963   1.9004  1746.94   32.061  1753.03   45.302  1740.84   45.381  207.255   2.6815  206.532   2.6955 0.7234192 3.802139 
1 1 1    7    1   82 o  106.153   1.5296  459.486   13.236  460.065   17.093  458.618   20.916  106.204   1.9744  106.016   2.4203 0.1876297 3.123531 
1 1 1    7    1   83 o   91.203   1.6770  339.222   12.468  336.672   14.757  345.584   23.307   90.848   1.9927   91.934   3.1146 -1.086128 3.697460 
1 1 1    7    1   84 o  113.536   1.6236  525.696   15.026  513.729   17.825  555.075   27.929  112.221   1.9486  116.548   2.9422 -4.326546 3.528951 
1 1 1    7    1   85 o   45.173   2.8791   83.675   10.546   84.973   11.808   78.555   23.448   45.491   3.2048   43.131   6.9019 2.360138 7.609702 
1 1 1    7    1   86 o   99.246   1.6474  401.740   13.328  414.915   18.512  387.561   19.203  100.830   2.2523   97.439   2.4177 3.390251 3.304256 
1 1 1    7    1   87 o  130.465   1.6359  694.261   17.398  705.404   24.291  682.525   24.930  131.463   2.2668  129.305   2.3652 2.157730 3.276059 
1 1 1    7    1   88 o  296.816   2.3170  3596.56   56.060  3646.21   79.724  3547.99   78.844  298.615   3.2752  294.563   3.2836 4.051819 4.637810 
1 1 1    7    1   89 o   35.312   2.4441   51.163   6.9919   39.970   9.8260   62.643   9.9511   30.985   3.9823   39.015   3.1559 -8.029175 5.081185 
1 1 1    7    1   90 o   93.993   1.5544  360.382   11.909  360.035   17.163  360.703   16.540   93.906   2.2421   93.999   2.1586 -0.9305573E-01 3.112303 
1 1 1    7    1   91 o   71.129   1.5857  206.397   9.1940  193.093   12.559  221.759   13.496   68.730   2.2448   73.660   2.2503 -4.929749 3.178476 
1 1 1    7    1   92 o  172.107   1.5745  1208.46   22.089  1197.50   29.438  1222.59   33.417  171.258   2.1087  173.003   2.3696 -1.744446 3.172027 
1 1 1    7    1   93 o  202.178   1.6915  1668.05   27.876  1676.30   37.276  1657.58   41.990  202.581   2.2573  201.384   2.5579 1.197067 3.411499 
1 1 1    7    1   94 o  130.971   1.4924  699.860   15.934  696.634   21.503  703.789   23.728  130.613   2.0196  131.256   2.2177 -0.6433868 2.999534 
1 1 1    7    1   95 o  167.051   1.4945  1138.67   20.350  1123.80   28.800  1153.50   28.760  165.859   2.1302  168.043   2.0996 -2.183395 2.990963 
1 1 1    7    1   96 o  131.712   1.4517  707.902   15.586  709.058   22.287  706.796   21.804  131.739   2.0754  131.535   2.0335 0.2038879 2.905624 
1 1 1    7    1   97 o   12.245   4.6703   4.3205   6.4732  -0.6675   9.6378   8.4199   8.7373   12.318   5.3031   15.379   5.5027 -3.060917 7.642143 
1 1 1    7    1   98 o   29.021   2.8255   34.833   6.5997   30.379   9.8215   38.499   8.9114   26.731   4.6776   30.381   3.6728 -3.650082 5.947228 
1 1 1    7    1   99 f   47.604   1.8555   92.739   7.1866   97.647   10.526   88.453   9.8358   48.748   2.6590   46.396   2.6112 2.351940 3.726766 
1 1 1    7    1  100 o   34.709   2.2870   49.523   6.4344   56.380   9.5016   43.715   8.7446   36.904   3.1898   32.431   3.3562 4.472893 4.630262 
1 1 1    7    1  101 o   94.916   1.4711  367.913   11.382  357.676   17.327  375.684   15.096   93.458   2.2744   95.845   1.9322 -2.386658 2.984332 
1 1 1    7    1  102 o   97.506   1.4656  388.341   11.649  401.596   18.067  378.909   15.240   99.014   2.2385   96.236   1.9427 2.777527 2.963952 
1 1 1    7    1  103 o   87.125   1.5881  310.253   11.278  304.813   16.247  315.312   15.669   86.191   2.3146   87.721   2.1913 -1.529884 3.187340 
1 1 1    7    1  104 o   19.410   3.9876   16.203   6.0980   13.283   8.7603   18.948   8.4935   17.716   5.4957   20.834   5.0536 -3.118856 7.466045 
1 1 1    7    1  105 o   55.536   1.7361  126.341   7.8497  121.915   10.850  131.201   11.371   54.417   2.4523   56.450   2.4771 -2.032673 3.485671 
1 1 1    7    1  106 o   39.379   2.1696   63.835   6.9374   71.810   9.8146   55.871   9.8073   41.614   2.9117   36.581   3.3253 5.033947 4.419894 
1 1 1    7    1  107 o   42.789   2.1002   75.336   7.3031   93.802   12.026   64.546   9.1923   47.501   3.1231   39.429   2.8799 8.071110 4.248235 
1 1 1    7    1  108 o   65.771   1.5763  177.075   8.4509  176.138   12.308  177.911   11.624   65.395   2.3126   65.765   2.1713 -0.3694229 3.172153 
1 1 1    7    1  109 o   70.567   1.5379  203.862   8.8461  209.480   12.976  198.983   12.092   71.323   2.2346   69.542   2.1356 1.780823 3.090960 
1 1 1    7    1  110 o   48.177   1.8606   95.400   7.2929   89.896   10.625  100.302   10.028   46.511   2.8157   49.234   2.5069 -2.723171 3.770023 
1 1 1    7    1  111 o   15.786   4.5771   10.869   6.2313   19.825   8.9707   2.5182   8.6621   21.040   5.2482   12.528   5.1889 8.512325 7.380278 
1 1 1    7    1  112 o   50.546   1.8285  105.064   7.5213  107.434   11.065  103.029   10.254   50.856   2.6786   49.850   2.5318 1.006264 3.685792 
1 1 1    7    1  113 o   18.541   4.3591   15.197   6.4765   16.182   10.579   14.606   8.1910   19.076   6.0567   18.103   5.2474 0.9730186 8.013679 
1 1 1    7    1  114 o   52.054   1.8271  111.505   7.7405  118.517   11.410  105.527   10.536   53.396   2.6295   50.399   2.5730 2.997028 3.678982 
1 1 1    7    1  115 o   51.998   1.8310  111.338   7.7489  119.910   11.446  104.084   10.529   53.681   2.6237   50.017   2.5912 3.663437 3.687553 
1 1 1    7    1  116 o   29.857   2.9318   37.570   7.0435   35.631   11.142   38.860   9.0905   28.207   5.0301   30.047   3.7961 -1.839296 6.301807 
1 1 1    7    1  117 o   39.034   2.4331   63.496   7.7034   65.477   10.589   61.269   11.227   39.267   3.3400   37.809   3.6897 1.457603 4.976904 
1 1 1    7    1  118 o   41.885   2.3382   73.059   7.9516   63.602   10.667   84.884   11.928   38.600   3.4259   44.701   3.2968 -6.101841 4.754532 
1 1 1    7    1  119 o   28.821   3.1889   35.519   7.3668   39.233   9.8152   30.728   11.148   29.851   4.1454   25.659   5.4955 4.192324 6.883657 
1 1 1    7    1  120 o   38.134   2.4732   60.980   7.6463   51.754   12.164   67.006   9.8314   34.043   4.4932   39.691   3.0624 -5.647945 5.437530 
1 1 1    7    1  121 o   30.901   2.8767   40.630   7.1629   33.000   11.397   45.612   9.2089   26.426   5.4712   32.417   3.5426 -5.991037 6.517994 
1 1 1    7    1  122 o   15.930   5.2414   11.639   7.8787   8.5804   10.753   15.184   11.577   15.146   5.9523   17.937   6.3427 -2.791199 8.698199 
1 1 1    7    1  123 o   39.883   2.5444   67.208   8.2288   60.663   10.505   77.604   13.238   37.304   3.4952   41.885   3.9230 -4.580841 5.254199 
1 1 1    7    1  124 o   36.633   3.1943   58.085   9.4435   73.352   13.708   44.297   13.028   40.350   4.2306   30.326   5.4714 10.02390 6.916230 
1 1 1    7    1  125 o   12.606   5.2958   3.6769   9.2123   7.0965   14.647   1.4388   11.850   15.490   6.5999   13.067   5.7482 2.422605 8.752182 
1 1 1    7    1  126 o   30.341   4.1023   41.695   9.8863   38.596   15.368   43.884   12.913   26.717   6.9809   30.039   5.4753 -3.322069 8.871932 
1 1 1    7    1  127 o   43.457   3.0203   81.523   10.633   73.155   16.690   87.239   13.794   38.897   5.4099   44.191   3.8683 -5.293453 6.650639 
1 1 1    7    1  128 o   31.023   4.7270   45.263   11.576   75.367   16.448   15.714   16.296   39.591   5.2241   17.926   7.2332 21.66483 8.922445 
1 1 1    7    1  129 o   15.760   5.7754   11.719   9.6996   17.968   12.354   1.6731   15.663   18.488   6.5506   14.296   6.4276 4.192264 9.177425 
1 1 1    7    1  130 o   15.457   5.8583   10.969   10.146   5.9760   12.905   19.051   16.418   14.431   6.1731   18.773   7.3617 -4.342392 9.607375 
1 1 1    7    1  131 o   19.887   5.8757   20.625   10.185   18.831   13.088   23.380   16.219   18.658   6.7274   20.068   7.4480 -1.410103 10.03646 
1 1 1    7    1  132 o   11.988   5.3901  -0.4701   11.015   6.3058   15.386  -7.5927   15.775   15.076   6.5933   12.548   5.9193 2.528406 8.860554 
1 1 1    7    1  133 o   11.095   5.2509  -8.2744   12.604   6.1393   21.789 -15.5234   15.452   16.294   7.4269   11.275   5.4598 5.018736 9.217857 
1 1 1    7    1  134 o   25.106   6.4701   34.497   13.324   50.286   23.234   26.759   16.264   26.540   9.0058   20.965   7.5068 5.574675 11.72420 
1 1 1    7    1  135 o   13.124   5.8904   1.1565   13.090   3.3976   23.280   0.1204   15.830   16.082   7.4555   13.804   6.3069 2.277916 9.765326 
1 1 1    7    2 -135 o   16.309   7.5845   3.6045   24.388   0.0000   0.0000   3.6045   24.388  ?   ?    16.309   7.5845 0.000000 7.584522 
1 1 1    7    2 -134 o   13.792   5.3617   8.0405   8.6480   19.460   11.648  -5.9841   12.909   18.870   6.3769   11.599   5.4347 7.270501 8.378608 
1 1 1    7    2 -133 o   22.460   4.6868   24.396   8.3029   25.301   10.591   22.953   13.374   21.943   5.8247   20.045   6.8322 1.898560 8.978154 
1 1 1    7    2 -132 o   33.439   3.5533   50.042   9.5374   55.553   13.009   43.638   14.024   34.051   4.8215   28.793   6.1612 5.257679 7.823523 
1 1 1    7    2 -131 o   18.251   5.5835   17.062   9.0807   26.010   12.263   6.1984   13.512   21.813   6.4478   14.563   6.2743 7.250302 8.996699 
1 1 1    7    2 -130 o   11.550   5.0022   1.7820   8.6762   3.2284   11.641  -0.0255   13.013   13.216   5.7581   12.928   5.8315 0.2877722 8.195296 
1 1 1    7    2 -129 o   21.862   4.7823   23.014   8.2848   22.252   10.581   24.221   13.319   20.647   5.9578   20.881   6.8114 -0.2341099 9.049400 
1 1 1    7    2 -128 o   44.627   2.5553   84.805   9.2567   65.907   11.696  116.485   15.143   38.350   3.7910   51.220   3.6509 -12.87002 5.263177 
1 1 1    7    2 -127 o   28.892   3.6246   37.242   8.3491   31.801   10.676   45.810   13.397   25.460   5.3158   30.412   5.6111 -4.951429 7.729269 
1 1 1    7    2 -126 o   16.486   5.4326   13.200   8.4630   18.868   11.232   5.7570   12.871   19.081   6.2572   14.500   6.1829 4.580832 8.796597 
1 1 1    7    2 -125 o   14.396   5.3122   8.9918   8.2297   19.291   10.930  -4.4899   12.506   19.386   6.1566   11.964   5.5172 7.422079 8.266967 
1 1 1    7    2 -124 o   22.456   4.8478   23.942   8.6134   24.544   11.547   23.187   12.932   21.823   6.2008   20.909   6.7029 0.9136887 9.131189 
1 1 1    7    2 -123 o   21.579   4.8018   22.000   8.2288   24.699   10.612   17.929   13.032   22.252   5.7943   18.828   6.7222 3.424105 8.874777 
1 1 1    7    2 -122 o   20.447   5.2197   20.085   8.7284   19.788   10.672   20.685   15.169   19.912   6.0455   20.029   7.2398 -0.1172047 9.431989 
1 1 1    7    2 -121 o   43.272   2.7472   79.310   9.6402   76.612   11.780   84.780   16.774   42.064   3.4663   43.094   4.8598 -1.030548 5.969358 
1 1 1    7    2 -120 f   13.044   5.2191   5.1738   8.4082   8.7943   10.333  -1.9216   14.465   15.183   5.8723   13.690   6.1642 1.493086 8.513618 
1 1 1    7    2 -119 o   27.094   4.1200   32.556   8.8129   23.151   10.801   51.291   15.244   21.908   5.9121   32.893   5.9022 -10.98442 8.353950 
1 1 1    7    2 -118 o   34.697   3.0706   51.163   8.5950   51.078   11.340   51.277   13.176   34.099   4.1661   33.691   4.9449 0.4078331 6.465913 
1 1 1    7    2 -117 o   10.984   4.4648   2.6823   6.2607  -2.6785   10.318   5.8060   7.8763   11.676   5.2359   13.245   5.1258 -1.568969 7.327262 
1 1 1    7    2 -116 o   37.929   2.3484   59.882   7.2252   59.485   11.499   60.141   9.2875   37.163   3.8517   37.747   3.0442 -0.5841484 4.909461 
1 1 1    7    2 -115 o   47.383   2.0349   92.784   7.8411   89.579   11.987   95.181   10.367   46.086   3.2110   47.755   2.6737 -1.669437 4.178432 
1 1 1    7    2 -114 o   16.966   4.1772   12.755   5.7380   9.7173   10.247   14.143   6.9257   15.969   5.9213   17.775   4.7064 -1.805706 7.563878 
1 1 1    7    2 -113 o   42.720   2.1338   75.433   7.4072   77.583   13.265   74.459   8.9289   42.670   3.8553   42.300   2.6021 0.3692551 4.651240 
1 1 1    7    2 -112 o   17.257   4.1505   13.123   5.7666   8.2312   10.195   15.424   6.9928   15.420   5.8658   18.623   4.6270 -3.203104 7.471090 
1 1 1    7    2 -111 f   44.681   1.9854   82.271   7.2130   64.159   11.255   94.894   9.3961   38.949   3.5853   47.870   2.4158 -8.921257 4.323196 
1 1 1    7    2 -110 o   24.906   3.0811   26.171   6.1219   29.255   10.306   24.490   7.6100   25.678   5.1035   23.786   4.0711 1.891560 6.528410 
1 1 1    7    2 -109 o   20.830   3.6026   18.631   5.8956   10.148   9.9838   23.172   7.3054   16.262   5.8741   23.163   4.0145 -6.901138 7.114854 
1 1 1    7    2 -108 o   10.700   4.3008   2.4640   5.7372   10.558   9.7892  -1.7706   7.0807   16.427   5.8302   10.002   4.4198 6.425063 7.316079 
1 1 1    7    2 -107 o   51.789   1.8785  110.141   7.9172  115.302   11.907  106.050   10.600   52.759   2.7784   50.650   2.5758 2.108757 3.788743 
1 1 1    7    2 -106 o   17.098   4.3097   12.746   6.0037   12.530   9.8927   12.872   7.5538   17.447   5.8767   17.229   5.0521 0.2178326 7.749754 
1 1 1    7    2 -105 o   50.118   1.8611  103.056   7.5901   97.108   11.599  107.510   10.038   48.405   2.9536   51.077   2.4177 -2.672215 3.816991 
1 1 1    7    2 -104 o   57.198   1.7472  134.031   8.1370  146.788   12.651  125.030   10.627   59.677   2.6069   55.122   2.3706 4.554199 3.523601 
1 1 1    7    2 -103 o   84.640   1.6969  293.043   11.708  285.502   21.130  296.384   14.064   83.130   3.1237   85.056   2.0285 -1.925316 3.724586 
1 1 1    7    2 -102 o   93.773   1.5893  359.437   12.148  357.776   19.358  360.517   15.604   93.311   2.5473   93.826   2.0402 -0.5153351 3.263650 
1 1 1    7    2 -101 o  108.072   1.6906  477.440   14.893  437.378   26.738  495.461   17.933  103.002   3.1883  110.028   1.9994 -7.025726 3.763391 
1 1 1    7    2 -100 o   58.275   2.1992  139.232   10.428  126.679   27.983  141.256   11.237   54.372   6.4386   58.672   2.3544 -4.300682 6.855603 
1 1 1    7    2  -99 o   21.317   4.6884   19.577   7.9250   6.8354   23.749   21.174   8.4069   20.685   8.5818   22.168   4.7923 -1.482830 9.829177 
1 1 1    7    2  -98 o   39.092   2.6076   62.883   8.2618   52.190   16.201   66.640   9.6044   34.879   5.9090   40.196   2.9518 -5.316975 6.605281 
1 1 1    7    2  -97 o   87.448   1.6343  312.255   11.650  325.965   19.092  304.123   14.704   89.178   2.6293   86.251   2.0914 2.927048 3.359610 
1 1 1    7    2  -96 f  131.851   1.4913  709.555   16.029  744.653   23.750  680.196   21.721  134.968   2.1587  129.011   2.0655 5.957489 2.987700 
1 1 1    7    2  -95 o  120.866   1.5102  596.197   14.879  608.298   21.867  585.765   20.303  121.996   2.1989  119.733   2.0803 2.263252 3.027001 
1 1 1    7    2  -94 o   13.333   4.9887   5.5367   7.3050   5.1538   11.528   5.7936   9.4427   15.358   6.1225   14.554   5.6177 0.8041296 8.309239 
1 1 1    7    2  -93 o   29.213   3.4422   35.455   8.0397   36.149   13.872   35.104   9.8656   29.007   6.0625   28.910   4.3185 0.9644318E-01 7.443329 
1 1 1    7    2  -92 o   31.717   2.9034   41.493   7.4233   39.205   11.311   43.225   9.8388   30.523   4.6964   32.242   3.8176 -1.719009 6.052287 
1 1 1    7    2  -91 o   92.348   1.5017  347.907   11.304  333.779   16.297  361.008   15.693   90.405   2.2114   94.034   2.0473 -3.628639 3.013635 
1 1 1    7    2  -90 o   53.793   1.9354  118.257   8.4725  129.545   12.619  108.992   11.433   56.229   2.7615   51.568   2.7295 4.661289 3.882812 
1 1 1    7    2  -89 o   51.250   2.1334  107.410   8.8932  100.553   13.924  112.135   11.558   49.444   3.4770   52.314   2.7196 -2.870338 4.414276 
1 1 1    7    2  -88 o  170.048   1.6187  1179.60   22.437  1208.18   34.816  1159.29   29.343  171.994   2.4833  168.524   2.1361 3.470230 3.275622 
1 1 1    7    2  -87 o  113.113   1.7373  521.966   16.019  544.760   22.332  497.807   22.991  115.509   2.3718  110.403   2.5547 5.105576 3.485917 
1 1 1    7    2  -86 o  198.069   1.8770  1600.59   30.306  1584.68   41.956  1617.95   43.823  196.987   2.6129  199.031   2.7011 -2.044128 3.758079 
1 1 1    7    2  -85 o  158.550   1.4851  1025.18   19.194  1032.77   27.380  1017.84   26.915  159.088   2.1113  157.936   2.0907 1.152130 2.971303 
1 1 1    7    2  -84 o  125.283   1.4352  640.059   14.656  631.116   20.802  648.875   20.654  124.371   2.0519  126.112   2.0091 -1.740433 2.871698 
1 1 1    7    2  -83 o   69.148   1.6507  195.007   9.3042  194.326   13.473  195.628   12.864   68.960   2.4005   69.200   2.2837 -0.2393951 3.313211 
1 1 1    7    2  -82 o   80.524   1.6566  264.434   10.874  256.836   14.664  273.716   16.208   79.305   2.2707   81.860   2.4316 -2.555206 3.326970 
1 1 1    7    2  -81 f  131.648   1.5496  706.726   16.630  710.236   22.430  702.440   24.781  131.948   2.0854  131.208   2.3170 0.7399292 3.117274 
1 1 1    7    2  -80 o  190.300   1.6923  1476.80   26.251  1494.09   35.248  1455.26   39.338  191.370   2.2596  188.841   2.5555 2.529221 3.411219 
1 1 1    7    2  -79 o  313.427   2.4332  4008.07   62.165  4009.26   76.348  4005.74  107.079  313.389   2.9887  313.010   4.1967 0.3791199 5.152150 
1 1 1    7    2  -78 o  180.086   1.6985  1322.47   24.933  1350.78   33.687  1288.17   37.079  181.967   2.2711  177.678   2.5601 4.289261 3.422261 
1 1 1    7    2  -77 o  256.874   1.9693  2691.12   41.235  2679.11   54.581  2707.10   62.938  256.235   2.6132  257.523   2.9982 -1.287720 3.977177 
1 1 1    7    2  -76 o  286.439   2.0973  3346.40   48.970  3317.76   64.476  3385.45   75.279  285.134   2.7740  287.968   3.2070 -2.833679 4.240271 
1 1 1    7    2  -75 o  273.019   2.0185  3039.94   44.921  3029.48   59.346  3053.97   68.741  272.485   2.6718  273.534   3.0830 -1.049316 4.079644 
1 1 1    7    2  -74 o   89.210   1.4299  324.461   10.398  324.467   14.850  324.455   14.564   89.197   2.0424   89.196   2.0031 0.6713867E-03 2.860770 
1 1 1    7    2  -73 o   64.682   1.5947  170.579   8.4080  180.266   12.233  161.905   11.576   66.442   2.2619   62.964   2.2591 3.478577 3.196821 
1 1 1    7    2  -72 o  151.134   1.5424  931.261   19.001  909.286   24.488  964.512   30.123  149.323   2.0118  153.773   2.4032 -4.449554 3.134111 
1 1 1    7    2  -71 o   17.521   4.2501   13.044   6.0071   13.237   8.8109   12.876   8.2114   17.978   5.5000   17.659   5.2901 0.3191872 7.631200 
1 1 1    7    2  -70 o  142.345   1.3924  826.034   16.156  838.592   23.075  813.957   22.629  143.405   1.9740  141.283   1.9649 2.121750 2.785186 
1 1 1    7    2  -69 o  182.328   1.5881  1355.34   23.603  1374.71   31.776  1331.51   35.254  183.604   2.1231  180.682   2.3936 2.921249 3.199552 
1 1 1    7    2  -68 o  244.134   1.8536  2430.20   36.887  2394.74   48.580  2478.47   56.684  242.309   2.4595  246.480   2.8213 -4.171234 3.742838 
1 1 1    7    2  -67 o  223.910   1.7601  2044.14   32.125  2005.93   42.260  2096.44   49.444  221.777   2.3376  226.703   2.6756 -4.926086 3.552930 
1 1 1    7    2  -66 o   25.896   3.1542   27.766   6.5210   30.898   9.0312   24.356   9.4255   27.189   4.2109   23.970   4.9865 3.218985 6.526669 
1 1 1    7    2  -65 o  103.325   1.3643  435.214   11.491  457.396   16.346  413.540   16.157  105.915   1.8932  100.708   1.9682 5.207100 2.730954 
1 1 1    7    2  -64 o   67.374   1.5205  185.055   8.3504  192.202   11.868  178.048   11.751   68.622   2.1242   66.042   2.1859 2.580490 3.048028 
1 1 1    7    2  -63 o   76.659   1.5452  239.572   9.6555  230.734   14.493  246.626   12.948   75.182   2.3678   77.745   2.0448 -2.563210 3.128504 
1 1 1    7    2  -62 o  370.267   2.5123  5591.13   75.828  5777.03  118.633  5462.71   98.599  376.215   3.8684  365.909   3.3057 10.30646 5.088451 
1 1 1    7    2  -61 o  188.225   1.6144  1444.32   24.770  1524.55   38.760  1388.93   32.205  193.351   2.4592  184.564   2.1406 8.787857 3.260389 
1 1 1    7    2  -60 o   47.430   1.9802   91.880   7.6392   88.378   11.338   94.791   10.338   46.451   3.0105   48.139   2.6448 -1.688454 4.007253 
1 1 1    7    2  -59 o  134.629   1.4644  738.851   16.070  792.617   24.910  700.524   21.032  139.426   2.1918  131.081   1.9684 8.344971 2.945919 
1 1 1    7    2  -58 o  208.557   1.7098  1773.18   29.068  1791.20   38.392  1748.98   44.496  209.597   2.2471  207.098   2.6358 2.499512 3.463645 
1 1 1    7    2  -57 o  360.716   2.4662  5305.45   72.514  5473.13   97.975  5102.33  107.834  366.312   3.2812  353.646   3.7407 12.66599 4.975813 
1 1 1    7    2  -56 o  202.587   1.6832  1673.04   27.797  1679.51   36.586  1664.21   42.751  202.965   2.2113  202.026   2.5960 0.9386902 3.410158 
1 1 1    7    2  -55 o  392.730   2.4635  6288.53   78.864  6377.17  112.899  6204.06  110.210  395.416   3.5027  390.015   3.4666 5.400909 4.928088 
1 1 1    7    2  -54 o  161.425   1.6328  1062.21   21.485  1122.04   31.626  1010.94   29.277  165.896   2.3387  157.470   2.2809 8.426270 3.266782 
1 1 1    7    2  -53 o  317.178   2.3960  4101.44   61.948  4230.36   89.871  3984.73   85.508  322.077   3.4231  312.590   3.3558 9.486755 4.793644 
1 1 1    7    2  -52 o  308.268   2.1713  3873.99   54.560  3920.27   84.304  3840.63   71.571  310.059   3.3355  306.914   2.8608 3.145020 4.394296 
1 1 1    7    2  -51 o   73.960   1.5457  222.968   9.3190  205.116   14.502  235.526   12.163   70.887   2.5137   75.986   1.9653 -5.099449 3.190748 
1 1 1    7    2  -50 o   22.793   3.6279   21.711   6.5148   26.669   10.925   18.975   8.1156   25.079   5.4963   21.148   4.8160 3.930731 7.307737 
1 1 1    7    2  -49 o  360.168   2.4507  5288.22   71.950  5361.95  111.313  5235.31   94.296  362.617   3.7658  358.333   3.2283 4.283630 4.960173 
1 1 1    7    2  -48 o  430.167   2.6602  7543.67   93.281  7394.14  130.010  7702.32  133.916  425.834   3.7454  434.615   3.7800 -8.781586 5.321333 
1 1 1    7    2  -47 o  204.140   1.5427  1698.60   25.671  1709.71   36.113  1687.26   36.499  204.798   2.1632  203.449   2.2009 1.349243 3.085977 
1 1 1    7    2  -46 o  200.239   1.5323  1634.30   25.011  1632.19   31.424  1637.93   41.314  200.106   1.9265  200.450   2.5284 -0.3438416 3.178744 
1 1 1    7    2  -45 o  394.699   2.6304  6350.62   84.631  6383.79  112.193  6306.83  128.916  395.702   3.4782  393.289   4.0212 2.412933 5.316819 
1 1 1    7    2  -44 o  257.085   1.8819  2693.98   39.437  2667.09   51.764  2731.18   60.885  255.790   2.4826  258.839   2.8856 -3.048370 3.806616 
1 1 1    7    2  -43 o  298.954   1.9726  3642.95   48.070  3612.55   67.252  3674.71   68.734  297.692   2.7714  300.241   2.8084 -2.549500 3.945632 
1 1 1    7    2  -42 o  286.194   2.1889  3338.64   51.065  3274.10   61.799  3477.53   90.664  283.407   2.6751  292.056   3.8083 -8.649048 4.653965 
1 1 1    7    2  -41 o  336.689   2.3112  4620.71   63.431  4706.44   84.942  4512.63   95.371  339.784   3.0668  332.705   3.5166 7.079285 4.666014 
1 1 1    7    2  -40 o   78.431   1.7084  250.729   10.923  255.943   12.688  235.812   21.463   79.241   1.9644   75.976   3.4749 3.265358 3.991663 
1 1 1    7    2  -39 o  127.645   1.3372  664.092   13.913  624.974   19.740  702.709   19.613  123.826   1.9557  131.302   1.8325 -7.475761 2.680095 
1 1 1    7    2  -38 o  233.802   1.6788  2228.05   31.996  2189.39   45.045  2267.41   45.455  231.759   2.3843  235.853   2.3643 -4.093674 3.357846 
1 1 1    7    2  -37 o  335.163   2.0433  4578.75   55.823  4574.07   83.743  4582.50   74.889  334.977   3.0669  335.290   2.7401 -0.3136597 4.112638 
1 1 1    7    2  -36 o  724.554   4.0383 21402.32  238.507 21852.59  364.581 21065.45  315.350  732.013   6.1100  718.756   5.3824 13.25665 8.142603 
1 1 1    7    2  -35 o  572.212   3.2334 13347.20  150.817 13182.27  224.018 13483.92  203.966  568.609   4.8332  575.097   4.3509 -6.488586 6.503077 
1 1 1    7    2  -34 f  707.014   3.9401 20378.10  227.075 20346.52  340.342 20403.43  304.846  706.363   5.9109  707.388   5.2867 -1.024231 7.930191 
1 1 1    7    2  -33 o  361.799   2.1640  5335.45   63.822  5340.43   96.005  5331.51   85.432  361.952   3.2539  361.656   2.8979 0.2963867 4.357306 
1 1 1    7    2  -32 o  608.981   3.4216 15117.73  169.849 15280.66  257.274 14991.85  226.134  612.189   5.1555  606.401   4.5748 5.788391 6.892627 
1 1 1    7    2  -31 o  664.055   3.7080 17976.20  200.713 17995.11  301.494 17961.14  268.983  664.324   5.5675  663.726   4.9716 0.5980835 7.464222 
1 1 1    7    2  -30 f  181.194   1.5640  1338.16   23.101  1314.30   34.742  1357.06   30.929  179.568   2.3735  182.467   2.0794 -2.899338 3.155550 
1 1 1    7    2  -29 o  173.089   1.6208  1221.13   22.869  1191.38   33.121  1248.23   31.614  170.965   2.3767  174.997   2.2162 -4.032364 3.249608 
1 1 1    7    2  -28 o   85.266   1.3119  296.322   9.1181  301.373   15.891  293.843   11.133   85.957   2.2700   84.908   1.6085 1.049644 2.782109 
1 1 1    7    2  -27 o  781.857   4.5957 24921.83  292.895 24933.44  478.989 24914.89  370.164  781.859   7.5156  781.684   5.8093 0.1754150 9.499056 
1 1 1    7    2  -26 o  367.767   2.6675  5513.06   79.968  5832.93  146.107  5376.25   95.550  378.249   4.7387  363.168   3.2277 15.08112 5.733469 
1 1 1    7    2  -25 o  446.485   2.7249  8125.71   99.173  8169.85  141.147  8082.67  139.373  447.675   3.8679  445.281   3.8398 2.394409 5.450173 
1 1 1    7    2  -24 o  468.687   2.8452  8953.96  108.699  9045.14  155.258  8866.30  152.234  471.043   4.0435  466.364   4.0045 4.678955 5.690886 
1 1 1    7    2  -23 o  260.289   1.8817  2761.46   39.926  2774.29   61.603  2752.16   52.427  260.886   2.8968  259.847   2.4752 1.039246 3.810204 
1 1 1    7    2  -22 o  696.505   4.7452 19777.65  269.409 20011.98  385.252 19553.39  376.889  700.519   6.7467  692.450   6.6771 8.068848 9.492169 
1 1 1    7    2  -21 o  417.369   2.7416  7100.47   93.274  6995.93  122.129  7246.81  144.491  414.271   3.6166  421.622   4.2042 -7.350586 5.545711 
1 1 1    7    2  -20 o  604.842   3.8433 14913.15  189.488 15065.91  253.097 14718.31  285.834  607.890   5.1077  600.807   5.8364 7.083069 7.755763 
1 1 1    7    2  -19 o  358.618   2.5962  5242.11   75.894  5263.20  107.825  5221.40  106.844  359.323   3.6813  357.894   3.6623 1.429382 5.192726 
1 1 1    7    2  -18 o  789.070   5.3450 25385.85  343.797 25531.64  488.797 25243.13  483.648  791.191   7.5790  786.710   7.5419 4.480225 10.69209 
1 1 1    7    2  -17 o  1020.15   6.8620 42441.52  570.620 42888.98  814.489 42010.19  799.673  1025.20   9.7463  1014.66   9.6685 10.54797 13.72843 
1 1 1    7    2  -16 o  445.595   3.4351  8093.78  124.773  8195.10  199.721  8028.92  159.794  448.323   5.4651  443.784   4.4172 4.539612 7.027039 
1 1 1    7    2  -15 o  743.541   5.0506 22540.29  306.116 22370.83  430.433 22713.72  435.438  740.619   7.1297  746.272   7.1580 -5.652527 10.10300 
1 1 1    7    2  -14 f  537.173   3.7179 11762.85  162.799 11901.17  232.804 11630.47  227.745  540.272   5.2862  534.094   5.2311 6.177795 7.436970 
1 1 1    7    2  -13 o  510.961   3.2895 10642.50  137.011 10501.44  207.203 10752.10  182.639  507.515   5.0085  513.557   4.3628 -6.041992 6.642280 
1 1 1    7    2  -12 o  1009.94   6.7980 41597.78  559.648 42370.27  804.598 40873.76  778.948  1018.94   9.6871  1000.81   9.5482 18.13806 13.60176 
1 1 1    7    2  -11 o  1043.10   6.4973 44372.78  552.458 44601.49  847.474 44203.75  728.533  1045.38   9.9453  1040.89   8.5864 4.489868 13.13902 
1 1 1    7    2  -10 o  907.257   6.1215 33565.79  452.712 33521.25  639.586 33610.50  640.880  906.415   8.6564  907.620   8.6624 -1.205200 12.24620 
1 1 1    7    2   -9 o  163.291   1.4431  1086.78   19.208  1089.94   25.605  1082.72   29.047  163.526   1.9209  162.982   2.1864 0.5436707 2.910374 
1 1 1    7    2   -8 o  176.580   1.4948  1270.87   21.516  1173.60   31.881  1352.23   29.158  169.684   2.3049  182.142   1.9638 -12.45836 3.028059 
1 1 1    7    2   -7 o  563.558   3.5993 12946.94  165.344 12816.48  216.952 13127.70  255.383  560.672   4.7470  567.405   5.5216 -6.733215 7.281586 
1 1 1    7    2   -6 o  548.879   3.7952 12281.54  169.805 12069.06  236.778 12506.54  243.651  544.053   5.3391  553.823   5.3971 -9.770142 7.591723 
1 1 1    7    2   -5 o  652.961   4.1345 17381.75  220.062 17506.15  293.118 17221.05  333.138  655.229   5.4880  649.826   6.2891 5.403687 8.346926 
1 1 1    7    2   -4 o  636.175   4.3549 16500.05  225.834 16476.89  276.345 16546.62  391.848  635.683   5.3330  636.888   7.5478 -1.205017 9.241759 
1 1 1    7    2   -3 o  455.750   2.9663  8466.76  110.198  8539.98  146.920  8372.58  166.620  457.692   3.9380  453.167   4.5106 4.524933 5.987728 
1 1 1    7    2   -2 o  265.682   2.2503  2877.15   48.736  2956.77   64.318  2769.81   74.683  269.325   2.9297  260.664   3.5148 8.661133 4.575694 
1 1 1    7    2   -1 o  793.194   5.3736 25654.26  347.443 25733.76  492.698 25575.62  490.031  794.244   7.6101  791.801   7.5923 2.442627 10.74971 
1 1 1    7    2    0 o  252.677   1.9840  2602.33   40.864  2596.09   57.787  2608.58   57.794  252.366   2.8091  252.972   2.8027 -0.6061707 3.968123 
1 1 1    7    2    1 o  451.350   3.1727  8304.26  116.730  8250.79  164.269  8358.79  165.904  449.860   4.4796  452.794   4.4949 -2.934235 6.345971 
1 1 1    7    2    2 o  162.525   1.5430  1076.62   20.442  1059.12   28.776  1094.44   29.045  161.196   2.1900  163.861   2.1745 -2.665451 3.086167 
1 1 1    7    2    3 o  401.002   2.8610  6554.71   93.519  6464.58  130.818  6648.91  133.742  398.211   4.0301  403.847   4.0627 -5.636383 5.722539 
1 1 1    7    2    4 o  662.399   4.5228 17888.81  244.208 17855.15  344.821 17922.69  345.906  661.673   6.3931  662.922   6.4012 -1.249817 9.046945 
1 1 1    7    2    5 o  663.437   4.5297 17944.86  244.966 17816.69  344.305 18076.25  348.603  660.962   6.3904  665.757   6.4236 -4.795044 9.060926 
1 1 1    7    2    6 o  188.229   1.8189  1444.12   27.908  1454.11   36.280  1429.63   43.679  188.876   2.3564  187.276   2.8612 1.600418 3.706660 
1 1 1    7    2    7 o  359.346   2.8568  5263.61   83.680  5199.66  107.097  5363.84  134.081  357.142   3.6788  362.718   4.5348 -5.575897 5.839348 
1 1 1    7    2    8 o  550.764   4.6589 12367.28  209.165 12287.81  294.301 12448.39  297.329  548.905   6.5775  552.479   6.6022 -3.573608 9.319426 
1 1 1    7    2    9 o  270.717   2.2859  2987.25   50.445  2992.16   65.235  2979.94   79.557  270.933   2.9538  270.371   3.6098 0.5621033 4.664296 
1 1 1    7    2   10 o  451.558   3.4809  8312.03  128.128  8328.64  165.765  8287.37  201.946  451.983   4.4992  450.830   5.4952 1.153076 7.102145 
1 1 1    7    2   11 o  370.161   2.9284  5585.21   88.360  5610.84  114.481  5547.45  138.967  370.995   3.7855  368.875   4.6217 2.119568 5.974116 
1 1 1    7    2   12 o  164.585   1.7102  1104.09   22.945  1066.15   29.165  1165.70   37.168  161.731   2.2123  169.109   2.6963 -7.378891 3.487705 
1 1 1    7    2   13 o  502.433   3.8306 10290.74  156.885 10292.98  202.551 10287.38  248.032  502.454   4.9454  502.277   6.0580 0.1777954 7.820254 
1 1 1    7    2   14 f  445.769   3.4414  8100.17  125.050  8182.06  162.765  7982.19  195.359  447.993   4.4571  442.461   5.4165 5.532990 7.014607 
1 1 1    7    2   15 o  717.397   5.3491 20983.90  312.805 20413.95  394.142 21953.75  514.148  707.504   6.8342  733.573   8.5982 -26.06873 10.98343 
1 1 1    7    2   16 o  272.837   2.5844  3034.24   57.478  2947.38   80.002  3126.90   82.633  268.892   3.6499  276.960   3.6602 -8.067780 5.169033 
1 1 1    7    2   17 o  171.895   2.2426  1204.37   31.423  1366.12   58.025  1137.24   37.379  183.062   3.8885  167.033   2.7453 16.02902 4.759901 
1 1 1    7    2   18 o  655.300   6.3333 17510.67  338.304 17367.02  581.589 17584.14  415.908  652.284   10.938  656.590   7.7708 -4.306519 13.41747 
1 1 1    7    2   19 o   60.513   2.1958  149.450   10.813  157.791   18.472  145.103   13.337   62.108   3.6650   59.601   2.7526 2.507195 4.583580 
1 1 1    7    2   20 o  490.311   4.8411  9801.10  193.488   0.0000   0.0000  9801.10  193.488  ?   ?   490.311   4.8411 0.000000 4.841138 
1 1 1    7    2   21 o  548.672   4.1558 12272.24  185.868 12210.76  292.811 12313.73  240.543  547.209   6.5644  549.559   5.3696 -2.350708 8.480831 
1 1 1    7    2   22 o  639.300   4.7944 16662.43  249.850 16894.05  399.802 16514.01  320.042  643.589   7.6208  636.387   6.1695 7.201660 9.805063 
1 1 1    7    2   23 o  216.322   2.2224  1907.37   39.189  1898.30   55.287  1916.53   55.558  215.801   3.1430  216.835   3.1433 -1.034103 4.445029 
1 1 1    7    2   24 o  346.031   2.7766  4880.65   78.318  4845.48  123.366  4904.39  101.364  344.757   4.3898  346.860   3.5850 -2.103455 5.667697 
1 1 1    7    2   25 o  1080.52   7.9580 47622.84  700.924 48296.70  1122.41 47192.05  897.426  1087.47   12.662  1075.33   10.238 12.13184 16.28315 
1 1 1    7    2   26 o  924.175   6.8320 34831.67  514.680 34887.20  815.085 34794.85  663.742  924.497   10.816  923.503   8.8171 0.9929199 13.95436 
1 1 1    7    2   27 o  231.654   2.0789  2187.31   39.256  2244.81   63.377  2151.52   50.003  234.669   3.3131  229.747   2.6700 4.922333 4.255058 
1 1 1    7    2   28 o  541.524   4.1120 11954.70  181.513 12167.58  291.584 11820.02  231.931  546.231   6.5486  538.426   5.2844 7.804810 8.414851 
1 1 1    7    2   29 o  175.446   1.8064  1254.62   25.834  1309.51   42.199  1221.71   32.672  179.237   2.8883  173.128   2.3151 6.109146 3.701598 
1 1 1    7    2   30 f  134.976   1.6767  742.565   18.448  793.594   30.529  713.213   23.154  139.532   2.6842  132.280   2.1473 7.252716 3.437388 
1 1 1    7    2   31 o  580.602   4.3887 13742.94  207.707 13884.77  331.533 13651.31  266.490  583.470   6.9706  578.612   5.6501 4.858521 8.972928 
1 1 1    7    2   32 o  415.099   3.2533  7023.86  110.081  6876.47  171.413  7127.32  143.608  410.675   5.1205  418.124   4.2134 -7.448730 6.631165 
1 1 1    7    2   33 o  628.349   4.7294 16097.21  242.238 16299.90  387.505 15967.20  310.352  632.135   7.5202  625.739   6.0845 6.395081 9.673430 
1 1 1    7    2   34 f  337.442   2.7510  4641.46   75.672  4833.30  123.901  4527.33   95.566  344.314   4.4145  333.256   3.5179 11.05844 5.644820 
1 1 1    7    2   35 o  375.056   2.9958  5734.02   91.590  5847.98  147.540  5662.57  116.826  378.724   4.7792  372.695   3.8455 6.028931 6.134167 
1 1 1    7    2   36 o  399.396   3.1576  6502.53  102.801  6802.30  168.918  6326.19  129.555  408.447   5.0735  393.923   4.0347 14.52365 6.482172 
1 1 1    7    2   37 o  230.550   2.1297  2166.54   40.024  2291.41   66.188  2094.56   50.253  237.086   3.4248  226.682   2.7196 10.40384 4.373291 
1 1 1    7    2   38 o  516.770   4.4185 10887.95  186.124 10986.39  265.846 10793.30  260.669  519.011   6.2837  514.434   6.2162 4.577393 8.838912 
1 1 1    7    2   39 o  377.710   3.8823  5816.23  119.532  5998.08  213.619  5733.33  144.224  383.461   6.8341  374.985   4.7183 8.476135 8.304691 
1 1 1    7    2   40 o  677.743   6.5543 18736.38  362.101 18625.65  625.249 18792.26  444.168  675.192   11.360  678.615   8.0295 -3.423523 13.91147 
1 1 1    7    2   41 o  343.978   3.1228  4823.39   87.561  5231.07  187.179  4709.18   99.069  358.110   6.4122  339.872   3.5759 18.23819 7.341864 
1 1 1    7    2   42 o  607.241   5.1208 15037.15  253.473 15575.84  523.204 14871.94  289.746  617.495   10.394  603.843   5.8865 13.65222 11.94552 
1 1 1    7    2   43 o  310.463   2.5785  3929.08   65.255  3752.34  100.679  4057.11   85.690  303.367   4.0713  315.466   3.3323 -12.09891 5.261172 
1 1 1    7    2   44 o  360.548   2.6450  5299.14   77.737  5380.60  111.819  5222.94  108.147  363.278   3.7761  357.918   3.7068 5.359711 5.291397 
1 1 1    7    2   45 o  677.122   4.6341 18697.38  255.780 18869.51  365.057 18531.39  358.488  680.039   6.5855  673.925   6.5257 6.113525 9.271144 
1 1 1    7    2   46 o  190.530   1.7490  1479.69   27.164  1522.33   39.818  1442.57   37.153  193.247   2.5277  188.118   2.4228 5.128754 3.501362 
1 1 1    7    2   47 o  334.279   2.4901  4555.18   67.852  4508.79   95.820  4601.84   96.095  332.540   3.5349  335.955   3.5090 -3.414734 4.980821 
1 1 1    7    2   48 o  152.301   1.6190  945.468   20.100  921.497   28.903  967.917   27.971  150.350   2.3583  154.092   2.2268 -3.741913 3.243520 
1 1 1    7    2   49 o  220.634   1.7281  1984.25   31.080  1978.32   41.252  1992.04   47.268  220.295   2.2972  221.051   2.6232 -0.7561951 3.486935 
1 1 1    7    2   50 o  294.563   2.0895  3537.01   50.172  3541.47   66.624  3531.17   76.254  294.730   2.7731  294.287   3.1787 0.4426270 4.218359 
1 1 1    7    2   51 o  240.085   1.8175  2349.61   35.570  2267.09   46.130  2470.61   55.862  235.819   2.3998  246.166   2.7839 -10.34691 3.675428 
1 1 1    7    2   52 o  146.145   1.4291  870.591   17.025  877.398   26.931  866.059   21.973  146.705   2.2520  145.759   1.8493 0.9456177 2.914059 
1 1 1    7    2   53 o  287.202   1.9111  3362.47   44.742  3349.87   63.546  3374.85   63.006  286.636   2.7197  287.704   2.6866 -1.067993 3.822907 
1 1 1    7    2   54 o   63.695   1.3950  165.374   7.2432  175.313   11.147  158.110   9.5290   65.544   2.0891   62.250   1.8801 3.294266 2.810490 
1 1 1    7    2   55 o   82.812   1.3031  279.534   8.7963  290.955   13.170  270.336   11.819   84.482   1.9125   81.435   1.7804 3.047264 2.612951 
1 1 1    7    2   56 o  155.066   1.4800  980.165   18.707  990.261   24.970  967.247   28.244  155.854   1.9654  154.026   2.2495 1.827560 2.987189 
1 1 1    7    2   57 o  257.225   1.9014  2697.37   39.868  2708.09   53.093  2683.52   60.367  257.710   2.5274  256.521   2.8870 1.188843 3.836959 
1 1 1    7    2   58 o  285.493   2.0429  3323.03   47.541  3356.81   63.582  3280.21   71.595  286.906   2.7187  283.590   3.0971 3.315857 4.121091 
1 1 1    7    2   59 o   91.689   1.3862  342.692   10.361  347.442   15.930  339.210   13.639   92.312   2.1170   91.216   1.8344 1.096008 2.801206 
1 1 1    7    2   60 o  324.111   2.4222  4283.64   63.993  4366.28  111.645  4243.20   78.094  327.057   4.1877  322.536   2.9703 4.521149 5.134207 
1 1 1    7    2   61 o   71.354   1.5283  207.558   8.8895  235.978   15.367  193.264   10.898   76.029   2.4829   68.821   1.9446 7.207443 3.153736 
1 1 1    7    2   62 o  152.872   1.6826  952.758   20.967  930.415   32.634  968.466   27.362  151.039   2.6506  154.113   2.1781 -3.074478 3.430691 
1 1 1    7    2   63 o  102.353   1.4517  427.071   12.112  405.536   17.197  448.266   17.061   99.727   2.1154  104.852   1.9961 -5.124962 2.908532 
1 1 1    7    2   64 o  196.407   1.7377  1572.73   27.820  1616.92   40.161  1531.96   38.574  199.115   2.4744  193.815   2.4416 5.300110 3.476220 
1 1 1    7    2   65 o  380.737   2.7611  5913.06   85.694  6011.91  122.905  5819.56  119.544  383.746   3.9291  377.564   3.8842 6.181793 5.524907 
1 1 1    7    2   66 o  215.235   1.5975  1888.67   28.027  1883.31   39.682  1894.01   39.591  214.898   2.2653  215.509   2.2537 -0.6101074 3.195413 
1 1 1    7    2   67 o   21.423   2.9521   19.078   5.0184   21.448   8.0655   17.580   6.4105   22.511   4.5521   20.399   3.9983 2.111952 6.058702 
1 1 1    7    2   68 o  188.800   1.4941  1453.20   22.995  1437.88   32.495  1468.58   32.544  187.776   2.1230  189.771   2.1038 -1.995026 2.988805 
1 1 1    7    2   69 o  156.513   1.3868  998.641   17.693  995.630   25.142  1001.60   24.903  156.258   1.9739  156.726   1.9493 -0.4683533 2.774147 
1 1 1    7    2   70 o   64.465   1.4176  169.421   7.4493  177.223   11.009  162.832   10.117   65.892   2.0521   63.161   1.9675 2.730675 2.842921 
1 1 1    7    2   71 o  149.414   1.3690  910.114   16.673  917.044   23.903  903.546   23.269  149.962   1.9554  148.856   1.9177 1.106339 2.738822 
1 1 1    7    2   72 o  212.159   1.5905  1835.18   27.506  1823.91   38.899  1846.45   38.901  211.469   2.2566  212.773   2.2429 -1.303482 3.181633 
1 1 1    7    2   73 o  186.134   1.4909  1412.52   22.621  1405.35   32.105  1419.58   31.878  185.631   2.1217  186.570   2.0961 -0.9384766 2.982492 
1 1 1    7    2   74 o  176.021   1.4558  1263.20   20.888  1211.73   29.125  1317.70   29.973  172.370   2.0728  179.751   2.0456 -7.380981 2.912251 
1 1 1    7    2   75 o  160.949   1.5502  1056.19   20.338  1037.20   26.392  1083.96   31.913  159.474   2.0302  163.008   2.4017 -3.534210 3.144860 
1 1 1    7    2   76 o  163.431   1.4392  1088.98   19.173  1077.45   27.213  1100.34   27.019  162.535   2.0539  164.255   2.0179 -1.719604 2.879370 
1 1 1    7    2   77 o  139.244   1.4962  790.547   16.983  769.408   22.621  817.851   25.709  137.348   2.0205  141.596   2.2274 -4.247253 3.007293 
1 1 1    7    2   78 o  161.771   1.5855  1067.09   20.907  1052.80   27.933  1085.28   31.526  160.656   2.1330  163.100   2.3713 -2.443710 3.189428 
1 1 1    7    2   79 o  107.587   1.5135  471.957   13.273  462.345   18.017  483.364   19.629  106.467   2.0760  108.854   2.2121 -2.387489 3.033703 
1 1 1    7    2   80 o   72.246   1.6170  212.836   9.5229  211.617   13.402  214.079   13.533   71.984   2.2870   72.402   2.2960 -0.4174805 3.240648 
1 1 1    7    2   81 f  150.492   1.6486  923.579   20.224  928.200   36.960  921.604   24.162  150.770   3.0074  150.312   1.9720 0.4570313 3.596248 
1 1 1    7    2   82 o  118.415   1.4512  571.769   14.008  565.063   21.938  576.386   18.201  117.678   2.2870  118.873   1.8784 -1.195595 2.959528 
1 1 1    7    2   83 o   73.757   1.6270  221.863   9.7817  229.116   15.045  216.553   12.874   74.881   2.4683   72.818   2.1713 2.062691 3.287367 
1 1 1    7    2   84 o   58.622   1.6797  140.277   8.0183  138.751   13.309  141.147   10.046   58.221   2.8126   58.778   2.1002 -0.5573769 3.510210 
1 1 1    7    2   85 o   66.598   1.5052  180.882   8.1711  177.543   12.344  183.485   10.901   65.914   2.3009   67.030   1.9974 -1.116707 3.046937 
1 1 1    7    2   86 o  108.530   1.3561  480.326   11.997  486.034   17.542  475.310   16.443  109.141   1.9718  107.936   1.8689 1.204659 2.716757 
1 1 1    7    2   87 o  115.661   1.3566  545.550   12.791  527.580   18.370  562.458   17.819  113.703   1.9820  117.410   1.8619 -3.706795 2.719382 
1 1 1    7    2   88 o   23.675   2.9727   23.269   5.6108   14.526   9.4623   28.010   6.9678   18.731   5.6936   25.950   3.3737 -7.219261 6.618133 
1 1 1    7    2   89 o   13.228   4.3041   6.9244   5.3198   12.363   9.1132   4.1131   6.5519   17.532   5.6275   12.223   4.6894 5.309688 7.325250 
1 1 1    7    2   90 o   85.583   1.4132  298.751   9.8588  286.639   14.525  309.096   13.425   83.763   2.1291   87.026   1.8924 -3.262978 2.848547 
1 1 1    7    2   91 o   73.891   1.5802  222.758   9.5178  195.935   13.130  252.464   13.817   69.219   2.3303   78.600   2.1586 -9.380379 3.176452 
1 1 1    7    2   92 o  166.214   1.4680  1127.09   19.890  1117.75   28.478  1135.98   27.792  165.440   2.1117  166.794   2.0441 -1.354095 2.938977 
1 1 1    7    2   93 o   54.837   1.6914  122.844   7.5515  134.239   11.776  114.886   9.8415   57.247   2.5297   52.977   2.2843 4.269981 3.408481 
1 1 1    7    2   94 o   46.236   2.0323   87.487   7.6409   89.378   11.443   85.966   10.264   46.620   3.0276   45.752   2.7651 0.8680801 4.100313 
1 1 1    7    2   95 o   97.319   1.5360  386.539   12.185  388.764   17.100  384.244   17.367   97.535   2.1508   96.960   2.1973 0.5743637 3.074740 
1 1 1    7    2   96 f   73.189   1.7252  218.735   10.292  222.230   16.075  216.307   13.399   73.625   2.6830   72.697   2.2638 0.9273987 3.510478 
1 1 1    7    2   97 o   25.945   3.3586   28.099   6.9365   12.930   11.552   36.651   8.6742   18.368   6.3469   29.630   3.6697 -11.26209 7.331470 
1 1 1    7    2   98 o   44.522   2.1199   81.249   7.6716   78.779   12.466   82.755   9.7330   43.618   3.5364   44.860   2.6738 -1.242008 4.433444 
1 1 1    7    2   99 o   62.696   1.6306  160.677   8.3264  162.748   12.012  158.761   11.552   63.002   2.3430   62.234   2.2811 0.7677994 3.270011 
1 1 1    7    2  100 o   77.465   1.5218  245.111   9.6094  264.325   13.753  226.782   13.432   80.338   2.1019   74.390   2.2176 5.948532 3.055444 
1 1 1    7    2  101 o   29.919   2.6492   37.030   6.3942   36.885   9.5397   37.148   8.6163   29.569   4.0654   29.778   3.6243 -0.2087231 5.446320 
1 1 1    7    2  102 o   46.140   1.9383   87.293   7.2737   84.794   10.489   89.608   10.096   45.313   2.8542   46.624   2.6675 -1.311077 3.906620 
1 1 1    7    2  103 o   13.169   4.4717   6.7621   5.7283   1.7312   8.6600   10.676   7.6381   12.392   5.1650   16.059   5.1517 -3.667604 7.295010 
1 1 1    7    2  104 o   71.565   1.4607  209.360   8.5213  214.161   12.708  205.437   11.486   72.223   2.1610   70.774   1.9930 1.448906 2.939726 
1 1 1    7    2  105 o   66.461   1.4978  180.644   8.1145  186.698   12.177  175.807   10.883   67.393   2.2196   65.438   2.0428 1.954575 3.016522 
1 1 1    7    2  106 o   40.559   2.3362   67.869   7.6910   54.656   9.9583   87.401   12.107   36.119   3.4231   45.796   3.2647 -9.676956 4.730327 
1 1 1    7    2  107 o   43.583   2.4403   78.470   8.6349   81.498   12.206   75.437   12.217   44.139   3.4191   42.408   3.5672 1.730988 4.941218 
1 1 1    7    2  108 o   56.891   1.9192  132.989   8.8873  136.557   11.679  128.081   13.698   57.489   2.4982   55.492   3.0398 1.997375 3.934630 
1 1 1    7    2  109 o   15.822   4.8734   10.772   6.9031   12.335   9.0928   8.6446   10.606   17.072   5.6314   15.837   5.9926 1.234954 8.223323 
1 1 1    7    2  110 o   15.110   5.1698   9.2736   7.6590   4.9321   8.8863   21.815   15.103   13.576   5.3872   22.000   7.2578 -8.423902 9.038659 
1 1 1    7    2  111 f   12.938   5.1367   4.4289   8.0831   7.0030   10.912   1.2989   12.033   15.246   5.9947   13.907   5.9551 1.339599 8.449782 
1 1 1    7    2  112 o   45.914   2.7410   87.780   10.212   93.325   12.777   77.973   16.992   47.105   3.3494   42.216   5.0371 4.888630 6.049048 
1 1 1    7    2  113 o   28.375   4.5266   35.246   10.118   42.028   13.035   24.962   16.050   30.618   5.4210   23.054   7.4742 7.564301 9.233138 
1 1 1    7    2  114 o   32.398   3.9963   45.226   10.330   48.775   13.521   40.249   16.011   33.087   5.1832   29.109   6.8607 3.978073 8.598582 
1 1 1    7    2  115 o   46.710   2.5592   90.894   9.7072   95.551   15.096   87.610   12.675   47.199   3.9603   45.459   3.4462 1.740009 5.249753 
1 1 1    7    2  116 o   62.998   2.1813  164.400   11.185  159.107   17.339  168.171   14.637   61.213   3.4894   63.365   2.8410 -2.151413 4.499677 
1 1 1    7    2  117 o   52.695   2.5265  115.919   10.821  118.778   18.336  114.391   13.404   52.155   4.3525   51.989   3.1781 0.1653366 5.389263 
1 1 1    7    2  118 o   52.687   2.5841  116.248   11.064  116.207   19.266  116.269   13.515   51.169   4.6706   52.332   3.1832 -1.163727 5.652215 
1 1 1    7    2  119 o   30.448   3.9803   40.769   9.6425   44.506   16.807   38.935   11.773   29.697   7.0492   29.058   5.1592 0.6392765 8.735485 
1 1 1    7    2  120 f   15.807   5.4328   11.154   8.4603   16.571   12.629   6.7441   11.395   18.700   6.6235   14.779   6.0175 3.921016 8.948761 
1 1 1    7    2  121 o   44.844   2.7565   85.177   10.028   83.300   14.539   86.880   13.849   43.320   4.1686   44.507   3.8552 -1.186741 5.678028 
1 1 1    7    2  122 o   12.906   5.2589   4.8207   8.7119   3.7360   12.679   5.7909   11.991   14.138   6.0844   14.484   6.0605 -0.3462744 8.587757 
1 1 1    7    2  123 o   11.955   5.1069   2.2046   8.8103   3.6089   12.546   0.8382   12.375   13.964   6.0312   13.181   5.8329 0.7829742 8.390308 
1 1 1    7    2  124 o   32.443   3.6672   46.619   9.5283   44.977   13.580   48.210   13.373   30.252   5.7163   31.648   5.3757 -1.396809 7.846934 
1 1 1    7    2  125 o   25.755   4.6966   31.119   9.4969   52.217   13.570   10.866   13.296   33.052   5.2089   16.195   6.5340 16.85664 8.356201 
1 1 1    7    2  126 o   38.175   3.5472   64.331   10.912   66.130   14.130   61.674   17.176   37.663   4.7047   34.741   6.2970 2.922153 7.860425 
1 1 1    7    2  127 o   24.034   5.4971   28.764   10.535   9.4078   13.292   61.461   17.277   15.600   6.4414   34.465   6.3846 -18.86487 9.069481 
1 1 1    7    2  128 o   19.060   6.3921   19.223   11.705   12.014   16.811   26.005   16.307   16.923   7.1343   21.143   7.5226 -4.219961 10.36762 
1 1 1    7    2  129 o   11.326   5.2592  -5.0374   11.659   7.7297   16.508 -17.7438   16.468   15.767   6.8635   11.505   5.5864 4.262665 8.849630 
1 1 1    7    2  130 o   23.758   6.0057   29.519   11.635   27.270   16.345   31.830   16.566   21.379   7.5385   22.994   7.6018 -1.615055 10.70594 
1 1 1    7    2  131 o   15.429   5.8396   11.137   10.073   22.402   13.044  -5.5045   15.855   20.033   6.7481   12.903   6.0384 7.130135 9.055336 
1 1 1    7    2  132 o   14.427   5.7404   8.7004   10.116   19.105   13.033  -7.0648   16.043   18.626   6.7136   12.674   5.9760 5.951203 8.988035 
1 1 1    7    2  133 o   26.568   6.1456   37.489   13.045   52.871   16.215   9.2727   21.961   31.204   6.5824   16.752   7.5642 14.45172 10.02723 
1 1 1    7    2  134 o   16.693   6.4881   14.041   12.661   17.848   15.295   5.7522   22.568   18.062   7.0986   16.283   7.4734 1.778942 10.30742 
1 1 1    7    3 -133 o   15.068   5.7880   10.522   9.9895   5.8466   12.647   18.276   16.288   14.124   6.0777   18.186   7.2682 -4.061574 9.474388 
1 1 1    7    3 -132 o   16.311   5.8386   13.464   9.8376   8.8629   12.223   21.925   16.576   14.893   6.1658   19.275   7.4422 -4.381927 9.664519 
1 1 1    7    3 -131 o   13.660   5.6272   6.6185   10.113   14.951   12.759  -7.4650   16.587   17.051   6.5434   12.788   6.0437 4.262938 8.907461 
1 1 1    7    3 -130 o   11.585   5.1714  -0.0720   9.9427  -2.0266   12.664   3.0691   16.054   12.317   5.6325   14.514   6.5178 -2.196892 8.614356 
1 1 1    7    3 -129 o   18.075   5.9759   17.019   10.237   26.945   13.058   1.1845   16.492   22.010   6.6881   14.308   6.4984 7.702108 9.325203 
1 1 1    7    3 -128 o   25.334   4.7746   30.699   9.4985   26.984   11.400   39.133   17.177   22.678   6.0538   25.652   7.6434 -2.974569 9.750363 
1 1 1    7    3 -127 o   10.842   4.8501  -0.9203   8.7970   11.430   10.488 -30.2306   16.157   15.714   5.9560   10.110   5.0269 5.603596 7.793831 
1 1 1    7    3 -126 o   17.395   5.8452   15.231   9.7873   19.554   12.354   7.9447   16.038   19.159   6.5657   15.800   6.8219 3.358189 9.468173 
1 1 1    7    3 -125 o   24.401   6.4052   31.407   12.899   31.407   12.899   0.0000   0.0000   24.401   6.4052  ?   ?  0.000000 6.405170 
1 1 1    7    3 -124 o   13.130   5.4350   4.9764   9.4956   8.3744   12.028  -0.6452   15.470   15.085   6.1669   13.906   6.3070 1.179206 8.820942 
1 1 1    7    3 -123 o   17.689   5.7015   15.454   9.3479   13.834   11.537   18.550   15.949   17.016   6.2879   18.996   7.3093 -1.980917 9.641726 
1 1 1    7    3 -122 o   25.873   4.6791   31.200   9.5050   30.334   11.934   32.701   15.719   24.523   6.0161   24.334   7.3262 0.1894989 9.479806 
1 1 1    7    3 -121 o   29.420   4.3056   39.245   10.020   36.292   12.539   44.463   16.667   27.171   5.8355   28.963   7.1124 -1.792194 9.200029 
1 1 1    7    3 -120 o   39.570   3.0546   67.028   9.7766   72.441   11.875   55.640   17.224   40.766   3.6108   33.325   6.5742 7.441116 7.500536 
1 1 1    7    3 -119 o   33.380   3.5466   48.410   9.5026   72.332   11.724   2.5903   16.225   40.857   3.5555   15.305   6.7296 25.55172 7.611166 
1 1 1    7    3 -118 o   20.843   5.1815   20.384   8.7657   33.312   10.784  -4.7979   15.050   26.829   5.1175   13.412   6.1360 13.41689 7.989958 
1 1 1    7    3 -117 o   15.422   5.4254   10.159   8.4623   16.205   10.506  -1.0078   14.279   18.603   6.0484   13.952   6.2146 4.651052 8.672071 
1 1 1    7    3 -116 o   37.325   2.4315   58.205   7.3578   68.561   11.520   51.070   9.5623   39.980   3.5726   34.528   3.4433 5.451134 4.961805 
1 1 1    7    3 -115 o   34.860   2.5606   50.847   7.2254   59.884   12.917   46.732   8.7166   36.984   4.3689   33.142   3.2690 3.842037 5.456561 
1 1 1    7    3 -114 o   44.457   2.0398   81.733   7.3723   90.953   11.623   75.526   9.5361   46.481   3.0851   42.473   2.7695 4.008194 4.145818 
1 1 1    7    3 -113 o   28.559   3.0186   34.440   6.9211   45.405   10.515   26.058   9.1937   32.414   4.0688   24.138   4.8412 8.276546 6.323923 
1 1 1    7    3 -112 o   17.803   4.5376   14.119   6.6034   6.2485   9.8456   20.554   8.9028   14.443   5.6895   21.323   5.1751 -6.879765 7.691065 
1 1 1    7    3 -111 o   51.490   2.1453  109.474   8.9847  118.209   11.999   98.327   13.555   53.281   2.7723   48.289   3.4667 4.991638 4.438878 
1 1 1    7    3 -110 o   10.206   4.4284  -0.4821   6.8254  -9.8473   9.5425   9.3280   9.7666   9.7116   4.5881   15.748   5.7913 -6.036422 7.388454 
1 1 1    7    3 -109 o   19.101   4.4293   16.103   6.7622   11.407   9.6988   20.545   9.4330   16.703   5.8131   21.358   5.4123 -4.655729 7.942631 
1 1 1    7    3 -108 o   54.816   1.8181  123.456   8.1125  128.071   11.964  119.528   11.038   55.585   2.6480   53.736   2.5270 1.849613 3.660283 
1 1 1    7    3 -107 o   40.627   2.2752   68.166   7.5046   73.527   10.839   63.230   10.401   41.939   3.1947   38.836   3.3171 3.103313 4.605371 
1 1 1    7    3 -106 o   30.770   2.7542   39.423   6.8352   42.792   10.234   36.709   9.1838   31.697   4.0535   29.360   3.9364 2.336969 5.650299 
1 1 1    7    3 -105 o   26.265   3.5522   29.204   7.4105   23.026   11.844   33.178   9.4996   22.653   6.2236   27.792   4.3347 -5.139326 7.584326 
1 1 1    7    3 -104 o   30.377   3.1139   38.564   7.6013   25.336   11.717   48.178   9.9889   23.810   6.0310   33.835   3.6810 -10.02410 7.065593 
1 1 1    7    3 -103 o   32.053   3.0249   42.791   7.8100   42.234   12.300   43.166   10.109   31.286   4.9908   31.954   3.9662 -0.6688614 6.374841 
1 1 1    7    3 -102 o   37.487   2.6145   58.064   7.9391   56.255   12.801   59.195   10.121   36.448   4.3972   37.696   3.3278 -1.247967 5.514480 
1 1 1    7    3 -101 o   32.231   2.9637   43.135   7.6994   51.705   12.691   38.142   9.6857   34.909   4.5692   30.041   4.0591 4.868431 6.111775 
1 1 1    7    3 -100 o   21.038   4.1739   18.998   6.9051   26.641   10.204   12.541   9.3791   24.763   5.2197   17.490   5.7167 7.273546 7.741166 
1 1 1    7    3  -99 o   76.067   1.7260  236.523   10.702  234.454   16.846  237.924   13.858   75.517   2.7411   76.185   2.2339 -0.6673355 3.536135 
1 1 1    7    3  -98 o   45.944   2.1336   86.566   7.9688   92.393   11.684   81.498   10.896   47.320   3.0453   44.435   3.0263 2.885818 4.293317 
1 1 1    7    3  -97 o   75.288   1.6270  231.520   9.9853  233.280   14.464  229.917   13.802   75.450   2.3546   74.919   2.2627 0.5309219 3.265554 
1 1 1    7    3  -96 o   32.878   2.8435   44.642   7.5459   44.058   11.061   45.150   10.320   32.390   4.2953   32.873   3.9289 -0.4830475 5.821141 
1 1 1    7    3  -95 o   64.473   1.8154  169.930   9.5314  182.818   13.992  158.771   13.019   66.777   2.5754   62.224   2.5723 4.552883 3.639972 
1 1 1    7    3  -94 o   15.889   5.3553   9.8157   8.2150   4.6739   12.726   13.489   10.756   15.759   6.3800   18.427   6.1266 -2.668307 8.845341 
1 1 1    7    3  -93 o   92.009   1.7201  345.606   12.901  346.237   20.137  345.167   16.801   91.945   2.6897   91.898   2.2428 0.4717255E-01 3.502133 
1 1 1    7    3  -92 o   49.078   2.5118   98.738   10.015  103.188   17.825   96.685   12.107   49.878   4.4301   48.493   3.0786 1.385918 5.394773 
1 1 1    7    3  -91 f   90.069   1.7565  331.115   12.896  333.369   19.168  329.251   17.431   90.259   2.6079   89.729   2.3853 0.5302887 3.534250 
1 1 1    7    3  -90 o  130.910   1.5770  699.225   16.828  672.180   25.568  719.896   22.352  128.257   2.4455  132.780   2.0652 -4.523285 3.200872 
1 1 1    7    3  -89 o  135.443   1.5776  748.427   17.417  733.450   26.450  759.893   23.143  133.990   2.4217  136.426   2.0810 -2.435776 3.193038 
1 1 1    7    3  -88 o   39.071   2.4789   62.608   7.8543   49.996   11.145   75.053   11.071   34.693   4.0150   42.712   3.2031 -8.019310 5.136114 
1 1 1    7    3  -87 o   62.140   1.8097  157.694   9.1571  147.843   12.922  167.632   12.978   60.097   2.6443   64.014   2.4919 -3.917759 3.633460 
1 1 1    7    3  -86 o   75.305   1.7393  231.358   10.677  234.978   16.105  228.519   14.261   75.799   2.6105   74.774   2.3425 1.025093 3.507421 
1 1 1    7    3  -85 o  122.208   1.5523  609.160   15.464  629.459   23.640  593.977   20.444  124.170   2.3355  120.640   2.0790 3.529396 3.126794 
1 1 1    7    3  -84 o  135.467   1.5546  748.464   17.167  740.189   25.831  755.009   22.974  134.656   2.3533  136.021   2.0721 -1.365524 3.135535 
1 1 1    7    3  -83 o   18.999   4.8760   15.367   7.5888   21.329   11.571   10.867   10.053   22.413   6.1490   17.109   5.9203 5.303717 8.535779 
1 1 1    7    3  -82 o  244.990   1.7851  2448.24   35.650  2468.04   50.607  2428.73   50.228  245.880   2.5250  243.914   2.5262 1.966370 3.571735 
1 1 1    7    3  -81 o  171.520   1.5209  1199.70   21.264  1202.61   30.000  1196.76   30.145  171.681   2.1437  171.262   2.1593 0.4194794 3.042727 
1 1 1    7    3  -80 o   40.086   2.4077   65.811   7.8310   63.595   11.181   67.944   10.971   39.290   3.5287   40.644   3.3409 -1.353081 4.859396 
1 1 1    7    3  -79 f  192.433   1.5898  1510.04   24.937  1498.78   34.933  1521.74   35.610  191.666   2.2359  193.126   2.2620 -1.460205 3.180582 
1 1 1    7    3  -78 o   89.132   1.5807  323.952   11.485  329.020   16.225  318.863   16.258   89.806   2.2164   88.379   2.2587 1.427414 3.164490 
1 1 1    7    3  -77 o   9.2019   4.3750 -11.4031   8.9465 -25.6343   11.234   13.271   14.792   8.7034   4.3035   19.743   7.1475 -11.03949 8.343090 
1 1 1    7    3  -76 o  164.771   1.8333  1107.21   24.624  1102.64   29.563  1117.56   44.496  164.409   2.2059  165.430   3.2996 -1.020721 3.969099 
1 1 1    7    3  -75 o  113.899   1.5943  528.972   14.802  542.203   19.635  511.556   22.528  115.297   2.0892  111.974   2.4681 3.322273 3.233612 
1 1 1    7    3  -74 o  277.373   2.0577  3137.85   46.525  3125.44   61.307  3154.70   71.443  276.754   2.7176  277.989   3.1528 -1.235077 4.162368 
1 1 1    7    3  -73 o  194.271   1.6826  1538.91   26.646  1561.58   35.422  1509.36   40.439  195.665   2.2209  192.340   2.5793 3.325012 3.403680 
1 1 1    7    3  -72 o  262.427   1.9777  2808.51   42.306  2814.35   55.577  2800.45   65.237  262.645   2.5959  261.945   3.0553 0.6997681 4.009174 
1 1 1    7    3  -71 o  214.703   1.7656  1879.64   30.901  1890.61   40.569  1864.47   47.690  215.294   2.3116  213.768   2.7369 1.526428 3.582473 
1 1 1    7    3  -70 o  232.150   1.8294  2197.57   34.619  2132.92   44.731  2294.14   54.667  228.671   2.3997  237.119   2.8283 -8.447815 3.709127 
1 1 1    7    3  -69 o  143.316   1.5240  837.399   17.804  833.540   23.235  842.889   27.710  142.970   1.9937  143.754   2.3647 -0.7840271 3.093016 
1 1 1    7    3  -68 o  317.036   2.2408  4099.27   57.910  4011.75   75.180  4226.97   90.811  313.560   2.9413  321.792   3.4620 -8.231995 4.542801 
1 1 1    7    3  -67 o  107.168   1.4983  468.225   13.089  455.933   16.825  487.068   20.830  105.741   1.9520  109.281   2.3384 -3.539566 3.046051 
1 1 1    7    3  -66 o   42.136   2.1600   72.594   7.3943   78.276   10.007   65.761   10.974   43.712   2.8236   39.997   3.3981 3.715263 4.418081 
1 1 1    7    3  -65 o  141.018   1.4260  810.693   16.392  802.583   22.626  819.653   23.781  140.295   1.9785  141.776   2.0578 -1.481400 2.854595 
1 1 1    7    3  -64 f  350.892   2.4110  5021.57   68.961  5014.45   91.234  5031.05  105.326  350.556   3.1928  351.069   3.6805 -0.5128174 4.872358 
1 1 1    7    3  -63 o  223.473   1.7704  2036.13   32.250  2046.26   42.825  2022.85   49.016  223.999   2.3454  222.693   2.7002 1.306946 3.576596 
1 1 1    7    3  -62 o  188.677   1.9254  1451.49   29.612  1491.59   38.547  1393.74   46.256  191.241   2.4727  184.830   3.0701 6.411484 3.942070 
1 1 1    7    3  -61 o  208.226   1.8484  1767.78   31.373  1758.08   38.192  1787.89   55.015  207.636   2.2565  209.332   3.2241 -1.696014 3.935309 
1 1 1    7    3  -60 o  139.406   1.5157  792.265   17.224  790.704   22.255  794.596   27.199  139.258   1.9605  139.588   2.3904 -0.3294220 3.091521 
1 1 1    7    3  -59 o  117.007   1.4948  558.109   14.257  555.402   18.339  562.244   22.668  116.714   1.9276  117.421   2.3683 -0.7062149 3.053591 
1 1 1    7    3  -58 o  200.925   1.6908  1645.83   27.693  1645.32   36.219  1646.56   42.968  200.875   2.2119  200.934   2.6233 -0.5833435E-01 3.431404 
1 1 1    7    3  -57 o  267.770   2.1458  2923.47   46.836  2967.57   66.252  2879.41   66.221  269.731   3.0132  265.691   3.0576 4.040131 4.292838 
1 1 1    7    3  -56 o  356.759   2.8963  5190.91   84.228  5257.51  109.268  5093.40  132.219  358.961   3.7343  353.215   4.5922 5.746399 5.918872 
1 1 1    7    3  -55 o  188.308   1.7700  1445.58   27.170  1482.54   38.299  1408.14   38.551  190.679   2.4640  185.831   2.5449 4.848434 3.542352 
1 1 1    7    3  -54 o  137.148   1.6239  766.772   18.155  765.922   24.952  767.728   26.464  137.061   2.2334  137.220   2.3659 -0.1586304 3.253525 
1 1 1    7    3  -53 o  557.244   3.8757 12667.90  176.047 12744.04  216.733 12520.25  301.826  558.782   4.7582  553.472   6.6900 5.310547 8.209556 
1 1 1    7    3  -52 o   87.436   1.5721  311.636   11.205  315.153   14.441  306.316   17.761   87.924   2.0149   86.640   2.5175 1.283775 3.224519 
1 1 1    7    3  -51 f  482.815   2.9470  9505.37  115.982  9575.72  165.061  9436.76  163.005  484.485   4.1796  480.959   4.1577 3.525970 5.895371 
1 1 1    7    3  -50 o   50.593   1.8365  104.480   7.5615  103.221   10.872  105.660   10.524   50.245   2.6640   50.844   2.5473 -0.5986404 3.685840 
1 1 1    7    3  -49 o  263.040   1.8233  2820.44   39.094  2911.42   56.476  2736.74   54.171  267.228   2.5927  259.089   2.5650 8.139618 3.647067 
1 1 1    7    3  -48 o  333.541   2.3129  4535.26   62.884  4598.27   84.054  4455.16   94.771  335.821   3.0706  330.533   3.5174 5.287964 4.669105 
1 1 1    7    3  -47 o  232.112   1.7970  2196.12   34.000  2272.60   53.004  2142.65   44.319  236.099   2.7541  229.258   2.3716 6.840927 3.634451 
1 1 1    7    3  -46 o  159.019   1.3858  1030.70   17.964  1020.04   22.624  1048.90   29.550  158.191   1.7545  160.407   2.2599 -2.216415 2.861020 
1 1 1    7    3  -45 o  266.546   1.8163  2896.00   39.463  2861.51   49.567  2955.70   65.217  264.945   2.2951  269.254   2.9714 -4.309082 3.754543 
1 1 1    7    3  -44 o   88.122   1.2704  316.517   9.1256  336.712   13.519  299.610   12.369   90.887   1.8247   85.734   1.7699 5.153320 2.542043 
1 1 1    7    3  -43 o  281.649   1.8768  3233.46   43.089  3265.51   61.750  3203.04   60.156  283.027   2.6765  280.308   2.6328 2.719269 3.754372 
1 1 1    7    3  -42 o  370.016   2.3263  5580.96   70.165  5693.73  101.157  5476.40   97.405  373.707   3.3207  366.508   3.2603 7.199493 4.653676 
1 1 1    7    3  -41 o  386.241   2.4110  6081.15   75.909  6054.39  107.342  6107.91  107.360  385.362   3.4171  387.062   3.4027 -1.699860 4.822381 
1 1 1    7    3  -40 o  145.514   1.4342  863.055   17.012  813.435   26.113  899.645   22.423  141.264   2.2677  148.565   1.8516 -7.300232 2.927606 
1 1 1    7    3  -39 o  524.540   3.6480 11217.30  155.978 11543.40  277.594 11066.84  188.559  531.950   6.4018  520.974   4.4401 10.97620 7.790902 
1 1 1    7    3  -38 o  560.564   3.3576 12810.23  153.422 12772.45  216.749 12848.16  217.195  559.672   4.7510  561.328   4.7468 -1.656616 6.715961 
1 1 1    7    3  -37 o  165.986   1.5119  1122.97   20.457  1157.76   32.661  1100.51   26.242  168.532   2.3774  164.315   1.9592 4.216431 3.080700 
1 1 1    7    3  -36 o  584.118   3.4899 13909.32  166.170 13924.66  235.330 13894.06  234.670  584.373   4.9403  583.731   4.9318 0.6420288 6.980636 
1 1 1    7    3  -35 o  452.493   2.7739  8346.23  102.313  8289.74  129.171  8441.34  167.611  450.940   3.5141  455.012   4.5190 -4.071503 5.724516 
1 1 1    7    3  -34 o  1160.37   7.2264 54927.88  683.524 56759.10  931.377 52790.38  1006.26  1179.13   9.6901  1136.92   10.858 42.20667 14.55300 
1 1 1    7    3  -33 o  267.129   2.1273  2908.58   46.322  2894.27   66.816  2921.83   64.277  266.460   3.0762  267.727   2.9453 -1.267242 4.258805 
1 1 1    7    3  -32 o   60.332   1.9330  148.515   9.4941  145.933   17.372  149.615   11.337   59.724   3.5848   60.541   2.3014 -0.8174744 4.259968 
1 1 1    7    3  -31 f  379.278   2.5604  5863.61   79.160  5910.60  122.840  5830.24  103.522  380.767   3.9577  378.183   3.3581 2.584137 5.190405 
1 1 1    7    3  -30 o  517.368   3.3473 10911.39  141.167 10922.38  216.749 10903.29  186.033  517.568   5.1375  517.143   4.4131 0.4249878 6.772711 
1 1 1    7    3  -29 o  372.668   2.3514  5660.92   71.430  5741.15  102.585  5585.40   99.520  375.284   3.3534  370.159   3.2983 5.124451 4.703606 
1 1 1    7    3  -28 f   56.448   1.6801  129.988   7.7219  118.745   11.635  138.838   10.323   53.908   2.6559   58.322   2.1752 -4.413845 3.432972 
1 1 1    7    3  -27 o  549.735   3.3013 12319.14  147.936 12365.32  210.292 12273.90  208.150  550.721   4.6844  548.682   4.6539 2.038513 6.603254 
1 1 1    7    3  -26 o  144.022   1.3479  845.429   15.825  862.256   23.054  830.438   21.761  145.447   1.9445  142.738   1.8702 2.708511 2.697949 
1 1 1    7    3  -25 o  611.150   3.6387 15225.87  181.272 15173.21  255.947 15278.86  256.771  610.037   5.1470  612.157   5.1457 -2.120300 7.278092 
1 1 1    7    3  -24 o  390.362   2.4330  6211.21   77.417  6272.58  110.697  6152.45  108.312  392.269   3.4619  388.496   3.4202 3.773682 4.866477 
1 1 1    7    3  -23 o  447.779   2.7394  8172.93   99.991  8198.08  142.116  8148.27  140.712  448.445   3.8878  447.081   3.8611 1.363678 5.479279 
1 1 1    7    3  -22 o  1149.36   6.6848 53873.46  626.298 53412.32  879.330 54348.25  892.250  1144.09   9.4287  1154.07   9.4846 -9.972290 13.37382 
1 1 1    7    3  -21 o  799.399   4.6926 26053.03  305.783 25946.97  431.243 26160.29  433.652  797.655   6.6324  800.927   6.6422 -3.271545 9.386570 
1 1 1    7    3  -20 o  564.368   3.3757 12983.58  155.297 12978.51  219.820 12988.64  219.426  564.216   4.7795  564.436   4.7691 -0.2205811 6.751920 
1 1 1    7    3  -19 o  832.556   4.8792 28259.57  331.129 27974.64  464.297 28554.51  472.383  828.224   6.8772  836.760   6.9256 -8.536255 9.760114 
1 1 1    7    3  -18 o  419.077   2.7594  7158.73   94.265  7118.97  143.741  7188.73  124.865  417.885   4.2198  419.939   3.6477 -2.054565 5.577819 
1 1 1    7    3  -17 o  823.882   4.8300 27673.46  324.379 27443.89  455.499 27909.67  462.053  820.339   6.8117  827.268   6.8519 -6.929321 9.661681 
1 1 1    7    3  -16 o  437.864   2.6823  7814.90   95.737  7616.27  132.753  8030.15  138.197  432.245   3.7677  443.832   3.8198 -11.58771 5.365338 
1 1 1    7    3  -15 o  679.783   4.2953 18838.48  238.010 18957.24  365.888 18751.36  313.375  681.816   6.5833  678.151   5.6689 3.665283 8.687741 
1 1 1    7    3  -14 o  573.559   3.6589 13410.20  171.065 13276.92  259.203 13513.04  227.692  570.640   5.5724  575.718   4.8518 -5.078613 7.388602 
1 1 1    7    3  -13 o  490.228   3.1692  9796.18  126.645  9669.50  191.593  9894.49  168.774  487.008   4.8262  492.658   4.2027 -5.650269 6.399590 
1 1 1    7    3  -12 o  467.269   3.2794  8900.18  124.911  8933.94  177.266  8866.88  176.042  468.123   4.6455  466.363   4.6308 1.759766 6.559309 
1 1 1    7    3  -11 o  732.506   4.9815 21875.72  297.443 22072.15  424.005 21685.39  417.370  735.672   7.0705  729.201   7.0216 6.470886 9.964701 
1 1 1    7    3  -10 o  1240.66   8.3283 62789.59  842.257 64667.13  1221.87 61089.78  1162.60  1258.51   11.911  1223.25   11.660 35.26025 16.66751 
1 1 1    7    3   -9 o  667.297   5.5825 18155.70  303.659 18050.29  348.810 18485.64  617.106  665.315   6.4317  672.934   11.250 -7.619019 12.95872 
1 1 1    7    3   -8 o  515.880   3.5891 10848.59  150.930 11454.52  223.192 10338.03  204.875  530.046   5.1657  503.557   4.9912 26.48889 7.183077 
1 1 1    7    3   -7 o  737.629   5.0118 22182.87  301.347 22114.53  425.137 22251.88  427.209  736.377   7.0826  738.659   7.0951 -2.282410 10.02517 
1 1 1    7    3   -6 o  255.686   2.0080  2664.67   41.852  2641.10   58.902  2688.70   59.478  254.547   2.8387  256.830   2.8410 -2.283264 4.016191 
1 1 1    7    3   -5 o  177.104   1.6169  1278.43   23.342  1256.43   32.746  1301.15   33.283  175.571   2.2880  178.668   2.2853 -3.097427 3.233829 
1 1 1    7    3   -4 o  355.553   2.5864  5152.91   74.961  5142.22  105.931  5163.64  106.090  355.169   3.6589  355.908   3.6568 -0.7390442 5.172977 
1 1 1    7    3   -3 o  115.933   1.5602  547.818   14.744  510.053   22.938  574.406   19.247  111.863   2.5156  118.712   1.9890 -6.849106 3.206909 
1 1 1    7    3   -2 f  245.997   1.9574  2466.53   39.250  2424.98   54.961  2509.77   56.071  243.910   2.7643  248.138   2.7721 -4.227692 3.914829 
1 1 1    7    3   -1 o  356.205   2.5915  5171.82   75.246  5086.45  105.165  5261.37  107.709  353.238   3.6523  359.260   3.6779 -6.021942 5.183299 
1 1 1    7    3    0 o  247.332   1.9653  2493.38   39.623  2481.93   55.952  2504.90   56.118  246.757   2.7817  247.897   2.7771 -1.139526 3.930680 
1 1 1    7    3    1 o  385.701   2.7710  6063.87   87.122  6031.94  122.812  6096.21  123.611  384.665   3.9167  386.709   3.9214 -2.043762 5.542363 
1 1 1    7    3    2 f  468.427   3.0416  8944.18  116.139  9124.07  180.429  8816.93  151.757  473.076   4.6789  465.063   4.0031 8.013367 6.157668 
1 1 1    7    3    3 o  581.980   4.0084 13807.35  190.160 13550.26  264.808 14081.08  273.244  576.479   5.6352  587.659   5.7041 -11.18005 8.018283 
1 1 1    7    3    4 o  622.859   4.2737 15815.62  216.984 15527.86  302.278 16121.52  311.660  617.097   6.0092  628.780   6.0806 -11.68225 8.548929 
1 1 1    7    3    5 o  566.795   4.2817 13096.61  197.824 13290.36  316.673 12972.62  253.338  570.872   6.8051  564.063   5.5098 6.808838 8.756007 
1 1 1    7    3    6 o  805.431   5.4556 26449.96  358.183 26264.91  503.420 26639.68  509.732  802.461   7.6961  808.162   7.7376 -5.701721 10.91333 
1 1 1    7    3    7 o  770.711   5.7287 24219.57  359.902 23943.78  459.966 24654.99  577.963  766.208   7.3645  777.364   9.1209 -11.15613 11.72294 
1 1 1    7    3    8 o  226.880   2.0364  2098.07   37.661  2124.48   49.048  2060.13   58.786  228.299   2.6356  224.810   3.2079 3.489044 4.151767 
1 1 1    7    3    9 o  549.517   4.1650 12310.13  186.568 12322.06  241.138 12292.34  294.476  549.744   5.3811  549.031   6.5799 0.7124634 8.500037 
1 1 1    7    3   10 o  273.079   2.3117  3039.57   51.458  3141.51   67.999  2902.94   78.719  277.615   3.0049  266.858   3.6188 10.75604 4.703691 
1 1 1    7    3   11 o  466.889   4.6335  8886.87  176.344  9027.72  218.699  8625.08  298.148  470.542   5.7018  459.841   7.9541 10.70071 9.786602 
1 1 1    7    3   12 o  465.591   4.6222  8837.54  175.426  9006.52  218.075  8527.68  295.306  469.989   5.6922  457.239   7.9231 12.75073 9.755843 
1 1 1    7    3   13 o  1010.24   8.3286 41632.11  685.852 42114.76  979.733 41168.29  960.437  1015.63   11.834  1004.17   11.733 11.46265 16.66492 
1 1 1    7    3   14 o  434.617   3.7672  7700.10  133.464  7982.47  194.199  7447.36  183.730  442.474   5.3842  427.389   5.2738 15.08472 7.536744 
1 1 1    7    3   15 o  622.778   4.6807 15812.12  237.617 15839.80  307.225 15770.92  374.861  623.265   6.0471  621.839   7.3953 1.426819 9.552917 
1 1 1    7    3   16 o  207.693   1.9393  1758.20   32.833  1726.61   41.902  1808.44   52.845  205.815   2.4976  210.632   3.0778 -4.816238 3.963723 
1 1 1    7    3   17 o  697.112   4.7509 19812.27  269.968 19899.61  383.282 19726.28  380.319  698.547   6.7311  695.499   6.7083 3.047607 9.503145 
1 1 1    7    3   18 o  773.288   5.2467 24380.37  330.724 24155.61  463.983 24612.51  471.539  769.583   7.3962  776.823   7.4466 -7.240540 10.49554 
1 1 1    7    3   19 o  172.155   1.6135  1207.98   22.643  1223.51   32.342  1193.04   31.710  173.255   2.2901  171.085   2.2738 2.170929 3.227152 
1 1 1    7    3   20 o  442.978   3.1292  7998.80  112.992  7916.96  158.519  8083.33  161.103  440.678   4.4129  445.284   4.4384 -4.605530 6.258870 
1 1 1    7    3   21 o  157.368   1.5654  1009.38   20.081  981.539   28.144  1038.25   28.660  155.180   2.2249  159.600   2.2029 -4.420135 3.131012 
1 1 1    7    3   22 o  439.612   3.4092  7877.94  122.169  7906.45  193.938  7859.18  157.303  440.356   5.4029  439.066   4.3951 1.289703 6.964768 
1 1 1    7    3   23 o  315.888   2.5930  4067.36   66.767  4099.05  106.500  4046.84   85.700  317.095   4.1203  315.081   3.3367 2.013397 5.301922 
1 1 1    7    3   24 o  272.700   2.3281  3031.17   51.751  3093.06   83.282  2992.24   66.051  275.455   3.7091  270.937   2.9907 4.517670 4.764612 
1 1 1    7    3   25 o  522.567   3.9831 11132.31  169.669 11259.96  271.124 11050.14  217.529  525.466   6.3298  520.597   5.1260 4.869019 8.145054 
1 1 1    7    3   26 o  161.035   1.7795  1056.98   23.359  1095.84   38.025  1033.43   29.604  163.963   2.8450  159.229   2.2808 4.734146 3.646401 
1 1 1    7    3   27 o  456.274   3.5331  8486.62  131.408  8792.83  214.159  8301.72  166.419  464.367   5.6577  451.250   4.5243 13.11719 7.244208 
1 1 1    7    3   28 f  380.954   3.0291  5915.74   94.065  6024.81  151.234  5846.93  120.130  384.410   4.8264  378.715   3.8914 5.694672 6.199713 
1 1 1    7    3   29 o  460.109   3.5626  8630.00  133.616  8784.14  214.631  8532.47  170.736  464.132   5.6730  457.474   4.5785 6.658783 7.290109 
1 1 1    7    3   30 o  1236.37   9.0912 62381.00  916.232 62636.00  1453.91 62213.02  1180.03  1237.71   14.411  1234.18   11.729 3.524414 18.58085 
1 1 1    7    3   31 f  676.475   5.0712 18658.88  279.642 18826.99  445.877 18549.89  359.031  679.306   8.0522  674.406   6.5309 4.899719 10.36777 
1 1 1    7    3   32 o  206.068   3.1956  1731.01   53.679  1731.01   53.679   0.0000   0.0000  206.068   3.1956  ?   ?  0.000000 3.195636 
1 1 1    7    3   33 o   45.653   3.0073   85.328   11.129   44.950   16.612  118.213   14.991   32.626   6.4747   53.740   3.4402 -21.11407 7.331889 
1 1 1    7    3   34 o  519.555   5.1205 11006.93  216.862 11073.54  379.071 10974.52  264.404  520.883   8.9278  518.732   6.2530 2.151611 10.89980 
1 1 1    7    3   35 o  902.464   8.6285 33238.93  634.746 33325.16  1102.96 33196.22  776.157  902.416   14.994  901.584   10.561 0.8319702 18.33999 
1 1 1    7    3   36 o  947.130   9.0440 36617.45  698.244 36477.44  1206.25 36688.00  856.291  943.877   15.678  947.680   11.085 -3.802917 19.20061 
1 1 1    7    3   37 o  240.722   2.4138  2362.04   47.364  2346.18   95.961  2367.15   54.460  239.870   4.9078  240.978   2.7725 -1.108047 5.636745 
1 1 1    7    3   38 o  242.358   2.7843  2394.36   55.006   0.0000   0.0000  2394.36   55.006  ?   ?   242.358   2.7843 0.000000 2.784323 
1 1 1    7    3   39 o  443.280   3.4408  8010.75  124.330  7944.23  195.644  8055.81  161.027  441.350   5.4381  444.486   4.4443 -3.135956 7.023151 
1 1 1    7    3   40 o  455.809   3.5274  8470.25  131.061  8486.37  207.993  8459.62  168.786  456.143   5.5939  455.479   4.5460 0.6634521 7.208171 
1 1 1    7    3   41 o  245.861   2.0076  2463.94   40.235  2429.22   57.148  2498.07   56.657  244.110   2.8720  247.546   2.8078 -3.436447 4.016449 
1 1 1    7    3   42 o  414.763   2.9737  7013.10  100.539  7177.24  145.412  6862.76  139.160  419.537   4.2520  410.247   4.1613 9.289856 5.949476 
1 1 1    7    3   43 o  179.480   1.9078  1313.05   27.911  1300.84   36.082  1331.24   44.043  178.637   2.4779  180.705   2.9900 -2.067932 3.883299 
1 1 1    7    3   44 o  300.120   2.2975  3671.70   56.207  3659.32   80.048  3683.75   78.941  299.588   3.2779  300.588   3.2218 -1.000122 4.596113 
1 1 1    7    3   45 o  216.197   1.8645  1905.27   32.858  1863.99   46.725  1945.66   46.217  213.829   2.6807  218.465   2.5953 -4.635925 3.731150 
1 1 1    7    3   46 o  322.283   2.4244  4234.23   63.690  4241.50   90.863  4227.20   89.300  322.525   3.4561  321.983   3.4024 0.5421143 4.849848 
1 1 1    7    3   47 o  220.760   1.8848  1986.59   33.917  1978.39   48.700  1994.31   47.264  220.288   2.7121  221.174   2.6216 -0.8862915 3.772000 
1 1 1    7    3   48 o  145.446   1.7186  862.313   20.375  847.716   32.724  871.556   26.038  144.195   2.7841  146.218   2.1846 -2.022736 3.538887 
1 1 1    7    3   49 o  320.175   2.6312  4179.45   68.673  4246.30  110.446  4137.32   87.682  322.647   4.1994  318.525   3.3770 4.121918 5.388803 
1 1 1    7    3   50 o   79.049   1.5356  254.709   9.8948  254.911   14.359  254.526   13.654   79.043   2.2308   78.988   2.1226 0.5574799E-01 3.079274 
1 1 1    7    3   51 f   88.184   1.4990  316.988   10.775  304.320   15.595  328.561   14.906   86.370   2.2169   89.775   2.0369 -3.405403 3.010532 
1 1 1    7    3   52 o  312.587   2.5781  3983.96   65.690  3946.03  103.364  4009.67   85.082  311.006   4.0772  313.554   3.3288 -2.547974 5.263535 
1 1 1    7    3   53 o   94.206   1.4850  361.764   11.403  360.951   16.569  362.495   15.718   94.093   2.1603   94.296   2.0449 -0.2024612 2.974611 
1 1 1    7    3   54 o  180.844   1.5343  1333.16   22.618  1383.72   36.056  1300.36   29.043  184.220   2.4011  178.595   1.9950 5.624588 3.121686 
1 1 1    7    3   55 o  124.651   1.5032  633.392   15.273  614.863   21.759  651.387   21.444  122.803   2.1737  126.400   2.0812 -3.596626 3.009394 
1 1 1    7    3   56 o  475.225   3.0938  9211.55  119.848  9231.65  183.811  9196.68  158.068  475.500   4.7423  474.708   4.0849 0.7928467 6.259035 
1 1 1    7    3   57 o  269.131   1.9482  2953.07   42.740  2959.64   57.463  2944.93   63.942  269.396   2.6167  268.706   2.9193 0.6893005 3.920370 
1 1 1    7    3   58 o  303.648   2.2922  3759.67   56.735  3770.71   70.588  3739.54   95.360  304.054   2.8480  302.702   3.8647 1.351715 4.800728 
1 1 1    7    3   59 o  144.042   1.3970  845.793   16.403  882.603   23.312  809.697   23.085  147.130   1.9438  140.921   2.0097 6.209442 2.795904 
1 1 1    7    3   60 o  126.531   1.3512  652.649   13.937  632.299   19.412  674.299   20.021  124.532   1.9123  128.601   1.9099 -4.069527 2.702691 
1 1 1    7    3   61 o  137.473   1.3464  770.415   15.088  776.133   21.648  765.014   21.040  137.969   1.9249  136.979   1.8843 0.9907532 2.693693 
1 1 1    7    3   62 o  107.798   1.3052  473.698   11.469  458.763   16.401  487.991   16.045  106.074   1.8969  109.403   1.7991 -3.328896 2.614374 
1 1 1    7    3   63 o  276.659   2.0217  3120.98   45.593  2951.08   67.595  3262.80   61.757  268.944   3.0833  282.828   2.6787 -13.88397 4.084415 
1 1 1    7    3   64 f   88.889   1.4007  322.105   10.149  308.686   15.745  331.645   13.276   86.975   2.2226   90.189   1.8058 -3.214333 2.863755 
1 1 1    7    3   65 o  195.960   1.4279  1565.48   22.809  1587.35   35.028  1549.38   30.054  197.293   2.1780  194.932   1.8914 2.361115 2.884640 
1 1 1    7    3   66 o   78.845   1.5474  253.445   9.9454  250.908   12.756  257.376   15.881   78.417   1.9973   79.399   2.4567 -0.9821472 3.166179 
1 1 1    7    3   67 o  127.661   1.4654  664.417   15.249  651.292   19.732  683.879   24.028  126.382   1.9154  129.493   2.2763 -3.110893 2.974931 
1 1 1    7    3   68 o  196.004   1.6612  1566.36   26.542  1585.35   35.101  1541.00   40.560  197.163   2.1840  194.363   2.5600 2.800003 3.365051 
1 1 1    7    3   69 o  258.783   1.9403  2730.85   40.930  2765.26   54.320  2685.65   62.257  260.360   2.5595  256.545   2.9771 3.815094 3.926041 
1 1 1    7    3   70 o   65.463   1.7111  174.853   9.1230  182.689   11.737  162.891   14.501   66.894   2.1552   63.121   2.8256 3.773396 3.553678 
1 1 1    7    3   71 o  167.049   1.5674  1137.75   21.343  1163.33   28.239  1103.67   32.593  168.896   2.0511  164.488   2.4309 4.407867 3.180594 
1 1 1    7    3   72 o   63.017   1.7619  162.056   9.0416  167.026   11.538  154.150   14.554   63.955   2.2167   61.391   2.9166 2.563229 3.663317 
1 1 1    7    3   73 o  181.425   1.7538  1342.17   25.936  1356.43   31.626  1312.89   45.324  182.366   2.1275  179.345   3.1003 3.021500 3.760044 
1 1 1    7    3   74 o  232.692   1.9857  2208.24   37.664  2203.82   45.723  2217.56   66.435  232.424   2.4133  233.027   3.4975 -0.6028595 4.249286 
1 1 1    7    3   75 o  172.547   1.7656  1214.09   24.834  1232.35   30.188  1175.86   43.680  173.818   2.1306  169.709   3.1574 4.108917 3.809047 
1 1 1    7    3   76 o  265.911   2.0172  2883.97   43.724  2884.61   57.532  2883.11   67.274  265.870   2.6546  265.739   3.1057 0.1303101 4.085629 
1 1 1    7    3   77 o   19.748   5.6139   16.379   9.4629  -1.0550   12.719   37.994   14.162   14.182   6.0986   29.910   6.0174 -15.72760 8.567474 
1 1 1    7    3   78 o  162.527   1.7464  1077.23   23.136  1055.49   32.012  1101.00   33.477  160.834   2.4418  164.260   2.5002 -3.426361 3.494721 
1 1 1    7    3   79 f   35.774   3.0790   52.646   8.8915   63.234   12.058   40.029   13.163   39.145   3.8278   30.798   5.4423 8.347296 6.653620 
1 1 1    7    3   80 o  111.965   1.7983  511.305   16.413  511.422   20.946  511.119   26.415  111.953   2.2953  111.844   2.8999 0.1091690 3.698315 
1 1 1    7    3   81 o  106.237   1.6989  460.317   14.712  453.517   20.603  467.392   21.016  105.414   2.3977  107.013   2.4092 -1.599579 3.399044 
1 1 1    7    3   82 o   64.696   1.8174  170.870   9.5750  159.983   12.209  188.264   15.432   62.561   2.3986   67.840   2.7966 -5.279335 3.684338 
1 1 1    7    3   83 o  167.302   1.5974  1141.57   21.785  1140.48   28.528  1143.09   33.740  167.181   2.0934  167.333   2.4736 -0.1521759 3.240518 
1 1 1    7    3   84 o   74.354   1.6924  225.514   10.258  224.844   13.282  226.503   16.148   74.191   2.1986   74.425   2.6660 -0.2343445 3.455620 
1 1 1    7    3   85 o   39.947   2.5261   65.428   8.1837   74.822   10.510   50.960   13.043   42.678   3.0410   34.934   4.6994 7.743721 5.597502 
1 1 1    7    3   86 o   27.446   3.4613   31.305   7.5718   25.891   9.6889   39.799   12.136   24.667   4.9901   30.734   5.0171 -6.066458 7.076175 
1 1 1    7    3   87 o   85.010   1.7834  294.868   12.358  312.639   17.693  277.940   17.269   87.453   2.4845   82.444   2.5727 5.008957 3.576540 
1 1 1    7    3   88 o   65.023   2.0198  172.751   10.693  171.389   15.353  174.033   14.901   64.679   2.9195   65.189   2.8108 -0.5103378 4.052630 
1 1 1    7    3   89 o  101.092   1.7068  417.011   14.065  409.120   19.809  425.034   19.975  100.072   2.4283  102.002   2.4023 -1.930283 3.415856 
1 1 1    7    3   90 o   72.654   1.9282  215.639   11.409  219.835   16.376  211.680   15.904   73.272   2.7467   71.902   2.7184 1.370331 3.864508 
1 1 1    7    3   91 f  103.175   1.8845  434.590   15.849  432.524   25.309  435.924   20.329  102.752   3.0249  103.279   2.4147 -0.5268784 3.870513 
1 1 1    7    3   92 o   28.832   4.2783   34.915   9.7504   25.442   15.692   40.873   12.444   24.482   7.3080   31.076   5.0885 -6.594770 8.905084 
1 1 1    7    3   93 o  110.007   2.1385  494.484   19.177  529.547   38.622  483.012   22.092  113.358   4.1869  108.674   2.4939 4.684425 4.873387 
1 1 1    7    3   94 o   9.0061   4.2940 -11.4089   8.7429 -16.0364   12.721  -7.2666   12.036   10.923   5.2001   12.143   5.5291 -1.219444 7.590281 
1 1 1    7    3   95 o   38.515   2.9756   61.174   9.2696   61.285   13.304   61.068   12.923   38.301   4.3374   38.259   4.2133 0.4254532E-01 6.046957 
1 1 1    7    3   96 o   23.885   4.4471   24.315   8.3397   8.4082   11.971   39.314   11.625   16.679   6.3536   30.442   4.8469 -13.76294 7.991285 
1 1 1    7    3   97 o   74.101   1.7966  224.380   10.852  216.671   13.181  240.600   19.119   72.733   2.2258   76.481   3.0730 -3.748344 3.794374 
1 1 1    7    3   98 o  106.738   1.6451  465.475   14.314  450.864   17.435  495.681   25.069  104.982   2.0374  109.860   2.8017 -4.878143 3.464174 
1 1 1    7    3   99 o   56.996   2.0361  133.111   9.4446  144.303   11.758  112.759   15.856   59.280   2.4385   52.108   3.7582 7.172138 4.479993 
1 1 1    7    3  100 o   11.382   4.6386   2.2018   6.7789   4.4406   8.8656  -0.9497   10.518   13.581   5.3836   12.698   5.5035 0.8823442 7.698777 
1 1 1    7    3  101 o   69.934   1.8420  200.284   10.492  193.337   12.779  214.650   18.377   68.621   2.2877   72.081   3.1351 -3.459900 3.881049 
1 1 1    7    3  102 o   23.891   4.3811   24.545   8.2178   26.438   10.518   21.578   13.167   24.556   5.4014   22.194   6.7103 2.362642 8.614126 
1 1 1    7    3  103 o  106.696   1.7998  466.165   15.653  468.021   20.045  463.264   25.058  106.749   2.3036  105.929   2.9047 0.8205643 3.707297 
1 1 1    7    3  104 o   39.582   2.7855   64.945   8.9301   67.576   11.645   61.190   13.913   40.160   3.5954   37.869   4.6015 2.290432 5.839561 
1 1 1    7    3  105 o   16.202   5.2272   11.011   7.8560   13.422   10.032   7.1870   12.632   17.889   5.9157   16.191   6.4237 1.697945 8.732647 
1 1 1    7    3  106 o   59.525   2.1173  145.775   10.257  144.568   13.137  147.659   16.415   59.094   2.7347   59.474   3.4001 -0.3803978 4.363431 
1 1 1    7    3  107 o   85.544   2.1602  301.187   15.051  320.325   17.373  243.601   30.136   88.112   2.4212   75.382   4.9315 12.72984 5.493768 
1 1 1    7    3  108 o   53.831   2.2189  119.528   9.7157  125.235   11.629  106.339   17.679   54.981   2.6022   49.904   4.3907 5.077148 5.103843 
1 1 1    7    3  109 o   20.739   4.8236   19.124   8.0001   18.769   9.3992   20.056   15.240   20.413   5.5179   21.300   7.2926 -0.8865814 9.144938 
1 1 1    7    3  110 o   44.703   2.2932   82.671   8.3283   85.273   10.964   79.123   12.806   45.169   2.9946   43.235   3.6681 1.934650 4.735292 
1 1 1    7    3  111 o   60.199   2.0309  149.376   9.9514  144.191   12.209  159.641   17.178   58.955   2.5465   61.602   3.4345 -2.647839 4.275591 
1 1 1    7    3  112 o   25.305   4.1855   27.914   8.3321   27.223   9.8154   29.698   15.763   24.646   5.0555   24.904   7.2968 -0.2584267 8.877017 
1 1 1    7    3  113 o   49.610   2.1667  101.820   8.7410   90.386   11.452  117.777   13.529   46.399   3.0447   52.937   3.1495 -6.537964 4.380604 
1 1 1    7    3  114 o   11.528   4.8900   1.2527   7.9785  -3.5186   11.368   5.8848   11.201   12.140   5.4656   14.776   5.9843 -2.635526 8.104599 
1 1 1    7    3  115 o   63.532   2.1039  167.073   10.881  171.507   15.618  162.892   15.168   63.863   3.0085   62.242   2.9983 1.621418 4.247480 
1 1 1    7    3  116 o   13.035   5.3040   4.2643   8.8468   1.3047   14.621   5.9738   11.112   14.726   6.4339   14.633   5.9479 0.9336662E-01 8.761992 
1 1 1    7    3  117 o   24.530   3.9553   26.537   7.6401   22.339   10.163   31.991   11.585   21.694   5.6812   26.082   5.6152 -4.388575 7.987878 
1 1 1    7    3  118 o   32.998   3.0406   46.439   8.0869   48.141   10.815   44.281   12.180   33.023   4.1060   31.123   4.9677 1.899666 6.444958 
1 1 1    7    3  119 o   10.401   4.5766  -0.6475   7.5156   0.6140   9.9185  -2.3484   11.517   12.183   5.3116   12.220   5.5013 -0.3627396E-01 7.647040 
1 1 1    7    3  120 o   14.314   5.2142   8.5833   7.8887  -0.4417   10.443   20.579   12.039   12.094   5.3548   20.237   6.4653 -8.143100 8.394868 
1 1 1    7    3  121 o   12.533   5.0546   4.7507   7.9537   8.2038   10.740   0.5570   11.836   14.862   5.9144   12.933   5.7147 1.928391 8.224217 
1 1 1    7    3  122 o   41.274   2.6609   72.416   8.9048   78.433   11.727   64.222   13.685   42.402   3.4219   37.396   4.5852 5.006058 5.721298 
1 1 1    7    3  123 o   34.611   3.3302   52.321   9.2798   43.650   12.981   61.382   13.270   29.936   5.5233   36.503   4.5590 -6.567440 7.161739 
1 1 1    7    3  124 o   54.113   3.1034  126.480   13.632  132.994   19.219  119.885   19.338   53.989   4.4053   50.855   4.7188 3.134201 6.455508 
1 1 1    7    3  125 o   13.397   5.5365   5.5057   9.8313  -0.6487   12.526   15.381   15.866   12.738   5.7357   17.843   7.1590 -5.104940 9.173304 
1 1 1    7    3  126 o   32.488   4.0909   48.071   10.594   49.641   13.467   45.523   17.160   31.885   5.3722   28.380   7.3572 3.505079 9.109808 
1 1 1    7    3  127 o   11.667   5.1908  -0.0385   9.9319   5.4615   12.698  -8.7053   15.940   14.248   6.1098   12.531   5.9230 1.717236 8.509465 
1 1 1    7    3  128 o   18.645   6.0055   18.128   10.373   30.132   13.388   0.1002   16.406   23.397   6.6860   14.135   6.4438 9.261762 9.285726 
1 1 1    7    3  129 o   22.519   5.7530   26.165   10.598   26.558   13.453   25.522   17.205   21.726   6.8212   20.621   7.6677 1.104342 10.26264 
1 1 1    7    3  130 o   32.594   4.7030   50.480   12.134   41.735   14.078   75.754   23.933   28.018   6.3156   34.788   8.5108 -6.769562 10.59813 
1 1 1    7    3  131 o   19.361   6.3217   20.427   11.471   15.478   13.078   36.931   23.881   17.252   6.6237   22.633   8.8776 -5.381216 11.07637 
1 1 1    7    3  132 o   30.710   4.9728   45.888   12.023   43.759   13.748   52.810   24.791   28.894   6.0322   26.556   9.2905 2.337971 11.07706 
1 1 1    7    3  133 o   15.793   5.9220   12.201   10.306   22.787   13.011  -5.6265   16.884   20.034   6.7395   13.133   6.1730 6.900772 9.139306 
1 1 1    7    4 -132 o   9.5266   4.5494  -9.1696   9.8967  -5.9723   12.538 -14.4540   16.119   11.429   5.3555   11.628   5.6176 -0.1986885 7.761346 
1 1 1    7    4 -131 o   12.024   5.2563   2.0041   9.7705   1.1561   12.393   3.3969   15.883   12.837   5.7488   14.413   6.4771 -1.576020 8.660320 
1 1 1    7    4 -130 o   19.066   5.9244   19.314   10.175   17.565   12.874   22.225   16.610   17.974   6.6421   19.381   7.4586 -1.407299 9.987416 
1 1 1    7    4 -129 o   12.806   5.3239   5.0334   9.1663   2.8935   10.908   10.176   16.910   12.784   5.5718   16.210   7.0017 -3.425968 8.948133 
1 1 1    7    4 -128 o   10.405   4.7528  -2.7465   8.9850   7.6068   10.807 -25.9267   16.170   14.244   5.8369   10.448   5.1655 3.795886 7.794373 
1 1 1    7    4 -127 o   34.071   3.6225   51.918   9.9067   57.393   11.865   39.315   18.002   35.316   4.2040   25.308   7.8825 10.00844 8.933469 
1 1 1    7    4 -126 o   8.9234   4.3422 -14.0187   10.093 -21.9354   12.556   0.4375   16.967   9.2558   4.5716   14.382   6.5550 -5.126292 7.991716 
1 1 1    7    4 -125 o   24.856   4.7480   29.429   9.2693   32.836   11.088   21.522   16.891   25.708   5.4599   19.582   7.5252 6.126667 9.297235 
1 1 1    7    4 -124 o   20.325   5.3562   20.553   8.9973   16.385   10.716   30.513   16.564   17.919   6.1156   22.819   7.6031 -4.899357 9.757450 
1 1 1    7    4 -123 o   18.150   5.5199   16.386   8.8920   17.654   10.800   13.719   15.667   18.572   6.1378   17.379   7.0633 1.192440 9.357488 
1 1 1    7    4 -122 o   24.348   5.2215   28.733   10.052   28.245   12.797   29.520   16.244   23.115   6.5140   22.760   7.5275 0.3549576 9.954702 
1 1 1    7    4 -121 o   20.714   6.1339   21.995   11.090   2.9176   14.933   45.452   16.559   14.554   6.4256   29.102   7.0545 -14.54776 9.542225 
1 1 1    7    4 -120 o   10.236   4.9131 -12.7971   11.866 -16.4636   20.235 -10.8758   14.648   13.336   6.4048   11.899   5.6402 1.436661 8.534198 
1 1 1    7    4 -119 o   20.856   5.9129   21.588   10.512   31.178   14.427   10.734   15.348   24.349   6.9350   16.888   6.9421 7.461473 9.812613 
1 1 1    7    4 -118 o   36.642   3.3736   58.012   9.9632   59.326   12.648   55.864   16.173   36.399   4.3489   33.954   6.0659 2.445232 7.463771 
1 1 1    7    4 -117 o   40.884   3.1800   71.491   10.515   74.450   13.679   67.219   16.437   41.071   4.1425   37.979   5.4667 3.091690 6.858975 
1 1 1    7    4 -116 o   28.752   3.8723   36.251   8.8449   33.041   10.910   42.406   15.108   26.707   5.1985   29.442   6.4719 -2.734549 8.301210 
1 1 1    7    4 -115 o   35.047   3.2003   52.348   9.0421   50.869   10.989   55.448   15.911   34.120   4.0287   34.426   5.8810 -0.3056602 7.128572 
1 1 1    7    4 -114 o   25.300   4.2838   28.345   8.5197   31.241   10.341   22.224   15.033   26.228   5.0193   21.476   7.2444 4.752211 8.813330 
1 1 1    7    4 -113 o   33.661   3.3115   48.194   8.9688   53.336   11.008   38.042   15.467   35.149   3.9081   28.061   6.8279 7.088060 7.867232 
1 1 1    7    4 -112 o   41.145   2.7817   70.854   9.2746   65.296   11.144   83.378   16.728   39.179   3.5273   43.586   4.7868 -4.407288 5.945979 
1 1 1    7    4 -111 o   13.383   5.1761   5.6827   8.0283   6.7294   9.7734   3.5111   14.078   14.575   5.6903   15.328   6.4982 -0.7524767 8.637499 
1 1 1    7    4 -110 o   38.672   2.8828   62.576   9.0220   65.113   10.938   57.177   15.959   39.234   3.4553   35.674   5.6780 3.559956 6.646688 
1 1 1    7    4 -109 o   45.506   2.2399   85.633   8.2831   91.755   11.281   78.473   12.201   46.857   2.9688   43.108   3.5023 3.749065 4.591284 
1 1 1    7    4 -108 o   19.844   4.5233   17.429   7.1533   18.577   9.7793   16.107   10.491   20.271   5.6879   19.052   6.0292 1.218987 8.288791 
1 1 1    7    4 -107 o   52.843   2.1445  115.146   9.2182  115.534   13.452  114.803   12.658   52.580   3.1530   52.485   2.9707 0.9450531E-01 4.331993 
1 1 1    7    4 -106 f   37.043   2.8415   57.179   8.5146   51.949   12.232   62.095   11.860   34.763   4.4160   38.272   3.8540 -3.509899 5.861289 
1 1 1    7    4 -105 o   52.910   2.3912  115.584   10.287  126.987   13.690  100.796   15.589   55.245   3.0518   48.856   3.9481 6.388103 4.990090 
1 1 1    7    4 -104 o   87.646   2.1352  315.647   15.255  301.752   18.157  348.998   28.129   85.487   2.6086   91.297   3.7880 -5.810593 4.599306 
1 1 1    7    4 -103 o   76.985   2.2219  243.751   13.929  247.890   16.822  234.725   24.843   77.482   2.6673   74.743   4.0932 2.739677 4.885623 
1 1 1    7    4 -102 o   11.183   4.8776  -1.1323   8.3719  -4.5015   13.170   1.1525   10.845   13.227   5.9245   13.422   5.6975 -0.1954994 8.219565 
1 1 1    7    4 -101 o   30.638   3.2203   39.227   7.9225   32.316   11.847   44.818   10.656   27.128   5.5445   32.536   4.1094 -5.407068 6.901338 
1 1 1    7    4 -100 o   47.389   2.1295   92.247   8.2053   94.716   11.313   89.506   11.919   47.860   2.9135   46.460   3.1662 1.400612 4.302674 
1 1 1    7    4  -99 o   74.000   1.7028  223.953   10.272  224.899   14.026  222.859   15.084   74.011   2.3277   73.629   2.5170 0.3822021 3.428317 
1 1 1    7    4  -98 o   57.903   1.8666  137.298   8.7987  149.521   12.328  124.607   12.562   60.314   2.5130   54.991   2.8118 5.323437 3.771065 
1 1 1    7    4  -97 o   21.168   4.1892   19.196   6.9725   14.079   9.5936   24.924   10.151   18.345   5.7604   23.953   5.3358 -5.607437 7.851954 
1 1 1    7    4  -96 o   26.553   3.4548   29.508   7.3006   21.593   10.118   38.104   10.544   22.287   5.5821   30.011   4.4444 -7.723755 7.135314 
1 1 1    7    4  -95 o   28.864   3.2803   34.673   7.5812   35.395   10.403   33.856   11.071   28.897   4.5682   28.145   5.0090 0.7514019 6.779275 
1 1 1    7    4  -94 o   45.928   2.2763   86.502   8.4956   91.230   11.609   81.050   12.466   47.058   3.0427   44.268   3.4827 2.790924 4.624574 
1 1 1    7    4  -93 o   52.818   2.1170  114.222   9.0960  105.964   12.297  124.202   13.517   50.753   2.9855   54.954   3.0293 -4.200844 4.253150 
1 1 1    7    4  -92 o   86.693   1.7469  306.890   12.345  313.849   17.024  299.172   17.928   87.568   2.3871   85.465   2.5763 2.103241 3.512203 
1 1 1    7    4  -91 o   78.811   2.0214  253.888   12.975  246.186   15.991  268.728   22.198   77.541   2.5334   80.876   3.3746 -3.335274 4.219721 
1 1 1    7    4  -90 o   99.938   1.7961  407.736   14.632  404.219   17.947  414.707   25.268   99.464   2.2135  100.583   3.0855 -1.118454 3.797404 
1 1 1    7    4  -89 o   72.294   2.1857  213.686   12.866  204.023   16.580  228.311   20.397   70.556   2.8889   74.573   3.3641 -4.017418 4.434286 
1 1 1    7    4  -88 o   42.870   3.3170   75.704   11.501   77.724   16.575   73.828   15.972   43.200   4.7873   42.100   4.7362 1.100037 6.734245 
1 1 1    7    4  -87 o   75.740   2.0586  234.373   12.698  230.954   16.245  239.742   20.356   75.124   2.6571   76.462   3.2736 -1.338287 4.216173 
1 1 1    7    4  -86 f  193.045   1.8539  1520.83   29.174  1483.21   35.326  1601.51   51.735  190.581   2.2740  197.847   3.2079 -7.265640 3.932078 
1 1 1    7    4  -85 o   60.954   2.1156  151.850   10.496  154.615   12.803  146.183   18.329   61.468   2.5608   59.620   3.7910 1.848492 4.574896 
1 1 1    7    4  -84 o  100.734   1.7361  413.997   14.256  421.620   17.455  398.724   24.706  101.633   2.1069   98.705   3.0743 2.927956 3.727019 
1 1 1    7    4  -83 f   33.654   3.6780   46.902   9.9258   52.697   12.781   38.096   15.755   35.566   4.5097   29.795   6.6553 5.771366 8.039268 
1 1 1    7    4  -82 o   66.678   2.4086  181.747   13.070  192.089   18.336  171.063   18.635   68.466   3.2951   64.571   3.5542 3.894783 4.846593 
1 1 1    7    4  -81 o  158.139   2.1000  1020.48   27.070  1049.01   38.543  992.708   38.028  160.242   2.9508  155.877   2.9929 4.364700 4.202907 
1 1 1    7    4  -80 o   75.547   2.0475  233.033   12.597  238.167   16.209  225.202   20.019   76.332   2.6089   74.155   3.3203 2.177002 4.222598 
1 1 1    7    4  -79 o   46.939   2.6468   90.236   10.086   81.327   12.655  105.751   16.700   44.466   3.5201   50.675   4.0773 -6.208885 5.386623 
1 1 1    7    4  -78 o  195.908   1.8434  1565.45   29.437  1573.94   36.078  1548.53   50.917  196.401   2.2535  194.696   3.2083 1.704895 3.920634 
1 1 1    7    4  -77 o   62.823   2.1080  161.187   10.780  155.160   12.979  174.586   19.353   61.603   2.5905   65.257   3.6527 -3.653877 4.478111 
1 1 1    7    4  -76 o  169.616   1.9372  1173.43   26.785  1163.75   34.299  1188.55   42.879  168.875   2.4916  170.610   3.0832 -1.735001 3.964167 
1 1 1    7    4  -75 o   74.968   2.0222  229.399   12.346  225.372   15.115  237.473   21.400   74.277   2.5000   76.171   3.4556 -1.893852 4.265090 
1 1 1    7    4  -74 o  158.406   1.9619  1023.40   25.333  1049.89   32.952  985.128   39.612  160.406   2.5201  155.333   3.1284 5.073441 4.017252 
1 1 1    7    4  -73 o  178.794   1.8125  1303.65   26.416  1322.03   32.553  1268.20   45.205  180.024   2.2183  176.244   3.1466 3.780228 3.849908 
1 1 1    7    4  -72 o   77.752   1.8804  246.537   11.918  241.037   14.508  257.952   20.901   76.833   2.3190   79.420   3.2353 -2.587227 3.980558 
1 1 1    7    4  -71 f  185.961   1.7930  1410.17   27.179  1410.86   33.214  1408.78   47.284  185.983   2.1909  185.773   3.1224 0.2096100 3.814375 
1 1 1    7    4  -70 o   66.674   2.0757  181.477   11.267  179.836   12.721  187.449   24.270   66.356   2.3557   67.573   4.4306 -1.216698 5.017856 
1 1 1    7    4  -69 o  126.497   1.7686  652.482   18.236  649.521   20.471  663.867   40.143  126.202   1.9899  127.428   3.8692 -1.225380 4.350869 
1 1 1    7    4  -68 f  109.750   1.7555  491.139   15.705  497.456   17.759  468.478   33.638  110.447   1.9726  107.029   3.8619 3.417877 4.336553 
1 1 1    7    4  -67 o   63.298   1.8957  163.529   9.7704  163.076   11.905  164.464   17.101   63.189   2.3152   63.389   3.3211 -0.1997147 4.048394 
1 1 1    7    4  -66 o   29.888   3.3032   36.904   7.9135   35.606   9.5826   39.688   14.033   29.236   4.1363   30.633   5.8327 -1.397112 7.150517 
1 1 1    7    4  -65 o  197.251   1.9807  1586.59   31.847  1606.90   41.208  1556.46   50.184  198.477   2.5470  195.295   3.1524 3.182648 4.052749 
1 1 1    7    4  -64 o  147.900   1.7930  891.903   21.617  888.335   27.621  897.542   34.725  147.585   2.2960  148.320   2.8722 -0.7353058 3.677078 
1 1 1    7    4  -63 o  226.762   1.9429  2096.74   35.913  2103.93   43.945  2082.27   62.314  227.125   2.3736  225.873   3.3844 1.251862 4.133797 
1 1 1    7    4  -62 o   81.885   1.7070  273.380   11.394  284.023   13.865  251.247   19.995   83.458   2.0381   78.406   3.1348 5.051559 3.739095 
1 1 1    7    4  -61 o  272.246   2.3808  3022.79   52.834  3026.21   58.996  3008.91  118.739  272.379   2.6571  271.264   5.3699 1.114166 5.991332 
1 1 1    7    4  -60 o  254.801   2.2802  2647.62   47.361  2655.90   52.955  2614.55  105.865  255.181   2.5458  252.914   5.1350 2.267838 5.731478 
1 1 1    7    4  -59 o   87.484   2.0058  312.066   14.304  312.066   14.304   0.0000   0.0000   87.484   2.0058  ?   ?  0.000000 2.005770 
1 1 1    7    4  -58 o  138.012   1.7830  776.568   20.059  761.191   22.097  848.609   47.828  136.633   1.9840  144.114   4.0755 -7.481262 4.532713 
1 1 1    7    4  -57 o  119.230   1.6043  579.546   15.592  612.894   19.251  515.956   26.584  122.605   1.9262  112.429   2.9031 10.17651 3.484050 
1 1 1    7    4  -56 o  163.764   1.6784  1093.34   22.405  1085.72   27.216  1109.37   39.463  163.181   2.0461  164.914   2.9356 -1.733078 3.578288 
1 1 1    7    4  -55 o  204.329   1.8358  1702.15   30.576  1703.83   37.420  1698.76   53.042  204.415   2.2457  204.062   3.1887 0.3521118 3.900151 
1 1 1    7    4  -54 o  387.923   2.8274  6137.55   89.405  6137.18  109.487  6138.28  154.888  387.846   3.4631  387.681   4.9012 0.1643066 6.001282 
1 1 1    7    4  -53 o  451.961   3.2179  8332.37  118.553  8313.83  144.948  8369.81  206.052  451.365   3.9396  452.598   5.5851 -1.233429 6.834707 
1 1 1    7    4  -52 o  109.329   1.6037  487.260   14.292  484.646   17.421  492.642   24.996  109.030   1.9602  109.874   2.7931 -0.8440552 3.412300 
1 1 1    7    4  -51 o  134.364   1.9641  736.015   21.512  714.114   24.387  812.811   45.666  132.344   2.2606  141.085   3.9748 -8.741241 4.572628 
1 1 1    7    4  -50 o  380.362   3.0429  5900.11   94.347  5893.12  121.691  5910.65  149.378  380.061   3.9280  380.530   4.8157 -0.4692993 6.214535 
1 1 1    7    4  -49 o  238.043   1.9555  2310.02   37.944  2343.86   54.813  2278.89   52.580  239.751   2.8047  236.408   2.7285 3.343201 3.912925 
1 1 1    7    4  -48 o  276.686   1.9955  3120.87   45.007  3129.40   69.711  3114.78   58.936  277.021   3.0871  276.394   2.6159 0.6272583 4.046396 
1 1 1    7    4  -47 o  286.709   1.8027  3350.91   42.132  3307.18   56.305  3406.54   63.511  284.813   2.4252  289.049   2.6955 -4.236206 3.625944 
1 1 1    7    4  -46 o  243.453   1.6985  2415.99   33.706  2372.78   47.341  2460.42   48.001  241.249   2.4073  245.664   2.3970 -4.414749 3.397187 
1 1 1    7    4  -45 o  121.977   1.4003  606.453   13.923  587.219   22.517  618.360   17.717  120.018   2.3016  123.165   1.7647 -3.147270 2.900220 
1 1 1    7    4  -44 o  433.741   2.5170  7669.75   88.991  7721.00  120.358  7607.94  132.174  435.141   3.3932  431.920   3.7541 3.220856 5.060356 
1 1 1    7    4  -43 o  528.238   3.0011 11376.70  129.223 11378.96  173.667 11373.90  193.423  528.216   4.0334  528.059   4.4936 0.1572266 6.038221 
1 1 1    7    4  -42 o  370.437   2.2007  5593.85   66.452  5530.52   88.680  5674.96  100.355  368.308   2.9538  373.073   3.3000 -4.764191 4.428837 
1 1 1    7    4  -41 o  640.857   3.5896 16746.21  187.516 16866.36  253.420 16600.82  278.764  643.038   4.8347  637.898   5.3610 5.139648 7.219068 
1 1 1    7    4  -40 o  106.032   1.2323  458.244   10.651  431.991   14.474  489.250   15.730  102.947   1.7248  109.557   1.7614 -6.610176 2.465257 
1 1 1    7    4  -39 o   95.992   1.4189  375.581   11.102  397.656   18.918  363.983   13.712   98.768   2.3497   94.497   1.7801 4.271072 2.947849 
1 1 1    7    4  -38 o  398.284   2.4802  6466.45   80.522  6427.40  113.675  6505.78  114.075  397.046   3.5123  399.460   3.5033 -2.413666 4.960786 
1 1 1    7    4  -37 o  452.174   2.9628  8335.18  109.204  8335.80  167.731  8334.73  143.875  452.122   4.5512  452.124   3.9038 -0.2593994E-02 5.996092 
1 1 1    7    4  -36 o  255.187   1.8936  2654.37   39.389  2601.97   60.416  2693.11   51.947  252.641   2.9337  257.035   2.4793 -4.393906 3.841041 
1 1 1    7    4  -35 o  397.746   2.6529  6448.91   86.013  6538.72  133.774  6385.61  112.304  400.462   4.0980  395.766   3.4811 4.695557 5.376995 
1 1 1    7    4  -34 o  471.288   2.8714  9054.30  110.311  8827.81  153.112  9298.75  159.065  465.315   4.0367  477.564   4.0861 -12.24857 5.743779 
1 1 1    7    4  -33 o  408.707   2.9188  6809.35   97.242  6822.35  168.741  6802.88  118.987  409.025   5.0610  408.495   3.5733 0.5304260 6.195350 
1 1 1    7    4  -32 f  438.171   3.1017  7826.63  110.785  7784.62  191.080  7847.90  135.970  436.911   5.3652  438.745   3.8018 -1.833771 6.575671 
1 1 1    7    4  -31 o  102.395   1.5019  427.350   12.536  417.096   21.640  432.529   15.380  101.121   2.6275  103.013   1.8316 -1.891907 3.202907 
1 1 1    7    4  -30 o  296.110   2.4664  3574.05   59.531  3579.93   94.626  3570.20   76.587  296.328   3.9174  295.940   3.1748 0.3887634 5.042368 
1 1 1    7    4  -29 o  320.657   2.6223  4191.22   68.544  4154.46  107.981  4216.03   88.707  319.219   4.1498  321.592   3.3839 -2.373322 5.354565 
1 1 1    7    4  -28 o  442.819   3.4320  7993.67  123.882  7949.04  195.295  8023.72  160.250  441.514   5.4264  443.621   4.4315 -2.106476 7.005979 
1 1 1    7    4  -27 o  368.031   2.4951  5521.04   74.853  5417.56   98.134  5665.00  115.749  364.552   3.3024  372.773   3.8092 -8.221191 5.041410 
1 1 1    7    4  -26 o  308.083   2.1753  3868.79   54.630  3917.95   73.560  3808.33   81.577  310.025   2.9108  305.651   3.2742 4.373535 4.380972 
1 1 1    7    4  -25 o  815.042   4.7898 27084.74  318.225 27405.40  454.946 26777.55  445.287  819.700   6.8088  810.262   6.7418 9.438110 9.581841 
1 1 1    7    4  -24 o  273.476   1.8751  3048.38   41.801  3028.83   59.378  3067.57   58.856  272.590   2.6723  274.329   2.6320 -1.738281 3.750781 
1 1 1    7    4  -23 o  572.246   3.4316 13349.04  160.074 13418.63  227.760 13281.12  225.022  573.684   4.8705  570.738   4.8367 2.945374 6.864061 
1 1 1    7    4  -22 o  666.810   3.9570 18126.46  215.082 18455.79  309.282 17818.02  299.307  672.759   5.6397  661.037   5.5546 11.72174 7.915840 
1 1 1    7    4  -21 o  259.240   1.8029  2739.24   38.099  2741.39   54.376  2737.16   53.398  259.335   2.5722  259.135   2.5279 0.1995544 3.606493 
1 1 1    7    4  -20 o  724.639   4.2779 21407.47  252.688 21435.77  358.192 21379.44  356.524  725.021   6.0608  724.069   6.0405 0.9520264 8.556923 
1 1 1    7    4  -19 o  432.426   2.6670  7622.10   94.008  7777.88  135.494  7477.50  130.540  436.800   3.8054  428.284   3.7392 8.516022 5.335038 
1 1 1    7    4  -18 o  759.826   4.7852 23538.33  296.380 23807.49  396.113 23195.99  446.727  764.063   6.3600  754.121   7.2672 9.942444 9.657156 
1 1 1    7    4  -17 o  213.772   1.8458  1862.64   32.164  1949.91   40.807  1719.46   52.264  218.720   2.2888  205.383   3.1218 13.33737 3.870957 
1 1 1    7    4  -16 o  564.640   3.6190 12996.55  166.569 13040.21  221.096 12939.26  253.304  565.549   4.7959  563.326   5.5163 2.222229 7.309602 
1 1 1    7    4  -15 o  238.802   1.9488  2324.36   37.935  2264.49   52.760  2388.45   54.584  235.700   2.7460  242.065   2.7663 -6.365128 3.897811 
1 1 1    7    4  -14 o  600.121   4.1322 14681.98  202.142 15066.04  357.697 14501.78  245.019  607.775   7.2200  596.393   5.0400 11.38184 8.805099 
1 1 1    7    4  -13 o  397.310   2.8526  6434.45   92.386  6456.48  160.511  6423.54  112.975  397.945   4.9482  396.962   3.4914 0.9834900 6.055921 
1 1 1    7    4  -12 o  1191.16   7.4002 57870.90  718.534 57987.82  1099.65 57783.79  949.190  1191.77   11.319  1189.93   9.7858 1.841553 14.96299 
1 1 1    7    4  -11 o  172.575   1.6352  1213.89   23.003  1172.45   39.464  1235.21   28.309  169.598   2.8546  174.083   1.9949 -4.484589 3.482567 
1 1 1    7    4  -10 o  480.221   3.1149  9400.34  121.934  9650.83  190.412  9226.21  158.755  486.534   4.8011  475.730   4.0938 10.80383 6.309555 
1 1 1    7    4   -9 o  113.734   1.6169  527.229   14.990  504.306   23.582  542.771   19.418  111.231   2.6009  115.397   2.0643 -4.165924 3.320505 
1 1 1    7    4   -8 o  150.671   1.5439  925.288   18.961  904.222   26.532  947.279   27.108  148.943   2.1853  152.448   2.1814 -3.504974 3.087763 
1 1 1    7    4   -7 o  505.468   3.5238 10415.10  145.191 10683.18  256.477 10288.67  176.130  511.848   6.1471  502.371   4.3010 9.476959 7.502408 
1 1 1    7    4   -6 o  511.906   3.9046 10682.46  162.931 10605.31  255.857 10735.10  211.318  509.979   6.1547  513.131   5.0521 -3.152130 7.962692 
1 1 1    7    4   -5 o  408.447   2.9152  6800.26   97.061  6764.90  167.210  6818.23  119.198  407.340   5.0358  408.975   3.5755 -1.635712 6.176036 
1 1 1    7    4   -4 o   86.998   1.4601  308.487   10.355  326.029   17.872  299.624   12.704   89.401   2.4548   85.738   1.8177 3.663033 3.054513 
1 1 1    7    4   -3 o  531.948   3.6912 11535.07  160.055 11586.75  227.230 11484.18  225.484  533.091   5.2291  530.727   5.2121 2.364380 7.383037 
1 1 1    7    4   -2 o  457.851   3.2255  8545.01  120.380  8538.42  170.149  8551.63  170.337  457.644   4.5611  457.998   4.5626 -0.3538818 6.451389 
1 1 1    7    4   -1 o  532.026   3.6942 11538.44  160.210 11524.92  226.439 11552.00  226.703  531.667   5.2249  532.292   5.2248 -0.6243286 7.389049 
1 1 1    7    4    0 o  421.004   3.2800  7225.00  112.564  7296.80  179.500  7178.47  144.509  423.046   5.2052  419.627   4.2247 3.419434 6.703924 
1 1 1    7    4    1 o  414.119   3.2320  6990.60  109.103  7017.97  173.021  6972.53  140.572  414.887   5.1160  413.565   4.1698 1.322144 6.600113 
1 1 1    7    4    2 o  568.465   4.2993 13173.98  199.221 13066.68  312.888 13247.13  258.360  566.046   6.7811  569.996   5.5605 -3.950256 8.769442 
1 1 1    7    4    3 o  824.570   5.5844 27722.65  375.350 27717.91  530.822 27727.38  530.828  824.334   7.8997  824.475   7.8984 -0.1409912 11.17095 
1 1 1    7    4    4 o  415.041   2.9615  7021.62  100.194  7357.61  147.106  6730.88  136.841  424.830   4.2480  406.336   4.1314 18.49387 5.925655 
1 1 1    7    4    5 o  495.328   3.4607 10001.34  139.732 10056.35  243.038  9974.18  170.780  496.611   6.0037  494.636   4.2356 1.975098 7.347465 
1 1 1    7    4    6 o  561.332   4.2491 12845.37  194.424 13219.98  315.044 12614.94  247.088  569.355   6.7882  556.232   5.4495 13.12244 8.704967 
1 1 1    7    4    7 o  332.105   3.0109  4495.82   81.509  4553.34  116.414  4440.50  114.162  334.203   4.2733  330.037   4.2435 4.166260 6.022274 
1 1 1    7    4    8 o  637.270   5.3485 16558.28  277.837 16695.78  395.728 16424.61  390.172  639.790   7.5879  634.576   7.5429 5.214050 10.69914 
1 1 1    7    4    9 o  462.820   3.2582  8731.52  122.922  8533.95  170.747  8944.08  177.103  457.523   4.5783  468.386   4.6386 -10.86307 6.517476 
1 1 1    7    4   10 o  149.481   1.5522  910.730   18.913  888.699   26.623  933.176   26.873  147.659   2.2119  151.309   2.1788 -3.649994 3.104776 
1 1 1    7    4   11 o  463.293   3.2623  8749.42  123.202  8689.43  173.306  8810.71  175.176  461.670   4.6052  464.880   4.6227 -3.209961 6.525122 
1 1 1    7    4   12 o  579.797   4.0012 13704.11  189.103 13646.56  266.584 13762.39  268.288  578.517   5.6530  580.966   5.6652 -2.449402 8.003201 
1 1 1    7    4   13 o  134.587   1.5231  738.286   16.710  766.222   24.102  712.429   23.188  137.107   2.1565  132.207   2.1516 4.900467 3.046326 
1 1 1    7    4   14 o  409.766   2.9303  6844.29   97.878  6835.98  138.340  6852.62  138.501  409.493   4.1444  409.991   4.1442 -0.4980469 5.860953 
1 1 1    7    4   15 o  546.993   3.7913 12197.06  169.046 12163.85  238.595 12230.53  239.544  546.194   5.3589  547.689   5.3656 -1.494690 7.583357 
1 1 1    7    4   16 o  226.363   1.8844  2088.52   34.770  2099.09   49.435  2078.17   48.914  226.930   2.6725  225.796   2.6575 1.133530 3.768891 
1 1 1    7    4   17 o  265.491   2.2945  2873.02   49.656  2905.25   64.616  2826.54   77.603  266.970   2.9692  263.321   3.6154 3.649109 4.678409 
1 1 1    7    4   18 o  179.661   1.8566  1315.64   27.190  1332.31   35.371  1291.55   42.511  180.794   2.4001  178.002   2.9298 2.791275 3.787367 
1 1 1    7    4   19 o  310.622   2.5779  3932.89   65.272  3997.62   85.257  3841.22  101.461  313.158   3.3399  306.959   4.0549 6.198608 5.253298 
1 1 1    7    4   20 o  100.789   1.7969  414.051   14.763  436.772   19.436  383.059   22.699  103.516   2.3033   96.898   2.8770 6.618492 3.685451 
1 1 1    7    4   21 o  441.229   3.1371  7935.91  112.832  8291.21  165.342  7626.24  154.360  450.963   4.4979  432.505   4.3783 18.45868 6.276982 
1 1 1    7    4   22 o  242.503   2.1954  2397.02   43.397  2475.04   57.232  2291.48   66.566  246.412   2.8493  237.092   3.4443 9.320435 4.470091 
1 1 1    7    4   23 o  1027.47   6.9223 43058.63  579.771 43177.27  822.312 42941.36  817.549  1028.51   9.8083  1025.70   9.7782 2.809082 13.84977 
1 1 1    7    4   24 o  627.916   4.3173 16074.40  220.978 16086.71  312.939 16062.16  312.083  628.065   6.1125  627.586   6.1004 0.4787598 8.635861 
1 1 1    7    4   25 o  358.603   2.6390  5241.81   77.142  5338.50  110.835  5150.98  107.434  361.874   3.7574  355.463   3.7078 6.411316 5.278749 
1 1 1    7    4   26 o  231.038   2.3770  2175.78   44.766  2213.20   64.855  2141.73   61.868  233.005   3.4146  229.214   3.3112 3.791458 4.756468 
1 1 1    7    4   27 o  670.387   5.6174 18326.77  306.971 18512.38  438.323 18148.11  430.042  673.593   7.9829  666.939   7.9102 6.653564 11.23824 
1 1 1    7    4   28 o  247.024   3.4498  2487.55   69.466   0.0000   0.0000  2487.55   69.466  ?   ?   247.024   3.4498 0.000000 3.449839 
1 1 1    7    4   29 o  569.976   5.5772 13248.20  259.125 13802.00  465.882 13000.14  311.805  581.430   9.8297  564.540   6.7757 16.89001 11.93874 
1 1 1    7    4   30 o  276.865   3.0532  3124.76   68.906  3228.27  123.845  3078.34   82.927  281.363   5.3998  274.790   3.7022 6.572357 6.547042 
1 1 1    7    4   31 o  519.881   3.9724 11019.02  168.344 10918.38  264.674 11087.40  218.159  517.386   6.2757  521.440   5.1325 -4.053101 8.107226 
1 1 1    7    4   32 f  150.916   1.7524  928.328   21.558  929.243   34.803  927.758   27.460  150.983   2.8278  150.867   2.2329 0.1161652 3.603103 
1 1 1    7    4   33 o   66.140   1.9446  178.459   10.473  170.950   17.535  182.622   13.057   64.670   3.3377   66.891   2.3985 -2.220940 4.110126 
1 1 1    7    4   34 o  233.254   2.1100  2217.71   40.118  2335.52   66.089  2148.97   50.484  239.351   3.3873  229.604   2.6974 9.747437 4.330107 
1 1 1    7    4   35 o  114.289   1.6818  532.411   15.668  548.089   25.757  523.201   19.741  115.954   2.7250  113.295   2.1376 2.659592 3.463372 
1 1 1    7    4   36 o  415.552   3.2560  7039.90  110.293  7067.97  175.322  7021.52  141.887  416.299   5.1665  414.974   4.1945 1.325195 6.654808 
1 1 1    7    4   37 o  636.981   4.7902 16546.83  248.724 16709.63  396.886 16441.54  319.176  639.821   7.6098  634.829   6.1679 4.991882 9.795494 
1 1 1    7    4   38 o  290.571   2.4502  3441.76   58.036  3482.86   92.990  3415.54   74.278  292.263   3.9032  289.446   3.1481 2.816956 5.014594 
1 1 1    7    4   39 o  603.343   4.5531 14845.61  223.926 14713.74  351.721 14935.50  290.381  600.385   7.1867  605.043   5.8877 -4.657837 9.290546 
1 1 1    7    4   40 o  328.868   2.6895  4409.09   72.100  4357.58  113.475  4443.97   93.370  326.885   4.2586  330.141   3.4695 -3.255920 5.493029 
1 1 1    7    4   41 o  400.516   2.8904  6539.85   94.365  6472.59  133.064  6607.90  133.844  398.394   4.0974  402.538   4.0790 -4.143616 5.781644 
1 1 1    7    4   42 o  109.857   1.5700  491.926   14.059  495.561   21.182  489.063   18.797  110.256   2.3568  109.533   2.1053 0.7230377 3.160202 
1 1 1    7    4   43 o  233.405   1.9465  2220.70   37.034  2245.26   53.665  2198.37   51.172  234.673   2.8054  232.213   2.7034 2.460800 3.895969 
1 1 1    7    4   44 o  118.034   1.5657  567.886   15.064  569.234   22.597  566.808   20.209  118.166   2.3460  117.917   2.1025 0.2493668 3.150300 
1 1 1    7    4   45 o  268.500   2.1295  2938.89   46.608  2900.70   66.228  2976.35   65.602  266.722   3.0461  270.180   2.9787 -3.458069 4.260484 
1 1 1    7    4   46 o  167.334   1.6723  1141.39   22.811  1113.88   32.951  1166.71   31.611  165.292   2.4456  169.171   2.2923 -3.877945 3.351928 
1 1 1    7    4   47 o  258.289   2.0714  2719.65   43.613  2691.66   62.067  2746.96   61.296  256.926   2.9636  259.555   2.8971 -2.628296 4.144401 
1 1 1    7    4   48 o  373.952   2.9874  5702.33   91.064  5891.92  148.715  5588.60  115.185  379.969   4.8014  370.146   3.8176 9.822754 6.134135 
1 1 1    7    4   49 o  323.636   2.6618  4270.74   70.221  4327.90  113.214  4235.00   89.521  325.686   4.2645  322.235   3.4081 3.451019 5.459019 
1 1 1    7    4   50 o  121.422   1.6746  601.008   16.575  622.667   28.236  589.621   20.473  123.570   2.8032  120.260   2.0885 3.310112 3.495685 
1 1 1    7    4   51 o  325.829   2.6686  4329.14   70.876  4340.01   92.260  4313.49  110.713  326.182   3.4699  325.123   4.1775 1.059326 5.430617 
1 1 1    7    4   52 o  354.322   2.8580  5119.99   82.546  5183.35  108.270  5032.05  127.563  356.431   3.7265  351.113   4.4570 5.318878 5.809604 
1 1 1    7    4   53 o  105.574   1.5261  454.363   13.134  420.612   16.573  511.336   21.533  101.571   2.0017  111.983   2.3589 -10.41273 3.093781 
1 1 1    7    4   54 o  192.787   1.7450  1515.21   27.422  1499.98   33.956  1543.78   46.499  191.802   2.1718  194.549   2.9321 -2.747589 3.648847 
1 1 1    7    4   55 o  260.814   2.0775  2773.55   44.168  2750.07   54.258  2819.67   76.044  259.681   2.5633  262.875   3.5488 -3.194183 4.377679 
1 1 1    7    4   56 o  125.414   1.4171  641.183   14.487  654.963   19.863  625.521   21.177  126.744   1.9225  123.859   2.0975 2.885605 2.845263 
1 1 1    7    4   57 o  184.917   1.4670  1393.96   22.113  1396.29   32.179  1391.88   30.440  185.049   2.1333  184.761   2.0211 0.2883148 2.938683 
1 1 1    7    4   58 o  210.413   1.8255  1805.09   31.311  1817.22   39.085  1783.36   52.313  211.099   2.2714  209.077   3.0695 2.022064 3.818531 
1 1 1    7    4   59 o  183.743   1.7226  1376.46   25.800  1391.44   37.695  1363.26   35.388  184.708   2.5036  182.834   2.3744 1.874191 3.450517 
1 1 1    7    4   60 o  226.924   1.8919  2099.60   34.996  2132.98   51.454  2070.87   47.737  228.671   2.7604  225.327   2.5990 3.343445 3.791399 
1 1 1    7    4   61 o   93.164   1.8341  353.888   13.929  342.237   17.768  372.462   22.435   91.574   2.3823   95.507   2.8850 -3.932640 3.741451 
1 1 1    7    4   62 o  258.862   2.3108  2732.84   48.760  2749.43   63.223  2708.49   76.601  259.591   2.9878  257.585   3.6482 2.005981 4.715535 
1 1 1    7    4   63 o  298.094   2.5404  3624.54   61.728  3621.90   79.600  3628.52   97.769  297.908   3.2779  298.082   4.0237 -0.1742249 5.189883 
1 1 1    7    4   64 o  171.657   1.8914  1201.49   26.465  1187.68   33.995  1222.75   42.164  170.641   2.4440  173.111   2.9880 -2.469376 3.860230 
1 1 1    7    4   65 o   62.080   2.1257  157.349   10.741  148.136   13.837  171.321   17.039   60.191   2.8280   64.710   3.2406 -4.519127 4.301060 
1 1 1    7    4   66 o  120.666   1.7952  593.691   17.658  626.655   27.653  570.996   22.945  123.935   2.7372  118.318   2.3790 5.617393 3.626582 
1 1 1    7    4   67 o  186.322   1.9651  1415.68   29.846  1445.36   38.602  1371.57   47.062  188.234   2.5158  183.320   3.1494 4.913376 4.030859 
1 1 1    7    4   68 f  140.206   1.8314  801.577   20.931  800.348   26.631  803.564   33.851  140.078   2.3323  140.326   2.9594 -0.2481995 3.767993 
1 1 1    7    4   69 o  104.791   1.8595  447.793   15.884  464.223   20.090  420.400   25.941  106.682   2.3102  101.440   3.1410 5.242233 3.899071 
1 1 1    7    4   70 o   85.416   1.7715  297.502   12.334  309.641   17.257  284.823   17.636   87.089   2.4333   83.513   2.5938 3.575760 3.556518 
1 1 1    7    4   71 f  146.471   1.6956  874.798   20.245  880.467   28.517  869.038   28.745  146.912   2.3813  145.954   2.4161 0.9585876 3.392381 
1 1 1    7    4   72 o  159.008   1.9300  1031.13   25.015  1014.53   39.663  1042.09   32.235  157.648   3.0865  159.819   2.4743 -2.171249 3.955859 
1 1 1    7    4   73 o  125.093   1.7341  638.116   17.683  646.631   24.923  629.486   25.091  125.893   2.4287  124.210   2.4782 1.682831 3.469825 
1 1 1    7    4   74 o   61.703   2.3281  155.546   11.689  164.551   16.193  145.750   16.890   63.406   3.1428   59.634   3.4899 3.772709 4.696412 
1 1 1    7    4   75 o   47.944   2.7131   94.110   10.560   75.372   14.335  116.343   15.615   42.735   4.1681   53.242   3.6194 -10.50726 5.520207 
1 1 1    7    4   76 o   87.169   1.6925  309.861   12.026  292.973   15.408  336.187   19.237   84.713   2.2332   90.724   2.6039 -6.011383 3.430355 
1 1 1    7    4   77 o   86.671   1.7654  306.359   12.472  302.978   15.155  313.455   21.954   86.150   2.1598   87.557   3.0808 -1.406494 3.762439 
1 1 1    7    4   78 o  172.076   1.6268  1207.54   22.818  1218.34   30.063  1192.86   35.046  172.807   2.1342  170.956   2.5149 1.850296 3.298419 
1 1 1    7    4   79 o   66.371   1.8435  179.829   9.9642  184.660   12.949  172.814   15.602   67.224   2.3668   64.981   2.9532 2.242821 3.784578 
1 1 1    7    4   80 o  221.000   1.7985  1992.27   32.400  2002.83   42.749  1978.02   49.665  221.518   2.3674  220.084   2.7684 1.434204 3.642624 
1 1 1    7    4   81 o   87.721   1.8182  313.910   13.001  307.171   18.160  320.997   18.622   86.698   2.5725   88.629   2.5804 -1.930679 3.643620 
1 1 1    7    4   82 o   87.101   1.6517  309.450   11.727  298.191   15.027  326.988   18.756   85.451   2.1591   89.448   2.5750 -3.997238 3.360426 
1 1 1    7    4   83 f  113.719   1.7119  527.560   15.869  503.780   22.107  552.836   22.792  111.075   2.4417  116.360   2.4029 -5.285812 3.425773 
1 1 1    7    4   84 o  103.389   1.5802  436.033   13.317  447.878   17.409  419.322   20.677  104.755   2.0387  101.325   2.5034 3.430046 3.228547 
1 1 1    7    4   85 o   43.860   2.3911   78.796   8.5165   64.457   10.898  101.289   13.650   39.541   3.4145   49.637   3.3939 -10.09518 4.814326 
1 1 1    7    4   86 f   76.654   1.8256  239.779   11.407  252.285   15.801  226.167   16.485   78.548   2.4709   74.340   2.7249 4.208130 3.678364 
1 1 1    7    4   87 o  120.307   1.6743  590.577   16.419  620.182   23.095  560.321   23.348  123.225   2.2992  117.110   2.4457 6.114159 3.356810 
1 1 1    7    4   88 o   45.697   2.4870   85.587   9.2291   90.435   12.645   80.060   13.500   46.876   3.3311   44.023   3.7992 2.853142 5.052708 
1 1 1    7    4   89 o   83.019   1.6770  281.273   11.348  285.972   14.954  274.892   17.427   83.642   2.1952   81.954   2.6120 1.687729 3.411908 
1 1 1    7    4   90 o  104.604   1.6115  446.550   13.741  473.924   18.374  411.812   20.698  107.714   2.0927  100.324   2.5330 7.389290 3.285635 
1 1 1    7    4   91 o   46.603   2.4928   89.072   9.4352   84.509   12.319   95.548   14.674   45.272   3.3623   48.085   3.7741 -2.813019 5.054574 
1 1 1    7    4   92 o  150.373   1.9064  923.646   23.367  902.610   29.738  957.597   37.780  148.543   2.4560  152.855   3.0321 -4.311417 3.901995 
1 1 1    7    4   93 o  102.530   1.8672  429.450   15.605  418.194   19.822  447.800   25.310  101.101   2.4052  104.471   2.9751 -3.370216 3.825708 
1 1 1    7    4   94 o   81.456   1.9357  271.161   12.853  255.035   16.244  298.157   21.018   78.882   2.5296   85.196   3.0313 -6.313614 3.948119 
1 1 1    7    4   95 o   26.653   4.0636   29.974   8.5498   30.510   10.882   29.109   13.820   26.643   5.1974   25.801   6.5580 0.8420448 8.367845 
1 1 1    7    4   96 o   89.804   1.5978  329.434   11.696  323.770   15.277  337.458   18.182   88.955   2.1068   90.719   2.4610 -1.764015 3.239583 
1 1 1    7    4   97 o   85.628   1.6150  299.597   11.273  310.664   14.864  284.615   17.295   87.121   2.0930   83.265   2.5512 3.856125 3.299904 
1 1 1    7    4   98 o   53.619   1.9907  117.833   8.6855  122.435   11.395  111.452   13.418   54.557   2.5695   51.917   3.1859 2.640114 4.092910 
1 1 1    7    4   99 o   20.036   4.4879   17.383   7.1475   15.537   9.2053   20.187   11.342   18.989   5.5795   21.496   6.1576 -2.506636 8.309431 
1 1 1    7    4  100 o   77.512   1.6554  245.738   10.460  242.150   13.625  250.885   16.321   76.815   2.1783   78.086   2.5677 -1.270660 3.367164 
1 1 1    7    4  101 o   43.910   2.2494   79.348   8.0243   81.100   10.458   76.839   12.512   44.249   2.9156   42.882   3.6132 1.367462 4.642822 
1 1 1    7    4  102 o   94.625   1.8786  366.932   14.491  352.291   18.321  391.396   23.682   92.517   2.4314   97.280   2.9900 -4.762527 3.853805 
1 1 1    7    4  103 o   53.361   2.1764  117.164   9.4469  116.174   11.350  119.396   17.043   53.018   2.6346   53.296   3.9510 -0.2782516 4.748816 
1 1 1    7    4  104 o   35.261   2.9626   51.815   8.4366   54.474   10.022   45.348   15.628   36.021   3.4556   31.803   6.2515 4.218500 7.142989 
1 1 1    7    4  105 o   40.838   2.4194   68.971   8.0178   65.137   10.489   74.360   12.436   39.438   3.2928   42.025   3.6668 -2.587025 4.928270 
1 1 1    7    4  106 f   74.368   1.7002  226.762   10.307  228.873   13.660  223.973   15.704   74.513   2.2516   73.562   2.6231 0.9505997 3.456909 
1 1 1    7    4  107 o   67.354   1.9476  186.599   10.682  173.544   14.967  200.151   15.250   64.618   2.8486   69.471   2.6980 -4.853676 3.923447 
1 1 1    7    4  108 o   23.216   3.9645   23.339   7.2336   20.578   9.5762   27.007   11.039   21.336   5.4782   24.406   5.6589 -3.069613 7.876193 
1 1 1    7    4  109 o   48.338   2.3847   96.782   9.3673   93.379   11.585  103.208   15.921   47.250   3.0237   49.223   4.0023 -1.973473 5.016125 
1 1 1    7    4  110 o  112.219   1.9019  518.041   17.398  519.685   22.584  515.642   27.285  112.041   2.4728  111.150   3.0143 0.8917465 3.898808 
1 1 1    7    4  111 o   55.625   2.6351  128.781   11.914  126.463   14.173  134.367   21.997   54.861   3.1830   55.433   4.9192 -0.5714417 5.859159 
1 1 1    7    4  112 o   11.101   4.8940  -1.3512   8.6338   3.0040   11.700  -6.5590   12.794   14.094   5.9472   12.271   5.6300 1.823806 8.189354 
1 1 1    7    4  113 o   30.061   3.5605   38.773   8.5557   38.360   10.617   39.538   14.450   29.441   4.5722   28.941   6.3039 0.4994621 7.787430 
1 1 1    7    4  114 o   81.862   1.8725  276.426   12.495  289.496   15.552  252.628   20.986   83.501   2.2870   77.195   3.3430 6.306160 4.050408 
1 1 1    7    4  115 o   29.419   3.6995   37.551   8.6760   32.586   10.799   46.587   14.570   26.642   5.1591   31.491   5.8925 -4.848747 7.831866 
1 1 1    7    4  116 o   15.198   5.3285   9.9219   8.1580   18.638   10.182  -5.7036   13.633   19.743   5.8853   12.624   5.7993 7.119194 8.262465 
1 1 1    7    4  117 o   21.201   4.8944   20.893   8.2870   20.231   10.267   22.131   14.038   20.443   5.8594   20.981   6.9995 -0.5387897 9.128319 
1 1 1    7    4  118 o   16.812   5.6147   13.138   9.0322  -3.4610   11.584   38.878   14.425   11.966   5.4391   27.876   6.4727 -15.91079 8.454515 
1 1 1    7    4  119 o   31.981   3.8348   45.254   9.7980   31.826   12.479   66.838   15.821   25.241   6.1276   37.712   5.2921 -12.47074 8.096470 
1 1 1    7    4  120 o   41.762   2.6087   73.955   8.8362   80.601   11.640   64.917   13.574   43.082   3.3407   37.714   4.5043 5.367489 5.607956 
1 1 1    7    4  121 o   34.586   3.3158   52.170   9.2339   53.865   11.289   48.744   16.051   34.585   4.0831   30.651   6.6181 3.933514 7.776325 
1 1 1    7    4  122 o   34.133   3.3858   51.065   9.2964   54.324   11.223   43.940   16.593   34.717   4.0414   28.348   7.1752 6.368402 8.235090 
1 1 1    7    4  123 o   31.249   3.7290   43.573   9.3114   36.665   11.109   59.891   17.074   27.623   5.1221   34.162   6.3653 -6.539021 8.170301 
1 1 1    7    4  124 o   29.938   4.5069   41.711   10.658   43.083   13.563   39.498   17.231   29.202   5.9010   26.041   7.6288 3.161167 9.644724 
1 1 1    7    4  125 o   22.573   5.6912   25.918   10.468   18.513   13.304   37.954   16.961   18.641   6.7742   25.411   7.6008 -6.769854 10.18145 
1 1 1    7    4  126 o   12.437   5.3902   2.4948   10.089   13.182   12.821 -14.8908   16.352   16.630   6.5101   11.806   5.6923 4.824545 8.647754 
1 1 1    7    4  127 o   34.273   4.5102   54.973   12.295   45.181   14.047   87.049   25.424   29.592   6.0282   37.698   8.4793 -8.106531 10.40377 
1 1 1    7    4  128 o   15.985   6.1558   12.176   11.319   5.0954   13.144   32.504   22.270   14.162   6.1448   21.940   8.5827 -7.778651 10.55561 
1 1 1    7    4  129 o   16.023   5.9027   12.651   10.154   11.645   13.037   14.203   16.189   15.981   6.4620   17.120   7.0925 -1.138856 9.594825 
1 1 1    7    4  130 o   16.426   5.9536   13.689   10.267   17.929   13.191   7.1715   16.354   18.098   6.7168   15.354   6.7536 2.743996 9.525045 
1 1 1    7    4  131 o   21.430   6.2899   25.180   11.704   17.634   13.313   50.862   24.561   17.955   6.7312   26.029   9.2351 -8.073938 11.42788 
1 1 1    7    4  132 o   21.549   6.3047   25.444   11.775   40.127   13.688 -16.3660   23.098   27.365   6.2709   13.626   6.6165 13.73902 9.115981 
1 1 1    7    5 -131 o   11.086   5.3548 -13.9945   14.632 -13.9945   14.632   0.0000   0.0000   11.086   5.3548  ?   ?  0.000000 5.354830 
1 1 1    7    5 -130 o   19.179   6.2814   20.168   11.321   25.482   13.085   4.3463   22.579   21.098   6.7402   15.988   7.3875 5.109600 10.00027 
1 1 1    7    5 -129 o   11.472   5.2283  -1.8097   10.791  -8.2023   12.496   16.944   21.403   10.997   5.2117   18.016   7.8292 -7.019196 9.405207 
1 1 1    7    5 -128 o   19.961   6.3495   21.891   11.622   26.519   13.132   5.1644   24.964   21.609   6.7327   16.574   7.6962 5.034637 10.22550 
1 1 1    7    5 -127 o   37.585   3.5434   63.063   10.728   61.727   11.651   70.505   27.493   36.809   3.9446   30.766   9.7635 6.042179 10.53026 
1 1 1    7    5 -126 o   10.397   4.7459  -2.6678   8.9369 -11.0191   10.600   17.857   16.618   9.6450   4.6331   18.241   7.3240 -8.596286 8.666402 
1 1 1    7    5 -125 f   33.642   3.6422   50.663   9.8291   48.205   11.775   56.310   17.850   31.947   4.6587   31.911   7.0504 0.3629494E-01 8.450583 
1 1 1    7    5 -124 f   13.535   5.4273   6.7760   9.1130   3.9377   10.925   13.269   16.523   13.199   5.6635   17.134   7.1376 -3.935808 9.111598 
1 1 1    7    5 -123 o   11.827   5.1009   2.0833   8.9485  -7.0361   10.518   25.977   17.026   10.370   4.8738   21.022   7.6598 -10.65157 9.078895 
1 1 1    7    5 -122 o   11.352   4.9929   0.4636   8.9363  -0.5778   10.613   3.0016   16.567   11.894   5.3236   14.889   6.6587 -2.995180 8.525171 
1 1 1    7    5 -121 o   32.823   3.6624   47.877   9.6322   48.773   11.665   45.958   17.077   32.452   4.5332   28.831   7.2692 3.620325 8.566883 
1 1 1    7    5 -120 o   10.637   4.7881  -1.7889   8.7196   2.8084   10.529 -11.8257   15.557   12.856   5.5388   12.054   5.7419 0.8017883 7.977997 
1 1 1    7    5 -119 o   22.726   5.5092   25.427   10.099   17.007   12.765   39.513   16.510   18.389   6.6421   26.756   7.3469 -8.367783 9.904215 
1 1 1    7    5 -118 o   10.981   4.8544  -0.4948   8.5513   5.1393   10.431 -12.0394   14.932   13.665   5.6800   11.866   5.6446 1.798766 8.007774 
1 1 1    7    5 -117 o   17.484   5.6352   14.602   9.1316   12.727   11.285   18.156   15.540   16.807   6.2175   19.258   7.2612 -2.450476 9.559365 
1 1 1    7    5 -116 o   34.046   3.6833   50.642   10.059   54.121   12.685   44.747   16.513   34.578   4.6155   29.570   6.9664 5.008097 8.356637 
1 1 1    7    5 -115 o   39.383   3.5050   66.981   11.134   82.720   15.166   48.577   16.399   43.149   4.3722   31.316   6.6311 11.83321 7.942724 
1 1 1    7    5 -114 o   18.886   5.9682   16.869   10.282   0.5376   14.513   33.333   14.571   14.371   6.3399   25.821   6.8218 -11.44995 9.312971 
1 1 1    7    5 -113 o   29.539   4.0557   38.261   9.5079   18.586   15.204   50.896   12.184   20.015   7.2464   33.860   4.5278 -13.84468 8.544646 
1 1 1    7    5 -112 o   39.355   2.7941   65.092   8.9055   68.339   12.965   62.191   12.253   39.681   4.0657   37.857   4.0328 1.824020 5.726532 
1 1 1    7    5 -111 o   12.650   4.9456   4.8690   7.3913   5.5434   10.026   4.0661   10.940   14.136   5.6841   14.027   5.8225 0.1088657 8.136989 
1 1 1    7    5 -110 o   24.269   3.9770   25.660   7.5955   26.945   10.086   23.977   11.545   24.368   5.2336   22.650   6.1124 1.718229 8.046888 
1 1 1    7    5 -109 o   29.303   3.2901   36.435   7.7232   34.255   10.142   39.444   11.915   27.884   4.6242   29.741   5.0982 -1.857300 6.882929 
1 1 1    7    5 -108 o   19.191   5.1487   16.585   8.2207  -2.7266   11.814   34.711   11.446   12.673   5.6483   27.851   5.2338 -15.17792 7.700379 
1 1 1    7    5 -107 o   14.566   5.2094   8.2210   7.8301   8.5640   11.191   7.8921   10.960   15.904   6.1216   15.564   6.0401 0.3395147 8.599834 
1 1 1    7    5 -106 o   31.734   3.3081   42.511   8.4319   48.860   12.009   36.336   11.842   33.584   4.4998   28.566   5.2801 5.017761 6.937379 
1 1 1    7    5 -105 o   48.960   2.3468   99.102   9.3389   98.187   13.421   99.961   13.003   48.348   3.4277   48.844   3.2850 -0.4953651 4.747643 
1 1 1    7    5 -104 o   10.447   4.6396  -2.2162   7.8986   3.1291   11.265  -7.3856   11.078   14.139   5.8919   11.261   5.1930 2.878000 7.853814 
1 1 1    7    5 -103 o   32.985   3.5101   45.867   9.2930   38.743   15.127   50.185   11.778   29.161   6.5267   34.242   4.3152 -5.080879 7.824271 
1 1 1    7    5 -102 o   43.354   2.3186   77.560   8.1642   86.529   11.005   66.580   12.176   45.624   2.9753   39.738   3.8053 5.885712 4.830394 
1 1 1    7    5 -101 o   43.050   2.4718   76.553   8.6374   78.960   12.330   74.233   12.103   43.435   3.5125   42.091   3.5610 1.343845 5.001816 
1 1 1    7    5 -100 o   35.384   2.6672   51.875   7.6366   45.935   10.302   59.119   11.377   32.970   3.9095   37.498   3.7733 -4.528011 5.433414 
1 1 1    7    5  -99 o   38.402   2.6765   61.001   8.3259   61.583   10.471   60.001   13.730   38.421   3.3777   37.563   4.5784 0.8578186 5.689520 
1 1 1    7    5  -98 f   59.613   1.9821  145.734   9.6183  144.053   12.015  148.733   16.048   59.161   2.4971   59.902   3.2994 -0.7404327 4.137841 
1 1 1    7    5  -97 o   23.428   4.1306   23.455   7.6001   32.360   9.5416   7.9991   12.570   27.546   4.3972   16.622   6.4636 10.92358 7.817529 
1 1 1    7    5  -96 o   14.549   5.1115   7.9176   7.5097   9.3568   9.4839   5.4982   12.296   15.994   5.7318   15.679   6.2984 0.3148537 8.516024 
1 1 1    7    5  -95 o  120.532   1.6457  593.691   16.169  598.685   20.201  584.786   26.974  120.950   2.0489  119.335   2.7730 1.614983 3.447817 
1 1 1    7    5  -94 o   97.557   1.6747  388.867   13.318  378.549   16.600  407.504   22.309   96.182   2.1173   99.620   2.7499 -3.437820 3.470571 
1 1 1    7    5  -93 o   24.543   4.0900   25.521   7.8948   29.380   10.003   19.145   12.857   26.203   4.8619   21.323   6.6647 4.880714 8.249622 
1 1 1    7    5  -92 o   47.133   2.2302   91.075   8.5443   78.825   11.494  106.206   12.774   43.691   3.2505   50.776   3.1011 -7.085304 4.492540 
1 1 1    7    5  -91 o   48.079   2.2564   94.744   8.8185   99.214   11.874   89.246   13.169   49.102   2.9806   46.474   3.5020 2.628654 4.598697 
1 1 1    7    5  -90 o   7.9920   3.8839 -13.8608   8.0026 -28.3852   10.929   2.9311   11.751   8.1695   4.0736   14.701   6.0619 -6.531223 7.303468 
1 1 1    7    5  -89 o   59.772   2.0913  146.152   10.174  141.511   13.816  151.651   15.038   58.715   2.8956   60.764   3.0457 -2.049778 4.202479 
1 1 1    7    5  -88 o  124.445   1.5826  632.013   16.055  618.973   21.402  648.794   24.278  123.090   2.1330  125.986   2.3641 -2.896484 3.184097 
1 1 1    7    5  -87 o   59.480   1.9953  144.631   9.6604  149.405   13.144  139.022   14.246   60.383   2.6770   58.200   3.0132 2.182777 4.030592 
1 1 1    7    5  -86 o  156.674   1.7373  1001.80   22.187  996.061   31.702  1007.31   31.064  156.115   2.4912  157.005   2.4272 -0.8898468 3.478096 
1 1 1    7    5  -85 o   34.617   2.9460   49.365   8.2341   59.002   11.023   37.202   12.385   37.775   3.6243   29.603   5.3283 8.172316 6.444094 
1 1 1    7    5  -84 o   24.398   4.1701   25.097   7.9960   29.150   10.744   20.066   11.971   26.156   5.2223   21.804   6.3505 4.351315 8.222006 
1 1 1    7    5  -83 o   86.534   1.7846  305.548   12.588  290.541   17.673  321.001   17.934   84.291   2.5752   88.613   2.4853 -4.321976 3.578832 
1 1 1    7    5  -82 o   47.967   2.4807   94.225   9.6669   93.509   13.653   94.945   13.689   47.667   3.5390   48.036   3.5205 -0.3689842 4.991830 
1 1 1    7    5  -81 o  111.405   1.6909  506.311   15.355  517.435   21.966  495.681   21.473  112.570   2.3939  110.179   2.3909 2.391411 3.383345 
1 1 1    7    5  -80 o   73.830   1.7903  222.376   10.775  220.626   14.290  224.682   16.402   73.473   2.3892   74.116   2.7195 -0.6430588 3.619950 
1 1 1    7    5  -79 o   66.425   1.8827  180.155   10.184  178.885   13.463  181.855   15.570   66.145   2.5015   66.659   2.8722 -0.5143967 3.808803 
1 1 1    7    5  -78 o  163.375   1.6090  1088.61   21.428  1086.64   28.280  1091.27   32.835  163.185   2.1260  163.499   2.4637 -0.3142700 3.254179 
1 1 1    7    5  -77 o  136.195   1.6815  756.546   18.667  781.053   26.442  732.195   26.358  138.337   2.3449  133.935   2.4142 4.402252 3.365544 
1 1 1    7    5  -76 o  169.248   1.7540  1168.33   24.199  1147.73   33.659  1190.38   34.815  167.691   2.4624  170.774   2.5009 -3.083603 3.509703 
1 1 1    7    5  -75 o   71.530   2.1691  208.941   12.633  191.332   19.053  222.756   16.876   68.343   3.4311   73.812   2.8099 -5.469040 4.434834 
1 1 1    7    5  -74 o  180.059   1.9995  1322.49   29.348  1331.67   46.067  1316.21   38.073  180.577   3.1296  179.581   2.6009 0.9959564 4.069318 
1 1 1    7    5  -73 o   36.277   3.6032   54.297   10.514   57.607   14.724   50.852   15.020   37.181   4.9833   34.810   5.4739 2.371243 7.402461 
1 1 1    7    5  -72 o  128.719   1.8510  675.714   19.422  681.414   27.390  669.950   27.543  129.222   2.6003  128.128   2.6372 1.093887 3.703519 
1 1 1    7    5  -71 o  199.939   1.7873  1630.23   29.129  1629.89   38.427  1630.70   44.664  199.875   2.3585  199.889   2.7411 -0.1431274E-01 3.616138 
1 1 1    7    5  -70 o  105.860   1.7870  456.990   15.420  459.030   18.837  452.846   26.849  106.081   2.1784  105.272   3.1323 0.8094482 3.815313 
1 1 1    7    5  -69 o  223.213   1.9671  2032.00   35.791  2051.77   44.028  1993.47   61.459  224.261   2.4084  220.945   3.4125 3.315536 4.176770 
1 1 1    7    5  -68 o   80.959   1.8106  267.274   11.949  260.690   14.477  281.342   21.162   79.914   2.2246   82.960   3.1349 -3.046341 3.844038 
1 1 1    7    5  -67 o  244.733   2.2362  2443.00   44.610  2441.01   57.428  2446.02   70.839  244.572   2.8806  244.743   3.5508 -0.1705170 4.572295 
1 1 1    7    5  -66 o  157.466   1.6986  1011.03   21.803  1003.52   26.530  1026.66   38.271  156.864   2.0748  158.611   2.9600 -1.746597 3.614782 
1 1 1    7    5  -65 o   19.995   4.9757   16.998   8.0773   12.949   9.7881   25.641   14.301   18.061   5.8353   24.646   6.8649 -6.584719 9.009884 
1 1 1    7    5  -64 o  298.852   2.5452  3643.41   62.003  3643.28   69.328  3643.91  138.593  298.814   2.8462  298.339   5.6990 0.4749756 6.370188 
1 1 1    7    5  -63 o  111.663   1.7951  508.410   16.340  493.287   18.122  574.169   37.787  109.983   2.0213  118.504   3.9171 -8.520798 4.407901 
1 1 1    7    5  -62 o  160.698   1.8515  1052.98   24.254  1047.39   27.061  1075.83   54.686  160.262   2.0714  162.237   4.1385 -1.974869 4.627983 
1 1 1    7    5  -61 o  115.025   1.9813  539.514   18.577  539.514   18.577   0.0000   0.0000  115.025   1.9813  ?   ?  0.000000 1.981270 
1 1 1    7    5  -60 o   95.938   1.6780  375.265   13.123  378.748   15.957  367.986   23.066   96.375   2.0312   94.921   2.9848 1.453720 3.610372 
1 1 1    7    5  -59 o  302.526   2.3429  3732.65   57.778  3727.94   70.633  3742.17  100.444  302.286   2.8665  302.711   4.0706 -0.4252625 4.978622 
1 1 1    7    5  -58 o  358.571   2.6644  5244.60   77.879  5255.99   95.490  5221.97  134.584  358.887   3.2641  357.503   4.6183 1.383270 5.655326 
1 1 1    7    5  -57 o  140.821   1.6407  808.488   18.834  805.261   22.955  815.136   32.946  140.530   2.0039  141.356   2.8593 -0.8263397 3.491540 
1 1 1    7    5  -56 o   44.870   2.3864   82.338   8.6970   68.444   10.324  116.298   16.140   40.839   3.1250   53.246   3.7425 -12.40763 4.875645 
1 1 1    7    5  -55 o  258.453   2.1017  2723.77   44.279  2746.87   54.521  2679.04   75.890  259.516   2.5773  256.203   3.6338 3.312561 4.455004 
1 1 1    7    5  -54 o  152.791   1.8237  951.812   22.714  954.417   25.367  941.273   51.014  152.994   2.0340  151.781   4.1270 1.212631 4.601019 
1 1 1    7    5  -53 o  273.513   2.6690  3051.17   59.506  3051.17   59.506   0.0000   0.0000  273.513   2.6690  ?   ?  0.000000 2.668972 
1 1 1    7    5  -52 o  136.060   1.5637  754.685   17.343  760.553   22.142  745.372   27.895  136.578   1.9889  135.193   2.5313 1.385513 3.219126 
1 1 1    7    5  -51 o  103.817   1.5306  439.373   12.953  439.070   16.856  439.811   20.240  103.774   1.9927  103.853   2.3908 -0.7951355E-01 3.112376 
1 1 1    7    5  -50 o  253.517   2.0499  2620.44   42.362  2639.34   52.748  2586.11   71.097  254.405   2.5436  251.768   3.4643 2.637283 4.297802 
1 1 1    7    5  -49 o  505.230   3.5453 10414.03  146.007 10527.95  180.880 10200.98  247.355  507.854   4.3693  499.551   6.0744 8.302490 7.482618 
1 1 1    7    5  -48 o  109.877   1.6769  492.164   15.020  506.598   20.972  476.965   21.520  111.466   2.3082  108.154   2.4410 3.311806 3.359489 
1 1 1    7    5  -47 o  160.453   1.5170  1049.47   19.841  1033.22   26.758  1069.33   29.571  159.195   2.0620  161.949   2.2400 -2.754059 3.044606 
1 1 1    7    5  -46 o  268.128   2.1145  2931.01   46.215  2952.08   66.235  2911.02   64.514  269.049   3.0201  267.174   2.9623 1.874542 4.230360 
1 1 1    7    5  -45 o  270.575   1.8375  2984.49   40.527  2958.60   57.373  3010.27   57.255  269.370   2.6129  271.714   2.5850 -2.343292 3.675531 
1 1 1    7    5  -44 o  255.780   1.8876  2667.03   39.356  2632.06   60.102  2693.28   52.073  254.063   2.9021  257.017   2.4855 -2.953888 3.821009 
1 1 1    7    5  -43 o  219.569   1.7155  1965.24   30.705  1948.42   47.145  1977.63   40.463  218.604   2.6457  220.248   2.2538 -1.643921 3.475520 
1 1 1    7    5  -42 o  114.431   1.5175  533.759   14.155  518.889   26.307  539.819   16.793  112.773   2.8640  115.076   1.7902 -2.303185 3.377502 
1 1 1    7    5  -41 o  135.311   1.4511  746.308   16.005  761.898   26.162  736.983   20.234  136.707   2.3477  134.459   1.8461 2.247253 2.986613 
1 1 1    7    5  -40 o  292.079   2.0850  3477.67   49.640  3434.95   76.233  3509.12   65.408  290.241   3.2222  293.376   2.7351 -3.135468 4.226478 
1 1 1    7    5  -39 f   65.538   1.6204  175.079   8.6567  175.671   15.364  174.804   10.478   65.577   2.8812   65.455   1.9661 0.1224365 3.488131 
1 1 1    7    5  -38 o  389.619   2.4397  6188.51   77.485  6102.08  108.751  6277.62  110.429  386.845   3.4487  392.370   3.4526 -5.524536 4.880014 
1 1 1    7    5  -37 o  376.193   2.3706  5769.19   72.695  5734.03  102.702  5804.48  102.910  375.006   3.3597  377.304   3.3460 -2.297485 4.741704 
1 1 1    7    5  -36 o  424.730   2.6264  7354.17   90.930  7259.35  127.628  7451.92  129.582  421.934   3.7108  427.493   3.7186 -5.559204 5.253379 
1 1 1    7    5  -35 o  124.681   1.4463  633.628   14.699  665.919   24.273  614.927   18.472  127.812   2.3298  122.825   1.8450 4.986938 2.971842 
1 1 1    7    5  -34 o  293.624   1.9531  3514.31   46.747  3475.09   65.953  3553.91   66.268  291.964   2.7712  295.257   2.7534 -3.292908 3.906499 
1 1 1    7    5  -33 o  284.527   1.9100  3299.89   44.298  3281.64   62.759  3318.01   62.535  283.725   2.7136  285.293   2.6890 -1.568298 3.820258 
1 1 1    7    5  -32 o  515.903   3.1178 10850.64  131.116 10696.94  183.504 11010.96  187.409  512.170   4.3954  519.632   4.4244 -7.461609 6.236589 
1 1 1    7    5  -31 o  104.921   1.3504  448.693   11.549  439.711   16.732  456.868   15.962  103.863   1.9763  105.870   1.8496 -2.007614 2.706797 
1 1 1    7    5  -30 o  453.264   2.7781  8375.07  102.646  8324.52  144.782  8426.15  145.548  451.852   3.9308  454.602   3.9277 -2.750061 5.556810 
1 1 1    7    5  -29 o  497.666   3.0192 10096.53  122.481 10032.54  172.637 10161.38  173.797  496.035   4.2696  499.210   4.2709 -3.174744 6.039069 
1 1 1    7    5  -28 o  312.086   2.0460  3970.03   52.049  3908.89   73.246  4032.39   73.976  309.659   2.9018  314.513   2.8855 -4.854248 4.092222 
1 1 1    7    5  -27 o  343.680   2.2032  4814.59   61.724  4800.36   87.507  4828.69   87.075  343.154   3.1284  344.166   3.1038 -1.011444 4.406836 
1 1 1    7    5  -26 o  256.438   1.7820  2680.40   37.249  2678.88   53.096  2681.87   52.270  256.357   2.5409  256.500   2.4999 -0.1433105 3.564511 
1 1 1    7    5  -25 o  122.618   1.4823  612.817   14.815  637.495   24.187  597.998   18.743  125.058   2.3727  121.124   1.8983 3.933594 3.038622 
1 1 1    7    5  -24 o   99.637   1.4115  404.633   11.464  430.878   17.075  383.093   15.469  102.815   2.0374   96.947   1.9575 5.868347 2.825346 
1 1 1    7    5  -23 o  724.440   6.0479 21404.56  357.145 21385.26  504.841 21423.90  505.319  723.868   8.5558  724.521   8.5561 -0.6534424 12.09996 
1 1 1    7    5  -22 o  451.022   3.9128  8293.19  143.853  8460.50  206.900  8136.62  200.146  455.484   5.5725  446.684   5.4968 8.800171 7.827375 
1 1 1    7    5  -21 o   74.182   2.2170  224.508   13.391  246.173   18.959  202.944   18.915   77.653   3.0009   70.480   3.3016 7.172813 4.461575 
1 1 1    7    5  -20 o  142.735   2.7927  830.472   32.494   0.0000   0.0000  830.472   32.494  ?   ?   142.735   2.7927 0.000000 2.792742 
1 1 1    7    5  -19 o  392.792   2.8418  6289.14   90.989  6210.21  156.353  6329.56  111.886  390.267   4.9148  394.039   3.4834 -3.772339 6.024077 
1 1 1    7    5  -18 o  554.714   3.8497 12544.44  174.074 12562.25  301.965 12535.57  213.035  554.970   6.6750  554.483   4.7133 0.4863892 8.171345 
1 1 1    7    5  -17 o  437.106   3.4141  7788.65  121.647  8040.65  197.409  7634.38  154.458  444.055   5.4537  432.728   4.3788 11.32632 6.994110 
1 1 1    7    5  -16 o  588.198   4.0656 14104.89  194.931 13945.01  273.085 14270.97  278.339  584.778   5.7289  591.571   5.7721 -6.792664 8.132462 
1 1 1    7    5  -15 o  371.206   2.7211  5616.77   82.338  5556.19  115.619  5679.11  117.285  369.177   3.8420  373.238   3.8550 -4.060944 5.442587 
1 1 1    7    5  -14 o  609.348   4.2003 15137.64  208.634 15060.04  293.862 15216.51  296.259  607.701   5.9322  610.848   5.9498 -3.147705 8.401859 
1 1 1    7    5  -13 o  443.713   3.1583  8025.61  114.233  8085.68  162.594  7967.07  160.526  445.336   4.4790  442.058   4.4548 3.277649 6.317181 
1 1 1    7    5  -12 o  755.350   5.1432 23263.74  316.677 23317.70  448.869 23210.26  446.836  756.071   7.2832  754.329   7.2669 1.742554 10.28849 
1 1 1    7    5  -11 o  210.955   1.8606  1813.88   31.995  1846.95   45.913  1782.66   44.611  212.863   2.6461  209.126   2.6169 3.737122 3.721572 
1 1 1    7    5  -10 o  280.024   2.1956  3196.15   50.118  3186.73   70.823  3205.60   70.931  279.600   3.1074  280.427   3.1030 -0.8266296 4.391438 
1 1 1    7    5   -9 f  170.012   1.8507  1178.11   25.648  1144.22   39.880  1202.02   33.494  167.542   2.9201  171.725   2.3928 -4.182724 3.775193 
1 1 1    7    5   -8 o  153.342   1.8034  958.404   22.542  1000.30   36.263  932.021   28.778  156.652   2.8399  151.214   2.3347 5.437622 3.676380 
1 1 1    7    5   -7 o  281.441   2.0345  3228.55   46.675  3242.57   71.399  3218.08   61.679  282.040   3.1056  280.978   2.6929 1.062378 4.110542 
1 1 1    7    5   -6 o  459.203   3.0072  8595.56  112.564  8733.61  174.236  8496.68  147.470  462.834   4.6182  456.532   3.9628 6.302185 6.085360 
1 1 1    7    5   -5 o  110.771   1.7312  500.120   15.632  472.790   24.250  519.550   20.447  107.662   2.7655  112.900   2.2217 -5.237991 3.547392 
1 1 1    7    5   -4 o  568.647   3.9369 13182.28  182.490 13249.59  259.022 13115.94  257.147  570.032   5.5744  567.150   5.5622 2.881714 7.874806 
1 1 1    7    5   -3 o  447.050   3.1716  8146.71  115.577  8265.53  165.376  8033.26  161.590  450.264   4.5058  443.894   4.4658 6.370178 6.343923 
1 1 1    7    5   -2 o  309.076   2.5684  3893.85   64.708  3844.89  101.356  3927.53   84.071  307.105   4.0488  310.400   3.3227 -3.294830 5.237666 
1 1 1    7    5   -1 o  320.305   2.6421  4181.93   68.985  4432.17  161.376  4125.98   76.309  329.679   6.0050  318.151   2.9424 11.52802 6.687140 
1 1 1    7    5    0 o  604.407   4.5631 14893.51  224.814 15538.26  521.232 14746.16  249.183  616.962   10.364  601.388   5.0831 15.57416 11.54360 
1 1 1    7    5    1 o  620.931   4.6790 15719.23  236.828 16173.15  542.568 15612.38  263.228  629.420   10.575  618.793   5.2186 10.62695 11.79248 
1 1 1    7    5    2 o  407.158   3.2042  6757.68  106.344  6822.86  239.794  6741.72  118.650  408.993   7.1926  406.670   3.5792 2.323700 8.033952 
1 1 1    7    5    3 o  183.312   1.7211  1369.65   25.719  1385.28   44.836  1361.98   31.398  184.347   2.9837  182.797   2.1071 1.550537 3.652702 
1 1 1    7    5    4 o  482.126   3.3894  9475.47  133.206  9444.71  187.950  9506.50  188.816  481.303   4.7906  482.874   4.7970 -1.571625 6.779449 
1 1 1    7    5    5 o  290.664   2.2507  3443.66   53.326  3522.89   76.565  3369.02   74.315  293.977   3.1951  287.486   3.1712 6.491302 4.501656 
1 1 1    7    5    6 o  1014.48   6.3270 41971.11  523.214 42381.10  806.062 41672.60  687.802  1019.02   9.7040  1010.65   8.3489 8.371277 12.80124 
1 1 1    7    5    7 o  538.585   3.4701 11824.77  152.348 11914.27  234.244 11759.16  200.563  540.555   5.3161  537.053   4.5814 3.501221 7.017823 
1 1 1    7    5    8 o  569.539   3.6528 13223.28  169.582 13349.54  261.224 13131.31  222.949  572.175   5.6008  567.513   4.8194 4.661743 7.388874 
1 1 1    7    5    9 f  684.229   4.3334 19086.72  241.694 18959.73  367.109 19183.87  321.105  681.821   6.6052  685.895   5.7432 -4.073303 8.752921 
1 1 1    7    5   10 o  218.759   1.7507  1950.55   31.219  2004.88   48.518  1912.16   40.783  221.778   2.6838  216.592   2.3099 5.185944 3.540960 
1 1 1    7    5   11 o  470.948   3.0795  9040.95  118.218  9065.44  181.151  9022.77  156.020  471.539   4.7129  470.449   4.0685 1.090729 6.226050 
1 1 1    7    5   12 o  593.949   3.7998 14381.41  183.972 14871.41  289.064 14047.80  238.514  603.890   5.8722  586.973   4.9849 16.91693 7.702736 
1 1 1    7    5   13 o  232.232   1.9583  2198.25   37.072  2227.23   52.972  2170.43   51.900  233.751   2.7801  230.751   2.7592 2.999527 3.916926 
1 1 1    7    5   14 o  247.079   1.8807  2488.29   37.879  2523.00   58.509  2463.24   49.700  248.787   2.8851  245.827   2.4802 2.959869 3.804629 
1 1 1    7    5   15 o  358.724   2.4502  5245.26   71.646  5212.38  109.069  5270.22   95.023  357.574   3.7420  359.563   3.2420 -1.988586 4.951066 
1 1 1    7    5   16 o  321.776   2.2549  4220.37   59.144  4261.51   91.199  4190.51   77.698  323.323   3.4603  320.626   2.9729 2.696747 4.562002 
1 1 1    7    5   17 o  358.078   2.6444  5226.50   77.187  5262.35  134.510  5208.90   94.248  359.262   4.5931  357.464   3.2345 1.797974 5.617698 
1 1 1    7    5   18 o  382.670   2.7886  5969.13   86.984  5847.44  148.417  6032.79  107.354  378.701   4.8079  384.693   3.4235 -5.991730 5.902177 
1 1 1    7    5   19 o  400.258   2.8907  6530.52   94.314  6748.00  167.920  6430.29  113.993  406.808   5.0638  397.161   3.5211 9.647339 6.167660 
1 1 1    7    5   20 o  554.482   4.7112 12535.70  212.941 12734.13  305.620 12348.49  296.858  558.743   6.7102  550.224   6.6187 8.519714 9.425170 
1 1 1    7    5   21 o  171.246   2.9840  1195.41   41.654  1195.41   41.654   0.0000   0.0000  171.246   2.9840  ?   ?  0.000000 2.984038 
1 1 1    7    5   22 o  436.443   4.4007  7766.29  156.560  7890.74  194.327  7536.12  264.287  439.886   5.4195  429.781   7.5438 10.10507 9.288711 
1 1 1    7    5   23 o  308.001   2.8742  3867.03   72.162  3841.49   83.032  3945.89  145.880  306.974   3.3182  311.054   5.7534 -4.079681 6.641691 
1 1 1    7    5   24 o   52.599   2.4125  113.010   10.316  114.448   13.250  110.795   16.439   52.896   3.0864   51.984   3.9080 0.9119682 4.979784 
1 1 1    7    5   25 o  239.160   2.1612  2331.43   42.133  2285.72   53.624  2405.16   68.111  236.797   2.7781  242.895   3.4400 -6.098495 4.421740 
1 1 1    7    5   26 o  500.141   3.8358 10198.14  156.381 10343.50  204.067  9991.33  243.411  503.642   4.9707  494.935   6.0333 8.706757 7.817200 
1 1 1    7    5   27 o  146.551   1.5926  875.402   19.026  888.355   27.263  863.106   26.563  147.627   2.2656  145.514   2.2394 2.112839 3.185582 
1 1 1    7    5   28 o  556.196   3.8533 12612.56  174.701 12502.19  245.303 12726.16  248.865  553.669   5.4352  558.604   5.4654 -4.935303 7.707942 
1 1 1    7    5   29 o  445.753   3.1593  8100.15  114.795  8065.02  161.779  8135.78  162.916  444.735   4.4626  446.681   4.4743 -1.946198 6.319352 
1 1 1    7    5   30 o  163.558   1.6360  1090.38   21.812  1091.01   31.035  1089.76   30.661  163.600   2.3272  163.507   2.3005 0.9347534E-01 3.272329 
1 1 1    7    5   31 o  361.194   2.6452  5318.20   77.882  5220.96  108.698  5420.79  111.643  357.845   3.7264  364.628   3.7562 -6.782898 5.291030 
1 1 1    7    5   32 o  748.104   5.0928 22826.08  310.566 22691.44  437.016 22963.46  441.430  745.637   7.1901  750.088   7.2196 -4.451660 10.18922 
1 1 1    7    5   33 o  346.008   2.5548  4880.45   72.058  4914.48  102.524  4847.24  101.298  347.180   3.6227  344.797   3.6041 2.382629 5.110187 
1 1 1    7    5   34 o  230.975   2.1111  2174.67   39.748  2249.52   64.688  2129.27   50.380  234.891   3.3785  228.541   2.7043 6.350433 4.327517 
1 1 1    7    5   35 o  217.949   2.0396  1936.31   36.235  1906.03   57.273  1956.52   46.790  216.216   3.2496  219.074   2.6202 -2.857666 4.174326 
1 1 1    7    5   36 o  239.493   1.9955  2338.04   38.957  2255.31   54.934  2421.74   55.255  235.201   2.8653  243.727   2.7812 -8.525375 3.993097 
1 1 1    7    5   37 o   67.501   1.8260  185.862   10.038  188.545   15.645  183.986   13.087   67.946   2.8309   67.138   2.3952 0.8082733 3.708200 
1 1 1    7    5   38 o  317.687   2.4068  4114.35   62.328  4168.85   89.771  4063.63   86.605  319.747   3.4442  315.689   3.3655 4.057465 4.815507 
1 1 1    7    5   39 f  116.382   1.5810  552.110   14.999  540.093   22.320  562.003   20.253  115.102   2.3789  117.416   2.1161 -2.314285 3.183859 
1 1 1    7    5   40 o  192.665   1.9168  1513.16   30.104  1487.43   47.981  1529.86   38.659  190.996   3.0819  193.716   2.4482 -2.719498 3.935937 
1 1 1    7    5   41 o  277.737   2.1857  3144.65   49.482  3099.75   70.221  3188.92   69.739  275.716   3.1244  279.656   3.0593 -3.940216 4.372756 
1 1 1    7    5   42 o  226.991   2.1019  2100.48   38.892  2122.41   63.368  2087.23   49.262  228.132   3.4076  226.259   2.6710 1.873642 4.329621 
1 1 1    7    5   43 o  185.907   1.9057  1408.90   28.879  1420.68   47.494  1401.98   36.377  186.652   3.1215  185.439   2.4065 1.212891 3.941465 
1 1 1    7    5   44 o  467.956   3.6249  8931.82  138.275  9043.73  221.992  8860.88  176.750  470.607   5.7869  465.981   4.6532 4.625458 7.425668 
1 1 1    7    5   45 o  257.611   2.5382  2705.86   53.301  2648.01   75.605  2763.02   75.155  254.790   3.6402  260.270   3.5424 -5.479477 5.079376 
1 1 1    7    5   46 o   54.072   2.1126  119.384   9.2939  127.197   13.863  113.006   12.526   55.763   3.0616   52.559   2.9352 3.204132 4.241292 
1 1 1    7    5   47 o  279.195   2.4001  3178.32   54.622  3172.69   71.320  3186.31   84.950  278.908   3.1370  279.466   3.7291 -0.5581665 4.873047 
1 1 1    7    5   48 o  430.441   3.3737  7557.93  118.374  7605.38  154.382  7490.22  184.402  431.663   4.3875  428.244   5.2825 3.419098 6.866940 
1 1 1    7    5   49 o  329.668   2.4831  4431.73   66.728  4529.88   96.506  4341.82   92.365  333.213   3.5530  326.230   3.4734 6.982941 4.968701 
1 1 1    7    5   50 o  446.238   3.1786  8122.90  115.623  8222.45  165.819  8028.70  161.305  448.767   4.5329  443.460   4.4623 5.307037 6.360768 
1 1 1    7    5   51 o   80.349   1.6515  263.190   10.817  247.751   16.507  274.808   14.320   77.899   2.6032   82.068   2.1423 -4.169212 3.371357 
1 1 1    7    5   52 o  184.989   1.6056  1395.09   24.212  1396.16   32.675  1393.79   36.056  185.041   2.1662  184.876   2.3925 0.1656647 3.227501 
1 1 1    7    5   53 o  274.848   2.1654  3080.28   48.514  3156.28   70.473  3011.81   66.886  278.150   3.1082  271.717   3.0198 6.433289 4.333638 
1 1 1    7    5   54 o   96.924   1.4326  382.966   11.318  400.558   15.884  364.820   16.132   99.116   1.9660   94.589   2.0923 4.527328 2.870999 
1 1 1    7    5   55 o  243.689   1.8523  2421.23   36.795  2429.33   49.225  2410.97   55.390  244.062   2.4743  243.117   2.7950 0.9456482 3.732842 
1 1 1    7    5   56 o  238.501   1.8302  2319.23   35.582  2326.81   47.627  2309.66   53.529  238.857   2.4461  237.954   2.7597 0.9029999 3.687745 
1 1 1    7    5   57 o  211.589   1.7106  1825.29   29.504  1812.35   39.382  1841.84   44.544  210.810   2.2918  212.502   2.5715 -1.692276 3.444556 
1 1 1    7    5   58 o  112.602   1.7692  516.955   16.239  513.954   18.027  529.869   37.396  112.270   1.9698  113.842   4.0362 -1.572411 4.491234 
1 1 1    7    5   59 o   72.592   1.4902  214.833   8.8179  218.325   12.916  211.785   12.068   73.137   2.1689   72.037   2.0573 1.099449 2.989350 
1 1 1    7    5   60 o  230.596   1.9657  2168.28   36.950  2169.63   45.158  2165.56   64.274  230.641   2.4019  230.340   3.4232 0.3006134 4.181769 
1 1 1    7    5   61 o  327.519   2.7166  4376.05   72.526  4367.96   80.888  4409.21  163.799  327.178   3.0329  328.135   6.1238 -0.9568481 6.833709 
1 1 1    7    5   62 o  255.472   2.2865  2661.87   47.615  2648.06   52.935  2720.38  108.979  254.788   2.5488  257.904   5.1838 -3.116547 5.776490 
1 1 1    7    5   63 o  152.972   1.8241  954.170   22.745  955.836   25.305  947.164   51.899  153.098   2.0277  152.207   4.1869 0.8902588 4.652109 
1 1 1    7    5   64 o  185.229   1.9380  1399.10   29.262  1405.25   32.750  1374.78   65.161  185.624   2.1644  183.419   4.3582 2.204697 4.866086 
1 1 1    7    5   65 o  121.498   1.6251  601.873   16.094  617.500   19.847  571.860   27.505  123.054   1.9786  118.383   2.8503 4.670334 3.469715 
1 1 1    7    5   66 o  311.729   2.3978  3963.95   60.929  4014.28   75.193  3867.74  103.971  313.635   2.9411  307.665   4.1457 5.970215 5.083028 
1 1 1    7    5   67 o  180.395   1.9431  1327.10   28.572  1359.63   37.295  1280.87   44.457  182.557   2.5062  177.148   3.0787 5.409409 3.969824 
1 1 1    7    5   68 o  256.047   2.5835  2674.88   53.922  2792.67   78.189  2568.05   74.463  261.483   3.6683  250.751   3.6430 10.73235 5.169893 
1 1 1    7    5   69 o  113.818   1.8875  528.300   17.512  530.137   22.814  525.664   27.324  113.992   2.4552  113.446   2.9572 0.5457993 3.843587 
1 1 1    7    5   70 o  149.583   1.7781  912.450   21.681  946.360   30.823  879.240   30.502  152.298   2.4828  146.793   2.5491 5.504333 3.558385 
1 1 1    7    5   71 o   55.624   2.3690  126.460   10.717  122.969   13.889  131.596   16.849   54.791   3.1226   56.636   3.6693 -1.844059 4.818126 
1 1 1    7    5   72 o  143.474   1.6681  839.406   19.509  832.409   25.292  849.685   30.654  142.850   2.1720  144.298   2.6061 -1.447647 3.392578 
1 1 1    7    5   73 o  193.951   1.7479  1534.06   27.635  1548.69   36.227  1513.71   42.737  194.834   2.2810  192.581   2.7225 2.253494 3.551746 
1 1 1    7    5   74 o   79.115   1.8382  255.283   11.854  264.707   15.214  240.721   18.912   80.512   2.3206   76.721   3.0300 3.791634 3.816604 
1 1 1    7    5   75 o   50.118   2.3299  102.717   9.4926  112.454   12.169   87.587   15.170   52.403   2.8597   46.096   4.0795 6.307377 4.981974 
1 1 1    7    5   76 o  252.950   1.9492  2610.12   40.192  2706.12   54.087  2491.74   60.062  257.474   2.5770  247.000   2.9831 10.47403 3.942052 
1 1 1    7    5   77 o  143.131   1.5858  835.506   18.502  848.028   24.183  817.829   28.732  144.169   2.0578  141.544   2.4902 2.625214 3.230438 
1 1 1    7    5   78 o   53.495   2.1905  116.980   9.5319  113.915   12.202  121.777   15.268   52.735   2.8492   54.467   3.4566 -1.732327 4.479481 
1 1 1    7    5   79 o  151.432   1.5957  935.297   19.698  941.552   25.855  926.646   30.409  151.899   2.0882  150.654   2.4762 1.244461 3.239128 
1 1 1    7    5   80 o   45.676   2.5925   85.477   9.6130   96.302   13.218   73.326   14.005   48.410   3.3707   42.109   4.1334 6.301510 5.333599 
1 1 1    7    5   81 o   25.808   4.8527   28.230   9.8339   21.238   15.208   33.254   12.892   22.828   7.2635   27.900   5.8556 -5.072081 9.329861 
1 1 1    7    5   82 o  138.404   1.8422  781.651   20.783  787.527   32.022  777.374   27.319  138.814   2.8300  137.966   2.4292 0.8479462 3.729557 
1 1 1    7    5   83 o  170.908   1.7628  1191.83   24.558  1232.29   34.881  1152.07   34.582  173.691   2.4636  167.934   2.5262 5.757843 3.528640 
1 1 1    7    5   84 o   38.568   2.9141   61.167   9.0937   55.564   12.317   67.880   13.482   36.562   4.2096   40.470   4.1455 -3.907310 5.908096 
1 1 1    7    5   85 o  120.654   1.6748  594.007   16.472  623.557   23.306  564.514   23.284  123.554   2.3141  117.546   2.4301 6.008194 3.355624 
1 1 1    7    5   86 o  165.389   1.6243  1116.15   21.898  1096.17   28.572  1144.60   34.092  163.831   2.1395  167.350   2.4992 -3.518661 3.289852 
1 1 1    7    5   87 o  225.839   1.9858  2082.68   36.557  2052.23   44.265  2148.00   64.833  224.079   2.4234  228.910   3.4745 -4.831055 4.236184 
1 1 1    7    5   88 o  156.607   1.7520  1001.20   22.366  985.258   27.032  1035.79   39.824  155.296   2.1354  159.029   3.0721 -3.732758 3.741389 
1 1 1    7    5   89 o   22.536   5.1228   21.823   9.1965   20.325   11.043   25.213   16.613   21.775   6.0200   24.460   7.5649 -2.684675 9.667878 
1 1 1    7    5   90 o   81.165   1.9197  269.115   12.701  278.017   15.412  250.273   22.423   82.425   2.2961   77.982   3.5367 4.442932 4.216684 
1 1 1    7    5   91 o   73.010   1.8143  217.738   10.798  226.938   14.061  204.516   16.857   74.448   2.3198   70.572   2.9367 3.876373 3.742406 
1 1 1    7    5   92 o   78.002   1.7025  248.504   10.825  251.659   14.115  243.998   16.867   78.408   2.2107   77.124   2.6871 1.283974 3.479606 
1 1 1    7    5   93 o   13.087   4.9452   5.2222   7.2168   6.6211   9.3626   3.1741   11.328   14.799   5.6232   14.506   5.9637 0.2921658 8.196728 
1 1 1    7    5   94 o   79.522   1.6724  258.378   10.841  249.312   14.106  271.460   16.944   78.009   2.2205   81.335   2.5589 -3.326164 3.388001 
1 1 1    7    5   95 o   96.348   1.5819  379.276   12.424  370.097   16.191  392.420   19.374   95.089   2.0888   97.842   2.4292 -2.752533 3.203776 
1 1 1    7    5   96 o   79.888   1.8027  261.026   11.739  257.764   14.111  268.357   21.154   79.292   2.1853   80.631   3.2251 -1.338226 3.895731 
1 1 1    7    5   97 o   39.729   2.6043   65.120   8.3877   59.853   9.9934   77.677   15.429   37.948   3.2623   42.934   4.4741 -4.986416 5.537136 
1 1 1    7    5   98 f   65.644   1.9079  176.603   10.199  174.284   12.232  181.892   18.472   65.128   2.3077   66.217   3.4340 -1.088310 4.137311 
1 1 1    7    5   99 o   36.251   2.5903   54.335   7.6037   53.926   9.9435   54.912   11.800   35.919   3.4380   36.068   4.0852 -0.1490402 5.339365 
1 1 1    7    5  100 o   40.264   2.3462   66.858   7.6671   59.253   9.9450   78.000   12.038   37.683   3.2699   43.221   3.4453 -5.538048 4.750022 
1 1 1    7    5  101 o   66.592   1.7305  181.768   9.3857  185.136   12.272  177.021   14.569   67.077   2.2475   65.438   2.7373 1.638412 3.541777 
1 1 1    7    5  102 o   49.672   2.0652  101.502   8.3438  105.761   10.995   95.718   12.813   50.548   2.6779   47.888   3.3026 2.659721 4.251831 
1 1 1    7    5  103 o   12.533   4.8180   4.7467   6.9256  -3.0596   8.9680   16.281   10.901   10.964   4.9015   19.318   6.1500 -8.354592 7.864278 
1 1 1    7    5  104 o   44.343   2.2518   81.184   8.1129   77.959   10.682   85.578   12.471   43.220   3.0517   45.162   3.4129 -1.942711 4.578310 
1 1 1    7    5  105 o   61.139   1.8614  153.651   9.2659  153.727   12.327  153.552   14.050   60.952   2.4862   60.778   2.8437 0.1748276 3.777303 
1 1 1    7    5  106 o   46.398   2.4088   89.161   9.0793   85.489   13.012   92.646   12.675   45.001   3.5765   46.962   3.3327 -1.960728 4.888594 
1 1 1    7    5  107 o   55.889   2.1679  128.960   9.8576  131.515   14.043  126.477   13.841   56.076   3.0840   54.981   3.1008 1.095329 4.373353 
1 1 1    7    5  108 o   55.713   2.2077  128.280   10.006  123.518   14.083  133.135   14.220   54.257   3.1984   56.382   3.1061 -2.124485 4.458428 
1 1 1    7    5  109 o   42.160   2.4345   73.844   8.3310   79.547   11.021   66.239   12.726   43.499   3.1290   39.276   4.0322 4.223125 5.103866 
1 1 1    7    5  110 o   82.504   1.6934  279.736   11.389  281.849   15.049  276.902   17.423   82.532   2.2390   81.576   2.6236 0.9557648 3.449073 
1 1 1    7    5  111 o   13.766   5.1730   6.8143   7.8730   5.7384   9.7440   8.8375   13.362   14.088   5.6245   16.510   6.5881 -2.421799 8.662516 
1 1 1    7    5  112 o   94.444   1.7939  367.504   13.811  359.000   19.180  376.659   19.902   92.814   2.5375   95.043   2.5713 -2.228981 3.612548 
1 1 1    7    5  113 o   18.961   5.1993   16.648   8.2752   16.482   11.520   16.826   11.895   18.856   6.3416   19.033   6.4439 -0.1772690 9.041025 
1 1 1    7    5  114 o   25.888   4.2491   29.864   8.6560   20.782   12.019   39.652   12.477   20.670   6.4413   29.187   5.4444 -8.517294 8.433942 
1 1 1    7    5  115 o   11.726   5.0175   1.4266   8.5295   6.9878   10.239 -11.1796   15.416   14.485   5.7715   12.440   5.8631 2.045556 8.227132 
1 1 1    7    5  116 o   10.130   4.5342  -1.8700   7.6989   14.473   10.239 -23.1306   11.678   17.555   5.9782   8.8541   4.3797 8.700824 7.410852 
1 1 1    7    5  117 o   23.528   4.3365   25.223   8.0105   17.142   10.535   36.298   12.333   18.708   6.0547   27.377   5.7116 -8.669428 8.323594 
1 1 1    7    5  118 o   23.309   4.4919   25.108   8.2252   36.506   10.798   9.3498   12.696   27.911   4.9259   15.749   6.3738 12.16255 8.055387 
1 1 1    7    5  119 o   14.549   5.5784   8.6876   9.2676  -1.6775   11.844   25.051   14.882   12.308   5.5565   21.411   7.2079 -9.103816 9.101028 
1 1 1    7    5  120 o   14.801   5.4571   9.6667   8.6815   16.718   10.479  -5.7683   15.503   18.212   6.0467   12.988   6.0424 5.224183 8.548305 
1 1 1    7    5  121 o   14.245   5.4197   8.4923   8.7043   5.9474   10.404   14.430   15.891   13.773   5.6940   17.621   7.1311 -3.848279 9.125509 
1 1 1    7    5  122 o   32.484   3.6061   46.899   9.3879   49.857   11.263   40.167   16.992   32.956   4.2947   26.429   7.5259 6.527193 8.665095 
1 1 1    7    5  123 o   18.088   5.8578   16.721   9.8599   14.937   10.966   24.252   22.529   17.222   6.1643   20.260   8.3778 -3.038225 10.40124 
1 1 1    7    5  124 f   27.951   5.3466   38.467   11.738   37.067   13.503   42.797   23.747   26.474   6.3408   24.774   9.0432 1.700481 11.04472 
1 1 1    7    5  125 f   13.803   5.8282   5.7034   11.249  -2.1297   15.302   14.913   16.592   13.335   6.1327   17.506   7.2094 -4.170720 9.464896 
1 1 1    7    5  126 o   28.357   5.9326   41.489   13.272   50.443   15.821   20.221   24.383   30.672   6.5284   19.124   8.3328 11.54781 10.58566 
1 1 1    7    5  127 o   17.016   6.6031   14.698   13.098   21.077   15.528  -1.0303   24.382   19.186   7.2529   15.750   7.4079 3.435840 10.36737 
1 1 1    7    5  128 o   18.812   5.9769   18.838   10.300   25.469   13.364   9.1324   16.168   21.091   6.8187   15.772   6.8294 5.319361 9.650705 
1 1 1    7    5  129 o   21.684   5.7868   24.773   10.419   36.479   13.437   7.1255   16.498   25.822   6.4127   15.315   6.7580 10.50745 9.316293 
1 1 1    7    5  130 o   13.307   5.5597   5.7841   10.069  -1.4420   12.703   18.002   16.517   12.362   5.6486   18.046   7.2820 -5.684464 9.215977 
1 1 1    7    5  131 o   15.800   6.1831   11.918   11.562   12.492   15.427   11.183   17.465   16.470   6.8816   16.428   7.1060 0.4194069E-01 9.891954 
1 1 1    7    6 -129 o   9.8034   4.6563  -8.1412   10.084 -14.9036   12.522   4.3362   17.009   10.002   4.8600   14.857   6.6875 -4.855686 8.266916 
1 1 1    7    6 -128 f   18.894   6.0538   19.277   10.550   27.934   13.617   6.2806   16.685   21.947   6.8587   15.153   6.7356 6.794046 9.613037 
1 1 1    7    6 -127 o   12.261   5.3698   2.2165   10.239  -0.8093   13.096   6.9747   16.422   12.636   5.7590   15.259   6.7375 -2.623277 8.863378 
1 1 1    7    6 -126 o   19.328   6.0575   20.060   10.614   18.107   13.762   22.927   16.674   18.142   6.8347   19.593   7.4899 -1.451344 10.13961 
1 1 1    7    6 -125 o   14.008   5.6817   7.5687   10.113  -2.7795   12.953   23.726   16.186   12.252   5.6375   19.995   7.4367 -7.742215 9.332011 
1 1 1    7    6 -124 f   14.829   5.6148   10.017   9.3145  -2.6476   11.063   40.863   17.265   11.486   5.2570   26.068   7.6360 -14.58229 9.270644 
1 1 1    7    6 -123 o   18.525   5.8827   17.837   9.9795   17.364   11.016   19.998   23.563   18.176   6.2007   19.150   8.2685 -0.9741116 10.33524 
1 1 1    7    6 -122 o   13.726   5.7337   5.9134   10.706   5.9134   10.706   0.0000   0.0000   13.726   5.7337  ?   ?  0.000000 5.733654 
1 1 1    7    6 -121 o   12.424   5.4443   1.7060   10.537   1.7060   10.537   0.0000   0.0000   12.424   5.4443  ?   ?  0.000000 5.444285 
1 1 1    7    6 -120 o   21.857   5.1544   23.380   9.0333   17.720   10.580   38.609   17.354   18.556   6.0719   25.668   7.6908 -7.112507 9.798791 
1 1 1    7    6 -119 o   21.863   5.1023   23.223   8.9265   21.819   10.606   26.631   16.530   20.609   5.9702   21.549   7.5825 -0.9397526 9.650840 
1 1 1    7    6 -118 o   16.925   5.5689   13.982   8.8941   17.364   10.571   5.7850   16.458   18.501   6.0703   15.574   6.8149 2.926344 9.126362 
1 1 1    7    6 -117 o   8.7470   4.1893  -9.6452   8.5237 -11.7902   10.103  -4.3480   15.877   9.3693   4.5065   13.432   6.2021 -4.062472 7.666484 
1 1 1    7    6 -116 o   12.365   5.2764   2.5320   9.3863   1.0146   10.173   11.217   24.338   12.277   5.3653   18.543   8.1941 -6.266036 9.794361 
1 1 1    7    6 -115 o   17.247   5.5310   14.141   8.8047   3.0209   10.451   41.342   16.345   13.078   5.5736   28.033   7.1358 -14.95468 9.054496 
1 1 1    7    6 -114 o   31.440   3.6224   43.164   9.1140   34.432   10.935   63.034   16.495   27.161   5.1268   36.412   5.7479 -9.251724 7.702079 
1 1 1    7    6 -113 o   41.485   2.7256   72.669   9.1660   61.239   12.450   86.197   13.544   37.209   4.1767   44.516   3.7679 -7.306881 5.625118 
1 1 1    7    6 -112 o   19.699   4.9985   18.014   8.0382   21.108   10.844   14.240   11.976   20.926   6.0292   17.834   6.4346 3.092346 8.817901 
1 1 1    7    6 -111 o   66.046   1.9964  180.551   10.736  177.854   14.699  183.633   15.716   65.087   2.7769   66.031   2.9272 -0.9440994 4.034827 
1 1 1    7    6 -110 o   46.259   2.3320   89.045   8.7653   81.460   11.510   99.517   13.524   43.820   3.2454   48.332   3.4555 -4.511837 4.740583 
1 1 1    7    6 -109 o   48.341   2.5763   97.503   10.115   93.001   13.297  103.687   15.585   46.747   3.5152   49.121   3.9250 -2.374557 5.268941 
1 1 1    7    6 -108 o   20.971   5.3475   20.122   9.1681   16.944   15.418   21.861   11.403   19.837   7.2795   21.634   6.1668 -1.796339 9.540461 
1 1 1    7    6 -107 o   10.572   4.7931  -3.9939   8.9233  -7.7740   14.533  -1.7062   11.305   12.972   5.9695   12.612   5.5785 0.3594122 8.170328 
1 1 1    7    6 -106 o   88.436   1.9928  322.043   14.366  332.137   23.539  316.052   18.135   89.008   3.2498   87.291   2.5514 1.717293 4.131698 
1 1 1    7    6 -105 o   39.707   3.0408   66.089   9.7675   73.823   15.962   61.459   12.350   41.142   4.8527   37.875   4.0636 3.267227 6.329439 
1 1 1    7    6 -104 o   19.075   5.4076   16.325   8.7923   2.8738   14.783   23.688   10.937   15.578   6.6336   22.777   5.8579 -7.199077 8.849858 
1 1 1    7    6 -103 o   37.422   2.8685   58.446   8.6834   49.514   12.689   66.312   11.908   33.738   4.7449   39.564   3.7367 -5.825706 6.039629 
1 1 1    7    6 -102 o   55.606   2.1606  127.449   9.7749  132.100   14.353  123.426   13.349   56.267   3.1419   54.431   3.0204 1.836128 4.358282 
1 1 1    7    6 -101 o   23.811   3.8280   24.314   7.1782   32.761   9.7293   14.223   10.634   27.497   4.4959   18.301   6.0918 9.196051 7.571165 
1 1 1    7    6 -100 o   55.799   1.9441  127.928   8.8292  113.482   11.946  145.320   13.107   52.318   2.8114   59.252   2.7211 -6.934151 3.912600 
1 1 1    7    6  -99 o   37.961   2.5038   59.614   7.7044   56.741   10.495   62.972   11.347   36.758   3.5465   38.711   3.6385 -1.953186 5.080946 
1 1 1    7    6  -98 o   25.680   3.4690   27.857   7.0763   33.842   9.6377   20.857   10.423   28.097   4.3484   21.667   5.7907 6.429636 7.241604 
1 1 1    7    6  -97 o   24.010   3.6899   24.481   6.9909   17.787   9.3777   32.853   10.488   20.119   5.5420   27.558   4.8459 -7.438871 7.361814 
1 1 1    7    6  -96 o   42.609   2.2925   74.725   7.9331   73.050   10.598   76.859   11.965   41.954   3.1212   42.957   3.4458 -1.002922 4.649274 
1 1 1    7    6  -95 o   38.432   2.4775   60.896   7.7200   60.501   10.287   61.404   11.680   38.128   3.3437   38.302   3.7907 -0.1744080 5.054714 
1 1 1    7    6  -94 o   59.378   1.8782  144.413   9.0795  144.301   12.018  144.561   13.859   59.244   2.4941   59.213   2.8799 0.3136063E-01 3.809766 
1 1 1    7    6  -93 o   61.448   2.0027  154.680   10.018  157.657   12.398  149.080   17.003   61.957   2.4598   60.012   3.4907 1.944870 4.270323 
1 1 1    7    6  -92 o   48.355   2.3400   96.003   9.1960   89.575   11.227  109.112   16.032   46.598   2.9711   51.247   3.8663 -4.649605 4.875986 
1 1 1    7    6  -91 o   56.872   2.1207  132.506   9.8140  137.131   11.935  122.851   17.245   57.793   2.5397   54.417   3.9139 3.376579 4.665647 
1 1 1    7    6  -90 o  113.134   1.5660  522.644   14.442  528.259   19.078  515.110   22.101  113.662   2.0591  112.170   2.4171 1.492096 3.175280 
1 1 1    7    6  -89 o   15.617   5.1817   9.6525   7.6954   9.8172   9.8704   9.3973   12.289   16.442   5.8524   17.187   6.4620 -0.7454700 8.718250 
1 1 1    7    6  -88 o   24.975   4.2420   26.409   8.3275   30.161   10.791   20.882   13.095   26.538   5.1741   22.190   6.6880 4.347565 8.455848 
1 1 1    7    6  -87 o   69.633   2.1145  198.328   11.988  213.834   14.948  170.380   20.068   72.250   2.5421   64.260   3.8488 7.989212 4.612537 
1 1 1    7    6  -86 o   86.782   2.0678  307.665   14.628  292.050   18.830  331.428   23.230   84.433   2.7396   89.874   3.1759 -5.440910 4.194191 
1 1 1    7    6  -85 o  180.707   2.0114  1333.63   29.629  1313.13   38.177  1364.69   46.982  179.188   2.6137  182.528   3.1577 -3.340805 4.099074 
1 1 1    7    6  -84 o  133.197   1.5883  723.950   17.245  707.218   22.678  746.895   26.556  131.590   2.1142  135.189   2.4098 -3.598862 3.205777 
1 1 1    7    6  -83 o   61.531   2.1803  154.819   10.918  151.401   15.502  158.183   15.380   60.738   3.1417   62.100   3.0477 -1.361359 4.377092 
1 1 1    7    6  -82 o   74.025   1.8169  223.639   10.963  230.027   14.434  214.928   16.854   75.004   2.3639   72.442   2.8597 2.561371 3.710242 
1 1 1    7    6  -81 o  102.713   1.6367  430.426   13.703  420.739   17.929  444.035   21.251  101.512   2.1667  104.254   2.5006 -2.741737 3.308732 
1 1 1    7    6  -80 o  146.241   1.5959  872.451   19.024  840.637   24.738  918.501   29.762  143.501   2.1148  149.960   2.4347 -6.459656 3.224960 
1 1 1    7    6  -79 o  187.545   1.7040  1434.99   26.051  1443.06   34.535  1424.32   39.681  188.003   2.2535  186.724   2.6070 1.279053 3.445998 
1 1 1    7    6  -78 o   61.495   2.0525  154.506   10.274  146.753   13.240  166.241   16.289   59.873   2.7199   63.688   3.1474 -3.814285 4.159809 
1 1 1    7    6  -77 o   57.284   2.3092  134.171   10.761  137.661   14.746  130.195   15.738   57.948   3.1334   56.315   3.4448 1.632866 4.656682 
1 1 1    7    6  -76 o   35.096   3.3348   50.807   9.4257   39.505   12.477   65.835   14.387   30.606   5.1859   39.828   4.5107 -9.221987 6.873114 
1 1 1    7    6  -75 o   97.971   1.7703  391.523   14.138  401.384   19.356  380.245   20.700   99.163   2.3946   96.465   2.6349 2.697731 3.560456 
1 1 1    7    6  -74 o   76.539   2.0650  239.196   12.872  221.820   16.325  267.749   20.927   73.654   2.7238   80.887   3.1802 -7.232353 4.187200 
1 1 1    7    6  -73 o  159.085   1.8904  1032.36   24.514  1014.41   31.203  1061.29   39.622  157.654   2.4281  161.195   3.0154 -3.541519 3.871467 
1 1 1    7    6  -72 o   86.065   1.8522  302.126   12.994  305.085   15.985  296.364   22.310   86.440   2.2706   85.115   3.2214 1.324287 3.941202 
1 1 1    7    6  -71 o  208.341   2.0968  1770.71   35.609  1791.12   46.261  1741.02   55.785  209.475   2.7092  206.447   3.3149 3.027817 4.281168 
1 1 1    7    6  -70 o  118.661   2.1262  574.383   20.566  573.907   28.413  574.906   29.805  118.565   2.9399  118.618   3.0851 -0.5338287E-01 4.261530 
1 1 1    7    6  -69 o  196.884   2.0891  1581.15   33.528  1545.98   42.553  1638.73   54.450  194.631   2.6821  200.313   3.3347 -5.681564 4.279440 
1 1 1    7    6  -68 f   61.543   2.7119  154.877   13.571  170.845   17.501  130.793   21.493   64.593   3.3351   56.339   4.7236 8.254097 5.782373 
1 1 1    7    6  -67 o  207.192   1.9279  1750.80   32.561  1727.24   39.567  1800.23   57.315  205.760   2.3590  209.957   3.3489 -4.197403 4.096363 
1 1 1    7    6  -66 o   52.055   2.7386  110.887   11.580  104.879   15.003  119.737   18.211   50.538   3.6669   53.963   4.1725 -3.424622 5.554777 
1 1 1    7    6  -65 o   96.007   1.9223  375.901   15.044  385.478   19.576  362.084   23.512   97.172   2.4734   94.133   3.0683 3.039200 3.941057 
1 1 1    7    6  -64 o  108.336   2.0439  478.669   18.050  486.003   21.192  459.290   34.451  109.150   2.3818  105.949   3.9962 3.201530 4.652116 
1 1 1    7    6  -63 o   44.551   2.8698   81.329   10.366   81.408   13.367   81.209   16.420   44.492   3.7197   44.330   4.6113 0.1616402 5.924512 
1 1 1    7    6  -62 o  163.832   1.7240  1094.44   23.023  1074.76   27.909  1136.36   40.731  162.335   2.1091  166.867   2.9945 -4.532928 3.662687 
1 1 1    7    6  -61 o   99.752   1.6878  405.715   13.724  407.576   16.695  401.836   24.101   99.971   2.0487   99.187   2.9843 0.7841873 3.619808 
1 1 1    7    6  -60 o  181.075   1.7723  1336.94   26.160  1339.66   31.999  1331.46   45.423  181.240   2.1660  180.625   3.0851 0.6155090 3.769495 
1 1 1    7    6  -59 o  129.723   1.6488  686.119   17.435  663.605   20.975  736.452   31.363  127.566   2.0171  134.348   2.8638 -6.782425 3.502912 
1 1 1    7    6  -58 o  180.018   1.9321  1321.44   28.352  1308.63   31.545  1375.28   64.670  179.132   2.1603  183.471   4.3241 -4.338806 4.833750 
1 1 1    7    6  -57 o   56.098   2.3130  128.568   10.554  135.787   11.821  100.200   23.433   57.642   2.5220   49.115   5.9758 8.526630 6.486225 
1 1 1    7    6  -56 o  144.447   1.7277  850.719   20.343  845.712   23.794  864.323   39.221  144.012   2.0269  145.527   3.3063 -1.514786 3.878178 
1 1 1    7    6  -55 o  200.908   1.8000  1645.78   29.479  1661.08   37.115  1619.63   48.520  201.818   2.2561  199.238   2.9875 2.579422 3.743666 
1 1 1    7    6  -54 o  151.021   1.5006  929.809   18.474  903.475   24.850  962.344   27.621  148.850   2.0480  153.617   2.2058 -4.766907 3.009949 
1 1 1    7    6  -53 o   38.246   2.0744   59.821   6.4429   57.105   10.192   61.628   8.3150   37.254   3.3936   38.780   2.6462 -1.526627 4.303355 
1 1 1    7    6  -52 f  161.286   1.5352  1060.49   20.184  1054.67   27.356  1067.45   29.901  160.825   2.0867  161.789   2.2673 -0.9646606 3.081392 
1 1 1    7    6  -51 o  172.229   1.5769  1209.30   22.139  1182.51   29.700  1242.81   33.212  170.291   2.1395  174.572   2.3339 -4.280136 3.166201 
1 1 1    7    6  -50 o  253.361   2.0599  2617.45   42.543  2587.67   60.577  2646.43   59.760  251.858   2.9507  254.707   2.8783 -2.849045 4.121998 
1 1 1    7    6  -49 o  156.506   1.5177  998.544   19.362  994.891   26.242  1002.91   28.684  156.204   2.0610  156.826   2.2438 -0.6219482 3.046694 
1 1 1    7    6  -48 o  230.595   1.9478  2168.02   36.612  2224.34   53.609  2118.80   50.122  233.524   2.8162  227.924   2.6977 5.600082 3.899861 
1 1 1    7    6  -47 o  102.936   1.5707  431.955   13.179  448.743   20.308  419.741   17.323  104.902   2.3750  101.461   2.0945 3.440636 3.166586 
1 1 1    7    6  -46 f  245.112   2.0208  2449.57   40.375  2508.93   59.049  2397.45   55.331  248.015   2.9208  242.450   2.7997 5.565018 4.045878 
1 1 1    7    6  -45 o  208.978   2.0020  1780.55   34.104  1784.61   55.006  1778.00   43.468  209.161   3.2262  208.807   2.5538 0.3539581 4.114647 
1 1 1    7    6  -44 o  123.900   1.5841  625.799   15.999  625.631   23.928  625.935   21.516  123.868   2.3698  123.904   2.1303 -0.3541565E-01 3.186506 
1 1 1    7    6  -43 f   77.696   1.5293  246.081   9.6858  273.832   16.879  232.456   11.827   81.908   2.5310   75.486   1.9236 6.422485 3.179066 
1 1 1    7    6  -42 o   76.026   1.6444  235.620   10.191  224.271   13.182  252.478   16.066   74.135   2.1838   78.649   2.5092 -4.514053 3.326371 
1 1 1    7    6  -41 f  239.751   1.9747  2343.35   38.593  2386.30   48.253  2267.10   64.292  241.921   2.4469  235.761   3.3454 6.160126 4.144758 
1 1 1    7    6  -40 o  279.741   2.1889  3190.43   49.913  3175.11   61.342  3220.43   85.866  279.048   2.6967  280.973   3.7491 -1.925232 4.618213 
1 1 1    7    6  -39 o   49.074   2.1983   98.379   8.7716   89.012   12.356  107.896   12.455   46.604   3.2733   51.352   2.9883 -4.747997 4.432202 
1 1 1    7    6  -38 o  171.661   1.8286  1201.24   25.588  1182.02   33.351  1228.74   39.896  170.271   2.4029  173.593   2.8194 -3.322067 3.704453 
1 1 1    7    6  -37 o  173.350   1.6756  1224.94   23.678  1196.65   33.550  1253.02   33.421  171.323   2.4024  175.313   2.3386 -3.989868 3.352711 
1 1 1    7    6  -36 o  138.781   1.5798  785.092   17.871  774.601   25.726  794.877   24.845  137.842   2.2896  139.636   2.1827 -1.794022 3.163302 
1 1 1    7    6  -35 o  263.192   1.9449  2823.76   41.726  2763.87   54.764  2906.66   64.427  260.369   2.5803  266.997   2.9602 -6.628387 3.926947 
1 1 1    7    6  -34 o  437.107   2.8852  7790.02  102.801  7697.12  134.992  7918.28  158.614  434.433   3.8120  440.583   4.4165 -6.149292 5.834092 
1 1 1    7    6  -33 o  492.207   3.2021  9878.38  128.474  9835.96  169.657  9935.41  196.710  491.070   4.2383  493.486   4.8901 -2.415619 6.471177 
1 1 1    7    6  -32 f  245.980   1.8659  2466.40   37.414  2457.78   49.717  2477.65   56.813  245.537   2.4840  246.518   2.8272 -0.9817352 3.763431 
1 1 1    7    6  -31 o  188.387   1.7672  1446.64   27.138  1445.19   39.321  1447.95   37.502  188.281   2.5620  188.463   2.4411 -0.1817322 3.538785 
1 1 1    7    6  -30 o  190.015   1.9450  1471.77   30.126  1461.47   38.806  1487.41   47.796  189.340   2.5143  191.003   3.0698 -1.662582 3.968058 
1 1 1    7    6  -29 o  275.927   2.1822  3103.58   49.082  3091.68   59.986  3127.69   85.376  275.386   2.6722  276.951   3.7818 -1.565643 4.630620 
1 1 1    7    6  -28 o  303.978   2.1598  3766.67   53.517  3774.45   71.032  3756.45   81.388  304.275   2.8639  303.536   3.2894 0.7389832 4.361396 
1 1 1    7    6  -27 o  252.839   1.9034  2605.81   39.229  2589.22   51.874  2627.98   59.955  252.022   2.5251  253.894   2.8969 -1.871460 3.842917 
1 1 1    7    6  -26 o  470.231   3.0679  9014.63  117.595  9158.01  181.999  8911.87  154.076  473.867   4.7117  467.496   4.0432 6.371613 6.208640 
1 1 1    7    6  -25 o  141.980   1.4701  821.652   17.014  831.399   26.203  814.548   22.371  142.814   2.2509  141.362   1.9414 1.452118 2.972426 
1 1 1    7    6  -24 o  377.337   2.5395  5804.16   78.110  5846.75  120.172  5773.00  102.784  378.675   3.8931  376.299   3.3509 2.376312 5.136607 
1 1 1    7    6  -23 o  214.589   2.0183  1877.01   35.305  1886.91   55.927  1870.45   45.522  215.137   3.1891  214.206   2.6071 0.9311218 4.119112 
1 1 1    7    6  -22 o  146.987   1.5838  880.620   18.976  844.807   32.052  899.946   23.546  143.958   2.7314  148.589   1.9440 -4.630356 3.352586 
1 1 1    7    6  -21 o  599.771   3.8261 14666.55  187.057 14684.75  286.135 14652.96  247.194  600.004   5.8503  599.415   5.0591 0.5883789 7.734400 
1 1 1    7    6  -20 o  540.790   3.4788 11922.93  153.354 11661.26  229.987 12132.41  205.779  534.726   5.2764  545.461   4.6281 -10.73529 7.018488 
1 1 1    7    6  -19 o  429.525   2.8326  7520.74   99.176  7479.37  150.908  7552.19  131.581  428.291   4.3225  430.393   3.7505 -2.102112 5.722807 
1 1 1    7    6  -18 o  412.854   2.7386  6948.15   92.163  7083.59  143.068  6852.08  120.495  416.812   4.2108  409.965   3.6057 6.846802 5.543635 
1 1 1    7    6  -17 o  339.993   2.5173  4711.98   69.765  4757.20   99.581  4668.40   97.770  341.597   3.5762  338.394   3.5444 3.202698 5.035123 
1 1 1    7    6  -16 o  159.031   1.6266  1030.84   21.086  1021.79   29.912  1039.78   29.730  158.326   2.3177  159.714   2.2836 -1.388077 3.253677 
1 1 1    7    6  -15 o  293.689   2.2537  3515.81   53.953  3551.44   77.022  3481.49   75.600  295.158   3.2013  292.237   3.1736 2.920685 4.507745 
1 1 1    7    6  -14 o  333.877   2.4869  4543.94   67.684  4602.93   96.782  4487.47   94.690  336.016   3.5335  331.776   3.5013 4.240326 4.974341 
1 1 1    7    6  -13 o  373.610   2.5249  5689.79   76.894  5765.17  118.486  5634.95  101.067  376.045   3.8654  371.788   3.3349 4.257111 5.105145 
1 1 1    7    6  -12 o  434.507   2.8694  7696.06  101.632  7655.23  154.662  7727.08  134.829  433.307   4.3788  435.356   3.7993 -2.048645 5.797256 
1 1 1    7    6  -11 o  402.145   2.9027  6592.35   95.153  6734.82  167.601  6524.59  115.587  406.401   5.0592  400.057   3.5445 6.343903 6.177308 
1 1 1    7    6  -10 o  257.785   2.0806  2708.67   43.719  2693.79   75.438  2716.20   53.647  257.055   3.6002  258.137   2.5495 -1.082672 4.411518 
1 1 1    7    6   -9 o  547.654   3.8081 12227.47  169.999 12252.39  295.032 12215.08  207.999  548.064   6.6039  547.340   4.6620 0.7236328 8.083672 
1 1 1    7    6   -8 o  311.989   2.9127  3967.81   74.075   0.0000   0.0000  3967.81   74.075  ?   ?   311.989   2.9127 0.000000 2.912689 
1 1 1    7    6   -7 o  340.735   3.1131  4732.79   86.466  4842.99  176.368  4697.92   99.207  344.586   6.2789  339.468   3.5851 5.117859 7.230370 
1 1 1    7    6   -6 o  307.297   2.5761  3849.25   64.528  4111.89  151.711  3791.24   71.299  317.529   5.8614  304.969   2.8681 12.56006 6.525454 
1 1 1    7    6   -5 f  150.696   2.0314  925.639   24.953   0.0000   0.0000  925.639   24.953  ?   ?   150.696   2.0314 0.000000 2.031361 
1 1 1    7    6   -4 o  374.805   3.3590  5726.69  102.624   0.0000   0.0000  5726.69  102.624  ?   ?   374.805   3.3590 0.000000 3.358980 
1 1 1    7    6   -3 o  325.617   2.4536  4321.83   65.124  4303.10  112.326  4331.31   79.929  324.876   4.2416  325.966   3.0081 -1.089355 5.199978 
1 1 1    7    6   -2 f  403.244   2.6975  6628.23   88.668  6669.78  136.053  6597.56  116.905  404.470   4.1265  402.290   3.5650 2.180450 5.453186 
1 1 1    7    6   -1 o  271.122   2.1618  2996.21   47.777  3043.88   68.281  2950.48   66.876  273.259   3.0654  269.034   3.0495 4.225159 4.323888 
1 1 1    7    6    0 o  470.148   3.0804  9010.51  118.054  9295.40  184.966  8814.70  153.349  477.467   4.7524  464.983   4.0458 12.48413 6.241319 
1 1 1    7    6    1 o  599.891   4.1450 14671.79  202.691 15025.73  292.436 14344.54  281.191  606.987   5.9104  593.075   5.8164 13.91254 8.292372 
1 1 1    7    6    2 f  304.744   2.3424  3785.45   58.189  3828.01   82.886  3744.10   81.708  306.437   3.3182  303.060   3.3075 3.377045 4.685113 
1 1 1    7    6    3 o  597.681   3.8236 14563.25  186.284 14990.05  291.447 14268.45  242.221  606.266   5.8974  591.544   5.0233 14.72186 7.746780 
1 1 1    7    6    4 o  334.792   2.5069  4568.83   68.415  4270.02  112.547  4743.95   86.161  323.624   4.2664  341.138   3.0984 -17.51376 5.272779 
1 1 1    7    6    5 f  387.686   3.0890  6126.90   97.618  6092.52  217.939  6135.53  109.183  386.463   6.9182  387.951   3.4526 -1.487213 7.731820 
1 1 1    7    6    6 o  264.775   2.1257  2857.56   45.879  2723.99   77.225  2930.42   57.036  258.492   3.6650  268.123   2.6096 -9.631622 4.499138 
1 1 1    7    6    7 o   93.755   1.8524  358.280   14.156  459.861   34.042  337.041   15.566  106.133   3.9417   90.933   2.1000 15.20000 4.466240 
1 1 1    7    6    8 o  364.897   2.9384  5427.70   87.402  5412.29  195.387  5431.56   97.725  364.262   6.5803  365.019   3.2844 -0.7571716 7.354415 
1 1 1    7    6    9 o  269.734   2.1465  2965.62   47.195  3107.23   84.473  2901.36   56.906  276.075   3.7536  266.791   2.6167 9.284027 4.575676 
1 1 1    7    6   10 o  437.236   3.4158  7793.50  121.745  7925.40  195.204  7709.54  155.747  440.846   5.4321  434.843   4.3939 6.003357 6.986700 
1 1 1    7    6   11 o  530.347   3.6977 11466.74  159.855 11574.91  279.130 11413.95  195.000  532.703   6.4281  529.091   4.5213 3.612061 7.858976 
1 1 1    7    6   12 o  396.395   2.8651  6405.16   92.577  6454.13  161.240  6381.08  113.072  397.844   4.9719  395.633   3.5061 2.210419 6.083804 
1 1 1    7    6   13 o  327.329   2.2744  4367.37   60.685  4347.78   92.391  4382.24   80.480  326.572   3.4707  327.874   3.0113 -1.301300 4.594913 
1 1 1    7    6   14 o   84.108   1.8777  288.346   12.873  309.047   16.667  257.736   20.268   87.042   2.3513   79.452   3.1356 7.589729 3.919262 
1 1 1    7    6   15 o  285.262   2.4205  3316.99   56.285  3313.09   89.019  3319.58   72.649  285.069   3.8309  285.362   3.1232 -0.2933044 4.942657 
1 1 1    7    6   16 o  185.962   1.7254  1409.55   26.155  1377.41   36.715  1442.67   37.269  183.823   2.4502  188.128   2.4303 -4.304688 3.451071 
1 1 1    7    6   17 o  232.870   1.9367  2210.38   36.763  2198.83   52.059  2221.87   51.922  232.251   2.7498  233.465   2.7283 -1.214142 3.873616 
1 1 1    7    6   18 o  298.492   2.1147  3631.72   51.454  3670.46   79.267  3603.51   67.641  300.060   3.2408  297.319   2.7909 2.740173 4.276912 
1 1 1    7    6   19 o  577.098   3.6925 13578.02  173.703 13622.65  266.123 13544.89  229.280  577.928   5.6490  576.328   4.8805 1.600098 7.465276 
1 1 1    7    6   20 o  358.711   2.4361  5245.10   71.232  5110.26  106.712  5353.47   95.664  354.039   3.6977  362.379   3.2386 -8.339935 4.915379 
1 1 1    7    6   21 o  373.989   2.5209  5701.51   76.850  5769.86  118.575  5652.01  100.915  376.186   3.8668  372.341   3.3249 3.844360 5.099714 
1 1 1    7    6   22 o  696.734   4.4055 19794.56  250.206 19692.48  380.501 19872.33  332.106  694.716   6.7191  697.976   5.8371 -3.259827 8.900496 
1 1 1    7    6   23 o  219.303   1.7303  1960.33   30.932  1958.55   47.330  1961.65   40.866  219.192   2.6490  219.371   2.2853 -0.1787872 3.498549 
1 1 1    7    6   24 o  215.980   1.7158  1901.36   30.208  1845.99   45.542  1944.87   40.365  212.800   2.6254  218.430   2.2670 -5.630035 3.468766 
1 1 1    7    6   25 o  332.494   2.2947  4506.48   62.194  4444.44   94.141  4554.54   82.847  330.165   3.4980  334.243   3.0407 -4.078491 4.634840 
1 1 1    7    6   26 o  564.655   3.6197 12999.86  166.608 12974.45  254.175 13019.01  220.613  563.959   5.5290  564.989   4.7902 -1.030640 7.315487 
1 1 1    7    6   27 o  130.653   1.4582  695.783   15.530  703.118   24.055  690.542   20.335  131.334   2.2469  130.157   1.9167 1.177078 2.953339 
1 1 1    7    6   28 o  596.778   4.1192 14523.45  200.382 14830.95  288.389 14236.42  278.628  602.893   5.8682  590.695   5.7866 12.19873 8.241386 
1 1 1    7    6   29 o  794.184   5.3962 25732.15  349.340 25639.83  492.505 25825.62  495.593  792.369   7.6251  795.231   7.6453 -2.861450 10.79786 
1 1 1    7    6   30 o  503.123   3.8632 10322.49  158.438 10335.47  204.555 10303.02  250.488  503.351   4.9854  502.448   6.1159 0.9025879 7.890413 
1 1 1    7    6   31 o  212.661   2.2933  1843.59   39.754  1895.22   57.131  1795.13   55.351  215.596   3.2508  209.827   3.2362 5.769424 4.587017 
1 1 1    7    6   32 f  499.984   3.5031 10193.57  142.774 10025.20  199.314 10371.01  204.615  495.721   4.9325  504.193   4.9786 -8.472534 7.008250 
1 1 1    7    6   33 o  182.940   1.7123  1364.20   25.535  1336.94   35.961  1391.92   36.264  181.092   2.4361  184.779   2.4076 -3.686829 3.425071 
1 1 1    7    6   34 o   44.137   2.1788   79.610   7.8147   82.676   11.160   76.659   10.947   44.925   3.0658   43.247   3.1263 1.678204 4.378647 
1 1 1    7    6   35 o   67.803   1.6584  187.395   9.1657  179.214   12.776  196.073   13.157   66.260   2.3692   69.312   2.3321 -3.051918 3.324408 
1 1 1    7    6   36 o  196.686   1.7801  1576.95   28.541  1525.95   40.240  1628.58   40.487  193.463   2.5517  199.865   2.4851 -6.401382 3.561815 
1 1 1    7    6   37 o  176.497   2.0927  1269.93   30.108  1358.40   45.997  1203.61   39.824  182.517   3.0916  171.810   2.8435 10.70715 4.200473 
1 1 1    7    6   38 o  290.200   2.4607  3433.57   58.208  3485.61   76.475  3361.91   89.747  292.357   3.2090  287.088   3.8350 5.269470 5.000513 
1 1 1    7    6   39 o  191.432   2.9685  1494.38   46.322   0.0000   0.0000  1494.38   46.322  ?   ?   191.432   2.9685 0.000000 2.968522 
1 1 1    7    6   40 o  177.257   2.5125  1281.10   36.304  1281.10   36.304   0.0000   0.0000  177.257   2.5125  ?   ?  0.000000 2.512519 
1 1 1    7    6   41 f  330.585   2.7247  4456.42   73.424  4604.78   97.962  4266.24  110.914  335.984   3.5769  323.345   4.2081 12.63876 5.522862 
1 1 1    7    6   42 o  267.656   2.5947  2921.23   56.611  2920.37   80.909  2922.05   79.237  267.551   3.7098  267.634   3.6320 -0.8251953E-01 5.191772 
1 1 1    7    6   43 f  258.105   2.2715  2716.22   47.791  2796.08   77.833  2667.89   60.549  261.792   3.6473  255.767   2.9042 6.025162 4.662299 
1 1 1    7    6   44 o  201.451   1.8154  1654.47   29.811  1644.41   42.951  1663.82   41.408  200.809   2.6240  201.995   2.5148 -1.185837 3.634491 
1 1 1    7    6   45 o  145.931   1.6229  868.157   19.305  867.067   28.379  869.096   26.339  145.821   2.3874  145.996   2.2132 -0.1754150 3.255460 
1 1 1    7    6   46 f  242.977   2.0134  2407.09   39.879  2449.13   57.923  2369.21   54.986  245.043   2.8998  241.018   2.7987 4.025101 4.030144 
1 1 1    7    6   47 o  222.207   2.0772  2013.23   37.624  1950.31   59.168  2055.95   48.750  218.640   3.3199  224.523   2.6636 -5.883621 4.256351 
1 1 1    7    6   48 o  251.390   2.0553  2576.79   42.118  2625.28   61.262  2533.32   57.999  253.689   2.9625  249.214   2.8551 4.475266 4.114329 
1 1 1    7    6   49 o  207.764   1.8470  1759.93   31.281  1797.09   45.784  1727.40   42.839  209.907   2.6758  205.803   2.5536 4.103821 3.698748 
1 1 1    7    6   50 o  248.490   2.0424  2517.74   41.369  2538.83   59.840  2498.44   57.255  249.471   2.9426  247.486   2.8381 1.984680 4.088278 
1 1 1    7    6   51 o  130.638   1.6093  695.767   17.137  682.153   25.413  707.120   23.208  129.331   2.4106  131.685   2.1621 -2.353546 3.238096 
1 1 1    7    6   52 f  474.297   3.3609  9179.97  129.939  9037.11  182.190  9327.87  185.373  470.302   4.7524  477.806   4.7595 -7.503998 6.725910 
1 1 1    7    6   53 o  161.336   1.8277  1061.29   24.036  1057.22   40.110  1063.57   30.024  160.973   3.0568  161.493   2.2808 -0.5201721 3.813877 
1 1 1    7    6   54 o  109.025   1.4442  484.581   12.835  479.954   17.667  489.751   18.677  108.492   1.9977  109.591   2.0907 -1.099258 2.891692 
1 1 1    7    6   55 o   81.158   1.5947  268.535   10.550  263.168   14.040  275.494   15.988   80.304   2.1467   82.153   2.3900 -1.848228 3.212561 
1 1 1    7    6   56 o   49.833   1.8927  101.404   7.6745   95.824   11.118  106.484   10.607   48.382   2.8314   51.029   2.5582 -2.647797 3.815855 
1 1 1    7    6   57 o  254.862   2.0654  2648.80   42.909  2686.93   53.771  2581.95   71.196  256.651   2.5702  251.501   3.4728 5.150223 4.320477 
1 1 1    7    6   58 o   25.867   2.7142   27.597   5.6380   29.682   10.012   26.629   6.8226   26.542   4.8044   25.317   3.3911 1.224169 5.880620 
1 1 1    7    6   59 o  170.051   1.9018  1179.17   26.363  1168.49   29.268  1225.11   60.695  169.269   2.1212  173.161   4.3000 -3.891922 4.794694 
1 1 1    7    6   60 o  188.025   1.6291  1441.43   24.969  1415.67   33.360  1474.25   37.653  186.309   2.1966  190.111   2.4297 -3.801285 3.275448 
1 1 1    7    6   61 o   67.703   2.1566  187.131   11.886  183.618   15.079  192.898   19.318   67.027   2.7658   68.651   3.4633 -1.623276 4.432109 
1 1 1    7    6   62 o  226.163   2.1573  2086.14   39.771  2075.34   51.179  2102.60   63.191  225.526   2.7839  226.938   3.4159 -1.411484 4.406693 
1 1 1    7    6   63 o  104.303   1.8842  443.640   16.020  435.492   20.549  456.267   25.581  103.322   2.4398  105.693   2.9721 -2.371216 3.845244 
1 1 1    7    6   64 o  211.044   2.0953  1816.55   36.046  1891.96   47.602  1715.18   55.190  215.330   2.7120  204.967   3.3032 10.36311 4.273905 
1 1 1    7    6   65 o  153.567   1.8923  961.728   23.688  953.091   26.325  998.476   54.301  152.865   2.1126  156.231   4.2679 -3.365906 4.762181 
1 1 1    7    6   66 o  370.034   2.7599  5587.89   83.248  5607.65  102.224  5548.98  143.445  370.569   3.3842  368.273   4.7784 2.295929 5.855360 
1 1 1    7    6   67 o  248.139   2.1161  2511.53   42.802  2488.62   52.126  2558.96   74.990  246.956   2.5894  250.271   3.6759 -3.315430 4.496330 
1 1 1    7    6   68 f  284.225   2.3066  3295.74   53.441  3326.88   65.900  3235.94   91.329  285.494   2.8317  281.364   3.9820 4.130096 4.886239 
1 1 1    7    6   69 o   46.286   3.3398   87.950   12.516   96.639   16.492   76.148   19.220   48.433   4.2195   42.734   5.6564 5.698891 7.056793 
1 1 1    7    6   70 o  151.235   1.9375  932.882   23.886  925.143   30.699  944.754   38.023  150.570   2.5012  152.112   3.0665 -1.541458 3.957211 
1 1 1    7    6   71 o  118.207   1.8879  569.912   18.191  598.786   23.650  528.078   28.467  121.137   2.3951  113.675   3.0750 7.461525 3.897652 
1 1 1    7    6   72 o  164.953   1.9172  1109.88   25.779  1124.71   33.472  1088.25   40.418  166.007   2.4735  163.238   3.0375 2.768829 3.917232 
1 1 1    7    6   73 o   71.170   2.1388  206.851   12.394  204.554   15.867  210.446   19.851   70.727   2.7574   71.679   3.4071 -0.9517746 4.383114 
1 1 1    7    6   74 o  199.530   2.0554  1624.37   33.431  1659.54   52.140  1599.82   43.564  201.531   3.1739  197.941   2.6999 3.589890 4.166946 
1 1 1    7    6   75 o  187.106   2.0126  1428.38   30.696  1454.29   47.322  1409.56   40.331  188.660   3.0772  185.794   2.6630 2.865448 4.069453 
1 1 1    7    6   76 o  201.256   1.8925  1652.48   31.047  1680.89   43.630  1623.34   44.189  202.883   2.6382  199.367   2.7191 3.515381 3.788584 
1 1 1    7    6   77 o   43.123   2.6766   76.244   9.3621   70.774   11.940   84.974   15.084   41.441   3.5694   45.361   4.1245 -3.920677 5.454558 
1 1 1    7    6   78 o  154.848   1.7339  978.214   21.886  966.015   26.704  1003.17   38.197  153.842   2.1294  156.663   2.9911 -2.820740 3.671623 
1 1 1    7    6   79 o   98.141   1.6608  392.931   13.287  403.604   17.380  377.921   20.611   99.434   2.1443   96.144   2.6323 3.289574 3.395152 
1 1 1    7    6   80 o  162.630   1.6320  1079.00   21.634  1084.82   28.496  1071.07   33.241  163.012   2.1445  161.925   2.5184 1.086685 3.307726 
1 1 1    7    6   81 o   82.949   1.9185  280.820   12.972  294.099   18.226  267.189   18.467   84.794   2.6401   80.798   2.8081 3.995728 3.854279 
1 1 1    7    6   82 o   89.795   1.8443  329.085   13.500  353.748   16.385  276.960   23.820   93.075   2.1596   82.146   3.5658 10.92879 4.168827 
1 1 1    7    6   83 o   81.275   1.9017  269.652   12.599  275.681   15.256  256.721   22.343   82.119   2.2813   79.083   3.4745 3.036240 4.156471 
1 1 1    7    6   84 o  117.163   1.7222  560.253   16.448  553.827   19.838  574.388   29.421  116.451   2.0899  118.418   3.0504 -1.967262 3.697646 
1 1 1    7    6   85 o   99.726   1.7889  405.993   14.542  386.437   17.407  451.188   26.462   97.255   2.1957  104.917   3.0975 -7.662415 3.796745 
1 1 1    7    6   86 o   64.537   2.0040  170.290   10.530  174.486   13.613  164.041   16.614   65.263   2.5638   63.180   3.2367 2.083450 4.129061 
1 1 1    7    6   87 o  104.487   1.6827  445.723   14.332  467.490   18.909  416.333   21.971  106.949   2.1689  100.819   2.6758 6.129761 3.444483 
1 1 1    7    6   88 o   65.906   1.9511  177.626   10.470  178.418   13.557  176.456   16.482   65.979   2.5255   65.523   3.0946 0.4559097 3.994322 
1 1 1    7    6   89 o   25.434   4.1259   27.339   8.2613   36.329   10.860   14.993   12.727   29.277   4.7105   19.559   6.6650 9.718035 8.161584 
1 1 1    7    6   90 o   85.631   1.6628  299.490   11.606  305.621   15.238  291.018   17.912   86.412   2.1650   84.240   2.6116 2.171944 3.392309 
1 1 1    7    6   91 o   48.776   2.3868   97.659   9.4608   90.867   11.246  114.104   17.499   46.954   2.9532   52.380   4.1317 -5.425930 5.078654 
1 1 1    7    6   92 o   66.126   1.9670  179.012   10.591  186.723   12.768  162.005   18.961   67.477   2.3247   62.536   3.7367 4.941608 4.400812 
1 1 1    7    6   93 o   43.372   2.5100   77.414   8.8363   75.349   10.612   82.080   15.956   42.686   3.0703   44.214   4.4895 -1.527588 5.438979 
1 1 1    7    6   94 o   44.630   2.2684   81.855   8.2252   62.829   10.588  110.809   13.062   38.875   3.3747   51.772   3.1094 -12.89679 4.588826 
1 1 1    7    6   95 o   77.285   1.6765  244.279   10.562  230.967   13.866  262.681   16.302   75.009   2.2704   79.936   2.5050 -4.927299 3.380739 
1 1 1    7    6   96 o   20.294   4.5189   17.885   7.2835   16.099   9.5432   20.377   11.272   19.274   5.6856   21.527   6.1296 -2.253332 8.360518 
1 1 1    7    6   97 o   42.860   2.3197   75.673   8.0742   80.216   10.714   69.703   12.283   43.975   3.0071   40.780   3.7365 3.194965 4.796234 
1 1 1    7    6   98 o   70.328   1.8695  202.850   10.708  220.206   15.234  185.905   15.053   73.080   2.5613   67.077   2.7590 6.002815 3.764630 
1 1 1    7    6   99 o   53.690   2.0075  118.464   8.7703  124.300   11.663  110.870   13.305   54.843   2.6164   51.618   3.1775 3.225376 4.116072 
1 1 1    7    6  100 o   62.108   1.8458  158.332   9.3345  155.678   12.456  161.731   14.097   61.406   2.4937   62.496   2.7742 -1.089890 3.730240 
1 1 1    7    6  101 o   39.283   2.6747   64.059   8.5138   62.774   12.253   65.258   11.838   38.472   3.9640   39.316   3.7387 -0.8436890 5.448942 
1 1 1    7    6  102 o   39.764   2.6468   65.671   8.5304   87.524   12.415   46.126   11.741   45.687   3.3570   32.674   4.5299 13.01284 5.638169 
1 1 1    7    6  103 o   17.983   4.9378   14.352   7.4582   17.232   10.585   11.513   10.510   19.641   6.0321   16.963   6.0389 2.678286 8.535496 
1 1 1    7    6  104 o   33.171   2.8435   46.018   7.6145   50.701   10.131   39.939   11.544   34.554   3.6520   30.153   4.8619 4.400824 6.080761 
1 1 1    7    6  105 o   25.205   3.7476   27.308   7.4659   25.772   9.8692   29.364   11.416   23.950   5.2043   25.420   5.6552 -1.470154 7.685400 
1 1 1    7    6  106 o   14.783   5.0493   8.9882   7.3051   4.4844   9.6389   15.066   11.197   13.688   5.5486   18.568   6.2522 -4.879811 8.359290 
1 1 1    7    6  107 o   37.183   3.2383   58.371   9.7173   86.300   15.970   41.953   12.245   44.631   4.4489   30.695   5.0707 13.93658 6.745737 
1 1 1    7    6  108 o  110.037   1.7292  497.811   15.511  500.017   22.073  495.660   21.800  109.789   2.4664  109.325   2.4463 0.4637680 3.473815 
1 1 1    7    6  109 o   47.442   2.3130   93.497   8.9181   87.192   11.665  102.366   13.835   45.436   3.1694   49.075   3.4811 -3.638607 4.707808 
1 1 1    7    6  110 o   29.790   3.3334   37.947   7.9560   40.278   10.444   34.725   12.280   30.222   4.3660   27.324   5.6983 2.897778 7.178643 
1 1 1    7    6  111 o   67.349   1.9885  187.717   10.905  196.739   13.490  170.708   18.523   68.705   2.4125   63.128   3.6147 5.576744 4.345856 
1 1 1    7    6  112 o   27.683   3.5173   33.215   7.7582   34.894   10.121   30.823   12.081   27.815   4.6261   25.346   5.9500 2.468868 7.536778 
1 1 1    7    6  113 o   33.478   3.0410   47.839   8.2084   49.921   10.760   44.941   12.695   33.671   3.9984   31.177   5.1767 2.493847 6.541032 
1 1 1    7    6  114 o   11.333   4.7939   1.8658   7.6325   4.4252   9.9492  -1.7946   11.898   13.387   5.5544   12.517   5.6170 0.8705053 7.899512 
1 1 1    7    6  115 o   38.081   2.9381   61.932   9.0499   71.640   12.196   50.037   13.500   40.415   3.7446   32.641   5.2520 7.773396 6.450201 
1 1 1    7    6  116 o   35.979   3.3809   56.358   9.7993   59.245   12.067   50.769   16.792   36.329   4.1492   31.334   6.7721 4.995497 7.942060 
1 1 1    7    6  117 o   23.826   5.0599   27.169   9.5234   19.135   11.641   43.430   16.560   19.306   6.3719   28.301   7.1710 -8.995708 9.592883 
1 1 1    7    6  118 o   20.422   5.7687   21.066   10.024   22.653   11.359   15.481   21.311   20.891   6.2133   18.599   7.9439 2.292007 10.08519 
1 1 1    7    6  119 o   9.8156   4.5913  -6.1373   9.1481  -3.9354   10.125 -15.9199   21.342   10.865   4.9938   13.571   6.5331 -2.705653 8.223144 
1 1 1    7    6  120 o   16.813   5.7992   13.942   9.6428   9.4373   10.812   31.462   21.321   15.068   5.9540   22.326   8.4853 -7.257431 10.36584 
1 1 1    7    6  121 o   11.837   5.3503  -1.4060   11.020  -0.5316   12.415  -4.6541   23.928   12.646   5.7010   15.461   7.2926 -2.814875 9.256470 
1 1 1    7    6  122 o   22.744   5.5689   26.181   10.241   21.771   11.253   47.442   24.708   20.228   6.2206   25.776   9.2499 -5.547876 11.14702 
1 1 1    7    6  123 o   10.207   4.7898  -6.4716   10.093 -20.7309   12.737   17.591   16.546   9.4628   4.6606   18.238   7.3130 -8.774920 8.671871 
1 1 1    7    6  124 f   21.182   5.9112   23.588   10.593   19.152   13.234   31.496   17.671   18.684   6.7612   22.464   7.8447 -3.780535 10.35626 
1 1 1    7    6  125 o   20.870   5.9550   23.083   10.628   14.870   13.412   36.945   17.424   17.080   6.6665   24.409   7.7758 -7.329098 10.24233 
1 1 1    7    6  126 o   12.347   5.3886   2.4173   10.231   12.723   13.074 -13.8610   16.432   16.271   6.5088   11.825   5.7027 4.445758 8.653609 
1 1 1    7    6  127 o   31.932   4.3562   47.899   11.044   34.048   14.026   70.491   17.913   24.447   6.7946   36.501   6.2449 -12.05404 9.228523 
1 1 1    7    6  128 f   12.642   5.4513   3.5768   10.216   9.9402   13.094  -6.3222   16.332   15.334   6.3679   12.789   6.0300 2.544552 8.769919 
1 1 1    7    6  129 o   12.377   5.4227   2.3079   10.450   5.4960   13.394  -2.6504   16.704   14.199   6.1818   13.513   6.2817 0.6867466 8.813318 
1 1 1    7    7    0 o  701.017   6.7716 20040.54  386.952 20005.83  669.314 20057.97  474.238  700.013   11.730  701.222   8.2967 -1.208984 14.36737 
1 1 1    7    7    1 o  124.031   1.5814  627.041   15.988  665.261   28.329  609.177   19.367  127.748   2.7205  122.250   1.9435 5.497955 3.343380 
1 1 1    7    7    2 o  213.488   2.0225  1857.79   35.196  1910.24   56.625  1824.77   44.930  216.464   3.2091  211.575   2.6052 4.888870 4.133448 
1 1 1    7    7    3 o  146.256   1.6032  871.885   19.113  909.841   33.781  854.013   23.180  149.396   2.7739  144.747   1.9646 4.649185 3.399157 
1 1 1    7    7    4 o  158.389   1.5141  1022.55   19.549  1042.63   30.096  1007.89   25.712  159.931   2.3086  157.247   2.0059 2.684357 3.058299 
1 1 1    7    7    5 o   62.266   1.7517  158.156   8.8821  191.840   14.004  135.486   11.489   68.555   2.5102   57.599   2.4525 10.95594 3.509400 
1 1 1    7    7    6 o  374.520   2.5303  5717.77   77.248  5854.72  120.112  5621.17  100.879  378.936   3.8885  371.320   3.3329 7.615845 5.121371 
1 1 1    7    7    7 o  265.677   2.5765  2877.33   55.799  2887.64   79.224  2867.17   78.602  266.130   3.6520  265.185   3.6362 0.9443665 5.153527 
1 1 1    7    7    8 o  282.144   2.4060  3245.00   55.335  3315.61   88.966  3200.45   70.668  285.164   3.8273  280.187   3.0941 4.977417 4.921576 
1 1 1    7    7    9 o  410.796   2.9497  6879.53   98.772  6894.20  140.044  6865.01  139.327  411.185   4.1782  410.315   4.1657 0.8708801 5.900024 
1 1 1    7    7   10 o  641.361   4.4029 16774.09  230.184 16658.18  323.767 16892.57  327.322  638.974   6.2160  643.451   6.2406 -4.476990 8.808146 
1 1 1    7    7   11 o  271.860   2.1457  3012.68   47.550  2976.28   81.977  3031.14   58.373  270.178   3.7222  272.683   2.6261 -2.505188 4.555407 
1 1 1    7    7   12 o  325.826   2.4452  4327.63   64.943  4275.85  111.788  4354.01   79.788  323.816   4.2351  326.803   2.9951 -2.987732 5.187156 
1 1 1    7    7   13 o  256.898   2.0631  2690.19   43.203  2824.68   77.670  2629.93   51.988  263.208   3.6201  253.998   2.5109 9.210266 4.405638 
1 1 1    7    7   14 o  232.433   1.9407  2202.16   36.769  2202.85   63.991  2201.82   44.926  232.443   3.3773  232.408   2.3714 0.3414917E-01 4.126709 
1 1 1    7    7   15 o  312.225   2.1920  3973.80   55.790  3954.00   84.963  3988.81   73.971  311.417   3.3470  312.797   2.9011 -1.380798 4.429282 
1 1 1    7    7   16 o  358.706   2.4408  5245.22   71.369  5401.88  111.657  5137.00   92.800  363.976   3.7634  354.962   3.2072 9.014404 4.944621 
1 1 1    7    7   17 o  603.189   3.8511 14836.13  189.353 15104.23  293.733 14645.50  247.687  608.416   5.9227  599.196   5.0710 9.219849 7.797008 
1 1 1    7    7   18 o  117.080   1.5639  558.741   14.925  578.990   26.063  548.861   18.206  119.174   2.6830  116.038   1.9247 3.135361 3.301959 
1 1 1    7    7   19 o  245.168   1.8559  2450.10   37.091  2523.24   57.825  2398.97   48.347  248.780   2.8514  242.586   2.4449 6.194626 3.756097 
1 1 1    7    7   20 o  148.818   1.4941  902.718   18.125  925.062   28.118  886.833   23.708  150.641   2.2899  147.499   1.9718 3.141998 3.021862 
1 1 1    7    7   21 o  229.430   1.7856  2145.64   33.395  2147.83   51.235  2144.03   44.033  229.529   2.7384  229.334   2.3555 0.1953583 3.612057 
1 1 1    7    7   22 o  726.011   4.5857 21499.91  271.382 21636.71  416.998 21399.40  357.434  727.928   7.0276  724.098   6.0557 3.829468 9.276795 
1 1 1    7    7   23 o  397.708   2.6600  6448.43   86.233  6490.13  132.483  6417.77  113.591  398.917   4.0742  396.720   3.5125 2.196899 5.379303 
1 1 1    7    7   24 o  301.335   2.1342  3701.56   52.423  3689.60   79.964  3710.58   69.424  300.810   3.2611  301.681   2.8231 -0.8703918 4.313322 
1 1 1    7    7   25 o  215.727   1.7212  1897.01   30.268  1884.82   46.211  1906.16   40.056  215.015   2.6366  216.237   2.2725 -1.222015 3.480800 
1 1 1    7    7   26 o  107.701   1.4535  472.805   12.761  479.561   19.753  467.965   16.717  108.460   2.2342  107.144   1.9141 1.316170 2.942010 
1 1 1    7    7   27 o  297.798   2.1152  3615.26   51.345  3635.06   78.855  3600.70   67.652  298.571   3.2400  297.175   2.7928 1.396027 4.277519 
1 1 1    7    7   28 o  273.022   2.1441  3038.76   47.717  2997.33   67.071  3081.22   67.901  271.124   3.0348  274.892   3.0303 -3.768097 4.288632 
1 1 1    7    7   29 o   92.290   1.7044  347.203   12.822  334.272   20.483  355.534   16.442   90.502   2.7798   93.387   2.1598 -2.885124 3.520274 
1 1 1    7    7   30 o  249.787   2.2024  2543.65   44.843  2568.13   71.464  2527.74   57.593  250.938   3.4937  248.984   2.8377 1.953873 4.500930 
1 1 1    7    7   31 o   62.016   1.8476  156.921   9.3298  146.845   14.015  164.939   12.503   59.942   2.8767   63.559   2.4176 -3.617088 3.757697 
1 1 1    7    7   32 f   67.060   1.8576  183.463   10.144  212.140   16.632  166.473   12.802   72.073   2.8365   63.851   2.4642 8.221611 3.757361 
1 1 1    7    7   33 f  403.309   2.9216  6632.96   96.048  6510.32  116.127  6898.51  170.886  399.512   3.5659  411.084   5.0997 -11.57169 6.222702 
1 1 1    7    7   34 o   84.706   1.5915  292.486   10.989  294.954   14.998  289.626   16.148   85.029   2.1656   84.250   2.3536 0.7793198 3.198338 
1 1 1    7    7   35 o  216.844   1.7488  1916.86   30.911  1940.72   41.428  1886.91   46.429  218.171   2.3295  215.114   2.6478 3.057510 3.526644 
1 1 1    7    7   36 o  118.460   1.4814  572.026   14.305  541.776   18.862  612.977   21.947  115.277   2.0073  122.615   2.1958 -7.337753 2.975017 
1 1 1    7    7   37 o  157.949   1.4254  1016.97   18.352  1003.40   26.462  1029.55   25.473  156.878   2.0693  158.912   1.9665 -2.033936 2.854637 
1 1 1    7    7   38 f   68.583   1.5348  191.743   8.5804  164.451   12.754  214.309   11.597   63.457   2.4704   72.475   1.9648 -9.018188 3.156470 
1 1 1    7    7   39 o  204.476   1.6962  1704.50   28.273  1677.92   44.021  1723.16   36.885  202.840   2.6624  205.576   2.2011 -2.735550 3.454460 
1 1 1    7    7   40 o  227.939   1.6699  2118.12   31.028  2134.77   44.696  2102.62   43.108  228.804   2.3964  227.078   2.3289 1.726288 3.341630 
1 1 1    7    7   41 o  165.588   1.4502  1117.75   19.575  1058.32   27.708  1176.96   27.658  161.108   2.1099  169.903   1.9970 -8.794296 2.905090 
1 1 1    7    7   42 o  180.923   1.6139  1334.45   23.801  1312.21   37.417  1349.56   30.847  179.376   2.5590  181.930   2.0801 -2.553925 3.297727 
1 1 1    7    7   43 o  246.899   1.8793  2485.40   37.822  2553.58   51.381  2404.77   55.878  250.228   2.5190  242.809   2.8232 7.419495 3.783634 
1 1 1    7    7   44 o  305.059   2.3524  3795.04   58.496  3820.39   84.168  3771.36   81.356  305.985   3.3745  304.025   3.2828 1.960236 4.707859 
1 1 1    7    7   45 o  247.801   2.2247  2504.02   44.938  2451.78   71.197  2538.62   57.938  245.103   3.5635  249.466   2.8491 -4.362839 4.562464 
1 1 1    7    7   46 o  162.718   1.6853  1079.47   22.354  1113.68   33.355  1051.58   30.118  165.247   2.4762  160.581   2.3009 4.666229 3.380191 
1 1 1    7    7   47 o  174.948   1.7273  1247.86   24.633  1241.33   35.843  1253.70   33.910  174.458   2.5204  175.331   2.3726 -0.8739014 3.461503 
1 1 1    7    7   48 o  283.762   2.2382  3283.68   51.771  3449.77   76.714  3144.77   70.156  290.761   3.2367  277.624   3.1001 13.13736 4.481825 
1 1 1    7    7   49 o  135.729   1.7690  751.115   19.572  742.320   26.714  761.305   28.755  134.910   2.4292  136.618   2.5821 -1.708221 3.545151 
1 1 1    7    7   50 o  143.155   1.7807  835.574   20.779  818.251   28.087  856.520   30.885  141.640   2.4326  144.907   2.6147 -3.266403 3.571312 
1 1 1    7    7   51 o   38.028   2.5427   59.250   7.8367   54.926   12.978   61.732   9.8315   36.395   4.4681   38.768   3.1379 -2.373711 5.459884 
1 1 1    7    7   52 o   79.387   1.6750  256.953   10.839  258.193   17.041  256.111   14.047   79.514   2.6328   79.217   2.1774 0.2968750 3.416548 
1 1 1    7    7   53 o  162.203   1.6625  1072.71   21.981  1059.07   31.930  1084.99   30.306  161.137   2.4309  163.104   2.2795 -1.967468 3.332432 
1 1 1    7    7   54 o  118.014   1.5700  567.824   15.104  590.609   22.866  550.189   20.117  120.335   2.3311  116.151   2.1247 4.183601 3.154123 
1 1 1    7    7   55 o   32.938   2.5445   44.521   6.7789   32.564   11.777   50.445   8.2898   27.741   5.4026   35.039   2.9292 -7.297684 6.145613 
1 1 1    7    7   56 o  123.225   1.5819  619.094   15.889  622.938   23.807  616.006   21.337  123.580   2.3633  122.900   2.1298 0.6804581 3.181426 
1 1 1    7    7   57 o  165.348   1.6875  1114.77   22.744  1101.38   33.123  1126.71   31.286  164.314   2.4730  166.202   2.3093 -1.887833 3.383547 
1 1 1    7    7   58 o   29.371   2.5925   35.467   6.1432   25.205   10.430   40.918   7.6017   24.342   5.3981   31.523   2.9943 -7.180511 6.172888 
1 1 1    7    7   59 o   96.326   1.5824  378.319   12.425  376.708   16.497  380.431   18.889   96.107   2.1058   96.571   2.3995 -0.4639816 3.192505 
1 1 1    7    7   60 o  107.223   1.7230  468.797   15.060  464.015   18.442  478.369   26.092  106.662   2.1211  108.223   2.9604 -1.560799 3.641852 
1 1 1    7    7   61 o  222.790   2.1454  2024.52   38.962  1991.09   49.659  2078.06   62.840  220.889   2.7580  225.587   3.4173 -4.698242 4.391425 
1 1 1    7    7   62 f  175.852   1.9800  1261.21   28.382  1262.42   36.339  1259.32   45.447  175.899   2.5344  175.629   3.1745 0.2698669 4.062080 
1 1 1    7    7   63 o  114.799   1.9447  537.492   18.198  523.849   22.924  560.741   29.925  113.309   2.4820  117.151   3.1365 -3.842361 3.999708 
1 1 1    7    7   64 o   12.193   5.4736  -5.4006   11.310  -5.3559   14.395  -5.4728   18.284   14.079   6.2574   16.121   7.1140 -2.041915 9.474338 
1 1 1    7    7   65 o   88.472   2.0456  319.268   14.753  305.087   17.762  350.809   26.490   86.431   2.5238   92.603   3.5157 -6.172348 4.327751 
1 1 1    7    7   66 o   38.553   3.4929   61.215   10.858   61.545   13.171   60.515   19.185   38.561   4.2611   37.869   6.4456 0.6916428 7.726768 
1 1 1    7    7   67 o  105.087   1.9986  450.455   17.120  436.405   19.007  510.874   39.414  103.424   2.2545  111.663   4.3384 -8.239456 4.889243 
1 1 1    7    7   68 o   17.364   5.9630   11.285   10.192   8.9996   12.698   15.422   17.087   17.379   6.5611   21.214   7.6818 -3.835325 10.10238 
1 1 1    7    7   69 o  178.728   1.9837  1303.11   28.901  1308.98   37.312  1294.30   45.695  179.077   2.5560  178.001   3.1493 1.075577 4.056008 
1 1 1    7    7   70 f  203.596   2.0774  1691.22   34.476  1705.66   44.650  1669.91   54.254  204.392   2.6799  202.148   3.2925 2.243713 4.245290 
1 1 1    7    7   71 o  100.173   1.7933  409.322   14.643  381.148   17.545  474.007   26.584   96.642   2.2271  107.672   3.0319 -11.03021 3.761977 
1 1 1    7    7   72 o   66.195   2.2828  179.051   12.299  178.613   15.873  179.710   19.457   66.056   2.9554   66.187   3.6201 -0.1314621 4.673283 
1 1 1    7    7   73 o  143.928   1.7372  845.034   20.381  810.742   24.527  921.546   36.637  140.947   2.1348  150.176   2.9928 -9.228790 3.676174 
1 1 1    7    7   74 o  168.763   1.7849  1161.93   24.554  1132.02   29.713  1226.35   43.606  166.536   2.1888  173.211   3.0884 -6.674576 3.785392 
1 1 1    7    7   75 o  134.742   1.7252  740.689   18.948  742.474   23.285  737.190   32.601  134.871   2.1180  134.294   2.9781 0.5767822 3.654460 
1 1 1    7    7   76 o   28.263   4.0555   33.398   9.0761   32.332   11.120   35.526   15.709   27.608   5.1299   28.729   6.8120 -1.121037 8.527557 
1 1 1    7    7   77 o   59.880   2.4012  146.679   11.697  142.342   13.135  163.293   25.710   58.953   2.7407   62.806   5.0648 -3.853085 5.758832 
1 1 1    7    7   78 o   87.319   1.9026  311.190   13.542  322.451   16.145  284.464   24.873   88.834   2.2313   83.248   3.6744 5.585876 4.298876 
1 1 1    7    7   79 o  189.607   1.8752  1467.38   28.983  1478.60   35.170  1443.62   51.165  190.268   2.2676  187.772   3.3428 2.495865 4.039335 
1 1 1    7    7   80 o  105.937   1.7607  458.022   15.204  474.536   18.880  427.550   25.646  107.794   2.1487  102.163   3.0831 5.630516 3.757997 
1 1 1    7    7   81 o  142.009   1.7713  823.143   20.505  787.655   28.268  862.552   29.789  138.813   2.4982  145.260   2.5157 -6.446884 3.545393 
1 1 1    7    7   82 o  103.044   1.6860  433.385   14.162  430.221   18.468  437.900   22.063  102.615   2.2079  103.443   2.6187 -0.8276215 3.425207 
1 1 1    7    7   83 o   62.294   2.1281  158.732   10.790  162.342   14.196  153.792   16.606   62.920   2.7746   61.152   3.3441 1.767895 4.345262 
1 1 1    7    7   84 o   82.379   1.8804  277.170   12.627  298.047   16.799  250.060   19.143   85.333   2.4175   78.061   3.0142 7.271637 3.863898 
1 1 1    7    7   85 o   68.919   2.2056  194.395   12.375  181.239   14.552  228.770   23.522   66.475   2.6910   74.459   3.8889 -7.983543 4.729171 
1 1 1    7    7   86 f   53.130   2.4429  115.771   10.551  116.630   12.473  113.609   19.784   53.262   2.8837   52.193   4.7005 1.069096 5.514577 
1 1 1    7    7   87 o  131.057   1.7189  701.601   18.363  685.354   22.118  737.649   32.945  129.460   2.0959  134.072   3.0145 -4.611908 3.671541 
1 1 1    7    7   88 o   28.256   3.5913   33.397   8.0850   35.645   10.643   30.328   12.432   28.968   4.6656   26.402   5.9228 2.565905 7.539720 
1 1 1    7    7   89 o   39.982   2.5938   65.822   8.4080   65.419   10.872   66.421   13.263   39.717   3.3905   39.855   4.1428 -0.1387825 5.353316 
1 1 1    7    7   90 o   29.296   3.4035   35.841   7.9769   34.328   10.322   38.085   12.569   28.381   4.6204   29.721   5.3864 -1.340637 7.096604 
1 1 1    7    7   91 o   57.096   2.0091  133.612   9.3361  141.094   12.287  123.390   14.361   58.569   2.5799   54.618   3.2403 3.951702 4.141849 
1 1 1    7    7   92 o   69.947   1.8036  200.315   10.275  193.448   13.491  209.801   15.856   68.613   2.4159   71.379   2.7301 -2.765419 3.645567 
1 1 1    7    7   93 o   35.945   2.7372   53.468   7.9598   55.445   10.496   50.791   12.212   36.415   3.5822   34.605   4.4306 1.809967 5.697561 
1 1 1    7    7   94 o   78.295   1.6811  250.847   10.729  243.628   14.215  260.404   16.355   77.002   2.2671   79.535   2.5259 -2.532356 3.394141 
1 1 1    7    7   95 o   21.914   4.2200   20.738   7.2648   28.720   9.7017   10.548   10.961   25.716   4.8048   16.893   6.1474 8.823061 7.802368 
1 1 1    7    7   96 o   64.605   1.9556  171.354   10.287  165.940   14.650  176.620   14.447   63.320   2.8456   65.373   2.7171 -2.053154 3.934462 
1 1 1    7    7   97 o   37.900   2.7440   59.629   8.4201   50.834   11.948   68.306   11.868   34.497   4.3453   40.308   3.6515 -5.811298 5.675831 
1 1 1    7    7   98 o   50.786   2.2258  106.309   9.1919   94.357   13.126  117.810   12.876   47.477   3.4145   53.237   2.9790 -5.759632 4.531346 
1 1 1    7    7   99 o   45.288   2.2402   84.653   8.2442   84.353   11.119   85.020   12.287   44.969   3.0513   45.034   3.3715 -0.6519699E-01 4.547248 
1 1 1    7    7  100 o   31.085   3.5201   40.917   8.7629   47.443   14.543   37.196   10.980   32.614   5.6763   29.167   4.7840 3.446758 7.423421 
1 1 1    7    7  101 o   10.299   4.6452  -3.4938   8.2542   1.7999   13.857  -6.4051   10.276   14.912   6.3882   10.934   5.0272 3.978258 8.129075 
1 1 1    7    7  102 f   83.304   1.9952  285.584   13.549  297.161   22.418  278.923   17.006   84.236   3.2711   82.041   2.5459 2.194283 4.145104 
1 1 1    7    7  103 o   29.268   3.9790   36.888   9.2474   18.991   15.482   46.814   11.530   20.781   7.3361   32.838   4.4195 -12.05738 8.564463 
1 1 1    7    7  104 o   52.736   2.2717  115.113   9.7426  104.873   14.221  124.171   13.375   49.795   3.5263   54.458   3.0248 -4.663101 4.645833 
1 1 1    7    7  105 o   11.420   4.8578   0.9871   7.9128   8.5514   11.711  -5.3666   10.733   15.966   6.2302   11.374   5.1952 4.592093 8.112071 
1 1 1    7    7  106 o   53.765   2.4694  120.211   10.794  114.166   16.979  124.311   13.983   51.518   4.0764   54.328   3.1712 -2.810108 5.164645 
1 1 1    7    7  107 o   86.669   2.2458  311.367   15.853  325.355   31.879  306.771   18.272   86.399   4.5424   85.770   2.6166 0.6285706 5.242131 
1 1 1    7    7  108 o   39.670   3.0906   66.645   9.9153   75.009   15.591   60.964   12.848   41.105   4.7398   37.284   4.3067 3.820812 6.404145 
1 1 1    7    7  109 o   28.976   3.4545   36.191   7.9990   31.581   10.368   42.968   12.572   26.276   5.0238   30.626   5.2231 -4.349998 7.247008 
1 1 1    7    7  110 o   30.524   3.2928   40.049   8.0635   47.011   10.531   30.182   12.537   32.693   4.0373   24.884   6.2027 7.808882 7.400891 
1 1 1    7    7  111 o   10.712   4.7123  -0.6067   7.9646  -4.8486   9.7467   7.9188   13.818   10.667   4.9017   15.922   6.5702 -5.254156 8.197180 
1 1 1    7    7  112 o   32.398   3.1772   45.166   8.2829   47.526   10.754   41.724   12.987   32.671   4.1303   29.592   5.5885 3.078615 6.949139 
1 1 1    7    7  113 o   31.134   3.5048   42.365   8.7404   41.478   10.486   44.383   15.821   30.256   4.3789   29.404   6.7443 0.8511448 8.041161 
1 1 1    7    7  114 o   33.914   3.6674   50.735   9.9773   56.247   11.157   28.734   22.291   35.541   3.9160   22.152   8.6093 13.38881 9.458035 
1 1 1    7    7  115 o   22.068   5.7925   24.492   10.550   24.492   10.550   0.0000   0.0000   22.068   5.7925  ?   ?  0.000000 5.792531 
1 1 1    7    7  116 o   33.199   3.8566   49.372   10.243   47.629   11.040   60.147   27.448   32.257   4.3062   29.215   9.7884 3.042095 10.69375 
1 1 1    7    7  117 o   11.802   5.1527   1.1944   9.3640   0.8668   10.142   3.0859   24.373   12.077   5.3151   16.771   7.7225 -4.694032 9.374825 
1 1 1    7    7  118 o   12.063   5.2244   2.0044   9.4648  -4.3812   10.209   41.054   25.247   10.771   4.9736   24.218   9.2265 -13.44612 10.48165 
1 1 1    7    7  119 o   21.749   5.3535   23.614   9.4261   27.517   11.268   14.515   17.203   23.027   5.9580   17.556   7.2956 5.471365 9.419321 
1 1 1    7    7  120 o   22.530   5.2201   25.146   9.3987   29.378   11.362   15.974   16.727   23.838   5.8834   17.832   7.2791 6.006329 9.359468 
1 1 1    7    7  121 o   7.8084   3.8511 -16.1328   8.7975  -8.4090   10.478 -34.5878   16.196   10.038   4.7616   9.7099   4.8595 0.3280849 6.803498 
1 1 1    7    7  122 o   26.247   5.6695   35.142   11.775   42.055   16.313   27.623   17.013   26.946   7.2632   21.228   7.6680 5.718338 10.56186 
1 1 1    7    7  123 o   15.387   5.9305   11.067   10.512   0.0029   13.374   28.950   17.004   12.973   5.8761   21.598   7.6820 -8.624723 9.671736 
1 1 1    7    7  124 o   24.138   5.5648   29.883   10.725   37.589   13.539   16.897   17.574   26.306   6.3801   17.821   7.3870 8.484852 9.760830 
1 1 1    7    7  125 o   23.448   5.6470   28.555   10.664   33.299   13.733   21.351   16.924   24.219   6.7202   18.964   7.4629 5.255632 10.04268 
1 1 1    7    7  126 o   13.292   5.6200   5.4424   10.483   3.6567   13.196   8.4973   17.259   13.645   6.0314   15.702   6.9211 -2.057004 9.180366 
1 1 1    7    7  127 o   27.538   5.0139   37.296   10.840   35.727   13.931   39.704   17.260   25.188   6.6775   25.222   7.6944 -0.3363419E-01 10.18786 
1 1 1    8    0 -135 o   30.255   11.412   65.564   26.348   65.564   26.348   65.564   26.348   30.255   11.412   30.255   11.412 -0.000000 0.000000 
1 1 1    8    0 -134 o   16.982   8.7879   22.570   15.675   22.570   15.675   22.570   15.675   16.982   8.7879   16.982   8.7879 -0.000000 0.000000 
1 1 1    8    0 -133 o   13.031   7.2739   12.268   11.522   12.268   11.522   12.268   11.522   13.031   7.2739   13.031   7.2739 0.000000 0.000000 
1 1 1    8    0 -132 o   12.722   6.9245   11.473   10.153   11.473   10.153   11.473   10.153   12.722   6.9245   12.722   6.9245 -0.000000 0.000000 
1 1 1    8    0 -131 o   16.149   7.2356   17.529   10.151   17.529   10.151   17.529   10.151   16.149   7.2356   16.149   7.2356 -0.000000 0.000000 
1 1 1    8    0 -130 o   9.0136   5.8221   1.7535   9.9850   1.7535   9.9850   1.7535   9.9850   9.0136   5.8221   9.0136   5.8221 0.000000 0.000000 
1 1 1    8    0 -129 o   10.034   6.2442   4.6679   10.312   4.6679   10.312   4.6679   10.312   10.034   6.2442   10.034   6.2442 -0.000000 0.000000 
1 1 1    8    0 -128 o   20.925   6.9587   25.076   10.564   25.076   10.564   25.076   10.564   20.925   6.9587   20.925   6.9587 -0.000000 0.000000 
1 1 1    8    0 -127 f   10.534   6.3354   6.2920   9.8302   6.2920   9.8302   6.2920   9.8302   10.534   6.3354   10.534   6.3354 0.000000 0.000000 
1 1 1    8    0 -126 o   23.543   6.1037   28.548   10.122   28.548   10.122   28.548   10.122   23.543   6.1037   23.543   6.1037 -0.000000 0.000000 
1 1 1    8    0 -125 o   10.006   6.1580   4.7935   9.7617   4.7935   9.7617   4.7935   9.7617   10.006   6.1580   10.006   6.1580 -0.000000 0.000000 
1 1 1    8    0 -124 o   10.615   6.3933   6.2041   10.040   6.2041   10.040   6.2041   10.040   10.615   6.3933   10.615   6.3933 -0.000000 0.000000 
1 1 1    8    0 -123 o   24.392   6.2392   30.418   10.723   30.418   10.723   30.418   10.723   24.392   6.2392   24.392   6.2392 0.000000 0.000000 
1 1 1    8    0 -122 o   30.025   5.4725   42.437   12.078   42.437   12.078   42.437   12.078   30.025   5.4725   30.025   5.4725 -0.000000 0.000000 
1 1 1    8    0 -121 o   13.348   7.2503   11.946   11.108   11.946   11.108   11.946   11.108   13.348   7.2503   13.348   7.2503 0.000000 0.000000 
1 1 1    8    0 -120 o   50.910   3.3450  109.489   13.742  109.489   13.742  109.489   13.742   50.910   3.3450   50.910   3.3450 -0.000000 0.000000 
1 1 1    8    0 -119 o   28.555   5.3203   38.010   11.123   38.010   11.123   38.010   11.123   28.555   5.3203   28.555   5.3203 0.000000 0.000000 
1 1 1    8    0 -118 o   46.893   3.1655   92.453   11.971   92.453   11.971   92.453   11.971   46.893   3.1655   46.893   3.1655 -0.000000 0.000000 
1 1 1    8    0 -117 o   8.3935   5.5521  -1.4469   9.9045  -1.4469   9.9045  -1.4469   9.9045   8.3935   5.5521   8.3935   5.5521 0.000000 0.000000 
1 1 1    8    0 -116 o   8.3514   5.5474  -1.9707   10.058  -1.9707   10.058  -1.9707   10.058   8.3514   5.5474   8.3514   5.5474 0.000000 0.000000 
1 1 1    8    0 -115 o   9.4390   6.0332   1.5123   10.370   1.5123   10.370   1.5123   10.370   9.4390   6.0332   9.4390   6.0332 -0.000000 0.000000 
1 1 1    8    0 -114 o   19.742   8.0862   23.561   12.828   23.561   12.828   23.561   12.828   19.742   8.0862   19.742   8.0862 -0.000000 0.000000 
1 1 1    8    0 -113 o   8.6190   5.8562  -5.7538   12.447  -5.7538   12.447  -5.7538   12.447   8.6190   5.8562   8.6190   5.8562 0.000000 0.000000 
1 1 1    8    0 -112 o   53.095   3.4580  117.966   14.819  117.966   14.819  117.966   14.819   53.095   3.4580   53.095   3.4580 -0.000000 0.000000 
1 1 1    8    0 -111 o   38.189   4.5652   63.251   13.675   63.251   13.675   63.251   13.675   38.189   4.5652   38.189   4.5652 -0.000000 0.000000 
1 1 1    8    0 -110 o   17.421   7.2242   18.063   10.208   18.063   10.208   18.063   10.208   17.421   7.2242   17.421   7.2242 -0.000000 0.000000 
1 1 1    8    0 -109 o   35.559   3.9760   54.203   11.155   54.203   11.155   54.203   11.155   35.559   3.9760   35.559   3.9760 -0.000000 0.000000 
1 1 1    8    0 -108 o   21.428   6.9039   24.369   10.645   24.369   10.645   24.369   10.645   21.428   6.9039   21.428   6.9039 -0.000000 0.000000 
1 1 1    8    0 -107 o   10.287   6.3290   3.8563   10.303   3.8563   10.303   3.8563   10.303   10.287   6.3290   10.287   6.3290 0.000000 0.000000 
1 1 1    8    0 -106 o   7.5004   5.2179  -9.8127   11.345  -9.8127   11.345  -9.8127   11.345   7.5004   5.2179   7.5004   5.2179 0.000000 0.000000 
1 1 1    8    0 -105 o   30.287   5.5820   41.674   12.402   41.674   12.402   41.674   12.402   30.287   5.5820   30.287   5.5820 -0.000000 0.000000 
1 1 1    8    0 -104 o   15.788   7.8240   15.547   12.130   15.547   12.130   15.547   12.130   15.788   7.8240   15.788   7.8240 -0.000000 0.000000 
1 1 1    8    0 -103 f  108.132   2.4890  479.100   21.913  479.100   21.913  479.100   21.913  108.132   2.4890  108.132   2.4890 -0.000000 0.000000 
1 1 1    8    0 -102 o  120.588   2.4345  595.334   23.908  595.334   23.908  595.334   23.908  120.588   2.4345  120.588   2.4345 0.000000 0.000000 
1 1 1    8    0 -101 o   31.526   4.7939   43.621   11.476   43.621   11.476   43.621   11.476   31.526   4.7939   31.526   4.7939 0.000000 0.000000 
1 1 1    8    0 -100 o   16.086   7.4702   15.726   10.851   15.726   10.851   15.726   10.851   16.086   7.4702   16.086   7.4702 -0.000000 0.000000 
1 1 1    8    0  -99 o   52.736   3.0009  114.855   12.804  114.855   12.804  114.855   12.804   52.736   3.0009   52.736   3.0009 -0.000000 0.000000 
1 1 1    8    0  -98 o  119.331   2.1764  581.965   21.154  581.965   21.154  581.965   21.154  119.331   2.1764  119.331   2.1764 0.000000 0.000000 
1 1 1    8    0  -97 o   74.883   3.0013  230.329   18.253  230.329   18.253  230.329   18.253   74.883   3.0013   74.883   3.0013 -0.000000 0.000000 
1 1 1    8    0  -96 o   79.866   2.5494  261.282   16.559  261.282   16.559  261.282   16.559   79.866   2.5494   79.866   2.5494 0.000000 0.000000 
1 1 1    8    0  -95 o  124.268   2.2551  630.911   22.827  630.911   22.827  630.911   22.827  124.268   2.2551  124.268   2.2551 -0.000000 0.000000 
1 1 1    8    0  -94 o   22.938   7.3696   27.385   12.155   27.385   12.155   27.385   12.155   22.938   7.3696   22.938   7.3696 0.000000 0.000000 
1 1 1    8    0  -93 o  154.549   2.5257  975.728   31.800  975.728   31.800  975.728   31.800  154.549   2.5257  154.549   2.5257 0.000000 0.000000 
1 1 1    8    0  -92 o   80.558   2.3399  265.475   15.336  265.475   15.336  265.475   15.336   80.558   2.3399   80.558   2.3399 -0.000000 0.000000 
1 1 1    8    0  -91 o   41.469   3.6066   71.842   11.970   71.842   11.970   71.842   11.970   41.469   3.6066   41.469   3.6066 -0.000000 0.000000 
1 1 1    8    0  -90 o  186.258   2.6240  1416.59   39.822  1416.59   39.822  1416.59   39.822  186.258   2.6240  186.258   2.6240 -0.000000 0.000000 
1 1 1    8    0  -89 o   76.701   2.8134  241.068   17.536  241.068   17.536  241.068   17.536   76.701   2.8134   76.701   2.8134 0.000000 0.000000 
1 1 1    8    0  -88 o   50.183   3.7156  104.544   15.003  104.544   15.003  104.544   15.003   50.183   3.7156   50.183   3.7156 0.000000 0.000000 
1 1 1    8    0  -87 o  102.784   2.5545  431.806   21.372  431.806   21.372  431.806   21.372  102.784   2.5545  102.784   2.5545 -0.000000 0.000000 
1 1 1    8    0  -86 o  147.760   2.8931  891.918   34.816  891.918   34.816  891.918   34.816  147.760   2.8931  147.760   2.8931 0.000000 0.000000 
1 1 1    8    0  -85 o  123.496   2.3943  622.770   24.082  622.770   24.082  622.770   24.082  123.496   2.3943  123.496   2.3943 0.000000 0.000000 
1 1 1    8    0  -84 o   38.678   4.3169   63.350   13.177   63.350   13.177   63.350   13.177   38.678   4.3169   38.678   4.3169 -0.000000 0.000000 
1 1 1    8    0  -83 o   5.9328   4.2723 -18.2221   10.248 -18.2221   10.248 -18.2221   10.248   5.9328   4.2723   5.9328   4.2723 0.000000 0.000000 
1 1 1    8    0  -82 o   6.0132   4.3280 -18.4036   10.456 -18.4036   10.456 -18.4036   10.456   6.0132   4.3280   6.0132   4.3280 0.000000 0.000000 
1 1 1    8    0  -81 o  119.287   2.1287  580.768   20.684  580.768   20.684  580.768   20.684  119.287   2.1287  119.287   2.1287 -0.000000 0.000000 
1 1 1    8    0  -80 o  150.743   2.1586  927.112   26.512  927.112   26.512  927.112   26.512  150.743   2.1586  150.743   2.1586 0.000000 0.000000 
1 1 1    8    0  -79 o   74.860   2.6040  229.371   15.847  229.371   15.847  229.371   15.847   74.860   2.6040   74.860   2.6040 0.000000 0.000000 
1 1 1    8    0  -78 o   56.836   2.9496  132.820   13.581  132.820   13.581  132.820   13.581   56.836   2.9496   56.836   2.9496 0.000000 0.000000 
1 1 1    8    0  -77 f   18.096   7.4213   18.727   10.802   18.727   10.802   18.727   10.802   18.096   7.4213   18.096   7.4213 -0.000000 0.000000 
1 1 1    8    0  -76 o  226.973   2.4165  2101.38   44.698  2101.38   44.698  2101.38   44.698  226.973   2.4165  226.973   2.4165 0.000000 0.000000 
1 1 1    8    0  -75 o   13.815   7.0034   11.454   9.8300   11.454   9.8300   11.454   9.8300   13.815   7.0034   13.815   7.0034 -0.000000 0.000000 
1 1 1    8    0  -74 o  184.156   2.1697  1383.27   32.561  1383.27   32.561  1383.27   32.561  184.156   2.1697  184.156   2.1697 0.000000 0.000000 
1 1 1    8    0  -73 o  327.032   3.0373  4362.92   80.953  4362.92   80.953  4362.92   80.953  327.032   3.0373  327.032   3.0373 0.000000 0.000000 
1 1 1    8    0  -72 o  370.117   3.3422  5588.77  100.814  5588.77  100.814  5588.77  100.814  370.117   3.3422  370.117   3.3422 -0.000000 0.000000 
1 1 1    8    0  -71 o   9.9565   6.0772   3.4692   9.3303   3.4692   9.3303   3.4692   9.3303   9.9565   6.0772   9.9565   6.0772 0.000000 0.000000 
1 1 1    8    0  -70 o   60.384   2.4276  149.384   11.905  149.384   11.905  149.384   11.905   60.384   2.4276   60.384   2.4276 0.000000 0.000000 
1 1 1    8    0  -69 o  248.620   2.5065  2521.03   50.786  2521.03   50.786  2521.03   50.786  248.620   2.5065  248.620   2.5065 -0.000000 0.000000 
1 1 1    8    0  -68 o  281.146   2.7120  3223.88   62.138  3223.88   62.138  3223.88   62.138  281.146   2.7120  281.146   2.7120 -0.000000 0.000000 
1 1 1    8    0  -67 o  372.185   2.9931  5649.75   90.793  5649.75   90.793  5649.75   90.793  372.185   2.9931  372.185   2.9931 0.000000 0.000000 
1 1 1    8    0  -66 o  307.900   2.8557  3866.61   71.659  3866.61   71.659  3866.61   71.659  307.900   2.8557  307.900   2.8557 -0.000000 0.000000 
1 1 1    8    0  -65 o  348.124   3.1440  4943.17   89.200  4943.17   89.200  4943.17   89.200  348.124   3.1440  348.124   3.1440 0.000000 0.000000 
1 1 1    8    0  -64 o   28.982   2.7370   35.155   6.3256   35.155   6.3256   35.155   6.3256   28.982   2.7370   28.982   2.7370 0.000000 0.000000 
1 1 1    8    0  -63 o  148.777   1.6587  902.601   20.111  902.601   20.111  902.601   20.111  148.777   1.6587  148.777   1.6587 0.000000 0.000000 
1 1 1    8    0  -62 o   85.461   1.5028  297.980   10.461  297.980   10.461  297.980   10.461   85.461   1.5028   85.461   1.5028 -0.000000 0.000000 
1 1 1    8    0  -61 o  316.345   2.5982  4080.81   66.988  4080.81   66.988  4080.81   66.988  316.345   2.5982  316.345   2.5982 0.000000 0.000000 
1 1 1    8    0  -60 o  118.345   1.5657  571.183   15.098  571.183   15.098  571.183   15.098  118.345   1.5657  118.345   1.5657 0.000000 0.000000 
1 1 1    8    0  -59 o   63.807   1.4813  166.217   7.6949  166.217   7.6949  166.217   7.6949   63.807   1.4813   63.807   1.4813 -0.000000 0.000000 
1 1 1    8    0  -58 o  231.249   1.8952  2180.27   35.719  2180.27   35.719  2180.27   35.719  231.249   1.8952  231.249   1.8952 -0.000000 0.000000 
1 1 1    8    0  -57 o  178.932   1.7726  1305.44   25.849  1305.44   25.849  1305.44   25.849  178.932   1.7726  178.932   1.7726 -0.000000 0.000000 
1 1 1    8    0  -56 o  134.051   1.5925  732.761   17.396  732.761   17.396  732.761   17.396  134.051   1.5925  134.051   1.5925 -0.000000 0.000000 
1 1 1    8    0  -55 o  416.927   2.9766  7087.60  101.152  7087.60  101.152  7087.60  101.152  416.927   2.9766  416.927   2.9766 -0.000000 0.000000 
1 1 1    8    0  -54 o  160.028   1.7571  1044.21   22.914  1044.21   22.914  1044.21   22.914  160.028   1.7571  160.028   1.7571 -0.000000 0.000000 
1 1 1    8    0  -53 o  564.611   4.2873 13000.70  197.295 13000.70  197.295 13000.70  197.295  564.611   4.2873  564.611   4.2873 0.000000 0.000000 
1 1 1    8    0  -52 o  719.825   5.3827 21135.11  315.797 21135.11  315.797 21135.11  315.797  719.825   5.3827  719.825   5.3827 -0.000000 0.000000 
1 1 1    8    0  -51 o  109.186   1.9603  486.401   17.434  486.401   17.434  486.401   17.434  109.186   1.9603  109.186   1.9603 0.000000 0.000000 
1 1 1    8    0  -50 o  313.422   2.8822  4005.36   73.622  4005.36   73.622  4005.36   73.622  313.422   2.8822  313.422   2.8822 0.000000 0.000000 
1 1 1    8    0  -49 o  136.208   1.6701  756.530   18.537  756.530   18.537  756.530   18.537  136.208   1.6701  136.208   1.6701 -0.000000 0.000000 
1 1 1    8    0  -48 o  109.682   1.6299  490.658   14.565  490.658   14.565  490.658   14.565  109.682   1.6299  109.682   1.6299 -0.000000 0.000000 
1 1 1    8    0  -47 o  113.477   1.6355  525.176   15.121  525.176   15.121  525.176   15.121  113.477   1.6355  113.477   1.6355 0.000000 0.000000 
1 1 1    8    0  -46 o  436.984   3.4001  7785.43  121.096  7785.43  121.096  7785.43  121.096  436.984   3.4001  436.984   3.4001 0.000000 0.000000 
1 1 1    8    0  -45 o  379.323   3.3653  5866.61  104.040  5866.61  104.040  5866.61  104.040  379.323   3.3653  379.323   3.3653 0.000000 0.000000 
1 1 1    8    0  -44 o   28.946   3.7019   35.795   8.3443   35.795   8.3443   35.795   8.3443   28.946   3.7019   28.946   3.7019 0.000000 0.000000 
1 1 1    8    0  -43 o  780.847   7.5011 24872.25  477.351 24872.25  477.351 24872.25  477.351  780.847   7.5011  780.847   7.5011 -0.000000 0.000000 
1 1 1    8    0  -42 o  118.665   2.1023  574.482   20.321  574.482   20.321  574.482   20.321  118.665   2.1023  118.665   2.1023 -0.000000 0.000000 
1 1 1    8    0  -41 o  235.628   2.7439  2263.94   52.686  2263.94   52.686  2263.94   52.686  235.628   2.7439  235.628   2.7439 0.000000 0.000000 
1 1 1    8    0  -40 o   56.664   2.6661  131.738   12.252  131.738   12.252  131.738   12.252   56.664   2.6661   56.664   2.6661 -0.000000 0.000000 
1 1 1    8    0  -39 o  107.576   1.9558  472.154   17.138  472.154   17.138  472.154   17.138  107.576   1.9558  107.576   1.9558 -0.000000 0.000000 
1 1 1    8    0  -38 o  1064.60   8.7863 46231.94  762.360 46231.94  762.360 46231.94  762.360  1064.60   8.7863  1064.60   8.7863 0.000000 0.000000 
1 1 1    8    0  -37 o  288.343   3.1577  3390.11   74.199  3390.11   74.199  3390.11   74.199  288.343   3.1577  288.343   3.1577 -0.000000 0.000000 
1 1 1    8    0  -36 o  261.795   2.9749  2794.65   63.467  2794.65   63.467  2794.65   63.467  261.795   2.9749  261.795   2.9749 0.000000 0.000000 
1 1 1    8    0  -35 o  246.908   2.4703  2485.58   49.708  2485.58   49.708  2485.58   49.708  246.908   2.4703  246.908   2.4703 -0.000000 0.000000 
1 1 1    8    0  -34 o  437.648   4.4274  7810.02  157.909  7810.02  157.909  7810.02  157.909  437.648   4.4274  437.648   4.4274 0.000000 0.000000 
1 1 1    8    0  -33 o  602.809   5.8874 14818.25  289.233 14818.25  289.233 14818.25  289.233  602.809   5.8874  602.809   5.8874 0.000000 0.000000 
1 1 1    8    0  -32 o   50.661   3.1408  105.813   12.855  105.813   12.855  105.813   12.855   50.661   3.1408   50.661   3.1408 0.000000 0.000000 
1 1 1    8    0  -31 o   19.311   7.4128   20.685   11.030   20.685   11.030   20.685   11.030   19.311   7.4128   19.311   7.4128 -0.000000 0.000000 
1 1 1    8    0  -30 o  145.415   2.8114  862.844   33.297  862.844   33.297  862.844   33.297  145.415   2.8114  145.415   2.8114 0.000000 0.000000 
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1 1 1    8    0  -26 o   30.089   2.7624   37.825   6.6370   37.825   6.6370   37.825   6.6370   30.089   2.7624   30.089   2.7624 0.000000 0.000000 
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1 1 1    8    0  -24 o  128.114   1.9707  669.448   20.570  669.448   20.570  669.448   20.570  128.114   1.9707  128.114   1.9707 -0.000000 0.000000 
1 1 1    8    0  -23 o  210.487   2.1661  1806.37   37.156  1806.37   37.156  1806.37   37.156  210.487   2.1661  210.487   2.1661 -0.000000 0.000000 
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1 1 1    8    0  -21 o  481.675   4.1186  9459.22  161.685  9459.22  161.685  9459.22  161.685  481.675   4.1186  481.675   4.1186 -0.000000 0.000000 
1 1 1    8    0  -20 o  659.624   5.5169 17740.75  296.592 17740.75  296.592 17740.75  296.592  659.624   5.5169  659.624   5.5169 -0.000000 0.000000 
1 1 1    8    0  -19 o  434.667   3.7565  7702.93  133.077  7702.93  133.077  7702.93  133.077  434.667   3.7565  434.667   3.7565 0.000000 0.000000 
1 1 1    8    0  -18 o  1002.59   8.2632 40995.15  675.212 40995.15  675.212 40995.15  675.212  1002.59   8.2632  1002.59   8.2632 -0.000000 0.000000 
1 1 1    8    0  -17 o  237.018   3.2359  2291.09   62.493  2291.09   62.493  2291.09   62.493  237.018   3.2359  237.018   3.2359 -0.000000 0.000000 
1 1 1    8    0  -16 o  660.149   5.5282 17769.22  297.434 17769.22  297.434 17769.22  297.434  660.149   5.5282  660.149   5.5282 0.000000 0.000000 
1 1 1    8    0  -15 o  485.060   4.1499  9592.74  164.059  9592.74  164.059  9592.74  164.059  485.060   4.1499  485.060   4.1499 0.000000 0.000000 
1 1 1    8    0  -14 o  524.495   5.1505 11217.45  220.155 11217.45  220.155 11217.45  220.155  524.495   5.1505  524.495   5.1505 -0.000000 0.000000 
1 1 1    8    0  -13 o  270.188   2.9630  2976.62   65.240  2976.62   65.240  2976.62   65.240  270.188   2.9630  270.188   2.9630 0.000000 0.000000 
1 1 1    8    0  -12 f  666.342   5.5714 18104.59  302.571 18104.59  302.571 18104.59  302.571  666.342   5.5714  666.342   5.5714 0.000000 0.000000 
1 1 1    8    0  -11 o  203.137   2.1230  1682.45   35.145  1682.45   35.145  1682.45   35.145  203.137   2.1230  203.137   2.1230 0.000000 0.000000 
1 1 1    8    0  -10 o  388.990   3.4179  6169.08  108.358  6169.08  108.358  6169.08  108.358  388.990   3.4179  388.990   3.4179 0.000000 0.000000 
1 1 1    8    0   -9 o   30.189   2.9392   38.193   7.0649   38.193   7.0649   38.193   7.0649   30.189   2.9392   30.189   2.9392 0.000000 0.000000 
1 1 1    8    0   -8 o  192.491   2.9904  1511.38   46.897  1511.38   46.897  1511.38   46.897  192.491   2.9904  192.491   2.9904 0.000000 0.000000 
1 1 1    8    0   -7 o  1010.86   11.803 41710.90  972.282 41710.90  972.282 41710.90  972.282  1010.86   11.803  1010.86   11.803 0.000000 0.000000 
1 1 1    8    0   -6 o  636.806   6.1738 16537.76  320.410 16537.76  320.410 16537.76  320.410  636.806   6.1738  636.806   6.1738 -0.000000 0.000000 
1 1 1    8    0   -5 o  1566.53   14.842 100225.60  1894.92 100225.60  1894.92 100225.60  1894.92  1566.53   14.842  1566.53   14.842 0.000000 0.000000 
1 1 1    8    0   -4 o  202.074   2.4710  1665.12   40.689  1665.12   40.689  1665.12   40.689  202.074   2.4710  202.074   2.4710 0.000000 0.000000 
1 1 1    8    0   -3 o  455.311   3.9245  8452.31  145.632  8452.31  145.632  8452.31  145.632  455.311   3.9245  455.311   3.9245 -0.000000 0.000000 
1 1 1    8    0   -2 o  894.783   8.5430 32660.74  622.980 32660.74  622.980 32660.74  622.980  894.783   8.5430  894.783   8.5430 0.000000 0.000000 
1 1 1    8    0   -1 o  207.593   2.9979  1757.67   50.707  1757.67   50.707  1757.67   50.707  207.593   2.9979  207.593   2.9979 0.000000 0.000000 
1 1 1    8    0    0 o   49.986   2.2643  102.465   9.1827  102.465   9.1827  102.465   9.1827   49.986   2.2643   49.986   2.2643 -0.000000 0.000000 
1 1 1    8    0    1 o   97.095   1.9344  384.706   15.296  384.706   15.296  384.706   15.296   97.095   1.9344   97.095   1.9344 0.000000 0.000000 
1 1 1    8    0    2 o  196.102   2.3891  1568.14   38.177  1568.14   38.177  1568.14   38.177  196.102   2.3891  196.102   2.3891 0.000000 0.000000 
1 1 1    8    0    3 o  154.976   2.1394  979.489   27.015  979.489   27.015  979.489   27.015  154.976   2.1394  154.976   2.1394 -0.000000 0.000000 
1 1 1    8    0    4 o  311.757   3.2852  3962.98   83.465  3962.98   83.465  3962.98   83.465  311.757   3.2852  311.757   3.2852 0.000000 0.000000 
1 1 1    8    0    5 o  692.330   6.6765 19548.42  376.710 19548.42  376.710 19548.42  376.710  692.330   6.6765  692.330   6.6765 -0.000000 0.000000 
1 1 1    8    0    6 o  440.795   4.3969  7922.77  157.952  7922.77  157.952  7922.77  157.952  440.795   4.3969  440.795   4.3969 0.000000 0.000000 
1 1 1    8    0    7 o  270.967   2.9554  2993.80   65.261  2993.80   65.261  2993.80   65.261  270.967   2.9554  270.967   2.9554 0.000000 0.000000 
1 1 1    8    0    8 o  411.401   4.1423  6901.25  138.880  6901.25  138.880  6901.25  138.880  411.401   4.1423  411.401   4.1423 0.000000 0.000000 
1 1 1    8    0    9 o  489.819   5.9189  9785.53  236.247  9785.53  236.247  9785.53  236.247  489.819   5.9189  489.819   5.9189 0.000000 0.000000 
1 1 1    8    0   10 o  733.195   8.6366 21931.56  516.016 21931.56  516.016 21931.56  516.016  733.195   8.6366  733.195   8.6366 0.000000 0.000000 
1 1 1    8    0   11 o  153.249   2.6121  958.081   32.610  958.081   32.610  958.081   32.610  153.249   2.6121  153.249   2.6121 -0.000000 0.000000 
1 1 1    8    0   12 f  127.079   2.4675  658.971   25.538  658.971   25.538  658.971   25.538  127.079   2.4675  127.079   2.4675 -0.000000 0.000000 
1 1 1    8    0   13 o   99.329   2.3950  402.839   19.366  402.839   19.366  402.839   19.366   99.329   2.3950   99.329   2.3950 -0.000000 0.000000 
1 1 1    8    0   14 o  497.480   6.0107 10093.82  243.665 10093.82  243.665 10093.82  243.665  497.480   6.0107  497.480   6.0107 -0.000000 0.000000 
1 1 1    8    0   15 o   99.396   2.4077  403.388   19.482  403.388   19.482  403.388   19.482   99.396   2.4077   99.396   2.4077 -0.000000 0.000000 
1 1 1    8    0   16 o  493.736   4.8749  9940.09  196.158  9940.09  196.158  9940.09  196.158  493.736   4.8749  493.736   4.8749 -0.000000 0.000000 
1 1 1    8    0   18 o  414.999   5.1139  7023.75  172.936  7023.75  172.936  7023.75  172.936  414.999   5.1139  414.999   5.1139 -0.000000 0.000000 
1 1 1    8    0   19 o  654.259   10.971 17474.30  584.717 17474.30  584.717 17474.30  584.717  654.259   10.971  654.259   10.971 0.000000 0.000000 
1 1 1    8    0   20 o  319.875   5.8216  4175.30  151.683  4175.30  151.683  4175.30  151.683  319.875   5.8216  319.875   5.8216 0.000000 0.000000 
1 1 1    8    0   21 o  503.856   8.6043 10360.89  353.159 10360.89  353.159 10360.89  353.159  503.856   8.6043  503.856   8.6043 -0.000000 0.000000 
1 1 1    8    0   22 o   68.609   2.6482  192.716   14.760  192.716   14.760  192.716   14.760   68.609   2.6482   68.609   2.6482 0.000000 0.000000 
1 1 1    8    0   23 o  209.942   3.0867  1797.68   52.798  1797.68   52.798  1797.68   52.798  209.942   3.0867  209.942   3.0867 0.000000 0.000000 
1 1 1    8    0   24 o  613.054   7.2973 15329.58  364.554 15329.58  364.554 15329.58  364.554  613.054   7.2973  613.054   7.2973 -0.000000 0.000000 
1 1 1    8    0   25 o  579.985   6.9296 13720.02  327.509 13720.02  327.509 13720.02  327.509  579.985   6.9296  579.985   6.9296 -0.000000 0.000000 
1 1 1    8    0   26 o  184.188   2.8979  1383.79   43.485  1383.79   43.485  1383.79   43.485  184.188   2.8979  184.188   2.8979 -0.000000 0.000000 
1 1 1    8    0   27 o  429.342   5.2853  7517.74  184.912  7517.74  184.912  7517.74  184.912  429.342   5.2853  429.342   5.2853 -0.000000 0.000000 
1 1 1    8    0   28 o  268.723   3.6389  2945.04   79.677  2945.04   79.677  2945.04   79.677  268.723   3.6389  268.723   3.6389 -0.000000 0.000000 
1 1 1    8    0   29 o  785.435   9.2418 25168.11  591.518 25168.11  591.518 25168.11  591.518  785.435   9.2418  785.435   9.2418 0.000000 0.000000 
1 1 1    8    0   30 o  435.442   5.3595  7732.98  190.170  7732.98  190.170  7732.98  190.170  435.442   5.3595  435.442   5.3595 0.000000 0.000000 
1 1 1    8    0   31 o  190.902   3.0011  1486.53   46.675  1486.53   46.675  1486.53   46.675  190.902   3.0011  190.902   3.0011 -0.000000 0.000000 
1 1 1    8    0   32 o  140.320   2.7220  803.453   31.108  803.453   31.108  803.453   31.108  140.320   2.7220  140.320   2.7220 0.000000 0.000000 
1 1 1    8    0   33 o  216.154   3.2263  1905.69   56.817  1905.69   56.817  1905.69   56.817  216.154   3.2263  216.154   3.2263 -0.000000 0.000000 
1 1 1    8    0   34 o  314.625   4.1310  4037.11  105.904  4037.11  105.904  4037.11  105.904  314.625   4.1310  314.625   4.1310 0.000000 0.000000 
1 1 1    8    0   35 o  573.675   6.8871 13423.91  321.957 13423.91  321.957 13423.91  321.957  573.675   6.8871  573.675   6.8871 0.000000 0.000000 
1 1 1    8    0   36 o  1019.65   11.916 42438.56  990.130 42438.56  990.130 42438.56  990.130  1019.65   11.916  1019.65   11.916 -0.000000 0.000000 
1 1 1    8    0   37 o  209.637   3.2463  1792.64   55.445  1792.64   55.445  1792.64   55.445  209.637   3.2463  209.637   3.2463 0.000000 0.000000 
1 1 1    8    0   38 o  570.373   6.8555 13270.28  318.636 13270.28  318.636 13270.28  318.636  570.373   6.8555  570.373   6.8555 0.000000 0.000000 
1 1 1    8    0   40 o   82.179   4.6064  277.885   30.634  277.885   30.634  277.885   30.634   82.179   4.6064   82.179   4.6064 0.000000 0.000000 
1 1 1    8    0   41 o  510.469   8.7671 10637.56  364.564 10637.56  364.564 10637.56  364.564  510.469   8.7671  510.469   8.7671 -0.000000 0.000000 
1 1 1    8    0   42 o  329.047   6.0635  4418.97  162.510  4418.97  162.510  4418.97  162.510  329.047   6.0635  329.047   6.0635 -0.000000 0.000000 
1 1 1    8    0   43 o  562.480   6.7715 12906.77  310.375 12906.77  310.375 12906.77  310.375  562.480   6.7715  562.480   6.7715 -0.000000 0.000000 
1 1 1    8    0   46 o  524.720   6.3409 11232.65  271.126 11232.65  271.126 11232.65  271.126  524.720   6.3409  524.720   6.3409 -0.000000 0.000000 
1 1 1    8    0   47 o  122.497   2.7264  612.554   27.193  612.554   27.193  612.554   27.193  122.497   2.7264  122.497   2.7264 0.000000 0.000000 
1 1 1    8    0   48 o  283.822   3.8292  3285.76   88.555  3285.76   88.555  3285.76   88.555  283.822   3.8292  283.822   3.8292 -0.000000 0.000000 
1 1 1    8    0   49 o  381.514   4.8122  5937.52  149.602  5937.52  149.602  5937.52  149.602  381.514   4.8122  381.514   4.8122 0.000000 0.000000 
1 1 1    8    0   50 o  337.604   3.0771  4647.33   84.664  4647.33   84.664  4647.33   84.664  337.604   3.0771  337.604   3.0771 0.000000 0.000000 
1 1 1    8    0   51 o  181.534   2.0844  1343.80   30.835  1343.80   30.835  1343.80   30.835  181.534   2.0844  181.534   2.0844 0.000000 0.000000 
1 1 1    8    0   52 o  296.951   2.7867  3595.53   67.441  3595.53   67.441  3595.53   67.441  296.951   2.7867  296.951   2.7867 0.000000 0.000000 
1 1 1    8    0   53 o  163.281   2.3091  1087.41   30.720  1087.41   30.720  1087.41   30.720  163.281   2.3091  163.281   2.3091 -0.000000 0.000000 
1 1 1    8    0   54 o  212.160   2.5935  1835.69   44.837  1835.69   44.837  1835.69   44.837  212.160   2.5935  212.160   2.5935 0.000000 0.000000 
1 1 1    8    0   55 o  287.674   2.7235  3374.54   63.852  3374.54   63.852  3374.54   63.852  287.674   2.7235  287.674   2.7235 0.000000 0.000000 
1 1 1    8    0   56 o  210.175   2.2318  1801.28   38.226  1801.28   38.226  1801.28   38.226  210.175   2.2318  210.175   2.2318 -0.000000 0.000000 
1 1 1    8    0   57 o  533.676   4.5596 11618.61  198.321 11618.61  198.321 11618.61  198.321  533.676   4.5596  533.676   4.5596 0.000000 0.000000 
1 1 1    8    0   58 o   59.942   2.1502  147.032   10.475  147.032   10.475  147.032   10.475   59.942   2.1502   59.942   2.1502 0.000000 0.000000 
1 1 1    8    0   59 o  295.979   3.1957  3573.16   77.083  3573.16   77.083  3573.16   77.083  295.979   3.1957  295.979   3.1957 0.000000 0.000000 
1 1 1    8    0   60 o  501.792   4.9683 10276.08  203.174 10276.08  203.174 10276.08  203.174  501.792   4.9683  501.792   4.9683 -0.000000 0.000000 
1 1 1    8    0   61 o  111.845   2.0908  510.477   19.047  510.477   19.047  510.477   19.047  111.845   2.0908  111.845   2.0908 0.000000 0.000000 
1 1 1    8    0   62 o  216.624   2.5986  1914.01   45.871  1914.01   45.871  1914.01   45.871  216.624   2.5986  216.624   2.5986 -0.000000 0.000000 
1 1 1    8    0   63 o   56.905   2.3443  132.684   10.832  132.684   10.832  132.684   10.832   56.905   2.3443   56.905   2.3443 -0.000000 0.000000 
1 1 1    8    0   64 o  196.946   3.1019  1582.84   49.771  1582.84   49.771  1582.84   49.771  196.946   3.1019  196.946   3.1019 0.000000 0.000000 
1 1 1    8    0   65 o   15.474   5.9642   13.318   7.1276   13.318   7.1276   13.318   7.1276   15.474   5.9642   15.474   5.9642 -0.000000 0.000000 
1 1 1    8    0   66 o   40.750   2.5892   68.519   8.5199   68.519   8.5199   68.519   8.5199   40.750   2.5892   40.750   2.5892 -0.000000 0.000000 
1 1 1    8    0   67 o  170.402   2.0192  1184.24   28.038  1184.24   28.038  1184.24   28.038  170.402   2.0192  170.402   2.0192 0.000000 0.000000 
1 1 1    8    0   68 o   91.663   1.8530  342.936   13.832  342.936   13.832  342.936   13.832   91.663   1.8530   91.663   1.8530 0.000000 0.000000 
1 1 1    8    0   69 o   71.477   1.9414  208.738   11.292  208.738   11.292  208.738   11.292   71.477   1.9414   71.477   1.9414 -0.000000 0.000000 
1 1 1    8    0   70 o   44.263   2.4241   80.597   8.6859   80.597   8.6859   80.597   8.6859   44.263   2.4241   44.263   2.4241 -0.000000 0.000000 
1 1 1    8    0   71 o  180.861   2.0810  1334.10   30.671  1334.10   30.671  1334.10   30.671  180.861   2.0810  180.861   2.0810 0.000000 0.000000 
1 1 1    8    0   72 o   89.926   1.8802  330.099   13.769  330.099   13.769  330.099   13.769   89.926   1.8802   89.926   1.8802 0.000000 0.000000 
1 1 1    8    0   73 o   54.970   2.4601  123.948   10.973  123.948   10.973  123.948   10.973   54.970   2.4601   54.970   2.4601 -0.000000 0.000000 
1 1 1    8    0   74 o  223.830   2.3289  2043.40   42.481  2043.40   42.481  2043.40   42.481  223.830   2.3289  223.830   2.3289 -0.000000 0.000000 
1 1 1    8    0   75 o   72.985   2.0331  217.677   12.074  217.677   12.074  217.677   12.074   72.985   2.0331   72.985   2.0331 0.000000 0.000000 
1 1 1    8    0   76 o   86.097   2.1890  302.820   15.340  302.820   15.340  302.820   15.340   86.097   2.1890   86.097   2.1890 -0.000000 0.000000 
1 1 1    8    0   77 f   23.101   5.9293   25.654   9.6499   25.654   9.6499   25.654   9.6499   23.101   5.9293   23.101   5.9293 -0.000000 0.000000 
1 1 1    8    0   78 o  166.781   3.0652  1135.79   41.640  1135.79   41.640  1135.79   41.640  166.781   3.0652  166.781   3.0652 -0.000000 0.000000 
1 1 1    8    0   79 o  301.373   3.3021  3706.72   81.098  3706.72   81.098  3706.72   81.098  301.373   3.3021  301.373   3.3021 -0.000000 0.000000 
1 1 1    8    0   80 o  107.209   2.7116  469.675   23.663  469.675   23.663  469.675   23.663  107.209   2.7116  107.209   2.7116 -0.000000 0.000000 
1 1 1    8    0   81 o  105.988   2.2942  458.725   19.800  458.725   19.800  458.725   19.800  105.988   2.2942  105.988   2.2942 -0.000000 0.000000 
1 1 1    8    0   82 o   34.888   3.9194   51.536   10.785   51.536   10.785   51.536   10.785   34.888   3.9194   34.888   3.9194 -0.000000 0.000000 
1 1 1    8    0   83 o   68.129   2.4725  190.060   13.690  190.060   13.690  190.060   13.690   68.129   2.4725   68.129   2.4725 0.000000 0.000000 
1 1 1    8    0   84 o  281.371   2.7073  3230.56   62.080  3230.56   62.080  3230.56   62.080  281.371   2.7073  281.371   2.7073 -0.000000 0.000000 
1 1 1    8    0   85 o   60.746   2.2753  151.131   11.231  151.131   11.231  151.131   11.231   60.746   2.2753   60.746   2.2753 0.000000 0.000000 
1 1 1    8    0   86 o   56.862   2.3991  132.586   11.075  132.586   11.075  132.586   11.075   56.862   2.3991   56.862   2.3991 -0.000000 0.000000 
1 1 1    8    0   87 o   53.320   2.7478  116.927   11.870  116.927   11.870  116.927   11.870   53.320   2.7478   53.320   2.7478 -0.000000 0.000000 
1 1 1    8    0   88 o  163.443   2.0568  1090.04   27.394  1090.04   27.394  1090.04   27.394  163.443   2.0568  163.443   2.0568 0.000000 0.000000 
1 1 1    8    0   89 o   80.478   2.0622  264.689   13.508  264.689   13.508  264.689   13.508   80.478   2.0622   80.478   2.0622 0.000000 0.000000 
1 1 1    8    0   90 o   8.1841   5.3067  -0.4473   8.4045  -0.4473   8.4045  -0.4473   8.4045   8.1841   5.3067   8.1841   5.3067 0.000000 0.000000 
1 1 1    8    0   91 o   8.3837   5.3837   0.2371   8.3778   0.2371   8.3778   0.2371   8.3778   8.3837   5.3837   8.3837   5.3837 -0.000000 0.000000 
1 1 1    8    0   92 o  171.025   2.0916  1193.79   29.149  1193.79   29.149  1193.79   29.149  171.025   2.0916  171.025   2.0916 -0.000000 0.000000 
1 1 1    8    0   93 o   6.3245   4.4291  -8.8507   8.5600  -8.8507   8.5600  -8.8507   8.5600   6.3245   4.4291   6.3245   4.4291 0.000000 0.000000 
1 1 1    8    0   94 o   98.513   2.0303  396.461   16.288  396.461   16.288  396.461   16.288   98.513   2.0303   98.513   2.0303 -0.000000 0.000000 
1 1 1    8    0   95 o   8.9432   5.7142   0.6843   9.2920   0.6843   9.2920   0.6843   9.2920   8.9432   5.7142   8.9432   5.7142 0.000000 0.000000 
1 1 1    8    0   96 o   58.264   2.4766  139.367   11.714  139.367   11.714  139.367   11.714   58.264   2.4766   58.264   2.4766 -0.000000 0.000000 
1 1 1    8    0   97 o  178.479   2.1461  1300.89   31.212  1300.89   31.212  1300.89   31.212  178.479   2.1461  178.479   2.1461 0.000000 0.000000 
1 1 1    8    0   98 o   27.545   4.3295   33.309   9.0041   33.309   9.0041   33.309   9.0041   27.545   4.3295   27.545   4.3295 -0.000000 0.000000 
1 1 1    8    0   99 o   14.595   6.9174   12.948   9.3413   12.948   9.3413   12.948   9.3413   14.595   6.9174   14.595   6.9174 0.000000 0.000000 
1 1 1    8    0  100 o   15.518   6.9349   14.416   9.3242   14.416   9.3242   14.416   9.3242   15.518   6.9349   15.518   6.9349 0.000000 0.000000 
1 1 1    8    0  101 o   38.056   3.3345   60.692   10.153   60.692   10.153   60.692   10.153   38.056   3.3345   38.056   3.3345 0.000000 0.000000 
1 1 1    8    0  102 o   82.818   2.0196  280.677   13.616  280.677   13.616  280.677   13.616   82.818   2.0196   82.818   2.0196 0.000000 0.000000 
1 1 1    8    0  103 f   31.318   3.5861   41.815   8.8443   41.815   8.8443   41.815   8.8443   31.318   3.5861   31.318   3.5861 0.000000 0.000000 
1 1 1    8    0  104 o   30.060   3.7690   38.852   8.8427   38.852   8.8427   38.852   8.8427   30.060   3.7690   30.060   3.7690 -0.000000 0.000000 
1 1 1    8    0  105 o   62.017   2.2385  157.942   11.283  157.942   11.283  157.942   11.283   62.017   2.2385   62.017   2.2385 0.000000 0.000000 
1 1 1    8    0  106 o   53.679   2.4124  118.693   10.507  118.693   10.507  118.693   10.507   53.679   2.4124   53.679   2.4124 -0.000000 0.000000 
1 1 1    8    0  107 o   74.442   2.3851  227.660   14.440  227.660   14.440  227.660   14.440   74.442   2.3851   74.442   2.3851 -0.000000 0.000000 
1 1 1    8    0  108 o  126.461   1.9905  654.685   20.507  654.685   20.507  654.685   20.507  126.461   1.9905  126.461   1.9905 0.000000 0.000000 
1 1 1    8    0  109 o   22.119   6.5891   25.236   10.339   25.236   10.339   25.236   10.339   22.119   6.5891   22.119   6.5891 -0.000000 0.000000 
1 1 1    8    0  110 o  113.663   1.9823  529.250   18.354  529.250   18.354  529.250   18.354  113.663   1.9823  113.663   1.9823 0.000000 0.000000 
1 1 1    8    0  111 o   7.0915   4.7899  -3.4432   8.0845  -3.4432   8.0845  -3.4432   8.0845   7.0915   4.7899   7.0915   4.7899 -0.000000 0.000000 
1 1 1    8    0  112 o   30.198   3.8455   39.538   9.0474   39.538   9.0474   39.538   9.0474   30.198   3.8455   30.198   3.8455 0.000000 0.000000 
1 1 1    8    0  113 o   69.833   2.4369  200.956   13.834  200.956   13.834  200.956   13.834   69.833   2.4369   69.833   2.4369 0.000000 0.000000 
1 1 1    8    0  114 o   11.008   6.1602   7.1927   8.2885   7.1927   8.2885   7.1927   8.2885   11.008   6.1602   11.008   6.1602 -0.000000 0.000000 
1 1 1    8    0  115 o   22.713   6.7507   26.933   10.874   26.933   10.874   26.933   10.874   22.713   6.7507   22.713   6.7507 0.000000 0.000000 
1 1 1    8    0  116 o   7.3312   5.0415  -6.2559   9.8525  -6.2559   9.8525  -6.2559   9.8525   7.3312   5.0415   7.3312   5.0415 0.000000 0.000000 
1 1 1    8    0  117 o   21.910   6.7829   25.607   10.605   25.607   10.605   25.607   10.605   21.910   6.7829   21.910   6.7829 0.000000 0.000000 
1 1 1    8    0  118 o   70.915   2.2067  207.384   12.728  207.384   12.728  207.384   12.728   70.915   2.2067   70.915   2.2067 -0.000000 0.000000 
1 1 1    8    0  119 o   22.729   5.6422   25.572   9.0466   25.572   9.0466   25.572   9.0466   22.729   5.6422   22.729   5.6422 0.000000 0.000000 
1 1 1    8    0  120 o   9.7590   5.9406   4.4393   8.8631   4.4393   8.8631   4.4393   8.8631   9.7590   5.9406   9.7590   5.9406 -0.000000 0.000000 
1 1 1    8    0  121 o   40.236   3.1856   68.709   10.293   68.709   10.293   68.709   10.293   40.236   3.1856   40.236   3.1856 -0.000000 0.000000 
1 1 1    8    0  122 o   12.379   7.2719   9.5126   12.398   9.5126   12.398   9.5126   12.398   12.379   7.2719   12.379   7.2719 0.000000 0.000000 
1 1 1    8    0  123 o   43.149   4.1741   81.385   14.345   81.385   14.345   81.385   14.345   43.149   4.1741   43.149   4.1741 0.000000 0.000000 
1 1 1    8    0  124 o   29.699   6.4449   43.851   13.677   43.851   13.677   43.851   13.677   29.699   6.4449   29.699   6.4449 -0.000000 0.000000 
1 1 1    8    0  125 o   40.918   4.4771   74.377   14.479   74.377   14.479   74.377   14.479   40.918   4.4771   40.918   4.4771 -0.000000 0.000000 
1 1 1    8    0  126 o   18.185   8.1251   22.470   12.800   22.470   12.800   22.470   12.800   18.185   8.1251   18.185   8.1251 0.000000 0.000000 
1 1 1    8    0  127 f   15.388   7.9182   17.158   12.679   17.158   12.679   17.158   12.679   15.388   7.9182   15.388   7.9182 -0.000000 0.000000 
1 1 1    8    0  128 o   22.805   7.7882   30.776   12.992   30.776   12.992   30.776   12.992   22.805   7.7882   22.805   7.7882 -0.000000 0.000000 
1 1 1    8    0  129 o   47.885   4.7616  102.774   18.133  102.774   18.133  102.774   18.133   47.885   4.7616   47.885   4.7616 -0.000000 0.000000 
1 1 1    8    0  130 o   24.547   9.0516   38.636   16.764   38.636   16.764   38.636   16.764   24.547   9.0516   24.547   9.0516 -0.000000 0.000000 
1 1 1    8    0  131 o   14.866   9.1643   16.565   21.703   16.565   21.703   16.565   21.703   14.866   9.1643   14.866   9.1643 0.000000 0.000000 
1 1 1    8    0  132 o   14.013   8.9135   12.779   22.309   12.779   22.309   12.779   22.309   14.013   8.9135   14.013   8.9135 -0.000000 0.000000 
1 1 1    8    0  133 o   13.847   8.8359   12.335   22.129   12.335   22.129   12.335   22.129   13.847   8.8359   13.847   8.8359 0.000000 0.000000 
1 1 1    8    0  134 o   14.902   8.4531   17.357   15.883   17.357   15.883   17.357   15.883   14.902   8.4531   14.902   8.4531 -0.000000 0.000000 
1 1 1    8    0  135 o   7.7707   5.5277 -16.2866   15.142 -16.2866   15.142 -16.2866   15.142   7.7707   5.5277   7.7707   5.5277 0.000000 0.000000 
1 1 1    8    1 -134 o   10.149   4.6465  -2.8941   8.6519  -5.8392   10.330   4.0246   15.834   10.410   4.8725   14.584   6.5168 -4.173587 8.136921 
1 1 1    8    1 -133 o   9.8595   4.5025  -2.6211   8.0558   1.3274   10.314  -8.7978   12.900   12.079   5.3362   11.109   5.2737 0.9700422 7.502476 
1 1 1    8    1 -132 f   10.826   4.7525   0.6834   8.0614  -2.6267   10.284   5.9602   12.984   11.076   5.0690   14.265   6.1483 -3.188795 7.968430 
1 1 1    8    1 -131 o   9.9012   4.5723  -3.9166   8.6319   3.6555   11.824 -12.5581   12.631   13.334   5.8065   10.436   5.0245 2.898300 7.678659 
1 1 1    8    1 -130 o   29.859   3.9575   40.690   9.3955   44.688   12.873   36.132   13.744   29.951   5.4745   25.800   6.5303 4.151848 8.521421 
1 1 1    8    1 -129 o   10.906   4.8692  -0.6255   8.8198  -3.9837   12.035   3.2703   12.963   11.691   5.3987   13.698   6.0194 -2.007501 8.085728 
1 1 1    8    1 -128 o   11.225   4.8341   1.7034   8.0137  -1.4743   10.235   6.7392   12.884   11.434   5.1632   14.642   6.2125 -3.208832 8.077962 
1 1 1    8    1 -127 o   17.806   5.2548   15.706   8.1503   13.292   10.303   19.743   13.323   16.501   5.9664   19.143   6.8009 -2.641865 9.047068 
1 1 1    8    1 -126 o   12.258   4.8531   5.2001   7.1958   6.8383   10.112   3.5198   10.242   13.945   5.6719   12.885   5.5052 1.059870 7.904276 
1 1 1    8    1 -125 o   14.736   5.1668   9.9251   7.6704   9.8739   10.279   9.9893   11.522   15.189   5.8617   15.496   6.1390 -0.3074541 8.488055 
1 1 1    8    1 -124 o   19.932   4.7523   18.911   7.6121   15.995   10.207   22.564   11.426   17.901   5.9686   20.866   6.2378 -2.964371 8.633325 
1 1 1    8    1 -123 o   14.835   5.1755   9.9788   7.6902   7.3263   10.243   13.405   11.642   14.298   5.7467   16.906   6.3033 -2.608038 8.529745 
1 1 1    8    1 -122 o   19.599   4.9444   18.316   7.8974   20.111   10.619   16.094   11.813   19.996   6.0219   18.097   6.4063 1.899178 8.792245 
1 1 1    8    1 -121 o   31.219   3.0997   41.966   7.7842   35.748   10.879   48.489   11.143   27.652   5.0108   32.841   4.2629 -5.188463 6.578782 
1 1 1    8    1 -120 o   18.277   4.9997   15.695   7.6626   12.153   11.674   18.375   10.157   16.758   6.2989   19.447   5.8962 -2.689484 8.627971 
1 1 1    8    1 -119 o   21.483   4.6317   21.172   7.8718   24.568   12.146   18.712   10.337   22.272   6.3695   19.692   5.9436 2.580256 8.711888 
1 1 1    8    1 -118 o   52.316   2.2135  113.925   9.4184  128.342   14.637  103.738   12.304   54.857   3.2884   49.445   3.0678 5.412029 4.497195 
1 1 1    8    1 -117 o   55.355   2.1472  127.174   9.6705  139.530   13.009  111.912   14.458   57.642   2.7768   51.172   3.4870 6.469940 4.457535 
1 1 1    8    1 -116 o   36.382   3.1758   56.158   9.3240   53.609   11.237   61.793   16.706   35.146   3.9929   36.626   5.7875 -1.480022 7.031293 
1 1 1    8    1 -115 o   12.018   5.0828   1.6645   8.5782   10.840   10.405 -17.8070   15.158   16.389   5.9855   11.587   5.5593 4.802255 8.168944 
1 1 1    8    1 -114 o   20.363   5.3022   18.914   8.8862   23.754   10.796   8.7479   15.647   22.651   5.8172   17.315   7.0507 5.335793 9.140713 
1 1 1    8    1 -113 f   58.702   1.9469  142.028   9.3034  134.088   13.077  150.165   13.238   56.680   2.8394   60.051   2.7115 -3.370548 3.926081 
1 1 1    8    1 -112 o   17.319   4.9854   13.336   7.4174   18.423   10.553   8.3684   10.428   20.131   5.9892   15.536   5.9271 4.594625 8.426191 
1 1 1    8    1 -111 o   35.219   2.7936   51.806   7.9546   55.691   11.109   47.717   11.396   36.155   3.8274   33.246   4.3060 2.908524 5.761126 
1 1 1    8    1 -110 o   40.370   2.6350   67.751   8.6237   72.129   11.388   61.867   13.204   41.394   3.4052   37.934   4.3485 3.460075 5.523156 
1 1 1    8    1 -109 o   32.123   3.0128   43.229   7.7969   41.211   10.938   45.314   11.118   30.862   4.4783   32.454   4.3089 -1.591217 6.214627 
1 1 1    8    1 -108 o   15.296   5.2348   9.4540   7.8528   0.6942   10.056   23.147   12.572   12.739   5.4493   22.562   6.4893 -9.822989 8.473822 
1 1 1    8    1 -107 o   64.295   1.8135  169.651   9.4949  176.099   13.304  162.958   13.555   65.304   2.5039   62.766   2.6553 2.538288 3.649734 
1 1 1    8    1 -106 o   20.625   4.5491   18.611   7.4425   10.347   10.449   27.122   10.604   16.585   6.0068   24.741   5.4089 -8.156183 8.083183 
1 1 1    8    1 -105 o   95.182   1.6652  370.899   12.920  369.098   19.381  372.341   17.334   94.649   2.5142   95.197   2.2337 -0.5484924 3.363137 
1 1 1    8    1 -104 o   47.164   2.3946   91.663   9.1759   90.681   13.893   92.422   12.220   46.564   3.6905   47.160   3.1978 -0.5960770 4.883210 
1 1 1    8    1 -103 o   44.986   2.6534   83.547   9.6868   79.016   13.893   87.834   13.513   43.402   3.9708   45.876   3.6435 -2.474968 5.389133 
1 1 1    8    1 -102 o   30.543   3.6897   39.185   9.0002   35.976   12.766   42.357   12.691   28.700   5.6580   31.364   5.1420 -2.664667 7.645440 
1 1 1    8    1 -101 o  114.296   1.7465  534.255   16.272  530.401   23.206  537.982   22.822  113.679   2.5043  114.507   2.4450 -0.8282242 3.499960 
1 1 1    8    1 -100 o   85.363   1.2707  297.474   8.8419  288.444   15.867  301.542   10.648   83.866   2.3232   85.914   1.5205 -2.048409 2.776528 
1 1 1    8    1  -99 o   43.971   1.6157   79.098   5.7815   70.229   13.332   81.151   6.4162   41.016   4.0399   44.523   1.7714 -3.506756 4.411238 
1 1 1    8    1  -98 o  155.586   1.4385  988.301   18.243  966.852   31.261  999.378   22.465  153.624   2.4964  156.388   1.7623 -2.764267 3.055717 
1 1 1    8    1  -97 o   25.248   2.2044   26.273   4.4914   14.960   12.363   27.993   4.8208   19.436   6.5696   26.057   2.2931 -6.620079 6.958268 
1 1 1    8    1  -96 o  137.912   1.2845  776.063   14.440  780.765   24.454  773.545   17.892  138.185   2.1710  137.646   1.5947 0.5388489 2.693689 
1 1 1    8    1  -95 o   81.863   1.4354  273.489   9.5783  241.773   24.011  279.491   10.445   76.570   3.8594   82.748   1.5486 -6.177834 4.158493 
1 1 1    8    1  -94 o   44.793   1.6918   82.026   6.1661   82.166   13.590   81.990   6.9193   44.564   3.7765   44.765   1.9005 -0.2016296 4.227787 
1 1 1    8    1  -93 o  122.026   1.2704  607.398   12.636  601.921   21.620  610.240   15.573  121.376   2.1852  122.285   1.5623 -0.9093704 2.686233 
1 1 1    8    1  -92 o   85.537   1.3444  298.458   9.3737  297.625   19.195  298.720   10.742   85.255   2.7657   85.563   1.5401 -0.3076248 3.165582 
1 1 1    8    1  -91 o  113.363   1.3033  524.172   12.043  550.711   23.510  514.731   14.023  116.084   2.4846  112.322   1.5316 3.762276 2.918685 
1 1 1    8    1  -90 o   48.740   1.6355   97.035   6.4888   81.124   14.489  101.027   7.2573   44.285   4.0589   49.722   1.7935 -5.437485 4.437475 
1 1 1    8    1  -89 o   85.098   1.3702  295.360   9.5046  275.128   18.329  302.802   11.116   81.999   2.7460   86.153   1.5828 -4.154152 3.169563 
1 1 1    8    1  -88 o   78.268   1.3548  249.834   8.6437  243.024   17.566  252.010   9.9290   77.062   2.8010   78.600   1.5497 -1.538200 3.201142 
1 1 1    8    1  -87 o   71.677   1.3588  209.523   7.9389  190.095   13.969  218.791   9.6486   68.176   2.5180   73.236   1.6162 -5.060036 2.992043 
1 1 1    8    1  -86 o  151.793   1.2820  939.576   15.863  938.836   26.202  940.004   19.930  151.666   2.1194  151.805   1.6106 -0.1391602 2.661956 
1 1 1    8    1  -85 f  129.275   1.2467  681.441   13.137  681.689   21.958  681.303   16.396  129.246   2.0842  129.245   1.5562 0.8544922E-03 2.601101 
1 1 1    8    1  -84 o  107.947   1.2799  475.137   11.262  503.962   21.397  464.091   13.246  111.115   2.3624  106.675   1.5233 4.439301 2.810907 
1 1 1    8    1  -83 o   79.514   1.3256  257.805   8.5922  263.463   16.689  255.764   10.023   80.294   2.5530   79.193   1.5526 1.100975 2.988077 
1 1 1    8    1  -82 o  175.032   1.3978  1249.23   19.944  1233.38   35.324  1256.65   24.164  173.830   2.4929  175.532   1.6888 -1.702393 3.011083 
1 1 1    8    1  -81 o  152.443   1.4987  947.621   18.623  938.433   29.672  953.592   23.921  151.643   2.4005  152.898   1.9193 -1.254898 3.073414 
1 1 1    8    1  -80 o  144.229   1.4123  848.178   16.604  837.394   24.707  857.060   22.422  143.273   2.1156  144.958   1.8975 -1.685593 2.841887 
1 1 1    8    1  -79 o  261.613   1.8417  2791.29   39.274  2784.92   56.469  2797.26   54.660  261.224   2.6519  261.814   2.5612 -0.5897827 3.686765 
1 1 1    8    1  -78 o   46.784   1.9656   89.428   7.4794   90.490   13.326   88.939   9.0371   46.938   3.5083   46.629   2.3855 0.3082886 4.242510 
1 1 1    8    1  -77 o  195.359   1.5080  1556.14   24.014  1571.63   37.349  1545.22   31.355  196.274   2.3344  194.645   1.9762 1.629150 3.058538 
1 1 1    8    1  -76 o   7.9270   3.6075  -3.2594   5.1149   17.106   11.034  -8.8341   5.7727   20.350   6.1404   7.0586   3.3980 13.29126 7.017851 
1 1 1    8    1  -75 o  100.938   1.2297  415.359   10.118  401.690   17.098  422.725   12.552   99.240   2.1136  101.823   1.5123 -2.583252 2.598880 
1 1 1    8    1  -74 o   34.554   1.9093   48.840   5.3571   44.971   10.376   50.245   6.2552   32.945   3.9419   35.029   2.2018 -2.084347 4.515178 
1 1 1    8    1  -73 o  138.167   1.2240  778.238   13.786  778.093   22.668  778.323   17.366  138.128   2.0133  138.166   1.5419 -0.3753662E-01 2.535917 
1 1 1    8    1  -72 o   88.451   1.2212  318.934   8.8047  327.998   15.098  314.263   10.839   89.681   2.0653   87.796   1.5145 1.885399 2.561052 
1 1 1    8    1  -71 o  370.474   2.1050  5597.41   63.568  5566.70  100.626  5617.80   82.003  369.286   3.3428  371.074   2.7110 -1.788605 4.303963 
1 1 1    8    1  -70 o  142.628   1.4250  829.341   16.568  798.456   22.931  863.071   23.964  139.928   2.0104  145.480   2.0208 -5.551315 2.850484 
1 1 1    8    1  -69 o   77.424   1.2864  244.370   8.1186  257.103   13.440  237.054   10.188   79.374   2.0789   76.251   1.6390 3.123436 2.647336 
1 1 1    8    1  -68 o  175.289   1.3734  1252.61   19.625  1237.27   29.929  1264.19   25.992  174.184   2.1079  176.082   1.8109 -1.897430 2.778942 
1 1 1    8    1  -67 o  289.241   1.8304  3411.16   43.157  3302.81   63.792  3502.60   58.604  284.538   2.7504  293.045   2.4533 -8.506958 3.685566 
1 1 1    8    1  -66 f  138.634   1.2740  783.477   14.397  797.474   22.404  773.631   18.790  139.848   1.9653  137.750   1.6734 2.097855 2.581254 
1 1 1    8    1  -65 o  317.555   1.9592  4111.80   50.715  4197.99   77.696  4047.82   66.942  320.776   2.9714  315.022   2.6069 5.753540 3.952864 
1 1 1    8    1  -64 o   70.760   1.3663  204.114   7.8808  222.674   12.477  191.794   10.165   73.869   2.0741   68.562   1.8205 5.306641 2.759739 
1 1 1    8    1  -63 o  201.899   1.5376  1661.82   25.305  1682.83   36.813  1643.00   34.842  203.144   2.2231  200.730   2.1294 2.413879 3.078390 
1 1 1    8    1  -62 o  194.588   1.5094  1543.61   23.942  1520.10   34.325  1565.89   33.412  193.076   2.1809  195.966   2.0916 -2.890213 3.021809 
1 1 1    8    1  -61 o   57.094   1.5726  132.991   7.3121  124.271   12.226  137.848   9.1238   55.131   2.7290   58.114   1.9287 -2.983238 3.341713 
1 1 1    8    1  -60 o  252.712   1.8692  2603.75   38.505  2555.86   58.780  2639.73   50.962  250.322   2.8807  254.422   2.4573 -4.100647 3.786361 
1 1 1    8    1  -59 o  262.856   1.8058  2816.88   38.692  2916.48   64.969  2762.14   48.165  267.397   2.9807  260.268   2.2703 7.128662 3.746814 
1 1 1    8    1  -58 o  270.895   1.9789  2991.91   43.698  2963.25   66.294  3013.94   58.108  269.536   3.0173  271.857   2.6222 -2.320526 3.997495 
1 1 1    8    1  -57 o  131.494   1.3568  704.827   14.543  715.552   21.040  695.017   20.124  132.481   1.9483  130.567   1.8908 1.913696 2.714946 
1 1 1    8    1  -56 o   89.702   1.4349  328.003   10.492  311.177   14.467  346.672   15.239   87.365   2.0315   92.213   2.0274 -4.848183 2.870032 
1 1 1    8    1  -55 o  153.188   1.4005  956.556   17.489  955.864   24.996  957.219   24.477  153.122   2.0026  153.231   1.9597 -0.1094055 2.801927 
1 1 1    8    1  -54 o  155.520   1.4155  985.890   17.944  943.735   25.276  1028.72   25.479  152.148   2.0380  158.853   1.9676 -6.704742 2.832847 
1 1 1    8    1  -53 o  138.671   1.4200  783.841   16.052  790.838   21.226  774.495   24.533  139.283   1.8695  137.831   2.1835 1.451569 2.874526 
1 1 1    8    1  -52 o  109.082   1.2947  485.008   11.512  480.552   15.886  489.937   16.707  108.575   1.7949  109.630   1.8695 -1.054344 2.591688 
1 1 1    8    1  -51 o  230.775   1.6597  2170.91   31.221  2149.80   43.716  2192.89   44.603  229.636   2.3354  231.925   2.3593 -2.289490 3.319711 
1 1 1    8    1  -50 o  209.455   1.6719  1788.31   28.545  1773.23   42.941  1800.24   38.209  208.554   2.5259  210.143   2.2306 -1.589233 3.369841 
1 1 1    8    1  -49 o  443.449   2.7282  8017.23   98.617  8093.18  140.465  7943.39  138.487  445.477   3.8682  441.336   3.8495 4.140564 5.457239 
1 1 1    8    1  -48 o  340.677   2.1924  4731.18   60.884  4741.16   76.852  4714.37   99.770  341.018   2.7647  340.019   3.5996 0.9988098 4.538811 
1 1 1    8    1  -47 o  317.024   2.0740  4096.89   53.597  4107.96   67.601  4078.15   87.945  317.438   2.6125  316.258   3.4114 1.180206 4.296873 
1 1 1    8    1  -46 o  428.954   2.6521  7501.13   92.733  7577.92  118.020  7377.23  149.918  431.115   3.3583  425.317   4.3242 5.797760 5.475134 
1 1 1    8    1  -45 o  317.926   2.0776  4120.14   53.842  4175.31   68.480  4030.83   87.135  320.035   2.6250  314.427   3.3997 5.607819 4.295175 
1 1 1    8    1  -44 o  348.776   2.2334  4958.60   63.498  5089.96   81.638  4757.44  101.027  353.351   2.8343  341.590   3.6283 11.76120 4.604092 
1 1 1    8    1  -43 o  403.820   2.6930  6647.55   88.648  6670.99  104.868  6588.85  165.928  404.517   3.1803  401.940   5.0644 2.577393 5.980141 
1 1 1    8    1  -42 f  333.200   2.1539  4525.48   58.501  4540.07   73.924  4501.02   95.693  333.727   2.7174  332.268   3.5331 1.457977 4.457279 
1 1 1    8    1  -41 o  374.576   2.3584  5719.25   72.010  5827.48  103.174  5616.46  100.552  378.080   3.3477  371.172   3.3234 6.907715 4.717233 
1 1 1    8    1  -40 o  648.537   3.8521 17147.80  203.644 17490.91  292.807 16826.34  283.415  654.890   5.4850  642.333   5.4129 12.55658 7.706130 
1 1 1    8    1  -39 o  343.120   2.3469  4798.93   65.642  4739.70   85.997  4881.61  101.609  340.982   3.0940  346.038   3.6022 -5.055511 4.748550 
1 1 1    8    1  -38 o  638.194   4.3796 16606.08  227.834 16260.09  316.341 16978.98  328.411  631.401   6.1463  645.201   6.2443 -13.79968 8.761784 
1 1 1    8    1  -37 o  334.108   2.4873  4550.17   67.742  4500.31   94.958  4601.84   96.668  332.254   3.5061  335.981   3.5297 -3.726715 4.975068 
1 1 1    8    1  -36 o  235.650   1.6879  2263.41   32.423  2270.93   46.374  2256.21   45.350  236.036   2.4102  235.269   2.3647 0.7661438 3.376559 
1 1 1    8    1  -35 o  239.072   1.7067  2329.61   33.260  2301.61   47.149  2357.35   46.926  237.624   2.4342  240.485   2.3938 -2.860764 3.413992 
1 1 1    8    1  -34 o  288.056   2.0739  3382.13   48.697  3526.01   77.677  3288.97   62.506  294.105   3.2401  284.054   2.6995 10.05042 4.217266 
1 1 1    8    1  -33 o  408.027   2.5450  6786.20   84.647  6882.18  140.572  6731.60  106.024  410.866   4.1972  406.370   3.2007 4.496307 5.278373 
1 1 1    8    1  -32 o  185.997   1.5148  1410.05   22.967  1391.33   38.209  1420.64   28.739  184.753   2.5371  186.693   1.8884 -1.939743 3.162787 
1 1 1    8    1  -31 o  560.828   3.3675 12821.47  153.947 12853.02  252.597 12802.82  194.178  561.438   5.5194  560.392   4.2508 1.046204 6.966558 
1 1 1    8    1  -30 o  248.047   1.6393  2507.80   33.145  2491.23   49.667  2521.10   44.506  247.221   2.4646  248.701   2.1954 -1.480194 3.300577 
1 1 1    8    1  -29 o  536.535   3.0438 11734.34  133.120 11703.77  199.350 11758.95  178.838  535.791   4.5644  537.069   4.0850 -1.277344 6.125450 
1 1 1    8    1  -28 o  250.771   1.6410  2563.17   33.544  2623.90   51.286  2517.77   44.343  253.718   2.4798  248.537   2.1888 5.181320 3.307561 
1 1 1    8    1  -27 o   36.909   1.7520   55.650   5.2562   59.662   7.4683   51.713   7.3989   38.183   2.4118   35.526   2.5724 2.656948 3.526220 
1 1 1    8    1  -26 o  212.607   1.4735  1842.35   25.536  1863.94   38.549  1825.46   34.088  213.845   2.2114  211.628   1.9760 2.217545 2.965655 
1 1 1    8    1  -25 o  965.138   5.3111 37979.29  417.838 37769.46  623.692 38150.16  562.811  962.246   7.9515  967.162   7.1388 -4.915588 10.68593 
1 1 1    8    1  -24 o  340.914   2.0478  4737.16   56.907  4808.76   86.331  4682.14   75.674  343.468   3.0835  338.921   2.7391 4.547729 4.124431 
1 1 1    8    1  -23 o  551.265   3.1142 12387.40  139.938 12585.64  212.690 12236.08  185.825  555.614   4.6961  547.860   4.1610 7.753723 6.274343 
1 1 1    8    1  -22 o  214.170   1.4689  1869.54   25.643  1862.71   38.368  1875.04   34.474  213.775   2.2018  214.482   1.9718 -0.7076263 2.955664 
1 1 1    8    1  -21 o  316.247   1.9245  4076.43   49.612  4103.08   74.804  4055.50   66.288  317.270   2.8924  315.428   2.5781 1.841766 3.874603 
1 1 1    8    1  -20 o  441.504   2.5453  7945.32   91.605  8075.41  139.238  7846.04  121.636  445.081   3.8378  438.724   3.4012 6.357910 5.128060 
1 1 1    8    1  -19 o  536.992   3.0380 11754.13  132.982 12057.08  203.733 11529.25  175.532  543.828   4.5958  531.806   4.0492 12.02136 6.125156 
1 1 1    8    1  -18 o  310.120   2.0107  3920.01   50.829  3887.29   71.487  3953.46   72.284  308.815   2.8398  311.433   2.8474 -2.617462 4.021463 
1 1 1    8    1  -17 o  294.746   1.9314  3540.98   46.404  3544.75   65.690  3537.22   65.561  294.897   2.7327  294.583   2.7303 0.3133850 3.862892 
1 1 1    8    1  -16 o  425.560   2.6171  7381.83   90.786  7367.53  128.381  7396.14  128.401  425.129   3.7046  425.954   3.6980 -0.8247070 5.234464 
1 1 1    8    1  -15 o  639.423   4.7921 16668.87  249.775 16790.90  397.628 16589.33  321.014  641.621   7.6026  637.836   6.1742 3.785034 9.793877 
1 1 1    8    1  -14 o  888.734   6.5723 32209.35  476.129 31467.40  737.646 32739.24  623.382  878.095   10.306  895.849   8.5366 -17.75446 13.38196 
1 1 1    8    1  -13 o  424.690   3.2945  7352.06  114.051  7383.42  181.303  7331.53  146.718  425.551   5.2266  424.078   4.2442 1.473053 6.732813 
1 1 1    8    1  -12 o  737.384   5.4907 22169.68  330.034 22709.05  532.770 21833.82  420.413  746.080   8.7603  731.687   7.0488 14.39337 11.24403 
1 1 1    8    1  -11 o  165.299   1.9253  1113.70   25.943  1168.99   37.762  1064.28   35.702  169.349   2.7355  161.587   2.7105 7.762390 3.850954 
1 1 1    8    1  -10 o   86.750   2.1188  306.743   14.983  306.743   14.983   0.0000   0.0000   86.750   2.1188  ?   ?  0.000000 2.118838 
1 1 1    8    1   -9 o  879.934   5.9423 31572.24  426.225 31441.74  520.138 31839.01  743.648  878.013   7.2674  883.234   10.329 -5.220520 12.62943 
1 1 1    8    1   -8 o  479.066   3.3532  9355.38  130.945  9463.80  161.924  9150.46  222.603  481.816   4.1228  473.723   5.7646 8.093750 7.087199 
1 1 1    8    1   -7 f  846.826   5.7307 29240.33  395.582 30195.33  497.846 27604.66  651.540  860.444   7.0980  822.466   9.7182 37.97809 12.03435 
1 1 1    8    1   -6 f  825.994   5.1766 27817.27  348.546 27731.21  460.080 27933.20  533.969  824.606   6.8447  827.517   7.9160 -2.910828 10.46478 
1 1 1    8    1   -5 o  320.756   2.3844  4193.62   62.344  4182.28   88.326  4204.87   88.010  320.310   3.3829  321.174   3.3617 -0.8642273 4.769135 
1 1 1    8    1   -4 o  1231.07   7.6478 61817.84  767.461 60861.16  1001.17 63181.04  1195.11  1221.16   10.058  1243.90   11.787 -22.73975 15.49456 
1 1 1    8    1   -3 o  1202.87   7.4703 59016.40  732.477 58577.32  962.654 59620.16  1128.84  1198.05   9.8573  1208.39   11.460 -10.33752 15.11623 
1 1 1    8    1   -2 o  685.109   4.3259 19135.34  241.585 19161.00  320.099 19101.37  368.246  685.503   5.7285  684.385   6.6009 1.117737 8.739958 
1 1 1    8    1   -1 o  660.404   4.1779 17779.88  224.906 17692.00  296.366 17899.21  345.353  658.711   5.5195  662.510   6.3949 -3.799194 8.447453 
1 1 1    8    1    0 o  501.798   3.2385 10264.24  132.466 10001.49  171.582 10651.90  208.414  495.309   4.2497  511.136   5.0021 -15.82724 6.563627 
1 1 1    8    1    1 o  591.081   3.7645 14242.45  181.380 14184.60  239.204 14320.70  278.214  589.837   4.9751  592.626   5.7592 -2.788940 7.610510 
1 1 1    8    1    2 o  603.831   3.8406 14863.60  189.037 14928.13  251.000 14779.02  287.347  605.094   5.0888  602.031   5.8553 3.063904 7.757633 
1 1 1    8    1    3 o  623.432   3.9564 15844.44  201.061 15842.39  266.040 15847.16  307.029  623.342   5.2358  623.398   6.0420 -0.5529785E-01 7.994951 
1 1 1    8    1    4 o  754.836   4.7464 23229.67  292.045 22994.96  383.042 23555.55  451.339  750.929   6.2577  759.955   7.2858 -9.026855 9.604239 
1 1 1    8    1    5 o  179.788   1.5192  1317.47   22.264  1321.50   29.686  1312.30   33.660  180.061   2.0225  179.431   2.3013 0.6295624 3.063769 
1 1 1    8    1    6 f  271.172   2.0952  2997.24   46.313  3035.66   66.157  2960.32   64.855  272.897   2.9740  269.489   2.9524 3.407501 4.190588 
1 1 1    8    1    7 f  598.726   4.1142 14613.68  200.795 14548.81  282.946 14679.50  284.998  597.330   5.8110  600.006   5.8271 -2.675964 8.229396 
1 1 1    8    1    8 o  251.438   1.9896  2576.85   40.780  2519.82   56.944  2636.89   58.427  248.633   2.8096  254.343   2.8181 -5.710083 3.979413 
1 1 1    8    1    9 o  1050.71   7.0671 45025.29  605.288 44284.49  843.471 45811.82  869.117  1041.70   9.9332  1059.50   10.063 -17.79346 14.14000 
1 1 1    8    1   10 o  176.710   1.7708  1272.77   25.508  1369.32   41.852  1215.70   32.175  183.285   2.8013  172.701   2.2855 10.58397 3.615321 
1 1 1    8    1   11 o  641.438   4.8072 16774.26  251.353 16885.28  399.531 16701.54  323.364  643.413   7.6177  639.983   6.1985 3.430176 9.820950 
1 1 1    8    1   12 o  539.864   4.5909 11882.01  202.030 12926.47  305.853 11073.53  269.092  563.008   6.6644  521.110   6.3348 41.89807 9.194799 
1 1 1    8    1   13 o  277.829   3.6814  3146.55   83.374  3208.80  119.471  3087.46  116.405  280.540   5.2244  275.185   5.1894 5.355042 7.363645 
1 1 1    8    1   14 o  141.722   2.5437  818.682   29.386  883.055   43.041  762.476   40.218  147.182   3.5875  136.717   3.6120 10.46519 5.090843 
1 1 1    8    1   15 o  251.667   3.4305  2581.79   70.376  2525.52   97.881  2642.01  101.258  248.891   4.8245  254.566   4.8797 -5.674683 6.862033 
1 1 1    8    1   16 o  404.036   4.9902  6655.50  164.352  6756.67  235.110  6558.81  229.839  407.032   7.0861  401.030   7.0309 6.002106 9.982295 
1 1 1    8    1   17 o  426.222   3.7080  7405.44  128.827  7261.09  179.511  7558.74  184.990  422.012   5.2183  430.573   5.2707 -8.561523 7.416927 
1 1 1    8    1   18 o  724.857   5.4082 21422.41  319.551 21789.31  512.339 21188.81  408.813  730.836   8.6001  720.809   6.9577 10.02704 11.06215 
1 1 1    8    1   19 o  576.146   4.3508 13532.34  204.334 13521.61  322.889 13539.51  263.898  575.816   6.8791  576.254   5.6181 -0.4372559 8.881722 
1 1 1    8    1   20 o  369.364   2.9300  5561.12   88.219  5534.29  138.965  5579.23  114.178  368.443   4.6270  369.952   3.7862 -1.509369 5.978645 
1 1 1    8    1   21 o  155.970   1.7007  991.521   21.622  983.304   34.065  997.065   27.981  155.318   2.6906  156.403   2.1947 -1.085403 3.472180 
1 1 1    8    1   22 o  376.763   2.9806  5786.19   91.541  5836.79  145.796  5753.26  117.613  378.375   4.7270  375.676   3.8407 2.699371 6.090592 
1 1 1    8    1   23 o  549.275   4.1667 12299.37  186.560 12428.56  297.568 12215.70  239.468  552.059   6.6125  547.364   5.3671 4.695557 8.516470 
1 1 1    8    1   24 o  1133.58   8.3469 52421.11  771.283 51274.02  1195.76 53238.36  1009.31  1120.37   13.093  1142.03   10.842 -21.65881 16.99945 
1 1 1    8    1   25 o  154.553   1.7259  973.595   21.743  1021.28   35.414  944.742   27.547  158.288   2.7447  152.244   2.2197 6.044296 3.529927 
1 1 1    8    1   26 o  361.462   2.8903  5325.74   85.161  5451.02  137.214  5247.25  108.612  365.657   4.6035  358.775   3.7138 6.881775 5.914762 
1 1 1    8    1   27 o  351.132   2.8267  5025.66   80.908  5337.31  134.074  4847.17  101.465  361.824   4.5458  344.828   3.6098 16.99573 5.804729 
1 1 1    8    1   28 o  292.488   2.7524  3487.13   65.623  3602.45   95.001  3381.88   90.755  297.269   3.9205  288.026   3.8655 9.243561 5.505679 
1 1 1    8    1   29 o  280.159   2.3935  3199.26   54.660  3335.33   89.108  3117.18   69.211  286.037   3.8217  276.534   3.0704 9.502655 4.902320 
1 1 1    8    1   30 o  1387.67   10.189 78601.21  1152.50 78714.46  1824.67 78526.04  1486.56  1387.10   16.138  1386.31   13.155 0.7889404 20.81999 
1 1 1    8    1   31 o  166.952   2.0902  1136.10   28.445  1165.02   40.878  1108.95   39.607  169.058   2.9663  164.939   2.9459 4.118790 4.180593 
1 1 1    8    1   32 o  799.572   5.9489 26070.77  387.728 25897.44  609.729 26188.44  502.388  796.591   9.3900  801.230   7.6921 -4.639099 12.13840 
1 1 1    8    1   33 o  127.024   1.8160  657.662   18.804  704.514   30.510  628.966   23.878  131.466   2.8470  124.220   2.3581 7.246132 3.696765 
1 1 1    8    1   34 o  332.614   2.7301  4509.60   74.022  4721.91  121.365  4383.84   93.407  340.321   4.3749  327.931   3.4943 12.39066 5.599119 
1 1 1    8    1   35 o  496.685   6.0360 10060.77  244.379   0.0000   0.0000 10060.77  244.379  ?   ?   496.685   6.0360 0.000000 6.035971 
1 1 1    8    1   36 o  515.381   5.0982 10830.71  214.182 11275.12  384.015 10630.04  258.046  525.602   8.9630  510.529   6.2007 15.07303 10.89884 
1 1 1    8    1   37 o  431.730   5.3498  7600.71  188.273  7424.05  261.214  7791.70  271.605  426.578   7.5121  437.005   7.6246 -10.42795 10.70354 
1 1 1    8    1   38 o  300.414   4.0069  3679.40   98.121  3769.22  141.199  3595.52  136.451  304.012   5.6978  296.927   5.6375 7.085693 8.015382 
1 1 1    8    1   39 o  454.951   4.5626  8439.42  169.206  8526.81  295.540  8396.81  206.379  457.112   7.9315  453.755   5.5797 3.356598 9.697531 
1 1 1    8    1   40 o  327.718   3.0070  4378.11   80.327  4439.50  114.670  4318.96  112.559  329.976   4.2632  325.466   4.2427 4.510254 6.014541 
1 1 1    8    1   41 o  219.641   2.3016  1966.46   41.208  1983.52   58.669  1949.84   57.892  220.579   3.2629  218.699   3.2474 1.880203 4.603508 
1 1 1    8    1   42 f  376.401   3.3590  5775.94  103.060  5796.24  146.188  5755.88  145.314  377.012   4.7569  375.698   4.7450 1.314392 6.718819 
1 1 1    8    1   43 o  414.654   3.6428  7010.10  123.129  6982.39  173.615  7038.15  174.650  413.765   5.1475  415.413   5.1577 -1.648224 7.286868 
1 1 1    8    1   44 o  438.398   3.8253  7836.40  136.701  8070.92  197.865  7622.24  189.082  444.817   5.4570  432.282   5.3660 12.53506 7.653240 
1 1 1    8    1   45 o  245.084   2.4569  2448.57   49.083  2439.51   69.278  2457.70   69.550  244.608   3.4745  245.518   3.4752 -0.9098511 4.914163 
1 1 1    8    1   46 o  446.211   3.8831  8118.91  141.240  8100.70  199.408  8137.25  200.081  445.603   5.4898  446.606   5.4960 -1.003754 7.768139 
1 1 1    8    1   47 o  254.798   2.5182  2646.63   52.303  2666.57   74.243  2626.98   73.697  255.728   3.5615  253.822   3.5619 1.905426 5.037045 
1 1 1    8    1   48 o  170.612   2.0550  1186.58   28.580  1177.04   40.249  1196.28   40.590  169.912   2.9060  171.295   2.9070 -1.383148 4.110415 
1 1 1    8    1   49 o   33.031   3.3863   44.955   8.9885   37.684   11.989   54.288   13.583   29.978   5.0878   36.175   4.7188 -6.197130 6.939207 
1 1 1    8    1   50 o  221.177   2.0862  1994.21   37.612  2034.77   49.456  1938.56   57.926  223.400   2.7158  218.040   3.2591 5.360992 4.242352 
1 1 1    8    1   51 o  209.739   2.0338  1793.29   34.771  1793.67   45.170  1792.74   54.474  209.747   2.6419  209.677   3.1871 0.6962585E-01 4.139729 
1 1 1    8    1   52 o  115.002   1.5555  539.101   14.582  546.768   17.827  523.600   25.348  115.813   1.8883  113.322   2.7441 2.491714 3.331051 
1 1 1    8    1   53 o  237.428   1.8040  2298.00   34.915  2287.18   46.310  2312.25   53.147  236.852   2.3986  238.135   2.7379 -1.283325 3.639992 
1 1 1    8    1   54 o  107.495   1.6166  471.032   14.165  497.318   19.564  442.068   20.536  110.446   2.1731  104.127   2.4195 6.319283 3.252096 
1 1 1    8    1   55 o   66.876   1.5624  182.315   8.5173  167.224   13.202  193.076   11.148   63.990   2.5359   68.790   1.9901 -4.799210 3.223591 
1 1 1    8    1   56 o  241.917   1.8360  2385.85   36.205  2386.53   47.932  2384.95   55.249  241.929   2.4305  241.832   2.8027 0.9712219E-01 3.709777 
1 1 1    8    1   57 o  434.220   2.8639  7689.54  101.370  7846.06  157.233  7578.20  132.608  438.428   4.3996  430.964   3.7748 7.464020 5.797003 
1 1 1    8    1   58 o  459.025   3.2477  8595.24  121.520  8527.33  170.727  8664.98  173.005  457.011   4.5829  460.680   4.6071 -3.669586 6.498294 
1 1 1    8    1   59 o  421.282   3.3110  7240.56  113.702  7284.98  147.158  7174.74  179.107  422.437   4.2735  419.058   5.2433 3.378662 6.764221 
1 1 1    8    1   60 o  170.135   1.6881  1180.08   23.411  1164.37   28.203  1214.89   41.984  168.989   2.0474  172.578   2.9844 -3.589508 3.619197 
1 1 1    8    1   61 o  181.614   1.7219  1344.71   25.491  1320.31   30.733  1398.51   45.634  179.946   2.0952  185.155   3.0235 -5.209503 3.678564 
1 1 1    8    1   62 o  137.430   1.5788  769.984   17.686  771.091   24.365  768.752   25.714  137.514   2.1736  137.301   2.2975 0.2126770 3.162776 
1 1 1    8    1   63 o  139.589   1.5802  794.367   17.981  780.253   24.573  810.632   26.380  138.327   2.1793  140.990   2.2954 -2.663300 3.165139 
1 1 1    8    1   64 o  241.923   1.9939  2386.43   39.321  2434.12   55.738  2339.19   55.480  244.277   2.7992  239.464   2.8422 4.813828 3.989200 
1 1 1    8    1   65 o  272.817   2.1558  3035.11   47.941  3078.87   67.874  2991.56   67.723  274.706   3.0311  270.779   3.0682 3.926697 4.312950 
1 1 1    8    1   66 f  179.738   1.7086  1317.15   25.034  1306.05   34.605  1329.34   36.260  178.951   2.3723  180.535   2.4640 -1.584305 3.420339 
1 1 1    8    1   67 o   77.107   1.6293  242.402   10.241  253.377   13.901  229.374   15.145   78.794   2.1663   74.950   2.4824 3.844490 3.294705 
1 1 1    8    1   68 o   39.104   2.3568   62.592   7.4776   60.686   9.7914   65.259   11.583   38.435   3.1530   39.820   3.6075 -1.385509 4.791195 
1 1 1    8    1   69 o  101.955   1.4474  423.779   12.029  412.410   15.385  441.656   19.293  100.569   1.8767  104.063   2.2744 -3.493797 2.948741 
1 1 1    8    1   70 o  107.194   1.4551  468.457   12.715  481.099   16.569  450.349   19.830  108.621   1.8714  105.079   2.3151 3.541557 2.976824 
1 1 1    8    1   71 o  220.249   1.7556  1977.95   31.520  1951.50   41.038  2016.00   49.219  218.738   2.3016  222.291   2.7163 -3.553726 3.560284 
1 1 1    8    1   72 o   79.595   1.5442  258.300   10.019  258.768   12.863  257.579   15.975   79.658   1.9810   79.424   2.4705 0.2338028 3.166690 
1 1 1    8    1   73 o   99.999   1.4778  407.694   12.046  402.859   15.489  415.094   19.163   99.393   1.9117  100.878   2.3303 -1.484810 3.014184 
1 1 1    8    1   74 o   55.618   1.8677  126.288   8.4558  114.969   10.605  146.048   14.011   53.030   2.4599   59.754   2.8851 -6.723831 3.791471 
1 1 1    8    1   75 o   60.509   1.8106  149.441   8.9204  151.606   11.329  145.909   14.470   60.921   2.2854   59.716   2.9821 1.205536 3.757111 
1 1 1    8    1   76 o  206.169   1.8768  1733.46   31.542  1713.84   37.886  1777.79   56.940  204.971   2.2675  208.652   3.3478 -3.681488 4.043448 
1 1 1    8    1   77 o  237.486   2.2372  2300.73   43.308  2297.71   55.204  2305.56   69.840  237.264   2.8543  237.567   3.6065 -0.3030090 4.599311 
1 1 1    8    1   78 o  148.207   2.1974  896.016   26.547  958.207   38.236  838.135   36.887  153.202   3.0617  143.274   3.1584 9.927551 4.398825 
1 1 1    8    1   79 o  186.622   1.8079  1420.37   27.503  1470.17   38.995  1371.07   38.796  189.809   2.5203  183.294   2.5966 6.515152 3.618597 
1 1 1    8    1   80 o   28.462   3.6806   33.655   8.3394   31.339   10.366   37.905   14.041   27.262   4.8419   29.866   5.9761 -2.603930 7.691415 
1 1 1    8    1   81 o  131.329   1.6033  703.355   17.163  696.060   20.696  719.422   30.715  130.629   1.9437  132.740   2.8386 -2.111481 3.440292 
1 1 1    8    1   82 o   65.242   1.8434  173.764   9.7940  177.434   11.757  165.440   17.705   65.907   2.1914   63.530   3.4315 2.376091 4.071578 
1 1 1    8    1   83 o  215.566   1.8899  1895.65   33.208  1906.13   40.612  1874.49   57.688  216.113   2.3054  214.160   3.3045 1.953125 4.029236 
1 1 1    8    1   84 o   65.027   1.8480  172.639   9.7855  160.629   11.605  202.182   18.202   62.694   2.2747   70.264   3.1862 -7.570797 3.914861 
1 1 1    8    1   85 f   38.828   2.5761   61.833   8.1074   59.373   9.6057   67.926   15.117   37.986   3.1299   40.433   4.6725 -2.447330 5.623959 
1 1 1    8    1   86 o  145.339   1.5327  861.571   18.158  866.123   23.677  855.070   28.294  145.686   1.9937  144.713   2.3985 0.9726410 3.118957 
1 1 1    8    1   87 o   17.072   4.8661   12.264   7.1003   10.861   8.8871   14.738   11.806   16.706   5.5692   19.360   6.4181 -2.654701 8.497519 
1 1 1    8    1   88 o   30.577   3.0297   38.601   7.4525   35.480   9.3987   43.886   12.231   29.144   4.0668   32.345   4.7830 -3.200237 6.278188 
1 1 1    8    1   89 o  146.159   1.6535  871.569   19.699  864.678   27.036  879.367   28.762  145.513   2.2794  146.727   2.4047 -1.214706 3.313347 
1 1 1    8    1   90 o   39.531   2.4213   64.080   7.7649   62.243   9.8093   67.164   12.708   38.879   3.1214   40.283   3.9194 -1.404221 5.010518 
1 1 1    8    1   91 o  134.910   1.5215  742.567   16.733  749.825   21.854  732.284   26.012  135.521   1.9783  133.874   2.3837 1.646225 3.097673 
1 1 1    8    1   92 o   10.248   4.4706  -1.3762   7.0350   6.4046   8.9171 -14.2029   11.449   14.565   5.4984   10.430   4.9563 4.134263 7.402505 
1 1 1    8    1   93 o  101.064   1.5704  416.819   12.937  419.446   16.817  413.011   20.248  101.338   2.0358  100.507   2.4715 0.8310776 3.202002 
1 1 1    8    1   94 o   79.865   1.8713  260.486   12.183  258.556   16.372  262.880   18.236   79.464   2.5307   80.085   2.7978 -0.6213226 3.772563 
1 1 1    8    1   95 o  115.258   1.8181  542.552   17.081  561.129   21.811  513.090   27.468  117.145   2.2841  111.843   3.0157 5.301338 3.783066 
1 1 1    8    1   96 o   34.861   3.1034   50.244   8.7269   41.670   10.829   66.126   14.739   31.491   4.3335   39.732   4.6380 -8.241613 6.347442 
1 1 1    8    1   97 o   17.323   4.9347   12.766   7.3041   11.020   8.8482   16.502   12.941   16.674   5.5570   20.224   6.7199 -3.550575 8.719916 
1 1 1    8    1   98 o   63.425   1.8662  164.572   9.6380  168.079   11.697  157.156   17.010   64.045   2.2440   61.711   3.3945 2.334099 4.069187 
1 1 1    8    1   99 o   23.933   3.6422   24.145   6.8817   23.399   8.7039   25.391   11.240   23.320   4.7405   24.126   5.7893 -0.8064251 7.482510 
1 1 1    8    1  100 o   35.728   2.5530   52.629   7.3861   55.073   9.4771   48.848   11.788   36.431   3.2246   34.037   4.3478 2.393501 5.413041 
1 1 1    8    1  101 o   79.428   1.6077  257.876   10.409  260.130   13.434  254.491   16.467   79.672   2.0703   78.687   2.5707 0.9849014 3.300695 
1 1 1    8    1  102 o   27.273   3.1866   31.093   6.9508   30.705   8.8461   31.719   11.237   26.865   4.1749   27.009   5.2934 -0.1439514 6.741679 
1 1 1    8    1  103 o   49.190   2.0051   99.315   8.0232   97.477   10.278  102.182   12.837   48.615   2.6031   49.633   3.1898 -1.017914 4.117132 
1 1 1    8    1  104 o   73.702   1.6323  222.265   9.8063  217.760   12.695  228.931   15.442   72.817   2.1410   74.547   2.5450 -1.729958 3.325776 
1 1 1    8    1  105 o   58.923   1.8098  142.385   8.6822  141.948   11.196  143.046   13.752   58.710   2.3441   58.783   2.8787 -0.7363510E-01 3.712392 
1 1 1    8    1  106 o  132.427   1.5354  717.676   16.574  734.894   21.899  694.590   25.359  133.813   2.0077  129.901   2.3948 3.911514 3.125066 
1 1 1    8    1  107 o   74.726   1.6760  228.781   10.209  237.747   13.355  216.174   15.835   76.016   2.1574   72.292   2.6919 3.723701 3.449728 
1 1 1    8    1  108 o   72.576   1.6888  215.915   9.9910  215.422   12.981  216.633   15.649   72.316   2.2047   72.346   2.6581 -0.3016663E-01 3.453462 
1 1 1    8    1  109 o   57.037   2.0779  133.994   9.6445  148.680   13.625  119.248   13.653   59.833   2.8014   53.437   3.1484 6.395790 4.214323 
1 1 1    8    1  110 o   34.599   2.9952   50.139   8.3644   48.110   9.7770   55.679   16.154   33.681   3.6178   35.259   5.8238 -1.578056 6.856020 
1 1 1    8    1  111 o   55.307   2.1280  126.206   9.5757  123.499   11.280  133.189   18.118   54.568   2.5429   55.975   3.9971 -1.407242 4.737386 
1 1 1    8    1  112 o   16.743   5.1685   12.306   7.7591   17.400   9.0393  -1.9556   15.124   19.618   5.4553   14.517   6.4350 5.101605 8.436164 
1 1 1    8    1  113 f   68.078   2.1022  191.312   11.652  208.740   15.418  168.100   17.793   70.839   2.6748   63.121   3.4715 7.718193 4.382475 
1 1 1    8    1  114 o   62.290   1.7734  159.688   8.9951  156.590   14.795  161.505   11.330   61.146   2.9773   62.468   2.2285 -1.322720 3.718920 
1 1 1    8    1  115 o   31.444   2.8871   41.659   7.3174   41.268   14.577   41.791   8.4607   29.661   6.2275   31.313   3.3676 -1.651804 7.079729 
1 1 1    8    1  116 o   22.399   3.4847   21.720   6.1557   15.721   9.6948   25.773   7.9679   18.492   5.7884   24.149   4.2002 -5.656494 7.151722 
1 1 1    8    1  117 o   71.527   1.5455  210.342   9.0112  218.754   13.575  203.714   12.049   72.529   2.2990   70.099   2.1110 2.430313 3.121154 
1 1 1    8    1  118 o   24.607   3.1679   26.030   6.2069   34.763   9.9866   20.534   7.9231   27.796   4.5659   21.172   4.7121 6.623980 6.561358 
1 1 1    8    1  119 o   34.922   2.3919   51.146   6.7679   60.176   11.207   45.962   8.4912   37.164   3.7505   32.721   3.2254 4.442757 4.946659 
1 1 1    8    1  120 o   23.788   4.2608   25.547   7.9586   20.277   10.354   33.155   12.442   20.379   5.8975   26.065   5.9827 -5.685797 8.400753 
1 1 1    8    1  121 o   31.901   3.2734   44.065   8.3915   50.153   11.109   35.975   12.806   33.478   4.1603   27.035   5.9706 6.442364 7.277120 
1 1 1    8    1  122 o   37.066   3.4690   60.011   10.359   72.183   16.649   52.321   13.233   38.971   5.3846   33.433   5.0098 5.538422 7.354773 
1 1 1    8    1  123 o   40.270   3.2816   70.461   10.679   55.007   16.423   81.780   14.056   32.935   6.3474   42.695   4.0886 -9.759121 7.550248 
1 1 1    8    1  124 o   13.634   5.3669   6.9309   8.7550  -2.8164   12.407   16.598   12.356   12.275   5.5988   18.153   6.5377 -5.878092 8.607484 
1 1 1    8    1  125 o   30.871   3.8433   42.724   9.4625   40.922   13.453   44.489   13.312   28.472   5.9868   30.044   5.6428 -1.572102 8.226954 
1 1 1    8    1  126 o   19.716   5.7882   19.833   9.9105   8.3004   15.607   27.624   12.829   15.843   6.7831   22.669   6.5658 -6.826391 9.440369 
1 1 1    8    1  127 o   15.965   6.0721   11.847   10.923   10.127   15.833   13.409   15.089   16.282   6.8967   17.062   6.9326 -0.7793140 9.778827 
1 1 1    8    1  128 o   21.131   6.3238   23.887   11.738   25.211   16.687   22.589   16.515   20.749   7.5797   19.894   7.4888 0.8546505 10.65520 
1 1 1    8    1  129 o   21.604   6.2477   24.966   11.624   25.097   13.698   24.630   21.971   21.104   6.9093   20.163   8.2990 0.9401569 10.79873 
1 1 1    8    1  130 o   15.226   6.0836   10.005   11.409   12.889   13.341   2.1546   22.009   16.499   6.5832   15.803   7.2988 0.6963968 9.829103 
1 1 1    8    1  131 o   17.561   6.5245   16.237   12.452   10.808   15.153   27.526   21.852   16.091   6.7777   20.637   8.3584 -4.546381 10.76103 
1 1 1    8    1  132 f   12.329   5.5128   0.5986   11.351   18.710   16.007 -17.7213   16.099   18.342   7.2456   11.240   5.4728 7.101994 9.080207 
1 1 1    8    1  133 o   28.236   5.4643   40.144   12.122   25.536   17.212   54.523   17.076   20.375   7.6504   31.319   6.8773 -10.94400 10.28716 
1 1 1    8    1  134 o   13.752   5.8789   5.4252   11.691  -2.9868   15.865   15.420   17.293   13.256   6.1484   17.500   7.2969 -4.244354 9.541851 
1 1 1    8    2 -133 o   11.604   5.3367  -2.9968   11.589  -5.5534   16.502  -0.5090   16.279   13.032   6.1186   13.810   6.3417 -0.7780943 8.812161 
1 1 1    8    2 -132 o   12.666   5.2819   4.8559   9.0621   7.0043   10.945   0.1729   16.159   13.990   5.8170   13.877   6.3521 0.1135740 8.613207 
1 1 1    8    2 -131 o   35.701   3.1781   56.090   9.1523   67.612   11.965   39.837   14.210   38.570   3.8572   26.973   6.5328 11.59707 7.586575 
1 1 1    8    2 -130 o   27.848   3.9770   35.591   8.7718   35.240   11.345   36.114   13.832   26.487   5.4369   25.636   6.5847 0.8513527 8.539215 
1 1 1    8    2 -129 o   11.325   4.9275   1.4137   8.4999  -0.4382   11.001   4.1567   13.389   11.983   5.3872   14.002   6.1363 -2.019223 8.165505 
1 1 1    8    2 -128 o   10.393   4.6858  -1.5879   8.3916   3.5156   10.688  -9.7916   13.550   12.946   5.5789   11.325   5.3843 1.620899 7.753376 
1 1 1    8    2 -127 o   13.558   5.2650   7.4013   8.3317   7.8597   10.613   6.6653   13.449   14.364   5.8224   14.762   6.3080 -0.3977804 8.584355 
1 1 1    8    2 -126 o   28.323   3.8542   36.262   8.6677   27.559   11.170   49.434   13.742   23.127   5.9052   31.635   5.5303 -8.507677 8.090472 
1 1 1    8    2 -125 o   15.403   5.5164   11.101   8.7830   3.3998   11.772   20.771   13.191   13.426   5.8205   19.617   6.7819 -6.191036 8.937146 
1 1 1    8    2 -124 o   9.8594   4.5529  -4.3588   8.5577  -1.5867   11.908  -7.3199   12.307   12.280   5.5551   11.295   5.2967 0.9856882 7.675591 
1 1 1    8    2 -123 o   40.228   2.7357   69.117   8.9176   72.794   11.496   63.563   14.130   40.711   3.4981   36.887   4.8140 3.824810 5.950774 
1 1 1    8    2 -122 o   29.418   3.5537   38.213   8.3494   43.654   10.868   30.373   13.044   30.831   4.4531   24.093   6.4950 6.737730 7.874954 
1 1 1    8    2 -121 o   23.084   4.5417   24.740   8.2415   30.221   10.834   17.211   12.697   24.924   5.4818   18.552   6.6340 6.372101 8.605818 
1 1 1    8    2 -120 o   42.427   2.6284   76.182   9.0454   86.732   12.094   62.790   13.626   44.785   3.3370   37.126   4.6010 7.659286 5.683737 
1 1 1    8    2 -119 o   29.445   3.5792   37.877   8.4145   37.943   11.092   37.787   12.915   28.662   4.9248   27.945   5.8574 0.7166519 7.652628 
1 1 1    8    2 -118 o   59.331   2.2258  146.759   10.746  141.589   14.783  152.553   15.647   57.626   3.1591   59.767   3.2237 -2.141094 4.513525 
1 1 1    8    2 -117 o   30.294   3.7929   40.083   9.1617   39.175   12.962   40.989   12.951   28.792   5.7246   29.567   5.5779 -0.7754593 7.992770 
1 1 1    8    2 -116 o   9.4090   4.3907  -6.4975   8.2845 -13.5353   11.644   0.7182   11.790   10.220   4.8953   13.290   5.7925 -3.069400 7.584022 
1 1 1    8    2 -115 o   55.879   2.2898  129.764   10.408  131.990   12.936  125.681   17.524   56.068   2.8397   53.930   4.0151 2.138599 4.917794 
1 1 1    8    2 -114 o   9.3478   3.9004   1.0986   4.9461 -18.7149   10.333   6.9880   5.6334   8.7176   4.2743   13.040   4.4344 -4.322634 6.159067 
1 1 1    8    2 -113 o   15.029   4.0894   9.9766   5.1424   18.342   10.402   7.2711   5.9157   19.958   5.9484   13.336   4.5440 6.622228 7.485457 
1 1 1    8    2 -112 o   38.040   2.0710   59.839   6.3975   58.610   11.169   60.439   7.8046   37.049   3.7498   38.098   2.5274 -1.048832 4.522051 
1 1 1    8    2 -111 o   51.975   1.7677  111.110   7.4785  127.146   12.462  102.084   9.3492   55.245   2.7761   49.655   2.3162 5.590092 3.615467 
1 1 1    8    2 -110 o   26.172   2.9199   28.824   6.1232   22.813   10.173   32.240   7.6678   22.405   5.5888   27.518   3.4972 -5.113569 6.592838 
1 1 1    8    2 -109 o   10.973   4.1684   3.7845   5.1439  -4.1074   9.7944   6.7904   6.0447   11.172   5.0475   13.168   4.5888 -1.995459 6.821623 
1 1 1    8    2 -108 o   21.148   3.3912   19.118   5.6485   20.064   9.9005   18.661   6.8778   21.087   5.6472   20.653   4.2279 0.4339485 7.054495 
1 1 1    8    2 -107 o   58.542   1.6913  140.620   8.0624  139.449   12.695  141.412   10.438   58.002   2.6924   58.575   2.1899 -0.5730629 3.470513 
1 1 1    8    2 -106 o   39.337   2.0382   63.734   6.5132   78.025   11.039   56.102   8.0671   43.236   3.1538   36.747   2.7122 6.488194 4.159630 
1 1 1    8    2 -105 o   31.474   2.4261   41.030   6.1762   41.627   11.597   40.793   7.2971   31.036   4.7337   31.277   2.8950 -0.2410641 5.548780 
1 1 1    8    2 -104 o   15.244   4.1380   10.064   5.2728   15.222   9.9265   8.0367   6.2233   18.768   5.8545   14.070   4.6595 4.697878 7.482435 
1 1 1    8    2 -103 o   16.147   4.0770   11.312   5.3662   24.921   10.023   5.8430   6.3535   23.786   5.3045   12.865   4.6805 10.92129 7.074239 
1 1 1    8    2 -102 o   24.267   2.9991   24.656   5.8064   34.866   10.195   19.754   7.0641   28.520   4.5371   21.405   4.1987 7.114655 6.181730 
1 1 1    8    2 -101 o   66.516   1.6107  180.920   8.7333  192.486   13.408  172.397   11.510   68.429   2.4075   64.805   2.1819 3.623856 3.249092 
1 1 1    8    2 -100 o   39.615   2.1799   64.507   7.0123   70.361   11.143   60.668   9.0231   41.151   3.3508   38.285   2.9131 2.865250 4.440036 
1 1 1    8    2  -99 o   79.827   1.5843  260.406   10.309  264.686   14.872  256.448   14.303   80.337   2.2733   79.087   2.2209 1.249809 3.178063 
1 1 1    8    2  -98 o   67.575   1.6660  186.606   9.1768  182.975   13.444  189.773   12.557   66.763   2.4746   68.032   2.2675 -1.269142 3.356392 
1 1 1    8    2  -97 o   62.145   1.7786  157.965   9.0006  154.767   15.114  159.722   11.204   61.306   3.0339   62.431   2.2050 -1.125507 3.750532 
1 1 1    8    2  -96 o   52.456   1.8469  112.586   7.8849  111.880   12.358  113.071   10.240   52.140   2.9194   52.500   2.3991 -0.3593559 3.778714 
1 1 1    8    2  -95 o   56.130   1.9504  128.909   8.9102  147.888   15.450  119.450   10.907   59.941   3.1733   53.962   2.4862 5.979385 4.031281 
1 1 1    8    2  -94 o  121.957   1.5935  607.210   15.841  592.533   25.168  616.838   20.385  120.316   2.5662  122.856   2.0356 -2.540161 3.275532 
1 1 1    8    2  -93 o   79.964   2.0266  261.415   13.199  336.776   35.694  249.477   14.206   90.140   4.8760   78.090   2.2341 12.05002 5.363491 
1 1 1    8    2  -92 o  100.518   1.9108  412.622   15.657  373.871   37.449  420.830   17.235   95.054   4.8493  101.494   2.0833 -6.439865 5.277811 
1 1 1    8    2  -91 o   94.986   1.7684  368.299   13.692  340.884   24.780  380.348   16.428   91.142   3.3411   96.498   2.0885 -5.356300 3.940106 
1 1 1    8    2  -90 o  114.096   1.5775  531.175   14.671  540.240   23.495  525.381   18.784  114.966   2.5071  113.429   2.0315 1.536255 3.226851 
1 1 1    8    2  -89 o   52.439   2.1149  112.468   9.0216  126.446   15.092  104.697   11.253   55.468   3.3537   50.529   2.7424 4.938229 4.332177 
1 1 1    8    2  -88 o   61.156   1.7977  152.761   8.9519  156.580   13.285  149.585   12.116   61.841   2.6414   60.460   2.4635 1.381531 3.611922 
1 1 1    8    2  -87 o  102.411   1.4811  427.808   12.364  440.182   18.092  416.966   16.936  103.837   2.1375  101.068   2.0557 2.769096 2.965583 
1 1 1    8    2  -86 f  228.624   1.8362  2132.83   34.220  2165.95   52.948  2109.07   44.843  230.210   2.8216  227.249   2.4208 2.960297 3.717727 
1 1 1    8    2  -85 o   82.388   1.5676  276.875   10.528  289.442   15.548  266.235   14.307   84.170   2.2681   80.730   2.1760 3.439453 3.143158 
1 1 1    8    2  -84 o  139.495   1.4573  793.599   16.570  789.245   23.733  797.741   23.146  139.064   2.0936  139.816   2.0309 -0.7519379 2.916823 
1 1 1    8    2  -83 o   60.151   1.7962  147.732   8.7974  156.800   13.128  140.341   11.852   61.912   2.6072   58.576   2.4879 3.335270 3.603745 
1 1 1    8    2  -82 o   20.869   4.2722   18.483   7.0225   19.173   10.577   17.939   9.3909   21.276   5.8955   20.546   5.4989 0.7298126 8.061947 
1 1 1    8    2  -81 o   56.173   1.9605  128.885   8.9634  137.019   14.232  123.537   11.540   57.836   3.0293   54.949   2.5835 2.887516 3.981371 
1 1 1    8    2  -80 o  131.450   1.5367  704.635   16.466  706.402   25.528  703.376   21.547  131.564   2.3804  131.306   2.0131 0.2574310 3.117485 
1 1 1    8    2  -79 o  170.411   1.6131  1184.26   22.407  1221.47   34.973  1158.34   29.184  173.002   2.4800  168.501   2.1248 4.500656 3.265734 
1 1 1    8    2  -78 o  246.040   1.9097  2469.08   38.301  2499.61   59.169  2447.06   50.248  247.432   2.9336  244.874   2.5174 2.558548 3.865635 
1 1 1    8    2  -77 o   49.419   2.1480   99.814   8.6324  100.097   13.105   99.597   11.473   49.400   3.2730   49.313   2.8665 0.8756638E-01 4.350777 
1 1 1    8    2  -76 o  301.880   2.0581  3717.08   50.645  3762.68   72.501  3673.64   70.775  303.608   2.9295  300.000   2.8942 3.608032 4.118053 
1 1 1    8    2  -75 o   89.697   1.7150  328.087   12.539  342.973   17.277  311.518   18.228   91.660   2.3142   87.337   2.5631 4.323402 3.453245 
1 1 1    8    2  -74 o  174.856   1.6421  1246.71   23.406  1237.55   31.123  1258.64   35.509  174.181   2.1920  175.639   2.4802 -1.458267 3.310052 
1 1 1    8    2  -73 o  157.175   1.5690  1007.26   20.102  1027.10   27.073  982.892   30.011  158.690   2.0929  155.222   2.3719 3.468079 3.163242 
1 1 1    8    2  -72 o  309.721   2.3942  3913.19   60.447  4169.12   77.253  3509.10   97.070  319.614   2.9652  293.051   4.0636 26.56284 5.030391 
1 1 1    8    2  -71 o   84.550   1.5909  291.470   10.965  302.575   14.632  277.250   16.559   86.134   2.0840   82.403   2.4679 3.730873 3.230150 
1 1 1    8    2  -70 o  184.829   1.6385  1392.88   24.686  1415.20   32.967  1364.39   37.247  186.277   2.1711  182.883   2.4985 3.394562 3.310060 
1 1 1    8    2  -69 o  111.630   1.6590  508.077   15.096  497.853   17.932  532.955   27.973  110.492   1.9909  114.241   3.0065 -3.749443 3.605913 
1 1 1    8    2  -68 f  178.130   1.6087  1293.69   23.358  1295.49   30.906  1291.29   35.672  178.231   2.1273  177.923   2.4596 0.3075714 3.251891 
1 1 1    8    2  -67 o   91.107   1.4356  338.392   10.661  356.274   15.213  321.133   14.945   93.471   1.9966   88.740   2.0661 4.730988 2.873173 
1 1 1    8    2  -66 o  202.140   1.5837  1665.89   26.096  1644.86   36.651  1687.52   37.164  200.829   2.2389  203.416   2.2413 -2.587311 3.167947 
1 1 1    8    2  -65 o  113.746   1.2771  527.432   11.841  554.255   18.475  508.733   15.426  116.588   1.9440  111.703   1.6942 4.884254 2.578660 
1 1 1    8    2  -64 o   78.183   1.3570  249.186   8.6481  259.784   13.559  241.919   11.228   79.789   2.0865   77.028   1.7883 2.760811 2.747998 
1 1 1    8    2  -63 o  283.137   1.9232  3268.75   44.387  3250.04   62.691  3287.54   62.855  282.266   2.7247  283.890   2.7161 -1.624451 3.847232 
1 1 1    8    2  -62 o  159.094   1.5178  1031.87   19.684  1035.22   30.161  1029.39   25.979  159.325   2.3224  158.888   2.0058 0.4376678 3.068660 
1 1 1    8    2  -61 o  158.630   1.4314  1025.82   18.509  1017.98   26.326  1033.47   26.027  158.005   2.0440  159.204   2.0055 -1.199387 2.863599 
1 1 1    8    2  -60 o  128.635   1.4378  674.560   15.076  679.449   20.563  668.877   22.169  129.089   1.9541  128.076   2.1234 1.012802 2.885758 
1 1 1    8    2  -59 o  130.350   1.4424  692.651   15.326  683.373   20.748  703.795   22.738  129.462   1.9660  131.378   2.1232 -1.916016 2.893641 
1 1 1    8    2  -58 f  236.986   1.8193  2289.74   35.145  2333.27   47.476  2236.96   52.276  239.198   2.4349  234.192   2.7384 5.006027 3.664356 
1 1 1    8    2  -57 o  398.825   2.6696  6487.10   86.790  6481.52  115.157  6494.43  132.048  398.556   3.5446  398.882   4.0612 -0.3261719 5.390472 
1 1 1    8    2  -56 o   82.664   1.6662  278.573   11.227  298.342   15.572  257.171   16.202   85.509   2.2360   79.373   2.5073 6.135880 3.359535 
1 1 1    8    2  -55 o  193.362   1.7462  1524.25   27.523  1541.32   39.510  1508.16   38.362  194.418   2.4931  192.316   2.4471 2.101273 3.493404 
1 1 1    8    2  -54 o  386.062   2.5991  6077.69   81.795  6023.85  124.117  6119.02  108.750  384.220   3.9629  387.299   3.4447 -3.078766 5.250759 
1 1 1    8    2  -53 o  324.699   2.2663  4298.55   59.983  4292.63   91.483  4303.02   79.444  324.399   3.4596  324.824   3.0004 -0.4254150 4.579404 
1 1 1    8    2  -52 o  321.224   1.9778  4206.60   51.788  4185.60   69.143  4233.45   78.161  320.390   2.6475  322.197   2.9760 -1.807159 3.983195 
1 1 1    8    2  -51 o  252.837   1.6654  2605.91   34.324  2646.96   46.295  2555.79   51.150  254.805   2.2289  250.369   2.5063 4.436111 3.354022 
1 1 1    8    2  -50 o  148.414   1.4948  897.861   18.084  918.741   27.992  882.905   23.691  150.118   2.2875  147.166   1.9749 2.951538 3.022079 
1 1 1    8    2  -49 o   99.082   1.3115  400.159   10.592  389.625   14.282  413.037   15.791   97.765   1.7921  100.659   1.9245 -2.893097 2.629726 
1 1 1    8    2  -48 o  355.006   2.1345  5137.72   61.770  5115.88   82.498  5165.59   93.188  354.221   2.8571  355.920   3.2120 -1.698883 4.298830 
1 1 1    8    2  -47 o  408.230   2.3976  6793.97   79.786  6914.06  108.386  6651.92  117.879  411.780   3.2290  403.878   3.5805 7.902374 4.821513 
1 1 1    8    2  -46 o  126.592   1.4654  653.216   15.122  681.622   17.618  573.722   29.472  129.314   1.6714  118.583   3.0515 10.73048 3.479238 
1 1 1    8    2  -45 o  318.585   1.9617  4137.32   50.944  4290.54   70.043  3965.25   74.229  324.412   2.6487  311.863   2.9199 12.54886 3.942294 
1 1 1    8    2  -44 o   76.232   1.4930  236.873   9.2775  228.925   13.342  244.315   12.910   74.907   2.1873   77.391   2.0482 -2.483604 2.996604 
1 1 1    8    2  -43 o  271.990   1.8537  3015.51   41.100  2983.51   57.511  3048.92   58.756  270.528   2.6080  273.477   2.6357 -2.948914 3.707879 
1 1 1    8    2  -42 o  358.172   2.1435  5229.36   62.583  5227.83   93.964  5230.58   83.901  358.088   3.2191  358.194   2.8735 -0.1052246 4.315054 
1 1 1    8    2  -41 o  566.880   3.2057 13101.24  148.130 13646.27  230.277 12716.50  193.472  578.442   4.8838  558.434   4.2502 20.00836 6.474218 
1 1 1    8    2  -40 o  338.505   2.0468  4670.71   56.479  4645.06   84.559  4691.37   75.889  337.551   3.0731  339.238   2.7443 -1.686737 4.120140 
1 1 1    8    2  -39 o  247.363   1.6321  2494.04   32.909  2485.94   49.473  2500.47   44.073  246.951   2.4577  247.675   2.1830 -0.7240753 3.287185 
1 1 1    8    2  -38 o  468.868   2.6950  8961.44  103.001  8937.23  154.362  8980.87  138.289  468.186   4.0447  469.345   3.6146 -1.159027 5.424471 
1 1 1    8    2  -37 o  187.019   1.4055  1425.60   21.427  1403.71   28.722  1453.07   32.175  185.575   1.8987  188.807   2.0906 -3.232834 2.824106 
1 1 1    8    2  -36 o  591.426   3.3342 14259.53  160.744 14024.27  238.263 14456.06  217.770  586.446   4.9842  595.434   4.4867 -8.987854 6.706147 
1 1 1    8    2  -35 o   44.283   2.0813   80.107   7.4917   87.163   16.517   78.279   8.4061   46.021   4.4588   43.759   2.3654 2.262131 5.047371 
1 1 1    8    2  -34 o  116.997   1.4526  557.923   13.853  574.636   22.340  547.481   17.659  118.733   2.3082  115.896   1.8692 2.837479 2.970112 
1 1 1    8    2  -33 o  621.712   3.7035 15757.62  187.690 15391.91  260.318 16153.56  270.863  614.382   5.1979  629.394   5.2795 -15.01270 7.408862 
1 1 1    8    2  -32 o  225.446   1.6523  2071.63   30.364  2113.19   43.727  2032.93   42.196  227.691   2.3559  223.325   2.3179 4.365738 3.305033 
1 1 1    8    2  -31 o  243.027   1.8440  2407.36   36.529  2474.23   56.884  2360.43   47.654  246.370   2.8325  240.642   2.4294 5.728088 3.731573 
1 1 1    8    2  -30 o  342.523   2.3500  4782.17   65.614  4726.93   86.623  4856.53  100.502  340.527   3.1206  345.155   3.5721 -4.628082 4.743242 
1 1 1    8    2  -29 f  216.712   1.9003  1914.24   33.569  1944.29   47.855  1885.14   47.100  218.400   2.6881  215.052   2.6868 3.347778 3.800634 
1 1 1    8    2  -28 o  222.220   1.7483  2012.76   31.669  2036.37   49.336  1996.22   41.300  223.512   2.7079  221.301   2.2895 2.210434 3.546010 
1 1 1    8    2  -27 o  417.344   2.7646  7099.78   94.050  7140.24  144.847  7070.29  123.665  418.499   4.2460  416.459   3.6428 2.040314 5.594502 
1 1 1    8    2  -26 o  629.643   4.0043 16162.08  205.521 16446.50  319.015 15960.29  268.716  635.056   6.1626  625.645   5.2690 9.410339 8.108021 
1 1 1    8    2  -25 o  404.211   2.6885  6659.91   88.583  6625.42  135.322  6685.76  117.179  403.135   4.1179  404.979   3.5496 -1.844330 5.436653 
1 1 1    8    2  -24 o  510.583   3.2984 10626.90  137.277 10667.12  210.871 10597.32  180.848  511.495   5.0575  509.843   4.3515 1.652069 6.671925 
1 1 1    8    2  -23 o  487.500   3.1625  9687.59  125.673  9789.09  194.073  9614.30  164.920  490.000   4.8588  485.627   4.1662 4.372925 6.400402 
1 1 1    8    2  -22 o  609.846   3.8808 15161.29  192.919 15056.30  293.382 15241.27  256.067  607.646   5.9231  611.404   5.1379 -3.757751 7.840995 
1 1 1    8    2  -21 f  137.756   1.4171  773.463   15.913  784.363   25.339  766.364   20.449  138.721   2.2408  137.121   1.8295 1.599289 2.892811 
1 1 1    8    2  -20 o  268.871   1.8164  2946.54   39.810  2833.76   55.104  3069.67   57.578  263.669   2.5638  274.425   2.5739 -10.75552 3.632934 
1 1 1    8    2  -19 o  149.125   1.3335  906.391   16.210  897.985   23.107  914.536   22.746  148.430   1.9098  149.792   1.8629 -1.361801 2.667901 
1 1 1    8    2  -18 o  512.585   3.0906 10710.06  129.136 10575.63  180.861 10849.86  184.444  509.326   4.3562  515.886   4.3861 -6.560455 6.181782 
1 1 1    8    2  -17 o  149.559   1.3314  911.680   16.231  888.903   22.992  934.306   22.916  147.677   1.9100  151.402   1.8569 -3.724716 2.663805 
1 1 1    8    2  -16 o  755.818   4.4472 23289.05  273.991 23580.53  391.925 23010.42  383.186  760.435   6.3227  751.190   6.2578 9.244995 8.895923 
1 1 1    8    2  -15 o  445.080   2.9121  8074.75  105.651  8116.19  140.444  8020.71  160.355  446.202   3.8613  443.556   4.4350 2.645935 5.880424 
1 1 1    8    2  -14 o  226.987   1.8790  2100.04   34.766  2185.35   50.742  2024.56   47.731  231.546   2.6884  222.865   2.6273 8.680725 3.759049 
1 1 1    8    2  -13 o  668.821   4.5724 18236.44  249.279 18211.84  352.501 18261.05  352.567  668.281   6.4709  669.184   6.4634 -0.9026489 9.145934 
1 1 1    8    2  -12 o  368.444   2.4771  5533.29   74.398  5494.92   98.054  5585.34  114.213  367.154   3.2763  370.154   3.7853 -3.000122 5.006231 
1 1 1    8    2  -11 o  706.094   4.8103 20326.25  276.868 20399.70  392.815 20253.73  390.298  707.266   6.8135  704.732   6.7942 2.533875 9.622070 
1 1 1    8    2  -10 o  189.536   1.6856  1464.22   26.042  1398.27   44.531  1498.50   32.104  185.212   2.9496  191.741   2.0540 -6.528824 3.594312 
1 1 1    8    2   -9 o  675.516   4.6125 18603.39  253.982 18405.92  355.908 18808.31  362.555  671.833   6.4989  679.135   6.5491 -7.301270 9.226397 
1 1 1    8    2   -8 o  753.754   5.1211 23163.66  314.649 22981.08  442.084 23351.10  447.936  750.656   7.2248  756.673   7.2623 -6.016479 10.24396 
1 1 1    8    2   -7 o  346.854   2.5408  4903.83   71.838  4815.89  100.270  4996.59  102.973  343.717   3.5788  350.105   3.6082 -6.388550 5.081995 
1 1 1    8    2   -6 o  434.582   2.8499  7698.29  100.956  7678.84  133.387  7724.38  154.467  434.017   3.7703  435.289   4.3533 -1.272369 5.759032 
1 1 1    8    2   -5 o  637.868   4.0440 16586.54  210.268 16603.79  278.561 16563.70  320.574  638.150   5.3550  637.342   6.1705 0.8081665 8.170135 
1 1 1    8    2   -4 o  190.399   1.5687  1477.57   24.347  1459.35   32.246  1501.73   37.133  189.219   2.0906  191.945   2.3732 -2.725800 3.162735 
1 1 1    8    2   -3 o  576.420   3.9745 13544.73  186.751 13406.15  262.089 13687.67  266.169  573.408   5.6072  579.396   5.6357 -5.988281 7.949957 
1 1 1    8    2   -2 o  268.164   2.2934  2931.12   50.132  2820.48   78.029  3008.89   65.420  263.041   3.6391  271.692   2.9539 -8.651337 4.687113 
1 1 1    8    2   -1 o  205.377   1.6320  1719.18   27.321  1701.03   36.156  1743.35   41.714  204.287   2.1712  206.810   2.4744 -2.523651 3.291938 
1 1 1    8    2    0 o  332.614   2.2767  4509.37   61.728  4510.05   81.903  4508.48   93.919  332.631   3.0206  332.567   3.4645 0.6387329E-01 4.596403 
1 1 1    8    2    1 o  528.534   3.3984 11387.12  146.413 11297.59  192.623 11509.62  225.319  526.424   4.4889  531.318   5.2024 -4.894043 6.871348 
1 1 1    8    2    2 o  777.418   5.2735 24641.45  334.186 24368.98  468.099 24924.69  477.257  772.977   7.4291  781.736   7.4896 -8.759277 10.54915 
1 1 1    8    2    3 o  649.729   4.4452 17209.85  235.426 17326.39  334.859 17095.94  331.060  651.844   6.3021  647.496   6.2724 4.348145 8.891504 
1 1 1    8    2    4 o  457.416   3.2184  8528.75  120.000  8499.39  169.269  8558.42  170.146  456.599   4.5479  458.182   4.5556 -1.582672 6.437139 
1 1 1    8    2    5 o  442.384   3.4213  7977.51  123.374  8202.55  199.510  7838.17  156.989  448.529   5.4568  438.482   4.3922 10.04706 7.004851 
1 1 1    8    2    6 o  321.020   2.6165  4200.55   68.468  4158.71   87.810  4265.43  109.354  319.408   3.3726  323.469   4.1473 -4.060822 5.345490 
1 1 1    8    2    7 o  181.084   1.8041  1336.54   26.630  1338.11   34.512  1334.23   41.866  181.188   2.3367  180.922   2.8388 0.2658081 3.676836 
1 1 1    8    2    8 o  171.239   1.9646  1195.18   27.423  1259.60   40.069  1138.42   37.612  175.789   2.7963  167.119   2.7610 8.669937 3.929666 
1 1 1    8    2    9 o  284.657   2.6648  3302.85   61.833  3304.00   87.566  3301.72   87.325  284.694   3.7733  284.596   3.7642 0.9814453E-01 5.329818 
1 1 1    8    2   10 o  871.526   7.2133 30977.67  512.451 31164.38  728.539 30794.82  720.950  873.863   10.228  868.671   10.182 5.191833 14.43148 
1 1 1    8    2   11 o  319.492   2.9137  4160.76   75.883  4169.49  107.502  4152.09  107.128  319.810   4.1237  319.142   4.1180 0.6680908 5.827766 
1 1 1    8    2   12 o  254.077   2.2020  2631.26   45.605  2605.99   71.729  2648.40   59.084  252.843   3.4802  254.898   2.8436 -2.055542 4.494223 
1 1 1    8    2   13 o  477.183   3.3441  9281.90  130.076  9116.25  181.257  9457.79  186.777  472.873   4.7023  481.648   4.7573 -8.775085 6.689065 
1 1 1    8    2   14 o  734.354   5.4719 21987.84  327.552 21887.00  515.860 22055.96  423.993  732.461   8.6400  735.397   7.0729 -2.936768 11.16581 
1 1 1    8    2   15 o  630.261   4.7347 16194.67  243.247 16103.55  382.761 16256.40  315.047  628.352   7.4729  631.401   6.1212 -3.049255 9.659850 
1 1 1    8    2   16 o  578.507   4.3746 13643.65  206.291 14142.42  335.911 13341.64  261.390  588.873   6.9979  572.023   5.6058 16.85028 8.966355 
1 1 1    8    2   17 o  753.515   6.2755 23153.24  385.454 23758.49  557.318 22598.24  533.680  763.097   8.9596  744.245   8.7969 18.85223 12.55624 
1 1 1    8    2   18 o  895.367   7.4116 32698.05  540.941 33075.64  772.750 32335.23  757.490  900.191   10.531  890.069   10.440 10.12146 14.82914 
1 1 1    8    2   19 o  248.745   2.4507  2522.03   49.692  2608.92   72.042  2443.18   68.632  252.984   3.4935  244.816   3.4391 8.167023 4.902242 
1 1 1    8    2   20 o  736.508   6.1407 22119.81  368.662 22357.86  526.219 21890.36  516.646  740.270   8.7205  732.495   8.6527 7.774658 12.28479 
1 1 1    8    2   21 f  568.899   4.8184 13195.12  223.446 13414.17  320.442 12987.80  311.737  573.508   6.8545  564.325   6.7768 9.184021 9.638915 
1 1 1    8    2   22 o  621.623   4.6788 15754.05  237.083 16187.77  383.938 15486.74  301.415  629.974   7.4766  616.267   6.0001 13.70709 9.586485 
1 1 1    8    2   23 o  456.117   3.5287  8480.75  131.197  8517.52  208.439  8456.62  168.837  457.044   5.5948  455.441   4.5478 1.603088 7.209999 
1 1 1    8    2   24 o  108.916   1.7088  483.511   15.171  489.914   24.545  479.552   19.299  109.597   2.7496  108.468   2.1828 1.128906 3.510673 
1 1 1    8    2   25 o  555.550   4.2202 12582.45  191.116 12864.38  308.159 12406.23  243.630  561.628   6.7312  551.600   5.4184 10.02771 8.641023 
1 1 1    8    2   26 o  233.139   2.1330  2215.46   40.537  2331.04   66.672  2147.69   51.058  239.130   3.4203  229.540   2.7288 9.589905 4.375506 
1 1 1    8    2   27 o  756.557   5.6397 23339.78  347.804 23318.22  549.697 23354.18  449.138  755.935   8.9208  756.669   7.2818 -0.7338867 11.51541 
1 1 1    8    2   28 o  438.358   3.4206  7833.24  122.228  8189.24  200.512  7622.74  154.187  448.144   5.4889  432.403   4.3744 15.74161 7.018836 
1 1 1    8    2   29 f  345.563   2.8090  4867.60   79.126  4972.18  127.410  4801.94  100.953  349.222   4.4758  343.211   3.6085 6.011200 5.749217 
1 1 1    8    2   30 o  848.831   7.0588 29390.01  488.412 27760.60  656.635 31407.90  730.730  824.660   9.7682  877.098   10.221 -52.43787 14.13776 
1 1 1    8    2   31 o  901.770   8.6245 33184.64  633.967 33711.36  1113.68 32932.14  771.099  907.746   15.051  898.058   10.533 9.687622 18.37058 
1 1 1    8    2   32 o  384.326   3.9473  6021.75  123.663  6144.56  218.596  5963.95  149.968  388.118   6.9094  382.452   4.8104 5.665344 8.419064 
1 1 1    8    2   33 o  241.895   2.8165  2385.17   55.535  2633.68  103.938  2285.88   65.699  254.145   5.0171  236.798   3.4037 17.34613 6.062714 
1 1 1    8    2   34 o  257.457   2.5350  2701.89   53.202  2955.45  113.972  2631.25   60.158  269.216   5.1935  254.065   2.9048 15.15120 5.950669 
1 1 1    8    2   35 o  252.913   2.2326  2607.30   46.027  2660.81   74.078  2573.66   58.741  255.477   3.5571  251.268   2.8679 4.208252 4.569277 
1 1 1    8    2   36 o  499.005   3.8285 10151.86  155.730 10661.68  256.659  9854.80  195.915  511.261   6.1585  491.604   4.8890 19.65701 7.863166 
1 1 1    8    2   37 o  851.788   6.3202 29596.41  438.836 30135.51  705.040 29255.46  560.685  858.950   10.070  846.633   8.1243 12.31635 12.93834 
1 1 1    8    2   38 o  553.218   4.2029 12478.74  189.533 12587.26  302.073 12408.28  243.407  555.450   6.6716  551.581   5.4136 3.868591 8.591724 
1 1 1    8    2   39 o  323.595   2.6579  4268.57   70.108  4347.01  112.634  4218.96   89.576  326.512   4.2319  321.691   3.4160 4.820984 5.438574 
1 1 1    8    2   40 o   72.424   1.9189  213.953   11.318  182.911   18.302  233.177   14.403   66.897   3.3671   75.596   2.3401 -8.699631 4.100447 
1 1 1    8    2   41 o  474.145   3.6556  9166.21  141.286  9241.82  225.181  9117.12  181.447  475.962   5.8039  472.816   4.7078 3.146118 7.473241 
1 1 1    8    2   42 o  286.044   2.4284  3335.40   56.622  3564.66   94.195  3205.69   70.851  295.670   3.9083  280.411   3.0997 15.25848 4.988240 
1 1 1    8    2   43 o  764.302   5.6974 23833.70  354.961 23417.41  552.965 24125.46  462.932  757.014   8.9610  768.692   7.3880 -11.67780 11.61390 
1 1 1    8    2   44 o  363.642   2.9182  5391.16   86.502  5556.13  140.369  5290.15  109.836  369.079   4.6657  360.185   3.7410 8.894012 5.980243 
1 1 1    8    2   45 o  459.102   3.5564  8594.66  133.095  8587.63  210.654  8599.33  171.710  458.752   5.6332  459.155   4.5877 -0.4034729 7.265020 
1 1 1    8    2   46 o  256.230   2.2487  2676.43   46.968  2695.43   75.052  2664.19   60.217  257.099   3.5812  255.627   2.8898 1.471436 4.601726 
1 1 1    8    2   47 o  255.445   2.0622  2659.99   42.940  2693.70   61.890  2628.70   59.626  257.033   2.9539  253.916   2.8808 3.117569 4.126059 
1 1 1    8    2   48 o  173.082   1.6971  1221.15   23.944  1203.72   34.355  1237.60   33.389  171.830   2.4528  174.234   2.3509 -2.403687 3.397488 
1 1 1    8    2   49 o  191.187   1.7711  1490.02   27.602  1453.36   39.465  1525.12   38.619  188.805   2.5643  193.412   2.4495 -4.607635 3.546185 
1 1 1    8    2   50 o  326.598   2.6786  4349.12   71.311  4457.49  115.361  4282.10   90.719  330.541   4.2815  324.031   3.4346 6.510315 5.488890 
1 1 1    8    2   51 o  244.929   2.1857  2445.73   43.639  2389.87   68.517  2483.84   56.604  242.064   3.4724  246.807   2.8135 -4.743179 4.469195 
1 1 1    8    2   52 o  101.431   1.8412  419.410   15.224  424.823   30.077  417.546   17.652  101.987   3.6236  101.201   2.1397 0.7861633 4.208242 
1 1 1    8    2   53 o  158.833   1.7344  1028.43   22.456  1058.91   35.404  1007.91   29.047  161.145   2.6952  157.229   2.2664 3.916504 3.521457 
1 1 1    8    2   54 o  277.696   3.0245  3145.14   68.462  3185.25  118.874  3125.23   83.746  279.273   5.2218  276.768   3.7120 2.505066 6.406756 
1 1 1    8    2   55 o  343.861   3.1332  4822.93   87.823  4466.96  118.028  5264.49  131.454  330.805   4.3770  359.109   4.4907 -28.30438 6.270907 
1 1 1    8    2   56 o  260.364   2.0754  2763.93   44.047  2771.06   54.385  2750.32   75.097  260.675   2.5594  259.631   3.5484 1.044067 4.375107 
1 1 1    8    2   57 o  358.095   2.4283  5229.19   70.882  5295.69   95.305  5146.87  106.035  360.290   3.2451  355.145   3.6628 5.144653 4.893501 
1 1 1    8    2   58 f  323.779   2.2441  4274.75   59.228  4244.41   78.493  4314.88   90.257  322.569   2.9852  325.194   3.4049 -2.625336 4.528197 
1 1 1    8    2   59 o  195.882   1.5158  1564.21   24.203  1624.10   35.549  1512.45   33.046  199.573   2.1852  192.594   2.1049 6.979126 3.034107 
1 1 1    8    2   60 o  197.383   1.5260  1588.29   24.552  1558.96   34.852  1617.18   34.595  195.527   2.1867  199.147   2.1311 -3.619904 3.053341 
1 1 1    8    2   61 o  250.649   1.6557  2561.32   33.829  2540.75   50.802  2577.71   45.345  249.594   2.4969  251.421   2.2126 -1.826431 3.336186 
1 1 1    8    2   62 o  159.400   1.3201  1035.78   17.153  1031.25   26.048  1039.24   22.792  159.031   2.0094  159.655   1.7513 -0.6239471 2.665441 
1 1 1    8    2   63 o  188.029   1.4104  1441.29   21.617  1403.52   32.256  1472.09   29.126  185.521   2.1330  190.010   1.8805 -4.488419 2.843534 
1 1 1    8    2   64 o  197.270   1.5229  1586.53   24.489  1520.16   39.178  1629.09   31.373  193.056   2.4895  199.882   1.9255 -6.826645 3.147277 
1 1 1    8    2   65 o  192.933   1.4268  1517.49   22.439  1562.16   34.543  1484.89   29.515  195.720   2.1651  190.831   1.8974 4.889572 2.878867 
1 1 1    8    2   66 o  128.846   1.2528  676.758   13.158  699.969   20.491  660.473   17.164  131.020   1.9186  127.277   1.6543 3.742577 2.533370 
1 1 1    8    2   67 o  124.106   1.2417  627.885   12.561  640.688   19.580  618.928   16.376  125.348   1.9162  123.209   1.6305 2.139000 2.516063 
1 1 1    8    2   68 f  157.539   1.3135  1011.77   16.868  1004.49   25.707  1017.28   22.352  156.947   2.0094  157.954   1.7360 -1.007370 2.655441 
1 1 1    8    2   69 o   54.121   1.5907  119.525   7.0099  108.717   10.415  128.475   9.4782   51.565   2.4851   56.089   2.0766 -4.524036 3.238513 
1 1 1    8    2   70 o  102.845   1.3346  431.207   11.189  426.675   15.993  435.551   15.659  102.290   1.9180  103.350   1.8587 -1.060120 2.670876 
1 1 1    8    2   71 o   64.737   1.5925  170.872   8.4038  165.863   11.583  176.439   12.212   63.730   2.2331   65.730   2.2826 -2.000198 3.193273 
1 1 1    8    2   72 o  265.217   2.1392  2868.91   46.248  2878.09   56.353  2849.96   80.938  265.597   2.6029  264.146   3.7590 1.450409 4.572224 
1 1 1    8    2   73 o  152.815   1.6880  952.216   21.026  942.550   25.141  974.714   38.357  152.021   2.0288  154.529   3.0450 -2.507843 3.658986 
1 1 1    8    2   74 o  144.504   1.5270  851.405   17.987  872.106   28.310  837.390   23.293  146.209   2.3754  143.290   1.9942 2.919418 3.101490 
1 1 1    8    2   75 o  120.806   1.5164  595.062   14.933  609.335   23.684  585.643   19.239  122.210   2.3775  119.829   1.9697 2.380524 3.087383 
1 1 1    8    2   76 o   40.571   2.3330   67.372   7.6830   64.323   13.523   68.826   9.3363   39.433   4.2752   40.969   2.8128 -1.535187 5.117508 
1 1 1    8    2   77 o  114.824   1.4080  537.568   13.178  505.808   18.763  568.489   18.514  111.357   2.0670  118.061   1.9237 -6.704651 2.823714 
1 1 1    8    2   78 o  320.502   2.2655  4190.99   59.187  4138.43   90.007  4231.03   78.563  318.265   3.4694  321.905   2.9940 -3.640350 4.582646 
1 1 1    8    2   79 o   81.408   1.4291  270.229   9.4831  274.442   14.027  266.682   12.870   81.992   2.1005   80.856   1.9527 1.135826 2.867882 
1 1 1    8    2   80 o  122.667   1.3654  613.552   13.653  624.831   19.768  603.263   18.880  123.761   1.9595  121.609   1.9045 2.151756 2.732536 
1 1 1    8    2   81 o   40.074   1.9790   65.677   6.4447   54.811   10.163   72.985   8.3348   36.455   3.4616   42.216   2.4323 -5.761238 4.230725 
1 1 1    8    2   82 o   39.653   2.0574   64.327   6.6272   57.054   10.196   69.649   8.7210   37.204   3.3994   41.220   2.6089 -4.015160 4.285117 
1 1 1    8    2   83 o  129.158   1.4552  680.305   15.320  678.074   20.851  682.923   22.586  128.913   1.9842  129.361   2.1419 -0.4483185 2.919727 
1 1 1    8    2   84 o   50.813   1.7657  105.460   7.3023  116.985   11.052   96.530   9.7284   53.463   2.5433   48.560   2.4658 4.903057 3.542379 
1 1 1    8    2   85 o   95.549   1.4413  372.347   11.226  358.634   15.433  387.752   16.358   93.742   2.0197   97.471   2.0588 -3.728668 2.884052 
1 1 1    8    2   86 f   18.114   3.7396   13.930   5.3386   8.4756   9.0271   16.864   6.6205   15.587   5.5912   19.909   4.2111 -4.322812 6.999688 
1 1 1    8    2   87 o   79.765   1.4745  259.523   9.5872  261.087   13.657  258.002   13.462   79.945   2.0975   79.473   2.0798 0.4724655 2.953842 
1 1 1    8    2   88 o  163.960   1.5404  1096.70   20.588  1103.03   27.815  1089.04   30.618  164.370   2.0759  163.293   2.3002 1.077164 3.098499 
1 1 1    8    2   89 o   65.946   2.0167  177.720   10.828  184.692   13.686  166.050   17.706   67.181   2.5035   63.580   3.4291 3.601261 4.245689 
1 1 1    8    2   90 o   60.213   1.9797  148.195   9.7038  146.921   13.193  149.698   14.323   59.879   2.7099   60.418   2.9169 -0.5389900 3.981476 
1 1 1    8    2   91 o  113.027   1.7947  521.513   16.535  500.369   24.264  539.847   22.594  110.603   2.6913  114.923   2.4118 -4.320694 3.613857 
1 1 1    8    2   92 o   69.833   1.9266  199.312   10.956  196.089   14.865  203.145   16.211   69.182   2.6409   70.391   2.8311 -1.208549 3.871578 
1 1 1    8    2   93 o  129.621   1.6934  685.959   17.893  669.362   21.608  722.163   31.914  127.990   2.0711  132.768   2.9489 -4.778824 3.603534 
1 1 1    8    2   94 o   46.461   2.4343   88.560   9.1871   84.175   11.275   97.221   15.846   45.203   3.0784   48.418   4.0521 -3.214890 5.088834 
1 1 1    8    2   95 o   61.145   2.0129  152.981   10.019  146.926   12.344  164.674   17.153   59.852   2.5358   63.228   3.3400 -3.376621 4.193566 
1 1 1    8    2   96 o  129.512   1.6417  685.075   17.332  676.456   21.121  702.842   30.326  128.627   2.0144  130.908   2.8419 -2.280594 3.483444 
1 1 1    8    2   97 o   76.509   1.6656  239.151   10.387  226.213   13.356  258.957   16.525   74.312   2.2073   79.446   2.5551 -5.134209 3.376481 
1 1 1    8    2   98 o   11.200   4.6108   1.7303   6.7838  -3.3883   8.7312   9.5265   10.776   10.838   4.8414   16.579   6.0853 -5.740751 7.776278 
1 1 1    8    2   99 o   13.751   4.8461   6.9963   6.7539   9.3451   8.7157   3.4659   10.685   15.721   5.5080   14.202   5.8100 1.519353 8.005882 
1 1 1    8    2  100 o   20.059   4.4046   17.393   7.0042   24.208   9.2437   8.2066   10.733   23.620   4.9592   15.961   6.0308 7.659009 7.807970 
1 1 1    8    2  101 o  110.837   1.5172  502.165   13.707  501.816   17.909  502.658   21.299  110.684   1.9850  110.662   2.3611 0.2149963E-01 3.084619 
1 1 1    8    2  102 o   75.987   1.6349  236.215   10.127  230.097   13.118  245.241   15.933   74.864   2.1518   77.183   2.5358 -2.318794 3.325748 
1 1 1    8    2  103 o   96.893   1.5343  384.023   12.118  377.829   15.707  393.133   19.048   95.986   2.0075   97.785   2.3896 -1.799461 3.120927 
1 1 1    8    2  104 o   32.359   2.7183   43.492   7.1040   42.289   9.1369   45.331   11.296   31.681   3.6019   32.577   4.3634 -0.8958874 5.658001 
1 1 1    8    2  105 o   88.678   1.5807  321.932   11.426  327.309   14.919  314.302   17.772   89.281   2.0499   87.297   2.5001 1.984001 3.233033 
1 1 1    8    2  106 o   38.552   2.7219   61.728   8.4989   60.275   9.9405   65.675   16.387   37.946   3.2448   38.804   5.3205 -0.8586464 6.231886 
1 1 1    8    2  107 o   11.284   4.8239   0.3867   7.8711  -1.9066   9.3931   5.7937   14.423   11.550   5.0978   16.348   6.7259 -4.797655 8.439509 
1 1 1    8    2  108 o   22.751   4.1653   22.508   7.4403   33.461   10.281   10.460   10.782   27.649   4.7314   16.601   6.0881 11.04805 7.710445 
1 1 1    8    2  109 o   69.245   2.0297  197.465   11.444  209.355   17.571  188.706   15.082   70.845   3.0498   67.399   2.7509 3.445976 4.107132 
1 1 1    8    2  110 o   15.473   5.3546   9.7617   8.2238  -4.2800   12.438   20.669   10.962   12.673   5.7102   21.261   6.0417 -8.588284 8.313103 
1 1 1    8    2  111 o   57.562   2.2541  137.003   10.556  145.800   16.250  130.580   13.885   58.855   3.4016   55.858   3.0612 2.996567 4.576280 
1 1 1    8    2  112 o   29.401   4.0574   37.402   9.4651   40.350   11.644   31.658   16.252   30.179   4.9011   25.585   7.3841 4.594213 8.862595 
1 1 1    8    2  113 o   53.421   2.1680  118.091   9.4209  121.262   11.524  111.701   16.358   53.945   2.6286   51.064   3.9608 2.880573 4.753687 
1 1 1    8    2  114 o   47.193   2.2199   92.386   8.5158   87.788   11.195   98.701   13.119   45.661   3.0248   48.252   3.3562 -2.590794 4.518167 
1 1 1    8    2  115 o   8.9340   4.1377  -5.1088   7.1454  -7.2087   9.5236  -2.4043   10.808   10.121   4.7177   12.027   5.3785 -1.906037 7.154337 
1 1 1    8    2  116 o   65.288   2.0139  176.517   10.705  181.744   14.929  170.985   15.359   65.774   2.7907   63.670   2.9675 2.103706 4.073638 
1 1 1    8    2  117 o   14.579   5.0760   9.0578   7.3956   7.8596   9.8950   10.574   11.132   14.758   5.7358   16.186   6.1359 -1.428000 8.399364 
1 1 1    8    2  118 o   20.296   4.6446   18.974   7.5176   13.958   9.7697   26.256   11.771   17.345   5.8401   23.121   6.1420 -5.776024 8.475248 
1 1 1    8    2  119 o   34.306   2.9503   50.225   8.1702   49.484   10.543   51.339   12.926   33.479   3.9387   33.452   4.8843 0.2660370E-01 6.274565 
1 1 1    8    2  120 o   42.021   2.5966   74.669   8.8507   64.099   11.247   91.864   14.345   38.252   3.6511   45.633   3.8936 -7.380569 5.337630 
1 1 1    8    2  121 o   18.321   5.1651   16.192   8.0442   23.592   10.575   6.0298   12.393   21.717   5.8454   14.604   6.1392 7.112317 8.476918 
1 1 1    8    2  122 o   33.351   4.0322   50.011   10.740   70.475   17.913   38.527   13.419   37.675   6.0366   27.593   6.1258 10.08254 8.600384 
1 1 1    8    2  123 o   30.044   4.4441   41.584   10.556   41.300   17.100   41.759   13.417   27.092   7.4916   28.905   5.8945 -1.812328 9.532567 
1 1 1    8    2  124 o   18.930   5.5825   17.943   9.2010   37.217   13.211  -0.2106   12.822   26.938   6.1520   12.982   5.8278 13.95626 8.474074 
1 1 1    8    2  125 o   13.243   5.5424   4.9194   10.032  -3.4263   12.861   17.892   16.034   12.254   5.6308   18.550   7.2748 -6.295104 9.199351 
1 1 1    8    2  126 o   17.254   6.2014   15.001   11.111   10.139   12.986   28.285   21.466   15.709   6.4132   21.296   8.3974 -5.587281 10.56627 
1 1 1    8    2  127 o   16.302   6.2716   12.606   11.741   16.040   13.562   2.3325   23.460   17.688   6.7567   16.250   7.5160 1.438110 10.10657 
1 1 1    8    2  128 o   28.660   5.3371   40.542   12.010   33.013   13.878   62.989   23.964   24.418   6.7481   30.746   8.9937 -6.328243 11.24382 
1 1 1    8    2  129 o   12.671   5.4725   3.1564   10.328   3.5749   13.348   2.5321   16.302   13.846   6.0955   14.491   6.5326 -0.6445436 8.934770 
1 1 1    8    2  130 o   10.785   4.9723  -3.6956   10.150  -9.8959   13.277   5.0264   15.747   11.131   5.3027   14.806   6.5644 -3.675025 8.438622 
1 1 1    8    2  131 o   27.648   4.9899   37.341   10.832   29.857   13.802   49.341   17.478   22.818   6.8639   29.054   7.3697 -6.235567 10.07102 
1 1 1    8    2  132 o   15.353   6.0524   10.827   11.148   11.957   15.627   9.6555   15.909   16.364   6.8873   15.828   6.8138 0.5360088 9.688238 
1 1 1    8    2  133 o   13.784   5.8371   5.9317   11.337   10.949   15.700   0.4648   16.388   16.144   6.8542   14.021   6.4101 2.123714 9.384509 
1 1 1    8    3 -132 o   19.069   6.3311   19.881   11.487   19.246   13.141   21.938   23.656   18.598   6.7363   19.201   8.2875 -0.6026020 10.67988 
1 1 1    8    3 -131 o   11.250   5.0856  -1.1636   9.9611   8.5475   12.327 -19.4371   16.910   14.799   6.1649   11.332   5.5376 3.467075 8.286853 
1 1 1    8    3 -130 o   12.888   5.3364   5.4119   9.1575   4.4290   10.887   7.7894   16.932   13.161   5.6507   15.572   6.8599 -2.411150 8.887530 
1 1 1    8    3 -129 o   18.105   5.6547   16.991   9.2575   24.469   11.051  -0.6025   16.951   21.381   6.0630   14.007   6.4462 7.374392 8.849483 
1 1 1    8    3 -128 o   11.775   5.1069   2.0115   9.0708   6.7155   10.869  -8.7857   16.466   13.949   5.7979   12.591   5.9715 1.358120 8.323144 
1 1 1    8    3 -127 o   50.273   2.6573  108.246   10.851   92.398   12.826  148.152   20.353   45.665   3.4717   56.460   4.4584 -10.79539 5.650628 
1 1 1    8    3 -126 o   12.595   5.4371   2.9391   10.185  -4.2443   12.898   14.835   16.599   12.027   5.5663   17.518   7.2121 -5.491174 9.110331 
1 1 1    8    3 -125 f   8.6626   4.2326 -14.9637   9.8713  -5.3178   12.687 -29.7638   15.715   11.760   5.4694   9.9599   4.9531 1.799822 7.378873 
1 1 1    8    3 -124 o   33.148   4.0149   49.847   10.628   62.639   13.817   31.318   16.630   36.489   4.7587   23.040   7.6163 13.44932 8.980698 
1 1 1    8    3 -123 o   11.618   5.1726  -0.3300   9.8793  -2.8690   12.769   3.4573   15.594   12.355   5.6522   14.733   6.5322 -2.377130 8.638146 
1 1 1    8    3 -122 o   18.231   5.4319   16.434   8.6755   12.149   10.342   26.611   15.939   16.141   5.9552   21.687   7.4567 -5.546087 9.542914 
1 1 1    8    3 -121 o   29.136   4.0144   38.308   9.2810   32.088   11.037   53.323   17.148   25.615   5.4534   31.833   6.8142 -6.218025 8.727743 
1 1 1    8    3 -120 o   19.848   5.7970   19.712   9.9630   27.703   12.665   6.7358   16.138   23.053   6.4744   15.840   6.8409 7.213777 9.418896 
1 1 1    8    3 -119 o   45.150   3.0354   87.397   11.106   81.961   14.067   96.393   18.097   42.888   4.0726   45.653   4.9416 -2.764633 6.403519 
1 1 1    8    3 -118 o   12.290   5.2762   1.8592   9.4898   2.3473   12.037   1.0577   15.426   13.589   5.8884   14.584   6.4799 -0.9949293 8.755701 
1 1 1    8    3 -117 o   52.328   2.4661  114.874   10.490  118.901   12.770  106.518   18.394   52.901   2.9733   48.614   4.7004 4.287182 5.561801 
1 1 1    8    3 -116 o   32.498   3.5254   45.723   9.1898   47.109   11.333   43.061   15.704   32.490   4.3914   29.431   6.6970 3.058762 8.008430 
1 1 1    8    3 -115 o   58.015   2.4409  140.580   11.517  143.999   14.639  135.027   18.659   58.296   3.0917   55.610   4.1460 2.685726 5.171849 
1 1 1    8    3 -114 o   61.295   2.3317  156.307   11.629  159.195   14.783  151.617   18.835   61.482   2.9584   59.283   3.9196 2.199177 4.910728 
1 1 1    8    3 -113 o   46.401   2.1135   89.219   7.9732   94.220   13.282   86.401   9.9694   47.034   3.4891   45.424   2.7047 1.609928 4.414659 
1 1 1    8    3 -112 o   10.959   4.4446   2.6242   6.1886   15.454   10.035  -5.2512   7.8617   18.478   5.9025   9.4724   4.3705 9.005504 7.344404 
1 1 1    8    3 -111 o   43.478   2.1373   78.221   7.5515   66.198   11.464   87.435   10.036   39.436   3.6062   45.772   2.7020 -6.335670 4.506178 
1 1 1    8    3 -110 o   42.184   2.1014   73.550   7.2030   66.123   11.235   78.734   9.3858   39.492   3.5272   43.469   2.6616 -3.977371 4.418705 
1 1 1    8    3 -109 o   49.393   1.9995  100.587   8.0338  110.128   11.793   92.326   10.974   51.397   2.8257   47.028   2.8765 4.369221 4.032231 
1 1 1    8    3 -108 o   47.362   1.9683   92.429   7.5825   83.300   11.391   99.691   10.160   44.576   3.1554   49.012   2.5519 -4.436470 4.058218 
1 1 1    8    3 -107 o   34.012   2.6086   48.145   7.1771   54.010   10.408   42.827   9.9105   35.705   3.6262   31.650   3.9255 4.055761 5.344033 
1 1 1    8    3 -106 o   38.183   2.3952   60.377   7.4174   59.534   10.731   61.148   10.264   37.564   3.5466   38.148   3.3342 -0.5839500 4.867748 
1 1 1    8    3 -105 o   58.120   1.8549  138.760   8.7767  140.426   12.328  137.048   12.498   58.248   2.6031   57.518   2.6729 0.7300072 3.730963 
1 1 1    8    3 -104 o   36.258   2.8838   54.734   8.4533   67.624   11.924   41.710   11.986   40.073   3.6917   30.977   4.9103 9.096001 6.143249 
1 1 1    8    3 -103 o   72.551   1.7079  215.614   10.101  223.708   13.912  206.591   14.689   73.708   2.3183   70.753   2.5510 2.955215 3.447035 
1 1 1    8    3 -102 o   36.025   2.6056   53.743   7.5998   48.452   10.690   59.150   10.806   33.845   3.9490   37.552   3.5732 -3.707436 5.325672 
1 1 1    8    3 -101 o   43.509   2.1373   77.860   7.5571   85.068   11.375   72.165   10.111   45.263   3.1018   41.700   2.9945 3.563293 4.311409 
1 1 1    8    3 -100 o   77.382   1.5797  244.872   9.9642  243.024   14.448  246.548   13.760   76.909   2.3072   77.499   2.1803 -0.5890732 3.174446 
1 1 1    8    3  -99 o   13.436   4.9145   6.2437   7.0182   4.8713   11.531   7.0514   8.8454   15.063   6.0821   14.656   5.4883 0.4068003 8.192260 
1 1 1    8    3  -98 f   54.869   1.8744  123.329   8.3709  127.040   12.274  120.103   11.446   55.534   2.7196   54.016   2.6072 1.517921 3.767458 
1 1 1    8    3  -97 o   44.252   2.2462   80.426   8.0758   91.781   11.490   69.338   11.354   47.145   3.0053   40.862   3.4406 6.283417 4.568333 
1 1 1    8    3  -96 o   90.517   1.5849  334.714   11.694  334.521   16.134  334.927   16.974   90.396   2.1895   90.400   2.3053 -0.4280090E-02 3.179354 
1 1 1    8    3  -95 o   16.780   4.8798   11.947   7.0733   19.150   10.073   4.9412   9.9345   21.041   5.7229   14.394   5.7012 6.646288 8.078044 
1 1 1    8    3  -94 o  134.812   1.5934  742.160   17.510  729.663   27.220  750.982   22.871  133.484   2.5016  135.521   2.0703 -2.036911 3.247210 
1 1 1    8    3  -93 o   81.410   1.7535  270.699   11.636  266.240   18.513  273.611   14.961   80.551   2.8238   81.760   2.2469 -1.208870 3.608707 
1 1 1    8    3  -92 o   61.208   2.0681  153.286   10.303  149.560   16.808  155.528   13.041   60.254   3.4364   61.586   2.6036 -1.331726 4.311313 
1 1 1    8    3  -91 o   94.620   1.7422  365.547   13.437  411.544   22.251  339.142   16.859  100.232   2.7258   91.083   2.2707 9.149826 3.547704 
1 1 1    8    3  -90 o   60.972   2.0758  152.042   10.302  133.633   16.612  163.546   13.132   56.954   3.5966   63.185   2.5550 -6.231262 4.411730 
1 1 1    8    3  -89 o   35.388   2.8284   51.562   8.0911   48.693   11.911   54.020   11.026   34.134   4.3815   36.084   3.8058 -1.949493 5.803629 
1 1 1    8    3  -88 o  184.240   1.6847  1385.26   25.302  1404.73   39.049  1371.17   33.218  185.370   2.5842  183.214   2.2242 2.156143 3.409606 
1 1 1    8    3  -87 o  106.004   1.5868  458.462   13.711  452.618   21.189  462.673   17.984  105.247   2.4698  106.450   2.0725 -1.202736 3.224171 
1 1 1    8    3  -86 o   64.809   1.8668  171.566   9.8518  164.813   15.392  176.252   12.822   63.411   2.9862   65.643   2.4004 -2.232197 3.831323 
1 1 1    8    3  -85 o   57.621   2.0071  135.686   9.4128  149.942   15.058  126.544   12.059   60.474   3.0647   55.585   2.6693 4.888554 4.064186 
1 1 1    8    3  -84 o   53.847   2.1067  118.536   9.2289  142.041   14.855  103.761   11.778   58.855   3.1074   50.302   2.8844 8.553074 4.239763 
1 1 1    8    3  -83 o  107.436   1.5793  470.827   13.831  461.637   21.327  477.496   18.169  106.321   2.4607  108.164   2.0607 -1.842606 3.209664 
1 1 1    8    3  -82 o  124.930   1.4738  636.537   15.009  607.060   21.057  666.977   21.399  121.960   2.1181  127.843   2.0534 -5.882408 2.950077 
1 1 1    8    3  -81 o   79.257   1.5985  256.210   10.327  266.621   14.800  246.329   14.418   80.792   2.2494   77.652   2.2802 3.140175 3.202991 
1 1 1    8    3  -80 o  217.184   1.6777  1923.92   29.702  1943.49   42.251  1904.79   41.763  218.205   2.3754  216.022   2.3717 2.182510 3.356697 
1 1 1    8    3  -79 o  128.039   1.4613  668.536   15.252  655.516   21.357  682.088   21.788  126.752   2.0671  129.296   2.0673 -2.543442 2.923432 
1 1 1    8    3  -78 o   15.188   5.1152   8.8248   7.4950   6.1855   10.753   11.318   10.452   15.435   5.9848   17.461   6.0370 -2.026340 8.500742 
1 1 1    8    3  -77 o  175.092   1.6439  1250.24   23.462  1257.58   35.723  1244.68   31.113  175.537   2.4966  174.662   2.1853 0.8751068 3.317909 
1 1 1    8    3  -76 o   65.511   1.9422  175.206   10.360  177.931   15.544  173.028   13.897   65.953   2.8984   65.058   2.6258 0.8952942 3.910950 
1 1 1    8    3  -75 o  203.605   1.7674  1690.59   29.334  1698.90   44.585  1684.25   38.952  204.026   2.6808  203.176   2.3519 0.8493042 3.566253 
1 1 1    8    3  -74 o   64.721   2.0249  171.020   10.670  168.937   15.122  173.085   15.056   64.268   2.8940   65.058   2.8460 -0.7895126 4.058923 
1 1 1    8    3  -73 o   91.835   1.6962  343.910   12.698  345.958   17.889  341.831   18.027   92.054   2.3860   91.500   2.4190 0.5533066 3.397768 
1 1 1    8    3  -72 o   68.376   1.6306  190.636   9.0882  191.102   14.041  190.301   11.923   68.391   2.5229   68.270   2.1451 0.1204453 3.311552 
1 1 1    8    3  -71 o  194.213   1.4914  1537.88   23.610  1570.26   35.957  1513.34   31.304  196.202   2.2482  192.630   1.9936 3.571732 3.004829 
1 1 1    8    3  -70 o   90.838   1.3923  336.410   10.309  338.190   15.581  335.024   13.749   91.060   2.0991   90.639   1.8609 0.4205551 2.805152 
1 1 1    8    3  -69 o   53.910   1.9300  118.669   8.4677  109.060   11.506  130.022   12.506   51.627   2.7440   56.384   2.7292 -4.757385 3.870142 
1 1 1    8    3  -68 o  178.629   1.6407  1301.00   23.890  1300.66   31.324  1301.47   36.938  178.580   2.1518  178.612   2.5371 -0.3215027E-01 3.326707 
1 1 1    8    3  -67 o  340.215   2.3655  4721.21   65.601  4715.65   86.784  4728.63  100.204  339.914   3.1321  340.304   3.6123 -0.3900757 4.781063 
1 1 1    8    3  -66 o   79.445   1.4926  257.317   9.6662  258.547   13.719  256.104   13.621   79.594   2.1164   79.217   2.1113 0.3768845 2.989444 
1 1 1    8    3  -65 o   96.984   1.4079  383.458   11.130  383.724   15.740  383.193   15.740   97.005   1.9906   96.938   1.9919 0.6715393E-01 2.816078 
1 1 1    8    3  -64 o  116.057   1.4712  549.123   13.918  548.581   21.131  549.537   18.497  115.979   2.2352  116.089   1.9547 -0.1097488 2.969301 
1 1 1    8    3  -63 o  229.871   1.8133  2154.52   33.978  2172.95   45.128  2130.40   51.629  230.816   2.3985  228.518   2.7716 2.298615 3.665384 
1 1 1    8    3  -62 o   98.228   1.4894  393.363   11.926  391.711   15.841  395.524   18.119   98.011   1.9827   98.480   2.2571 -0.4689789 3.004259 
1 1 1    8    3  -61 o  116.922   1.4761  557.322   14.069  554.146   18.644  561.523   21.440  116.577   1.9620  117.342   2.2414 -0.7653198 2.978843 
1 1 1    8    3  -60 o  169.256   1.5779  1167.92   21.771  1174.09   28.856  1159.78   33.169  169.684   2.0862  168.633   2.4130 1.051056 3.189803 
1 1 1    8    3  -59 o  178.727   1.6143  1302.30   23.519  1332.61   31.302  1263.01   35.642  180.776   2.1242  175.976   2.4847 4.800049 3.268890 
1 1 1    8    3  -58 o  137.300   1.4938  768.507   16.718  795.462   22.394  734.568   25.128  139.675   1.9669  134.212   2.2968 5.462616 3.023916 
1 1 1    8    3  -57 o  144.743   1.4158  854.062   16.704  857.464   23.627  850.661   23.620  145.016   1.9988  144.439   2.0061 0.5767059 2.831883 
1 1 1    8    3  -56 o  426.959   2.8321  7435.69   98.565  7398.95  130.164  7485.07  150.911  425.776   3.7504  428.150   4.3240 -2.373322 5.723856 
1 1 1    8    3  -55 o   63.142   1.6744  162.652   8.6104  166.495   11.871  158.385   12.508   63.858   2.2842   62.271   2.4691 1.586330 3.363588 
1 1 1    8    3  -54 o  198.855   1.6594  1612.08   26.898  1610.82   35.909  1613.69   40.600  198.758   2.2164  198.923   2.5038 -0.1647644 3.343848 
1 1 1    8    3  -53 o  220.431   1.7488  1980.91   31.424  1976.49   41.874  1986.60   47.544  220.163   2.3333  220.711   2.6426 -0.5479126 3.525281 
1 1 1    8    3  -52 f  172.812   1.4351  1217.38   20.216  1192.41   25.306  1261.42   33.610  171.022   1.8152  175.886   2.3443 -4.863586 2.964904 
1 1 1    8    3  -51 o  123.335   1.2619  620.055   12.687  608.703   16.498  636.483   19.846  122.196   1.6563  124.948   1.9486 -2.752357 2.557372 
1 1 1    8    3  -50 o  368.061   2.4857  5523.73   74.576  5466.90   97.834  5602.55  115.219  366.104   3.2783  370.569   3.8143 -4.465149 5.029558 
1 1 1    8    3  -49 o  100.555   1.5837  412.176   12.981  407.175   16.379  420.621   21.287   99.938   2.0106  101.534   2.5740 -1.595642 3.266241 
1 1 1    8    3  -48 o  343.029   2.5339  4797.72   70.853  4788.68   86.685  4815.91  122.985  342.673   3.1033  343.547   4.3917 -0.8738708 5.377488 
1 1 1    8    3  -47 o  318.423   2.2154  4133.65   57.502  4108.22   75.729  4168.27   88.368  317.410   2.9269  319.695   3.3909 -2.285370 4.479414 
1 1 1    8    3  -46 o  295.774   1.8449  3566.17   44.479  3537.83   59.652  3601.64   66.752  294.575   2.4842  297.209   2.7553 -2.633606 3.709859 
1 1 1    8    3  -45 o  328.171   1.9965  4390.25   53.407  4356.61   71.573  4432.50   80.222  326.885   2.6861  329.707   2.9849 -2.821655 4.015544 
1 1 1    8    3  -44 o  129.736   1.2334  686.048   13.043  684.572   17.834  687.747   19.126  129.592   1.6882  129.891   1.8064 -0.2989960 2.472463 
1 1 1    8    3  -43 o  411.640   2.5503  6908.13   85.576  6930.10  121.691  6886.64  120.365  412.237   3.6214  410.944   3.5932 1.292755 5.101523 
1 1 1    8    3  -42 o   65.112   1.4963  172.807   7.9418  226.876   13.271  142.638   9.9129   74.570   2.1856   59.117   2.0602 15.45270 3.003533 
1 1 1    8    3  -41 o  517.169   2.9434 10904.56  124.084 11047.00  168.590 10736.20  183.292  520.468   3.9738  513.062   4.3826 7.405701 5.915944 
1 1 1    8    3  -40 o   61.481   1.3966  154.072   6.9992  138.018   9.7500  171.141   10.054   58.152   2.0601   64.768   1.9064 -6.616302 2.806839 
1 1 1    8    3  -39 o  100.661   1.3218  413.005   10.846  404.436   16.216  419.941   14.589   99.608   1.9972  101.501   1.7633 -1.892830 2.664240 
1 1 1    8    3  -38 o  156.725   1.4735  1001.17   18.825  1016.88   29.814  990.760   24.276  157.942   2.3157  155.904   1.9102 2.037888 3.001935 
1 1 1    8    3  -37 o  507.955   3.0738 10518.94  127.271 10461.15  179.760 10577.03  180.219  506.490   4.3540  509.289   4.3411 -2.798553 6.148358 
1 1 1    8    3  -36 o  350.057   2.1022  4994.97   59.986  5014.74   81.049  4971.02   89.202  350.732   2.8349  349.192   3.1338 1.540283 4.225798 
1 1 1    8    3  -35 o  646.414   3.6187 17036.00  190.680 17091.00  256.840 16968.45  284.618  647.373   4.8671  645.003   5.4133 2.369507 7.279639 
1 1 1    8    3  -34 o  143.890   1.3516  843.893   15.853  831.375   22.753  855.700   22.099  142.816   1.9545  144.891   1.8711 -2.074768 2.705740 
1 1 1    8    3  -33 o  361.779   2.4469  5335.18   72.160  5386.96  111.678  5298.08   94.547  363.497   3.7690  360.501   3.2174 2.995911 4.955537 
1 1 1    8    3  -32 o  253.570   1.8762  2620.81   38.781  2560.11   58.922  2667.20   51.512  250.604   2.8844  255.798   2.4705 -5.193573 3.797747 
1 1 1    8    3  -31 o  295.667   2.0926  3563.27   50.435  3542.83   77.324  3578.41   66.536  294.799   3.2178  296.284   2.7550 -1.484955 4.236004 
1 1 1    8    3  -30 o  300.838   2.1263  3689.01   52.142  3534.59   77.899  3814.36   70.183  294.457   3.2454  305.896   2.8146 -11.43903 4.295928 
1 1 1    8    3  -29 o  583.562   4.0253 13883.89  191.481 13627.67  326.534 14018.18  236.391  577.981   6.9307  586.332   4.9460 -8.351501 8.514551 
1 1 1    8    3  -28 o  148.931   1.7265  904.065   20.960  916.414   33.991  896.489   26.625  149.938   2.7811  148.303   2.2024 1.635117 3.547574 
1 1 1    8    3  -27 o  416.571   3.2569  7073.99  110.593  7042.76  174.721  7094.86  142.853  415.592   5.1575  417.159   4.2010 -1.567169 6.651944 
1 1 1    8    3  -26 o  456.012   3.5240  8477.16  130.994  8463.47  207.362  8486.24  168.981  455.570   5.5839  456.224   4.5438 -0.6533508 7.199064 
1 1 1    8    3  -25 o  141.487   1.9244  815.957   22.195  844.219   32.987  792.579   30.002  143.912   2.8119  139.442   2.6395 4.469818 3.856672 
1 1 1    8    3  -24 o  587.777   4.0639 14084.73  194.714 13794.83  271.332 14392.54  279.588  581.620   5.7230  594.084   5.7734 -12.46387 8.129296 
1 1 1    8    3  -23 o  484.289   3.1563  9560.58  124.601  9862.23  195.755  9355.13  161.554  491.815   4.8829  479.030   4.1373 12.78534 6.399992 
1 1 1    8    3  -22 o  195.195   1.6595  1552.97   26.405  1528.93   40.899  1570.15   34.577  193.672   2.5907  196.269   2.1612 -2.596909 3.373798 
1 1 1    8    3  -21 o  335.507   2.3206  4588.24   63.465  4620.52   98.167  4565.05   83.187  336.667   3.5771  334.648   3.0495 2.018158 4.700540 
1 1 1    8    3  -20 o  282.245   2.2180  3247.06   51.030  3217.90   72.175  3276.20   72.160  280.964   3.1514  283.498   3.1226 -2.534210 4.436387 
1 1 1    8    3  -19 o  691.249   4.3773 19480.46  246.648 19781.88  330.764 19102.92  370.181  696.500   5.8259  684.391   6.6355 12.10840 8.830098 
1 1 1    8    3  -18 o  626.409   3.9900 15996.43  203.735 16078.92  270.823 15888.90  309.232  627.966   5.2907  624.204   6.0774 3.762512 8.057724 
1 1 1    8    3  -17 o  597.890   3.8188 14572.72  186.117 14280.20  242.097 14995.43  291.025  591.814   5.0184  606.412   5.8874 -14.59796 7.736066 
1 1 1    8    3  -16 o  704.251   4.4514 20220.17  255.543 20333.60  339.822 20072.54  387.672  706.148   5.9036  701.545   6.7791 4.603394 8.989397 
1 1 1    8    3  -15 o  415.672   2.5759  7042.86   87.279  6974.34  122.749  7112.92  124.126  413.626   3.6406  417.715   3.6454 -4.088989 5.151997 
1 1 1    8    3  -14 o  1151.32   6.6976 54059.67  628.569 53402.14  879.416 54746.44  898.763  1143.94   9.4309  1158.24   9.5194 -14.29517 13.40004 
1 1 1    8    3  -13 o  439.464   2.7017  7872.21   96.784  7818.31  136.365  7926.93  137.387  437.935   3.8200  440.966   3.8221 -3.031494 5.403767 
1 1 1    8    3  -12 o  506.647   3.2771 10463.59  135.339 10303.80  204.539 10588.04  180.504  502.714   4.9914  509.622   4.3451 -6.907990 6.617695 
1 1 1    8    3  -11 o  292.560   1.9422  3488.67   46.317  3471.92   65.552  3505.36   65.451  291.850   2.7555  293.252   2.7380 -1.402588 3.884507 
1 1 1    8    3  -10 o  388.257   2.4272  6144.40   76.816  6113.84  108.458  6175.16  108.812  387.275   3.4356  389.212   3.4297 -1.937317 4.854511 
1 1 1    8    3   -9 o  548.759   3.2951 12275.32  147.395 12091.80  206.006 12467.80  210.980  544.602   4.6405  553.003   4.6803 -8.401184 6.590875 
1 1 1    8    3   -8 o  371.029   2.3370  5611.16   70.680  5561.26   99.542  5661.90  100.377  369.362   3.3061  372.689   3.3041 -3.327209 4.674134 
1 1 1    8    3   -7 o  627.350   3.7306 16043.80  190.774 15784.21  266.308 16317.45  273.424  622.198   5.2507  632.618   5.3022 -10.42029 7.462158 
1 1 1    8    3   -6 o  782.246   5.8187 24951.09  371.026 24590.51  472.995 25527.83  598.207  776.460   7.4731  790.960   9.2781 -14.50024 11.91349 
1 1 1    8    3   -5 o  491.517   3.4376  9848.05  137.729 10121.99  243.820  9719.68  166.909  498.225   6.0035  488.284   4.1935 9.941498 7.323089 
1 1 1    8    3   -4 o  242.711   1.9535  2401.08   38.649  2433.11   67.471  2385.44   47.152  244.312   3.3879  241.916   2.3911 2.396225 4.146745 
1 1 1    8    3   -3 o  172.647   1.6264  1214.89   22.889  1282.80   40.703  1183.48   27.680  177.400   2.8148  170.399   1.9928 7.001205 3.448792 
1 1 1    8    3   -2 o  396.013   3.1146  6392.64  100.542  6315.61  157.271  6445.89  130.751  393.582   4.9020  397.641   4.0338 -4.059143 6.348359 
1 1 1    8    3   -1 o  326.331   2.4276  4340.67   64.577  4297.60   90.721  4384.91   91.942  324.695   3.4277  327.977   3.4390 -3.281647 4.855488 
1 1 1    8    3    0 o  293.084   2.4473  3501.26   58.467  3450.25   91.595  3536.34   75.953  290.924   3.8624  294.541   3.1635 -3.616669 4.992554 
1 1 1    8    3    1 o  576.259   3.9770 13537.28  186.814 13215.45  258.855 13887.12  269.880  569.310   5.5779  583.594   5.6731 -14.28418 7.955984 
1 1 1    8    3    2 o  387.927   3.4210  6134.41  108.178  6326.13  156.653  5959.64  149.567  393.911   4.8787  382.332   4.7991 11.57864 6.843461 
1 1 1    8    3    3 o  583.337   4.4101 13872.57  209.704 14405.63  342.470 13552.81  265.245  594.319   7.0692  576.528   5.6441 17.79132 9.045897 
1 1 1    8    3    4 o  840.164   6.2312 28784.47  426.748 29086.83  680.855 28588.82  547.678  844.235   9.8936  837.162   8.0256 7.072815 12.73949 
1 1 1    8    3    5 o  641.917   4.8190 16799.55  252.156 16795.52  398.620 16802.25  325.572  641.691   7.6207  641.902   6.2222 -0.2110596 9.838245 
1 1 1    8    3    6 o  309.924   2.5569  3915.21   64.595  3987.69  103.746  3869.32   82.547  312.759   4.0694  308.094   3.2869 4.664703 5.231002 
1 1 1    8    3    7 o  690.893   5.1656 19461.79  290.918 19831.33  467.616 19228.45  371.584  697.230   8.2277  686.659   6.6387 10.57141 10.57197 
1 1 1    8    3    8 o  628.541   4.7260 16106.58  242.140 15947.66  310.068 16354.99  387.657  625.370   6.0825  633.224   7.5103 -7.853638 9.664412 
1 1 1    8    3    9 o  132.184   1.5259  712.162   16.441  708.373   23.525  715.779   22.987  131.830   2.1892  132.518   2.1280 -0.6876221 3.053041 
1 1 1    8    3   10 o  358.755   2.6231  5246.17   76.710  5220.66  108.241  5271.91  108.731  357.865   3.7105  359.617   3.7092 -1.752167 5.246514 
1 1 1    8    3   11 o  229.070   1.8985  2138.77   35.451  2129.84   50.167  2147.67   50.102  228.585   2.6924  229.541   2.6777 -0.9552765 3.797220 
1 1 1    8    3   12 o  822.961   5.5763 27615.37  374.078 27460.08  526.508 27773.66  531.582  820.469   7.8724  825.137   7.9033 -4.668518 11.15512 
1 1 1    8    3   13 o  692.424   4.7291 19547.22  266.922 19385.55  374.931 19713.38  380.092  689.448   6.6714  695.251   6.7067 -5.802856 9.459771 
1 1 1    8    3   14 o  389.771   2.8126  6192.59   89.362  6172.81  126.150  6212.51  126.605  389.126   3.9770  390.375   3.9786 -1.249329 5.625506 
1 1 1    8    3   15 o  372.187   2.7086  5646.42   82.176  5594.20  115.463  5700.02  116.980  370.443   3.8237  373.930   3.8378 -3.487000 5.417542 
1 1 1    8    3   16 o  276.064   2.1608  3106.39   48.626  3125.46   69.263  3087.85   68.281  276.901   3.0686  275.230   3.0435 1.670593 4.321932 
1 1 1    8    3   17 o  1017.46   6.8538 42221.65  568.443 42121.54  802.313 42322.56  805.496  1015.91   9.6884  1018.33   9.7038 -2.419128 13.71236 
1 1 1    8    3   18 o  803.886   5.4564 26350.23  357.553 26267.51  504.248 26433.87  507.075  802.449   7.7089  804.984   7.7277 -2.535278 10.91530 
1 1 1    8    3   19 o  836.737   5.6718 28549.06  386.853 28495.55  546.159 28602.94  548.032  835.753   8.0169  837.325   8.0293 -1.571960 11.34634 
1 1 1    8    3   20 o  682.435   4.6684 18987.68  259.697 19227.41  371.375 18758.27  363.291  686.615   6.6354  678.191   6.5715 8.423950 9.338796 
1 1 1    8    3   21 o  405.884   3.5884  6715.77  118.724  6873.37  171.089  6569.39  164.886  410.577   5.1120  401.398   5.0393 9.179596 7.178252 
1 1 1    8    3   22 o  732.529   6.1209 21883.20  365.489 21920.60  517.692 21846.03  516.072  732.940   8.6650  731.693   8.6526 1.246460 12.24536 
1 1 1    8    3   23 o  634.608   5.3449 16421.59  276.492 16617.61  394.879 16233.06  387.270  638.237   7.5901  630.813   7.5314 7.423584 10.69258 
1 1 1    8    3   24 o  384.333   4.8514  6022.64  151.990   0.0000   0.0000  6022.64  151.990  ?   ?   384.333   4.8514 0.000000 4.851444 
1 1 1    8    3   25 o  345.187   4.4600  4858.02  125.495  4771.62  175.819  4947.75  179.182  342.047   6.3058  348.303   6.3111 -6.255127 8.921491 
1 1 1    8    3   26 o  428.705   4.3279  7493.11  151.241  7412.44  261.259  7533.77  185.479  426.253   7.5191  429.832   5.2937 -3.579163 9.195697 
1 1 1    8    3   27 o  219.589   4.7285  1966.07   84.638  1966.07   84.638   0.0000   0.0000  219.589   4.7285  ?   ?  0.000000 4.728463 
1 1 1    8    3   28 o  457.224   4.5788  8523.69  170.653  8870.97  306.638  8367.88  205.401  466.259   8.0679  452.984   5.5627 13.27438 9.799751 
1 1 1    8    3   29 o  586.649   4.4435 14032.11  212.492 13806.98  331.676 14188.85  276.747  581.766   6.9941  589.843   5.7559 -8.077026 9.057966 
1 1 1    8    3   30 o  401.659   3.1654  6576.65  103.640  6601.03  164.691  6560.66  133.357  402.344   5.0216  401.145   4.0783 1.198975 6.469039 
1 1 1    8    3   31 o  245.096   2.8123  2448.77   56.188   0.0000   0.0000  2448.77   56.188  ?   ?   245.096   2.8123 0.000000 2.812340 
1 1 1    8    3   32 o  456.677   3.5362  8502.35  131.639  8524.37  208.903  8487.84  169.534  457.177   5.6056  456.248   4.5585 0.9295044 7.225143 
1 1 1    8    3   33 o  282.078   2.3988  3243.39   55.158  3255.16   87.925  3235.76   70.828  282.562   3.8174  281.734   3.0841 0.8275146 4.907533 
1 1 1    8    3   34 o  424.651   3.3193  7351.58  114.899  7419.06  183.428  7308.02  147.399  426.512   5.2759  423.355   4.2712 3.156738 6.788157 
1 1 1    8    3   35 o  327.170   2.6802  4363.44   71.479  4347.63  113.167  4373.92   92.198  326.533   4.2516  327.544   3.4531 -1.010803 5.477280 
1 1 1    8    3   36 o  663.627   4.9795 17961.19  269.368 18276.27  432.618 17761.70  344.240  669.088   7.9320  659.791   6.4006 9.297119 10.19237 
1 1 1    8    3   37 o  239.540   2.1537  2338.93   42.054  2328.75   66.776  2345.63   54.139  238.994   3.4277  239.872   2.7688 -0.8782043 4.406268 
1 1 1    8    3   38 o  229.235   2.0950  2142.03   39.147  2151.37   62.570  2136.03   50.182  229.711   3.3416  228.904   2.6894 0.8071747 4.289382 
1 1 1    8    3   39 o  384.773   3.0535  6035.95   95.772  6144.48  153.967  5967.46  122.315  388.128   4.8665  382.547   3.9225 5.580780 6.250493 
1 1 1    8    3   40 o   89.194   1.7256  324.280   12.546  333.037   20.557  319.083   15.838   90.340   2.7950   88.473   2.1961 1.866112 3.554513 
1 1 1    8    3   41 o  303.797   2.5329  3762.48   62.725  3807.34  100.423  3733.77   80.321  305.548   4.0320  302.612   3.2562 2.935272 5.182600 
1 1 1    8    3   42 o  568.694   4.3132 13191.01  199.948 13200.61  316.674 13184.64  257.845  568.590   6.8325  568.420   5.5648 0.1701050 8.811926 
1 1 1    8    3   43 o  436.741   3.4039  7777.98  121.183  7771.72  191.947  7782.12  156.261  436.405   5.3958  436.787   4.3888 -0.3820801 6.955302 
1 1 1    8    3   44 o  163.625   1.7860  1091.36   23.822  1131.64   38.993  1067.38   30.090  166.598   2.8713  161.810   2.2813 4.788300 3.667270 
1 1 1    8    3   45 o  531.419   3.7070 11517.75  160.583 11606.21  229.184 11432.45  225.070  533.275   5.2723  529.276   5.2168 3.999573 7.416951 
1 1 1    8    3   46 o  296.869   2.5005  3593.17   60.510  3653.24   97.987  3556.14   76.932  299.264   4.0168  295.305   3.1959 3.958496 5.133094 
1 1 1    8    3   47 o  127.155   1.7055  659.089   17.678  671.451   29.988  652.506   21.885  128.323   2.8668  126.513   2.1221 1.810234 3.566805 
1 1 1    8    3   48 o   32.394   2.9960   43.158   7.8216   62.691   14.782   35.563   9.2176   38.904   4.7604   29.259   3.9668 9.644896 6.196513 
1 1 1    8    3   49 o   99.444   1.8804  403.147   15.243  416.028   24.003  394.442   19.733  100.962   2.9196   98.326   2.4639 2.636055 3.820320 
1 1 1    8    3   50 o  202.777   1.9774  1676.33   32.686  1630.65   42.532  1742.24   51.083  199.974   2.6092  206.686   3.0320 -6.712051 4.000112 
1 1 1    8    3   51 o  142.725   1.7431  830.438   20.280  816.865   27.216  847.382   30.409  141.541   2.3589  144.154   2.5878 -2.613525 3.501575 
1 1 1    8    3   52 f  121.174   1.6957  598.581   16.749  630.751   23.372  564.617   24.015  124.375   2.3053  117.670   2.5037 6.705292 3.403360 
1 1 1    8    3   53 o  112.425   1.5468  515.255   14.175  515.824   21.034  514.781   19.187  112.474   2.2942  112.364   2.0949 0.1096573 3.106730 
1 1 1    8    3   54 o  160.132   1.6344  1045.36   21.334  1042.43   30.856  1048.04   29.529  159.886   2.3675  160.320   2.2595 -0.4334259 3.272736 
1 1 1    8    3   55 o   97.171   1.5453  384.922   12.240  408.199   18.528  366.896   16.305  100.052   2.2717   94.859   2.1087 5.193665 3.099563 
1 1 1    8    3   56 o  216.327   1.7247  1907.90   30.412  1929.86   40.835  1880.54   45.574  217.544   2.3027  214.730   2.6037 2.813278 3.475869 
1 1 1    8    3   57 o  153.525   1.4917  960.869   18.668  982.335   25.316  935.285   27.638  155.216   2.0009  151.446   2.2388 3.770599 3.002642 
1 1 1    8    3   58 o  200.281   1.6606  1635.35   27.111  1653.51   36.449  1612.87   40.560  201.366   2.2206  198.862   2.5021 2.504120 3.345367 
1 1 1    8    3   59 o  182.951   1.5939  1364.56   23.770  1333.35   31.379  1406.59   36.412  180.826   2.1288  185.714   2.4052 -4.887405 3.212027 
1 1 1    8    3   60 o  303.201   2.2988  3749.08   56.815  3774.51   70.930  3703.56   94.902  304.178   2.8607  301.191   3.8654 2.986664 4.808818 
1 1 1    8    3   61 o  121.094   1.3809  597.791   13.630  634.643   19.542  562.879   19.021  124.758   1.9216  117.491   1.9860 7.266922 2.763518 
1 1 1    8    3   62 o  280.988   1.8932  3219.36   43.364  3269.16   62.679  3173.64   60.057  283.088   2.7162  278.928   2.6414 4.159882 3.788788 
1 1 1    8    3   63 o  217.634   1.6068  1931.07   28.505  1936.52   41.154  1926.05   39.519  217.903   2.3169  217.318   2.2309 0.5846863 3.216346 
1 1 1    8    3   64 o  143.277   1.4622  836.911   17.078  834.667   23.053  839.640   25.423  143.069   1.9768  143.487   2.1736 -0.4180756 2.938059 
1 1 1    8    3   65 o  112.646   1.2308  517.277   11.301  542.072   17.981  501.086   14.530  115.298   1.9132  110.861   1.6079 4.436623 2.499074 
1 1 1    8    3   66 o  102.061   1.3562  424.655   11.283  454.743   18.728  407.510   14.137  105.594   2.1758   99.972   1.7348 5.622452 2.782705 
1 1 1    8    3   67 o  141.243   1.3436  813.304   15.469  826.010   22.882  802.610   20.993  142.322   1.9724  140.296   1.8357 2.025253 2.694433 
1 1 1    8    3   68 o   58.497   1.4226  139.507   6.7833  141.627   11.461  138.364   8.4154   58.875   2.3931   58.225   1.7752 0.6504173 2.979650 
1 1 1    8    3   69 o   68.148   1.7579  189.499   9.7570  177.886   12.392  208.444   15.827   65.998   2.3070   71.423   2.7235 -5.424751 3.569232 
1 1 1    8    3   70 o  136.059   1.6683  754.836   18.503  776.971   25.963  731.992   26.375  138.012   2.3078  133.953   2.4155 4.059616 3.340774 
1 1 1    8    3   71 o   84.239   1.5238  289.330   10.463  291.719   17.199  287.926   13.184   84.522   2.4991   84.024   1.9248 0.4973221 3.154448 
1 1 1    8    3   72 o   72.973   2.0146  217.354   11.972  207.751   16.380  228.366   17.541   71.291   2.8243   74.745   2.8844 -3.454277 4.036903 
1 1 1    8    3   73 o  128.901   1.6319  677.523   17.147  675.565   22.193  680.425   27.009  128.693   2.1156  129.131   2.5660 -0.4376526 3.325617 
1 1 1    8    3   74 o   73.806   1.9438  222.325   11.684  222.766   14.882  221.616   18.864   73.848   2.4758   73.606   3.1513 0.2418594 4.007531 
1 1 1    8    3   75 o  184.515   1.6970  1388.37   25.524  1389.15   33.286  1387.26   39.767  184.531   2.2128  184.369   2.6460 0.1621857 3.449361 
1 1 1    8    3   76 o  323.631   2.2984  4273.40   60.633  4264.56   79.759  4285.50   93.326  323.168   3.0277  323.851   3.5352 -0.6828918 4.654558 
1 1 1    8    3   77 o  168.387   1.6223  1156.31   22.267  1119.87   28.628  1212.12   35.430  165.680   2.1198  172.333   2.5221 -6.653397 3.294611 
1 1 1    8    3   78 o  122.539   1.7047  612.419   17.028  595.741   23.632  630.430   24.557  120.818   2.3995  124.284   2.4240 -3.466103 3.410767 
1 1 1    8    3   79 o  133.171   1.6596  723.317   18.016  725.412   21.908  718.938   31.665  133.342   2.0155  132.671   2.9280 0.6714325 3.554652 
1 1 1    8    3   80 o   44.333   2.4069   80.464   8.6654   77.249   11.080   85.529   13.905   43.365   3.1561   45.569   3.7773 -2.204315 4.922300 
1 1 1    8    3   81 o  117.927   1.5507  567.191   14.907  553.383   19.164  588.345   23.720  116.456   2.0188  120.048   2.4240 -3.592041 3.154548 
1 1 1    8    3   82 o  174.507   1.6345  1242.18   23.251  1236.24   30.438  1250.50   36.030  174.039   2.1455  174.993   2.5258 -0.9539032 3.314045 
1 1 1    8    3   83 o  162.156   1.5998  1072.60   21.147  1069.94   27.706  1076.31   32.729  161.907   2.0993  162.343   2.4732 -0.4362946 3.244073 
1 1 1    8    3   84 o  133.291   1.8532  724.972   20.135  728.303   31.737  722.728   26.049  133.480   2.9168  133.031   2.4021 0.4491425 3.778639 
1 1 1    8    3   85 o   39.531   3.1181   64.309   9.9664   63.068   15.507   65.182   13.009   38.847   5.0140   39.665   4.0815 -0.8179131 6.465181 
1 1 1    8    3   86 o   31.585   3.7428   41.444   9.4491   53.442   14.665   32.927   12.356   35.662   5.1975   27.762   5.6523 7.900175 7.678690 
1 1 1    8    3   87 o  107.307   1.8878  470.012   16.513  466.440   21.520  475.126   25.750  106.842   2.4709  107.736   2.9348 -0.8943481 3.836504 
1 1 1    8    3   88 o   75.458   2.0814  232.699   12.791  226.483   16.602  241.777   20.063   74.368   2.7433   76.775   3.2129 -2.407036 4.224765 
1 1 1    8    3   89 o  154.625   2.1288  976.612   26.832  976.448   31.259  977.069   52.299  154.551   2.4812  154.127   4.1666 0.4239807 4.849410 
1 1 1    8    3   90 o   94.696   2.1972  366.424   16.960  370.180   19.998  356.800   32.013   95.099   2.5821   93.029   4.2326 2.070473 4.958008 
1 1 1    8    3   91 o   88.145   2.3136  317.872   16.609  319.541   19.656  313.707   31.054   88.310   2.7339   87.138   4.3861 1.171974 5.168339 
1 1 1    8    3   92 o  211.681   2.7359  1835.02   47.209  1819.65   57.818  1865.76   81.769  210.534   3.3690  212.449   4.7217 -1.914902 5.800404 
1 1 1    8    3   93 o   21.590   5.2952   20.122   9.2469   31.691   12.264   4.8778   14.078   27.090   5.7327   16.433   6.6892 10.65652 8.809596 
1 1 1    8    3   94 o   78.230   1.8491  250.077   11.792  250.850   16.888  249.343   16.472   78.199   2.6531   77.975   2.5952 0.2246475 3.711361 
1 1 1    8    3   95 o  105.119   1.6948  451.457   14.522  441.837   20.440  461.262   20.637  103.865   2.4142  106.130   2.3855 -2.264717 3.393931 
1 1 1    8    3   96 o   36.317   3.1051   54.619   9.1042   52.005   14.261   56.418   11.828   34.947   5.1612   36.724   4.0168 -1.777161 6.540051 
1 1 1    8    3   97 o   34.022   2.8405   47.885   7.8056   47.510   10.631   48.323   11.497   33.657   3.9501   33.872   4.2579 -0.2151260 5.807968 
1 1 1    8    3   98 f   38.148   2.5643   60.015   7.9278   59.078   10.738   61.137   11.754   37.649   3.5404   38.236   3.8224 -0.5874214 5.210096 
1 1 1    8    3   99 o   65.559   1.8527  176.051   9.8909  182.363   13.670  169.115   14.329   66.584   2.5232   64.060   2.7505 2.523315 3.732508 
1 1 1    8    3  100 o   56.439   2.0163  130.700   9.2611  125.469   12.674  136.694   13.566   55.117   2.8303   57.516   2.9030 -2.399368 4.054372 
1 1 1    8    3  101 o   30.547   3.2487   39.039   7.9656   44.771   9.5202   25.658   14.545   32.635   3.6406   23.935   7.0082 8.699591 7.897438 
1 1 1    8    3  102 o   51.315   2.1780  108.333   9.0897  111.409   10.893  101.280   16.495   51.942   2.5807   49.006   4.1688 2.936737 4.902965 
1 1 1    8    3  103 o   20.010   4.4148   17.486   7.0077   24.491   9.0274   6.8636   11.116   23.644   4.8468   15.442   6.0569 8.201988 7.757432 
1 1 1    8    3  104 o   35.990   2.5939   53.717   7.5587   49.502   9.7584   60.039   11.951   34.284   3.5427   37.651   3.9529 -3.366615 5.308145 
1 1 1    8    3  105 o   33.730   2.7553   47.371   7.5097   45.360   9.7519   50.302   11.772   32.717   3.7227   34.262   4.3100 -1.544762 5.695177 
1 1 1    8    3  106 o   27.180   3.7661   31.551   8.1203   36.256   11.564   26.974   11.405   28.661   5.1385   24.410   5.8153 4.250664 7.760261 
1 1 1    8    3  107 o   61.777   2.0584  157.216   10.351  137.018   14.574  177.776   14.704   57.264   3.1342   65.422   2.7635 -8.158157 4.178588 
1 1 1    8    3  108 o   82.026   1.8179  276.398   12.155  276.128   17.335  276.660   17.048   81.607   2.6093   81.710   2.5627 -0.1031570 3.657318 
1 1 1    8    3  109 o   31.884   3.3217   42.996   8.5069   44.461   12.160   41.591   11.905   31.812   4.8418   30.714   4.9214 1.098541 6.903850 
1 1 1    8    3  110 o   46.767   2.2530   90.540   8.5637   88.777   11.248   92.971   13.209   46.029   3.0144   46.898   3.4799 -0.8693237 4.603998 
1 1 1    8    3  111 o   44.259   2.3502   81.303   8.4485   84.208   11.038   77.194   13.128   44.776   3.0422   42.496   3.8309 2.280506 4.891932 
1 1 1    8    3  112 o   78.346   1.7273  252.441   11.031  243.109   14.368  265.843   17.217   76.584   2.3041   79.875   2.6480 -3.291252 3.510138 
1 1 1    8    3  113 o   11.405   4.8331   1.3446   7.7820   3.5450   9.5584  -2.9811   13.402   13.168   5.4520   13.264   5.9561 -0.9661007E-01 8.074656 
1 1 1    8    3  114 o   22.139   4.8400   22.336   8.4905   14.650   9.8033   45.407   16.985   17.910   5.8439   30.368   7.0041 -12.45827 9.121923 
1 1 1    8    3  115 o   24.081   4.1506   25.780   7.8536   25.348   10.287   26.384   12.160   23.203   5.5195   23.295   6.2674 -0.9224510E-01 8.351326 
1 1 1    8    3  116 o   14.702   5.1699   9.2106   7.6835   24.166   10.347  -9.1730   11.472   22.485   5.6523   10.808   5.0829 11.67684 7.601608 
1 1 1    8    3  117 o   19.467   5.2078   17.928   8.4254   20.038   11.829   15.754   12.004   20.147   6.4054   18.284   6.4592 1.862888 9.096747 
1 1 1    8    3  118 o   77.278   1.9443  247.965   12.238  236.426   16.894  260.707   17.753   74.746   2.7775   78.493   2.7790 -3.747383 3.929070 
1 1 1    8    3  119 o   8.9703   4.1970  -5.8904   7.6527   4.1536   10.148 -19.1316   11.652   13.253   5.5624   9.2550   4.5380 3.998461 7.178729 
1 1 1    8    3  120 o   36.051   2.9871   55.912   8.6994   56.675   11.354   54.827   13.538   35.596   3.9811   34.165   5.0099 1.430344 6.399085 
1 1 1    8    3  121 o   13.579   5.2158   7.2652   8.1116   15.239   10.566  -4.1794   12.658   17.554   6.0698   12.109   5.5721 5.445050 8.239566 
1 1 1    8    3  122 o   17.030   5.6799   14.225   9.2437   8.7135   13.042   19.788   13.103   15.441   6.3786   19.366   6.7557 -3.924397 9.291178 
1 1 1    8    3  123 o   36.688   4.1012   61.015   12.055   69.905   14.203   38.100   22.802   38.833   4.5745   24.062   8.8488 14.77016 9.961339 
1 1 1    8    3  124 o   18.069   6.2600   16.846   11.241   16.691   13.046   17.292   22.153   17.992   6.6794   18.775   8.0608 -0.7833405 10.46858 
1 1 1    8    3  125 f   16.741   6.2196   13.784   11.315   6.5433   13.144   34.514   22.239   14.669   6.2511   22.833   8.6688 -8.163936 10.68758 
1 1 1    8    3  126 o   36.304   3.9445   59.747   11.486   63.981   15.043   53.828   17.786   36.270   5.2397   31.055   7.1707 5.214838 8.881132 
1 1 1    8    3  127 o   12.803   5.5238   3.3379   10.502   12.115   13.800  -8.7391   16.187   16.317   6.6299   12.529   5.9358 3.788557 8.898863 
1 1 1    8    3  128 o   13.546   5.6557   5.9125   10.409   15.196   13.540  -7.4976   16.274   17.237   6.7068   12.714   6.0019 4.523637 9.000178 
1 1 1    8    3  129 o   14.331   5.7966   8.2541   10.494   14.144   13.687  -0.1485   16.348   16.829   6.6833   13.911   6.3759 2.917500 9.236787 
1 1 1    8    3  130 o   20.059   6.4142   22.323   11.847   30.513   13.738  -1.4386   23.401   23.078   6.8255   15.368   7.2372 7.710460 9.948042 
1 1 1    8    3  131 o   14.463   5.9940   8.0246   11.568   1.2980   13.052   32.661   24.979   13.100   5.8806   21.300   8.8159 -8.199942 10.59726 
1 1 1    8    3  132 o   16.934   6.3722   14.829   11.955   6.8634   13.556   42.691   25.353   14.638   6.2954   23.664   9.1858 -9.025823 11.13601 
1 1 1    8    4 -130 o   14.617   5.7657   9.4032   10.123  -2.3212   12.478   31.973   17.312   12.089   5.5515   22.422   7.7687 -10.33357 9.548391 
1 1 1    8    4 -129 o   22.332   5.8071   26.269   10.669   25.843   13.315   27.035   17.831   21.176   6.8026   20.658   7.7804 0.5182323 10.33493 
1 1 1    8    4 -128 o   18.121   5.8930   17.336   9.9730   19.466   10.936   6.8115   24.309   18.968   6.1711   16.678   7.6916 2.289841 9.861194 
1 1 1    8    4 -127 o   15.827   5.7786   12.292   9.6969   10.523   10.576   21.626   24.293   15.200   5.9236   19.256   8.3547 -4.056251 10.24155 
1 1 1    8    4 -126 o   24.095   5.0035   28.413   9.5055   24.805   11.341   36.932   17.428   21.517   6.1553   24.483   7.7739 -2.965961 9.915724 
1 1 1    8    4 -125 o   14.621   5.5679   9.4996   9.1919   5.6708   10.917   18.823   17.036   13.674   5.7559   18.595   7.4327 -4.921292 9.400796 
1 1 1    8    4 -124 o   13.503   5.4200   6.7381   9.0985   11.990   10.826  -5.8952   16.790   15.939   6.0490   13.233   6.1996 2.705914 8.661737 
1 1 1    8    4 -123 o   35.933   3.3496   56.840   9.6984   56.194   11.558   58.377   17.830   35.084   4.1198   32.865   6.8766 2.218868 8.016240 
1 1 1    8    4 -122 o   13.172   5.3384   5.8676   8.9205   4.4620   10.628   9.2192   16.411   13.307   5.6440   16.206   6.9476 -2.899475 8.951169 
1 1 1    8    4 -121 o   18.380   5.5312   16.855   8.9617   16.287   10.739   18.157   16.266   17.937   6.1220   18.737   7.3334 -0.8005848 9.552909 
1 1 1    8    4 -120 o   24.188   4.7897   27.701   9.1096   36.504   10.873   6.9718   16.685   27.688   5.0016   15.889   6.9087 11.79868 8.529092 
1 1 1    8    4 -119 o   12.194   5.1126   3.3585   8.5606   3.0299   10.206   4.1379   15.721   12.816   5.4864   15.062   6.6234 -2.245064 8.600538 
1 1 1    8    4 -118 o   17.448   5.7829   14.809   9.5852   26.856   12.344  -3.4841   15.211   22.800   6.3881   13.394   6.1429 9.405900 8.862457 
1 1 1    8    4 -117 o   11.954   5.2238   0.6591   9.6425 -10.3808   12.247   18.662   15.640   10.881   5.1575   19.364   7.2880 -8.483228 8.928348 
1 1 1    8    4 -116 o   50.155   2.8393  106.691   11.561  106.182   15.047  107.425   18.060   49.310   3.7723   48.835   4.5906 0.4749146 5.941720 
1 1 1    8    4 -115 o   55.617   2.6506  130.234   11.982  127.817   15.330  134.027   19.209   54.484   3.4698   55.005   4.3187 -0.5214806 5.539958 
1 1 1    8    4 -114 o   13.978   5.7059   5.4220   10.278  -3.5063   11.511   40.533   22.827   12.019   5.4468   26.755   8.9259 -14.73619 10.45650 
1 1 1    8    4 -113 f   20.345   5.5680   19.487   9.5011   7.7033   12.027   39.046   15.495   15.493   6.2272   28.109   6.8307 -12.61553 9.243191 
1 1 1    8    4 -112 o   27.078   3.5536   31.651   7.6546   32.092   11.638   31.314   10.162   26.264   5.6066   26.297   4.9216 -0.3305244E-01 7.460313 
1 1 1    8    4 -111 o   9.1759   4.1987  -4.0109   7.0512 -12.5940   10.620   2.7562   9.4297   9.8202   4.6960   12.842   5.3739 -3.021928 7.136613 
1 1 1    8    4 -110 o   18.807   4.8205   15.970   7.4235   10.475   11.101   20.414   9.9843   16.468   6.1522   21.018   5.6895 -4.550085 8.379711 
1 1 1    8    4 -109 o   13.892   4.9478   7.5501   7.0561   11.737   9.9201   3.2625   10.039   16.762   5.8760   13.411   5.5730 3.351428 8.098471 
1 1 1    8    4 -108 o   16.383   4.9476   11.824   7.1613   23.345   9.7772  -1.5098   10.519   22.679   5.3720   12.249   5.4010 10.42946 7.617688 
1 1 1    8    4 -107 o   13.290   4.9175   6.3043   7.0604   2.8730   9.6595   10.240   10.345   13.144   5.4648   16.293   5.9656 -3.149065 8.090254 
1 1 1    8    4 -106 o   42.803   2.3237   75.845   8.0772   66.154   11.049   86.967   11.837   39.590   3.4586   45.532   3.2098 -5.942577 4.718574 
1 1 1    8    4 -105 o   56.269   1.9943  130.361   9.1327  135.830   12.466  124.024   13.417   57.208   2.6807   54.523   3.0309 2.685219 4.046268 
1 1 1    8    4 -104 o   84.862   1.6596  295.231   11.480  306.260   15.787  282.850   16.726   86.195   2.2488   82.731   2.4830 3.464447 3.349938 
1 1 1    8    4 -103 o   41.997   2.3985   72.933   8.1768   71.659   11.352   74.306   11.787   41.330   3.3996   42.067   3.4682 -0.7371597 4.856570 
1 1 1    8    4 -102 o   45.407   2.2035   84.979   8.1318   86.801   11.215   82.961   11.808   45.669   3.0298   44.566   3.2731 1.102943 4.460151 
1 1 1    8    4 -101 o   36.593   2.7767   55.603   8.2205   62.585   12.375   50.090   10.997   38.468   4.0051   34.375   3.9993 4.093513 5.660001 
1 1 1    8    4 -100 o   60.203   1.8638  148.679   9.1354  152.355   12.603  144.609   13.261   60.773   2.5498   59.145   2.7581 1.628193 3.756112 
1 1 1    8    4  -99 o   83.831   1.9738  288.067   13.488  284.458   15.046  302.837   30.440   83.212   2.2201   84.887   4.4142 -1.674599 4.941090 
1 1 1    8    4  -98 o   21.373   5.6017   20.099   9.8759   20.099   9.8759   0.0000   0.0000   21.373   5.6017  ?   ?  0.000000 5.601694 
1 1 1    8    4  -97 o   73.189   2.3179  219.971   13.811  219.971   13.811   0.0000   0.0000   73.189   2.3179  ?   ?  0.000000 2.317899 
1 1 1    8    4  -96 o   82.773   1.9838  280.478   13.385  292.016   15.062  237.152   29.187   84.390   2.1915   75.180   4.7876 9.209824 5.265277 
1 1 1    8    4  -95 o   18.835   5.5351   15.192   9.0589   23.300   10.178 -15.7192   19.873   23.114   5.4848   14.750   6.8553 8.363704 8.779371 
1 1 1    8    4  -94 o   14.582   5.4539   6.8563   8.7296  -2.6248   11.327   20.726   13.700   12.760   5.6163   22.066   6.8770 -9.305840 8.878979 
1 1 1    8    4  -93 o   24.880   4.7796   26.534   9.3412   28.589   12.174   23.592   14.566   25.617   5.9451   23.417   7.0527 2.199831 9.224111 
1 1 1    8    4  -92 o   30.609   4.0095   39.285   9.7637   33.239   12.773   47.782   15.143   27.707   5.8399   33.377   5.7749 -5.669613 8.212995 
1 1 1    8    4  -91 o   84.823   2.0739  294.130   14.340  276.897   18.626  319.206   22.468   82.156   2.7854   88.142   3.1322 -5.986198 4.191494 
1 1 1    8    4  -90 o  123.533   1.9541  623.500   19.678  620.726   25.554  627.541   30.843  123.153   2.5455  123.713   3.0585 -0.5604019 3.979196 
1 1 1    8    4  -89 o  113.337   2.0067  524.782   18.539  555.097   24.718  485.803   28.028  116.471   2.6035  108.811   3.1633 7.659859 4.096972 
1 1 1    8    4  -88 o  135.342   1.9494  748.090   21.507  716.746   27.661  796.009   34.201  132.378   2.5634  139.413   3.0095 -7.035019 3.953228 
1 1 1    8    4  -87 o   34.166   3.4376   48.329   9.4438   52.056   11.718   41.421   15.953   35.353   4.1447   31.000   6.5200 4.353167 7.725855 
1 1 1    8    4  -86 o   91.046   1.7913  338.346   13.294  342.239   16.215  330.366   23.217   91.536   2.1732   89.769   3.1778 1.767365 3.849869 
1 1 1    8    4  -85 o  105.620   1.7318  455.255   14.910  468.548   18.407  429.897   25.424  107.118   2.1081  102.455   3.0476 4.663292 3.705692 
1 1 1    8    4  -84 o   73.302   1.9208  219.469   11.467  211.961   13.955  235.083   20.123   71.995   2.3811   75.717   3.2680 -3.721817 4.043489 
1 1 1    8    4  -83 o  144.821   1.7183  855.740   20.285  857.090   24.853  853.046   35.106  144.895   2.1042  144.434   2.9818 0.4613800 3.649524 
1 1 1    8    4  -82 o   97.477   1.9152  387.768   15.218  402.959   19.831  366.013   23.733   99.328   2.4493   94.557   3.0833 4.770851 3.937729 
1 1 1    8    4  -81 o  197.697   2.0392  1595.17   32.861  1636.41   43.032  1537.46   50.898  200.143   2.6376  193.888   3.2204 6.255142 4.162716 
1 1 1    8    4  -80 o   69.254   2.1904  195.960   12.350  207.160   16.037  179.641   19.359   71.155   2.7702   66.160   3.6032 4.995552 4.544989 
1 1 1    8    4  -79 o   28.750   3.8917   34.443   8.8863   24.287   10.915   54.403   15.303   23.828   5.6970   36.000   5.3794 -12.17195 7.835406 
1 1 1    8    4  -78 o  113.907   1.6961  529.235   15.748  531.249   19.315  525.241   27.201  114.102   2.0766  113.349   2.9465 0.7521896 3.604748 
1 1 1    8    4  -77 o   81.565   1.8800  271.400   12.499  260.694   15.288  292.982   21.707   79.885   2.3503   84.618   3.1525 -4.733047 3.932217 
1 1 1    8    4  -76 f   79.462   2.0604  257.790   13.335  263.751   17.328  249.133   20.882   80.332   2.6498   78.012   3.2912 2.320419 4.225354 
1 1 1    8    4  -75 o  132.845   1.8540  719.835   20.077  717.176   25.967  723.786   31.657  132.564   2.4030  133.133   2.9171 -0.5683746 3.779411 
1 1 1    8    4  -74 o  164.041   1.7615  1097.48   23.554  1085.14   33.161  1110.05   33.463  163.062   2.4948  164.924   2.4891 -1.861710 3.524135 
1 1 1    8    4  -73 o  158.520   1.9393  1024.94   25.059  1054.74   39.882  1005.50   32.212  160.721   3.0442  156.970   2.5175 3.751389 3.950304 
1 1 1    8    4  -72 o   51.698   2.7072  109.376   11.369  123.550   15.951   94.742   16.208   54.876   3.5856   47.955   4.1883 6.921402 5.513445 
1 1 1    8    4  -71 o  198.242   2.0951  1603.04   33.856  1635.74   53.385  1581.04   43.788  200.140   3.2723  196.823   2.7293 3.317368 4.261057 
1 1 1    8    4  -70 o   63.042   2.5203  162.424   12.925  149.403   16.510  183.037   20.773   60.391   3.3672   66.818   3.8300 -6.427391 5.099731 
1 1 1    8    4  -69 o  248.336   2.2927  2515.79   46.412  2543.54   60.095  2474.77   73.061  249.628   2.9533  246.136   3.6414 3.492188 4.688496 
1 1 1    8    4  -68 o  113.515   1.6966  525.430   15.699  525.145   19.149  526.015   27.414  113.471   2.0703  113.485   2.9660 -0.1384735E-01 3.617090 
1 1 1    8    4  -67 f   23.868   4.6955   24.107   8.8102   22.954   11.023   26.146   14.661   23.220   5.8320   24.885   6.9577 -1.664532 9.078703 
1 1 1    8    4  -66 o  175.163   1.6033  1251.00   22.892  1251.93   30.602  1249.81   34.496  175.201   2.1428  175.037   2.4177 0.1643829 3.230596 
1 1 1    8    4  -65 o  156.592   1.5473  999.755   19.750  1017.80   26.695  977.927   29.356  157.977   2.0730  154.839   2.3259 3.138107 3.115606 
1 1 1    8    4  -64 o  191.212   1.6591  1490.75   25.859  1556.47   35.327  1414.88   37.956  195.352   2.2185  186.237   2.5002 9.114639 3.342548 
1 1 1    8    4  -63 o  216.748   1.8892  1915.71   33.378  1926.92   41.534  1895.26   56.088  217.353   2.3442  215.491   3.1930 1.862045 3.961171 
1 1 1    8    4  -62 o  176.869   1.7160  1275.50   24.740  1313.18   31.301  1212.77   40.386  179.443   2.1399  172.404   2.8738 7.038940 3.582968 
1 1 1    8    4  -61 o  115.529   1.5732  544.157   14.815  557.728   18.843  522.182   23.977  116.950   1.9766  113.141   2.5998 3.808769 3.265867 
1 1 1    8    4  -60 o  210.016   1.7193  1798.33   29.434  1802.18   39.339  1793.45   44.364  210.210   2.2958  209.681   2.5956 0.5289154 3.465241 
1 1 1    8    4  -59 o  169.034   1.5678  1164.89   21.603  1153.00   28.721  1180.37   32.782  168.150   2.0954  170.121   2.3640 -1.971313 3.158994 
1 1 1    8    4  -58 o  169.672   1.5699  1173.69   21.712  1185.80   29.217  1158.77   32.449  170.525   2.1019  168.559   2.3616 1.966309 3.161521 
1 1 1    8    4  -57 o  316.781   2.2337  4092.35   57.678  4075.78   76.425  4114.28   87.915  316.071   2.9663  317.511   3.3968 -1.439911 4.509667 
1 1 1    8    4  -56 f  272.859   2.0083  3035.81   44.669  3005.95   59.045  3075.78   68.307  271.467   2.6683  274.569   3.0519 -3.102173 4.053874 
1 1 1    8    4  -55 o  113.817   1.4653  528.107   13.594  537.682   18.516  516.909   20.023  114.834   1.9781  112.588   2.1817 2.245224 2.944929 
1 1 1    8    4  -54 o  245.631   1.8724  2459.98   37.490  2499.24   50.477  2411.67   55.987  247.548   2.5015  243.151   2.8247 4.397324 3.773141 
1 1 1    8    4  -53 o  249.013   2.0415  2528.33   41.439  2611.54   52.177  2386.18   68.196  253.049   2.5295  241.817   3.4597 11.23260 4.285797 
1 1 1    8    4  -52 o  328.573   2.4756  4402.78   66.305  4404.80   81.554  4398.84  113.881  328.598   3.0447  328.235   4.2563 0.3627930 5.233156 
1 1 1    8    4  -51 o  244.639   1.7185  2439.93   34.270  2454.30   43.952  2417.64   54.733  245.337   2.1977  243.467   2.7578 1.870392 3.526439 
1 1 1    8    4  -50 o  340.147   2.1831  4717.60   60.532  4746.32   77.298  4672.06   97.334  341.136   2.7797  338.387   3.5287 2.749451 4.492060 
1 1 1    8    4  -49 o  241.310   1.8118  2373.98   35.639  2361.89   47.364  2389.75   54.109  240.669   2.4143  242.068   2.7422 -1.398346 3.653553 
1 1 1    8    4  -48 o  272.477   1.8447  3026.79   40.973  3112.54   59.307  2948.48   56.671  276.272   2.6335  268.895   2.5855 7.376984 3.690532 
1 1 1    8    4  -47 o  203.852   1.4585  1693.96   24.235  1658.50   32.480  1738.51   36.403  201.694   1.9755  206.495   2.1627 -4.801620 2.929127 
1 1 1    8    4  -46 o  124.168   1.3585  628.469   13.750  585.889   20.508  663.243   18.533  119.878   2.0987  127.552   1.7825 -7.673798 2.753471 
1 1 1    8    4  -45 o  126.775   1.3079  655.126   13.515  655.099   19.624  655.150   18.641  126.765   1.8991  126.771   1.8039 -0.6332397E-02 2.619308 
1 1 1    8    4  -44 o  171.432   1.4167  1197.96   19.797  1221.56   28.621  1176.30   27.413  173.102   2.0284  169.865   1.9798 3.236389 2.834410 
1 1 1    8    4  -43 o  220.465   1.6089  1981.30   28.914  1929.56   40.577  2034.68   41.212  217.551   2.2881  223.399   2.2631 -5.847931 3.218281 
1 1 1    8    4  -42 o  252.242   1.8807  2593.71   38.670  2596.00   60.011  2592.08   50.570  252.320   2.9177  252.146   2.4604 0.1738129 3.816597 
1 1 1    8    4  -41 o  405.884   2.7013  6716.85   89.374  6778.82  138.367  6672.49  117.073  407.651   4.1640  404.488   3.5507 3.162598 5.472308 
1 1 1    8    4  -40 o  369.456   2.3410  5564.69   70.503  5576.96  100.650  5552.86   98.788  369.815   3.3388  369.017   3.2841 0.7969360 4.683294 
1 1 1    8    4  -39 o  194.632   1.5196  1544.10   24.108  1524.08   34.371  1563.49   33.825  193.355   2.1807  195.840   2.1188 -2.485138 3.040539 
1 1 1    8    4  -38 f  439.658   2.7051  7880.71   96.946  7892.98  137.754  7868.66  136.461  439.933   3.8413  439.257   3.8111 0.6763916 5.411145 
1 1 1    8    4  -37 o  370.756   2.3420  5603.69   70.780  5593.56  100.376  5613.70   99.822  370.382   3.3247  371.049   3.3004 -0.6674194 4.684621 
1 1 1    8    4  -36 o  366.493   2.3198  5475.47   69.304  5554.65   99.572  5401.08   96.521  369.096   3.3095  363.960   3.2533 5.135468 4.640796 
1 1 1    8    4  -35 o  614.508   3.6627 15397.82  183.470 15466.17  260.829 15330.89  258.123  615.727   5.1968  613.031   5.1654 2.695496 7.327215 
1 1 1    8    4  -34 o  354.701   2.2581  5128.64   65.289  5176.68   93.398  5082.73   91.302  356.328   3.2155  353.082   3.1723 3.246826 4.516949 
1 1 1    8    4  -33 o  297.053   1.9681  3596.89   47.656  3609.88   67.957  3584.31   66.847  297.572   2.8016  296.517   2.7657 1.054810 3.936721 
1 1 1    8    4  -32 o  138.781   1.4405  785.046   16.296  746.398   24.891  814.034   21.558  135.316   2.2566  141.318   1.8714 -6.001266 2.931643 
1 1 1    8    4  -31 o  194.563   1.5196  1542.96   24.100  1553.84   34.652  1532.77   33.542  195.241   2.1773  193.914   2.1220 1.327301 3.040294 
1 1 1    8    4  -30 o  310.457   2.0347  3928.74   51.491  3961.37   73.642  3897.53   72.023  311.726   2.8981  309.205   2.8575 2.520996 4.069953 
1 1 1    8    4  -29 o  174.515   1.4568  1241.35   20.723  1264.77   30.119  1220.29   28.557  176.149   2.0976  173.024   2.0248 3.124786 2.915398 
1 1 1    8    4  -28 o  353.239   2.2520  5086.21   64.845  5186.73   93.560  4993.28   89.955  356.691   3.2178  349.977   3.1532 6.713257 4.505197 
1 1 1    8    4  -27 o  124.991   1.4526  636.769   14.800  646.801   24.043  630.649   18.779  125.967   2.3415  124.387   1.8521 1.579910 2.985447 
1 1 1    8    4  -26 o   90.478   1.4671  333.668   10.820  374.274   17.825  309.978   13.615   95.823   2.2821   87.206   1.9153 8.616768 2.979340 
1 1 1    8    4  -25 o  420.826   2.6050  7218.93   89.362  7233.07  126.887  7205.01  125.874  421.209   3.6956  420.391   3.6732 0.8171997 5.210557 
1 1 1    8    4  -24 o  684.527   4.3359 19105.14  241.941 18930.96  317.621 19345.91  373.424  681.305   5.7192  688.652   6.6522 -7.346985 8.772729 
1 1 1    8    4  -23 o  417.968   2.7766  7121.25   94.600  6915.69  122.348  7426.84  149.173  411.869   3.6442  426.797   4.2878 -14.92828 5.627203 
1 1 1    8    4  -22 o  481.386   3.7141  9447.26  145.740  9559.90  190.391  9287.86  226.494  484.204   4.8237  477.217   5.8224 6.986694 7.561032 
1 1 1    8    4  -21 o  134.319   1.6084  735.363   17.610  736.898   25.962  734.055   23.966  134.455   2.3687  134.197   2.1909 0.2586212 3.226614 
1 1 1    8    4  -20 o  517.225   3.9503 10906.53  166.551 10649.99  258.520 11088.56  217.766  511.000   6.2064  521.473   5.1230 -10.47299 8.047587 
1 1 1    8    4  -19 f  214.125   2.0196  1868.85   35.250  1806.04   55.010  1912.61   45.915  210.485   3.2062  216.613   2.6004 -6.127960 4.128140 
1 1 1    8    4  -18 o  251.537   2.0400  2578.94   41.829  2578.63   72.576  2579.10   51.185  251.504   3.5401  251.540   2.4963 -0.3636169E-01 4.331711 
1 1 1    8    4  -17 o  155.839   1.6573  989.872   21.052  989.662   36.729  989.974   25.692  155.815   2.8918  155.845   2.0224 -0.3022766E-01 3.528780 
1 1 1    8    4  -16 o  328.779   2.4690  4406.15   66.171  4262.33  112.013  4483.24   82.010  323.337   4.2499  331.634   3.0337 -8.297821 5.221563 
1 1 1    8    4  -15 o  233.469   1.8166  2221.72   34.572  2272.76   53.673  2185.53   45.196  236.127   2.7885  231.555   2.3945 4.571716 3.675532 
1 1 1    8    4  -14 o  744.381   4.6992 22591.88  285.138 22336.38  373.716 22947.84  441.102  740.061   6.1950  750.039   7.2147 -9.977722 9.509448 
1 1 1    8    4  -13 o  351.881   2.4229  5047.06   69.498  5007.81   91.686  5100.06  106.549  350.498   3.2091  353.702   3.6955 -3.203888 4.894402 
1 1 1    8    4  -12 o  156.155   2.0660  993.914   26.298  879.528   35.966  1125.31   38.549  146.889   3.0038  166.152   2.8462 -19.26251 4.138077 
1 1 1    8    4  -11 o  257.596   2.2849  2704.71   47.979  2781.55   77.522  2657.00   61.084  261.213   3.6408  255.307   2.9351 5.905991 4.676551 
1 1 1    8    4  -10 o  427.511   3.0588  7450.15  106.593  7487.64  151.365  7413.25  150.133  428.554   4.3329  426.421   4.3192 2.133698 6.117990 
1 1 1    8    4   -9 o  358.764   2.6460  5246.51   77.382  5236.04  109.272  5257.04  109.598  358.386   3.7404  359.104   3.7441 -0.7176819 5.292349 
1 1 1    8    4   -8 o  432.954   3.0932  7641.06  109.164  7758.17  156.196  7529.25  152.629  436.227   4.3926  429.744   4.3570 6.482880 6.186975 
1 1 1    8    4   -7 o  496.349   3.2272 10042.69  130.570 10438.20  205.912  9776.71  168.860  505.973   4.9925  489.704   4.2302 16.26852 6.543658 
1 1 1    8    4   -6 o  850.500   5.3381 29494.66  370.079 30087.43  574.999 29075.46  483.543  858.750   8.2142  844.301   7.0259 14.44897 10.80907 
1 1 1    8    4   -5 o  637.885   4.3833 16588.92  227.917 16526.79  321.340 16651.81  323.316  636.597   6.1925  639.000   6.2071 -2.402527 8.767852 
1 1 1    8    4   -4 o  292.880   2.2644  3496.38   54.061  3552.63   77.379  3442.74   75.562  295.215   3.2155  290.613   3.1897 4.601349 4.529182 
1 1 1    8    4   -3 o   92.240   1.7148  346.784   12.893  337.266   18.162  356.454   18.306   90.930   2.4526   93.484   2.4042 -2.554131 3.434458 
1 1 1    8    4   -2 o  612.535   4.2209 15296.23  210.751 15022.00  359.595 15439.71  260.104  606.860   7.2692  615.359   5.1854 -8.499390 8.929178 
1 1 1    8    4   -1 o  864.479   6.4114 30477.73  451.797 30726.67  1017.18 30416.55  504.269  866.923   14.394  863.544   7.1638 3.378296 16.07814 
1 1 1    8    4    0 o  305.566   2.3417  3805.86   58.328  3650.27   98.488  3889.91   72.389  299.231   4.0378  308.916   2.8747 -9.684723 4.956552 
1 1 1    8    4    1 o  394.153   3.1251  6332.85  100.409  6236.03  221.833  6357.79  112.604  391.015   6.9598  394.921   3.4979 -3.906250 7.789358 
1 1 1    8    4    2 o  978.286   8.0827 39044.84  644.549   0.0000   0.0000 39044.84  644.549  ?   ?   978.286   8.0827 0.000000 8.082663 
1 1 1    8    4    3 o  493.241   3.7935  9917.86  152.522  9587.37  331.452 10006.64  171.792  484.749   8.3882  495.430   4.2539 -10.68091 9.405154 
1 1 1    8    4    4 o  165.973   1.6878  1122.79   22.834  1117.21   39.528  1125.59   27.974  165.553   2.9291  166.178   2.0651 -0.6250610 3.583914 
1 1 1    8    4    5 o  494.240   3.4712  9957.75  139.848  9777.86  194.740 10149.31  200.956  489.712   4.8784  498.925   4.9412 -9.212830 6.943645 
1 1 1    8    4    6 o  831.284   5.2187 28176.38  353.626 28213.63  540.819 28148.56  467.385  831.603   7.9781  830.745   6.9019 0.8583984 10.54926 
1 1 1    8    4    7 o  471.595   3.0866  9065.84  118.654  8973.04  179.752  9137.51  157.957  469.130   4.7005  473.429   4.0931 -4.299133 6.232797 
1 1 1    8    4    8 o  327.832   2.2841  4380.69   61.037  4384.40   93.402  4377.93   80.638  327.953   3.4939  327.719   3.0186 0.2342224 4.617255 
1 1 1    8    4    9 o  384.088   2.5908  6013.29   81.115  6037.04  124.352  5995.69  107.018  384.819   3.9642  383.510   3.4233 1.308472 5.237754 
1 1 1    8    4   10 o  224.291   1.9284  2050.48   35.257  2053.48   50.145  2047.54   49.580  224.449   2.7408  224.124   2.7138 0.3248291 3.857052 
1 1 1    8    4   11 o  637.830   4.3850 16586.24  227.989 16668.65  323.964 16505.39  320.909  639.315   6.2165  636.178   6.1882 3.136780 8.771489 
1 1 1    8    4   12 o  704.293   4.8136 20224.27  276.350 20298.11  392.141 20151.43  389.509  705.446   6.8193  702.895   6.7982 2.551941 9.629038 
1 1 1    8    4   13 o  248.205   2.0498  2511.05   41.473  2501.29   58.853  2520.68   58.453  247.714   2.9146  248.672   2.8836 -0.9585114 4.100060 
1 1 1    8    4   14 o  285.937   2.2408  3332.60   52.228  3422.21   75.527  3250.48   72.302  289.744   3.1978  282.381   3.1411 7.362701 4.482450 
1 1 1    8    4   15 o  739.139   5.0390 22276.18  303.603 21992.73  424.702 22572.41  434.174  734.270   7.0956  743.879   7.1602 -9.608337 10.08051 
1 1 1    8    4   16 o  349.382   2.8456  4975.83   81.041  5040.87  129.841  4934.33  103.727  351.621   4.5300  347.906   3.6576 3.714844 5.822273 
1 1 1    8    4   17 o  429.137   3.3640  7507.27  117.675  7506.59  186.395  7507.73  151.737  429.056   5.3295  429.123   4.3378 -0.6735229E-01 6.871699 
1 1 1    8    4   18 o  376.220   3.0131  5769.77   92.403  5796.72  146.923  5752.13  118.852  377.053   4.7803  375.625   3.8816 1.427429 6.157766 
1 1 1    8    4   19 f  203.114   2.2292  1681.61   36.908  1702.47   53.315  1662.41   51.143  204.361   3.2005  201.943   3.1068 2.417328 4.460470 
1 1 1    8    4   20 o  209.961   3.2472  1797.08   55.575  1797.08   55.575   0.0000   0.0000  209.961   3.2472  ?   ?  0.000000 3.247157 
1 1 1    8    4   21 o  370.009   3.3132  5581.08   99.930  5500.06  140.315  5664.45  142.351  367.276   4.6868  372.725   4.6853 -5.448334 6.627059 
1 1 1    8    4   22 o  347.534   2.8136  4923.41   79.706  4985.28  104.219  4836.23  123.716  349.693   3.6562  344.406   4.4067 5.286865 5.725981 
1 1 1    8    4   23 o  142.661   1.6018  829.544   18.627  844.957   26.982  815.509   25.747  143.977   2.2990  141.446   2.2331 2.530777 3.205014 
1 1 1    8    4   24 o  403.344   2.9011  6631.78   95.384  6756.84  137.088  6514.42  132.800  407.094   4.1311  399.726   4.0757 7.367706 5.803219 
1 1 1    8    4   25 o  447.933   3.4825  8179.75  127.157  8009.60  161.221  8459.81  206.839  443.214   4.4624  455.448   5.5713 -12.23373 7.138149 
1 1 1    8    4   26 o   61.050   2.1968  152.121   10.915  144.098   14.144  163.931   17.161   59.382   2.9311   63.325   3.3363 -3.942490 4.440907 
1 1 1    8    4   27 o  165.463   2.0475  1115.96   27.616  1146.75   39.551  1086.66   38.576  167.723   2.8929  163.269   2.8985 4.453445 4.095162 
1 1 1    8    4   28 o  234.418   2.3932  2239.99   45.731  2272.35   65.304  2208.85   64.062  236.090   3.3933  232.768   3.3763 3.321594 4.786852 
1 1 1    8    4   29 o  427.990   3.7467  7468.28  130.714  7430.02  183.920  7507.33  185.810  426.820   5.2862  429.034   5.3130 -2.213287 7.494830 
1 1 1    8    4   30 o  840.052   6.2390 28790.70  427.225 29073.00  681.432 28607.86  548.387  843.521   9.9104  837.106   8.0366 6.414795 12.75940 
1 1 1    8    4   31 o  577.723   4.3762 13610.40  206.088 13285.45  319.372 13842.26  269.770  570.568   6.8668  582.520   5.6813 -11.95129 8.912337 
1 1 1    8    4   32 o  504.715   3.8696 10386.86  159.201 10380.96  251.799 10390.79  205.484  504.408   6.1240  504.738   4.9943 -0.3296814 7.902320 
1 1 1    8    4   33 o  348.083   2.8201  4939.42   80.016  4890.52  125.871  4972.58  103.656  346.293   4.4591  349.221   3.6413 -2.928467 5.756958 
1 1 1    8    4   34 o  337.874   2.7530  4653.94   75.821  4661.55  120.346  4648.93   97.635  338.087   4.3668  337.664   3.5472 0.4226990 5.626005 
1 1 1    8    4   35 o  613.509   4.6286 15352.04  231.475 15292.33  365.060 15392.18  299.345  611.980   7.3180  614.161   5.9793 -2.181030 9.450147 
1 1 1    8    4   36 o  382.975   3.0457  5979.89   95.081  5949.29  150.084  6000.41  122.886  381.898   4.8212  383.589   3.9301 -1.691528 6.220054 
1 1 1    8    4   37 o  119.568   1.7067  582.755   16.635  599.729   27.328  572.765   20.966  121.286   2.7642  118.535   2.1699 2.751289 3.514117 
1 1 1    8    4   38 f  213.358   2.0159  1855.64   35.061  1797.52   54.931  1895.60   45.544  209.963   3.2095  215.631   2.5911 -5.668015 4.124923 
1 1 1    8    4   39 o   67.573   1.8971  186.279   10.439  190.610   17.369  183.830   13.062   68.300   3.1281   67.108   2.3916 1.192268 3.937589 
1 1 1    8    4   40 o   93.724   1.7166  358.070   13.114  346.014   21.403  365.317   16.595   92.077   2.8550   94.664   2.1505 -2.586678 3.574326 
1 1 1    8    4   41 o  236.268   2.3793  2275.81   45.824  2342.97   93.502  2254.57   52.571  239.626   4.7869  235.152   2.7426 4.474365 5.516863 
1 1 1    8    4   42 o  245.915   2.4402  2465.53   48.916  2603.34  101.573  2423.92   55.814  252.572   4.9335  243.818   2.8083 8.753448 5.676813 
1 1 1    8    4   43 o  258.101   2.5481  2716.08   53.609  2702.78   76.940  2728.64   74.738  257.417   3.6667  258.652   3.5448 -1.234924 5.100024 
1 1 1    8    4   44 o  391.053   3.4750  6237.23  110.770  6153.89  156.154  6321.64  157.156  388.289   4.9336  393.549   4.8989 -5.260559 6.952619 
1 1 1    8    4   45 o  279.543   2.4048  3186.15   54.799  3149.23   71.008  3240.51   86.168  277.883   3.1348  281.843   3.7506 -3.959778 4.888155 
1 1 1    8    4   46 o  168.754   1.8371  1160.95   25.271  1176.71   33.944  1141.35   37.851  169.880   2.4512  167.298   2.7756 2.581390 3.702993 
1 1 1    8    4   47 o  111.660   1.7256  508.273   15.706  477.685   21.247  545.131   23.323  108.237   2.4081  115.624   2.4745 -7.387657 3.452882 
1 1 1    8    4   48 o  118.193   1.5808  569.472   15.231  595.699   23.103  549.312   20.255  120.869   2.3449  116.072   2.1408 4.797287 3.175116 
1 1 1    8    4   49 o  165.714   1.6777  1119.50   22.663  1108.31   32.934  1129.56   31.234  164.862   2.4507  166.439   2.3022 -1.577362 3.362415 
1 1 1    8    4   50 o  158.105   1.6488  1019.06   21.250  1006.73   30.950  1030.06   29.228  157.124   2.4164  158.939   2.2560 -1.815750 3.305856 
1 1 1    8    4   51 o  158.297   1.6558  1021.55   21.366  983.543   30.704  1057.24   29.752  155.301   2.4254  161.020   2.2667 -5.718979 3.319700 
1 1 1    8    4   52 o  270.883   2.1530  2992.02   47.540  2984.01   67.876  2999.73   66.607  270.457   3.0788  271.173   3.0133 -0.7167664 4.307974 
1 1 1    8    4   53 o  103.446   1.5874  436.261   13.386  410.072   19.916  457.839   18.078  100.276   2.4365  105.964   2.0929 -5.687759 3.212029 
1 1 1    8    4   54 o  102.738   1.5698  430.308   13.146  445.014   19.993  419.107   17.448  104.462   2.3479  101.381   2.1114 3.080681 3.157631 
1 1 1    8    4   55 o  245.759   2.2175  2462.93   44.423  2573.46   73.888  2400.36   55.593  251.104   3.6098  242.578   2.8115 8.525681 4.575490 
1 1 1    8    4   56 f  253.436   2.0637  2619.07   42.633  2579.80   60.513  2657.78   60.075  251.467   2.9521  255.245   2.8873 -3.777557 4.129373 
1 1 1    8    4   57 o  113.446   1.5745  524.696   14.560  515.500   21.773  532.135   19.582  112.427   2.3758  114.235   2.1030 -1.807472 3.172807 
1 1 1    8    4   58 o  196.177   1.7879  1569.16   28.591  1598.12   41.835  1543.78   39.165  197.938   2.5928  194.551   2.4696 3.387085 3.580730 
1 1 1    8    4   59 o   91.582   1.4593  341.932   10.894  347.249   15.278  336.432   15.539   92.280   2.0310   90.830   2.0988 1.450218 2.920582 
1 1 1    8    4   60 o  169.569   1.6705  1172.33   23.091  1173.37   28.891  1170.49   38.418  169.627   2.0895  169.384   2.7825 0.2434692 3.479648 
1 1 1    8    4   61 o   65.067   1.5134  172.604   8.0269  175.389   12.144  170.443   10.697   65.538   2.2767   64.619   2.0333 0.9194107 3.052427 
1 1 1    8    4   62 o  186.657   1.5776  1420.49   24.003  1439.69   33.126  1399.26   34.829  187.887   2.1629  185.222   2.3068 2.664612 3.162226 
1 1 1    8    4   63 o  202.183   1.6433  1666.69   27.084  1700.98   37.371  1628.77   39.307  204.219   2.2449  199.827   2.4131 4.392319 3.295885 
1 1 1    8    4   64 o  153.692   1.5087  963.052   18.901  959.059   25.674  967.776   27.927  153.352   2.0539  154.040   2.2241 -0.6875153 3.027373 
1 1 1    8    4   65 o  117.335   1.5543  561.325   14.867  557.985   22.175  564.051   20.036  116.960   2.3259  117.603   2.0901 -0.6429749 3.127004 
1 1 1    8    4   66 o  129.062   1.3948  679.092   14.674  702.460   24.638  666.244   18.268  131.231   2.3032  127.824   1.7533 3.406281 2.894565 
1 1 1    8    4   67 f  122.209   1.8153  609.022   18.084  633.653   23.491  573.195   28.332  124.636   2.3122  118.511   2.9328 6.124939 3.734665 
1 1 1    8    4   68 o  263.419   2.6354  2831.33   56.589  2875.18   80.685  2788.88   79.388  265.301   3.7309  261.289   3.7273 4.011261 5.273797 
1 1 1    8    4   69 o  209.289   1.7907  1786.23   30.549  1736.95   39.414  1860.38   48.347  206.342   2.3433  213.507   2.7780 -7.165146 3.634297 
1 1 1    8    4   70 o  157.828   1.6651  1015.76   21.422  1012.14   27.817  1021.03   33.580  157.520   2.1664  158.181   2.6043 -0.6611481 3.387587 
1 1 1    8    4   71 o   79.567   2.0146  258.386   13.056  261.700   16.164  252.166   22.145   80.048   2.4802   78.496   3.4695 1.551865 4.264849 
1 1 1    8    4   72 o  218.204   1.8420  1941.81   32.763  1924.79   42.650  1966.30   51.173  217.198   2.4089  219.479   2.8603 -2.280991 3.739556 
1 1 1    8    4   73 o   38.930   3.0139   62.250   9.4899   67.792   12.125   53.487   15.246   40.561   3.7082   35.729   5.4035 4.831844 6.553498 
1 1 1    8    4   74 o  176.754   1.6757  1274.09   24.144  1301.13   31.778  1237.17   37.133  178.582   2.1830  174.100   2.6166 4.482849 3.407604 
1 1 1    8    4   75 o  211.343   1.7773  1821.76   30.619  1833.64   40.276  1805.49   47.129  211.977   2.3309  210.293   2.7493 1.683929 3.604449 
1 1 1    8    4   76 f   34.385   3.0851   48.685   8.5552   41.267   10.945   60.337   13.717   31.448   4.3889   38.122   4.5010 -6.674171 6.286601 
1 1 1    8    4   77 o   69.957   1.8606  199.782   10.601  197.575   13.557  203.255   17.006   69.532   2.3954   70.477   2.9668 -0.9444046 3.813117 
1 1 1    8    4   78 o   87.316   1.8650  311.034   13.274  327.622   18.826  294.631   18.720   89.539   2.5820   84.895   2.7086 4.643219 3.742077 
1 1 1    8    4   79 o  127.455   1.7027  662.652   17.691  650.546   24.212  676.517   25.911  126.238   2.3529  128.723   2.4695 -2.484772 3.410893 
1 1 1    8    4   80 o  144.174   1.7072  847.953   20.063  861.799   28.019  833.382   28.742  145.286   2.3659  142.860   2.4682 2.426315 3.418970 
1 1 1    8    4   81 o  139.483   1.7025  793.716   19.357  811.403   27.015  775.051   27.751  140.967   2.3510  137.759   2.4713 3.207169 3.410925 
1 1 1    8    4   82 o   88.008   1.6696  315.989   11.977  306.597   15.501  329.906   18.869   86.631   2.1968   89.827   2.5796 -3.195984 3.388255 
1 1 1    8    4   83 o   45.779   2.3853   85.825   8.8705   88.592   11.502   81.765   13.935   46.443   3.0551   44.500   3.8805 1.942818 4.938787 
1 1 1    8    4   84 o   91.509   1.6422  341.661   12.250  332.199   15.788  355.972   19.417   90.198   2.1473   93.300   2.5555 -3.101601 3.337866 
1 1 1    8    4   85 o   32.702   3.5879   44.342   9.4075   45.285   11.726   42.639   15.759   32.897   4.4899   31.534   6.3506 1.362955 7.777457 
1 1 1    8    4   86 o   91.844   1.8856  344.359   14.117  355.087   17.971  327.071   22.814   93.190   2.3676   89.326   3.1380 3.864037 3.931002 
1 1 1    8    4   87 o   80.849   2.0183  266.951   13.301  269.892   16.966  262.258   21.428   81.203   2.5663   79.936   3.2956 1.267853 4.176978 
1 1 1    8    4   88 o   55.603   2.3549  126.607   10.649  119.818   14.161  135.443   16.155   53.973   3.2335   57.359   3.4715 -3.385132 4.744175 
1 1 1    8    4   89 o   65.419   2.1589  175.092   11.497  197.825   15.818  149.631   16.740   69.453   2.7996   60.289   3.4202 9.164280 4.419952 
1 1 1    8    4   90 o   90.260   1.8051  332.739   13.281  325.103   16.085  349.099   23.544   89.171   2.2128   92.205   3.1370 -3.033905 3.838963 
1 1 1    8    4   91 o   40.738   2.7440   68.299   9.0591   58.362   11.004   89.203   15.959   37.496   3.6461   46.299   4.2770 -8.803001 5.620268 
1 1 1    8    4   92 o   40.184   2.6775   66.460   8.7202   70.142   10.571   58.617   15.427   41.208   3.1714   37.198   5.2320 4.009815 6.118133 
1 1 1    8    4   93 o   51.746   2.2175  109.783   9.3320  103.083   11.257  124.507   16.688   50.055   2.7696   54.823   3.7569 -4.767994 4.667468 
1 1 1    8    4   94 o   13.225   5.1743   4.5229   8.0952   9.9711   10.283  -4.3577   13.128   16.597   5.9658   13.390   5.9618 3.207751 8.434121 
1 1 1    8    4   95 o   88.736   1.9008  322.101   13.749  324.657   15.164  310.291   32.598   89.054   2.0889   86.194   4.6568 2.859756 5.103890 
1 1 1    8    4   96 o   34.292   3.2697   48.925   9.0293   56.213   9.8473   10.445   22.627   36.767   3.3214   20.940   8.4966 15.82693 9.122705 
1 1 1    8    4   97 o   48.050   2.5186   95.085   9.8303   95.628   10.698   92.138   24.914   48.142   2.7375   45.819   6.8830 2.323338 7.407390 
1 1 1    8    4   98 o   87.384   1.7130  312.443   12.202  316.183   14.862  304.709   21.372   87.825   2.0760   85.877   3.0579 1.947884 3.696055 
1 1 1    8    4   99 o   39.891   2.5895   65.761   8.3746   60.593   10.158   76.728   14.797   38.118   3.3017   42.608   4.3201 -4.490433 5.437345 
1 1 1    8    4  100 o   12.233   4.7403   4.2425   6.7428   5.2245   8.9129   2.9284   10.311   13.825   5.4233   13.694   5.6655 0.1318150 7.842802 
1 1 1    8    4  101 o   56.184   1.9004  129.601   8.6909  129.394   11.420  129.887   13.398   55.988   2.5086   55.961   2.9474 0.2708817E-01 3.870418 
1 1 1    8    4  102 o   33.033   2.9599   45.534   7.8858   60.676   11.368   31.489   10.948   37.935   3.7243   26.733   5.2113 11.20109 6.405294 
1 1 1    8    4  103 o   8.4362   3.9782  -7.4906   7.1133 -20.1276   9.9070   5.9567   10.220   8.3511   4.1126   14.647   5.7884 -6.296247 7.100630 
1 1 1    8    4  104 o   52.105   2.1767  111.953   9.2245  127.165   13.077   96.884   13.015   55.290   2.9117   48.082   3.3414 7.208286 4.432003 
1 1 1    8    4  105 o   18.308   4.6848   14.865   7.0195   10.007   9.2606   21.424   10.762   15.928   5.6688   21.709   5.9196 -5.780761 8.196145 
1 1 1    8    4  106 o   60.500   1.8916  150.596   9.3172  153.921   12.235  146.006   14.376   60.965   2.4670   59.154   2.9911 1.810902 3.877234 
1 1 1    8    4  107 o   59.674   1.9413  146.647   9.4304  151.255   12.345  140.190   14.613   60.397   2.5131   57.880   3.1086 2.516869 3.997364 
1 1 1    8    4  108 o   79.352   1.7146  258.615   11.091  271.977   14.723  241.086   16.863   81.134   2.2283   76.130   2.7218 5.004387 3.517554 
1 1 1    8    4  109 o   37.753   2.8880   59.761   8.8203   53.041   12.523   66.377   12.426   34.861   4.5124   39.350   3.9261 -4.488857 5.981371 
1 1 1    8    4  110 o   35.622   2.7990   53.221   8.0623   54.082   10.597   52.037   12.423   35.539   3.7127   34.457   4.5329 1.081383 5.859282 
1 1 1    8    4  111 o   31.836   3.3242   43.185   8.4996   50.893   11.930   35.240   12.113   34.064   4.3990   27.676   5.5623 6.388407 7.091563 
1 1 1    8    4  112 o   17.715   5.2336   14.363   8.0810   5.3686   11.241   23.982   11.625   14.498   5.9485   22.408   6.1694 -7.910148 8.570046 
1 1 1    8    4  113 f   33.477   3.4948   48.214   9.3965   42.744   12.611   55.042   14.089   30.528   5.2574   34.813   5.1175 -4.285503 7.336770 
1 1 1    8    4  114 o   9.5642   4.3605  -3.5693   7.5158   5.8376   10.028 -15.6253   11.353   14.027   5.6690   9.6834   4.6869 4.343308 7.355634 
1 1 1    8    4  115 o   37.430   3.1028   59.867   9.3819   62.120   11.129   54.332   17.442   37.799   3.6575   33.045   6.7048 4.754677 7.637526 
1 1 1    8    4  116 o   47.282   2.3937   93.778   9.1955   88.202   11.924  101.959   14.444   45.314   3.2498   48.384   3.6901 -3.070118 4.917129 
1 1 1    8    4  117 o   17.560   5.1730   14.695   7.9043   14.340   10.194   15.229   12.516   17.347   5.9635   17.898   6.5603 -0.5518379 8.865767 
1 1 1    8    4  118 o   20.034   4.9802   19.196   8.0979   13.089   10.436   28.436   12.837   16.695   6.0090   23.385   6.5005 -6.690296 8.852345 
1 1 1    8    4  119 o   9.6435   4.5139  -6.2896   8.8666 -17.8817   11.064   14.517   14.823   9.0326   4.4276   17.646   6.9719 -8.613134 8.258968 
1 1 1    8    4  120 o   13.724   5.4687   6.8580   9.1944   4.4079   10.237   17.082   20.912   13.223   5.5703   18.893   7.9602 -5.669754 9.715640 
1 1 1    8    4  121 o   37.808   3.3307   62.554   10.160   60.095   11.273   73.197   23.453   36.657   3.8290   35.262   8.2986 1.395840 9.139385 
1 1 1    8    4  122 o   16.911   5.9664   14.166   10.240   3.3036   13.154   30.872   16.313   13.878   6.0820   22.992   7.5407 -9.114365 9.687716 
1 1 1    8    4  123 o   25.142   5.3452   31.252   10.617   44.974   13.734   10.871   16.737   29.792   5.8642   16.583   7.0601 13.20837 9.177936 
1 1 1    8    4  124 o   12.796   5.4988   3.3964   10.326 -11.4503   13.120   27.567   16.740   10.893   5.2120   21.492   7.6245 -10.59825 9.235645 
1 1 1    8    4  125 o   23.319   6.2463   29.040   12.111   25.408   13.727   41.802   25.731   21.184   6.9154   23.825   9.2523 -2.640232 11.55111 
1 1 1    8    4  126 o   25.477   5.9404   33.797   12.108   24.995   13.507   69.834   27.328   20.980   6.8604   30.761   9.7308 -9.781473 11.90598 
1 1 1    8    4  127 o   15.011   6.0631   9.5568   11.463   17.762   12.918 -20.8245   24.858   18.104   6.6599   13.718   6.7056 4.386135 9.450905 
1 1 1    8    4  128 o   16.582   5.9873   14.068   10.371   13.475   13.104   15.063   16.967   16.512   6.5453   17.323   7.2257 -0.8110352 9.749449 
1 1 1    8    4  129 o   32.630   4.2898   49.792   11.134   52.886   14.443   45.260   17.480   32.143   5.7220   27.330   7.5811 4.812302 9.498133 
1 1 1    8    4  130 o   14.092   5.8716   7.2046   11.185  -0.7250   15.296   16.318   16.398   13.415   6.1553   17.567   7.1934 -4.152595 9.467449 
1 1 1    8    5 -129 o   23.736   5.5908   29.027   10.638   38.701   13.476   13.031   17.329   26.802   6.2789   16.810   7.1710 9.991871 9.531438 
1 1 1    8    5 -128 o   20.769   5.9472   23.127   10.582   27.150   13.461   16.619   17.120   21.659   6.8266   17.649   7.3009 4.010290 9.995312 
1 1 1    8    5 -127 o   21.655   5.7874   24.755   10.411   11.242   12.979   49.149   17.438   15.710   6.4123   28.831   7.3873 -13.12078 9.782091 
1 1 1    8    5 -126 o   17.421   5.9684   15.931   10.208   15.912   11.225   16.024   24.553   17.354   6.2336   18.136   8.1089 -0.7817612 10.22805 
1 1 1    8    5 -125 o   9.3163   4.4616  -9.6942   9.6629  -7.8072   10.692 -18.1049   22.573   10.227   4.8392   13.364   6.5009 -3.136378 8.104326 
1 1 1    8    5 -124 o   9.5769   4.5532  -8.4101   9.6883 -11.5191   10.705   5.6619   22.775   9.6140   4.6279   16.419   7.5252 -6.804589 8.834348 
1 1 1    8    5 -123 o   12.101   5.1788   2.9131   9.0905  -2.3790   10.666   16.962   17.379   11.383   5.1915   18.089   7.4059 -6.705935 9.044324 
1 1 1    8    5 -122 o   10.429   4.8115  -4.0498   9.5247  -4.1011   10.412  -3.7871   23.580   10.893   5.0273   15.416   7.2614 -4.522976 8.831878 
1 1 1    8    5 -121 o   40.962   3.2101   73.323   10.633   71.456   11.563   83.553   27.065   40.118   3.5731   35.827   9.2155 4.291111 9.883967 
1 1 1    8    5 -120 o   11.546   5.1261  -0.0569   9.6342   7.9125   11.915 -15.1041   16.373   14.802   6.1039   11.850   5.7091 2.951633 8.357671 
1 1 1    8    5 -119 o   12.789   5.2611   4.8459   8.8239   5.7214   10.444   2.6617   16.496   13.695   5.6871   14.846   6.6416 -1.151166 8.743810 
1 1 1    8    5 -118 o   22.330   5.1136   24.159   9.1071   22.948   10.912   26.939   16.531   21.127   6.0361   21.722   7.5873 -0.5950356 9.695400 
1 1 1    8    5 -117 o   19.220   5.4570   18.233   8.9471   16.952   10.722   21.170   16.235   18.356   6.1172   19.880   7.4373 -1.523848 9.629838 
1 1 1    8    5 -116 o   38.665   3.4335   65.221   10.709   69.244   11.840   47.131   25.107   39.636   3.7078   26.885   9.3532 12.75110 10.06131 
1 1 1    8    5 -115 o   18.402   5.4668   16.350   8.7974   16.629   10.449   15.670   16.306   18.437   6.0343   18.501   7.3115 -0.6414223E-01 9.480030 
1 1 1    8    5 -114 o   13.024   5.2509   5.0620   8.5802   10.985   10.376  -7.7492   15.260   16.008   5.9541   12.846   5.9826 3.162203 8.440551 
1 1 1    8    5 -113 o   23.771   4.6492   25.855   8.6858   21.605   10.387   35.737   15.839   21.114   5.8390   26.267   7.1892 -5.153448 9.261682 
1 1 1    8    5 -112 o   40.922   2.5679   70.335   8.5229   70.819   11.497   69.745   12.699   40.550   3.5128   39.961   3.9501 0.5889893 5.286114 
1 1 1    8    5 -111 o   24.771   3.9704   27.020   7.7465   28.277   10.645   25.605   11.294   24.614   5.4496   23.149   5.9523 1.464947 8.070216 
1 1 1    8    5 -110 o   18.092   4.9542   14.964   7.5193   17.736   10.123   11.552   11.231   19.479   5.8823   16.780   6.2033 2.699257 8.548868 
1 1 1    8    5 -109 o   22.602   4.8466   23.105   8.6614   23.183   13.455   23.050   11.319   21.997   6.8087   22.105   6.0883 -0.1079922 9.133752 
1 1 1    8    5 -108 o   24.379   5.0417   26.835   9.6881   5.8389   18.405   34.882   11.394   17.393   7.4042   27.793   5.2211 -10.39957 9.059907 
1 1 1    8    5 -107 o   11.992   5.2879  -1.4136   10.085   3.7822   17.023  -4.2231   12.518   16.516   7.0779   12.651   5.7117 3.865006 9.095101 
1 1 1    8    5 -106 o   51.044   2.4459  108.098   10.147  108.097   16.377  108.098   12.928   50.298   4.0280   50.757   3.1400 -0.4588585 5.107334 
1 1 1    8    5 -105 f   52.721   2.0419  114.634   8.7586  113.115   11.836  116.471   13.021   52.103   2.7971   52.769   3.0401 -0.6658745 4.131089 
1 1 1    8    5 -104 o   43.002   2.3206   76.556   8.1044   75.426   11.043   77.875   11.932   42.381   3.2205   42.982   3.4340 -0.6008606 4.707870 
1 1 1    8    5 -103 o   22.528   4.7271   22.451   8.4034   55.920   13.739   2.4468   10.622   35.837   4.8258   13.549   5.6888 22.28794 7.459966 
1 1 1    8    5 -102 o   51.751   2.0539  110.311   8.6474  106.725   11.751  114.546   12.771   50.655   2.8574   52.430   3.0008 -1.775078 4.143629 
1 1 1    8    5 -101 o   12.944   4.8847   5.4920   7.0361   12.921   9.8455  -2.2625   10.059   17.524   5.8623   11.878   5.2575 5.645874 7.874459 
1 1 1    8    5 -100 o   71.041   1.7353  206.848   10.049  205.637   13.740  208.242   14.735   70.617   2.3903   71.007   2.5499 -0.3896179 3.495087 
1 1 1    8    5  -99 o   50.524   2.0590  104.980   8.4623   95.974   11.454  115.803   12.556   48.080   2.9366   52.833   2.9270 -4.752808 4.146164 
1 1 1    8    5  -98 o   61.907   1.8343  157.187   9.2462  157.843   12.692  156.445   13.498   61.863   2.5221   61.536   2.6974 0.3271637 3.692853 
1 1 1    8    5  -97 o   28.926   3.1374   34.989   7.2793   27.394   10.131   43.095   10.466   25.018   5.1398   31.870   4.1253 -6.852200 6.590597 
1 1 1    8    5  -96 o   16.505   4.8739   11.668   7.0097   10.033   9.6994   13.455   10.142   16.305   5.8017   18.030   5.9474 -1.725107 8.308466 
1 1 1    8    5  -95 o   46.860   2.1841   90.222   8.3199   97.828   11.359   81.420   12.220   48.659   2.8767   44.248   3.4143 4.410511 4.464671 
1 1 1    8    5  -94 o  112.935   1.5477  521.261   14.248  530.327   19.309  510.424   21.110  113.787   2.0818  111.564   2.3213 2.222687 3.118009 
1 1 1    8    5  -93 o   32.126   3.4690   43.065   8.9404   41.251   12.302   45.095   13.015   31.043   5.0340   32.473   5.0835 -1.430498 7.154246 
1 1 1    8    5  -92 o   79.536   1.9693  258.782   12.768  251.499   16.935  268.374   19.436   78.247   2.6589   80.758   2.9574 -2.511444 3.976969 
1 1 1    8    5  -91 o   69.235   2.0769  196.273   11.708  190.085   15.700  204.025   17.573   67.997   2.8387   70.400   3.0696 -2.402611 4.181001 
1 1 1    8    5  -90 o   44.858   2.7463   82.801   9.9938   91.808   13.203   70.718   15.293   47.116   3.4619   41.058   4.6511 6.057800 5.798050 
1 1 1    8    5  -89 o   14.148   5.4901   5.3957   9.0543   3.6925   11.694   7.9447   14.306   14.891   6.0834   17.485   6.8673 -2.593988 9.174349 
1 1 1    8    5  -88 o   51.063   2.6897  107.075   11.156  111.225   14.675  101.392   17.171   51.916   3.4879   49.392   4.3079 2.523132 5.542905 
1 1 1    8    5  -87 o   99.834   2.0185  407.234   16.426  370.132   21.286  461.862   25.829   95.037   2.7506  106.121   2.9888 -11.08363 4.061816 
1 1 1    8    5  -86 o   16.365   5.7016   9.9838   9.3317   5.8443   13.797   13.474   12.669   16.654   6.6779   18.976   6.6412 -2.321886 9.418108 
1 1 1    8    5  -85 o   76.453   1.8229  238.635   11.360  218.883   14.933  265.772   17.503   73.122   2.5090   80.561   2.6691 -7.438438 3.663162 
1 1 1    8    5  -84 o  206.408   1.9049  1739.44   32.051  1793.26   46.126  1689.19   44.568  209.394   2.7024  203.231   2.6903 6.163132 3.813188 
1 1 1    8    5  -83 o  158.663   1.6251  1027.23   21.018  1056.30   28.161  990.679   31.578  160.823   2.1482  155.693   2.4882 5.129822 3.287213 
1 1 1    8    5  -82 o   93.332   1.6700  355.439   12.705  372.203   16.922  333.783   19.234   95.469   2.1745   90.331   2.6149 5.138145 3.400877 
1 1 1    8    5  -81 o   41.622   2.6499   71.085   8.9441   59.020   11.646   88.436   13.966   37.755   3.8372   46.309   3.7313 -8.554031 5.352254 
1 1 1    8    5  -80 o   37.749   2.8937   58.595   8.8364   55.035   11.430   63.884   13.931   36.440   3.9090   39.206   4.4370 -2.765961 5.913290 
1 1 1    8    5  -79 o   20.483   5.0640   17.932   8.4069   30.743   11.095   0.6574   12.883   26.885   5.2510   14.703   6.2242 12.18139 8.143304 
1 1 1    8    5  -78 o   26.439   4.1217   29.319   8.5933   25.567   11.130   34.856   13.521   24.435   5.6940   28.554   6.0000 -4.119366 8.271733 
1 1 1    8    5  -77 f   88.595   1.6973  320.190   12.258  319.780   15.991  320.774   19.087   88.484   2.2188   88.581   2.6464 -0.9779358E-01 3.453449 
1 1 1    8    5  -76 o   55.009   2.3344  123.745   10.444  120.920   14.172  127.102   15.451   54.294   3.2165   55.647   3.4229 -1.352322 4.697012 
1 1 1    8    5  -75 o   74.655   1.9665  227.550   11.957  225.573   16.391  229.799   17.481   74.272   2.7119   74.951   2.8666 -0.6790466 3.946052 
1 1 1    8    5  -74 o  110.239   1.8730  495.757   16.831  491.902   21.631  501.671   26.794  109.777   2.4172  110.780   2.9698 -1.002975 3.829238 
1 1 1    8    5  -73 o   99.288   1.7397  402.086   14.080  411.235   17.481  385.190   23.757  100.393   2.1362   97.064   3.0062 3.329437 3.687908 
1 1 1    8    5  -72 o   85.066   1.8279  295.154   12.675  289.084   15.487  307.464   22.057   84.140   2.2601   86.704   3.1259 -2.563362 3.857376 
1 1 1    8    5  -71 o   27.231   4.2633   31.059   9.1529   35.572   11.273   22.330   15.678   29.072   4.9332   23.412   7.3658 5.660782 8.865167 
1 1 1    8    5  -70 o  172.566   1.8229  1214.50   25.642  1168.02   30.808  1319.31   46.262  169.203   2.2337  179.740   3.1575 -10.53638 3.867672 
1 1 1    8    5  -69 o   10.485   4.9171 -11.0076   10.607 -11.5068   13.677 -10.2543   16.801   12.383   5.7314   14.408   6.5497 -2.025026 8.703305 
1 1 1    8    5  -68 o  116.495   2.0956  553.561   19.900  592.840   26.619  503.796   29.962  120.524   2.7094  111.019   3.3146 9.505409 4.281077 
1 1 1    8    5  -67 o  108.520   2.2297  480.413   19.724  486.535   27.867  474.268   27.921  109.117   3.1363  107.727   3.1831 1.389702 4.468624 
1 1 1    8    5  -66 o  169.737   2.2059  1175.22   30.521  1215.23   43.871  1137.70   42.489  172.530   3.1194  166.935   3.1224 5.595047 4.413677 
1 1 1    8    5  -65 o  215.415   2.3859  1893.06   41.894  1870.33   58.809  1916.48   59.696  214.018   3.3710  216.641   3.3804 -2.623581 4.773962 
1 1 1    8    5  -64 o  126.062   2.3589  648.273   24.240  652.908   29.802  639.212   41.667  126.484   2.8905  125.001   4.0947 1.482994 5.012181 
1 1 1    8    5  -63 o   95.762   1.5516  373.894   12.111  374.892   16.391  372.694   17.974   95.875   2.0974   95.587   2.3068 0.2883072 3.117753 
1 1 1    8    5  -62 o  302.978   2.1746  3743.95   53.707  3743.58   71.421  3744.43   81.474  302.882   2.8928  302.859   3.3002 0.2212524E-01 4.388598 
1 1 1    8    5  -61 o   99.383   1.5322  402.693   12.412  396.483   16.707  410.342   18.543   98.600   2.0787  100.302   2.2680 -1.702484 3.076471 
1 1 1    8    5  -60 o  241.670   1.8694  2381.56   36.826  2396.37   49.228  2362.74   55.493  242.374   2.4917  240.638   2.8291 1.736847 3.769876 
1 1 1    8    5  -59 o   45.962   2.1510   86.342   8.0364   95.876   11.125   75.937   11.622   48.392   2.8326   43.003   3.3417 5.389603 4.380703 
1 1 1    8    5  -58 o   68.671   1.7046  192.274   9.5418  185.827   12.877  200.125   14.209   67.458   2.3454   70.000   2.4942 -2.541634 3.423732 
1 1 1    8    5  -57 o  176.352   1.7222  1268.04   24.757  1271.75   30.781  1261.24   41.664  176.592   2.1383  175.817   2.9071 0.7748718 3.608839 
1 1 1    8    5  -56 o  260.113   2.1053  2759.12   44.639  2716.11   54.486  2846.93   77.852  258.041   2.5904  264.078   3.6166 -6.036560 4.448585 
1 1 1    8    5  -55 o  339.783   2.3444  4708.69   64.933  4788.62   87.857  4612.46   96.395  342.563   3.1463  336.153   3.5179 6.410583 4.719599 
1 1 1    8    5  -54 o  123.117   1.5224  617.965   15.279  624.916   20.229  608.734   23.312  123.796   2.0046  122.172   2.3409 1.623886 3.081915 
1 1 1    8    5  -53 o  269.698   1.8531  2965.72   40.740  2988.00   58.625  2944.91   56.656  270.653   2.6573  268.700   2.5867 1.952850 3.708356 
1 1 1    8    5  -52 o  140.946   1.3720  809.840   15.763  811.771   23.282  808.205   21.419  141.096   2.0242  140.791   1.8663 0.3054504 2.753296 
1 1 1    8    5  -51 o  145.012   1.3780  857.245   16.288  883.436   24.280  835.812   21.964  147.193   2.0236  143.175   1.8820 4.018082 2.763482 
1 1 1    8    5  -50 o  133.564   1.2670  727.206   13.794  722.441   18.927  732.606   20.146  133.115   1.7442  134.046   1.8437 -0.9307404 2.538047 
1 1 1    8    5  -49 o  311.480   1.9308  3955.76   49.024  3977.92   66.417  3929.23   72.665  312.302   2.6090  310.362   2.8722 1.940094 3.880256 
1 1 1    8    5  -48 o  544.294   3.5029 12089.16  155.415 12257.82  240.388 11968.04  203.716  547.628   5.3851  541.320   4.6167 6.307922 7.093169 
1 1 1    8    5  -47 o  132.152   1.2720  711.907   13.702  710.753   18.807  713.212   20.004  132.036   1.7474  132.262   1.8554 -0.2257080 2.548754 
1 1 1    8    5  -46 o  453.211   2.7876  8377.40  102.985  8540.92  148.630  8226.40  142.829  457.445   3.9860  448.957   3.9028 8.488525 5.578488 
1 1 1    8    5  -45 o   92.824   1.3657  351.232   10.334  348.797   15.622  353.126   13.780   92.492   2.0720   93.068   1.8164 -0.5761490 2.755409 
1 1 1    8    5  -44 o  209.701   1.5845  1792.65   27.085  1799.52   38.932  1786.20   37.705  210.080   2.2734  209.303   2.2100 0.7763672 3.170576 
1 1 1    8    5  -43 o  120.323   1.4067  590.156   13.797  617.938   19.295  561.089   19.737  123.114   1.9227  117.312   2.0640 5.802292 2.820749 
1 1 1    8    5  -42 o  292.403   2.0855  3485.83   49.709  3490.36   66.317  3480.01   75.098  292.557   2.7809  292.099   3.1540 0.4576111 4.204867 
1 1 1    8    5  -41 o  194.607   1.6217  1543.83   25.725  1555.14   34.746  1530.11   38.271  195.304   2.1825  193.718   2.4236 1.585297 3.261486 
1 1 1    8    5  -40 o  185.115   1.5853  1396.88   23.922  1380.22   32.011  1417.95   36.000  183.996   2.1343  186.487   2.3682 -2.491394 3.188048 
1 1 1    8    5  -39 o  264.931   1.9464  2861.34   42.034  2774.88   54.960  2983.19   65.244  260.874   2.5845  270.472   2.9592 -9.597900 3.928990 
1 1 1    8    5  -38 o   52.597   1.7639  112.899   7.5517  126.185   12.355  104.976   9.5416   55.563   2.7363   50.690   2.3153 4.872589 3.584409 
1 1 1    8    5  -37 o  624.971   3.9799 15932.92  202.753 15855.12  308.772 15991.89  268.832  623.090   6.0793  625.926   5.2689 -2.835999 8.044809 
1 1 1    8    5  -36 o  124.331   1.5305  630.107   15.511  737.682   29.461  588.846   18.245  134.509   2.6869  120.188   1.8623 14.32162 3.269203 
1 1 1    8    5  -35 o  461.514   3.0182  8684.92  113.547  8755.55  175.007  8633.57  149.217  463.250   4.6345  460.073   3.9788 3.176056 6.108183 
1 1 1    8    5  -34 o   31.388   2.4884   40.418   6.3148   45.216   9.6659   36.845   8.3408   33.098   3.6428   29.855   3.4933 3.243155 5.047050 
1 1 1    8    5  -33 o  293.104   1.9559  3502.04   46.732  3487.00   66.310  3516.87   65.870  292.449   2.7816  293.700   2.7513 -1.250977 3.912430 
1 1 1    8    5  -32 o  439.435   2.7076  7872.74   96.988  7858.07  137.315  7887.35  137.008  438.960   3.8376  439.778   3.8219 -0.8180847 5.416065 
1 1 1    8    5  -31 o  240.472   1.8354  2357.18   35.978  2368.89   48.082  2342.28   54.234  241.057   2.4470  239.691   2.7758 1.365891 3.700335 
1 1 1    8    5  -30 o  213.205   1.7202  1852.89   29.897  1873.96   40.005  1826.24   44.994  214.405   2.2890  211.652   2.6079 2.753311 3.469968 
1 1 1    8    5  -29 o  583.820   4.0418 13899.99  192.350 13874.13  235.223 13952.19  334.177  583.193   4.9480  584.578   7.0129 -1.384277 8.582755 
1 1 1    8    5  -28 f   89.049   1.9565  323.236   14.202  330.896   18.794  313.040   21.684   90.057   2.5628   87.573   3.0422 2.484756 3.977793 
1 1 1    8    5  -27 o  573.484   3.9761 13411.26  185.872 13294.10  225.988 13656.24  326.787  570.903   4.8561  578.399   6.9311 -7.496704 8.462953 
1 1 1    8    5  -26 o  134.631   1.4915  738.797   16.368  774.015   22.488  699.119   23.869  137.799   2.0020  130.960   2.2360 6.838486 3.001271 
1 1 1    8    5  -25 o  182.478   1.6005  1357.26   23.807  1366.24   31.997  1346.11   35.632  183.076   2.1441  181.719   2.4055 1.356552 3.222338 
1 1 1    8    5  -24 o   46.602   2.1274   88.712   8.0602   98.105   11.362   79.198   11.436   48.973   2.8587   43.958   3.2137 5.015198 4.301158 
1 1 1    8    5  -23 o  290.729   2.0845  3445.36   49.400  3490.39   66.261  3389.01   74.121  292.610   2.7780  288.320   3.1538 4.289612 4.202801 
1 1 1    8    5  -22 o  422.739   2.6202  7284.98   90.290  7402.20  129.561  7174.29  125.896  426.088   3.7302  419.479   3.6818 6.608948 5.241246 
1 1 1    8    5  -21 o  145.970   1.3939  868.470   16.585  910.133   24.485  833.149   22.545  149.426   2.0102  142.968   1.9345 6.458710 2.789875 
1 1 1    8    5  -20 o  302.218   2.0033  3722.96   49.351  3765.89   70.788  3682.37   68.838  303.941   2.8571  300.552   2.8098 3.388611 4.007270 
1 1 1    8    5  -19 o  525.989   3.1774 11278.73  136.233 11206.39  191.956 11352.14  193.378  524.238   4.4920  527.636   4.4961 -3.397705 6.355522 
1 1 1    8    5  -18 o  104.963   1.3798  449.056   11.806  483.274   17.530  420.655   15.970  108.887   1.9750  101.588   1.9286 7.298820 2.760437 
1 1 1    8    5  -17 o  112.335   1.4313  514.348   13.106  502.225   19.963  523.534   17.376  111.000   2.2063  113.332   1.8809 -2.332069 2.899186 
1 1 1    8    5  -16 o  219.600   2.0376  1965.67   36.475  2009.31   58.808  1938.38   46.499  222.009   3.2496  218.064   2.6159 3.945007 4.171684 
1 1 1    8    5  -15 o  237.383   2.1354  2296.92   41.320  2184.56   63.513  2379.38   54.409  231.487   3.3659  241.599   2.7627 -10.11119 4.354548 
1 1 1    8    5  -14 o   75.066   1.8436  229.679   11.281  226.046   18.306  231.903   14.324   74.404   3.0247   75.391   2.3336 -0.9867096 3.820254 
1 1 1    8    5  -13 o  170.442   2.3395  1184.16   32.505   0.0000   0.0000  1184.16   32.505  ?   ?   170.442   2.3395 0.000000 2.339542 
1 1 1    8    5  -12 o  507.119   3.5511 10484.18  146.796 11229.48  269.034 10168.22  175.170  524.694   6.2902  499.389   4.3031 25.30438 7.621258 
1 1 1    8    5  -11 o  403.774   2.9105  6645.90   95.795  6804.00  169.079  6571.17  116.253  408.479   5.0779  401.480   3.5523 6.998230 6.197076 
1 1 1    8    5  -10 o  613.144   3.9138 15327.07  195.615 14772.95  289.739 15791.22  265.173  601.844   5.9059  622.286   5.2276 -20.44177 7.887175 
1 1 1    8    5   -9 o  721.757   4.5611 21240.32  268.347 21131.79  408.415 21322.77  355.969  719.721   6.9615  723.049   6.0396 -3.327820 9.216236 
1 1 1    8    5   -8 o  480.371   3.3864  9407.08  132.603  9749.88  236.663  9250.21  160.093  488.935   5.9380  476.324   4.1232 12.61111 7.229175 
1 1 1    8    5   -7 o  322.735   2.4337  4245.67   64.024  4387.21  113.940  4180.36   77.399  328.033   4.2611  320.234   2.9650 7.798279 5.191212 
1 1 1    8    5   -6 o  105.225   1.6553  451.299   14.198  442.606   24.702  455.587   17.350  104.160   2.9123  105.722   2.0132 -1.562050 3.540365 
1 1 1    8    5   -5 o  534.969   4.0875 11668.02  178.247 11490.75  278.563 11790.93  231.950  530.767   6.4385  537.722   5.2918 -6.955078 8.334064 
1 1 1    8    5   -4 o  307.286   2.5706  3848.98   64.389  3772.13  100.093  3903.23   84.099  304.176   4.0369  309.431   3.3342 -5.255157 5.235758 
1 1 1    8    5   -3 o  493.179   3.2073  9915.09  128.938  9871.16  196.188  9948.49  171.072  492.023   4.8916  493.974   4.2485 -1.950317 6.479032 
1 1 1    8    5   -2 o  604.048   3.8583 14875.36  189.980 14800.27  288.956 14932.54  252.137  602.413   5.8844  605.146   5.1114 -2.732971 7.794387 
1 1 1    8    5   -1 o  462.982   3.2802  8738.17  123.795  8604.89  172.892  8878.39  177.337  459.394   4.6169  466.636   4.6621 -7.241974 6.561365 
1 1 1    8    5    0 o  523.102   3.6565 11155.40  155.915 11072.10  219.194 11240.72  221.823  521.082   5.1604  525.034   5.1830 -3.951721 7.313938 
1 1 1    8    5    1 o  465.829   3.2986  8845.98  125.253  8699.70  174.860  9000.13  179.500  461.917   4.6440  469.823   4.6870 -7.906281 6.598058 
1 1 1    8    5    2 o  418.682   3.0088  7145.72  102.688  7174.08  145.820  7117.81  144.633  419.477   4.2646  417.829   4.2465 1.647827 6.018247 
1 1 1    8    5    3 o  403.216   2.6965  6627.36   88.630  6647.73  135.842  6612.26  116.952  403.799   4.1270  402.737   3.5625 1.062775 5.451898 
1 1 1    8    5    4 o  358.491   2.4500  5238.53   71.594  5340.99  110.979  5165.50   93.699  361.952   3.7614  355.968   3.2291 5.983856 4.957384 
1 1 1    8    5    5 o  567.648   3.9356 13136.81  182.106 13362.38  320.059 13028.82  221.446  572.334   6.8603  565.271   4.8059 7.062988 8.376192 
1 1 1    8    5    6 o  254.113   2.0709  2632.05   42.896  2481.94   71.770  2715.49   53.505  246.741   3.5683  258.104   2.5431 -11.36319 4.381835 
1 1 1    8    5    7 o  201.731   1.9965  1658.77   32.830  1627.22   72.781  1666.83   36.785  199.774   4.4694  202.219   2.2316 -2.445114 4.995509 
1 1 1    8    5    8 o  270.537   2.3518  2983.35   51.864  3040.90  117.934  2969.55   57.748  273.075   5.2981  269.907   2.6248 3.168304 5.912635 
1 1 1    8    5    9 o  106.268   1.7914  460.300   15.518  449.900   35.849  462.698   17.214  104.963   4.1984  106.544   1.9821 -1.581436 4.642795 
1 1 1    8    5   10 o  173.369   1.8821  1225.13   26.599  1176.64   41.872  1257.93   34.440  169.895   3.0235  175.671   2.4051 -5.776108 3.863414 
1 1 1    8    5   11 o  160.732   1.6595  1053.01   21.743  1069.67   38.180  1045.02   26.451  161.989   2.8914  160.118   2.0266 1.870834 3.530935 
1 1 1    8    5   12 o  198.245   1.9672  1601.93   31.789  1650.19   51.298  1571.84   40.503  201.197   3.1278  196.369   2.5304 4.828033 4.023195 
1 1 1    8    5   13 o  387.217   2.8072  6112.01   88.606  6030.21  124.169  6196.88  126.479  384.587   3.9608  389.865   3.9799 -5.278168 5.614914 
1 1 1    8    5   14 o  686.621   4.6940 19223.68  262.720 19374.61  374.254 19077.05  368.887  689.153   6.6622  683.844   6.6176 5.308411 9.390263 
1 1 1    8    5   15 o  445.942   3.1642  8106.88  115.022  8226.59  164.859  7993.33  160.557  449.174   4.5026  442.763   4.4486 6.411560 6.329552 
1 1 1    8    5   16 o  119.374   1.5860  580.834   15.433  559.187   21.962  601.953   21.692  117.125   2.3003  121.522   2.1898 -4.396988 3.175903 
1 1 1    8    5   17 o  247.836   2.0146  2503.65   40.699  2451.15   57.003  2558.24   58.128  245.213   2.8518  250.512   2.8466 -5.299149 4.029349 
1 1 1    8    5   18 o  503.149   3.2605 10320.54  133.725 10533.29  207.890 10170.38  174.653  508.225   5.0181  499.431   4.2901 8.794006 6.601993 
1 1 1    8    5   19 o  197.429   1.7785  1588.76   28.623  1582.39   40.614  1595.05   40.345  197.025   2.5288  197.812   2.5021 -0.7868958 3.557405 
1 1 1    8    5   20 o   73.971   1.7369  223.025   10.473  238.898   15.249  208.854   14.409   76.516   2.4481   71.536   2.4747 4.979134 3.481011 
1 1 1    8    5   21 o  171.074   1.6710  1192.90   23.302  1176.37   32.874  1209.58   33.036  169.878   2.3740  172.260   2.3527 -2.381943 3.342294 
1 1 1    8    5   22 o   50.815   2.1619  105.444   8.9345  102.520   12.889  108.148   12.396   50.046   3.1758   51.420   2.9701 -1.373810 4.348221 
1 1 1    8    5   23 o  602.823   4.1581 14817.89  204.326 14873.33  290.146 14763.34  287.790  603.809   5.8950  601.575   5.8688 2.234192 8.318262 
1 1 1    8    5   24 o  460.810   3.2569  8657.22  122.339  8732.79  174.349  8583.92  171.709  462.747   4.6221  458.788   4.5914 3.959381 6.514969 
1 1 1    8    5   25 o  271.015   2.1370  2993.99   47.209  2972.38   66.548  3015.88   66.981  270.017   3.0235  271.986   3.0211 -1.968658 4.274206 
1 1 1    8    5   26 o  382.873   2.7794  5976.11   86.743  5982.80  122.862  5969.47  122.486  383.042   3.9349  382.615   3.9272 0.4267578 5.559393 
1 1 1    8    5   27 o  317.367   2.6268  4106.07   67.956  4232.95  110.239  4028.30   86.304  322.178   4.1976  314.325   3.3683 7.853271 5.381975 
1 1 1    8    5   28 f  471.734   3.3258  9073.23  127.889  9029.88  180.281  9117.14  181.449  470.518   4.7004  472.785   4.7082 -2.267212 6.652896 
1 1 1    8    5   29 o  268.484   2.1254  2938.41   46.515  2951.30   66.150  2925.79   65.421  269.051   3.0162  267.886   2.9959 1.164581 4.251242 
1 1 1    8    5   30 o  645.266   4.8558 16984.84  255.409 16977.11  329.433 16996.49  404.388  644.933   6.2664  645.065   7.6906 -0.1320801 9.920297 
1 1 1    8    5   31 o   45.804   2.6930   85.830   10.011   82.735   12.950   90.427   15.780   44.902   3.5674   46.902   4.1710 -1.999805 5.488476 
1 1 1    8    5   32 o  382.586   3.0483  5967.99   95.066  5934.74  122.053  6019.27  151.579  381.471   3.9251  384.115   4.8411 -2.644226 6.232379 
1 1 1    8    5   33 o  320.826   2.9724  4196.72   77.735  4283.50  111.535  4114.76  108.400  324.063   4.2223  317.618   4.1868 6.444977 5.946200 
1 1 1    8    5   34 o  137.444   1.7256  770.051   19.333  758.359   31.086  777.426   24.689  136.382   2.7962  138.095   2.1933 -1.713226 3.553789 
1 1 1    8    5   35 o   95.875   1.9074  374.707   14.906  415.345   31.695  363.166   16.891  100.839   3.8630   94.384   2.1954 6.454727 4.443317 
1 1 1    8    5   36 o  103.725   2.1361  438.604   18.061  442.014   32.421  437.070   21.749  104.030   3.8297  103.538   2.5769 0.4924011 4.615988 
1 1 1    8    5   37 o   76.877   2.2516  241.154   14.095  241.140   25.715  241.160   16.852   76.773   4.1242   76.860   2.6939 -0.8655548E-01 4.926111 
1 1 1    8    5   38 o  464.961   4.6402  8822.08  175.868  9133.89  314.012  8679.58  212.286  472.502   8.1528  461.054   5.6485 11.44818 9.918331 
1 1 1    8    5   39 o  288.978   2.7353  3405.11   64.433  3386.86   91.541  3423.04   90.708  288.135   3.8975  289.674   3.8415 -1.538391 5.472427 
1 1 1    8    5   40 o  150.033   2.2207  917.737   27.159  889.983   47.680  931.066   33.043  147.643   3.9654  151.108   2.6826 -3.464767 4.787507 
1 1 1    8    5   41 o  212.495   1.8647  1840.79   32.300  1897.94   47.476  1791.54   44.072  215.740   2.6996  209.610   2.5794 6.129745 3.733798 
1 1 1    8    5   42 o  225.895   1.9286  2080.35   35.513  2168.88   52.484  2005.59   48.232  230.617   2.7919  221.771   2.6680 8.845718 3.861750 
1 1 1    8    5   43 o  213.698   1.8753  1861.77   32.668  1896.26   47.686  1831.27   44.843  215.637   2.7129  211.914   2.5959 3.722610 3.754827 
1 1 1    8    5   44 o   52.410   2.0971  112.170   8.9409  117.957   14.290  108.448   11.461   53.674   3.2819   51.495   2.7403 2.179043 4.275551 
1 1 1    8    5   45 o  607.703   4.2022 15074.67  208.165 15274.15  298.407 14885.57  290.530  611.234   5.9891  603.434   5.9064 7.799744 8.411646 
1 1 1    8    5   46 o  173.758   1.7200  1230.86   24.361  1233.81   35.504  1228.24   33.488  173.939   2.5040  173.552   2.3672 0.3874054 3.445819 
1 1 1    8    5   47 o   98.321   1.6106  394.099   12.908  381.084   19.448  404.349   17.258   96.636   2.4709   99.582   2.1260 -2.946007 3.259632 
1 1 1    8    5   48 o   67.145   1.7940  183.939   9.8101  191.478   15.609  179.017   12.612   68.458   2.8031   66.215   2.3404 2.243294 3.651640 
1 1 1    8    5   49 o  163.271   1.6788  1086.79   22.343  1097.59   32.848  1077.50   30.481  164.053   2.4564  162.551   2.3004 1.502380 3.365356 
1 1 1    8    5   50 o  313.769   2.3930  4015.01   61.206  4009.22   87.315  4020.61   85.820  313.444   3.4174  313.896   3.3540 -0.4518127 4.788323 
1 1 1    8    5   51 o  330.133   2.4871  4445.01   66.929  4437.93   95.367  4451.88   93.952  329.756   3.5479  330.281   3.4897 -0.5251160 4.976475 
1 1 1    8    5   52 o  149.282   1.6374  908.557   19.925  913.223   29.408  904.596   27.091  149.639   2.4109  148.938   2.2314 0.7016144 3.285057 
1 1 1    8    5   53 o  142.378   1.6193  826.453   18.794  814.936   27.462  836.598   25.775  141.357   2.3833  143.230   2.2076 -1.873001 3.248639 
1 1 1    8    5   54 o   96.173   1.6003  377.089   12.546  386.151   19.303  370.462   16.507   97.272   2.4364   95.313   2.1246 1.958725 3.232659 
1 1 1    8    5   55 o  167.909   2.0581  1149.68   28.170  1103.34   41.386  1189.68   38.452  164.437   3.0876  170.770   2.7623 -6.332764 4.142882 
1 1 1    8    5   56 o  106.326   1.5644  460.908   13.559  451.198   17.414  475.862   21.610  105.189   2.0309  108.013   2.4544 -2.823936 3.185660 
1 1 1    8    5   57 o  189.836   1.7612  1469.38   27.253  1474.55   34.105  1460.24   45.332  190.148   2.2003  189.178   2.9397 0.9704437 3.671918 
1 1 1    8    5   58 o  220.322   1.7617  1979.24   31.640  1944.72   41.945  2024.82   48.193  218.357   2.3566  222.787   2.6538 -4.429443 3.549056 
1 1 1    8    5   59 o   25.169   3.2245   26.277   6.4638   10.754   11.620   33.233   7.7783   17.665   6.3428   28.325   3.4392 -10.66030 7.215178 
1 1 1    8    5   60 o   82.009   1.6078  274.210   10.748  304.190   17.019  254.322   13.862   86.322   2.4211   78.938   2.1563 7.384041 3.242104 
1 1 1    8    5   61 o   75.283   1.7909  231.100   10.990  224.852   16.086  236.570   15.050   74.190   2.6642   76.115   2.4288 -1.925385 3.605187 
1 1 1    8    5   62 o  215.820   1.8842  1899.41   33.149  1932.44   48.286  1869.97   45.588  217.627   2.7219  214.090   2.6123 3.537354 3.772658 
1 1 1    8    5   63 o   24.385   2.9085   24.611   5.6676   21.019   10.113   26.255   6.8433   22.227   5.5884   25.127   3.4305 -2.900934 6.557321 
1 1 1    8    5   64 o   38.508   2.9272   60.866   9.1194   58.455   10.969   66.264   16.412   37.660   3.6175   39.910   5.1658 -2.249958 6.306448 
1 1 1    8    5   65 o  172.821   1.9565  1218.07   27.562  1212.82   30.588  1240.70   63.561  172.435   2.1761  174.129   4.4817 -1.693863 4.982124 
1 1 1    8    5   66 o  243.377   2.0874  2415.96   41.412  2444.79   50.909  2359.58   71.201  244.779   2.5514  240.338   3.6344 4.441483 4.440551 
1 1 1    8    5   67 o  240.774   2.0880  2364.64   40.981  2403.10   50.615  2291.44   69.826  242.676   2.5587  236.832   3.6169 5.844238 4.430463 
1 1 1    8    5   68 o  169.128   1.8487  1166.56   25.487  1172.36   31.159  1154.81   44.307  169.522   2.2549  168.166   3.2322 1.356110 3.940975 
1 1 1    8    5   69 o  132.106   1.8010  711.729   19.395  723.292   23.727  688.450   33.667  133.156   2.1860  129.845   3.1809 3.311127 3.859585 
1 1 1    8    5   70 o   48.133   2.7425   94.873   10.716   89.310   13.081  106.223   18.685   46.628   3.4664   50.745   4.5659 -4.116688 5.732603 
1 1 1    8    5   71 o   68.196   2.2268  189.948   12.362  196.775   15.871  179.416   19.712   69.369   2.8125   66.153   3.6699 3.215714 4.623683 
1 1 1    8    5   72 o  182.335   1.8095  1356.02   26.895  1348.64   32.852  1371.04   46.835  181.804   2.2168  183.207   3.1361 -1.402649 3.840460 
1 1 1    8    5   73 o  112.279   1.6381  514.139   14.993  515.838   19.345  511.583   23.725  112.440   2.1106  111.944   2.5999 0.4957275 3.348782 
1 1 1    8    5   74 o   39.200   3.2232   63.218   10.208   58.367   13.200   70.436   16.102   37.496   4.4025   41.161   4.8949 -3.664692 6.583522 
1 1 1    8    5   75 o   56.670   2.4937  131.361   11.491  141.645   16.531  121.745   15.985   58.756   3.4669   54.439   3.6229 4.316723 5.014445 
1 1 1    8    5   76 o  153.245   1.9155  958.148   23.928  989.955   36.462  934.091   31.711  155.666   2.8735  151.245   2.5721 4.420685 3.856497 
1 1 1    8    5   77 f  141.275   1.7351  814.211   19.982  808.727   27.232  820.607   29.411  140.743   2.3736  141.755   2.5453 -1.011749 3.480302 
1 1 1    8    5   78 o  193.467   2.0532  1527.63   32.380  1521.01   50.374  1532.29   42.270  192.857   3.2043  193.669   2.6775 -0.8118134 4.175721 
1 1 1    8    5   79 o  108.783   1.6311  482.755   14.464  488.414   18.895  474.748   22.478  109.384   2.1192  107.804   2.5579 1.579567 3.321732 
1 1 1    8    5   80 o   89.887   1.8239  329.705   13.364  341.527   16.150  304.030   23.801   91.462   2.1662   86.122   3.3970 5.339905 4.028889 
1 1 1    8    5   81 o   72.500   1.9911  214.722   11.756  199.180   13.863  254.517   22.183   69.784   2.4407   78.766   3.4634 -8.981712 4.237019 
1 1 1    8    5   82 o   40.621   2.9213   67.834   9.6085   62.200   11.357   82.023   18.023   38.793   3.6338   44.345   5.0774 -5.552654 6.243772 
1 1 1    8    5   83 o  109.793   1.7452  491.971   15.619  498.847   18.845  476.886   27.914  110.525   2.0918  107.882   3.1777 2.642731 3.804375 
1 1 1    8    5   84 o  101.865   1.6449  423.465   13.659  420.529   17.838  427.626   21.236  101.465   2.1567  102.272   2.5473 -0.8079453 3.337687 
1 1 1    8    5   85 o  117.960   1.6126  567.879   15.505  576.287   20.410  556.402   23.845  118.774   2.1080  116.651   2.5077 2.122353 3.276029 
1 1 1    8    5   86 o   13.355   5.2786   4.1369   8.5003  -3.9339   11.062   15.771   13.282   12.327   5.4817   20.082   6.8092 -7.755092 8.741577 
1 1 1    8    5   87 o   73.885   1.9131  223.143   11.512  220.470   15.088  226.867   17.811   73.362   2.5268   74.353   2.9446 -0.9912033 3.880078 
1 1 1    8    5   88 o  124.620   1.6141  634.069   16.397  623.947   21.293  648.816   25.701  123.545   2.1143  125.908   2.5041 -2.362915 3.277378 
1 1 1    8    5   89 o   23.945   4.3176   24.379   8.1174   30.113   10.350   15.218   13.083   26.537   4.9673   19.736   6.7569 6.801462 8.386276 
1 1 1    8    5   90 o   79.854   1.8464  260.596   12.019  258.040   14.244  266.911   22.392   79.387   2.2033   80.485   3.4209 -1.097755 4.068997 
1 1 1    8    5   91 o   51.391   2.2964  108.346   9.5954  106.338   11.327  113.447   18.055   50.841   2.7434   52.179   4.2827 -1.337894 5.086019 
1 1 1    8    5   92 o   50.356   2.3117  104.091   9.4638  114.326   11.265   79.545   17.445   52.725   2.6295   43.392   5.0249 9.333588 5.671335 
1 1 1    8    5   93 o   76.628   1.6950  240.039   10.587  246.709   13.726  230.240   16.636   77.582   2.1725   74.821   2.7323 2.760254 3.490763 
1 1 1    8    5   94 o   51.409   2.2156  108.523   9.2628  101.295   11.147  124.652   16.651   49.560   2.7702   54.739   3.7545 -5.179478 4.665833 
1 1 1    8    5   95 o   50.737   2.2402  105.780   9.2422  101.777   10.997  115.407   17.053   49.668   2.7267   52.543   4.0119 -2.874245 4.850847 
1 1 1    8    5   96 o   89.884   1.8611  330.840   13.636  328.020   17.126  335.724   22.537   89.344   2.3536   90.130   3.0720 -0.7861328 3.870011 
1 1 1    8    5   97 o   18.370   5.0612   14.733   7.8205   17.971   9.4984   7.9188   13.780   20.209   5.5817   16.962   6.7157 3.246233 8.732512 
1 1 1    8    5   98 o   83.566   1.9256  286.328   13.117  284.501   16.699  289.273   21.194   83.104   2.4678   83.535   3.1179 -0.4313431 3.976373 
1 1 1    8    5   99 o  105.355   1.8480  455.087   15.871  464.465   20.396  440.696   25.267  106.239   2.3552  103.132   3.0088 3.107323 3.820958 
1 1 1    8    5  100 o   43.413   2.6977   78.143   9.4995  100.070   12.521   48.404   14.582   49.004   3.1512   33.131   5.5986 15.87285 6.424498 
1 1 1    8    5  101 o   10.911   4.6442   0.5189   7.2397   3.7128   8.9652  -5.4682   12.275   13.174   5.3471   12.405   5.6230 0.7685966 7.759489 
1 1 1    8    5  102 o   53.493   2.1191  117.927   9.2219  114.231   11.320  125.218   15.900   52.482   2.6548   54.571   3.5944 -2.088200 4.468476 
1 1 1    8    5  103 o   52.408   2.1695  113.330   9.2482  111.252   11.384  117.364   15.861   51.749   2.7080   52.723   3.7144 -0.9743042 4.596722 
1 1 1    8    5  104 o   11.365   4.7476   1.6577   7.3411   0.6661   8.9897   3.6427   12.719   12.036   5.1505   14.889   6.2365 -2.852498 8.088367 
1 1 1    8    5  105 f   28.216   3.4669   33.875   7.8067   36.178   9.6156   29.421   13.372   28.901   4.2048   25.115   6.4864 3.786150 7.730087 
1 1 1    8    5  106 o   71.511   2.0548  210.907   11.966  208.698   15.348  214.331   19.107   70.854   2.6621   71.439   3.2900 -0.5850296 4.232117 
1 1 1    8    5  107 o   12.787   5.1483   4.0673   8.2358   8.5005   10.623  -2.6115   13.039   15.582   5.9730   13.290   5.9280 2.291614 8.415284 
1 1 1    8    5  108 o   12.031   5.0322   2.1454   8.2632   1.8069   10.613   2.6664   13.167   13.192   5.6193   14.642   6.2486 -1.449917 8.403652 
1 1 1    8    5  109 o   34.195   3.1462   49.546   8.6715   51.468   12.280   47.634   12.247   34.197   4.5156   32.772   4.7203 1.425156 6.532408 
1 1 1    8    5  110 o   12.969   4.9751   5.6869   7.3742   11.428   9.8118  -1.7647   11.179   16.409   5.8356   12.385   5.5086 4.024221 8.024900 
1 1 1    8    5  111 o   26.144   3.7312   29.796   7.7264   34.604   10.273   23.534   11.724   27.712   4.7163   22.075   6.2399 5.636274 7.821755 
1 1 1    8    5  112 o   51.225   2.1963  109.235   9.1497   99.810   12.050  122.068   14.061   48.483   3.0647   53.511   3.2387 -5.028469 4.458872 
1 1 1    8    5  113 o   17.287   5.3016   13.962   8.1802   20.643   10.238   2.1633   13.604   20.650   5.8287   14.286   6.2245 6.364882 8.527450 
1 1 1    8    5  114 o   55.205   2.1472  127.064   9.6442  122.051   12.417  134.688   15.311   53.648   2.8496   55.934   3.3738 -2.285324 4.416186 
1 1 1    8    5  115 o   36.946   3.0629   58.591   9.1416   71.565   11.252   33.396   15.680   40.600   3.4319   24.946   7.2687 15.65418 8.038143 
1 1 1    8    5  116 o   42.039   2.7546   75.265   9.3876   68.861   11.406   88.710   16.527   39.633   3.5687   43.955   4.6848 -4.322025 5.889275 
1 1 1    8    5  117 o   17.145   5.7114   14.340   9.3469   10.640   10.260   32.402   22.667   15.560   5.8925   22.866   8.7349 -7.305711 10.53666 
1 1 1    8    5  118 o   26.898   4.2602   33.182   9.0299   25.356   10.653   53.152   17.018   22.403   5.7916   31.729   6.7852 -9.325611 8.920850 
1 1 1    8    5  119 o   9.6206   4.5021  -6.0602   8.8117  -7.2836   10.433  -3.0151   16.459   10.322   4.8519   13.755   6.3383 -3.433406 7.982128 
1 1 1    8    5  120 o   17.768   6.1043   16.067   10.681   20.963   11.883  -4.5241   24.369   19.854   6.4308   15.656   7.3768 4.197476 9.786326 
1 1 1    8    5  121 o   14.074   6.3603   0.9229   15.563  -8.2940   20.713   12.872   23.585   14.153   6.7082   17.989   8.0014 -3.835850 10.44135 
1 1 1    8    5  122 o   16.174   6.1764   12.443   11.330   21.836   15.749   2.3671   16.313   19.635   7.3293   14.548   6.5487 5.086278 9.828726 
1 1 1    8    5  123 o   14.409   5.8087   8.2229   10.499   2.1400   13.193   18.729   17.339   13.477   5.9901   18.572   7.4725 -5.094136 9.577077 
1 1 1    8    5  124 o   16.742   6.0513   14.227   10.597   16.131   13.838   11.526   16.480   17.566   6.7952   16.501   7.0146 1.065281 9.766201 
1 1 1    8    5  125 o   21.410   5.9768   24.332   10.827   27.829   13.926   18.987   17.217   21.981   6.9453   18.478   7.4422 3.503077 10.17959 
1 1 1    8    5  126 o   12.422   5.4213   2.5307   10.355  -2.1073   13.158   10.079   16.786   12.422   5.7032   16.075   6.9596 -3.652558 8.997957 
1 1 1    8    5  127 o   25.100   5.4635   32.102   10.860   31.066   13.830   33.768   17.541   23.212   6.8438   22.935   7.8245 0.2762680 10.39521 
1 1 1    8    5  128 o   13.040   5.5474   4.7582   10.320  -8.3763   13.140   25.901   16.672   11.243   5.3329   20.433   7.5572 -9.189631 9.249408 
1 1 1    8    5  129 o   13.741   5.6682   6.8749   10.279   1.7805   13.326   14.357   16.151   13.293   5.9564   17.022   7.0708 -3.729078 9.245265 
1 1 1    8    6 -127 o   16.127   6.0244   13.116   10.644  -0.2454   13.227   37.670   17.931   12.788   5.8126   24.187   7.9042 -11.39906 9.811399 
1 1 1    8    6 -126 o   17.004   5.9402   15.182   10.133   15.870   12.605   13.926   17.036   17.228   6.5297   16.917   7.1591 0.3105984 9.689662 
1 1 1    8    6 -125 o   20.860   5.8730   23.212   10.407   27.038   13.003   16.391   17.362   21.743   6.6869   17.582   7.3196 4.160923 9.914198 
1 1 1    8    6 -124 f   16.698   5.6826   14.303   9.2512   13.355   10.943   16.677   17.320   16.283   6.1030   17.737   7.3411 -1.454535 9.546633 
1 1 1    8    6 -123 o   29.778   4.1504   41.073   9.8010   45.322   11.674   30.925   18.039   30.688   4.8261   22.031   7.9039 8.656782 9.260786 
1 1 1    8    6 -122 o   10.175   4.7833  -6.6009   10.145 -14.9892   12.587   8.9508   17.138   10.070   4.8883   15.986   6.9754 -5.916102 8.517758 
1 1 1    8    6 -121 o   23.041   5.2187   26.362   9.5733   34.120   11.365   7.4127   17.763   26.035   5.5264   15.851   7.0025 10.18403 8.920591 
1 1 1    8    6 -120 o   12.040   5.1550   2.7775   9.0135   12.812   10.753 -20.9261   16.527   16.244   6.0577   11.144   5.4519 5.099437 8.149759 
1 1 1    8    6 -119 o   12.525   5.2208   4.3278   8.8486   2.9273   10.521   7.7128   16.357   12.747   5.5145   15.735   6.8410 -2.988019 8.786910 
1 1 1    8    6 -118 f   23.828   5.7016   28.719   10.926   28.719   10.926   0.0000   0.0000   23.828   5.7016  ?   ?  0.000000 5.701628 
1 1 1    8    6 -117 o   10.399   4.8713  -6.6435   10.358  -6.6435   10.358   0.0000   0.0000   10.399   4.8713  ?   ?  0.000000 4.871274 
1 1 1    8    6 -116 o   31.608   4.4133   46.008   11.061   46.008   11.061   0.0000   0.0000   31.608   4.4133  ?   ?  0.000000 4.413293 
1 1 1    8    6 -115 o   19.538   5.6768   19.098   9.5762   20.774   10.456   10.373   23.854   20.214   5.9482   18.035   8.0329 2.178804 9.995415 
1 1 1    8    6 -114 o   20.378   5.2492   20.147   8.7727   18.677   10.371   23.843   16.449   19.290   5.9788   20.915   7.5418 -1.624771 9.624199 
1 1 1    8    6 -113 o   16.937   5.4943   13.622   8.6722   13.286   10.414   14.384   15.664   16.885   6.0112   17.998   7.1490 -1.112965 9.340393 
1 1 1    8    6 -112 o   55.334   2.3538  128.273   10.593  119.901   12.637  148.052   19.424   53.100   2.9310   57.853   4.1464 -4.752335 5.077716 
1 1 1    8    6 -111 o   7.8333   3.7938 -11.0035   7.4669  -4.6423   9.8396 -19.6407   11.465   10.767   4.9391   9.1644   4.4953 1.602427 6.678453 
1 1 1    8    6 -110 o   50.535   2.2091  106.378   9.0780  104.432   12.014  108.968   13.859   49.633   2.9833   50.423   3.3915 -0.7894516 4.516884 
1 1 1    8    6 -109 o   20.381   4.9075   19.132   8.0549   22.185   9.9168   13.210   13.809   21.680   5.5791   17.839   6.8170 3.840670 8.808968 
1 1 1    8    6 -108 o   50.619   2.1858  106.387   8.9978  106.115   11.888  106.751   13.768   50.197   2.9179   50.066   3.3936 0.1306458 4.475515 
1 1 1    8    6 -107 o   69.188   1.8454  197.421   10.398  182.348   13.874  216.739   15.707   66.123   2.5790   72.033   2.6796 -5.910095 3.719066 
1 1 1    8    6 -106 o   9.3845   4.2608  -3.4236   7.0831 -15.2430   9.3263   12.686   10.888   8.5622   4.1682   17.319   6.1485 -8.756360 7.428192 
1 1 1    8    6 -105 o   59.941   2.0605  148.378   10.053  144.989   14.391  151.608   14.049   58.816   3.0117   60.223   2.8700 -1.406399 4.160192 
1 1 1    8    6 -104 o   55.082   2.1307  125.346   9.5487  127.783   13.606  122.980   13.405   55.237   3.0333   54.179   3.0475 1.057842 4.299800 
1 1 1    8    6 -103 o   42.360   2.7610   74.854   9.4815   66.817   15.304   79.860   12.079   39.053   4.9163   43.491   3.4350 -4.438011 5.997421 
1 1 1    8    6 -102 o   58.714   2.1913  142.353   10.469  144.628   17.236  141.023   13.179   58.527   3.6308   58.207   2.7856 0.3200111 4.576255 
1 1 1    8    6 -101 o   59.129   2.1742  144.257   10.462  149.624   17.061  141.022   13.244   59.636   3.5253   58.229   2.7984 1.406956 4.500951 
1 1 1    8    6 -100 o   14.832   5.0823   8.8971   7.4024   19.817   11.004  -0.1301   10.005   20.929   6.0864   12.423   5.3759 8.506278 8.120608 
1 1 1    8    6  -99 o   34.522   2.9172   49.759   8.1324   40.034   11.715   58.804   11.298   30.265   4.9171   37.268   3.7710 -7.002981 6.196639 
1 1 1    8    6  -98 o   62.972   1.9586  162.967   10.042  183.055   14.768  145.693   13.695   66.489   2.7306   59.265   2.8431 7.224354 3.942049 
1 1 1    8    6  -97 o   29.890   3.0728   37.399   7.3802   29.908   9.9921   46.390   10.948   26.166   4.8637   32.991   4.1633 -6.825333 6.402228 
1 1 1    8    6  -96 o   11.914   4.7416   3.3849   6.9036   1.3571   9.6107   5.5466   9.9230   12.758   5.3871   14.425   5.7028 -1.667356 7.844904 
1 1 1    8    6  -95 o   37.528   2.6148   58.284   7.9490   71.143   11.002   44.241   11.498   41.307   3.2947   32.159   4.5097 9.147739 5.585040 
1 1 1    8    6  -94 o   27.677   3.3771   32.174   7.4614   18.250   10.117   48.779   11.048   20.391   5.8075   33.970   4.0708 -13.57953 7.092131 
1 1 1    8    6  -93 o   23.405   4.0661   23.423   7.4761   18.573   10.076   29.364   11.151   20.593   5.7718   25.894   5.4557 -5.300779 7.942146 
1 1 1    8    6  -92 o   42.499   2.4000   74.359   8.2807   81.921   11.241   65.385   12.245   44.466   3.1210   39.524   3.8494 4.942062 4.955666 
1 1 1    8    6  -91 o   55.518   2.0392  126.368   9.2128  129.891   12.352  121.952   13.831   56.163   2.7060   54.319   3.1370 1.844147 4.142849 
1 1 1    8    6  -90 f   86.626   1.7998  306.840   12.709  293.224   18.023  320.304   17.923   84.489   2.6201   88.340   2.4915 -3.851242 3.615582 
1 1 1    8    6  -89 o   20.138   5.0576   17.566   8.2898   13.996   11.702   21.162   11.746   18.789   6.3910   22.084   6.2466 -3.294392 8.936759 
1 1 1    8    6  -88 o   62.061   2.1141  157.747   10.679  158.638   15.089  156.852   15.117   62.085   2.9902   61.729   3.0134 0.3560257 4.245262 
1 1 1    8    6  -87 o   51.362   2.6354  108.372   10.997  110.240   14.342  105.708   17.132   51.666   3.4246   50.419   4.2067 1.246593 5.424470 
1 1 1    8    6  -86 o   69.597   2.2797  198.354   12.916  208.885   16.825  183.247   20.153   71.320   2.9001   66.625   3.7255 4.694710 4.721262 
1 1 1    8    6  -85 o   8.8433   4.3090 -17.9838   10.032 -25.1951   12.830  -6.6408   16.091   9.7095   4.7611   14.586   6.5399 -4.876853 8.089460 
1 1 1    8    6  -84 o   33.127   4.0581   45.823   10.730   92.470   15.723   5.1676   14.679   47.216   4.1267   16.830   6.8381 30.38619 7.986789 
1 1 1    8    6  -83 o   92.823   1.9102  351.877   14.453  337.952   20.422  365.850   20.458   90.827   2.7616   94.522   2.6578 -3.695358 3.832783 
1 1 1    8    6  -82 o   54.322   2.3239  120.820   10.267  132.321   13.511  105.105   15.793   56.780   2.9290   50.445   3.8703 6.335037 4.853732 
1 1 1    8    6  -81 o   39.130   3.1921   63.116   10.093   61.291   12.031   67.452   18.546   38.449   3.8923   39.953   5.8693 -1.504345 7.042611 
1 1 1    8    6  -80 o   90.205   1.8887  332.161   13.888  329.953   16.613  337.285   25.306   89.845   2.2702   90.670   3.4301 -0.8256226 4.113356 
1 1 1    8    6  -79 o   80.548   1.9635  264.852   12.892  271.201   15.487  250.518   23.269   81.447   2.3350   78.099   3.6653 3.348358 4.345898 
1 1 1    8    6  -78 o  138.193   1.7549  779.279   19.768  805.573   24.113  725.381   34.522  140.468   2.1059  133.147   3.1808 7.321121 3.814692 
1 1 1    8    6  -77 o  103.616   1.7613  438.083   14.876  438.290   18.259  437.674   25.657  103.611   2.1619  103.407   3.0472 0.2044449 3.736188 
1 1 1    8    6  -76 o   48.095   2.5021   94.737   9.7757   88.230   11.998  107.592   16.862   46.335   3.1960   51.070   4.0846 -4.734531 5.186408 
1 1 1    8    6  -75 o   75.504   1.9523  232.799   12.005  240.971   14.791  217.021   20.553   76.784   2.3660   72.743   3.4762 4.040970 4.204957 
1 1 1    8    6  -74 o  105.111   1.7682  450.733   15.150  459.718   18.647  433.282   25.987  106.129   2.1555  102.907   3.1015 3.221550 3.776988 
1 1 1    8    6  -73 o   29.849   4.3626   37.271   10.301   26.940   13.331   52.584   16.229   25.090   6.4748   35.291   5.8461 -10.20095 8.723527 
1 1 1    8    6  -72 o  163.929   1.9364  1096.38   25.876  1093.83   33.367  1100.23   40.985  163.682   2.5008  164.090   3.0641 -0.4074249 3.955077 
1 1 1    8    6  -71 f   55.841   2.3484  127.498   10.666  114.512   13.070  153.379   18.452   52.855   3.0466   61.123   3.7211 -8.268295 4.809158 
1 1 1    8    6  -70 f  114.070   1.8906  530.803   17.580  535.861   22.724  523.264   27.744  114.579   2.4330  113.141   3.0109 1.438332 3.871035 
1 1 1    8    6  -69 o   69.170   2.2250  195.428   12.529  206.123   16.203  179.524   19.759   70.995   2.8054   66.164   3.6780 4.831657 4.625792 
1 1 1    8    6  -68 o   33.987   3.9346   47.862   10.699   50.155   13.588   44.119   17.358   34.644   4.9523   32.142   6.8355 2.501865 8.440891 
1 1 1    8    6  -67 o   98.856   1.8491  398.581   14.900  398.973   18.320  397.815   25.609   98.887   2.2728   98.642   3.1891 0.2448502 3.916072 
1 1 1    8    6  -66 o  118.621   1.9831  573.931   19.175  578.013   21.583  558.640   41.776  119.031   2.2245  116.776   4.3965 2.254776 4.927251 
1 1 1    8    6  -65 o   98.411   1.9883  395.010   15.950  402.971   19.772  380.176   26.990   99.379   2.4407   96.414   3.4398 2.964981 4.217706 
1 1 1    8    6  -64 o  111.013   2.3655  502.809   21.406  502.809   21.406   0.0000   0.0000  111.013   2.3655  ?   ?  0.000000 2.365535 
1 1 1    8    6  -63 o  151.368   1.8031  934.383   22.248  950.472   27.417  903.364   38.070  152.644   2.2035  148.747   3.1398 3.896957 3.835822 
1 1 1    8    6  -62 o  137.198   1.7673  767.599   19.765  739.331   23.866  829.322   35.266  134.630   2.1747  142.534   3.0353 -7.903915 3.733971 
1 1 1    8    6  -61 o  223.708   2.1656  2041.29   39.491  2053.46   51.011  2023.08   62.391  224.318   2.7897  222.578   3.4387 1.739349 4.428038 
1 1 1    8    6  -60 o  294.814   2.5420  3546.05   61.088  3528.13   78.445  3573.67   97.374  293.969   3.2736  295.730   4.0394 -1.760742 5.199319 
1 1 1    8    6  -59 o  181.806   1.9140  1347.93   28.365  1269.42   45.214  1398.88   36.424  176.348   3.1454  185.180   2.4130 -8.831680 3.964339 
1 1 1    8    6  -58 o  307.057   2.5792  3846.56   64.556  3886.44  103.913  3821.49   82.382  308.406   4.1334  305.958   3.3032 2.448120 5.291168 
1 1 1    8    6  -57 o  138.806   1.7522  785.628   19.826  822.412   33.157  765.160   24.734  141.966   2.8652  136.968   2.2153 4.998093 3.621772 
1 1 1    8    6  -56 o   18.781   4.2866   14.990   6.4175   24.722   12.157   11.230   7.5561   24.108   6.1632   16.581   5.0972 7.526484 7.997944 
1 1 1    8    6  -55 o  164.507   1.6787  1103.42   22.511  1072.69   32.541  1131.62   31.173  162.163   2.4618  166.568   2.2959 -4.404388 3.366213 
1 1 1    8    6  -54 o  152.436   1.5279  947.358   18.985  921.555   25.652  978.610   28.232  150.325   2.0934  154.902   2.2358 -4.577209 3.062923 
1 1 1    8    6  -53 o  276.397   2.0285  3115.34   45.703  3155.03   61.673  3067.00   68.065  278.093   2.7206  274.153   3.0458 3.940002 4.083926 
1 1 1    8    6  -52 o  112.631   1.4663  517.182   13.462  516.594   18.747  517.808   19.344  112.553   2.0434  112.683   2.1059 -0.1303482 2.934318 
1 1 1    8    6  -51 o  142.969   1.7544  833.399   20.446  826.282   27.713  841.900   30.289  142.334   2.3886  143.664   2.5865 -1.330139 3.520666 
1 1 1    8    6  -50 o  425.961   3.3514  7405.16  116.368  7470.86  152.300  7312.99  180.380  427.644   4.3690  422.891   5.2327 4.753326 6.816803 
1 1 1    8    6  -49 o  171.501   1.8638  1199.27   26.055  1214.16   35.306  1181.46   38.612  172.534   2.5103  170.180   2.7834 2.353577 3.748204 
1 1 1    8    6  -48 o  168.391   1.5604  1156.01   21.419  1171.63   29.125  1137.62   31.609  169.505   2.1079  167.018   2.3217 2.487335 3.135866 
1 1 1    8    6  -47 o   67.636   1.6844  186.510   9.2867  199.624   14.122  176.519   12.327   69.917   2.4819   65.751   2.3035 4.166328 3.386099 
1 1 1    8    6  -46 o  450.855   2.7798  8291.71  102.161  8420.97  146.680  8169.94  142.373  454.160   3.9621  447.350   3.9043 6.809357 5.562532 
1 1 1    8    6  -45 o  243.060   1.8623  2408.76   36.898  2443.88   49.746  2365.80   55.013  244.790   2.4930  240.827   2.8024 3.963150 3.750789 
1 1 1    8    6  -44 o  242.368   1.7347  2394.92   34.272  2378.75   48.854  2410.59   48.091  241.510   2.4816  243.124   2.4266 -1.614288 3.470830 
1 1 1    8    6  -43 o  235.892   1.7050  2268.60   32.785  2314.22   47.537  2227.21   45.277  238.216   2.4481  233.698   2.3768 4.517334 3.412041 
1 1 1    8    6  -42 o  246.817   1.7518  2483.61   35.244  2421.43   49.548  2547.29   50.143  243.671   2.4945  249.925   2.4613 -6.254425 3.504366 
1 1 1    8    6  -41 o  314.813   2.0704  4040.95   53.130  4065.11   75.983  4017.83   74.319  315.688   2.9527  313.851   2.9049 1.837006 4.142145 
1 1 1    8    6  -40 o   50.154   1.7904  102.680   7.3079   87.546   11.135  114.131   9.6857   46.233   2.9704   52.858   2.2531 -6.624378 3.728211 
1 1 1    8    6  -39 o  344.886   2.2212  4849.97   62.445  4843.10   88.667  4856.73   87.958  344.569   3.1568  345.056   3.1271 -0.4871521 4.443487 
1 1 1    8    6  -38 o  183.597   1.4979  1374.09   22.417  1388.10   32.386  1361.21   31.060  184.512   2.1533  182.719   2.0854 1.793732 2.997568 
1 1 1    8    6  -37 o  230.880   1.6790  2173.06   31.599  2197.13   45.502  2150.65   43.915  232.128   2.4047  229.663   2.3458 2.465912 3.359360 
1 1 1    8    6  -36 f  118.603   1.3501  573.395   13.053  574.714   19.113  572.242   17.869  118.730   1.9749  118.477   1.8502 0.2535095 2.706182 
1 1 1    8    6  -35 o   76.382   1.6141  237.831   10.050  235.791   13.519  240.351   15.024   76.017   2.1840   76.740   2.4048 -0.7228012 3.248538 
1 1 1    8    6  -34 o  143.256   1.5103  836.558   17.637  820.428   23.379  857.861   26.868  141.860   2.0218  145.055   2.2723 -3.195007 3.041535 
1 1 1    8    6  -33 o  480.677   3.3934  9423.74  132.960  9476.60  163.767  9321.54  227.739  481.935   4.1687  477.726   5.8482 4.209106 7.181910 
1 1 1    8    6  -32 o  369.004   2.7031  5552.08   81.306  5485.71  114.429  5619.75  115.549  366.712   3.8280  371.166   3.8191 -4.453949 5.407337 
1 1 1    8    6  -31 o  310.989   2.3646  3943.07   59.943  3845.66   83.807  4045.11   85.773  307.075   3.3481  314.938   3.3411 -7.862885 4.729989 
1 1 1    8    6  -30 o  203.498   1.8111  1688.12   30.043  1669.77   42.975  1705.66   42.015  202.370   2.6052  204.536   2.5200 -2.166260 3.624525 
1 1 1    8    6  -29 o  164.027   1.6561  1096.72   22.143  1092.94   31.957  1100.22   30.709  163.731   2.3944  164.277   2.2932 -0.5466461 3.315442 
1 1 1    8    6  -28 o   88.813   1.5148  321.518   10.966  294.577   14.935  353.033   16.153   84.978   2.1578   93.059   2.1295 -8.080460 3.031655 
1 1 1    8    6  -27 o  123.461   1.3678  621.305   13.766  631.215   20.142  612.619   18.857  124.436   1.9857  122.590   1.8870 1.845528 2.739326 
1 1 1    8    6  -26 o  379.695   2.3969  5877.44   74.184  5885.66  105.402  5869.36  104.430  379.910   3.4036  379.385   3.3768 0.5249329 4.794488 
1 1 1    8    6  -25 o  369.146   2.3436  5555.29   70.520  5657.00  101.523  5460.46   98.028  372.464   3.3438  365.940   3.2863 6.524200 4.688370 
1 1 1    8    6  -24 o  304.692   2.3337  3784.66   57.962  3611.05   79.897  3977.53   84.215  297.588   3.2937  312.324   3.3079 -14.73550 4.668019 
1 1 1    8    6  -23 o  514.508   3.3275 10794.00  139.556 10891.03  214.872 10723.21  183.535  516.661   5.1020  512.734   4.3913 3.927185 6.731520 
1 1 1    8    6  -22 o  270.997   1.9794  2993.65   43.724  3031.07   67.492  2966.58   57.398  272.658   3.0367  269.754   2.6103 2.903381 4.004390 
1 1 1    8    6  -21 o   83.714   1.5313  285.657   10.449  265.478   15.914  300.952   13.855   80.662   2.4230   85.924   1.9781 -5.262016 3.127919 
1 1 1    8    6  -20 o  128.067   1.4542  668.519   15.181  668.253   23.413  668.712   19.941  128.035   2.2433  128.082   1.9099 -0.4718018E-01 2.946204 
1 1 1    8    6  -19 o  261.408   1.9308  2785.48   41.142  2803.35   63.235  2772.36   54.176  262.222   2.9584  260.779   2.5486 1.443115 3.904768 
1 1 1    8    6  -18 o  228.809   1.7771  2134.02   33.146  2175.50   51.324  2104.34   43.414  231.005   2.7256  227.204   2.3441 3.801514 3.594971 
1 1 1    8    6  -17 o  164.062   1.5280  1097.12   20.435  1085.62   31.253  1105.71   27.009  163.191   2.3494  164.698   2.0118 -1.507431 3.093034 
1 1 1    8    6  -16 o  277.086   2.0077  3129.63   45.348  3047.04   68.128  3195.33   60.765  273.383   3.0572  279.966   2.6626 -6.583191 4.054109 
1 1 1    8    6  -15 o  354.563   2.4181  5124.74   69.889  5186.21  107.890  5080.30   91.738  356.639   3.7112  352.998   3.1882 3.640808 4.892581 
1 1 1    8    6  -14 o  599.701   4.1372 14665.63  202.243 14505.15  347.434 14747.87  248.727  596.105   7.1501  601.302   5.0745 -5.196960 8.767827 
1 1 1    8    6  -13 o  316.715   2.3960  4089.00   61.856  4326.95  112.443  3985.75   74.071  325.741   4.2347  312.678   2.9061 13.06293 5.135991 
1 1 1    8    6  -12 o  285.237   2.4249  3316.60   56.381  3384.17  128.578  3300.51   62.734  288.028   5.4764  284.539   2.7048 3.488922 6.107944 
1 1 1    8    6  -11 o  127.811   1.7217  665.852   17.938  682.887   41.774  662.002   19.862  129.351   3.9666  127.439   1.9120 1.911812 4.403338 
1 1 1    8    6  -10 f  106.930   1.7224  466.060   15.013  477.325   24.078  458.896   19.203  108.173   2.7329  106.102   2.2203 2.071259 3.521133 
1 1 1    8    6   -9 o  369.809   2.9576  5575.26   89.157  5612.17  141.799  5551.13  114.655  370.964   4.6893  368.979   3.8120 1.985443 6.043241 
1 1 1    8    6   -8 o  137.040   2.2315  765.525   24.927   0.0000   0.0000  765.525   24.927  ?   ?   137.040   2.2315 0.000000 2.231481 
1 1 1    8    6   -7 o  382.019   3.3935  5949.89  105.673  6012.31  212.795  5929.45  121.746  383.841   6.8010  381.343   3.9165 2.497894 7.848116 
1 1 1    8    6   -6 o  347.937   2.5800  4934.96   73.174  5049.95  128.622  4879.94   88.975  351.905   4.4839  345.977   3.1549 5.928467 5.482566 
1 1 1    8    6   -5 o  207.004   1.9986  1746.66   33.724  1797.28   54.246  1714.77   43.056  209.966   3.1694  205.099   2.5753 4.867020 4.083820 
1 1 1    8    6   -4 o  285.168   2.4286  3314.94   56.454  3322.90   89.333  3309.64   72.844  285.478   3.8388  284.926   3.1364 0.5524902 4.957158 
1 1 1    8    6   -3 o  236.695   1.9622  2283.64   37.860  2278.55   65.612  2286.18   46.355  236.408   3.4047  236.821   2.4013 -0.4130554 4.166350 
1 1 1    8    6   -2 o  196.993   1.7829  1581.77   28.629  1710.25   52.001  1525.88   34.295  204.820   3.1146  193.478   2.1745 11.34262 3.798577 
1 1 1    8    6   -1 o  476.104   3.6741  9241.85  142.589  9214.71  225.031  9260.06  184.313  475.283   5.8084  476.519   4.7450 -1.235931 7.500163 
1 1 1    8    6    0 o  463.630   3.2767  8763.28  123.835  8924.73  217.862  8686.23  150.514  467.751   5.7139  461.556   4.0005 6.195160 6.975146 
1 1 1    8    6    1 o  202.831   1.8047  1676.92   29.838  1790.59   53.759  1626.30   35.871  209.575   3.1468  199.743   2.2031 9.832474 3.841387 
1 1 1    8    6    2 o  181.342   1.7183  1340.40   25.400  1349.34   36.076  1331.62   35.768  181.939   2.4325  180.740   2.4278 1.199051 3.436743 
1 1 1    8    6    3 o  531.609   3.4308 11521.82  148.670 11582.17  228.012 11477.19  196.085  532.891   5.2491  530.518   4.5343 2.372986 6.936312 
1 1 1    8    6    4 o  296.857   2.1114  3592.11   51.092  3556.64   77.495  3619.38   67.952  295.365   3.2187  297.968   2.7977 -2.603302 4.264609 
1 1 1    8    6    5 o  165.753   1.5426  1119.83   20.842  1106.99   31.666  1129.65   27.684  164.793   2.3573  166.473   2.0401 -1.680786 3.117531 
1 1 1    8    6    6 o  670.051   4.2484 18307.45  232.046 18299.05  354.307 18313.75  307.065  669.686   6.4904  670.047   5.6220 -0.3612061 8.586727 
1 1 1    8    6    7 o  218.224   1.8707  1941.11   33.277  1926.68   46.970  1955.65   47.151  217.401   2.6505  219.029   2.6409 -1.628494 3.741602 
1 1 1    8    6    8 o  284.318   2.4197  3295.20   56.080  3307.71   89.070  3286.99   72.183  284.823   3.8364  283.948   3.1186 0.8745728 4.944027 
1 1 1    8    6    9 o  228.265   2.1028  2123.92   39.126  2106.08   50.361  2151.08   62.144  227.295   2.7181  229.699   3.3190 -2.403870 4.289950 
1 1 1    8    6   10 f  421.541   3.0151  7244.28  103.604  7392.21  149.018  7105.88  144.141  425.768   4.2937  417.443   4.2360 8.324646 6.031528 
1 1 1    8    6   11 o  287.218   2.0620  3362.66   48.276  3393.16   74.328  3340.40   63.490  288.495   3.1607  286.254   2.7209 2.240967 4.170518 
1 1 1    8    6   12 o  417.597   2.9929  7109.41  101.880  7139.31  177.220  7094.65  124.512  418.365   5.1966  417.137   3.6618 1.228363 6.357188 
1 1 1    8    6   13 o  511.164   3.5755 10653.45  148.981 10845.60  262.166 10561.80  181.056  515.554   6.2383  508.913   4.3645 6.640533 7.613484 
1 1 1    8    6   14 o  309.906   2.3561  3915.07   59.519  3927.59  103.592  3908.91   72.720  310.349   4.0949  309.649   2.8810 0.6996765 5.006826 
1 1 1    8    6   15 o  320.190   2.4139  4179.27   63.002  4159.42  109.209  4189.16   77.131  319.370   4.1950  320.554   2.9518 -1.183960 5.129426 
1 1 1    8    6   16 o  268.017   2.1244  2928.16   46.413  2977.69   81.601  2904.47   56.430  270.235   3.7044  266.922   2.5935 3.313019 4.522084 
1 1 1    8    6   17 o  399.570   2.6672  6508.69   86.873  6470.19  132.193  6537.97  115.255  398.324   4.0713  400.432   3.5310 -2.108124 5.389213 
1 1 1    8    6   18 o  153.857   1.5019  964.878   18.837  988.420   29.315  948.323   24.583  155.714   2.3096  152.527   1.9772 3.187408 3.040297 
1 1 1    8    6   19 o  312.068   2.1918  3969.88   55.755  3990.53   85.592  3954.66   73.485  312.843   3.3564  311.450   2.8945 1.393402 4.432098 
1 1 1    8    6   20 o  167.829   1.5455  1148.10   21.143  1168.66   32.810  1133.50   27.649  169.315   2.3773  166.754   2.0341 2.561707 3.128735 
1 1 1    8    6   21 o  144.533   1.6069  851.489   18.932  932.687   34.515  816.549   22.641  151.252   2.7994  141.533   1.9625 9.719421 3.418813 
1 1 1    8    6   22 o  408.522   2.7203  6803.94   90.588  6974.03  141.223  6685.03  118.082  413.516   4.1896  404.895   3.5777 8.621552 5.509360 
1 1 1    8    6   23 o  121.766   1.4627  604.356   14.518  613.396   22.604  598.007   18.942  122.666   2.2606  121.121   1.9186 1.545006 2.965013 
1 1 1    8    6   24 o   95.157   1.4761  369.088   11.450  369.571   17.784  368.746   14.964   95.214   2.2914   95.110   1.9301 0.1033173 2.995957 
1 1 1    8    6   25 o  100.865   1.4715  414.693   12.099  398.750   18.566  426.460   15.950   98.900   2.3030  102.283   1.9131 -3.382362 2.993888 
1 1 1    8    6   26 o  272.102   1.9845  3018.20   44.017  3009.67   67.256  3024.59   58.217  271.685   3.0369  272.372   2.6221 -0.6870422 4.012235 
1 1 1    8    6   27 o  175.498   1.6941  1255.47   24.235  1334.92   44.023  1220.93   29.030  180.939   2.9848  173.061   2.0578 7.878220 3.625409 
1 1 1    8    6   28 o  269.096   2.1265  2952.00   46.645  2918.03   65.701  2986.53   66.234  267.513   3.0129  270.636   3.0024 -3.122498 4.253457 
1 1 1    8    6   29 o   93.498   1.9272  356.361   14.688  339.785   21.042  372.113   20.513   91.243   2.8325   95.497   2.6376 -4.254059 3.870414 
1 1 1    8    6   30 o   82.911   1.9827  280.235   13.400  265.982   19.374  293.306   18.553   80.711   2.9498   84.772   2.6883 -4.061653 3.990972 
1 1 1    8    6   31 o  244.492   2.4375  2437.15   48.578  2431.81   68.815  2442.46   68.586  244.183   3.4573  244.718   3.4382 -0.5350342 4.875860 
1 1 1    8    6   32 o  193.020   2.1359  1518.90   33.606  1488.59   47.184  1550.09   47.876  191.059   3.0296  194.966   3.0125 -3.907684 4.272416 
1 1 1    8    6   33 o  128.095   1.5722  668.866   16.416  669.919   23.578  667.875   22.869  128.186   2.2565  127.991   2.1920 0.1945496 3.145888 
1 1 1    8    6   34 o  275.960   2.1669  3104.79   48.745  3057.59   68.393  3153.51   69.492  273.812   3.0643  278.074   3.0657 -4.261444 4.334566 
1 1 1    8    6   35 o   76.364   1.9423  237.893   12.081  225.721   15.309  257.984   19.669   74.359   2.5293   79.476   3.0416 -5.116707 3.955820 
1 1 1    8    6   36 f  112.090   1.7606  512.196   16.086  513.594   20.704  510.066   25.552  112.234   2.2630  111.802   2.8060 0.4325790 3.604847 
1 1 1    8    6   37 o  280.503   2.6964  3208.66   61.653  3096.93   84.502  3335.82   90.152  275.503   3.7628  285.923   3.8680 -10.41953 5.396298 
1 1 1    8    6   38 o  191.147   1.9894  1489.64   30.997  1506.89   40.706  1465.82   47.821  192.229   2.5978  189.570   3.0946 2.659073 4.040452 
1 1 1    8    6   39 o  303.187   2.3405  3748.24   57.843  3745.94   82.655  3750.44   80.977  303.021   3.3463  303.209   3.2763 -0.1880493 4.683121 
1 1 1    8    6   40 o  328.751   2.4850  4407.34   66.593  4439.97   95.547  4376.51   92.865  329.871   3.5533  327.513   3.4785 2.358307 4.972504 
1 1 1    8    6   41 o  100.723   1.6461  413.592   13.515  415.436   20.420  412.154   18.029  100.931   2.4820  100.538   2.2000 0.3933105 3.316618 
1 1 1    8    6   42 o   31.517   3.2176   40.946   8.1504   33.606   14.407   44.401   9.8842   28.103   6.4287   32.769   3.7689 -4.665766 7.452034 
1 1 1    8    6   43 o  193.139   1.8023  1520.85   28.375  1520.76   41.208  1520.93   39.128  193.098   2.6180  193.116   2.4856 -0.1737976E-01 3.610024 
1 1 1    8    6   44 o   87.837   1.6860  314.546   12.072  291.583   18.267  332.350   16.085   84.510   2.6550   90.279   2.1857 -5.769455 3.438984 
1 1 1    8    6   45 o   64.231   1.8906  168.359   9.8878  146.544   15.207  184.338   13.015   59.850   3.1278   67.190   2.3800 -7.339355 3.930360 
1 1 1    8    6   46 o   61.785   1.8913  155.790   9.5142  173.602   15.271  144.491   12.163   65.171   2.8818   59.468   2.5148 5.703541 3.824813 
1 1 1    8    6   47 o   86.759   1.6562  306.876   11.713  311.835   18.084  303.293   15.373   87.402   2.5410   86.213   2.1893 1.188736 3.354105 
1 1 1    8    6   48 o  209.478   2.0391  1789.32   34.818  1764.09   45.610  1824.56   53.903  207.959   2.6906  211.463   3.1271 -3.503723 4.125299 
1 1 1    8    6   49 o  171.668   1.8730  1201.61   26.210  1215.09   35.199  1184.84   39.266  172.601   2.5018  170.421   2.8266 2.179535 3.774729 
1 1 1    8    6   50 o   45.058   2.4038   83.038   8.7970   69.763   13.290   93.391   11.736   41.138   4.0142   47.746   3.0311 -6.608212 5.029999 
1 1 1    8    6   51 o  115.052   1.7366  539.706   16.286  541.788   22.718  537.505   23.361  115.254   2.4181  114.794   2.4965 0.4592361 3.475584 
1 1 1    8    6   52 o   82.606   1.8307  278.234   12.327  292.770   22.741  272.186   14.669   84.631   3.3028   81.665   2.2056 2.965858 3.971509 
1 1 1    8    6   53 o  146.220   1.7936  871.773   21.378  921.668   37.215  847.197   26.118  150.288   3.0377  144.129   2.2231 6.159576 3.764296 
1 1 1    8    6   54 o  155.063   1.8334  980.424   23.173  940.268   38.662  1002.94   28.950  151.790   3.1247  156.815   2.2648 -5.025238 3.859128 
1 1 1    8    6   55 o   83.193   1.8225  282.210   12.359  305.710   23.391  273.108   14.557   86.478   3.3245   81.803   2.1851 4.674904 3.978276 
1 1 1    8    6   56 o  138.130   1.7786  777.998   20.027  754.875   34.109  790.163   24.741  136.002   3.0767  139.191   2.1805 -3.188553 3.771056 
1 1 1    8    6   57 o  120.710   1.4896  594.057   14.657  599.968   20.414  587.767   21.058  121.291   2.0647  120.048   2.1520 1.242844 2.982309 
1 1 1    8    6   58 o  272.296   2.0133  3023.77   44.688  3006.64   59.497  3045.95   67.690  271.459   2.6888  273.188   3.0397 -1.728149 4.058244 
1 1 1    8    6   59 o  164.424   1.5678  1102.30   21.014  1100.32   28.549  1104.65   31.043  164.250   2.1323  164.563   2.3142 -0.3127136 3.146767 
1 1 1    8    6   60 o  207.069   1.7215  1748.39   29.057  1770.61   39.476  1722.11   42.927  208.340   2.3245  205.448   2.5633 2.892319 3.460257 
1 1 1    8    6   61 o   33.102   3.9069   45.388   10.339   51.270   11.538   21.427   23.288   35.183   4.1000   24.878   8.9734 10.30502 9.865712 
1 1 1    8    6   62 o  109.857   1.5322  492.077   13.721  499.290   19.394  484.847   19.414  110.637   2.1504  109.024   2.1846 1.613342 3.065385 
1 1 1    8    6   63 o   20.202   3.7818   17.216   5.9988   1.6194   13.245   21.241   6.7285   15.227   6.3702   22.493   3.8054 -7.265648 7.420300 
1 1 1    8    6   64 o   95.983   2.1514  375.809   16.833  360.772   21.351  400.507   27.363   93.974   2.7903   98.966   3.3970 -4.991272 4.396026 
1 1 1    8    6   65 o  197.194   2.1171  1586.18   34.031  1549.41   43.205  1646.30   55.236  194.842   2.7203  200.767   3.3752 -5.925537 4.334949 
1 1 1    8    6   66 o  150.815   1.9772  927.728   24.307  913.849   30.951  950.066   39.265  149.646   2.5373  152.531   3.1580 -2.884720 4.051025 
1 1 1    8    6   67 o  134.178   2.1768  734.492   23.808  723.595   27.234  769.822   49.037  133.158   2.5090  137.095   4.3937 -3.937149 5.059578 
1 1 1    8    6   68 o   60.460   3.2125  149.735   15.775  149.735   15.775   0.0000   0.0000   60.460   3.2125  ?   ?  0.000000 3.212457 
1 1 1    8    6   69 o  227.978   2.1875  2120.67   40.651  2183.48   53.184  2032.41   63.045  231.245   2.8215  222.998   3.4683 8.247177 4.470978 
1 1 1    8    6   70 f  154.205   1.9108  970.047   24.019  955.847   30.513  993.181   38.945  153.028   2.4461  155.922   3.0642 -2.894485 3.920791 
1 1 1    8    6   71 f  107.120   1.7577  468.057   15.348  470.873   18.736  462.310   26.762  107.421   2.1397  106.326   3.0910 1.094696 3.759331 
1 1 1    8    6   72 o  115.821   1.7302  547.182   16.335  528.278   19.780  587.724   28.966  113.778   2.1327  119.940   2.9627 -6.161766 3.650461 
1 1 1    8    6   73 o   33.357   3.7607   46.106   10.048   52.043   12.738   36.328   16.347   35.347   4.5246   29.078   6.9842 6.268280 8.321736 
1 1 1    8    6   74 o   99.252   1.9598  401.975   15.855  392.548   17.645  441.515   36.137   98.066   2.2073  103.701   4.2843 -5.635033 4.819431 
1 1 1    8    6   75 o  131.288   1.9019  703.359   20.354  711.643   22.886  672.003   44.523  132.040   2.1263  127.949   4.2749 4.090187 4.774504 
1 1 1    8    6   76 o  192.292   2.0387  1509.25   31.956  1534.53   36.125  1418.31   68.523  193.860   2.2860  185.880   4.5224 7.979996 5.067350 
1 1 1    8    6   77 o   43.629   2.8992   78.160   10.252   84.637   12.254   63.046   18.718   45.356   3.3378   38.605   6.1546 6.750927 7.001406 
1 1 1    8    6   78 o   37.438   3.2802   57.797   9.9093   45.945   13.408   72.061   14.709   33.026   5.1485   41.666   4.3971 -8.640785 6.770642 
1 1 1    8    6   79 o   78.076   1.8319  248.794   11.659  240.712   14.843  261.812   18.837   76.724   2.3762   79.958   2.8949 -3.233414 3.745240 
1 1 1    8    6   80 o  186.398   1.7217  1417.94   26.160  1406.00   33.971  1435.35   41.006  185.526   2.2463  187.364   2.6849 -1.837631 3.500649 
1 1 1    8    6   81 o   63.424   2.0545  164.449   10.608  160.134   13.614  171.116   16.923   62.518   2.6776   64.557   3.2261 -2.038193 4.192559 
1 1 1    8    6   82 o  157.540   1.6576  1012.96   21.286  1021.61   27.999  1001.11   32.767  158.132   2.1721  156.463   2.5692 1.669083 3.364326 
1 1 1    8    6   83 o   22.232   5.0199   21.216   8.8811   16.073   11.540   28.687   13.908   19.819   6.3297   25.739   6.5985 -5.920387 9.143641 
1 1 1    8    6   84 o   45.503   3.0213   85.219   11.143   80.172   13.228   97.552   20.677   44.015   3.7217   48.231   5.3493 -4.215157 6.516578 
1 1 1    8    6   85 o   48.970   2.7167   98.507   10.802   97.217   12.709  101.866   20.502   48.569   3.2284   49.307   5.1783 -0.7377472 6.102216 
1 1 1    8    6   86 o   33.913   3.5158   47.777   9.5785   38.387   11.239   72.702   18.311   30.106   4.7359   41.440   5.5609 -11.33391 7.304287 
1 1 1    8    6   87 o   50.404   2.3041  104.182   9.4416   99.245   12.245  111.423   14.828   49.074   3.0765   51.924   3.5241 -2.849518 4.678041 
1 1 1    8    6   88 o   56.992   2.0349  133.009   9.4384  123.434   12.293  146.761   14.732   54.789   2.7614   59.701   3.0371 -4.912498 4.104766 
1 1 1    8    6   89 o   64.988   1.8807  172.838   9.9527  172.905   13.028  172.745   15.424   64.905   2.4668   64.783   2.9285 0.1224213 3.828986 
1 1 1    8    6   90 f  101.598   1.6024  421.791   13.270  414.232   17.290  432.628   20.702  100.589   2.1087  102.712   2.4726 -2.123520 3.249645 
1 1 1    8    6   91 o   99.889   1.5980  407.816   13.011  411.627   17.055  402.509   20.126  100.255   2.0869   99.006   2.4958 1.249245 3.253328 
1 1 1    8    6   92 o   29.307   3.3277   35.909   7.8089   20.516   10.033   59.567   12.438   21.627   5.6351   37.635   4.1217 -16.00736 6.981606 
1 1 1    8    6   93 o   50.745   2.3040  105.896   9.5056  119.673   13.295   91.487   13.596   53.778   3.0452   46.855   3.5871 6.923588 4.705389 
1 1 1    8    6   94 o   75.749   1.8368  234.988   11.342  224.501   15.811  246.105   16.279   73.807   2.6321   77.295   2.5873 -3.488037 3.690800 
1 1 1    8    6   95 o   37.368   2.8375   57.944   8.5787   54.888   11.883   61.271   12.397   36.008   4.1227   38.090   4.0552 -2.081562 5.782829 
1 1 1    8    6   96 o   74.950   1.7323  230.111   10.584  222.907   13.815  240.347   16.467   73.590   2.3058   76.297   2.6517 -2.707542 3.514064 
1 1 1    8    6   97 o   30.398   3.4384   38.916   8.3704   40.565   11.562   37.100   12.134   30.602   4.7922   29.047   5.3205 1.554756 7.160466 
1 1 1    8    6   98 o   73.528   1.7486  221.643   10.481  229.929   13.897  210.714   15.960   74.702   2.2849   71.335   2.7498 3.366318 3.575221 
1 1 1    8    6   99 o   60.387   1.9256  149.912   9.4664  154.160   12.518  144.239   14.468   61.052   2.5208   58.862   3.0254 2.189560 3.937935 
1 1 1    8    6  100 o   19.515   4.9635   16.966   7.9129   13.269   9.6331   24.634   13.875   17.599   5.7958   23.116   6.8649 -5.517387 8.984380 
1 1 1    8    6  101 o   50.709   2.5203  106.605   10.385  104.673   13.421  109.488   16.394   49.939   3.3157   50.754   3.9948 -0.8145790 5.191561 
1 1 1    8    6  102 o   12.424   5.1260   2.7584   8.4087  -4.3119   10.869   13.298   13.271   11.766   5.3164   18.303   6.7473 -6.537089 8.590070 
1 1 1    8    6  103 o   33.873   3.0985   48.279   8.4609   51.476   10.436   42.148   14.452   34.743   3.7441   30.347   6.0548 4.396307 7.118904 
1 1 1    8    6  104 o   42.592   2.6115   75.558   9.0231   67.143   10.985   93.008   15.820   39.836   3.4159   46.507   4.2187 -6.671600 5.428300 
1 1 1    8    6  105 o   31.759   3.3166   42.811   8.4598   42.951   10.384   42.534   14.589   31.470   4.1489   30.314   6.1150 1.155453 7.389621 
1 1 1    8    6  106 o   21.936   4.6580   21.573   8.0713   23.625   9.7782   17.186   14.298   22.697   5.3695   19.703   7.0404 2.994328 8.854371 
1 1 1    8    6  107 o   13.374   5.1846   5.8356   8.0689   14.396   9.8114 -12.0537   14.183   17.868   5.8473   11.922   5.6205 5.945604 8.110591 
1 1 1    8    6  108 o   48.278   2.4526   97.253   9.6205   96.541   11.693   98.745   16.927   47.820   3.0150   47.439   4.4284 0.3808327 5.357368 
1 1 1    8    6  109 o   28.203   4.1879   35.168   9.3360   31.647   11.794   41.077   15.279   25.885   5.7399   28.983   6.6138 -3.097355 8.757205 
1 1 1    8    6  110 o   30.015   3.9130   39.557   9.3460   36.240   11.427   46.263   16.245   27.974   5.2024   30.562   6.7054 -2.587872 8.486934 
1 1 1    8    6  111 o   27.493   4.6063   34.345   9.9584   35.869   11.426   29.528   20.313   27.702   5.2520   23.263   8.3819 4.439146 9.891398 
1 1 1    8    6  112 o   26.705   4.6771   32.712   9.8106   28.836   11.197   45.522   20.357   24.378   5.7316   28.419   8.2824 -4.040667 10.07224 
1 1 1    8    6  113 o   43.322   2.8892   80.040   10.144   82.600   11.327   69.663   22.807   43.798   3.1945   35.508   8.0641 8.290066 8.673744 
1 1 1    8    6  114 o   11.330   4.9087   1.0230   8.3623   4.4121   9.9051  -7.3861   15.602   13.186   5.5120   12.853   6.0068 0.3330460 8.152597 
1 1 1    8    6  115 o   11.568   5.0991   0.2053   9.3693   9.5397   10.149 -53.6631   24.380   15.079   5.8229   11.534   5.7989 3.544284 8.217872 
1 1 1    8    6  116 o   11.542   5.0919   0.2511   9.3612  -3.1300   10.073   21.654   25.345   11.031   5.0366   20.114   8.6285 -9.082493 9.990963 
1 1 1    8    6  117 o   36.480   3.2717   58.166   9.6256   44.147   11.422   92.512   17.879   30.670   4.7200   44.146   5.0597 -13.47605 6.919480 
1 1 1    8    6  118 f   12.553   5.3347   3.4796   9.5266   5.9713   10.380  -9.8383   23.997   13.699   5.6776   14.905   7.1085 -1.205288 9.097585 
1 1 1    8    6  119 o   12.307   5.1676   3.8125   8.7653   3.8995   10.445   3.6052   16.118   13.009   5.5589   14.772   6.5898 -1.762997 8.621274 
1 1 1    8    6  120 o   18.983   5.6159   18.434   9.2993   18.037   11.000   19.428   17.411   18.505   6.1964   18.828   7.5179 -0.3225727 9.742393 
1 1 1    8    6  121 o   25.469   5.4431   32.510   10.958   23.136   13.966   47.522   17.674   20.188   6.9783   28.528   7.5017 -8.339951 10.24564 
1 1 1    8    6  122 o   17.546   6.0898   16.097   10.640   6.8961   13.604   30.595   17.076   14.723   6.3189   22.231   7.7148 -7.507659 9.972310 
1 1 1    8    6  123 o   14.114   5.7646   7.6431   10.498   2.5088   13.255   16.284   17.196   13.490   5.9994   17.713   7.3213 -4.222739 9.465415 
1 1 1    8    6  124 f   6.7630   3.4345 -33.2640   9.9495 -26.1865   12.771 -44.1932   15.870   8.8454   4.4096   8.8263   4.4665 0.1913929E-01 6.276481 
1 1 1    8    6  125 o   10.554   4.9108  -4.6946   10.247  -6.5848   12.963  -1.5469   16.728   11.460   5.3938   13.669   6.3309 -2.208889 8.317057 
1 1 1    8    6  126 o   18.059   6.4722   17.966   12.093   40.930   17.307  -3.9398   16.904   25.632   7.6806   13.319   6.2337 12.31238 9.891962 
1 1 1    8    6  127 o   24.298   7.0085   34.443   14.645  -1.1124   26.763   49.640   17.497   15.946   7.5772   28.976   7.3866 -13.03043 10.58186 
1 1 1    8    7 -125 o   15.525   6.6180   9.7098   14.739 -15.3083   26.918   20.423   17.615   14.508   7.0668   18.631   7.5193 -4.122686 10.31885 
1 1 1    8    7 -124 o   14.363   6.3189   5.4708   14.323   1.5822   26.627   7.0543   16.991   16.153   7.6409   15.310   6.8018 0.8420610 10.22978 
1 1 1    8    7 -123 o   14.599   6.1508   8.0286   12.484   6.1828   17.531   9.9277   17.781   15.254   6.8337   16.067   7.0556 -0.8133812 9.822466 
1 1 1    8    7 -122 o   13.955   5.7002   7.5443   10.266   1.9500   12.863   17.359   17.037   13.160   5.8777   17.857   7.3244 -4.696629 9.391193 
1 1 1    8    7 -121 o   9.5121   4.4852  -6.6395   9.0391 -11.7114   10.615   6.7363   17.239   9.5026   4.5829   15.439   6.8556 -5.936769 8.246314 
1 1 1    8    7 -120 o   16.410   5.7231   13.601   9.4034   14.336   11.265   11.913   17.076   16.756   6.2094   16.617   7.1044 0.1395302 9.435527 
1 1 1    8    7 -119 f   12.787   5.3285   4.8683   9.2136   7.6695   10.860  -2.3247   17.403   14.270   5.8498   13.910   6.4477 0.3591413 8.705967 
1 1 1    8    7 -118 o   26.848   4.5312   34.003   9.5640   32.168   11.220   38.881   18.293   25.205   5.6056   25.013   7.9673 0.1924820 9.741665 
1 1 1    8    7 -117 o   40.595   3.1142   71.841   10.226   58.141   12.057  106.966   19.305   35.532   4.2468   47.161   5.1029 -11.62935 6.638877 
1 1 1    8    7 -116 o   16.131   5.6329   12.662   9.1111   22.956   10.817 -12.4720   16.903   20.971   6.0154   12.363   5.9152 8.607960 8.436528 
1 1 1    8    7 -115 o   13.624   5.4066   6.9659   8.9507   6.5069   10.614   8.0961   16.655   13.978   5.7622   16.014   6.9330 -2.036213 9.014914 
1 1 1    8    7 -114 o   25.604   4.5755   30.697   9.1990   41.510   10.929   4.4140   17.039   29.791   4.6523   15.352   6.8164 14.43873 8.252714 
1 1 1    8    7 -113 o   14.107   5.4470   8.0081   8.8799   15.721   10.501 -11.3516   16.637   17.742   6.0539   12.552   5.9673 5.189791 8.500452 
1 1 1    8    7 -112 o   14.998   5.4434   10.011   8.5867  -0.4040   9.9955   39.344   16.774   11.742   5.2167   26.608   7.4435 -14.86584 9.089548 
1 1 1    8    7 -111 o   14.416   5.6797   7.7633   9.8125   7.7633   9.8125   0.0000   0.0000   14.416   5.6797  ?   ?  0.000000 5.679715 
1 1 1    8    7 -110 o   19.493   5.3882   18.282   8.8472   22.772   9.9939   2.0163   19.022   21.638   5.6174   15.918   7.1257 5.720565 9.073591 
1 1 1    8    7 -109 o   18.878   5.5085   17.055   8.9997   6.5749   10.169   54.910   19.328   14.241   5.7253   32.367   7.4762 -18.12632 9.416574 
1 1 1    8    7 -108 f   19.321   5.0065   17.451   7.9486   9.0804   9.7554   33.983   13.710   15.157   5.7445   26.171   6.4650 -11.01362 8.648446 
1 1 1    8    7 -107 o   36.148   2.7539   55.147   8.0536   66.486   10.797   40.928   12.091   39.369   3.3977   29.852   5.1553 9.517611 6.174268 
1 1 1    8    7 -106 o   59.495   1.9458  146.424   9.4241  137.881   12.493  157.704   14.356   57.354   2.6796   61.213   2.8851 -3.859131 3.937545 
1 1 1    8    7 -105 o   39.161   2.5516   64.145   8.1008   55.711   10.755   75.203   12.315   35.966   3.7222   41.879   3.6437 -5.913277 5.208758 
1 1 1    8    7 -104 o   35.977   2.7342   54.291   7.9585   63.818   10.693   42.456   11.917   38.724   3.4226   30.827   4.9067 7.897104 5.982430 
1 1 1    8    7 -103 o   29.907   3.2034   37.947   7.6879   26.130   10.360   52.431   11.469   23.880   5.4435   34.795   4.1238 -10.91439 6.829182 
1 1 1    8    7 -102 o   21.514   4.4361   20.533   7.5212   14.702   10.283   27.241   11.029   18.213   5.9878   24.358   5.6624 -6.144985 8.241118 
1 1 1    8    7 -101 o   20.603   4.7351   18.981   7.7855   20.596   11.198   17.469   10.832   21.141   6.1377   19.631   6.1143 1.510040 8.663511 
1 1 1    8    7 -100 o   49.382   2.1620  100.752   8.6816  114.526   11.800   84.498   12.818   52.433   2.7707   44.698   3.5471 7.734211 4.501014 
1 1 1    8    7  -99 o   60.153   2.0338  149.121   9.9582  148.448   14.203  149.771   13.966   59.665   2.9292   59.960   2.8657 -0.2948227 4.097881 
1 1 1    8    7  -98 o   13.707   5.0998   6.6029   7.6129   5.2558   10.895   7.8882   10.642   14.617   5.9085   15.485   5.9674 -0.8680162 8.397632 
1 1 1    8    7  -97 o   32.663   3.4620   45.067   9.0774   37.374   14.594   49.921   11.593   28.547   6.4269   34.100   4.2635 -5.552946 7.712487 
1 1 1    8    7  -96 o   10.129   4.5923  -4.0643   8.1912  -6.3432   13.207  -2.6396   10.442   12.731   5.7951   12.006   5.3332 0.7249289 7.875676 
1 1 1    8    7  -95 o   49.744   2.2909  102.064   9.2642  102.713   13.392  101.469   12.829   49.576   3.3333   49.318   3.2087 0.2577629 4.626693 
1 1 1    8    7  -94 o   62.296   1.8571  159.284   9.4200  157.133   12.644  161.967   14.123   61.693   2.5195   62.552   2.7767 -0.8580322 3.749354 
1 1 1    8    7  -93 o   32.302   3.0175   43.529   7.8534   46.176   10.666   40.395   11.606   32.985   4.0519   30.570   4.8167 2.414782 6.294342 
1 1 1    8    7  -92 o   18.558   5.1564   15.060   8.0794   8.9280   11.861   20.367   11.035   16.566   6.3210   21.438   6.0516 -4.872396 8.750824 
1 1 1    8    7  -91 o   28.758   3.6532   34.858   8.3709   22.081   12.034   46.837   11.652   22.326   6.3254   33.179   4.4179 -10.85260 7.715530 
1 1 1    8    7  -90 o   11.348   4.8675  -0.0973   8.0629 -15.2023   11.621   13.925   11.196   10.263   4.9089   18.501   6.2519 -8.238496 7.948840 
1 1 1    8    7  -89 o   54.343   2.1204  121.194   9.3746  118.413   12.537  124.720   14.119   53.559   2.8823   54.900   3.1684 -1.340702 4.283214 
1 1 1    8    7  -88 o   74.173   1.7954  225.024   10.855  209.566   14.251  246.389   16.754   71.429   2.4512   77.406   2.6591 -5.976883 3.616547 
1 1 1    8    7  -87 o   59.775   2.0140  146.384   9.7993  141.019   12.845  153.853   15.156   58.546   2.6988   61.080   3.0538 -2.533440 4.075462 
1 1 1    8    7  -86 o   42.127   2.8002   73.167   9.5613   68.298   13.482   78.096   13.562   40.413   4.1514   43.307   3.8830 -2.893627 5.684316 
1 1 1    8    7  -85 o   80.322   1.9298  263.778   12.635  245.804   17.558  283.084   18.197   77.357   2.7890   83.044   2.6917 -5.687828 3.876031 
1 1 1    8    7  -84 o  102.475   1.8179  429.091   15.185  410.692   21.053  449.044   21.924  100.092   2.5825  104.698   2.5689 -4.606232 3.642629 
1 1 1    8    7  -83 o   64.349   2.2525  169.587   11.797  160.772   16.145  179.684   17.280   62.501   3.1793   66.077   3.2179 -3.575119 4.523616 
1 1 1    8    7  -82 f   15.326   5.7509   7.3925   9.7225   13.374   13.895   1.6554   13.609   19.265   6.9337   15.274   6.4278 3.991198 9.454726 
1 1 1    8    7  -81 o   82.791   2.3783  280.562   16.034  286.936   20.361  270.156   26.015   83.624   2.9917   80.935   3.9552 2.689285 4.959216 
1 1 1    8    7  -80 o   71.930   2.6764  212.014   15.665  210.166   18.303  217.078   30.291   71.542   3.1462   72.260   5.1768 -0.7185593 6.057906 
1 1 1    8    7  -79 o   46.755   3.4605   90.133   13.095   89.280   15.588   92.179   24.139   46.413   4.1645   46.621   6.5308 -0.2086105 7.745629 
1 1 1    8    7  -78 o   67.459   2.3248  186.179   12.764  176.659   16.528  200.247   20.092   65.611   3.0992   69.793   3.5433 -4.181831 4.707418 
1 1 1    8    7  -77 o  129.482   1.9271  684.468   20.340  691.303   26.373  674.432   31.955  130.053   2.4877  128.366   3.0539 1.687851 3.938927 
1 1 1    8    7  -76 o  138.408   1.7501  781.794   19.745  769.580   24.070  806.922   34.523  137.277   2.1510  140.435   3.0158 -3.158035 3.704273 
1 1 1    8    7  -75 o  110.939   1.7737  502.249   16.040  498.172   19.618  510.470   27.859  110.452   2.1789  111.663   3.0636 -1.210381 3.759403 
1 1 1    8    7  -74 o   67.457   2.1241  185.961   11.665  197.918   14.653  165.267   19.277   69.549   2.5891   63.402   3.7467 6.147831 4.554281 
1 1 1    8    7  -73 o   82.089   2.1153  275.270   14.143  276.461   15.711  270.179   32.472   82.245   2.3459   80.915   4.9467 1.329636 5.474765 
1 1 1    8    7  -72 o  103.320   1.9753  435.665   16.637  431.090   18.488  455.139   38.142  102.758   2.2071  105.224   4.4570 -2.465141 4.973549 
1 1 1    8    7  -71 o  172.624   1.9898  1216.09   27.999  1227.10   31.396  1173.29   61.881  173.377   2.2215  169.060   4.4943 4.317505 5.013409 
1 1 1    8    7  -70 o   92.034   2.0430  345.660   15.327  345.542   17.068  346.151   34.837   92.004   2.2758   91.739   4.6740 0.2656021 5.198616 
1 1 1    8    7  -69 o  133.789   1.9198  730.305   20.937  752.860   23.683  649.634   44.790  135.822   2.1391  125.833   4.3733 9.989647 4.868460 
1 1 1    8    7  -68 o  305.251   2.4014  3803.66   59.754  3751.84   72.476  3913.63  105.587  303.048   2.9339  309.138   4.1901 -6.090546 5.115130 
1 1 1    8    7  -67 o  118.828   1.7691  575.971   17.136  577.269   20.886  573.299   29.971  118.939   2.1542  118.412   3.1078 0.5273056 3.781413 
1 1 1    8    7  -66 o  104.755   1.7913  447.604   15.296  453.302   18.744  436.243   26.467  105.399   2.1816  103.285   3.1473 2.114807 3.829501 
1 1 1    8    7  -65 o  118.999   1.7657  577.575   17.128  578.815   20.966  575.089   29.697  119.106   2.1595  118.617   3.0740 0.4889069 3.756661 
1 1 1    8    7  -64 o   58.174   2.6499  138.428   12.533  135.731   16.079  142.603   20.008   57.532   3.4443   58.891   4.1953 -1.359192 5.428061 
1 1 1    8    7  -63 o  148.636   1.9761  901.157   23.943  871.434   30.204  951.420   39.277  146.126   2.5357  152.630   3.1569 -6.503906 4.049170 
1 1 1    8    7  -62 o   32.842   2.8267   44.353   7.4938   66.320   15.586   37.748   8.5466   39.953   4.8873   30.191   3.5399 9.761730 6.034660 
1 1 1    8    7  -61 o  252.115   1.9758  2592.51   40.605  2581.40   54.589  2606.28   60.752  251.499   2.6627  252.670   2.9497 -1.171249 3.973759 
1 1 1    8    7  -60 o  270.808   2.0612  2991.40   45.500  3044.83   61.952  2928.81   67.043  273.127   2.7826  267.830   3.0708 5.296448 4.144022 
1 1 1    8    7  -59 o  264.531   2.0128  2854.16   43.401  2832.53   58.243  2881.16   65.083  263.448   2.7121  265.659   3.0054 -2.211060 4.048253 
1 1 1    8    7  -58 o   25.779   3.2278   27.557   6.6345   25.129   12.241   28.567   7.8946   24.286   6.1716   26.169   3.8129 -1.883249 7.254421 
1 1 1    8    7  -57 o  125.918   1.6003  646.498   16.426  649.523   22.307  642.914   24.277  126.189   2.1686  125.536   2.3724 0.6533737 3.214200 
1 1 1    8    7  -56 o  117.682   1.4107  564.636   13.532  554.128   20.356  572.957   18.114  116.558   2.1425  118.532   1.8748 -1.974060 2.846943 
1 1 1    8    7  -55 o   72.347   1.5358  213.407   9.0571  189.809   14.138  229.833   11.795   68.160   2.5491   75.047   1.9298 -6.886482 3.197126 
1 1 1    8    7  -54 o  197.378   1.5788  1588.43   25.401  1551.67   36.472  1623.06   35.398  195.039   2.2940  199.484   2.1769 -4.444534 3.162474 
1 1 1    8    7  -53 o  184.716   1.9067  1391.40   28.709  1352.59   66.844  1400.18   31.791  181.897   4.5082  185.287   2.1049 -3.390060 4.975330 
1 1 1    8    7  -52 o  131.294   1.5945  702.843   17.065  705.871   31.675  701.605   20.257  131.518   2.9545  131.169   1.8946 0.3493958 3.509788 
1 1 1    8    7  -51 o  136.555   1.5904  760.282   17.703  723.023   31.949  776.789   21.266  133.109   2.9445  138.019   1.8902 -4.910049 3.499021 
1 1 1    8    7  -50 o   55.597   1.8745  126.187   8.4831  143.045   17.645  121.119   9.6746   59.073   3.6826   54.452   2.1841 4.621468 4.281550 
1 1 1    8    7  -49 o   94.417   1.7044  363.475   13.118  396.424   34.062  357.738   14.214   98.412   4.2561   93.665   1.8617 4.746864 4.645452 
1 1 1    8    7  -48 o  105.222   1.4695  451.382   12.604  441.680   20.443  457.331   16.009  104.061   2.4100  105.905   1.8544 -1.844048 3.040872 
1 1 1    8    7  -47 o   96.623   1.8624  380.685   14.669   0.0000   0.0000  380.685   14.669  ?   ?    96.623   1.8624 0.000000 1.862435 
1 1 1    8    7  -46 o  103.810   1.4665  439.339   12.409  432.026   20.229  443.751   15.713  102.918   2.4113  104.321   1.8478 -1.402992 3.037895 
1 1 1    8    7  -45 o  126.365   1.7147  651.058   17.663  642.498   24.247  660.737   25.782  125.511   2.3699  127.276   2.4850 -1.764664 3.433902 
1 1 1    8    7  -44 o  175.156   1.5773  1250.80   22.520  1240.93   30.499  1262.63   33.395  174.442   2.1449  175.952   2.3284 -1.509903 3.165715 
1 1 1    8    7  -43 o   78.577   1.5340  251.719   9.8256  270.069   14.263  235.148   13.555   81.351   2.1528   75.904   2.1930 5.447365 3.073078 
1 1 1    8    7  -42 o  150.092   1.5023  918.395   18.381  905.513   24.958  933.664   27.172  149.018   2.0546  151.312   2.2030 -2.293182 3.012391 
1 1 1    8    7  -41 o  137.488   1.5161  770.637   16.992  780.494   22.904  758.573   25.339  138.351   2.0310  136.386   2.2792 1.964767 3.052812 
1 1 1    8    7  -40 o  184.743   1.6373  1391.46   24.657  1394.94   32.839  1386.95   37.331  184.953   2.1782  184.409   2.4834 0.5447540 3.303318 
1 1 1    8    7  -39 o  182.366   1.6322  1355.87   24.264  1352.22   32.293  1360.59   36.770  182.100   2.1755  182.650   2.4696 -0.5498505 3.291204 
1 1 1    8    7  -38 o  234.511   1.7076  2242.15   32.643  2236.12   46.653  2247.94   45.690  234.158   2.4442  234.779   2.3874 -0.6210022 3.416667 
1 1 1    8    7  -37 o  160.092   1.4431  1044.81   18.832  1023.15   27.077  1065.11   26.210  158.405   2.0970  161.625   1.9894 -3.219757 2.890520 
1 1 1    8    7  -36 f  128.902   1.3886  677.347   14.591  656.825   21.079  696.225   20.217  126.921   2.0374  130.676   1.8979 -3.754845 2.784465 
1 1 1    8    7  -35 o  191.880   1.6605  1501.00   25.972  1489.06   40.842  1509.10   33.652  191.077   2.6222  192.380   2.1459 -1.303085 3.388338 
1 1 1    8    7  -34 o  108.480   1.3821  479.713   12.221  472.757   17.919  485.764   16.712  107.679   2.0414  109.154   1.8782 -1.474464 2.774030 
1 1 1    8    7  -33 o  107.104   1.3828  467.621   12.073  455.121   17.618  478.685   16.575  105.652   2.0458  108.356   1.8766 -2.703773 2.776115 
1 1 1    8    7  -32 o  319.654   2.1019  4166.10   54.768  4261.91   79.277  4078.63   75.750  323.244   3.0087  316.223   2.9387 7.021057 4.205740 
1 1 1    8    7  -31 o  399.927   2.5104  6522.19   81.839  6557.20  116.704  6488.31  114.795  400.892   3.5713  398.785   3.5314 2.106995 5.022445 
1 1 1    8    7  -30 o   99.810   1.4130  406.087   11.496  403.238   16.879  408.552   15.700   99.450   2.0822  100.105   1.9240 -0.6557388 2.835002 
1 1 1    8    7  -29 o  364.612   2.3271  5420.60   69.164  5418.37   98.291  5422.79   97.340  364.460   3.3085  364.611   3.2751 -0.1516724 4.655372 
1 1 1    8    7  -28 o  185.360   1.5191  1400.60   22.954  1393.00   32.954  1407.75   31.990  184.840   2.1871  185.818   2.1120 -0.9781952 3.040387 
1 1 1    8    7  -27 o  145.084   1.4828  858.050   17.536  865.700   27.017  852.482   23.051  145.714   2.2746  144.604   1.9556 1.109909 2.999706 
1 1 1    8    7  -26 o  327.658   2.2763  4377.23   60.796  4321.79   92.206  4419.87   80.864  325.500   3.4752  329.206   3.0134 -3.706299 4.599678 
1 1 1    8    7  -25 o  246.304   2.0072  2473.23   40.298  2471.57   69.589  2474.06   49.430  246.158   3.4681  246.330   2.4617 -0.1717224 4.252959 
1 1 1    8    7  -24 o  132.952   1.5704  720.550   17.019  734.160   29.376  713.675   20.880  134.182   2.6858  132.311   1.9360 1.870941 3.310796 
1 1 1    8    7  -23 o   30.793   3.0420   39.046   7.5362   41.874   12.947   37.596   9.2682   31.615   5.2049   30.112   3.8649 1.502466 6.482909 
1 1 1    8    7  -22 o  137.488   1.7131  770.568   19.199  770.337   30.384  770.722   24.770  137.450   2.7119  137.494   2.2101 -0.4421997E-01 3.498370 
1 1 1    8    7  -21 o  155.025   1.6237  979.656   20.519  933.590   28.638  1028.26   29.415  151.324   2.3216  158.812   2.2722 -7.487839 3.248495 
1 1 1    8    7  -20 o  254.712   2.2526  2644.99   46.771  2716.88   75.867  2600.92   59.401  258.094   3.6061  252.558   2.8853 5.535934 4.618348 
1 1 1    8    7  -19 o   88.121   1.8000  316.546   12.930  320.101   21.349  314.487   16.249   88.552   2.9618   87.800   2.2722 0.7519302 3.732992 
1 1 1    8    7  -18 o  172.006   1.8531  1206.06   25.982  1162.05   40.942  1235.74   33.619  168.815   2.9752  174.100   2.3689 -5.285034 3.803138 
1 1 1    8    7  -17 o  224.167   2.0915  2048.53   38.218  2087.18   61.568  2024.31   48.746  226.233   3.3386  222.822   2.6838 3.411011 4.283550 
1 1 1    8    7  -16 o  331.682   2.2988  4484.98   62.152  4559.96   96.177  4431.23   81.442  334.384   3.5285  329.656   3.0307 4.727356 4.651420 
1 1 1    8    7  -15 o  380.155   2.5640  5892.00   79.453  5892.07  121.451  5891.94  105.052  380.077   3.9201  380.108   3.3905 -0.3109741E-01 5.182872 
1 1 1    8    7  -14 f  304.340   2.1544  3775.89   53.446  3769.64   81.690  3780.57   70.670  304.044   3.2961  304.504   2.8471 -0.4602051 4.355471 
1 1 1    8    7  -13 o  274.931   2.3765  3081.52   53.260  3340.71   88.935  2936.59   66.504  286.201   3.8121  268.366   3.0401 17.83566 4.875869 
1 1 1    8    7  -12 o  423.100   2.8052  7298.70   96.750  7577.68  152.364  7110.21  125.239  431.005   4.3367  417.548   3.6796 13.45703 5.687398 
1 1 1    8    7  -11 o  144.538   1.6109  851.568   18.979  913.864   33.999  823.366   22.876  149.714   2.7859  142.120   1.9746 7.594101 3.414700 
1 1 1    8    7  -10 o  125.654   1.5815  643.584   16.198  640.242   28.068  645.253   19.835  125.314   2.7477  125.813   1.9340 -0.4997025 3.360123 
1 1 1    8    7   -9 o  421.837   3.0215  7255.46  103.898  7310.79  181.088  7228.31  126.853  423.277   5.2484  421.007   3.6964 2.270264 6.419434 
1 1 1    8    7   -8 o  331.303   2.4806  4474.75   66.990  4496.49  116.523  4464.01   81.873  332.021   4.3054  330.884   3.0355 1.136902 5.267882 
1 1 1    8    7   -7 o  215.481   1.8685  1892.72   32.821  2010.19   58.829  1839.64   39.547  222.035   3.2504  212.430   2.2838 9.604263 3.972526 
1 1 1    8    7   -6 o  297.370   2.2888  3604.90   55.481  3638.86   96.679  3588.22   67.746  298.703   3.9706  296.665   2.8014 2.038086 4.859405 
1 1 1    8    7   -5 o  597.243   4.5187 14550.13  219.986 14527.13  347.429 14565.52  284.220  596.402   7.1465  597.394   5.8366 -0.9924927 9.226989 
1 1 1    8    7   -4 o  388.949   3.4555  6168.78  109.556  6115.86  153.945  6223.09  155.946  387.185   4.8776  390.563   4.8983 -3.377747 6.912668 
1 1 1    8    7   -3 o  220.557   2.3109  1983.07   41.547  1954.16   58.278  2012.95   59.246  218.919   3.2658  222.188   3.2712 -3.268890 4.622307 
1 1 1    8    7   -2 o   55.283   2.2961  124.803   10.325  134.154   16.262  118.488   13.364   57.251   3.5014   53.821   3.0586 3.429901 4.649169 
1 1 1    8    7   -1 o  353.963   2.8615  5108.15   82.565  5093.87  130.126  5117.77  106.821  353.383   4.5174  354.258   3.6991 -0.8754578 5.838672 
1 1 1    8    7    0 o  187.970   2.1459  1440.33   32.881  1428.10   46.129  1452.97   46.881  187.153   3.0237  188.775   3.0466 -1.622131 4.292388 
1 1 1    8    7    1 o  522.879   3.6522 11149.04  155.667 11475.94  225.461 10851.25  215.190  530.343   5.2153  515.717   5.1189 14.62634 7.307669 
1 1 1    8    7    2 o  329.665   2.4736  4430.56   66.471  4399.06   93.575  4462.64   94.439  328.452   3.4951  330.816   3.5021 -2.364746 4.947738 
1 1 1    8    7    3 o  292.459   2.2646  3486.79   53.988  3522.80   77.019  3452.00   75.700  293.935   3.2145  290.967   3.1917 2.968048 4.529849 
1 1 1    8    7    4 o  585.244   4.0489 13969.03  193.156 14043.59  274.491 13895.89  271.855  586.609   5.7404  583.520   5.7154 3.089722 8.100497 
1 1 1    8    7    5 o  348.464   2.5822  4950.38   73.346  4891.39  102.850  5011.42  104.627  346.335   3.6431  350.558   3.6614 -4.222961 5.165080 
1 1 1    8    7    6 o  263.942   2.1097  2839.90   45.391  2789.20   63.484  2892.93   64.927  261.552   2.9776  266.371   2.9902 -4.818939 4.219907 
1 1 1    8    7    7 o  196.855   1.6557  1579.60   26.569  1628.24   41.300  1545.26   34.703  199.848   2.5352  194.695   2.1866 5.152328 3.347914 
1 1 1    8    7    8 o  212.493   1.7173  1840.56   29.745  1840.91   45.482  1840.29   39.320  212.496   2.6257  212.468   2.2703 0.2783203E-01 3.471120 
1 1 1    8    7    9 o  170.212   1.5649  1180.94   21.712  1183.84   33.309  1178.80   28.631  170.408   2.3979  170.051   2.0655 0.3578339 3.164856 
1 1 1    8    7   10 o  121.226   1.5863  599.021   15.675  585.252   27.313  605.784   19.142  119.811   2.7966  121.905   1.9263 -2.094299 3.395854 
1 1 1    8    7   11 o  240.710   1.9870  2361.94   38.988  2396.72   68.226  2345.08   47.509  242.433   3.4524  239.839   2.4301 2.594406 4.221901 
1 1 1    8    7   12 o  337.328   2.3295  4638.91   64.054  4685.53   98.737  4605.03   84.169  338.963   3.5735  336.064   3.0725 2.899475 4.712775 
1 1 1    8    7   13 o  236.797   1.8213  2285.73   35.155  2317.72   54.278  2262.61   46.140  238.424   2.7928  235.583   2.4027 2.840332 3.684115 
1 1 1    8    7   14 f   60.743   1.7953  150.539   8.8798  167.705   13.971  138.904   11.502   64.079   2.6806   58.320   2.4247 5.758884 3.614537 
1 1 1    8    7   15 o  172.274   1.5644  1209.75   21.969  1215.90   33.832  1205.27   28.888  172.697   2.4033  171.947   2.0610 0.7503815 3.166014 
1 1 1    8    7   16 o  150.134   1.5013  918.777   18.373  899.335   27.925  933.616   24.396  148.526   2.3065  151.335   1.9777 -2.809448 3.038291 
1 1 1    8    7   17 o  202.768   1.6757  1675.98   27.698  1679.55   42.446  1673.33   36.552  202.966   2.5656  202.597   2.2133 0.3681488 3.388318 
1 1 1    8    7   18 o  108.239   1.7352  477.576   15.310  511.637   25.136  457.488   19.303  112.019   2.7527  105.933   2.2354 6.086517 3.546070 
1 1 1    8    7   19 o  167.164   2.3425  1139.25   31.919   0.0000   0.0000  1139.25   31.919  ?   ?   167.164   2.3425 0.000000 2.342477 
1 1 1    8    7   20 o  297.813   2.5108  3616.12   60.954  3655.73   97.680  3590.86   78.004  299.360   4.0029  296.737   3.2249 2.622498 5.140328 
1 1 1    8    7   21 o  565.427   4.2982 13044.08  198.105 13403.36  320.894 12822.82  251.823  572.696   6.8739  560.423   5.5124 12.27332 8.811182 
1 1 1    8    7   22 o  261.085   2.0935  2778.96   44.554  2687.57   61.907  2877.16   64.172  256.724   2.9583  265.624   2.9638 -8.900177 4.187529 
1 1 1    8    7   23 o  183.444   1.8781  1371.84   28.084  1389.80   44.873  1360.28   36.007  184.610   2.9819  182.656   2.4184 1.953934 3.839289 
1 1 1    8    7   24 o  279.597   2.1843  3187.15   49.782  3237.05   87.161  3162.98   60.648  281.693   3.7959  278.515   2.6713 3.178101 4.641636 
1 1 1    8    7   25 o  104.199   1.5618  442.592   13.266  430.734   22.948  448.543   16.257  102.740   2.7425  104.893   1.9014 -2.153069 3.337165 
1 1 1    8    7   26 o  135.779   1.4698  751.509   16.268  730.873   24.949  766.773   21.457  133.888   2.2860  137.144   1.9194 -3.256073 2.984901 
1 1 1    8    7   27 o  227.325   1.7790  2106.67   32.966  2132.42   51.065  2088.28   43.165  228.675   2.7395  226.312   2.3399 2.362900 3.602768 
1 1 1    8    7   28 o  158.425   1.5236  1023.12   19.676  1016.49   30.316  1027.95   25.862  157.892   2.3555  158.788   1.9981 -0.8966675 3.088805 
1 1 1    8    7   29 o  317.418   2.2242  4108.04   57.549  4112.91   88.265  4104.44   75.900  317.525   3.4102  317.235   2.9351 0.2905884 4.499356 
1 1 1    8    7   30 o   46.576   2.0793   88.624   7.8745   89.114   12.640   88.313   10.067   46.619   3.3484   46.459   2.6694 0.1596565 4.282248 
1 1 1    8    7   31 o  229.207   1.7876  2141.78   33.400  2137.38   51.295  2145.02   44.007  228.930   2.7487  229.358   2.3538 -0.4280243 3.618853 
1 1 1    8    7   32 o  130.566   1.4620  694.938   15.560  691.413   24.101  697.458   20.375  130.218   2.2705  130.794   1.9111 -0.5764923 2.967766 
1 1 1    8    7   33 o  177.130   1.5816  1279.04   22.836  1239.96   34.702  1308.90   30.329  174.376   2.4414  179.170   2.0766 -4.794739 3.205080 
1 1 1    8    7   34 o  351.933   2.4128  5050.79   69.219  5075.03  106.378  5033.00   91.156  352.649   3.7006  351.243   3.1838 1.405823 4.881679 
1 1 1    8    7   35 o  115.890   1.3980  547.492   13.207  542.524   19.532  551.677   17.926  115.350   2.0773  116.323   1.8905 -0.9730911 2.808752 
1 1 1    8    7   36 f  138.909   1.4071  786.592   15.933  747.939   22.810  823.422   22.265  135.437   2.0661  142.111   1.9220 -6.674057 2.821850 
1 1 1    8    7   37 o  138.638   1.3991  783.536   15.811  776.648   23.075  789.632   21.709  138.012   2.0511  139.165   1.9137 -1.152725 2.805233 
1 1 1    8    7   38 o  223.183   1.7850  2030.83   32.473  2066.39   51.511  2007.38   41.833  225.073   2.8076  221.866   2.3131 3.207825 3.637738 
1 1 1    8    7   39 o  159.007   1.4462  1030.71   18.744  1012.74   27.109  1047.16   25.946  157.595   2.1103  160.255   1.9862 -2.659683 2.897949 
1 1 1    8    7   40 o  195.635   1.6854  1560.40   26.877  1520.90   35.445  1613.83   41.225  193.120   2.2516  198.917   2.5424 -5.797455 3.396147 
1 1 1    8    7   41 o  185.640   1.6559  1405.02   25.058  1419.90   33.636  1386.47   37.564  186.598   2.2113  184.374   2.4994 2.223770 3.337227 
1 1 1    8    7   42 o   96.904   1.8795  382.882   14.846  384.426   16.736  377.181   32.157   97.094   2.1146   96.019   4.1180 1.075150 4.629250 
1 1 1    8    7   43 o  197.998   2.0003  1598.57   32.284  1641.11   43.557  1546.70   48.093  200.579   2.6640  194.701   3.0302 5.878937 4.034758 
1 1 1    8    7   44 o   91.468   1.9541  341.152   14.570  306.560   21.766  369.236   19.612   86.623   3.0875   95.111   2.5319 -8.487892 3.992905 
1 1 1    8    7   45 o  167.505   2.0995  1144.18   28.666  1120.48   42.728  1163.58   38.658  165.704   3.1634  168.882   2.8081 -3.178909 4.229927 
1 1 1    8    7   46 o   54.534   2.2579  121.494   10.015   93.542   19.075  132.133   11.768   47.574   4.9931   56.858   2.5455 -9.284275 5.604558 
1 1 1    8    7   47 o   83.382   1.8646  283.494   12.673  299.203   23.212  276.822   15.127   85.554   3.3347   82.356   2.2554 3.198616 4.025850 
1 1 1    8    7   48 o  323.029   2.6978  4256.98   71.037  4279.40  114.922  4243.12   90.368  323.630   4.3563  322.406   3.4386 1.223541 5.549876 
1 1 1    8    7   49 o  268.744   2.1688  2945.48   47.511  2964.85   68.658  2927.68   65.813  269.534   3.1249  267.852   3.0143 1.682556 4.341764 
1 1 1    8    7   50 o  142.473   1.8201  827.698   21.138  790.831   28.291  874.287   31.803  139.236   2.4926  146.390   2.6652 -7.153519 3.649162 
1 1 1    8    7   51 o  118.273   1.7405  570.382   16.781  575.691   28.057  567.425   20.938  118.777   2.8978  117.952   2.1777 0.8254242 3.624886 
1 1 1    8    7   52 o   65.287   2.0037  173.991   10.651  166.897   19.168  177.159   12.810   63.822   3.7003   65.859   2.3901 -2.037109 4.405128 
1 1 1    8    7   53 o  247.907   2.2425  2506.74   45.317  2470.68   72.048  2530.34   58.292  245.974   3.5933  249.012   2.8718 -3.038651 4.599897 
1 1 1    8    7   54 o  147.024   1.8018  881.449   21.594  885.741   35.664  878.964   27.134  147.319   2.9698  146.795   2.2676 0.5236511 3.736571 
1 1 1    8    7   55 o  105.363   1.7699  452.682   15.201  415.841   25.525  472.927   18.922  100.885   3.1076  107.680   2.1557 -6.795021 3.782111 
1 1 1    8    7   56 o   94.812   1.9907  366.619   15.386  370.272   35.773  365.790   17.042   95.038   4.6316   94.698   2.2078 0.3395996 5.130882 
1 1 1    8    7   57 o  259.463   2.1624  2745.98   45.735  2707.88   55.556  2826.09   80.560  257.606   2.6457  263.012   3.7576 -5.405975 4.595540 
1 1 1    8    7   58 o  138.540   1.7801  782.699   20.103  776.346   24.498  795.793   35.173  137.958   2.1785  139.616   3.0905 -1.658844 3.781168 
1 1 1    8    7   59 o  183.151   1.6911  1367.88   25.248  1365.49   34.367  1370.69   37.215  182.950   2.3045  183.283   2.4909 -0.3332214 3.393393 
1 1 1    8    7   60 o  117.678   1.6455  564.701   15.784  567.724   22.569  561.806   22.083  117.962   2.3471  117.347   2.3086 0.6144485 3.292224 
1 1 1    8    7   61 o   29.121   3.5210   35.146   8.1887   40.623   14.265   32.455   10.000   30.969   5.8655   27.805   4.5710 3.164869 7.436267 
1 1 1    8    7   62 o  228.553   2.1814  2130.99   40.640  2106.22   53.610  2164.45   62.313  227.141   2.8955  230.200   3.3208 -3.059311 4.405798 
1 1 1    8    7   63 o  109.749   1.6687  491.193   14.928  475.354   22.817  503.047   19.739  107.921   2.5937  111.043   2.1807 -3.121536 3.388600 
1 1 1    8    7   64 o  104.780   1.6544  447.733   14.130  438.751   21.863  454.176   18.517  103.679   2.5869  105.509   2.1531 -1.830276 3.365702 
1 1 1    8    7   65 o   39.175   3.1587   63.099   10.001   59.421   12.224   70.545   17.395   37.903   4.0175   41.136   5.3113 -3.233753 6.659619 
1 1 1    8    7   66 o  217.445   2.1647  1929.31   38.369  1856.96   48.580  2049.29   62.556  213.247   2.7947  223.911   3.4273 -10.66351 4.422336 
1 1 1    8    7   67 o   95.575   1.8439  372.628   14.366  376.238   17.527  365.241   25.074   96.016   2.2394   94.478   3.2607 1.538422 3.955654 
1 1 1    8    7   68 o  101.674   1.9812  421.786   16.420  421.101   18.310  424.599   37.116  101.578   2.2113  101.692   4.4885 -0.1133347 5.003664 
1 1 1    8    7   69 o  111.343   2.1505  505.944   19.518  505.944   19.518   0.0000   0.0000  111.343   2.1505  ?   ?  0.000000 2.150481 
1 1 1    8    7   70 o   20.752   5.8628   18.201   10.353   17.035   11.444   23.457   24.291   20.340   6.2767   25.575   9.1722 -5.235004 11.11418 
1 1 1    8    7   71 o   97.580   2.0068  388.588   15.963  401.269   18.026  342.511   34.362   99.144   2.2305   91.241   4.6353 7.903252 5.143990 
1 1 1    8    7   72 o  153.998   1.7682  967.611   22.196  962.248   27.084  978.583   38.735  153.529   2.1641  154.701   3.0717 -1.171738 3.757494 
1 1 1    8    7   73 o   41.848   2.9916   71.968   10.138   82.380   12.374   50.707   17.682   44.735   3.4191   34.462   6.5333 10.27309 7.373906 
1 1 1    8    7   74 o  203.341   1.9157  1687.55   31.753  1702.88   39.177  1658.18   54.208  204.191   2.3538  201.289   3.3038 2.901367 4.056482 
1 1 1    8    7   75 o  153.581   1.9269  962.770   24.123  977.961   31.453  941.069   37.593  154.710   2.4941  151.673   3.0406 3.037491 3.932632 
1 1 1    8    7   76 o   14.692   5.5342   6.5546   9.0221   20.853   11.220 -19.5997   15.175   22.097   6.0522   11.880   5.6623 10.21707 8.288024 
1 1 1    8    7   77 o   11.876   5.1224  -0.8702   9.0261 -14.1952   11.259   23.102   15.101   10.308   4.9028   23.491   7.2030 -13.18292 8.713231 
1 1 1    8    7   78 o  118.182   1.9533  570.311   18.817  583.148   24.661  552.422   29.113  119.429   2.5332  116.114   3.0785 3.315170 3.986781 
1 1 1    8    7   79 o  133.253   1.9489  725.134   21.169  743.133   23.986  661.734   45.017  134.863   2.1819  126.720   4.3646 8.142548 4.879552 
1 1 1    8    7   80 o   27.043   5.1370   31.213   10.910   32.233   12.422   27.773   22.821   27.376   5.7498   26.298   8.9255 1.077602 10.61717 
1 1 1    8    7   81 o   58.694   2.6016  141.264   12.416  149.713   14.782  121.024   22.880   60.366   3.0136   53.789   5.2866 6.577515 6.085216 
1 1 1    8    7   82 f  111.037   1.6914  503.458   15.309  492.419   19.805  519.845   24.131  109.739   2.2140  112.679   2.6272 -2.940132 3.435703 
1 1 1    8    7   83 o   17.005   5.3754   11.885   8.3407   8.3142   10.756   17.271   13.210   16.141   6.0504   20.619   6.7870 -4.477606 9.092357 
1 1 1    8    7   84 o   40.342   2.7643   67.030   9.0355   68.848   11.611   64.239   14.387   40.757   3.5297   39.128   4.5983 1.628857 5.796838 
1 1 1    8    7   85 o   71.329   1.8658  208.115   10.839  221.746   14.194  189.050   16.787   73.549   2.3707   67.775   3.0463 5.774315 3.860036 
1 1 1    8    7   86 o   56.718   2.0936  131.822   9.6629  126.421   12.677  139.311   14.928   55.422   2.8153   58.113   3.1633 -2.691372 4.234655 
1 1 1    8    7   87 o   48.992   2.4977   98.690   9.9417   91.104   13.675  107.195   14.479   46.840   3.6094   50.853   3.5145 -4.013020 5.037830 
1 1 1    8    7   88 o   45.290   2.6103   84.500   9.5960   86.925   13.398   81.946   13.751   45.716   3.6250   44.323   3.8438 1.392643 5.283523 
1 1 1    8    7   89 o  108.187   1.7570  478.810   15.495  478.256   21.931  479.362   21.896  107.923   2.4929  108.050   2.4860 -0.1269302 3.520579 
1 1 1    8    7   90 o   74.164   1.9585  225.447   11.830  214.562   16.624  236.613   16.837   72.127   2.8330   75.779   2.7301 -3.652397 3.934441 
1 1 1    8    7   91 o   27.517   3.6187   31.937   7.9203   35.073   10.588   27.953   11.935   28.549   4.7142   25.101   5.9281 3.447960 7.574087 
1 1 1    8    7   92 o   31.320   3.1609   40.987   7.9595   39.825   10.556   42.517   12.118   30.535   4.3652   31.393   4.8948 -0.8589001 6.558525 
1 1 1    8    7   93 o   45.884   2.3281   86.798   8.6793   74.487   11.428  103.578   13.341   42.233   3.3470   49.858   3.3013 -7.624977 4.701134 
1 1 1    8    7   94 o   65.353   1.8482  175.272   9.8358  175.637   13.081  174.798   14.919   65.248   2.4639   64.970   2.8239 0.2785873 3.747650 
1 1 1    8    7   95 o   55.361   2.1610  126.207   9.7332  127.270   13.686  125.118   13.845   55.316   3.0471   54.822   3.1109 0.4943581 4.354568 
1 1 1    8    7   96 o   21.232   5.1602   20.085   8.8420   13.522   14.646   23.849   11.091   18.912   7.0662   22.967   5.8951 -4.054506 9.202380 
1 1 1    8    7   97 o   43.261   2.8186   77.903   9.8854   62.864   16.181   86.859   12.487   37.788   5.4070   45.483   3.3923 -7.695740 6.383070 
1 1 1    8    7   98 o   38.556   2.8171   62.000   8.7927   80.641   13.020   46.372   11.922   43.662   3.6929   32.674   4.6036 10.98812 5.901740 
1 1 1    8    7   99 o   24.517   4.5814   26.454   8.8191   8.0713   14.154   38.120   11.275   16.794   6.7535   29.423   4.8715 -12.62957 8.327114 
1 1 1    8    7  100 o   36.271   3.1692   55.367   9.2760   66.035   14.851   48.543   11.878   38.900   4.7843   33.426   4.4714 5.474190 6.548478 
1 1 1    8    7  101 o   15.710   5.5056   10.067   8.7084   8.1885   13.782   11.315   11.235   16.621   6.6711   16.947   6.2149 -0.3256950 9.117451 
1 1 1    8    7  102 o   10.004   4.5836  -4.8947   8.4401 -10.2381   13.347  -1.3345   10.895   11.891   5.5567   12.476   5.4991 -0.5857601 7.817781 
1 1 1    8    7  103 o   52.440   2.5027  114.405   10.667  112.149   17.186  115.819   13.605   51.013   4.1692   52.429   3.1987 -1.415623 5.254865 
1 1 1    8    7  104 o   10.497   4.6653  -1.8607   8.0016  -4.0260   11.453   0.2041   11.184   12.041   5.4473   12.973   5.6484 -0.9324951 7.847131 
1 1 1    8    7  105 o   22.133   4.8524   22.268   8.5126   19.696   11.964   24.906   12.115   20.405   6.4362   22.806   6.3056 -2.400387 9.010342 
1 1 1    8    7  106 o   16.975   5.1813   13.138   7.8253   13.859   9.5965   11.708   13.519   17.472   5.7861   17.313   6.7111 0.1590023 8.861073 
1 1 1    8    7  107 o   19.589   5.0346   17.828   8.0825   33.333   9.9601 -12.0714   13.831   27.156   4.6676   11.604   5.4945 15.55223 7.209496 
1 1 1    8    7  108 f   34.175   2.9340   49.680   8.0945   50.581   10.526   48.376   12.663   33.976   3.8694   32.545   4.9271 1.430908 6.264852 
1 1 1    8    7  109 o   41.236   2.7173   71.921   9.0828   82.913   11.118   49.860   15.750   44.039   3.1171   31.886   6.2832 12.15268 7.013891 
1 1 1    8    7  110 o   14.845   5.2962   9.5723   8.0881  -1.0585   9.7492   33.043   14.486   11.558   5.1424   25.232   6.8628 -13.67456 8.575692 
1 1 1    8    7  111 o   12.909   5.1578   5.4204   8.2003   14.581   9.9504 -13.9714   14.477   17.398   5.8937   11.392   5.4570 6.005758 8.032149 
1 1 1    8    7  112 o   16.935   5.1901   13.797   7.8415   10.435   10.270   18.498   12.144   15.505   5.8899   19.012   6.5096 -3.507491 8.778719 
1 1 1    8    7  113 o   22.157   5.3218   24.068   9.4908   19.883   10.380   45.413   23.439   19.748   5.9549   26.316   9.0428 -6.567606 10.82746 
1 1 1    8    7  114 o   41.707   2.9629   75.002   10.007   70.654   11.924   85.360   18.405   39.865   3.7120   41.867   5.5280 -2.002094 6.658660 
1 1 1    8    7  115 o   17.003   5.5942   14.313   8.9752   10.126   10.676   24.404   16.574   15.296   5.9543   20.654   7.5526 -5.357394 9.617480 
1 1 1    8    7  116 o   30.012   3.9930   40.952   9.5263   37.208   11.424   49.496   17.258   27.577   5.2743   29.818   7.1855 -2.241467 8.913502 
1 1 1    8    7  117 o   17.044   5.6392   14.623   9.1158   10.366   10.845   24.869   16.827   15.304   5.9886   20.539   7.5931 -5.234945 9.670485 
1 1 1    8    7  118 o   34.329   3.5681   52.588   9.8393   51.113   11.619   56.327   18.501   33.115   4.4141   31.493   7.3427 1.621624 8.567327 
1 1 1    8    7  119 f   12.778   5.3046   4.9818   9.0811   2.4725   10.754   11.217   16.952   12.631   5.5182   16.511   7.0693 -3.880490 8.968018 
1 1 1    8    7  120 o   13.026   5.5071   4.7760   10.064   4.3897   11.005   6.7491   24.872   13.234   5.6816   16.830   7.7682 -3.595860 9.624162 
1 1 1    8    7  121 o   17.804   6.4129   17.044   11.889   3.1352   17.072   30.142   16.567   14.686   6.6467   22.052   7.6015 -7.365791 10.09761 
1 1 1    8    7  122 o   13.673   6.1542   2.0303   14.404  -3.6650   26.779   4.3489   17.086   15.688   7.4898   14.861   6.6946 0.8278389 10.04560 
1 1 1    8    7  123 o   21.022   7.0719   26.393   14.326   47.356   27.476   18.566   16.789   23.874   9.4732   18.099   7.3278 5.775377 11.97662 
1 1 1    8    7  124 o   13.929   5.9133   6.4526   11.684 -12.7310   16.526   25.623   16.520   11.919   5.7405   20.265   7.5178 -8.346886 9.458872 
1 1 1    8    7  125 o   22.753   6.3606   28.688   12.253   25.230   17.328   32.147   17.329   20.063   7.6437   22.356   7.7710 -2.293890 10.90020 
1 1 1    8    8    0 o  299.029   3.2585  3645.67   79.427  3754.25  140.368  3594.53   96.333  303.348   5.6767  296.900   3.9804 6.447327 6.933110 
1 1 1    8    8    1 o  296.593   2.2909  3586.49   55.386  3541.97   94.957  3609.45   68.186  294.651   3.9535  297.516   2.8116 -2.865509 4.851330 
1 1 1    8    8    2 o  266.743   2.1297  2900.79   46.307  3044.36   82.676  2835.17   55.898  273.186   3.7127  263.690   2.6005 9.495209 4.532865 
1 1 1    8    8    3 o  119.142   1.7367  578.657   16.867  583.996   26.536  575.038   21.848  119.674   2.7202  118.761   2.2568 0.9128647 3.534462 
1 1 1    8    8    4 o   97.374   1.7684  386.526   14.036  355.518   21.614  409.141   18.458   93.329   2.8444  100.176   2.2604 -6.847168 3.633171 
1 1 1    8    8    5 o  426.391   3.7422  7416.65  130.067  7361.79  182.784  7472.93  185.124  424.624   5.2808  427.813   5.3085 -3.189209 7.487775 
1 1 1    8    8    6 o  186.379   2.1459  1416.21   32.602  1455.30   46.699  1379.05   45.536  188.906   3.0327  183.890   3.0378 5.015991 4.292483 
1 1 1    8    8    7 o  293.986   2.7944  3524.36   66.964  3682.46   97.494  3383.16   92.137  300.429   3.9811  287.966   3.9251 12.46332 5.590681 
1 1 1    8    8    8 f  395.552   3.1389  6381.07  101.208  6437.90  131.643  6298.94  158.265  397.222   4.0656  392.810   4.9427 4.411865 6.399992 
1 1 1    8    8    9 o   63.462   1.8960  164.334   9.7974  161.398   13.924  167.212   13.788   62.854   2.7242   63.982   2.6494 -1.128284 3.800076 
1 1 1    8    8   10 o  171.028   1.6917  1192.41   23.584  1179.06   33.223  1205.95   33.485  170.052   2.3968  171.980   2.3885 -1.928391 3.383731 
1 1 1    8    8   11 o  395.375   2.8655  6374.82   92.353  6281.67  129.143  6472.33  132.122  392.366   4.0378  398.272   4.0697 -5.906494 5.732879 
1 1 1    8    8   12 o  237.151   1.8322  2292.75   35.418  2326.93   54.606  2267.93   46.535  238.874   2.8044  235.843   2.4206 3.031021 3.704559 
1 1 1    8    8   13 o   91.619   1.5264  342.174   11.399  344.487   17.544  340.484   14.996   91.888   2.3442   91.387   2.0131 0.5011444 3.089966 
1 1 1    8    8   14 o   84.658   1.6503  292.168   11.389  301.581   19.484  287.282   14.037   85.951   2.7846   83.943   2.0514 2.007591 3.458594 
1 1 1    8    8   15 o  128.433   1.4708  672.405   15.398  680.602   23.704  666.422   20.252  129.200   2.2507  127.853   1.9432 1.346931 2.973543 
1 1 1    8    8   16 o  104.858   1.5811  448.217   13.514  439.687   23.143  452.631   16.647  103.799   2.7376  105.368   1.9382 -1.568268 3.354259 
1 1 1    8    8   17 o  174.606   1.6980  1242.86   24.167  1233.45   41.549  1247.68   29.711  173.906   2.9310  174.934   2.0835 -1.028763 3.596055 
1 1 1    8    8   18 o  254.189   2.0581  2634.29   42.644  2580.23   72.679  2662.67   52.662  251.484   3.5454  255.532   2.5282 -4.048645 4.354473 
1 1 1    8    8   19 o  134.668   1.4985  739.286   16.450  714.047   25.119  758.235   21.766  132.332   2.3287  136.374   1.9580 -4.041962 3.042437 
1 1 1    8    8   20 o  449.924   2.9649  8256.64  108.739  8210.78  165.557  8291.43  144.205  448.454   4.5289  450.747   3.9247 -2.292938 5.992885 
1 1 1    8    8   21 o  204.022   1.6936  1696.94   28.166  1639.27   42.355  1742.66   37.714  200.492   2.5916  206.733   2.2380 -6.240448 3.424183 
1 1 1    8    8   22 o  258.682   1.9348  2728.24   40.798  2748.84   62.821  2713.22   53.653  259.599   2.9687  257.938   2.5518 1.661682 3.914683 
1 1 1    8    8   23 o  152.297   1.5177  945.539   18.841  948.394   29.007  943.455   24.780  152.505   2.3334  152.118   1.9984 0.3876343 3.072177 
1 1 1    8    8   24 o  284.740   2.2290  3306.00   51.736  3258.16   89.290  3330.19   63.477  282.542   3.8769  285.748   2.7252 -3.206024 4.738876 
1 1 1    8    8   25 o  166.990   1.6863  1136.86   22.955  1110.23   39.865  1150.06   28.076  164.977   2.9644  167.947   2.0508 -2.970291 3.604630 
1 1 1    8    8   26 o  242.385   2.0108  2395.45   39.729  2476.19   70.963  2358.59   47.948  246.334   3.5341  240.490   2.4459 5.844604 4.297897 
1 1 1    8    8   27 o  257.654   2.0863  2706.86   43.817  2720.90   76.854  2700.10   53.335  258.206   3.6514  257.305   2.5429 0.9008179 4.449624 
1 1 1    8    8   28 o   56.636   1.8428  130.919   8.4962  125.884   13.199  134.482   11.102   55.474   2.9291   57.376   2.3790 -1.902172 3.773519 
1 1 1    8    8   29 o  226.835   1.7853  2097.83   33.011  2087.71   50.404  2105.44   43.683  226.237   2.7332  227.218   2.3585 -0.9811707 3.610094 
1 1 1    8    8   30 o  112.144   1.4667  512.695   13.407  533.975   21.002  498.056   17.419  114.430   2.2515  110.522   1.9334 3.907875 2.967754 
1 1 1    8    8   31 o  136.083   1.4838  754.955   16.459  754.077   25.403  755.590   21.608  135.982   2.2917  136.129   1.9473 -0.1471100 3.007326 
1 1 1    8    8   32 o  178.817   1.5108  1303.57   22.022  1283.17   31.467  1323.15   30.832  177.388   2.1762  180.134   2.0997 -2.746078 3.024004 
1 1 1    8    8   33 o  168.970   1.4832  1163.94   20.429  1166.14   29.571  1161.94   28.257  169.106   2.1452  168.805   2.0535 0.3012543 2.969665 
1 1 1    8    8   34 o  310.350   2.0639  3927.54   52.212  3920.93   74.363  3933.98   73.325  310.012   2.9427  310.532   2.8967 -0.5199890 4.129214 
1 1 1    8    8   35 o   71.505   1.6008  208.456   9.3307  214.636   14.280  203.850   12.326   72.504   2.4195   70.670   2.1422 1.833221 3.231543 
1 1 1    8    8   36 o  160.294   1.6822  1047.57   21.980  1048.78   32.257  1046.53   30.031  160.355   2.4678  160.191   2.2998 0.1638641 3.373284 
1 1 1    8    8   37 o  226.358   1.9393  2089.27   35.782  2096.85   51.814  2082.36   49.474  226.712   2.8038  225.936   2.6863 0.7758179 3.882964 
1 1 1    8    8   38 o  161.079   1.6954  1057.88   22.261  1017.71   32.372  1093.91   30.662  157.957   2.5142  163.775   2.2968 -5.817093 3.405313 
1 1 1    8    8   39 f  144.893   1.6057  855.943   18.965  885.488   33.816  842.386   22.907  147.323   2.8159  143.730   1.9551 3.592987 3.428061 
1 1 1    8    8   40 o  118.675   1.4489  574.169   14.017  561.634   21.809  582.992   18.296  117.349   2.2799  119.572   1.8771 -2.223289 2.953213 
1 1 1    8    8   41 o   65.477   1.6414  174.908   8.7538  176.081   14.091  174.170   11.171   65.646   2.6387   65.318   2.1008 0.3273544 3.372834 
1 1 1    8    8   42 o   40.684   2.1933   67.701   7.2469   76.191   12.140   63.001   9.0329   43.061   3.4885   39.192   2.8468 3.868977 4.502650 
1 1 1    8    8   43 o  131.105   1.4715  700.769   15.726  670.228   24.207  723.073   20.687  128.189   2.3166  133.162   1.9058 -4.973450 2.999769 
1 1 1    8    8   44 o  133.090   1.4176  722.135   15.379  719.363   22.684  724.493   20.922  132.812   2.0953  133.291   1.9256 -0.4790344 2.845740 
1 1 1    8    8   45 o  119.418   1.5468  581.421   15.057  556.271   20.029  614.112   22.835  116.789   2.1039  122.704   2.2830 -5.914871 3.104563 
1 1 1    8    8   46 o  191.461   1.7994  1494.77   28.083  1430.55   38.847  1565.05   40.645  187.260   2.5450  195.865   2.5457 -8.605270 3.599655 
1 1 1    8    8   47 o  168.228   1.7730  1154.00   24.313  1119.43   35.029  1186.13   33.772  165.645   2.5943  170.519   2.4297 -4.874313 3.554361 
1 1 1    8    8   48 o  147.470   1.5527  886.695   18.666  900.479   30.533  878.470   23.586  148.568   2.5212  146.768   1.9715 1.799255 3.200483 
1 1 1    8    8   49 o   41.519   2.3152   70.534   7.8043   69.516   14.227   70.972   9.3342   41.015   4.3201   41.613   2.7675 -0.5983315 5.130505 
1 1 1    8    8   50 o   63.855   1.8107  166.408   9.4153  172.927   16.881  163.464   11.344   65.006   3.1955   63.267   2.2030 1.738804 3.881237 
1 1 1    8    8   51 o  119.671   1.5435  583.923   15.057  549.491   24.689  604.315   19.000  116.047   2.6099  121.730   1.9148 -5.683037 3.236985 
1 1 1    8    8   52 o  140.962   1.5730  810.203   18.075  817.326   29.752  806.035   22.755  141.530   2.5789  140.581   1.9857 0.9485474 3.254821 
1 1 1    8    8   53 o   37.227   2.7002   56.851   8.1381   51.584   15.462   58.869   9.5709   35.051   5.6002   37.844   3.1306 -2.793072 6.415833 
1 1 1    8    8   54 f  149.643   1.8005  913.217   21.962  914.083   31.838  912.430   30.335  149.665   2.6097  149.538   2.4886 0.1269531 3.606051 
1 1 1    8    8   55 o   96.483   1.7308  379.627   13.613  406.755   23.693  366.260   16.632   99.777   2.9163   94.755   2.1533 5.021935 3.625081 
1 1 1    8    8   56 o  212.816   2.1384  1847.52   37.096  1802.79   88.917  1856.95   40.819  209.777   5.1999  213.339   2.3472 -3.562088 5.705073 
1 1 1    8    8   57 o  135.041   1.6168  743.631   17.798  711.012   28.586  764.279   22.744  131.990   2.6569  136.883   2.0384 -4.893234 3.348762 
1 1 1    8    8   58 o  189.725   1.8616  1468.12   28.791  1450.31   41.802  1484.18   39.711  188.496   2.7206  190.701   2.5546 -2.205063 3.731938 
1 1 1    8    8   59 o  136.622   1.5981  761.175   17.798  755.491   24.744  767.268   25.618  136.076   2.2307  137.128   2.2918 -1.052505 3.198229 
1 1 1    8    8   60 o  159.510   1.6180  1037.62   21.038  1028.20   28.763  1048.47   30.852  158.742   2.2228  160.289   2.3612 -1.546265 3.242881 
1 1 1    8    8   61 o  200.314   1.8634  1636.77   30.427  1618.74   38.147  1668.31   50.446  199.159   2.3498  202.092   3.0623 -2.933655 3.859916 
1 1 1    8    8   62 o   91.187   1.6950  339.146   12.599  328.572   17.119  351.644   18.610   89.694   2.3434   92.782   2.4628 -3.088020 3.399552 
1 1 1    8    8   63 o   21.557   3.9357   19.607   6.6610   18.154   11.728   20.299   8.0930   20.925   6.3342   21.840   4.6862 -0.9152069 7.879243 
1 1 1    8    8   64 o   95.429   1.7994  371.500   13.997  377.955   20.659  366.023   19.031   96.169   2.6379   94.654   2.4686 1.515488 3.612847 
1 1 1    8    8   65 o  187.396   1.8172  1432.67   27.758  1399.57   40.264  1462.65   38.320  185.116   2.6683  189.268   2.4838 -4.151306 3.645406 
1 1 1    8    8   66 o   57.178   1.9380  133.554   9.0196  123.302   15.943  138.380   10.938   54.778   3.5903   58.175   2.3112 -3.397171 4.269926 
1 1 1    8    8   67 o   70.852   2.6134  205.333   15.068  206.342   21.224  204.309   21.395   70.901   3.6849   70.543   3.7340 0.3577194 5.246094 
1 1 1    8    8   68 o   30.112   4.6025   38.064   10.939   22.690   14.074   61.527   17.387   23.244   6.9168   38.223   5.7589 -14.97913 9.000401 
1 1 1    8    8   69 o  117.555   1.9453  564.006   18.640  542.927   23.913  596.653   29.759  115.281   2.5447  120.754   3.0257 -5.473083 3.953515 
1 1 1    8    8   70 o   93.828   2.0596  359.392   15.752  351.070   20.501  371.388   24.613   92.641   2.7177   95.223   3.1754 -2.582909 4.179606 
1 1 1    8    8   71 o   37.375   3.6888   57.791   11.092   53.253   14.251   64.766   17.667   35.623   5.0488   39.219   5.6926 -3.595459 7.608971 
1 1 1    8    8   72 o  155.352   2.2022  985.676   27.887  987.846   32.402  979.474   54.768  155.468   2.5568  154.342   4.3575 1.126022 5.052273 
1 1 1    8    8   73 o  139.533   2.1965  795.256   24.983  784.821   28.813  826.866   50.150  138.562   2.5510  141.767   4.3448 -3.204483 5.038383 
1 1 1    8    8   74 o   55.396   3.0785  126.024   13.847  134.494   16.116  102.136   27.064   57.175   3.4742   49.038   6.9662 8.137383 7.784510 
1 1 1    8    8   75 o   89.273   2.4128  326.024   17.542  322.511   20.471  335.733   34.031   88.728   2.8340   90.147   4.6468 -1.419487 5.442792 
1 1 1    8    8   76 o  101.105   2.0847  417.625   17.181  402.006   22.122  441.370   27.276   99.073   2.7419  103.717   3.2302 -4.644348 4.237015 
1 1 1    8    8   77 o  104.171   2.3386  443.722   19.858  423.058   28.459  463.330   27.723  101.467   3.4458  106.250   3.2046 -4.782532 4.705664 
1 1 1    8    8   78 o   43.070   3.5978   76.754   12.516   69.893   16.740   85.451   18.848   40.757   5.1538   45.109   5.2220 -4.352165 7.336950 
1 1 1    8    8   79 o  208.131   2.1496  1771.21   36.469  1792.38   47.626  1741.21   56.704  209.140   2.7936  205.876   3.3789 3.263855 4.384179 
1 1 1    8    8   80 o   96.312   1.8556  379.039   14.568  384.175   18.139  369.707   24.450   96.897   2.2965   94.836   3.1672 2.061096 3.912198 
1 1 1    8    8   81 o   49.764   2.7431  101.848   11.084  100.275   14.594  103.992   17.040   49.204   3.6649   49.985   4.2215 -0.7805901 5.590386 
1 1 1    8    8   82 o   88.323   2.0391  319.107   14.681  317.864   19.221  320.848   22.746   87.994   2.6828   88.282   3.1659 -0.2884293 4.149754 
1 1 1    8    8   83 o   77.212   2.1118  244.202   13.279  253.718   17.441  231.080   20.481   78.573   2.7273   74.819   3.3668 3.754738 4.332778 
1 1 1    8    8   84 o   19.857   5.2711   17.118   8.6733   25.226   12.124   8.6193   12.413   23.962   6.1701   16.831   6.4553 7.130804 8.929803 
1 1 1    8    8   85 o   33.474   3.2181   46.615   8.6729   49.089   11.322   43.101   13.493   34.136   4.1541   31.590   5.4358 2.545973 6.841371 
1 1 1    8    8   86 o   14.727   5.2598   7.9673   7.9795   11.437   10.380   2.9544   12.477   17.191   6.0117   14.908   6.2057 2.282193 8.640090 
1 1 1    8    8   87 o   31.378   3.3268   41.153   8.3798   34.233   11.237   49.822   12.578   28.109   5.0915   34.196   4.6312 -6.086569 6.882675 
1 1 1    8    8   88 o   19.880   4.9737   17.316   8.0393   23.595   10.810   9.5454   12.026   23.076   5.7641   16.890   6.3833 6.185217 8.600661 
1 1 1    8    8   89 o   67.769   1.9090  188.399   10.535  186.166   14.014  191.300   15.976   67.192   2.5633   68.008   2.8885 -0.8159256 3.861830 
1 1 1    8    8   90 o   53.878   2.5348  119.854   11.101  114.616   17.671  123.268   14.268   52.106   4.1959   54.426   3.2306 -2.319431 5.295546 
1 1 1    8    8   91 o   92.039   1.9695  347.685   14.776  378.582   23.605  327.778   18.948   95.541   3.0348   89.094   2.6118 6.446419 4.003952 
1 1 1    8    8   92 o   41.463   2.7604   71.393   9.2766   71.392   12.885   71.395   13.366   41.092   3.8932   41.033   4.0489 0.5850983E-01 5.616937 
1 1 1    8    8   93 f   64.422   2.0275  170.740   10.634  151.687   14.612  192.191   15.505   60.391   2.9774   68.070   2.8002 -7.679565 4.087348 
1 1 1    8    8   94 o   15.550   5.1209   10.141   7.5202   6.1264   9.9930   15.384   11.419   14.563   5.7335   18.887   6.3134 -4.323756 8.528317 
1 1 1    8    8   95 o   38.278   2.6587   60.970   8.2442   57.886   10.958   64.992   12.515   36.944   3.6879   39.042   3.9883 -2.097088 5.432082 
1 1 1    8    8   96 o   42.043   2.4849   73.372   8.4782   64.720   11.148   85.239   13.056   39.112   3.5349   44.898   3.5976 -5.785439 5.043578 
1 1 1    8    8   97 o   42.790   2.4210   75.973   8.4102   72.410   11.269   80.452   12.636   41.431   3.3656   43.586   3.5883 -2.154953 4.919677 
1 1 1    8    8   98 o   39.187   2.6084   63.983   8.2847   57.205   10.847   73.470   12.834   36.648   3.6809   41.499   3.8374 -4.851322 5.317431 
1 1 1    8    8   99 o   23.919   4.0970   24.994   7.7009   28.805   10.286   20.133   11.616   25.275   5.1671   20.855   6.3021 4.419584 8.149561 
1 1 1    8    8  100 o   12.271   5.0835   2.7075   8.3157   5.9843   10.687  -2.3220   13.240   14.617   5.8716   13.417   5.9797 1.199863 8.380509 
1 1 1    8    8  101 o   26.832   3.9056   31.287   8.2919   29.893   10.177   34.041   14.302   25.718   5.0348   26.651   6.6145 -0.9327049 8.312647 
1 1 1    8    8  102 o   44.296   2.6007   82.061   9.3494   82.774   11.624   80.755   15.734   44.176   3.2508   42.829   4.5777 1.347088 5.614556 
1 1 1    8    8  103 o   8.2831   3.9311  -7.8133   7.1587  -7.8025   9.4195  -7.8281   11.014   9.9032   4.6409   10.887   5.0746 -0.9840889 6.876705 
1 1 1    8    8  104 o   30.369   3.4566   39.768   8.4047   33.654   10.299   51.956   14.542   27.225   4.8171   33.477   5.5210 -6.252470 7.327097 
1 1 1    8    8  105 o   11.142   4.7793   0.9625   7.7748  -0.7588   9.5798   4.2840   13.307   11.651   5.1449   14.775   6.2930 -3.124895 8.128485 
1 1 1    8    8  106 o   46.402   2.3099   90.075   8.7095   81.756   11.480  101.359   13.370   43.655   3.2492   48.516   3.4022 -4.860928 4.704502 
1 1 1    8    8  107 o   27.366   3.6563   32.928   7.9524   29.906   10.610   36.801   12.013   25.066   5.3551   27.775   5.5008 -2.708900 7.676977 
1 1 1    8    8  108 o   9.6830   4.4586  -4.3251   8.1235  -2.0935   11.540  -6.5170   11.437   12.168   5.4900   11.156   5.1901 1.012198 7.554950 
1 1 1    8    8  109 o   10.025   4.5204  -2.1429   7.8117   1.0789   10.220  -6.6705   12.115   12.283   5.3725   11.411   5.3197 0.8722124 7.560670 
1 1 1    8    8  110 o   18.622   5.4950   17.184   8.9129   9.8098   10.432   37.123   17.153   15.228   5.8974   25.438   7.6517 -10.21066 9.660631 
1 1 1    8    8  111 f   10.527   4.7614  -2.1449   8.7431   0.5190   10.198  -9.5341   16.985   12.013   5.3066   12.897   6.1014 -0.8837805 8.086251 
1 1 1    8    8  112 o   27.088   4.4670   34.165   9.5198   32.165   11.299   39.058   17.675   25.375   5.6115   25.721   7.7740 -0.3452053 9.587731 
1 1 1    8    8  113 o   12.285   5.2753   2.7300   9.4909   3.5546   10.503  -0.9430   22.165   12.958   5.5565   15.580   7.2403 -2.621511 9.126753 
1 1 1    8    8  114 o   28.409   4.3226   37.471   9.6947   37.737   11.490   36.814   18.064   27.719   5.2778   24.459   7.9293 3.259609 9.525162 
1 1 1    8    8  115 o   12.325   5.2287   3.5597   9.1242  -5.3125   10.784   25.910   17.116   10.799   5.0294   20.755   7.6608 -9.956194 9.164159 
1 1 1    8    8  116 o   12.362   5.3874   2.3127   10.197   0.5289   12.616   5.6733   17.316   12.860   5.7764   15.361   6.8429 -2.501120 8.955028 
1 1 1    8    8  117 o   12.274   5.5134   0.0546   11.495   2.2207   15.378  -2.6879   17.303   14.102   6.3522   13.776   6.4004 0.3264790 9.017545 
1 1 1    8    8  118 o   15.307   6.1901   10.307   11.964   20.801   16.457  -1.4544   17.423   18.932   7.3861   13.959   6.4638 4.973016 9.815041 
1 1 1    8    8  119 o   19.190   6.0498   19.855   10.572   34.408   13.348  -4.6339   17.315   24.947   6.4998   13.382   6.2780 11.56461 9.036600 
1 1 1    8    8  120 o   10.112   4.8757 -12.1547   12.001  -6.2380   16.457 -18.8751   17.539   12.813   6.0447   11.575   5.6525 1.238065 8.275791 
1 1 1    8    8  121 o   23.555   6.9837   32.768   14.368   42.250   17.320   11.841   25.731   25.980   7.6586   17.298   7.9540 8.682116 11.04181 
1 1 1    8    8  122 o   17.532   6.4834   16.848   12.270   2.0594   17.170   32.281   17.540   14.347   6.5599   22.229   7.8118 -7.882483 10.20078 
1 1 1    8    8  123 o   13.680   5.9307   5.0373   12.222   9.5896   17.027   0.1990   17.554   15.859   6.9357   14.152   6.5300 1.706897 9.526022 
1 1 1    9    0 -133 o   7.6134   5.3424 -10.1791   12.638 -10.1791   12.638 -10.1791   12.638   7.6134   5.3424   7.6134   5.3424 -0.000000 0.000000 
1 1 1    9    0 -132 o   10.228   6.3062   5.5122   10.282   5.5122   10.282   5.5122   10.282   10.228   6.3062   10.228   6.3062 0.000000 0.000000 
1 1 1    9    0 -131 o   10.366   6.3756   5.7682   10.448   5.7682   10.448   5.7682   10.448   10.366   6.3756   10.366   6.3756 0.000000 0.000000 
1 1 1    9    0 -130 o   16.897   7.9651   20.334   12.370   20.334   12.370   20.334   12.370   16.897   7.9651   16.897   7.9651 0.000000 0.000000 
1 1 1    9    0 -129 o   10.504   6.6323   4.8452   12.092   4.8452   12.092   4.8452   12.092   10.504   6.6323   10.504   6.6323 -0.000000 0.000000 
1 1 1    9    0 -128 o   27.357   7.7487   41.569   14.964   41.569   14.964   41.569   14.964   27.357   7.7487   27.357   7.7487 -0.000000 0.000000 
1 1 1    9    0 -127 o   21.850   7.3101   27.721   11.609   27.721   11.609   27.721   11.609   21.850   7.3101   21.850   7.3101 -0.000000 0.000000 
1 1 1    9    0 -126 o   8.8810   5.8948  -0.7007   11.322  -0.7007   11.322  -0.7007   11.322   8.8810   5.8948   8.8810   5.8948 0.000000 0.000000 
1 1 1    9    0 -125 o   6.8767   4.7991  -7.7758   9.8056  -7.7758   9.8056  -7.7758   9.8056   6.8767   4.7991   6.8767   4.7991 -0.000000 0.000000 
1 1 1    9    0 -124 o   27.943   5.2201   37.040   10.674   37.040   10.674   37.040   10.674   27.943   5.2201   27.943   5.2201 0.000000 0.000000 
1 1 1    9    0 -123 o   29.435   4.7826   39.980   10.567   39.980   10.567   39.980   10.567   29.435   4.7826   29.435   4.7826 0.000000 0.000000 
1 1 1    9    0 -122 o   8.0008   5.3868  -2.7254   10.069  -2.7254   10.069  -2.7254   10.069   8.0008   5.3868   8.0008   5.3868 -0.000000 0.000000 
1 1 1    9    0 -121 o   7.2127   4.9948  -6.8299   10.090  -6.8299   10.090  -6.8299   10.090   7.2127   4.9948   7.2127   4.9948 -0.000000 0.000000 
1 1 1    9    0 -120 f   69.037   2.5148  198.031   14.110  198.031   14.110  198.031   14.110   69.037   2.5148   69.037   2.5148 -0.000000 0.000000 
1 1 1    9    0 -119 o   35.508   4.0715   55.193   11.384   55.193   11.384   55.193   11.384   35.508   4.0715   35.508   4.0715 0.000000 0.000000 
1 1 1    9    0 -118 o   38.199   3.7836   62.929   11.497   62.929   11.497   62.929   11.497   38.199   3.7836   38.199   3.7836 0.000000 0.000000 
1 1 1    9    0 -117 o   13.067   7.0524   11.170   10.445   11.170   10.445   11.170   10.445   13.067   7.0524   13.067   7.0524 0.000000 0.000000 
1 1 1    9    0 -116 o   41.154   3.6004   72.162   11.856   72.162   11.856   72.162   11.856   41.154   3.6004   41.154   3.6004 -0.000000 0.000000 
1 1 1    9    0 -115 o   8.0432   5.4257  -3.7180   10.308  -3.7180   10.308  -3.7180   10.308   8.0432   5.4257   8.0432   5.4257 0.000000 0.000000 
1 1 1    9    0 -114 o   17.887   8.0421   20.360   12.541   20.360   12.541   20.360   12.541   17.887   8.0421   17.887   8.0421 0.000000 0.000000 
1 1 1    9    0 -113 o   23.477   7.5172   29.815   12.681   29.815   12.681   29.815   12.681   23.477   7.5172   23.477   7.5172 0.000000 0.000000 
1 1 1    9    0 -112 o   6.9470   5.0033 -23.5801   14.077 -23.5801   14.077 -23.5801   14.077   6.9470   5.0033   6.9470   5.0033 -0.000000 0.000000 
1 1 1    9    0 -111 o   78.169   2.4072  251.555   15.306  251.555   15.306  251.555   15.306   78.169   2.4072   78.169   2.4072 -0.000000 0.000000 
1 1 1    9    0 -110 o   43.489   3.4092   79.542   11.910   79.542   11.910   79.542   11.910   43.489   3.4092   43.489   3.4092 0.000000 0.000000 
1 1 1    9    0 -109 o   33.920   4.2391   49.930   11.226   49.930   11.226   49.930   11.226   33.920   4.2391   33.920   4.2391 0.000000 0.000000 
1 1 1    9    0 -108 o   8.1704   5.4511  -2.7098   9.8950  -2.7098   9.8950  -2.7098   9.8950   8.1704   5.4511   8.1704   5.4511 0.000000 0.000000 
1 1 1    9    0 -107 o   25.669   7.0387   33.227   12.732   33.227   12.732   33.227   12.732   25.669   7.0387   25.669   7.0387 0.000000 0.000000 
1 1 1    9    0 -106 o   22.328   7.6877   27.334   12.591   27.334   12.591   27.334   12.591   22.328   7.6877   22.328   7.6877 -0.000000 0.000000 
1 1 1    9    0 -105 o   35.558   4.7395   55.118   13.055   55.118   13.055   55.118   13.055   35.558   4.7395   35.558   4.7395 -0.000000 0.000000 
1 1 1    9    0 -104 o   41.489   4.1299   73.136   13.626   73.136   13.626   73.136   13.626   41.489   4.1299   41.489   4.1299 -0.000000 0.000000 
1 1 1    9    0 -103 o   25.398   7.1801   32.604   12.871   32.604   12.871   32.604   12.871   25.398   7.1801   25.398   7.1801 -0.000000 0.000000 
1 1 1    9    0 -102 o   10.725   6.4807   4.8767   10.384   4.8767   10.384   4.8767   10.384   10.725   6.4807   10.725   6.4807 -0.000000 0.000000 
1 1 1    9    0 -101 o  108.412   2.1786  480.999   19.235  480.999   19.235  480.999   19.235  108.412   2.1786  108.412   2.1786 0.000000 0.000000 
1 1 1    9    0 -100 o  112.891   2.1716  521.370   19.967  521.370   19.967  521.370   19.967  112.891   2.1716  112.891   2.1716 -0.000000 0.000000 
1 1 1    9    0  -99 o   90.463   2.2886  335.057   16.852  335.057   16.852  335.057   16.852   90.463   2.2886   90.463   2.2886 -0.000000 0.000000 
1 1 1    9    0  -98 o   69.447   2.5860  197.986   14.593  197.986   14.593  197.986   14.593   69.447   2.5860   69.447   2.5860 0.000000 0.000000 
1 1 1    9    0  -97 o   81.100   3.3436  270.673   22.019  270.673   22.019  270.673   22.019   81.100   3.3436   81.100   3.3436 -0.000000 0.000000 
1 1 1    9    0  -96 o   42.377   4.1189   75.689   13.899   75.689   13.899   75.689   13.899   42.377   4.1189   42.377   4.1189 -0.000000 0.000000 
1 1 1    9    0  -95 o   9.1399   6.1036  -4.0257   12.457  -4.0257   12.457  -4.0257   12.457   9.1399   6.1036   9.1399   6.1036 -0.000000 0.000000 
1 1 1    9    0  -94 o   33.337   4.8997   48.438   12.473   48.438   12.473   48.438   12.473   33.337   4.8997   33.337   4.8997 0.000000 0.000000 
1 1 1    9    0  -93 o   86.762   2.7858  308.432   19.656  308.432   19.656  308.432   19.656   86.762   2.7858   86.762   2.7858 -0.000000 0.000000 
1 1 1    9    0  -92 o   52.240   3.1991  112.765   13.504  112.765   13.504  112.765   13.504   52.240   3.1991   52.240   3.1991 -0.000000 0.000000 
1 1 1    9    0  -91 o   76.259   2.4690  238.111   15.312  238.111   15.312  238.111   15.312   76.259   2.4690   76.259   2.4690 0.000000 0.000000 
1 1 1    9    0  -90 o   85.700   2.3364  300.368   16.294  300.368   16.294  300.368   16.294   85.700   2.3364   85.700   2.3364 -0.000000 0.000000 
1 1 1    9    0  -89 o   14.715   7.4257   13.108   11.024   13.108   11.024   13.108   11.024   14.715   7.4257   14.715   7.4257 0.000000 0.000000 
1 1 1    9    0  -88 o  117.912   2.1245  567.697   20.405  567.697   20.405  567.697   20.405  117.912   2.1245  117.912   2.1245 -0.000000 0.000000 
1 1 1    9    0  -87 o   29.891   5.1428   39.636   11.419   39.636   11.419   39.636   11.419   29.891   5.1428   29.891   5.1428 0.000000 0.000000 
1 1 1    9    0  -86 o  127.456   2.1073  663.142   21.881  663.142   21.881  663.142   21.881  127.456   2.1073  127.456   2.1073 0.000000 0.000000 
1 1 1    9    0  -85 o  195.175   2.2922  1554.51   36.456  1554.51   36.456  1554.51   36.456  195.175   2.2922  195.175   2.2922 -0.000000 0.000000 
1 1 1    9    0  -84 o   75.312   2.3796  232.053   14.576  232.053   14.576  232.053   14.576   75.312   2.3796   75.312   2.3796 0.000000 0.000000 
1 1 1    9    0  -83 o   73.873   2.3760  223.279   14.274  223.279   14.274  223.279   14.274   73.873   2.3760   73.873   2.3760 -0.000000 0.000000 
1 1 1    9    0  -82 o   74.108   2.8344  225.048   17.066  225.048   17.066  225.048   17.066   74.108   2.8344   74.108   2.8344 -0.000000 0.000000 
1 1 1    9    0  -81 o   94.517   2.5707  365.201   19.773  365.201   19.773  365.201   19.773   94.517   2.5707   94.517   2.5707 0.000000 0.000000 
1 1 1    9    0  -80 o   82.986   2.6914  281.797   18.163  281.797   18.163  281.797   18.163   82.986   2.6914   82.986   2.6914 -0.000000 0.000000 
1 1 1    9    0  -79 o  103.576   3.1180  438.874   26.271  438.874   26.271  438.874   26.271  103.576   3.1180  103.576   3.1180 -0.000000 0.000000 
1 1 1    9    0  -78 o   47.351   5.1536   94.808   19.295   94.808   19.295   94.808   19.295   47.351   5.1536   47.351   5.1536 -0.000000 0.000000 
1 1 1    9    0  -77 o  137.430   2.5041  770.988   28.032  770.988   28.032  770.988   28.032  137.430   2.5041  137.430   2.5041 -0.000000 0.000000 
1 1 1    9    0  -76 o   70.137   3.2801  201.995   18.659  201.995   18.659  201.995   18.659   70.137   3.2801   70.137   3.2801 0.000000 0.000000 
1 1 1    9    0  -75 o   80.092   2.4147  262.293   15.732  262.293   15.732  262.293   15.732   80.092   2.4147   80.092   2.4147 0.000000 0.000000 
1 1 1    9    0  -74 o   62.372   2.6158  159.482   13.246  159.482   13.246  159.482   13.246   62.372   2.6158   62.372   2.6158 0.000000 0.000000 
1 1 1    9    0  -73 o  329.588   3.0735  4431.84   82.557  4431.84   82.557  4431.84   82.557  329.588   3.0735  329.588   3.0735 0.000000 0.000000 
1 1 1    9    0  -72 o  207.720   2.3021  1759.93   38.969  1759.93   38.969  1759.93   38.969  207.720   2.3021  207.720   2.3021 0.000000 0.000000 
1 1 1    9    0  -71 o  136.063   2.0262  755.272   22.461  755.272   22.461  755.272   22.461  136.063   2.0262  136.063   2.0262 -0.000000 0.000000 
1 1 1    9    0  -70 o  180.790   2.1655  1333.17   31.904  1333.17   31.904  1333.17   31.904  180.790   2.1655  180.790   2.1655 -0.000000 0.000000 
1 1 1    9    0  -69 o   88.385   2.0963  319.026   15.084  319.026   15.084  319.026   15.084   88.385   2.0963   88.385   2.0963 0.000000 0.000000 
1 1 1    9    0  -68 o  221.949   2.3633  2009.18   42.746  2009.18   42.746  2009.18   42.746  221.949   2.3633  221.949   2.3633 -0.000000 0.000000 
1 1 1    9    0  -67 o  324.866   3.0216  4305.03   80.001  4305.03   80.001  4305.03   80.001  324.866   3.0216  324.866   3.0216 0.000000 0.000000 
1 1 1    9    0  -66 o  159.813   1.7736  1041.54   23.098  1041.54   23.098  1041.54   23.098  159.813   1.7736  159.813   1.7736 -0.000000 0.000000 
1 1 1    9    0  -65 o  151.592   1.5457  937.033   19.095  937.033   19.095  937.033   19.095  151.592   1.5457  151.592   1.5457 -0.000000 0.000000 
1 1 1    9    0  -64 o   73.498   1.6815  220.550   10.062  220.550   10.062  220.550   10.062   73.498   1.6815   73.498   1.6815 0.000000 0.000000 
1 1 1    9    0  -63 o  260.451   2.0641  2765.95   43.817  2765.95   43.817  2765.95   43.817  260.451   2.0641  260.451   2.0641 0.000000 0.000000 
1 1 1    9    0  -62 o  264.179   2.0824  2845.67   44.837  2845.67   44.837  2845.67   44.837  264.179   2.0824  264.179   2.0824 -0.000000 0.000000 
1 1 1    9    0  -61 o   48.298   1.6906   95.439   6.6374   95.439   6.6374   95.439   6.6374   48.298   1.6906   48.298   1.6906 -0.000000 0.000000 
1 1 1    9    0  -60 o  203.813   1.9649  1693.84   32.637  1693.84   32.637  1693.84   32.637  203.813   1.9649  203.813   1.9649 -0.000000 0.000000 
1 1 1    9    0  -59 o  288.534   2.4122  3394.80   56.727  3394.80   56.727  3394.80   56.727  288.534   2.4122  288.534   2.4122 0.000000 0.000000 
1 1 1    9    0  -58 f  234.250   2.3478  2237.73   44.821  2237.73   44.821  2237.73   44.821  234.250   2.3478  234.250   2.3478 -0.000000 0.000000 
1 1 1    9    0  -57 o   94.749   1.7726  366.329   13.680  366.329   13.680  366.329   13.680   94.749   1.7726   94.749   1.7726 0.000000 0.000000 
1 1 1    9    0  -56 o  271.392   2.9864  3004.10   66.048  3004.10   66.048  3004.10   66.048  271.392   2.9864  271.392   2.9864 0.000000 0.000000 
1 1 1    9    0  -55 o  305.380   2.8494  3803.08   70.917  3803.08   70.917  3803.08   70.917  305.380   2.8494  305.380   2.8494 0.000000 0.000000 
1 1 1    9    0  -54 o  279.078   2.6649  3176.03   60.612  3176.03   60.612  3176.03   60.612  279.078   2.6649  279.078   2.6649 0.000000 0.000000 
1 1 1    9    0  -53 o  277.662   3.0506  3144.33   69.028  3144.33   69.028  3144.33   69.028  277.662   3.0506  277.662   3.0506 -0.000000 0.000000 
1 1 1    9    0  -52 o  438.029   4.3995  7827.02  157.052  7827.02  157.052  7827.02  157.052  438.029   4.3995  438.029   4.3995 -0.000000 0.000000 
1 1 1    9    0  -51 o  348.295   3.1517  4946.83   89.464  4946.83   89.464  4946.83   89.464  348.295   3.1517  348.295   3.1517 -0.000000 0.000000 
1 1 1    9    0  -50 o  750.911   6.2720 23009.76  383.853 23009.76  383.853 23009.76  383.853  750.911   6.2720  750.911   6.2720 -0.000000 0.000000 
1 1 1    9    0  -49 o  482.238   4.1564  9484.26  163.360  9484.26  163.360  9484.26  163.360  482.238   4.1564  482.238   4.1564 -0.000000 0.000000 
1 1 1    9    0  -48 o  252.258   2.4870  2594.66   51.128  2594.66   51.128  2594.66   51.128  252.258   2.4870  252.258   2.4870 -0.000000 0.000000 
1 1 1    9    0  -47 o   31.724   3.0980   42.187   7.8238   42.187   7.8238   42.187   7.8238   31.724   3.0980   31.724   3.0980 0.000000 0.000000 
1 1 1    9    0  -46 o  209.274   2.2242  1785.76   37.932  1785.76   37.932  1785.76   37.932  209.274   2.2242  209.274   2.2242 -0.000000 0.000000 
1 1 1    9    0  -45 o   88.741   1.8973  321.422   13.710  321.422   13.710  321.422   13.710   88.741   1.8973   88.741   1.8973 0.000000 0.000000 
1 1 1    9    0  -44 o   53.765   2.2241  118.432   9.7096  118.432   9.7096  118.432   9.7096   53.765   2.2241   53.765   2.2241 0.000000 0.000000 
1 1 1    9    0  -43 o  726.516   7.0221 21534.90  415.773 21534.90  415.773 21534.90  415.773  726.516   7.0221  726.516   7.0221 0.000000 0.000000 
1 1 1    9    0  -42 o  225.467   2.7442  2073.05   50.418  2073.05   50.418  2073.05   50.418  225.467   2.7442  225.467   2.7442 -0.000000 0.000000 
1 1 1    9    0  -41 o  501.676   6.1250 10267.32  250.391 10267.32  250.391 10267.32  250.391  501.676   6.1250  501.676   6.1250 -0.000000 0.000000 
1 1 1    9    0  -40 o  194.917   3.1606  1549.88   50.188  1549.88   50.188  1549.88   50.188  194.917   3.1606  194.917   3.1606 -0.000000 0.000000 
1 1 1    9    0  -39 o  778.899   7.4987 24749.38  476.009 24749.38  476.009 24749.38  476.009  778.899   7.4987  778.899   7.4987 -0.000000 0.000000 
1 1 1    9    0  -38 o  369.384   3.3029  5563.09   99.433  5563.09   99.433  5563.09   99.433  369.384   3.3029  369.384   3.3029 0.000000 0.000000 
1 1 1    9    0  -37 o  120.689   2.3644  594.382   23.241  594.382   23.241  594.382   23.241  120.689   2.3644  120.689   2.3644 -0.000000 0.000000 
1 1 1    9    0  -36 f  953.168   9.1043 37069.01  707.236 37069.01  707.236 37069.01  707.236  953.168   9.1043  953.168   9.1043 0.000000 0.000000 
1 1 1    9    0  -35 o  428.393   4.3244  7483.41  150.973  7483.41  150.973  7483.41  150.973  428.393   4.3244  428.393   4.3244 -0.000000 0.000000 
1 1 1    9    0  -34 o  226.680   3.2395  2095.75   59.832  2095.75   59.832  2095.75   59.832  226.680   3.2395  226.680   3.2395 -0.000000 0.000000 
1 1 1    9    0  -33 o  121.236   2.3087  599.740   22.797  599.740   22.797  599.740   22.797  121.236   2.3087  121.236   2.3087 -0.000000 0.000000 
1 1 1    9    0  -32 o  876.895   7.2642 31360.34  519.164 31360.34  519.164 31360.34  519.164  876.895   7.2642  876.895   7.2642 0.000000 0.000000 
1 1 1    9    0  -31 o  866.894   6.4287 30644.67  454.226 30644.67  454.226 30644.67  454.226  866.894   6.4287  866.894   6.4287 -0.000000 0.000000 
1 1 1    9    0  -30 o  390.858   3.1016  6228.13   98.804  6228.13   98.804  6228.13   98.804  390.858   3.1016  390.858   3.1016 0.000000 0.000000 
1 1 1    9    0  -29 o  496.422   3.8157 10046.94  154.385 10046.94  154.385 10046.94  154.385  496.422   3.8157  496.422   3.8157 -0.000000 0.000000 
1 1 1    9    0  -28 o  691.719   5.1801 19508.60  292.042 19508.60  292.042 19508.60  292.042  691.719   5.1801  691.719   5.1801 0.000000 0.000000 
1 1 1    9    0  -27 o  336.037   2.7376  4603.52   74.976  4603.52   74.976  4603.52   74.976  336.037   2.7376  336.037   2.7376 0.000000 0.000000 
1 1 1    9    0  -26 o  805.443   5.9892 26452.04  393.177 26452.04  393.177 26452.04  393.177  805.443   5.9892  805.443   5.9892 0.000000 0.000000 
1 1 1    9    0  -25 o  610.673   4.6018 15204.17  229.045 15204.17  229.045 15204.17  229.045  610.673   4.6018  610.673   4.6018 -0.000000 0.000000 
1 1 1    9    0  -24 o  549.441   4.1721 12307.66  186.833 12307.66  186.833 12307.66  186.833  549.441   4.1721  549.441   4.1721 -0.000000 0.000000 
1 1 1    9    0  -23 o   66.652   1.8131  181.468   9.8345  181.468   9.8345  181.468   9.8345   66.652   1.8131   66.652   1.8131 -0.000000 0.000000 
1 1 1    9    0  -22 o  229.740   2.3150  2151.92   43.344  2151.92   43.344  2151.92   43.344  229.740   2.3150  229.740   2.3150 -0.000000 0.000000 
1 1 1    9    0  -21 o  246.408   2.1664  2475.30   43.506  2475.30   43.506  2475.30   43.506  246.408   2.1664  246.408   2.1664 -0.000000 0.000000 
1 1 1    9    0  -20 o  193.581   1.8840  1527.80   29.723  1527.80   29.723  1527.80   29.723  193.581   1.8840  193.581   1.8840 -0.000000 0.000000 
1 1 1    9    0  -19 o  657.826   4.9303 17642.90  264.343 17642.90  264.343 17642.90  264.343  657.826   4.9303  657.826   4.9303 -0.000000 0.000000 
1 1 1    9    0  -18 o  953.930   7.8781 37110.85  612.505 37110.85  612.505 37110.85  612.505  953.930   7.8781  953.930   7.8781 -0.000000 0.000000 
1 1 1    9    0  -17 o  584.390   5.7041 13925.96  271.663 13925.96  271.663 13925.96  271.663  584.390   5.7041  584.390   5.7041 0.000000 0.000000 
1 1 1    9    0  -16 o  184.620   2.8812  1390.29   43.336  1390.29   43.336  1390.29   43.336  184.620   2.8812  184.620   2.8812 -0.000000 0.000000 
1 1 1    9    0  -15 o  448.276   4.4843  8193.72  163.823  8193.72  163.823  8193.72  163.823  448.276   4.4843  448.276   4.4843 0.000000 0.000000 
1 1 1    9    0  -14 f  1462.24   13.852 87272.91  1650.73 87272.91  1650.73 87272.91  1650.73  1462.24   13.852  1462.24   13.852 -0.000000 0.000000 
1 1 1    9    0  -13 o   58.067   2.6345  138.276   12.411  138.276   12.411  138.276   12.411   58.067   2.6345   58.067   2.6345 -0.000000 0.000000 
1 1 1    9    0  -12 o  604.779   5.0960 14912.91  251.186 14912.91  251.186 14912.91  251.186  604.779   5.0960  604.779   5.0960 0.000000 0.000000 
1 1 1    9    0  -11 o  490.805   5.9407  9824.48  237.594  9824.48  237.594  9824.48  237.594  490.805   5.9407  490.805   5.9407 -0.000000 0.000000 
1 1 1    9    0  -10 o  531.779   6.3924 11533.67  277.007 11533.67  277.007 11533.67  277.007  531.779   6.3924  531.779   6.3924 -0.000000 0.000000 
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1 1 1    9    0   -8 o   52.166   2.3733  111.605   10.044  111.605   10.044  111.605   10.044   52.166   2.3733   52.166   2.3733 0.000000 0.000000 
1 1 1    9    0   -7 o  738.177   7.0959 22222.01  426.889 22222.01  426.889 22222.01  426.889  738.177   7.0959  738.177   7.0959 0.000000 0.000000 
1 1 1    9    0   -6 o  964.906   9.1975 37977.17  723.275 37977.17  723.275 37977.17  723.275  964.906   9.1975  964.906   9.1975 -0.000000 0.000000 
1 1 1    9    0   -5 o  292.637   3.1656  3491.76   75.493  3491.76   75.493  3491.76   75.493  292.637   3.1656  292.637   3.1656 0.000000 0.000000 
1 1 1    9    0   -4 o  1090.41   12.710 48528.36  1129.33 48528.36  1129.33 48528.36  1129.33  1090.41   12.710  1090.41   12.710 -0.000000 0.000000 
1 1 1    9    0   -3 o  606.821   5.8936 15015.64  291.463 15015.64  291.463 15015.64  291.463  606.821   5.8936  606.821   5.8936 -0.000000 0.000000 
1 1 1    9    0   -2 o  175.564   2.2966  1256.94   32.853  1256.94   32.853  1256.94   32.853  175.564   2.2966  175.564   2.2966 -0.000000 0.000000 
1 1 1    9    0   -1 o  527.256   5.1752 11335.67  222.377 11335.67  222.377 11335.67  222.377  527.256   5.1752  527.256   5.1752 0.000000 0.000000 
1 1 1    9    0    0 o   81.155   2.0695  268.962   13.670  268.962   13.670  268.962   13.670   81.155   2.0695   81.155   2.0695 -0.000000 0.000000 
1 1 1    9    0    1 o  381.257   3.8859  5926.77  120.739  5926.77  120.739  5926.77  120.739  381.257   3.8859  381.257   3.8859 0.000000 0.000000 
1 1 1    9    0    2 o  148.695   2.1468  901.747   26.008  901.747   26.008  901.747   26.008  148.695   2.1468  148.695   2.1468 -0.000000 0.000000 
1 1 1    9    0    3 o  251.657   2.8202  2582.32   57.837  2582.32   57.837  2582.32   57.837  251.657   2.8202  251.657   2.8202 -0.000000 0.000000 
1 1 1    9    0    4 o  161.198   2.2239  1059.71   29.210  1059.71   29.210  1059.71   29.210  161.198   2.2239  161.198   2.2239 -0.000000 0.000000 
1 1 1    9    0    5 o  1340.56   12.708 73338.48  1388.43 73338.48  1388.43 73338.48  1388.43  1340.56   12.708  1340.56   12.708 -0.000000 0.000000 
1 1 1    9    0    6 o  180.891   2.3460  1334.36   34.579  1334.36   34.579  1334.36   34.579  180.891   2.3460  180.891   2.3460 -0.000000 0.000000 
1 1 1    9    0    7 o  1468.48   13.905 88019.51  1664.13 88019.51  1664.13 88019.51  1664.13  1468.48   13.905  1468.48   13.905 -0.000000 0.000000 
1 1 1    9    0    8 o  788.204   7.5649 25337.17  485.944 25337.17  485.944 25337.17  485.944  788.204   7.5649  788.204   7.5649 -0.000000 0.000000 
1 1 1    9    0    9 o  733.493   8.6517 21947.33  517.127 21947.33  517.127 21947.33  517.127  733.493   8.6517  733.493   8.6517 -0.000000 0.000000 
1 1 1    9    0   11 o  890.133   10.424 32328.69  756.102 32328.69  756.102 32328.69  756.102  890.133   10.424  890.133   10.424 -0.000000 0.000000 
1 1 1    9    0   12 o  301.543   3.9529  3708.26   97.125  3708.26   97.125  3708.26   97.125  301.543   3.9529  301.543   3.9529 -0.000000 0.000000 
1 1 1    9    0   13 o  345.052   4.3879  4855.54  123.373  4855.54  123.373  4855.54  123.373  345.052   4.3879  345.052   4.3879 -0.000000 0.000000 
1 1 1    9    0   14 f  115.772   2.5192  547.078   23.748  547.078   23.748  547.078   23.748  115.772   2.5192  115.772   2.5192 -0.000000 0.000000 
1 1 1    9    0   15 o  816.575   7.8282 27194.76  520.957 27194.76  520.957 27194.76  520.957  816.575   7.8282  816.575   7.8282 0.000000 0.000000 
1 1 1    9    0   16 o  690.810   6.6694 19461.05  375.483 19461.05  375.483 19461.05  375.483  690.810   6.6694  690.810   6.6694 -0.000000 0.000000 
1 1 1    9    0   17 o  188.261   2.9204  1445.65   44.793  1445.65   44.793  1445.65   44.793  188.261   2.9204  188.261   2.9204 0.000000 0.000000 
1 1 1    9    0   18 o  250.644   2.8309  2561.59   57.823  2561.59   57.823  2561.59   57.823  250.644   2.8309  250.644   2.8309 0.000000 0.000000 
1 1 1    9    0   19 o  140.340   2.1781  803.339   24.903  803.339   24.903  803.339   24.903  140.340   2.1781  140.340   2.1781 0.000000 0.000000 
1 1 1    9    0   20 o  336.015   3.5148  4603.64   96.248  4603.64   96.248  4603.64   96.248  336.015   3.5148  336.015   3.5148 0.000000 0.000000 
1 1 1    9    0   21 o  207.987   2.5418  1763.97   43.079  1763.97   43.079  1763.97   43.079  207.987   2.5418  207.987   2.5418 0.000000 0.000000 
1 1 1    9    0   22 o   77.619   2.7407  246.481   17.292  246.481   17.292  246.481   17.292   77.619   2.7407   77.619   2.7407 0.000000 0.000000 
1 1 1    9    0   23 o  275.440   3.7234  3094.13   83.565  3094.13   83.565  3094.13   83.565  275.440   3.7234  275.440   3.7234 0.000000 0.000000 
1 1 1    9    0   24 o  540.455   6.5057 11913.53  286.513 11913.53  286.513 11913.53  286.513  540.455   6.5057  540.455   6.5057 0.000000 0.000000 
1 1 1    9    0   25 o  778.489   9.1714 24725.72  581.820 24725.72  581.820 24725.72  581.820  778.489   9.1714  778.489   9.1714 0.000000 0.000000 
1 1 1    9    0   26 o  671.225   7.9686 18379.09  435.860 18379.09  435.860 18379.09  435.860  671.225   7.9686  671.225   7.9686 -0.000000 0.000000 
1 1 1    9    0   27 o  834.822   9.8093 28436.71  667.315 28436.71  667.315 28436.71  667.315  834.822   9.8093  834.822   9.8093 0.000000 0.000000 
1 1 1    9    0   28 o   55.223   3.9350  126.190   17.503  126.190   17.503  126.190   17.503   55.223   3.9350   55.223   3.9350 -0.000000 0.000000 
1 1 1    9    0   29 o  328.051   4.2783  4389.06  114.362  4389.06  114.362  4389.06  114.362  328.051   4.2783  328.051   4.2783 -0.000000 0.000000 
1 1 1    9    0   30 o  597.440   7.1548 14559.78  348.325 14559.78  348.325 14559.78  348.325  597.440   7.1548  597.440   7.1548 0.000000 0.000000 
1 1 1    9    0   32 o  130.660   4.0966  697.959   43.534  697.959   43.534  697.959   43.534  130.660   4.0966  130.660   4.0966 0.000000 0.000000 
1 1 1    9    0   33 o  392.803   6.9938  6297.24  223.775  6297.24  223.775  6297.24  223.775  392.803   6.9938  392.803   6.9938 -0.000000 0.000000 
1 1 1    9    0   34 o  137.493   4.0900  772.646   45.748  772.646   45.748  772.646   45.748  137.493   4.0900  137.493   4.0900 -0.000000 0.000000 
1 1 1    9    0   35 o  267.114   5.2379  2912.12  113.949  2912.12  113.949  2912.12  113.949  267.114   5.2379  267.114   5.2379 0.000000 0.000000 
1 1 1    9    0   36 f  120.751   2.7766  595.263   27.297  595.263   27.297  595.263   27.297  120.751   2.7766  120.751   2.7766 0.000000 0.000000 
1 1 1    9    0   37 o  399.421   4.9996  6507.00  162.724  6507.00  162.724  6507.00  162.724  399.421   4.9996  399.421   4.9996 -0.000000 0.000000 
1 1 1    9    0   38 o  674.740   8.0068 18576.27  440.244 18576.27  440.244 18576.27  440.244  674.740   8.0068  674.740   8.0068 -0.000000 0.000000 
1 1 1    9    0   39 o   76.787   3.0846  241.503   19.237  241.503   19.237  241.503   19.237   76.787   3.0846   76.787   3.0846 -0.000000 0.000000 
1 1 1    9    0   40 o  718.243   8.5036 21052.75  497.708 21052.75  497.708 21052.75  497.708  718.243   8.5036  718.243   8.5036 -0.000000 0.000000 
1 1 1    9    0   41 o  417.996   5.1971  7126.93  177.019  7126.93  177.019  7126.93  177.019  417.996   5.1971  417.996   5.1971 0.000000 0.000000 
1 1 1    9    0   42 o   41.187   4.6398   71.751   15.069   71.751   15.069   71.751   15.069   41.187   4.6398   41.187   4.6398 -0.000000 0.000000 
1 1 1    9    0   43 o  283.176   3.8279  3270.80   88.324  3270.80   88.324  3270.80   88.324  283.176   3.8279  283.176   3.8279 -0.000000 0.000000 
1 1 1    9    0   44 o   43.711   4.2820   80.114   14.898   80.114   14.898   80.114   14.898   43.711   4.2820   43.711   4.2820 0.000000 0.000000 
1 1 1    9    0   45 o  346.561   4.4584  4899.27  125.901  4899.27  125.901  4899.27  125.901  346.561   4.4584  346.561   4.4584 0.000000 0.000000 
1 1 1    9    0   46 o  469.829   5.7577  9006.40  220.434  9006.40  220.434  9006.40  220.434  469.829   5.7577  469.829   5.7577 -0.000000 0.000000 
1 1 1    9    0   47 o  243.864   3.4793  2425.90   69.132  2425.90   69.132  2425.90   69.132  243.864   3.4793  243.864   3.4793 -0.000000 0.000000 
1 1 1    9    0   48 o   27.010   7.2560   35.492   13.804   35.492   13.804   35.492   13.804   27.010   7.2560   27.010   7.2560 -0.000000 0.000000 
1 1 1    9    0   49 o  534.443   6.4630 11658.10  281.469 11658.10  281.469 11658.10  281.469  534.443   6.4630  534.443   6.4630 0.000000 0.000000 
1 1 1    9    0   50 o  202.808   3.1531  1678.04   52.098  1678.04   52.098  1678.04   52.098  202.808   3.1531  202.808   3.1531 -0.000000 0.000000 
1 1 1    9    0   51 o  267.085   3.6888  2910.17   80.276  2910.17   80.276  2910.17   80.276  267.085   3.6888  267.085   3.6888 -0.000000 0.000000 
1 1 1    9    0   52 o  197.303   3.0962  1588.25   49.769  1588.25   49.769  1588.25   49.769  197.303   3.0962  197.303   3.0962 -0.000000 0.000000 
1 1 1    9    0   53 o  182.669   3.0024  1361.49   44.679  1361.49   44.679  1361.49   44.679  182.669   3.0024  182.669   3.0024 -0.000000 0.000000 
1 1 1    9    0   55 o  190.043   2.4497  1473.08   37.934  1473.08   37.934  1473.08   37.934  190.043   2.4497  190.043   2.4497 -0.000000 0.000000 
1 1 1    9    0   56 o  144.889   2.7404  856.788   32.340  856.788   32.340  856.788   32.340  144.889   2.7404  144.889   2.7404 0.000000 0.000000 
1 1 1    9    0   57 o  162.421   2.3141  1076.10   30.624  1076.10   30.624  1076.10   30.624  162.421   2.3141  162.421   2.3141 0.000000 0.000000 
1 1 1    9    0   58 f  415.931   3.6629  7056.95  124.166  7056.95  124.166  7056.95  124.166  415.931   3.6629  415.931   3.6629 -0.000000 0.000000 
1 1 1    9    0   59 o  119.699   1.9201  584.514   18.724  584.514   18.724  584.514   18.724  119.699   1.9201  119.699   1.9201 -0.000000 0.000000 
1 1 1    9    0   60 o  367.757   3.3048  5516.58   99.053  5516.58   99.053  5516.58   99.053  367.757   3.3048  367.757   3.3048 0.000000 0.000000 
1 1 1    9    0   61 o  148.992   1.9627  905.412   23.828  905.412   23.828  905.412   23.828  148.992   1.9627  148.992   1.9627 -0.000000 0.000000 
1 1 1    9    0   62 o  347.859   3.6405  4937.00  103.204  4937.00  103.204  4937.00  103.204  347.859   3.6405  347.859   3.6405 -0.000000 0.000000 
1 1 1    9    0   63 o  241.923   2.4430  2386.92   48.165  2386.92   48.165  2386.92   48.165  241.923   2.4430  241.923   2.4430 0.000000 0.000000 
1 1 1    9    0   64 o   8.5247   5.3473   1.5105   7.7192   1.5105   7.7192   1.5105   7.7192   8.5247   5.3473   8.5247   5.3473 -0.000000 0.000000 
1 1 1    9    0   65 o   39.566   3.1226   65.025   9.9225   65.025   9.9225   65.025   9.9225   39.566   3.1226   39.566   3.1226 0.000000 0.000000 
1 1 1    9    0   66 o   43.360   2.8124   77.628   9.8432   77.628   9.8432   77.628   9.8432   43.360   2.8124   43.360   2.8124 -0.000000 0.000000 
1 1 1    9    0   67 o   95.101   2.1026  369.264   16.281  369.264   16.281  369.264   16.281   95.101   2.1026   95.101   2.1026 0.000000 0.000000 
1 1 1    9    0   68 o  141.228   2.1890  813.762   25.187  813.762   25.187  813.762   25.187  141.228   2.1890  141.228   2.1890 0.000000 0.000000 
1 1 1    9    0   69 o  262.969   2.9553  2821.22   63.331  2821.22   63.331  2821.22   63.331  262.969   2.9553  262.969   2.9553 0.000000 0.000000 
1 1 1    9    0   70 o  367.667   3.8077  5516.90  114.089  5516.90  114.089  5516.90  114.089  367.667   3.8077  367.667   3.8077 -0.000000 0.000000 
1 1 1    9    0   71 o   83.116   2.1593  282.230   14.607  282.230   14.607  282.230   14.607   83.116   2.1593   83.116   2.1593 0.000000 0.000000 
1 1 1    9    0   72 o   69.551   2.0572  197.735   11.640  197.735   11.640  197.735   11.640   69.551   2.0572   69.551   2.0572 -0.000000 0.000000 
1 1 1    9    0   73 o   31.650   3.9768   42.769   9.8213   42.769   9.8213   42.769   9.8213   31.650   3.9768   31.650   3.9768 0.000000 0.000000 
1 1 1    9    0   74 o  203.234   2.5911  1685.20   42.909  1685.20   42.909  1685.20   42.909  203.234   2.5911  203.234   2.5911 -0.000000 0.000000 
1 1 1    9    0   75 o   62.894   2.6700  162.191   13.632  162.191   13.632  162.191   13.632   62.894   2.6700   62.894   2.6700 -0.000000 0.000000 
1 1 1    9    0   76 o   38.909   3.4648   63.221   10.779   63.221   10.779   63.221   10.779   38.909   3.4648   38.909   3.4648 -0.000000 0.000000 
1 1 1    9    0   77 o  139.404   2.0090  792.847   22.818  792.847   22.818  792.847   22.818  139.404   2.0090  139.404   2.0090 0.000000 0.000000 
1 1 1    9    0   78 o  146.467   2.0133  875.189   24.027  875.189   24.027  875.189   24.027  146.467   2.0133  146.467   2.0133 0.000000 0.000000 
1 1 1    9    0   79 o   60.308   2.2826  148.954   11.185  148.954   11.185  148.954   11.185   60.308   2.2826   60.308   2.2826 0.000000 0.000000 
1 1 1    9    0   80 o   16.770   6.3699   15.572   8.1827   15.572   8.1827   15.572   8.1827   16.770   6.3699   16.770   6.3699 -0.000000 0.000000 
1 1 1    9    0   81 o  166.837   2.0580  1135.57   27.979  1135.57   27.979  1135.57   27.979  166.837   2.0580  166.837   2.0580 -0.000000 0.000000 
1 1 1    9    0   82 o   88.403   2.0042  319.180   14.426  319.180   14.426  319.180   14.426   88.403   2.0042   88.403   2.0042 -0.000000 0.000000 
1 1 1    9    0   83 o   55.364   2.4443  125.757   10.982  125.757   10.982  125.757   10.982   55.364   2.4443   55.364   2.4443 0.000000 0.000000 
1 1 1    9    0   84 o  125.538   1.9552  643.154   19.997  643.154   19.997  643.154   19.997  125.538   1.9552  125.538   1.9552 0.000000 0.000000 
1 1 1    9    0   85 o  257.315   2.5671  2702.20   53.833  2702.20   53.833  2702.20   53.833  257.315   2.5671  257.315   2.5671 0.000000 0.000000 
1 1 1    9    0   86 o   76.136   2.0940  236.969   12.974  236.969   12.974  236.969   12.974   76.136   2.0940   76.136   2.0940 0.000000 0.000000 
1 1 1    9    0   87 o   30.894   3.7041   40.636   8.9735   40.636   8.9735   40.636   8.9735   30.894   3.7041   30.894   3.7041 0.000000 0.000000 
1 1 1    9    0   88 o   89.361   1.9925  326.192   14.497  326.192   14.497  326.192   14.497   89.361   1.9925   89.361   1.9925 0.000000 0.000000 
1 1 1    9    0   89 o  120.761   1.9562  595.306   19.245  595.306   19.245  595.306   19.245  120.761   1.9562  120.761   1.9562 0.000000 0.000000 
1 1 1    9    0   90 o   17.937   6.5093   17.530   8.7443   17.530   8.7443   17.530   8.7443   17.937   6.5093   17.937   6.5093 0.000000 0.000000 
1 1 1    9    0   91 o  138.609   2.0013  784.289   22.601  784.289   22.601  784.289   22.601  138.609   2.0013  138.609   2.0013 0.000000 0.000000 
1 1 1    9    0   92 o   12.838   6.8534   9.7600   9.7656   9.7600   9.7656   9.7600   9.7656   12.838   6.8534   12.838   6.8534 0.000000 0.000000 
1 1 1    9    0   93 o  122.417   2.2830  612.330   22.764  612.330   22.764  612.330   22.764  122.417   2.2830  122.417   2.2830 0.000000 0.000000 
1 1 1    9    0   94 o   41.619   3.3346   72.186   11.141   72.186   11.141   72.186   11.141   41.619   3.3346   41.619   3.3346 -0.000000 0.000000 
1 1 1    9    0   95 o   27.686   4.4102   33.703   9.1975   33.703   9.1975   33.703   9.1975   27.686   4.4102   27.686   4.4102 0.000000 0.000000 
1 1 1    9    0   96 o   7.9570   5.1694  -0.4883   8.0276  -0.4883   8.0276  -0.4883   8.0276   7.9570   5.1694   7.9570   5.1694 0.000000 0.000000 
1 1 1    9    0   97 o   92.793   1.9752  351.990   14.925  351.990   14.925  351.990   14.925   92.793   1.9752   92.793   1.9752 0.000000 0.000000 
1 1 1    9    0   98 o   26.310   4.3358   30.617   8.5407   30.617   8.5407   30.617   8.5407   26.310   4.3358   26.310   4.3358 0.000000 0.000000 
1 1 1    9    0   99 o  125.541   1.9535  644.058   19.980  644.058   19.980  644.058   19.980  125.541   1.9535  125.541   1.9535 0.000000 0.000000 
1 1 1    9    0  100 o  168.969   2.0978  1167.05   28.884  1167.05   28.884  1167.05   28.884  168.969   2.0978  168.969   2.0978 -0.000000 0.000000 
1 1 1    9    0  101 o   20.400   5.8777   20.946   8.4755   20.946   8.4755   20.946   8.4755   20.400   5.8777   20.400   5.8777 -0.000000 0.000000 
1 1 1    9    0  102 o  169.236   2.0985  1171.32   28.939  1171.32   28.939  1171.32   28.939  169.236   2.0985  169.236   2.0985 -0.000000 0.000000 
1 1 1    9    0  103 o   85.301   1.9981  297.925   13.876  297.925   13.876  297.925   13.876   85.301   1.9981   85.301   1.9981 -0.000000 0.000000 
1 1 1    9    0  104 o  124.323   1.9531  632.354   19.782  632.354   19.782  632.354   19.782  124.323   1.9531  124.323   1.9531 -0.000000 0.000000 
1 1 1    9    0  105 o   93.375   1.9721  357.028   14.996  357.028   14.996  357.028   14.996   93.375   1.9721   93.375   1.9721 -0.000000 0.000000 
1 1 1    9    0  106 o   32.633   3.4508   45.294   8.9217   45.294   8.9217   45.294   8.9217   32.633   3.4508   32.633   3.4508 -0.000000 0.000000 
1 1 1    9    0  107 o   73.639   2.1177  222.558   12.688  222.558   12.688  222.558   12.688   73.639   2.1177   73.639   2.1177 -0.000000 0.000000 
1 1 1    9    0  108 o  137.161   2.3207  771.856   25.930  771.856   25.930  771.856   25.930  137.161   2.3207  137.161   2.3207 -0.000000 0.000000 
1 1 1    9    0  109 o   9.2526   5.8767   1.6502   9.6543   1.6502   9.6543   1.6502   9.6543   9.2526   5.8767   9.2526   5.8767 -0.000000 0.000000 
1 1 1    9    0  110 o   87.258   2.3775  313.111   16.882  313.111   16.882  313.111   16.882   87.258   2.3775   87.258   2.3775 -0.000000 0.000000 
1 1 1    9    0  111 o   79.108   2.1279  257.059   13.699  257.059   13.699  257.059   13.699   79.108   2.1279   79.108   2.1279 0.000000 0.000000 
1 1 1    9    0  112 o   14.213   6.5690   12.584   8.3854   12.584   8.3854   12.584   8.3854   14.213   6.5690   14.213   6.5690 -0.000000 0.000000 
1 1 1    9    0  113 o   26.693   4.3630   31.934   8.7321   31.934   8.7321   31.934   8.7321   26.693   4.3630   26.693   4.3630 0.000000 0.000000 
1 1 1    9    0  114 o   23.217   5.2703   25.793   8.6957   25.793   8.6957   25.793   8.6957   23.217   5.2703   23.217   5.2703 0.000000 0.000000 
1 1 1    9    0  115 o   21.065   6.4680   23.494   9.7090   23.494   9.7090   23.494   9.7090   21.065   6.4680   21.065   6.4680 0.000000 0.000000 
1 1 1    9    0  116 o   9.5241   5.7855   4.0945   8.3683   4.0945   8.3683   4.0945   8.3683   9.5241   5.7855   9.5241   5.7855 -0.000000 0.000000 
1 1 1    9    0  117 o   69.816   2.2308  201.210   12.666  201.210   12.666  201.210   12.666   69.816   2.2308   69.816   2.2308 -0.000000 0.000000 
1 1 1    9    0  118 o   8.5010   5.4227   1.4913   8.3266   1.4913   8.3266   1.4913   8.3266   8.5010   5.4227   8.5010   5.4227 0.000000 0.000000 
1 1 1    9    0  119 o   35.147   3.4641   53.110   9.6875   53.110   9.6875   53.110   9.6875   35.147   3.4641   35.147   3.4641 -0.000000 0.000000 
1 1 1    9    0  120 f   31.114   5.6940   45.755   13.013   45.755   13.013   45.755   13.013   31.114   5.6940   31.114   5.6940 -0.000000 0.000000 
1 1 1    9    0  121 o   9.7154   6.3373   1.0270   12.238   1.0270   12.238   1.0270   12.238   9.7154   6.3373   9.7154   6.3373 0.000000 0.000000 
1 1 1    9    0  122 o   7.4928   5.2579 -10.7477   12.246 -10.7477   12.246 -10.7477   12.246   7.4928   5.2579   7.4928   5.2579 -0.000000 0.000000 
1 1 1    9    0  123 o   13.762   7.7406   13.334   13.171   13.334   13.171   13.334   13.171   13.762   7.7406   13.762   7.7406 0.000000 0.000000 
1 1 1    9    0  124 o   63.698   3.9005  174.579   20.077  174.579   20.077  174.579   20.077   63.698   3.9005   63.698   3.9005 -0.000000 0.000000 
1 1 1    9    0  125 o   9.8278   6.6085  -2.1492   15.065  -2.1492   15.065  -2.1492   15.065   9.8278   6.6085   9.8278   6.6085 -0.000000 0.000000 
1 1 1    9    0  126 o   14.102   8.8824   12.628   21.541   12.628   21.541   12.628   21.541   14.102   8.8824   14.102   8.8824 -0.000000 0.000000 
1 1 1    9    0  127 o   8.7785   6.1417 -11.4475   16.346 -11.4475   16.346 -11.4475   16.346   8.7785   6.1417   8.7785   6.1417 0.000000 0.000000 
1 1 1    9    0  128 o   25.148   9.1131   40.266   17.153   40.266   17.153   40.266   17.153   25.148   9.1131   25.148   9.1131 -0.000000 0.000000 
1 1 1    9    0  129 o   26.607   8.9936   43.661   17.446   43.661   17.446   43.661   17.446   26.607   8.9936   26.607   8.9936 -0.000000 0.000000 
1 1 1    9    0  130 o   22.400   9.3761   35.169   17.160   35.169   17.160   35.169   17.160   22.400   9.3761   22.400   9.3761 -0.000000 0.000000 
1 1 1    9    0  131 o   11.986   7.6039   7.5279   16.106   7.5279   16.106   7.5279   16.106   11.986   7.6039   11.986   7.6039 -0.000000 0.000000 
1 1 1    9    0  132 o   32.454   7.5630   56.069   17.396   56.069   17.396   56.069   17.396   32.454   7.5630   32.454   7.5630 -0.000000 0.000000 
1 1 1    9    0  133 o   9.1370   6.3200  -7.4570   16.038  -7.4570   16.038  -7.4570   16.038   9.1370   6.3200   9.1370   6.3200 0.000000 0.000000 
1 1 1    9    1 -132 o   12.509   5.2350   4.5363   8.9492   0.3874   11.846   10.052   13.659   12.455   5.5957   15.524   6.4799 -3.069113 8.561645 
1 1 1    9    1 -131 o   21.757   5.2012   23.799   9.0990   24.651   12.222   22.739   13.628   21.017   6.4867   19.870   6.8922 1.147123 9.464630 
1 1 1    9    1 -130 o   23.950   4.9136   28.045   9.2706   44.396   12.551   8.4135   13.752   29.849   5.3552   15.114   6.4158 14.73491 8.357039 
1 1 1    9    1 -129 o   10.552   4.7670  -1.5866   8.7338   1.6888   11.684  -5.7336   13.148   12.769   5.6584   11.783   5.5091 0.9863033 7.897320 
1 1 1    9    1 -128 o   15.410   5.5612   11.386   8.9459   13.562   10.564   5.8693   16.820   16.487   6.0296   15.311   6.7866 1.175896 9.078200 
1 1 1    9    1 -127 o   15.013   5.5613   10.411   9.0344   14.463   10.886   1.4462   16.192   16.934   6.1316   14.307   6.4744 2.626242 8.917081 
1 1 1    9    1 -126 o   12.549   5.2327   4.3383   8.8933   1.8882   10.630   10.055   16.237   12.498   5.4726   16.277   6.9425 -3.779028 8.840073 
1 1 1    9    1 -125 o   14.715   5.3370   9.8903   8.2523   13.769   10.671   4.1206   13.015   16.717   6.0682   14.005   6.0954 2.712264 8.601048 
1 1 1    9    1 -124 o   22.491   4.9811   24.444   8.8912   28.503   12.039   19.573   13.188   23.342   6.2165   19.160   6.7701 4.181768 9.191265 
1 1 1    9    1 -123 o   30.423   3.8276   41.481   9.2824   40.753   12.596   42.347   13.732   28.787   5.5691   28.946   6.0166 -0.1590385 8.198446 
1 1 1    9    1 -122 o   27.880   3.7719   34.757   8.3526   37.330   10.720   30.780   13.326   28.149   4.8467   24.103   6.5933 4.046179 8.183053 
1 1 1    9    1 -121 o   15.637   5.2757   11.441   7.9726   17.448   10.163   1.8330   12.855   18.662   5.9379   13.579   5.9798 5.082394 8.427128 
1 1 1    9    1 -120 o   53.783   2.2325  121.218   9.7663  114.487   12.601  131.342   15.454   51.696   3.0034   54.943   3.4684 -3.247055 4.588011 
1 1 1    9    1 -119 o   27.469   3.7885   33.409   8.2574   44.089   10.756   18.079   12.887   31.253   4.3389   19.092   6.6968 12.16050 7.979546 
1 1 1    9    1 -118 o   32.199   3.5226   45.089   9.0951   36.827   11.002   62.924   16.164   28.222   4.9635   36.504   5.6117 -8.281847 7.491824 
1 1 1    9    1 -117 o   41.161   2.9223   71.895   9.7413   79.473   12.006   57.293   16.665   42.953   3.4581   34.505   6.1507 8.448650 7.056211 
1 1 1    9    1 -116 o   51.922   2.5038  112.855   10.566  125.941   13.067   88.137   17.958   54.582   2.9478   44.086   5.0906 10.49523 5.882449 
1 1 1    9    1 -115 o   26.792   4.1114   31.629   8.6926   36.301   11.604   25.655   13.121   28.122   5.2554   22.904   6.6421 5.217607 8.469787 
1 1 1    9    1 -114 o   12.974   5.2216   4.4906   8.4683   4.0256   11.860   4.9743   12.096   14.357   6.0186   14.747   6.1220 -0.3901253 8.585007 
1 1 1    9    1 -113 o   47.923   2.5580   95.767   9.9565   89.548   13.876  102.367   14.294   45.745   3.7543   49.017   3.6027 -3.272362 5.203243 
1 1 1    9    1 -112 o   24.481   4.4849   26.508   8.6201   29.206   11.882   23.510   12.525   25.100   5.9063   22.350   6.4919 2.750202 8.776635 
1 1 1    9    1 -111 o   17.054   5.4732   12.760   8.6207   27.764   11.649  -5.4024   12.817   24.530   5.8986   12.572   5.7173 11.95836 8.214677 
1 1 1    9    1 -110 o   17.980   5.1362   14.453   7.9019   18.754   10.094   7.6438   12.700   20.294   5.8074   16.096   6.4229 4.198099 8.659101 
1 1 1    9    1 -109 o   32.876   3.3974   45.719   8.9736   52.155   10.798   31.351   16.133   34.961   3.8528   25.673   7.3406 9.288065 8.290271 
1 1 1    9    1 -108 o   33.096   3.3457   46.223   8.9022   45.735   10.694   47.325   16.065   32.641   4.1102   32.170   6.3517 0.4710846 7.565579 
1 1 1    9    1 -107 o   23.927   4.9062   25.335   9.2475   44.654   11.760  -5.9636   14.969   32.079   4.6313   13.693   6.2079 18.38528 7.745183 
1 1 1    9    1 -106 o   51.369   2.2147  108.819   9.2517  104.311   12.138  115.068   14.292   50.052   2.9886   52.434   3.3615 -2.381649 4.497986 
1 1 1    9    1 -105 o   29.182   3.4858   35.971   8.1279   38.829   10.590   31.874   12.679   30.016   4.4640   26.607   5.9906 3.409515 7.470883 
1 1 1    9    1 -104 o   55.902   2.0639  128.491   9.3886  136.591   12.298  117.176   14.535   57.484   2.6316   52.987   3.3830 4.496616 4.285969 
1 1 1    9    1 -103 o   37.450   2.7654   58.183   8.3824   56.343   10.825   60.937   13.247   36.604   3.6778   37.850   4.3739 -1.245152 5.714681 
1 1 1    9    1 -102 o   17.463   5.1304   13.185   7.7838   15.581   10.161   9.7829   12.109   19.023   5.9217   16.987   6.4085 2.036352 8.725610 
1 1 1    9    1 -101 o  102.283   1.6536  428.007   13.787  415.170   17.844  447.021   21.717  100.600   2.1760  104.259   2.5553 -3.659462 3.356250 
1 1 1    9    1 -100 o   48.252   2.3928   95.806   9.3822  105.436   12.211   81.931   14.658   50.496   2.9799   44.189   4.1167 6.307186 5.082023 
1 1 1    9    1  -99 o   73.424   2.0225  220.925   12.094  219.085   14.481  225.169   21.987   73.028   2.4359   73.672   3.6729 -0.6432953 4.407270 
1 1 1    9    1  -98 o   85.821   1.7434  301.139   12.196  299.675   15.990  303.175   18.859   85.483   2.2969   85.881   2.6972 -0.3980560 3.542708 
1 1 1    9    1  -97 o   45.522   2.6977   85.331   9.9655   98.779   14.159   72.130   14.028   48.808   3.5838   41.523   4.2024 7.285767 5.523035 
1 1 1    9    1  -96 o   8.6550   4.1620 -12.6290   8.6061   5.6344   12.298 -30.1574   12.048   15.795   6.3144   8.6647   4.3136 7.130098 7.647169 
1 1 1    9    1  -95 o   59.275   2.7598  144.350   13.298  144.914   19.683  143.876   18.037   59.106   4.1109   58.974   3.7718 0.1317787 5.579030 
1 1 1    9    1  -94 o   39.837   3.2477   65.585   10.455   65.666   13.876   65.479   15.901   39.644   4.3661   39.422   5.0649 0.2218628 6.687043 
1 1 1    9    1  -93 f   32.119   3.7405   42.983   9.6102   51.400   12.235   29.427   15.527   35.034   4.3799   26.022   7.1165 9.011871 8.356283 
1 1 1    9    1  -92 o   56.533   2.5094  131.002   11.535  145.005   16.353  117.134   16.274   59.350   3.3944   53.255   3.7734 6.094986 5.075468 
1 1 1    9    1  -91 o  130.198   1.7902  692.089   18.999  701.122   26.745  682.888   26.995  130.936   2.5058  129.212   2.5630 1.723923 3.584383 
1 1 1    9    1  -90 o  120.360   1.7674  591.342   17.340  596.584   24.084  585.699   24.986  120.807   2.4457  119.683   2.5611 1.124222 3.541304 
1 1 1    9    1  -89 o   96.894   1.6805  383.138   13.273  380.910   17.349  386.283   20.613   96.567   2.2040   97.168   2.6048 -0.6014557 3.412105 
1 1 1    9    1  -88 o  114.294   1.6294  533.015   15.181  516.154   19.641  558.036   23.926  112.426   2.1432  116.855   2.5118 -4.429893 3.301841 
1 1 1    9    1  -87 o  175.267   1.6846  1253.40   24.068  1251.00   31.677  1256.67   37.017  175.027   2.2202  175.362   2.5896 -0.3347473 3.411075 
1 1 1    9    1  -86 o  144.122   1.6245  847.394   19.085  861.441   25.207  828.526   29.214  145.261   2.1288  142.412   2.5166 2.849091 3.296194 
1 1 1    9    1  -85 o  125.161   1.6181  639.051   16.508  626.210   21.636  656.942   25.539  123.854   2.1430  126.824   2.4704 -2.969597 3.270363 
1 1 1    9    1  -84 o  121.707   1.4304  604.132   14.191  600.649   20.949  607.085   19.291  121.308   2.1185  121.970   1.9403 -0.6626358 2.872750 
1 1 1    9    1  -83 o   94.610   1.3681  365.026   10.551  365.354   20.205  364.904   12.372   94.544   2.6243   94.584   1.6046 -0.3978729E-01 3.076015 
1 1 1    9    1  -82 o   28.085   2.2239   32.393   5.0497   36.817   13.726   31.700   5.4305   29.395   5.9334   27.761   2.4241 1.633942 6.409508 
1 1 1    9    1  -81 f   18.461   3.2141   14.330   4.6611  -2.1728   12.681   16.908   5.0120   13.839   6.0199   20.100   3.1634 -6.261333 6.800445 
1 1 1    9    1  -80 o   74.897   1.4219  228.749   8.6813  238.120   17.252  225.572   10.046   76.311   2.7781   74.369   1.6571 1.942535 3.234796 
1 1 1    9    1  -79 o  100.399   1.3706  411.018   11.217  419.882   21.012  407.485   13.266  101.390   2.5444   99.958   1.6281 1.431824 3.020677 
1 1 1    9    1  -78 o  247.804   1.6743  2504.31   33.819  2418.01   50.409  2574.96   45.607  243.399   2.5407  251.215   2.2271 -7.816177 3.378639 
1 1 1    9    1  -77 o   24.650   2.7268   25.105   5.3877   28.490   11.558   24.165   6.0899   25.860   5.6420   24.119   3.1745 1.741474 6.473755 
1 1 1    9    1  -76 o  117.623   1.3869  564.091   13.297  573.861   23.738  559.623   16.052  118.591   2.4556  117.146   1.6810 1.444778 2.975868 
1 1 1    9    1  -75 o  185.142   1.5502  1397.67   23.395  1367.31   39.413  1414.19   29.070  183.045   2.6415  186.212   1.9152 -3.166840 3.262692 
1 1 1    9    1  -74 f  232.736   1.8371  2209.00   34.852  2232.54   55.155  2193.35   44.968  233.868   2.8932  231.863   2.3792 2.005646 3.745822 
1 1 1    9    1  -73 o   84.923   1.4942  294.049   10.343  309.155   18.321  286.981   12.531   87.005   2.5861   83.888   1.8326 3.117432 3.169561 
1 1 1    9    1  -72 o   63.482   1.6078  164.423   8.3129  161.873   13.301  166.057   10.649   62.933   2.5985   63.775   2.0510 -0.8425217 3.310403 
1 1 1    9    1  -71 o   25.145   2.7311   26.104   5.5081   30.798   9.9743   24.044   6.6069   27.058   4.6922   24.019   3.4754 3.039070 5.839095 
1 1 1    9    1  -70 o  186.149   1.5120  1412.79   22.943  1428.31   33.390  1398.91   31.577  187.134   2.1889  185.204   2.0916 1.930695 3.027604 
1 1 1    9    1  -69 o  221.416   1.6450  1998.91   29.690  1994.22   42.610  2003.33   41.393  221.110   2.3641  221.620   2.2913 -0.5096741 3.292257 
1 1 1    9    1  -68 o   34.762   2.0384   49.449   5.7506   45.562   10.368   51.176   6.9111   33.172   3.9093   35.338   2.4137 -2.166897 4.594425 
1 1 1    9    1  -67 o   85.529   1.6070  298.256   11.204  312.340   14.651  278.417   17.388   87.516   2.0537   82.573   2.5865 4.943230 3.302662 
1 1 1    9    1  -66 o  130.805   1.3937  697.532   14.860  693.911   21.230  701.010   20.806  130.447   1.9965  131.115   1.9467 -0.6672974 2.788550 
1 1 1    9    1  -65 o  310.687   1.9350  3936.02   49.006  3919.45   73.838  3949.06   65.516  309.938   2.9226  311.143   2.5832 -1.204987 3.900551 
1 1 1    9    1  -64 o  187.017   1.4263  1425.86   21.743  1420.53   33.195  1429.86   28.776  186.636   2.1819  187.262   1.8851 -0.6260071 2.883509 
1 1 1    9    1  -63 o  319.765   1.9794  4169.37   51.595  4085.08   76.637  4239.25   69.777  316.423   2.9712  322.373   2.6553 -5.949951 3.984849 
1 1 1    9    1  -62 o  184.954   1.6071  1394.65   24.229  1373.26   36.856  1410.92   32.155  183.494   2.4640  186.010   2.1207 -2.516113 3.250955 
1 1 1    9    1  -61 o  168.363   1.5501  1155.63   21.274  1164.59   32.785  1149.11   27.959  168.985   2.3801  167.871   2.0432 1.113464 3.136825 
1 1 1    9    1  -60 o   53.223   1.6934  115.605   7.3374  118.745   11.178  113.228   9.7262   53.897   2.5515   52.644   2.2718 1.253132 3.416343 
1 1 1    9    1  -59 o  203.858   1.5789  1694.24   26.237  1725.85   37.777  1664.79   36.467  205.723   2.2527  202.053   2.2141 3.670486 3.158679 
1 1 1    9    1  -58 o  223.487   1.6319  2036.24   29.729  2019.66   37.589  2063.93   48.581  222.557   2.0720  224.952   2.6494 -2.395126 3.363358 
1 1 1    9    1  -57 o  359.262   2.1608  5262.90   63.280  5280.36   85.038  5241.23   94.727  359.792   2.8995  358.419   3.2423 1.372345 4.349645 
1 1 1    9    1  -56 o   83.470   1.4056  284.021   9.5640  282.984   11.465  286.397   17.344   83.314   1.6881   83.763   2.5431 -0.4483261 3.052427 
1 1 1    9    1  -55 o  278.423   2.1769  3160.80   49.406  3149.46   53.975  3219.39  122.705  277.912   2.3826  280.696   5.3628 -2.784363 5.868209 
1 1 1    9    1  -54 f   86.970   1.4574  308.335   10.332  309.067   11.926  306.131   20.685   87.071   1.6803   86.586   2.9350 0.4849930 3.381949 
1 1 1    9    1  -53 o  115.688   1.5092  545.586   14.233  542.030   16.885  554.313   26.451  115.307   1.7965  116.585   2.7833 -1.278740 3.312717 
1 1 1    9    1  -52 o  420.645   3.2918  7217.37  112.872  7178.33  144.530  7278.41  180.716  419.399   4.2276  422.165   5.2514 -2.765198 6.741682 
1 1 1    9    1  -51 o  338.904   2.3393  4682.94   64.624  4677.82   84.867  4690.02   99.700  338.673   3.0741  339.074   3.6071 -0.4008789 4.739373 
1 1 1    9    1  -50 o  476.470   2.9069  9257.74  112.903  9409.17  161.599  9113.34  157.807  480.223   4.1282  472.617   4.0962 7.605621 5.815561 
1 1 1    9    1  -49 o  187.074   1.4097  1426.53   21.496  1411.08   28.618  1446.54   32.563  186.050   1.8870  188.367   2.1207 -2.317673 2.838709 
1 1 1    9    1  -48 o  364.358   2.1808  5412.20   64.770  5402.75   86.756  5424.09   97.353  364.003   2.9239  364.700   3.2748 -0.6968384 4.390106 
1 1 1    9    1  -47 o  393.929   2.4667  6326.62   79.209  6322.94  111.919  6330.32  112.119  393.755   3.4869  393.984   3.4911 -0.2293701 4.934226 
1 1 1    9    1  -46 o  203.499   1.5570  1688.03   25.828  1650.18   35.952  1728.41   37.130  201.193   2.1921  205.907   2.2122 -4.713318 3.114332 
1 1 1    9    1  -45 o  187.253   1.5903  1429.25   24.275  1422.12   36.575  1434.87   32.453  186.772   2.4024  187.612   2.1221 -0.8403473 3.205386 
1 1 1    9    1  -44 o  157.810   1.5064  1015.11   19.379  992.299   25.283  1047.59   30.172  156.021   1.9879  160.305   2.3090 -4.283401 3.046851 
1 1 1    9    1  -43 o   86.890   1.4676  307.738   10.395  317.539   13.767  294.740   15.855   88.260   1.9135   85.000   2.2904 3.260788 2.984500 
1 1 1    9    1  -42 o   94.162   1.5066  361.400   11.564  355.281   18.356  365.427   14.890   93.324   2.4150   94.682   1.9293 -1.358215 3.090980 
1 1 1    9    1  -41 o  138.522   1.4943  782.124   16.873  781.536   26.405  782.531   21.936  138.463   2.3395  138.555   1.9422 -0.9194946E-01 3.040637 
1 1 1    9    1  -40 o  557.359   3.5859 12666.18  162.918 12832.13  251.856 12546.78  213.635  560.850   5.5090  554.646   4.7252 6.203735 7.257824 
1 1 1    9    1  -39 o  349.631   2.2381  4982.95   63.786  4951.27  104.316  5001.87   80.613  348.476   3.6723  350.279   2.8233 -1.803131 4.632176 
1 1 1    9    1  -38 o   61.522   1.5234  154.273   7.6397  169.951   13.322  146.591   9.3254   64.519   2.5380   59.939   1.9111 4.579998 3.177058 
1 1 1    9    1  -37 o  281.512   1.7845  3230.22   40.951  3278.91   62.328  3193.24   54.320  283.611   2.6960  279.887   2.3809 3.724304 3.596846 
1 1 1    9    1  -36 o  431.385   2.5072  7585.77   88.164  7735.22  134.555  7473.34  116.707  435.573   3.7897  428.152   3.3440 7.421173 5.054094 
1 1 1    9    1  -35 o  186.912   1.4030  1423.96   21.376  1434.83   32.459  1415.64   28.404  187.618   2.1224  186.362   1.8698 1.256653 2.828547 
1 1 1    9    1  -34 o  170.538   1.3551  1185.40   18.838  1208.56   28.796  1168.08   24.908  172.191   2.0515  169.285   1.8050 2.906509 2.732564 
1 1 1    9    1  -33 o  272.480   1.7474  3026.23   38.811  3065.00   58.923  2996.52   51.581  274.209   2.6361  271.133   2.3338 3.076447 3.520781 
1 1 1    9    1  -32 o  331.692   2.0253  4484.46   54.759  4453.38   81.923  4509.56   73.622  330.525   3.0406  332.609   2.7154 -2.084015 4.076649 
1 1 1    9    1  -31 o  450.368   2.7655  8268.04  101.525  8432.59  168.290  8173.88  127.299  454.774   4.5397  447.778   3.4876 6.995911 5.724713 
1 1 1    9    1  -30 o  274.012   1.8620  3060.34   41.590  3101.36   59.347  3020.76   58.301  275.833   2.6394  272.225   2.6273 3.607422 3.724181 
1 1 1    9    1  -29 o  322.342   2.0951  4235.20   55.051  4268.27   78.270  4202.82   77.443  323.586   2.9674  321.096   2.9588 2.490601 4.190412 
1 1 1    9    1  -28 o   64.958   1.7502  172.110   9.2590  195.870   14.215  154.600   12.203   69.274   2.5215   61.538   2.4375 7.736439 3.507049 
1 1 1    9    1  -27 o   56.408   2.0484  129.866   9.4033  147.535   15.420  119.406   11.865   60.077   3.1599   54.056   2.7012 6.021175 4.157096 
1 1 1    9    1  -26 o  248.759   1.6717  2522.22   33.897  2590.60   52.058  2471.89   44.662  252.101   2.5333  246.260   2.2249 5.841110 3.371578 
1 1 1    9    1  -25 o  573.121   3.2408 13389.65  151.403 13390.70  227.342 13388.81  202.959  573.084   4.8666  573.065   4.3448 0.1904297E-01 6.523860 
1 1 1    9    1  -24 o  347.890   2.2348  4933.13   63.375  4926.15  103.808  4937.28   80.017  347.621   3.6634  348.028   2.8206 -0.4071350 4.623432 
1 1 1    9    1  -23 f  173.814   1.4814  1231.38   20.989  1277.80   35.469  1206.36   26.037  177.055   2.4576  172.038   1.8566 5.017654 3.080050 
1 1 1    9    1  -22 o  376.321   2.3769  5772.42   72.913  5765.00  119.308  5776.85   92.118  376.052   3.8921  376.456   3.0019 -0.4034729 4.915265 
1 1 1    9    1  -21 o  482.374   2.9381  9484.80  115.526  9621.75  191.167  9406.02  144.998  485.792   4.8275  480.349   3.7031 5.443390 6.084279 
1 1 1    9    1  -20 o  753.889   4.4434 23170.91  273.061 23265.95  447.562 23114.57  344.635  755.255   7.2698  752.908   5.6154 2.346558 9.186028 
1 1 1    9    1  -19 o  572.315   3.4279 13352.06  159.921 13272.98  224.872 13432.99  227.476  570.571   4.8349  573.999   4.8617 -3.427673 6.856566 
1 1 1    9    1  -18 o  660.696   3.9182 17795.16  211.022 17801.14  298.381 17789.18  298.478  660.736   5.5400  660.514   5.5436 0.2223511 7.837290 
1 1 1    9    1  -17 f   21.832   3.5486   19.931   6.0984   22.219   8.4746   17.473   8.7826   22.927   4.6927   20.324   5.2608 2.603271 7.049641 
1 1 1    9    1  -16 o  187.994   1.5851  1440.49   24.291  1402.45   31.777  1493.97   37.678  185.493   2.1016  191.448   2.4144 -5.954620 3.200918 
1 1 1    9    1  -15 o  740.966   4.3651 22382.81  263.650 22859.38  379.808 21939.60  366.274  748.714   6.2232  733.502   6.1259 15.21136 8.732378 
1 1 1    9    1  -14 o  194.839   1.4972  1547.29   23.778  1546.38   33.892  1548.18   33.369  194.779   2.1346  194.892   2.1005 -0.1133728 2.994774 
1 1 1    9    1  -13 o  317.349   2.0573  4104.93   53.219  4144.92   75.998  4066.45   74.548  318.883   2.9237  315.850   2.8955 3.032837 4.114849 
1 1 1    9    1  -12 o  532.373   3.4217 11553.28  148.490 11488.75  195.761 11640.72  227.869  530.854   4.5239  534.329   5.2317 -3.475281 6.916385 
1 1 1    9    1  -11 o  247.502   1.8362  2496.78   37.045  2457.62   48.733  2550.39   57.014  245.548   2.4347  250.137   2.7962 -4.588776 3.707656 
1 1 1    9    1  -10 f  644.953   4.4177 16957.89  232.252 17127.93  331.610 16794.17  325.385  648.095   6.2770  641.752   6.2201 6.342590 8.836859 
1 1 1    9    1   -9 f  894.452   5.5956 32620.90  407.982 32463.55  537.579 32834.63  626.528  892.158   7.3920  897.134   8.5674 -4.976013 11.31556 
1 1 1    9    1   -8 f  546.238   3.7862 12163.25  168.584 12250.23  207.799 11995.76  288.351  548.162   4.6505  542.366   6.5222 5.796143 8.010371 
1 1 1    9    1   -7 f  349.320   2.5558  4973.82   72.776  4973.95  103.062  4973.69  102.780  349.310   3.6195  349.301   3.6097 0.9063721E-02 5.111832 
1 1 1    9    1   -6 o  258.072   2.0321  2714.62   42.749  2819.36   62.147  2620.57   58.895  262.996   2.8989  253.555   2.8495 9.440933 4.064913 
1 1 1    9    1   -5 o  502.483   3.5038 10292.40  143.513 10479.71  206.058 10115.96  199.994  506.994   4.9860  498.119   4.9255 8.874542 7.008591 
1 1 1    9    1   -4 o  277.768   2.3468  3144.86   53.137  3162.99   68.938  3118.31   83.406  278.561   3.0360  276.579   3.6995 1.982330 4.785761 
1 1 1    9    1   -3 o  212.049   1.7959  1832.72   31.042  1859.89   44.396  1806.73   43.420  213.611   2.5497  210.536   2.5300 3.074814 3.591941 
1 1 1    9    1   -2 o  403.858   3.1629  6648.40  104.123  6758.29  166.967  6578.47  133.196  407.142   5.0309  401.711   4.0676 5.430786 6.469611 
1 1 1    9    1   -1 o  212.171   1.6725  1834.82   28.926  1786.77   37.853  1902.25   44.844  209.372   2.2179  216.029   2.5466 -6.657913 3.377030 
1 1 1    9    1    0 o  709.939   4.4778 20547.49  259.134 20387.94  340.600 20766.77  399.301  707.111   5.9091  713.595   6.8646 -6.484009 9.057567 
1 1 1    9    1    1 o  772.843   4.8580 24351.09  306.043 24284.22  404.025 24441.12  468.777  771.695   6.4228  774.115   7.4289 -2.420593 9.820465 
1 1 1    9    1    2 o  533.124   3.4268 11585.82  148.921 11671.24  198.335 11475.44  225.477  535.055   4.5474  530.526   5.2139 4.528992 6.918344 
1 1 1    9    1    3 o  618.962   4.2496 15618.28  214.413 15625.48  262.811 15603.94  370.784  619.069   5.2080  618.536   7.3539 0.5326538 9.011289 
1 1 1    9    1    4 o  382.649   2.7639  5968.27   86.209  5918.29  104.970  6071.84  151.101  381.034   3.3796  385.917   4.8033 -4.882629 5.873084 
1 1 1    9    1    5 o  677.622   5.6691 18722.27  313.142 18472.95  437.700 18983.67  448.185  672.959   7.9791  682.193   8.0596 -9.233704 11.34119 
1 1 1    9    1    6 o  591.854   4.9936 14281.49  240.917 14094.57  336.783 14477.37  344.772  587.876   7.0279  595.802   7.0990 -7.925842 9.989350 
1 1 1    9    1    7 f  126.955   1.8423  656.940   19.066  669.092   27.337  645.429   26.605  128.121   2.6175  125.835   2.5937 2.285767 3.684916 
1 1 1    9    1    8 f  679.579   5.0884 18829.17  281.877 19671.40  462.657 18331.98  355.468  694.430   8.1732  670.477   6.5040 23.95300 10.44529 
1 1 1    9    1    9 f  595.411   4.4907 14452.85  217.956 14580.30  347.212 14369.96  279.995  597.913   7.1240  593.651   5.7861 4.262390 9.177655 
1 1 1    9    1   10 f  588.502   4.0561 14118.68  194.576 14312.56  278.481 13933.74  271.977  592.464   5.7663  584.573   5.7076 7.890747 8.113416 
1 1 1    9    1   11 o  171.226   1.7924  1194.99   25.017  1198.77   32.621  1189.60   38.981  171.494   2.3335  170.835   2.7992 0.6593475 3.644300 
1 1 1    9    1   12 o  377.959   2.7403  5822.88   84.425  6021.70  122.664  5643.93  116.375  384.338   3.9153  372.088   3.8369 12.24957 5.481915 
1 1 1    9    1   13 o  493.340   3.4536  9921.28  138.884  9728.88  193.343 10126.39  199.630  488.495   4.8555  498.373   4.9140 -9.877899 6.908192 
1 1 1    9    1   14 o  922.957   6.8245 34740.73  513.438 34479.52  806.302 34918.89  665.898  919.056   10.763  925.127   8.8302 -6.070984 13.92147 
1 1 1    9    1   15 o  139.055   1.6953  788.132   19.216  761.016   29.905  807.201   25.079  136.638   2.6850  140.726   2.1862 -4.087418 3.462479 
1 1 1    9    1   16 o  529.778   4.0349 11441.67  174.245 11274.88  272.129 11557.57  226.845  525.816   6.3490  532.414   5.2269 -6.598022 8.223743 
1 1 1    9    1   17 f  754.742   5.6208 23226.95  345.809 23263.84  547.568 23202.47  446.006  755.094   8.8961  754.235   7.2543 0.8591919 11.47895 
1 1 1    9    1   18 o  367.524   2.9357  5505.91   87.949  5560.43  140.144  5470.49  112.963  369.305   4.6554  366.325   3.7830 2.980011 5.998609 
1 1 1    9    1   19 o  401.372   3.1619  6566.93  103.450  6598.55  164.263  6546.14  133.179  402.295   5.0091  400.718   4.0772 1.576965 6.458664 
1 1 1    9    1   20 o  615.969   4.6409 15468.84  233.023 15427.56  367.749 15496.54  301.210  615.005   7.3356  616.457   5.9942 -1.451965 9.473197 
1 1 1    9    1   21 o  345.468   2.8028  4864.86   78.928  4931.06  126.194  4822.33  101.155  347.780   4.4514  343.941   3.6080 3.838837 5.729990 
1 1 1    9    1   22 o  433.024   3.3836  7643.69  119.432  7754.14  191.154  7572.97  152.964  436.085   5.3775  430.992   4.3539 5.092926 6.919088 
1 1 1    9    1   23 f  777.395   5.7909 24643.81  366.966 24466.02  576.616 24764.84  475.747  774.297   9.1357  779.170   7.4904 -4.873413 11.81391 
1 1 1    9    1   24 o  720.762   6.0243 21185.04  353.945 21203.02  500.943 21167.10  500.166  720.868   8.5250  720.258   8.5190 0.6103516 12.05197 
1 1 1    9    1   25 o  673.171   5.6487 18478.74  309.961 18537.24  439.724 18420.96  436.991  674.067   8.0028  671.952   7.9781 2.115540 11.30019 
1 1 1    9    1   26 o  449.800   3.9159  8248.04  143.579  8517.96  208.496  8004.58  198.013  457.043   5.5964  443.060   5.4827 13.98279 7.834499 
1 1 1    9    1   27 o  199.567   3.1977  1623.52   52.020  1865.70   80.079  1446.71   68.423  213.916   4.5924  188.372   4.4560 25.54352 6.398905 
1 1 1    9    1   28 o  238.459   3.4651  2318.04   67.355  2246.68   93.773  2394.10   96.809  234.736   4.9007  242.315   4.9012 -7.579086 6.930992 
1 1 1    9    1   29 o  621.673   7.4194 15766.74  375.984 15938.10  536.901 15601.84  526.690  624.741   10.543  618.126   10.453 6.615540 14.84645 
1 1 1    9    1   30 o  104.135   2.4108  442.025   20.464  473.835   36.550  427.501   24.698  107.726   4.1702  102.365   2.9630 5.360962 5.115649 
1 1 1    9    1   31 o  574.270   6.8774 13452.89  321.943   0.0000   0.0000 13452.89  321.943  ?   ?   574.270   6.8774 0.000000 6.877444 
1 1 1    9    1   32 o  638.521   4.8030 16624.45  249.990 16373.59  390.180 16799.15  325.598  633.480   7.5561  641.771   6.2239 -8.291687 9.789361 
1 1 1    9    1   33 o  400.753   3.1630  6547.04  103.327  6634.46  165.254  6490.92  132.400  403.358   5.0260  399.005   4.0707 4.352875 6.467743 
1 1 1    9    1   34 o  224.872   2.0859  2061.18   38.236  2068.44   60.698  2056.41   49.232  225.252   3.3058  224.605   2.6890 0.6472931 4.261326 
1 1 1    9    1   35 o  216.703   2.0420  1914.14   36.070  1957.93   57.864  1886.31   46.129  219.152   3.2391  215.115   2.6307 4.037354 4.172808 
1 1 1    9    1   36 o  305.488   2.5536  3804.17   63.589  3969.77  103.789  3704.65   80.458  312.030   4.0806  301.451   3.2743 10.57910 5.231825 
1 1 1    9    1   37 o  693.939   5.1963 19639.75  293.934 19250.23  456.883 19914.83  383.939  686.691   8.1622  698.625   6.7419 -11.93384 10.58654 
1 1 1    9    1   38 o  217.334   2.0519  1925.35   36.351  1970.46   58.357  1896.75   46.467  219.847   3.2564  215.706   2.6427 4.140884 4.193774 
1 1 1    9    1   39 o  343.520   2.7911  4810.68   78.155  4929.79  125.935  4736.07   99.672  347.689   4.4434  340.822   3.5876 6.866882 5.710979 
1 1 1    9    1   40 o  380.688   3.0322  5908.32   94.095  5864.13  148.034  5938.28  121.885  379.182   4.7894  381.616   3.9182 -2.433441 6.187914 
1 1 1    9    1   41 o  371.380   2.9710  5622.98   89.942  5593.83  141.759  5642.62  116.362  370.336   4.6959  371.992   3.8374 -1.655579 6.064430 
1 1 1    9    1   42 o  162.519   1.8124  1076.62   24.010  1149.13   39.323  1033.51   30.318  167.888   2.8733  159.226   2.3359 8.662064 3.703039 
1 1 1    9    1   43 o  250.468   2.2280  2557.35   45.489  2526.27   71.403  2578.59   59.015  248.907   3.5192  251.490   2.8787 -2.583572 4.546637 
1 1 1    9    1   44 o  116.209   1.9350  550.491   18.330  568.191   26.373  533.951   25.494  118.054   2.7406  114.441   2.7329 3.612144 3.870321 
1 1 1    9    1   45 o   87.330   2.0301  310.896   14.452  298.487   20.643  322.824   20.240   85.510   2.9660   88.939   2.7952 -3.429070 4.075569 
1 1 1    9    1   46 o  140.106   1.9659  800.201   22.452  827.179   32.283  774.926   31.248  142.436   2.7804  137.864   2.7805 4.572250 3.932208 
1 1 1    9    1   47 o  210.755   2.2607  1810.81   38.838  1842.38   55.467  1780.46   54.400  212.557   3.2013  208.955   3.1938 3.602173 4.522004 
1 1 1    9    1   48 o  233.195   2.3896  2217.06   45.423  2241.33   64.684  2193.44   63.800  234.432   3.3849  231.914   3.3748 2.517899 4.779869 
1 1 1    9    1   49 o  162.728   2.3239  1079.60   30.825  1109.15   53.329  1064.78   37.776  164.890   3.9676  161.594   2.8678 3.296570 4.895555 
1 1 1    9    1   50 o  123.226   2.6467  619.157   26.585  651.840   38.091  588.118   37.122  126.356   3.7022  120.010   3.7994 6.346222 5.304930 
1 1 1    9    1   51 o  154.275   2.7749  970.564   34.896  949.650   48.804  992.442   49.916  152.514   3.9289  155.915   3.9306 -3.400482 5.557514 
1 1 1    9    1   52 o  123.212   2.6660  619.066   26.777  605.033   37.527  633.621   38.218  121.717   3.7869  124.563   3.7683 -2.846291 5.342353 
1 1 1    9    1   53 o  407.159   4.1608  6765.77  138.095  6782.34  169.686  6733.28  237.640  407.519   5.1081  405.640   7.1869 1.878174 8.817287 
1 1 1    9    1   54 f  130.735   1.9695  696.836   20.988  697.905   29.468  695.736   29.900  130.815   2.7635  130.610   2.8084 0.2048035 3.940050 
1 1 1    9    1   55 o   60.724   2.3667  150.591   11.693  157.089   16.262  143.638   16.824   61.970   3.2305   59.230   3.5002 2.739979 4.763089 
1 1 1    9    1   56 o  318.369   2.6414  4133.81   68.549  4014.41   86.241  4338.67  112.967  313.674   3.3729  325.995   4.2512 -12.32080 5.426662 
1 1 1    9    1   57 o  238.453   2.1937  2318.55   42.639  2249.60   54.038  2432.29   69.410  234.845   2.8228  244.145   3.4877 -9.300095 4.486896 
1 1 1    9    1   58 o  306.229   2.3376  3824.18   58.352  3778.91   71.124  3917.40  102.059  304.368   2.8667  309.768   4.0418 -5.399841 4.955218 
1 1 1    9    1   59 o   97.865   1.4545  390.440   11.603  417.121   15.689  358.230   17.238  101.145   1.9029   93.726   2.2563 7.418854 2.951563 
1 1 1    9    1   60 o  163.672   1.4369  1092.07   19.171  1081.26   26.952  1103.15   27.274  162.842   2.0305  164.482   2.0342 -1.639664 2.874169 
1 1 1    9    1   61 o  121.373   1.3479  600.533   13.335  594.537   18.836  606.558   18.882  120.753   1.9136  121.968   1.8992 -1.215065 2.696056 
1 1 1    9    1   62 o  167.590   1.5394  1145.04   21.029  1145.58   27.975  1144.34   31.887  167.612   2.0476  167.509   2.3353 0.1029663 3.105825 
1 1 1    9    1   63 o  349.845   2.2504  4991.39   64.176  5023.04   91.137  4960.25   90.385  350.846   3.1867  348.647   3.1803 2.198883 4.502191 
1 1 1    9    1   64 o  266.459   1.9648  2895.16   42.675  2901.36   65.129  2890.49   56.492  266.659   2.9963  266.196   2.6035 0.4636230 3.969360 
1 1 1    9    1   65 o  148.014   1.4017  893.134   16.911  894.236   23.976  892.043   23.858  148.086   1.9862  147.905   1.9788 0.1814270 2.803692 
1 1 1    9    1   66 o  189.049   1.5206  1457.09   23.432  1475.64   33.375  1439.06   32.907  190.220   2.1524  187.848   2.1490 2.372055 3.041605 
1 1 1    9    1   67 o   65.618   1.5765  175.549   8.4325  190.201   11.792  160.217   12.063   68.259   2.1219   62.629   2.3671 5.629951 3.178981 
1 1 1    9    1   68 o  244.718   2.0004  2442.20   39.904  2472.96   49.635  2385.99   67.100  246.218   2.4731  241.758   3.4049 4.460281 4.208272 
1 1 1    9    1   69 o  131.878   1.5577  709.096   16.746  684.352   20.691  756.068   28.508  129.544   1.9595  136.135   2.5690 -6.591461 3.230994 
1 1 1    9    1   70 o  108.448   1.6785  479.549   14.839  490.828   20.027  465.820   22.095  109.698   2.2396  106.856   2.5366 2.842453 3.383859 
1 1 1    9    1   71 o  101.146   1.6848  417.152   13.891  407.910   18.477  429.168   21.068  100.001   2.2667  102.564   2.5199 -2.562874 3.389361 
1 1 1    9    1   72 o   34.153   2.6522   47.881   7.3259   47.464   11.586   48.158   9.4562   33.805   4.3017   34.169   3.4419 -0.3639755 5.509241 
1 1 1    9    1   73 o   62.021   1.9948  157.046   10.072  152.826   12.156  166.285   17.988   61.155   2.4434   63.714   3.4766 -2.559265 4.249348 
1 1 1    9    1   74 f   94.069   1.4857  360.804   11.392  355.261   16.492  365.863   15.755   93.323   2.1679   94.710   2.0408 -1.386787 2.977379 
1 1 1    9    1   75 o   58.914   1.7913  141.675   8.5927  129.296   12.721  152.065   11.653   56.216   2.7846   61.007   2.3477 -4.790794 3.642242 
1 1 1    9    1   76 o  202.255   1.7241  1668.21   28.425  1683.81   44.443  1657.42   36.977  203.117   2.6842  201.560   2.2505 1.557449 3.502856 
1 1 1    9    1   77 o  124.698   1.3906  634.008   14.135  626.768   20.124  641.061   19.860  123.958   1.9916  125.366   1.9434 -1.407845 2.782645 
1 1 1    9    1   78 o   67.739   1.5253  187.112   8.4221  176.682   12.146  196.771   11.689   65.765   2.2691   69.420   2.0679 -3.655190 3.070014 
1 1 1    9    1   79 o  179.455   1.5901  1313.33   23.261  1312.45   31.020  1314.46   35.158  179.353   2.1218  179.463   2.4034 -0.1101532 3.205938 
1 1 1    9    1   80 o   40.000   2.3872   65.535   7.7483   55.752   9.5381   84.518   13.287   36.799   3.2119   45.319   3.6268 -8.520638 4.844614 
1 1 1    9    1   81 f   83.139   1.6007  281.910   10.848  273.410   13.687  296.271   17.791   81.832   2.0534   85.146   2.5662 -3.313965 3.286607 
1 1 1    9    1   82 o   43.971   2.2357   79.118   7.9872   76.012   9.9242   84.830   13.457   43.043   2.8445   45.389   3.6684 -2.346111 4.642001 
1 1 1    9    1   83 o  134.262   1.6923  735.347   18.521  742.220   26.131  728.409   26.254  134.831   2.3775  133.568   2.4114 1.263596 3.386339 
1 1 1    9    1   84 o  117.982   1.6132  567.819   15.514  559.003   18.672  587.476   27.883  117.039   1.9571  119.899   2.8529 -2.859238 3.459655 
1 1 1    9    1   85 o   81.732   1.6025  272.508   10.676  274.588   13.627  269.201   17.181   82.021   2.0381   81.134   2.6011 0.8866425 3.304506 
1 1 1    9    1   86 o   57.529   1.8651  135.204   8.7348  128.991   11.023  145.692   14.320   56.146   2.4141   59.620   2.9558 -3.474834 3.816377 
1 1 1    9    1   87 o   45.095   2.3007   83.269   8.4291   94.278   11.101   68.282   12.952   47.935   2.8541   40.617   3.9625 7.317966 4.883318 
1 1 1    9    1   88 o   29.488   3.4568   36.101   8.1517   29.094   10.864   45.127   12.331   26.107   5.2867   32.789   4.7519 -6.682030 7.108446 
1 1 1    9    1   89 o   49.040   2.3533   98.490   9.3796   93.207   11.394  109.599   16.522   47.637   2.9486   51.523   3.9645 -3.885933 4.940789 
1 1 1    9    1   90 o   74.257   1.8305  225.112   11.080  214.794   13.295  248.573   20.048   72.470   2.2533   77.839   3.1662 -5.369728 3.886183 
1 1 1    9    1   91 o  119.055   1.6758  578.572   16.263  584.604   19.750  565.867   28.662  119.632   2.0253  117.508   2.9947 2.124161 3.615260 
1 1 1    9    1   92 o   91.204   1.6504  339.572   12.270  311.172   15.442  388.202   20.208   87.255   2.1711   97.375   2.5480 -10.11929 3.347583 
1 1 1    9    1   93 f   94.097   1.5970  361.472   12.250  347.244   15.639  384.061   19.706   92.173   2.0814   96.845   2.4983 -4.671761 3.251685 
1 1 1    9    1   94 o   25.808   2.9240   27.654   6.0431   27.941   9.0898   27.426   8.0898   25.638   4.5143   25.496   4.0259 0.1415672 6.048747 
1 1 1    9    1   95 o   15.600   4.2441   10.385   5.5393   17.180   8.5380   5.4464   7.2792   19.957   5.1977   13.235   4.9740 6.721575 7.194230 
1 1 1    9    1   96 o  149.523   1.4227  912.795   17.341  922.111   24.851  903.955   24.209  150.150   2.0304  148.672   1.9976 1.477173 2.848337 
1 1 1    9    1   97 o  111.537   1.3720  507.942   12.474  494.839   17.773  520.664   17.513  109.983   1.9824  112.832   1.9041 -2.849655 2.748718 
1 1 1    9    1   98 o  119.461   1.3744  582.786   13.384  562.837   18.982  602.507   18.873  117.273   1.9857  121.355   1.9079 -4.081604 2.753731 
1 1 1    9    1   99 o  107.805   1.3678  474.696   12.020  463.242   17.190  485.653   16.813  106.371   1.9826  108.935   1.8934 -2.564148 2.741429 
1 1 1    9    1  100 o   44.372   1.8496   80.728   6.6753   81.986   9.8775   79.670   9.0564   44.561   2.7324   43.964   2.5379 0.5972900 3.729224 
1 1 1    9    1  101 o  119.488   1.3705  583.414   13.349  586.142   19.165  580.843   18.603  119.603   1.9658  119.077   1.9166 0.5262299 2.745457 
1 1 1    9    1  102 o   83.998   1.4045  288.425   9.6170  289.731   13.980  287.252   13.250   84.049   2.0405   83.713   1.9418 0.3356018 2.816745 
1 1 1    9    1  103 o   32.486   2.3080   43.603   6.0721   47.422   9.1991   40.653   8.0832   33.631   3.4024   31.159   3.2293 2.471985 4.690885 
1 1 1    9    1  104 o   28.836   2.6697   34.595   6.2041   34.387   8.9242   34.790   8.6309   28.408   3.9615   28.628   3.7917 -0.2199745 5.483657 
1 1 1    9    1  105 o   56.047   1.7513  128.896   7.9913  109.383   10.930  151.308   11.714   51.408   2.6168   60.561   2.3775 -9.152454 3.535550 
1 1 1    9    1  106 o   60.126   1.8164  148.467   8.8923  141.939   13.183  153.917   12.045   58.494   2.7727   61.041   2.4256 -2.547291 3.683935 
1 1 1    9    1  107 o   10.154   4.2335   1.2151   5.8205  -7.9741   10.016   5.9007   7.1522   10.439   4.8567   13.176   4.9349 -2.737052 6.923900 
1 1 1    9    1  108 o   71.565   1.5994  209.977   9.3305  206.046   15.053  212.430   11.890   70.496   2.6240   71.824   2.0329 -1.328148 3.319404 
1 1 1    9    1  109 o   70.917   1.5212  206.128   8.7937  204.330   13.021  207.635   11.924   70.330   2.2743   70.981   2.0629 -0.6510468 3.070549 
1 1 1    9    1  110 o   56.729   1.6782  132.214   7.7519  136.571   11.738  128.843   10.324   57.375   2.5158   55.815   2.2738 1.559689 3.391114 
1 1 1    9    1  111 o   28.067   2.9108   33.166   6.5630   29.499   11.317   35.024   8.0559   25.420   5.6119   28.645   3.5243 -3.224411 6.626786 
1 1 1    9    1  112 o   29.059   2.8203   35.509   6.5968   40.439   9.7845   31.401   8.9321   30.571   4.0239   26.802   4.2284 3.769281 5.837081 
1 1 1    9    1  113 o   50.205   1.8355  103.943   7.4989  123.701   12.557   92.990   9.3490   54.341   2.8447   47.271   2.4344 7.069393 3.744174 
1 1 1    9    1  114 o   74.736   1.8322  230.235   11.162  216.455   14.889  247.919   16.867   72.053   2.5390   77.012   2.6910 -4.959076 3.699710 
1 1 1    9    1  115 o   23.785   3.0221   24.164   5.7272   21.337   10.366   25.406   6.8710   21.222   5.8193   24.178   3.5955 -2.956137 6.840450 
1 1 1    9    1  116 o   29.795   3.3839   38.239   8.0732   35.062   10.755   42.339   12.219   27.709   4.9430   30.400   5.1121 -2.690546 7.111070 
1 1 1    9    1  117 o   63.103   1.9267  165.024   9.8991  154.658   12.717  180.963   15.769   60.693   2.5763   65.352   2.9679 -4.658432 3.930127 
1 1 1    9    1  118 o   44.253   2.3861   82.117   8.5756   81.481   11.183   83.025   13.361   43.622   3.1666   43.583   3.7988 0.3907394E-01 4.945496 
1 1 1    9    1  119 o   15.672   5.1631   11.304   7.6445   5.6611   9.9326   19.504   11.973   13.738   5.6087   19.713   6.4599 -5.974963 8.554955 
1 1 1    9    1  120 o   9.7252   4.5815  -7.6597   9.3921 -36.7182   15.184   10.348   11.953   9.2787   4.6526   15.908   6.2682 -6.628893 7.806231 
1 1 1    9    1  121 o   36.751   4.6670   62.372   13.666   0.0000   0.0000   62.372   13.666  ?   ?    36.751   4.6670 0.000000 4.667031 
1 1 1    9    1  122 o   59.800   2.5511  151.523   12.407  157.638   16.521  143.615   18.789   60.138   3.3839   56.540   4.1047 3.597786 5.319695 
1 1 1    9    1  123 o   63.224   2.4634  169.060   12.671  173.177   16.835  163.679   19.246   63.111   3.2838   60.557   3.9199 2.554649 5.113628 
1 1 1    9    1  124 o   33.097   4.0271   49.619   10.641   61.291   13.939   33.316   16.475   36.036   4.8698   23.939   7.5530 12.09633 8.986789 
1 1 1    9    1  125 o   13.216   5.4099   5.7189   9.2716   10.963   13.210   0.6270   13.017   16.013   6.4938   13.156   5.8915 2.857012 8.768107 
1 1 1    9    1  126 o   9.6750   4.6230  -9.9298   10.251   1.2804   13.585 -24.7506   15.620   13.481   6.0293   10.391   5.1259 3.090420 7.913713 
1 1 1    9    1  127 o   25.704   5.4493   32.996   11.063   31.280   14.200   35.645   17.645   23.565   6.9313   24.114   7.8383 -0.5486851 10.46338 
1 1 1    9    1  128 o   20.944   5.9049   23.019   10.513   16.723   13.456   32.888   16.845   17.803   6.7467   23.226   7.6650 -5.422918 10.21127 
1 1 1    9    1  129 o   41.464   3.4342   76.263   11.504   65.481   14.762   92.938   18.357   36.748   5.0622   43.540   5.2800 -6.791634 7.314663 
1 1 1    9    1  130 o   12.479   5.5655   0.9889   11.488  -9.5227   16.020   12.117   16.484   12.269   5.8394   16.557   7.0260 -4.287488 9.135811 
1 1 1    9    1  131 o   17.489   6.3363   16.292   11.628   15.702   16.407   16.887   16.480   17.433   7.1731   17.764   7.2351 -0.3311386 10.18817 
1 1 1    9    1  132 o   32.050   4.8536   49.582   12.284   62.961   16.827   34.317   17.973   34.595   6.1946   23.119   7.9194 11.47542 10.05435 
1 1 1    9    2 -131 o   23.200   5.0821   26.733   9.3445   36.974   11.214   3.4660   16.903   27.257   5.2374   14.686   6.6333 12.57127 8.451669 
1 1 1    9    2 -130 o   9.5415   4.4929  -6.3744   9.0143  -8.0191   10.765  -2.5151   16.490   10.194   4.8328   13.478   6.2572 -3.284091 7.906192 
1 1 1    9    2 -129 o   19.711   5.7049   20.346   9.6882   35.999   13.877   5.4629   13.532   25.455   6.6249   14.263   6.2114 11.19125 9.081409 
1 1 1    9    2 -128 o   10.625   4.8593  -2.7457   9.4303   3.3499   13.286  -8.9355   13.388   13.719   6.0585   11.327   5.3758 2.391392 8.099717 
1 1 1    9    2 -127 o   14.924   5.6899   10.132   9.6059   11.575   13.525   8.6626   13.645   16.074   6.5516   15.242   6.4265 0.8326063 9.177288 
1 1 1    9    2 -126 o   14.792   5.8296   9.3507   10.340   10.712   13.236   7.2180   16.565   15.817   6.4681   15.583   6.8274 0.2335882 9.404795 
1 1 1    9    2 -125 o   35.783   3.3937   56.543   9.7807   50.811   11.634   70.355   18.060   33.048   4.4303   36.927   6.2208 -3.878952 7.637105 
1 1 1    9    2 -124 o   14.312   5.7933   7.7436   10.491   7.7436   10.491   0.0000   0.0000   14.312   5.7933  ?   ?  0.000000 5.793287 
1 1 1    9    2 -123 o   10.743   4.7367  -0.0024   8.0907  -7.4500   10.241   12.367   13.198   10.156   4.7841   16.510   6.5608 -6.354193 8.119840 
1 1 1    9    2 -122 f   20.558   5.0409   20.527   8.3815   22.704   10.788   17.212   13.312   20.994   6.0027   18.312   6.7566 2.681717 9.037936 
1 1 1    9    2 -121 o   16.508   5.3256   13.168   8.1546   5.7120   10.524   24.373   12.901   13.760   5.7110   21.339   6.6769 -7.579239 8.786199 
1 1 1    9    2 -120 o   22.159   4.8196   23.298   8.4571   22.139   11.047   24.940   13.144   20.781   6.1140   21.626   6.7356 -0.8448181 9.096661 
1 1 1    9    2 -119 o   36.420   3.2762   57.594   9.6224   70.102   13.798   45.751   13.426   39.302   4.3813   30.748   5.5612 8.554247 7.079755 
1 1 1    9    2 -118 o   21.900   5.1014   22.823   8.9367   28.024   12.557   17.485   12.722   23.443   6.3949   18.801   6.6489 4.642689 9.225114 
1 1 1    9    2 -117 o   38.874   3.2791   65.071   10.294   72.684   13.389   54.065   16.098   40.500   4.1126   33.294   6.1584 7.205437 7.405387 
1 1 1    9    2 -116 o   26.011   4.3756   30.488   8.9484   34.447   12.426   26.222   12.898   26.741   5.8624   22.852   6.5727 3.889029 8.807272 
1 1 1    9    2 -115 o   35.824   2.9998   54.568   8.6798   49.697   11.379   61.347   13.423   33.486   4.2655   37.060   4.5378 -3.574413 6.227850 
1 1 1    9    2 -114 o   44.490   2.5290   82.863   9.1340   79.434   11.949   87.685   14.168   43.084   3.4305   44.970   3.9036 -1.886314 5.196794 
1 1 1    9    2 -113 o   10.673   4.6772  -0.6996   7.7773  -5.0523   10.146   5.5023   12.111   10.991   5.0320   14.889   6.1482 -3.898123 7.944944 
1 1 1    9    2 -112 o   13.465   5.1352   6.2393   7.8261   9.6753   10.129   1.1501   12.327   15.791   5.8811   13.784   5.9661 2.006534 8.377483 
1 1 1    9    2 -111 o   24.680   4.4962   26.980   8.7123   28.496   10.513   23.656   15.567   25.020   5.3187   22.310   7.3687 2.710669 9.087696 
1 1 1    9    2 -110 o   51.110   2.4383  108.458   10.129  111.409   13.809  105.020   14.903   51.409   3.3130   49.702   3.7052 1.707264 4.970310 
1 1 1    9    2 -109 o   11.120   4.9610  -2.5639   9.1382   2.4171   11.084 -13.1320   16.146   13.698   5.7847   12.881   6.0491 0.8165083 8.369860 
1 1 1    9    2 -108 o   67.849   2.2586  190.194   12.474  192.892   15.482  185.202   21.060   68.086   2.7955   66.057   3.9289 2.028580 4.821940 
1 1 1    9    2 -107 o   48.067   2.5677   95.898   10.024   96.214   11.953   95.148   18.406   47.961   3.0735   46.794   4.8979 1.167202 5.782357 
1 1 1    9    2 -106 o   59.371   2.3849  145.720   11.519  148.992   14.110  139.184   19.942   59.834   2.9017   57.117   4.3150 2.716908 5.199941 
1 1 1    9    2 -105 o   29.965   3.4140   37.938   8.1906   35.024   10.548   42.363   12.998   28.325   4.7357   30.958   5.3437 -2.633259 7.140146 
1 1 1    9    2 -104 o   10.918   4.6894   0.0232   7.5032  -4.5705   9.4888   7.6883   12.257   10.908   4.9441   16.131   6.3501 -5.222923 8.047845 
1 1 1    9    2 -103 o   41.645   2.7211   71.930   9.1866   72.011   10.928   71.736   16.964   41.514   3.2552   40.665   5.2392 0.8488693 6.168119 
1 1 1    9    2 -102 o   53.856   2.3243  119.520   10.180  119.483   12.098  119.610   18.839   53.724   2.7720   53.143   4.3880 0.5805397 5.190199 
1 1 1    9    2 -101 o   35.975   1.7688   53.135   5.1712   70.834   10.935   48.037   5.8690   41.215   3.2818   34.145   2.1191 7.070030 3.906494 
1 1 1    9    2 -100 o   46.518   1.5336   88.593   5.8073   99.479   11.699   85.033   6.6897   49.013   2.9418   45.534   1.8059 3.479080 3.451911 
1 1 1    9    2  -99 o   50.919   1.5054  106.081   6.2417  109.259   11.916  104.879   7.3274   51.424   2.8538   50.591   1.7796 0.8332520 3.363164 
1 1 1    9    2  -98 o   47.422   1.5661   92.028   6.0456   94.015   11.735   91.310   7.0535   47.670   3.0358   47.201   1.8368 0.4695816 3.548242 
1 1 1    9    2  -97 o   62.596   1.4888  160.090   7.5965  141.410   15.059  166.467   8.7979   58.497   3.1699   63.786   1.6936 -5.289021 3.593957 
1 1 1    9    2  -96 f   64.278   1.4349  168.741   7.5181  164.691   13.476  170.571   9.0588   63.299   2.6174   64.574   1.7225 -1.275219 3.133384 
1 1 1    9    2  -95 o   54.319   1.5375  120.610   6.8007  132.288   12.697  115.912   8.0533   56.711   2.7549   53.213   1.8595 3.497707 3.323682 
1 1 1    9    2  -94 o   59.409   1.4945  144.204   7.2316  157.631   13.239  138.494   8.6334   61.960   2.6272   58.185   1.8225 3.774769 3.197465 
1 1 1    9    2  -93 o   89.898   1.5077  329.947   11.049  304.803   23.713  336.919   12.487   86.047   3.3874   90.824   1.6866 -4.777222 3.784055 
1 1 1    9    2  -92 o   65.185   1.5389  173.464   8.1769  168.656   14.284  175.806   9.9725   64.105   2.7399   65.572   1.8676 -1.466972 3.315879 
1 1 1    9    2  -91 o   87.616   1.4501  313.290   10.357  323.150   17.378  307.858   12.897   88.850   2.4016   86.820   1.8224 2.029938 3.014741 
1 1 1    9    2  -90 o  192.648   1.5870  1514.82   24.922  1523.99   37.158  1507.33   33.600  193.061   2.3611  192.056   2.1462 1.005142 3.190804 
1 1 1    9    2  -89 o   14.522   4.7807   8.3237   6.5544   22.376   11.651   1.8174   7.9279   22.818   6.1329   12.072   4.9786 10.74634 7.899340 
1 1 1    9    2  -88 f   70.324   1.6460  201.827   9.4355  200.960   14.524  202.461   12.411   70.063   2.5473   70.368   2.1663 -0.3044968 3.343946 
1 1 1    9    2  -87 o   72.840   1.5832  216.490   9.4003  234.731   20.326  211.527   10.602   75.634   3.3049   71.966   1.8088 3.668159 3.767464 
1 1 1    9    2  -86 o   58.700   1.7244  140.730   8.2421  134.139   17.658  142.566   9.3196   57.071   3.8176   59.066   1.9383 -1.994583 4.281426 
1 1 1    9    2  -85 f   70.096   1.6086  200.462   9.1914  190.986   19.541  203.155   10.416   68.200   3.5269   70.533   1.8131 -2.332634 3.965647 
1 1 1    9    2  -84 o   96.330   1.4270  378.489   11.205  355.251   19.774  389.480   13.600   93.210   2.6051   97.704   1.7076 -4.493256 3.114875 
1 1 1    9    2  -83 f  212.555   1.6451  1843.13   28.504  1803.79   47.256  1865.62   35.737  210.098   2.7593  213.794   2.0506 -3.695755 3.437864 
1 1 1    9    2  -82 o   82.683   1.4680  278.832   9.8942  285.910   18.416  275.961   11.731   83.613   2.7056   82.244   1.7498 1.368462 3.222160 
1 1 1    9    2  -81 o   27.922   2.8103   32.171   6.3096   40.678   13.361   29.730   7.1581   31.004   5.4873   26.756   3.3557 4.248333 6.432035 
1 1 1    9    2  -80 o  102.506   1.4123  428.496   11.801  439.909   21.207  423.376   14.203  103.800   2.5064  101.878   1.7102 1.921303 3.034306 
1 1 1    9    2  -79 o   38.942   2.1667   62.073   6.8508   78.915   14.256   57.016   7.8120   43.724   4.0456   37.280   2.5867 6.443932 4.801886 
1 1 1    9    2  -78 o   15.193   5.0372   8.9801   7.2724  -0.3393   12.734   13.491   8.8595   14.367   6.1386   18.094   5.5112 -3.726674 8.249558 
1 1 1    9    2  -77 o  138.812   1.4615  785.739   16.537  807.527   23.845  765.547   22.954  140.688   2.0792  136.984   2.0557 3.704132 2.923852 
1 1 1    9    2  -76 o  191.592   1.5886  1496.92   24.810  1503.42   35.267  1490.55   34.909  191.954   2.2539  191.132   2.2406 0.8219604 3.178125 
1 1 1    9    2  -75 o   73.147   1.6960  218.199   10.113  211.868   14.642  223.973   13.983   72.010   2.4982   74.053   2.3194 -2.043251 3.408888 
1 1 1    9    2  -74 o  128.978   1.4978  678.300   15.747  676.796   22.390  679.773   22.151  128.807   2.1324  129.091   2.1051 -0.2844543 2.996418 
1 1 1    9    2  -73 o   8.0014   3.9293 -18.1262   8.8389 -15.0213   13.887 -20.2406   11.460   11.886   5.5904   9.5374   4.6378 2.348206 7.263775 
1 1 1    9    2  -72 o   94.826   1.7679  366.692   13.665  367.037   21.209  366.447   17.869   94.793   2.7477   94.775   2.3130 0.1783752E-01 3.591625 
1 1 1    9    2  -71 o  255.510   1.9733  2662.66   41.100  2672.46   62.922  2655.36   54.280  255.866   3.0169  255.096   2.6103 0.7694550 3.989419 
1 1 1    9    2  -70 o   84.226   1.5118  289.241   10.380  297.936   17.881  284.822   12.747   85.414   2.5711   83.572   1.8712 1.842033 3.179939 
1 1 1    9    2  -69 o  190.434   1.4679  1478.56   22.786  1476.07   34.635  1480.47   30.257  190.230   2.2335  190.531   1.9481 -0.3009644 2.963768 
1 1 1    9    2  -68 o  144.207   1.4195  847.837   16.686  849.124   24.218  846.674   23.024  144.292   2.0590  144.088   1.9602 0.2039642 2.842877 
1 1 1    9    2  -67 o   81.329   1.5604  269.684   10.345  265.068   14.234  274.852   15.061   80.588   2.1688   82.058   2.2537 -1.470238 3.127789 
1 1 1    9    2  -66 o  125.607   1.6589  643.281   16.985  640.380   20.438  649.758   30.539  125.312   2.0008  126.183   2.9690 -0.8712463 3.580310 
1 1 1    9    2  -65 o   38.945   2.2862   62.075   7.2258   62.053   10.425   62.096   10.024   38.849   3.3239   38.875   3.1914 -0.2674103E-01 4.608001 
1 1 1    9    2  -64 o   39.720   2.2533   64.552   7.2657   59.139   11.801   67.857   9.2207   37.857   3.8788   40.686   2.7972 -2.828938 4.782200 
1 1 1    9    2  -63 o  122.199   1.4893  608.788   14.834  598.739   19.731  621.853   22.498  121.173   1.9976  123.481   2.2352 -2.308777 2.997752 
1 1 1    9    2  -62 o  135.921   1.4989  753.183   16.607  772.298   22.323  729.494   24.851  137.620   1.9899  133.742   2.2795 3.878448 3.025900 
1 1 1    9    2  -61 o   76.547   1.5835  238.886   9.8807  245.578   13.500  231.165   14.501   77.572   2.1370   75.248   2.3670 2.324219 3.188947 
1 1 1    9    2  -60 o  137.125   1.4987  766.579   16.753  757.610   22.236  778.352   25.477  136.307   2.0013  138.151   2.2623 -1.844254 3.020447 
1 1 1    9    2  -59 o   87.133   1.5219  309.518   10.809  308.783   14.482  310.444   16.242   87.020   2.0416   87.219   2.2865 -0.1986008 3.065326 
1 1 1    9    2  -58 o  168.333   1.6669  1155.26   22.873  1169.71   28.816  1130.65   37.605  169.368   2.0872  166.486   2.7709 2.881958 3.469090 
1 1 1    9    2  -57 o  154.586   1.4340  974.180   18.070  997.143   25.935  952.516   25.191  156.380   2.0345  152.840   2.0219 3.539078 2.868360 
1 1 1    9    2  -56 o  211.783   1.5103  1828.48   26.073  1818.01   34.654  1842.15   39.579  211.156   2.0133  212.540   2.2845 -1.384521 3.045045 
1 1 1    9    2  -55 o   56.086   1.4655  128.321   6.6942  124.149   8.4999  135.136   10.863   55.149   1.8936   57.519   2.3217 -2.370594 2.995997 
1 1 1    9    2  -54 o  274.226   1.7671  3065.87   39.501  3023.77   52.300  3121.78   60.270  272.305   2.3562  276.662   2.6725 -4.357147 3.562867 
1 1 1    9    2  -53 o  310.448   1.9314  3929.47   48.876  3911.90   65.163  3952.07   73.900  309.712   2.5811  311.272   2.9125 -1.560028 3.891647 
1 1 1    9    2  -52 o  129.783   1.4459  686.631   15.296  687.774   22.646  685.673   20.744  129.877   2.1391  129.683   1.9623 0.1943817 2.902814 
1 1 1    9    2  -51 o  225.507   1.6436  2073.11   30.212  2063.87   38.196  2088.55   49.379  224.989   2.0827  226.303   2.6768 -1.314728 3.391594 
1 1 1    9    2  -50 o  235.549   1.6868  2261.84   32.387  2281.02   41.265  2231.08   52.264  236.529   2.1402  233.899   2.7412 2.630463 3.477719 
1 1 1    9    2  -49 o  291.042   1.9447  3453.32   46.136  3442.04   58.394  3472.05   75.264  290.543   2.4656  291.765   3.1646 -1.222290 4.011714 
1 1 1    9    2  -48 o   59.391   1.5994  143.892   7.7361  140.884   10.213  147.941   11.849   58.745   2.1364   60.187   2.4200 -1.441982 3.228104 
1 1 1    9    2  -47 o  352.005   2.2522  5051.75   64.624  5124.40   92.025  4981.07   90.773  354.471   3.1848  349.478   3.1864 4.992706 4.505140 
1 1 1    9    2  -46 o   59.496   1.6916  144.411   8.1958  142.088   10.465  148.096   13.180   58.996   2.1800   60.206   2.6923 -1.210934 3.464193 
1 1 1    9    2  -45 o  600.378   3.5899 14701.44  175.687 14859.06  250.621 14549.15  246.352  603.374   5.0956  597.055   5.0618 6.319702 7.182418 
1 1 1    9    2  -44 o  250.038   1.5677  2548.43   31.953  2568.64   45.579  2528.91   44.807  251.012   2.2276  249.063   2.2070 1.948380 3.135760 
1 1 1    9    2  -43 f  308.878   1.9195  3889.15   48.328  3836.57   72.263  3931.70   65.005  306.749   2.8900  310.541   2.5680 -3.792389 3.866059 
1 1 1    9    2  -42 o  130.040   1.2832  689.272   13.603  715.610   21.424  671.484   17.607  132.494   1.9837  128.348   1.6829 4.146866 2.601353 
1 1 1    9    2  -41 o  287.716   1.9335  3374.43   45.347  3450.52   75.985  3332.34   56.514  290.902   3.2044  285.903   2.4249 4.999481 4.018522 
1 1 1    9    2  -40 o  418.620   2.4475  7144.09   83.516  7022.17  123.818  7245.85  113.125  414.974   3.6604  421.552   3.2921 -6.578247 4.923044 
1 1 1    9    2  -39 o  564.077   3.1916 12973.08  146.750 12865.84  218.787 13060.78  197.859  561.612   4.7791  565.896   4.2893 -4.283936 6.421671 
1 1 1    9    2  -38 o  467.117   2.6916  8895.37  102.488  8971.68  154.981  8836.06  136.627  469.043   4.0535  465.512   3.6006 3.530975 5.421701 
1 1 1    9    2  -37 o   50.932   1.6580  105.851   6.8745  106.581   10.781  105.350   8.9243   51.066   2.5984   50.791   2.1604 0.2744789 3.379262 
1 1 1    9    2  -36 o  472.824   2.8845  9114.09  111.176  9267.58  184.345  9026.36  139.375  476.688   4.7442  470.509   3.6340 6.179108 5.976030 
1 1 1    9    2  -35 o  245.215   1.6369  2450.94   32.720  2436.59   49.270  2462.26   43.764  244.484   2.4722  245.773   2.1845 -1.289124 3.299072 
1 1 1    9    2  -34 o  162.433   1.3394  1075.41   17.735  1061.63   26.630  1086.39   23.774  161.384   2.0243  163.257   1.7864 -1.873291 2.699817 
1 1 1    9    2  -33 o  159.493   1.3326  1036.84   17.326  1066.61   26.610  1014.93   22.827  161.763   2.0181  157.796   1.7747 3.966370 2.687393 
1 1 1    9    2  -32 o  443.907   2.7252  8032.79   98.612  8134.42  141.259  7936.18  137.726  446.667   3.8797  441.192   3.8296 5.474396 5.451387 
1 1 1    9    2  -31 o  163.042   1.4077  1083.49   18.709  1132.97   27.640  1041.66   25.416  166.720   2.0339  159.861   1.9504 6.859100 2.817944 
1 1 1    9    2  -30 o  453.243   2.9658  8374.32  109.576  8233.22  165.536  8484.37  146.189  449.353   4.5193  456.179   3.9314 -6.826294 5.989961 
1 1 1    9    2  -29 o  671.143   4.2509 18365.27  232.561 18405.63  356.387 18335.34  306.912  671.713   6.5088  670.503   5.6153 1.209595 8.596326 
1 1 1    9    2  -28 o  402.540   2.6788  6605.20   87.899  6515.53  133.346  6674.10  116.888  399.761   4.0921  404.612   3.5440 -4.851837 5.413423 
1 1 1    9    2  -27 o  216.359   1.7209  1908.00   30.350  1841.33   46.192  1958.65   40.260  212.537   2.6663  219.207   2.2531 -6.670074 3.490781 
1 1 1    9    2  -26 o  120.223   1.4609  589.115   14.317  596.327   23.002  584.553   18.292  120.953   2.3330  119.755   1.8739 1.197838 2.992347 
1 1 1    9    2  -25 o  575.444   3.9729 13500.04  186.355 13223.27  259.170 13796.33  268.151  569.436   5.5835  581.639   5.6557 -12.20374 7.947488 
1 1 1    9    2  -24 o  347.977   2.5627  4935.81   72.692  4797.12  100.879  5085.59  104.839  343.034   3.6077  353.197   3.6414 -10.16272 5.125919 
1 1 1    9    2  -23 o  359.735   2.8905  5275.12   84.759  5317.07  110.211  5214.40  132.606  361.145   3.7438  357.620   4.5489 3.524139 5.891358 
1 1 1    9    2  -22 o  301.637   2.5275  3708.70   62.147  3707.25   80.354  3710.85   98.038  301.567   3.2688  301.701   3.9864 -0.1331482 5.155248 
1 1 1    9    2  -21 o  292.118   2.4771  3478.30   58.985  3434.26   75.602  3546.81   94.294  290.253   3.1954  294.959   3.9218 -4.705688 5.058772 
1 1 1    9    2  -20 o  634.637   4.0429 16419.92  209.146 16349.66  275.803 16515.00  320.832  633.216   5.3433  636.359   6.1850 -3.143860 8.173448 
1 1 1    9    2  -19 o  452.659   2.9792  8352.38  109.926  8226.19  143.807  8529.76  170.498  449.204   3.9274  457.397   4.5729 -8.193268 6.027879 
1 1 1    9    2  -18 o  255.568   1.7936  2662.21   37.366  2694.50   53.685  2631.87   52.039  257.107   2.5616  254.102   2.5124 3.004837 3.587994 
1 1 1    9    2  -17 o  528.187   3.1895 11372.34  137.325 11350.36  194.162 11394.34  194.252  527.635   4.5143  528.657   4.5077 -1.021545 6.379551 
1 1 1    9    2  -16 o  328.440   2.1348  4396.92   57.155  4381.90   80.990  4411.83   80.669  327.867   3.0304  328.985   3.0081 -1.118439 4.269909 
1 1 1    9    2  -15 o  387.163   2.4348  6109.88   76.842  6041.37  108.107  6179.84  109.243  384.969   3.4450  389.356   3.4420 -4.386780 4.869858 
1 1 1    9    2  -14 f  149.639   1.4155  912.659   17.266  925.765   25.099  900.886   23.788  150.707   2.0431  148.669   1.9629 2.038437 2.833256 
1 1 1    9    2  -13 o  477.659   2.9137  9300.30  113.447  9357.52  161.545  9244.62  159.354  479.096   4.1365  476.198   4.1052 2.898010 5.827843 
1 1 1    9    2  -12 o  513.988   3.1083 10768.94  130.231 10708.13  183.635 10830.47  184.719  512.499   4.3957  515.418   4.3966 -2.919128 6.217081 
1 1 1    9    2  -11 o  276.916   1.8784  3125.53   42.400  3070.96   59.574  3181.54   60.359  274.481   2.6626  279.379   2.6504 -4.898193 3.756887 
1 1 1    9    2  -10 o  185.785   1.6092  1406.84   24.370  1302.12   36.577  1490.44   32.680  178.732   2.5106  191.223   2.0966 -12.49088 3.270855 
1 1 1    9    2   -9 o  283.494   2.0420  3275.81   47.189  3260.85   72.439  3286.83   62.196  282.834   3.1420  283.964   2.6870 -1.129883 4.134247 
1 1 1    9    2   -8 o  666.184   3.9490 18092.18  214.444 18259.97  305.921 17930.08  300.686  669.191   5.6082  663.121   5.5627 6.070007 7.899065 
1 1 1    9    2   -7 o  575.535   3.4459 13502.76  161.663 13308.12  226.154 13706.16  231.182  571.325   4.8561  579.805   4.8914 -8.479492 6.892574 
1 1 1    9    2   -6 o  873.938   5.9130 31144.39  421.234 30893.39  512.434 31667.42  739.721  870.304   7.2232  880.806   10.303 -10.50238 12.58256 
1 1 1    9    2   -5 o  663.036   4.5419 17922.78  245.475 17971.69  301.447 17826.50  422.931  663.892   5.5703  661.063   7.8486 2.828369 9.624352 
1 1 1    9    2   -4 o  243.126   1.9919  2409.31   39.477  2421.63   48.795  2385.97   67.163  243.743   2.4559  241.933   3.4057 1.810562 4.198801 
1 1 1    9    2   -3 o  747.463   5.0871 22779.37  309.951 22716.31  378.882 22906.95  538.928  746.361   6.2276  749.283   8.8237 -2.921936 10.79999 
1 1 1    9    2   -2 o  281.594   2.6969  3232.18   61.904  3232.18   61.904   0.0000   0.0000  281.594   2.6969  ?   ?  0.000000 2.696883 
1 1 1    9    2   -1 o  228.477   2.0883  2127.73   38.892  2122.89   50.374  2134.87   61.195  228.212   2.7079  228.850   3.2804 -0.6374664 4.253699 
1 1 1    9    2    0 o  255.578   2.2449  2662.47   46.768  2587.85   59.534  2782.73   75.583  251.965   2.8986  261.273   3.5489 -9.307587 4.582201 
1 1 1    9    2    1 o  376.745   3.3533  5785.88  102.980  5887.53  148.003  5690.48  143.380  380.010   4.7779  373.598   4.7081 6.411621 6.707815 
1 1 1    9    2    2 o  455.899   3.5291  8472.63  131.151  8826.71  214.761  8262.04  165.620  465.264   5.6626  450.173   4.5133 15.09171 7.241255 
1 1 1    9    2    3 o  561.626   4.2589 12859.10  194.975 12735.44  306.151 12943.47  252.892  558.815   6.7210  563.418   5.5064 -4.603638 8.688605 
1 1 1    9    2    4 o  246.352   2.0021  2473.67   40.204  2512.55   57.882  2437.43   55.885  248.273   2.8601  244.534   2.8036 3.738861 4.005053 
1 1 1    9    2    5 o  593.165   4.0924 14343.61  197.874 14156.50  276.592 14539.76  283.198  589.216   5.7588  597.136   5.8181 -7.919861 8.186176 
1 1 1    9    2    6 o  242.537   1.9765  2397.66   39.077  2387.53   55.394  2407.68   55.133  242.018   2.8079  243.037   2.7829 -1.019073 3.953336 
1 1 1    9    2    7 o  582.211   4.0210 13818.64  190.830 13903.02  271.345 13736.06  268.426  583.919   5.7008  580.403   5.6736 3.515442 8.042921 
1 1 1    9    2    8 o  401.053   3.1603  6556.50  103.315  6578.88  133.837  6523.50  162.523  401.718   4.0871  400.001   4.9845 1.717316 6.445898 
1 1 1    9    2    9 o  444.552   3.4544  8056.10  125.178  8117.06  162.755  7967.81  195.866  446.205   4.4747  442.054   5.4356 4.151154 7.040505 
1 1 1    9    2   10 o  413.284   2.9624  6962.37   99.800  6963.22  141.278  6961.52  140.999  413.283   4.1936  413.233   4.1859 0.5010986E-01 5.925208 
1 1 1    9    2   11 o  350.502   2.5886  5007.59   73.959  5028.23  105.047  4987.29  104.146  351.207   3.6693  349.774   3.6528 1.432556 5.177503 
1 1 1    9    2   12 o  182.327   1.7279  1354.96   25.680  1332.43   36.389  1377.32   36.247  180.800   2.4691  183.821   2.4190 -3.020660 3.456583 
1 1 1    9    2   13 o  288.762   2.4524  3398.79   57.726  3455.42   92.561  3362.76   73.846  291.138   3.9003  287.219   3.1541 3.919037 5.016016 
1 1 1    9    2   14 f  640.149   4.8177 16707.73  251.393 16485.70  392.912 16861.63  327.110  635.720   7.5822  643.016   6.2407 -7.295532 9.820197 
1 1 1    9    2   15 o  303.518   2.5480  3755.07   63.041  3858.82  101.820  3690.58   80.279  307.659   4.0600  300.891   3.2731 6.768219 5.215035 
1 1 1    9    2   16 o  724.270   5.4137 21389.46  319.616 20957.30  496.574 21695.12  417.620  716.683   8.5000  729.316   7.0247 -12.63293 11.02712 
1 1 1    9    2   17 o  751.221   5.6048 23011.79  343.215 23032.88  543.186 22997.79  442.809  751.293   8.8696  750.872   7.2346 0.4211426 11.44592 
1 1 1    9    2   18 o  639.039   4.8120 16650.12  250.663 16636.47  396.165 16659.23  323.696  638.604   7.6104  639.137   6.2131 -0.5327148 9.824493 
1 1 1    9    2   19 o  319.270   2.6503  4155.01   68.974  4289.13  111.844  4072.70   87.619  324.355   4.2302  316.081   3.4007 8.273804 5.427590 
1 1 1    9    2   20 o  795.639   5.9223 25815.68  384.102 25607.48  603.115 25957.75  498.201  792.091   9.3409  797.674   7.6620 -5.582092 12.08135 
1 1 1    9    2   21 o  225.994   2.1231  2081.77   39.111  1988.98   60.440  2148.63   51.300  220.888   3.3567  229.589   2.7411 -8.701004 4.333773 
1 1 1    9    2   22 o  468.371   4.6862  8944.30  178.916  9012.32  312.680  8911.19  218.160  469.974   8.1619  467.461   5.7252 2.512146 9.969688 
1 1 1    9    2   23 o  177.035   2.4662  1277.52   35.589  1217.37   61.719  1307.49   43.560  172.742   4.3867  179.094   2.9838 -6.352753 5.305299 
1 1 1    9    2   24 o  635.310   6.1771 16461.47  319.895 16591.24  558.796 16398.21  390.151  637.376   10.755  633.984   7.5495 3.392639 13.14043 
1 1 1    9    2   25 o  300.205   3.2615  3673.88   79.814  3763.24  142.207  3632.79   96.435  303.773   5.7430  298.508   3.9632 5.264984 6.977704 
1 1 1    9    2   26 o  281.628   2.4134  3232.99   55.403  3281.37   88.712  3202.05   70.938  283.704   3.8360  280.267   3.1051 3.436676 4.935229 
1 1 1    9    2   27 o  565.393   4.7985 13034.60  221.154 13136.66  314.854 12935.20  310.706  567.476   6.8065  563.110   6.7689 4.365540 9.599332 
1 1 1    9    2   28 o  681.708   5.7126 18953.23  317.444 19245.08  454.866 18676.13  443.228  686.710   8.1259  676.493   8.0376 10.21735 11.42954 
1 1 1    9    2   29 o  350.025   3.1677  4994.52   90.380  5106.75  130.066  4889.74  125.681  353.898   4.5087  346.299   4.4523 7.598969 6.336473 
1 1 1    9    2   30 o  610.413   7.2854 15203.58  362.504   0.0000   0.0000 15203.58  362.504  ?   ?   610.413   7.2854 0.000000 7.285403 
1 1 1    9    2   31 o  756.573   6.3112 23350.35  389.223 23545.61  554.395 23160.55  546.577  759.388   8.9561  753.161   8.9028 6.226990 12.62823 
1 1 1    9    2   32 o  253.791   2.5169  2625.56   52.068  2663.17   74.373  2589.41   72.920  255.583   3.5698  252.019   3.5496 3.564041 5.034216 
1 1 1    9    2   33 o  299.637   2.5122  3659.87   61.361  3705.05   98.122  3630.85   78.634  301.445   3.9932  298.431   3.2324 3.013458 5.137546 
1 1 1    9    2   34 o  259.362   2.2734  2742.07   48.063  2832.56   77.984  2686.64   61.033  263.579   3.6296  256.716   2.9166 6.862976 4.656224 
1 1 1    9    2   35 o  210.886   2.0119  1812.81   34.586  1815.01   54.978  1811.37   44.493  210.996   3.1965  210.795   2.5894 0.2014618 4.113697 
1 1 1    9    2   36 o  120.486   1.7248  591.725   16.940  612.099   27.365  579.067   21.570  122.535   2.7397  119.187   2.2201 3.347565 3.526283 
1 1 1    9    2   37 o  273.084   2.3540  3040.01   52.401  3103.39   84.327  3000.14   66.882  275.878   3.7498  271.271   3.0246 4.606934 4.817635 
1 1 1    9    2   38 o  181.116   1.8796  1337.12   27.749  1308.51   43.866  1356.21   35.829  179.151   3.0038  182.397   2.4098 -3.245956 3.851010 
1 1 1    9    2   39 o  421.203   3.3016  7233.69  113.359  7222.94  179.288  7240.84  146.317  420.765   5.2273  421.356   4.2600 -0.5909119 6.743309 
1 1 1    9    2   40 o  477.427   3.6838  9294.96  143.366  9337.86  227.752  9266.81  184.508  478.339   5.8410  476.621   4.7490 1.717438 7.528025 
1 1 1    9    2   41 o  478.641   3.6920  9342.66  144.050  9373.91  228.652  9322.09  185.488  479.237   5.8531  478.025   4.7603 1.211792 7.544489 
1 1 1    9    2   42 o  332.366   2.7198  4503.83   73.687  4634.22  119.368  4423.56   93.663  337.057   4.3446  329.356   3.4887 7.701080 5.571955 
1 1 1    9    2   43 f  113.884   1.7144  528.675   15.915  552.487   26.205  514.759   20.033  116.407   2.7616  112.370   2.1870 4.037270 3.522739 
1 1 1    9    2   44 o  564.607   5.5363 13012.78  254.803   0.0000   0.0000 13012.78  254.803  ?   ?   564.607   5.5363 0.000000 5.536348 
1 1 1    9    2   45 o  230.140   2.3521  2159.34   44.126  2382.62   94.060  2096.33   49.965  241.633   4.7754  226.747   2.7033 14.88589 5.487475 
1 1 1    9    2   46 o  268.775   2.9800  2945.83   65.289  3041.49  116.255  2901.76   78.907  272.958   5.2249  266.723   3.6293 6.234528 6.361725 
1 1 1    9    2   47 o   89.175   2.1555  324.207   15.669  338.844   28.156  317.640   18.859   91.059   3.8016   88.222   2.6253 2.836823 4.620015 
1 1 1    9    2   48 o  281.217   2.6845  3224.77   61.539  3227.12   87.949  3222.50   86.136  281.249   3.8362  281.053   3.7598 0.1959839 5.371478 
1 1 1    9    2   49 o  248.679   2.4678  2521.59   50.024  2546.20   71.948  2498.57   69.599  249.831   3.5330  247.489   3.4499 2.342438 4.937999 
1 1 1    9    2   50 o  133.410   1.7262  725.573   18.772  774.436   31.072  697.489   23.557  137.804   2.7661  130.793   2.2095 7.011154 3.540233 
1 1 1    9    2   51 o   52.934   2.1122  114.427   9.0958  102.173   13.950  123.489   11.997   49.926   3.4489   54.962   2.6858 -5.036842 4.371356 
1 1 1    9    2   52 o  272.848   2.1681  3035.48   48.221  3073.29   69.445  3000.27   67.009  274.484   3.1038  271.209   3.0311 3.274933 4.338296 
1 1 1    9    2   53 o  267.393   2.1403  2915.33   46.651  2939.14   66.979  2892.90   65.015  268.423   3.0611  266.308   2.9950 2.114960 4.282561 
1 1 1    9    2   54 o  173.234   1.7183  1223.47   24.264  1268.40   35.889  1185.65   32.932  176.358   2.4965  170.513   2.3693 5.844406 3.441803 
1 1 1    9    2   55 o  154.950   1.6550  978.829   20.904  990.948   30.541  968.147   28.673  155.882   2.4035  154.083   2.2829 1.799438 3.314890 
1 1 1    9    2   56 o  183.104   1.7431  1366.91   26.017  1333.25   37.056  1399.64   36.536  180.805   2.5143  185.256   2.4194 -4.451569 3.489295 
1 1 1    9    2   57 o  100.660   1.5728  413.081   12.905  396.491   18.517  428.749   17.996   98.603   2.3038  102.539   2.1530 -3.936302 3.153237 
1 1 1    9    2   58 o  173.155   1.5647  1222.35   22.085  1239.54   29.673  1200.99   33.068  174.351   2.0879  171.606   2.3640 2.744263 3.153986 
1 1 1    9    2   59 o   80.455   1.6867  263.905   11.062  269.673   13.425  251.710   19.521   81.323   2.0252   78.485   3.0572 2.838058 3.667122 
1 1 1    9    2   60 o  160.067   1.4021  1044.50   18.295  1064.92   26.777  1026.64   25.054  161.603   2.0327  158.675   1.9370 2.927444 2.807830 
1 1 1    9    2   61 o  400.822   2.6766  6553.71   87.452  6597.92  116.880  6497.49  131.813  402.035   3.5665  398.874   4.0540 3.161377 5.399529 
1 1 1    9    2   62 o  143.406   1.4847  838.418   17.356  841.867   23.287  834.107   26.033  143.685   1.9882  143.012   2.2332 0.6730042 2.989957 
1 1 1    9    2   63 o   46.256   2.0774   87.428   7.8130   80.595   10.030   97.971   12.459   44.359   2.7881   48.897   3.1424 -4.537792 4.200987 
1 1 1    9    2   64 o   89.377   1.5222  325.677   11.090  307.234   14.384  352.715   17.416   86.799   2.0329   92.994   2.2974 -6.195892 3.067725 
1 1 1    9    2   65 o  254.984   1.9247  2651.25   40.005  2640.35   52.746  2666.02   61.381  254.411   2.5434  255.606   2.9460 -1.195236 3.891992 
1 1 1    9    2   66 o  245.272   2.2250  2453.61   44.485  2452.88   70.121  2454.11   57.548  245.108   3.5096  245.239   2.8788 -0.1309357 4.539218 
1 1 1    9    2   67 o  250.964   2.0646  2568.61   42.236  2692.82   74.983  2510.88   51.116  256.799   3.5821  248.089   2.5276 8.710297 4.384072 
1 1 1    9    2   68 o  167.282   1.6787  1141.01   22.891  1183.21   33.432  1103.77   31.408  170.309   2.4082  164.496   2.3424 5.812683 3.359451 
1 1 1    9    2   69 o  198.129   1.6512  1600.62   26.667  1673.23   42.912  1554.94   34.037  202.509   2.5996  195.253   2.1385 7.255951 3.366170 
1 1 1    9    2   70 o  158.206   1.7183  1020.61   22.159  1033.67   27.215  994.940   38.170  159.195   2.0972  156.126   2.9992 3.069534 3.659741 
1 1 1    9    2   71 o  223.144   1.6669  2030.42   30.320  2053.70   44.147  2009.63   41.715  224.361   2.4139  221.950   2.3057 2.410736 3.338110 
1 1 1    9    2   72 o   55.777   1.9666  127.044   8.9275  117.755   13.217  134.838   12.106   53.621   3.0363   57.425   2.5930 -3.803726 3.992846 
1 1 1    9    2   73 o  109.258   1.5856  486.758   14.122  471.124   19.071  505.737   21.012  107.468   2.1770  111.340   2.3152 -3.871605 3.177945 
1 1 1    9    2   74 o  150.813   1.5050  927.412   18.502  954.172   29.712  910.465   23.646  152.924   2.3835  149.408   1.9415 3.516403 3.074204 
1 1 1    9    2   75 o  243.952   1.7456  2427.08   34.712  2410.89   49.670  2442.54   48.530  243.057   2.5070  244.656   2.4334 -1.599091 3.493777 
1 1 1    9    2   76 o   10.836   4.2044   2.9929   5.3095   11.094   12.314   1.1426   5.8847   18.031   6.5222   10.354   4.2816 7.676418 7.802011 
1 1 1    9    2   77 o   36.194   1.9993   53.604   5.8756   38.806   10.445   60.454   7.1068   30.491   4.3234   38.423   2.2793 -7.931698 4.887444 
1 1 1    9    2   78 o  139.720   1.3032  795.996   14.842  809.955   23.200  786.324   19.311  140.898   2.0200  138.848   1.7062 2.050232 2.644146 
1 1 1    9    2   79 o  227.270   1.5771  2106.56   29.217  2131.56   44.692  2087.90   38.610  228.516   2.3993  226.204   2.0939 2.312027 3.184508 
1 1 1    9    2   80 o  121.216   1.2797  599.137   12.645  595.014   19.617  602.068   16.540  120.759   1.9928  121.493   1.6701 -0.7338257 2.600111 
1 1 1    9    2   81 o  120.211   1.3282  589.286   13.015  596.734   19.613  583.426   17.398  120.929   1.9897  119.587   1.7848 1.342163 2.672854 
1 1 1    9    2   82 o  170.555   1.3788  1186.33   19.169  1139.25   28.806  1223.74   25.680  167.067   2.1152  173.184   1.8191 -6.117126 2.789861 
1 1 1    9    2   83 f   94.545   1.3287  364.541   10.240  364.302   17.717  364.660   12.549   94.457   2.3010   94.546   1.6282 -0.8937836E-01 2.818789 
1 1 1    9    2   84 o   63.330   1.4286  163.585   7.3749  169.148   13.249  161.087   8.8775   64.297   2.5327   62.809   1.7356 1.487949 3.070335 
1 1 1    9    2   85 f  113.337   1.3810  523.928   12.759  502.905   20.520  537.178   16.291  110.971   2.2685  114.737   1.7418 -3.765747 2.860087 
1 1 1    9    2   86 o   58.175   1.6883  138.216   7.9978  126.214   11.653  148.904   10.997   55.512   2.5823   60.340   2.2397 -4.827740 3.418244 
1 1 1    9    2   87 o   84.364   1.4759  290.366   10.150  294.122   14.372  286.629   14.336   84.868   2.0775   83.752   2.1015 1.116119 2.955035 
1 1 1    9    2   88 f   47.718   1.8218   93.086   7.0733   89.254   11.053   95.744   9.2050   46.610   2.9238   48.348   2.3427 -1.737991 3.746586 
1 1 1    9    2   89 o  160.918   1.6219  1056.85   21.275  1052.87   27.699  1062.56   33.226  160.537   2.1166  161.194   2.5287 -0.6568756 3.297615 
1 1 1    9    2   90 o  113.722   1.7273  528.008   16.012  527.664   21.764  528.414   23.642  113.603   2.3502  113.651   2.5520 -0.4853058E-01 3.469318 
1 1 1    9    2   91 o  101.733   1.6155  422.512   13.397  431.167   17.441  410.059   20.921  102.714   2.0831  100.065   2.5670 2.648605 3.305888 
1 1 1    9    2   92 o   72.568   1.7306  215.076   10.237  197.916   13.028  242.779   16.553   69.521   2.3021   76.951   2.6429 -7.430099 3.504880 
1 1 1    9    2   93 o   77.553   1.6543  245.634   10.458  228.302   13.287  273.853   16.954   74.679   2.1851   81.734   2.5478 -7.054916 3.356498 
1 1 1    9    2   94 o   45.802   2.1601   86.017   8.0420   77.266   10.254   99.998   12.962   43.292   2.9229   49.216   3.2490 -5.923561 4.370316 
1 1 1    9    2   95 o   26.332   3.3709   29.001   7.0697   32.336   9.0534   23.790   11.318   27.662   4.1423   23.348   5.9348 4.314402 7.237455 
1 1 1    9    2   96 f   77.706   1.6351  246.753   10.357  234.165   13.149  267.323   16.809   75.597   2.1360   80.685   2.5590 -5.087929 3.333322 
1 1 1    9    2   97 o   48.464   2.0836   96.364   8.2121   93.378   10.472  101.132   13.233   47.597   2.7103   49.410   3.3047 -1.812443 4.273965 
1 1 1    9    2   98 o   36.809   2.5031   55.891   7.4657   58.828   9.6464   51.503   11.789   37.635   3.1740   34.936   4.2255 2.698738 5.284787 
1 1 1    9    2   99 o   73.001   1.8123  218.139   10.784  222.391   12.826  207.880   19.923   73.616   2.1397   70.780   3.4636 2.835846 4.071210 
1 1 1    9    2  100 o   30.129   3.2231   37.961   7.7929   30.209   9.0672   59.876   15.244   26.549   4.3395   37.309   5.1498 -10.75972 6.734333 
1 1 1    9    2  101 o   12.259   4.9300   3.2634   7.5425  -0.1872   8.9979   11.418   13.832   11.896   5.1226   18.134   6.8476 -6.238733 8.551689 
1 1 1    9    2  102 o   28.515   3.5386   34.329   8.0487   49.339   11.839   21.430   10.975   33.992   4.3740   21.900   5.9806 12.09191 7.409451 
1 1 1    9    2  103 o   10.467   4.5889  -1.3242   7.4949 -15.1819   10.729   11.883   10.474   9.6252   4.6333   17.241   6.0383 -7.615680 7.611059 
1 1 1    9    2  104 o   17.516   5.2358   13.406   8.0504   3.0012   11.810   22.436   11.002   14.393   6.0179   22.302   5.9446 -7.908315 8.458924 
1 1 1    9    2  105 o   20.837   4.2694   18.981   7.0076   14.984   9.0510   24.963   11.072   18.430   5.5614   23.488   5.8143 -5.057823 8.045828 
1 1 1    9    2  106 o   26.048   3.4187   28.818   7.0838   29.919   9.2798   27.280   10.966   26.181   4.5110   24.588   5.5974 1.593729 7.188879 
1 1 1    9    2  107 o   55.496   1.9392  126.792   8.7590  122.047   11.330  133.840   13.808   54.241   2.5699   56.629   3.0020 -2.387722 3.951794 
1 1 1    9    2  108 o   39.438   2.4582   64.575   7.8634   60.396   10.222   70.634   12.307   37.838   3.3486   40.776   3.7445 -2.937168 5.023376 
1 1 1    9    2  109 o   34.775   2.7374   50.539   7.6971   46.933   10.067   55.614   11.942   33.127   3.7968   35.936   4.1529 -2.809059 5.626943 
1 1 1    9    2  110 o   72.904   1.7440  218.453   10.364  214.316   13.521  224.347   16.137   71.949   2.3084   73.406   2.7015 -1.456718 3.553463 
1 1 1    9    2  111 o   55.783   2.1946  128.821   9.9595  121.318   13.801  136.975   14.387   53.682   3.1679   57.087   3.1034 -3.405220 4.434722 
1 1 1    9    2  112 o   22.126   4.3131   21.752   7.4996   19.339   9.6331   25.466   11.949   20.416   5.6142   23.179   6.2025 -2.763161 8.365978 
1 1 1    9    2  113 o   25.072   3.8563   27.461   7.6290   16.205   9.9108   43.831   11.952   18.710   5.8520   31.263   4.8466 -12.55363 7.598378 
1 1 1    9    2  114 o   44.146   2.6622   81.821   9.5357   74.593   11.052  102.871   18.861   41.836   3.2668   47.941   4.8949 -6.105484 5.884869 
1 1 1    9    2  115 o   23.371   4.7462   24.990   8.7328   36.343   11.445   9.1700   13.511   28.028   5.2008   16.320   6.5858 11.70787 8.391725 
1 1 1    9    2  116 o   60.649   2.1141  153.033   10.436  147.749   14.122  159.389   15.489   59.031   2.9440   61.176   3.1164 -2.144512 4.287115 
1 1 1    9    2  117 o   39.123   2.8712   65.092   9.0929   79.375   12.622   49.684   13.110   42.684   3.6632   32.751   5.0746 9.932430 6.258688 
1 1 1    9    2  118 o   32.657   3.4313   46.467   8.9980   28.242   12.181   68.357   13.350   23.652   6.2317   39.024   4.2661 -15.37116 7.552065 
1 1 1    9    2  119 o   10.662   4.9413  -5.4552   10.216  -5.4552   10.216   0.0000   0.0000   10.662   4.9413  ?   ?  0.000000 4.941262 
1 1 1    9    2  120 o   33.271   4.0126   49.752   10.663   55.663   14.406   42.590   15.858   34.046   5.3686   28.233   6.9402 5.813002 8.774299 
1 1 1    9    2  121 o   50.387   2.9162  108.975   11.926  106.069   15.458  113.249   18.747   48.731   3.9246   49.439   4.7086 -0.7075348 6.129708 
1 1 1    9    2  122 f   39.241   3.4645   67.722   10.968   89.997   17.218   52.509   14.229   43.744   4.9135   32.773   5.5223 10.97092 7.391787 
1 1 1    9    2  123 o   20.971   5.5077   22.083   9.5343   31.290   13.534   13.014   13.433   24.030   6.6727   16.756   6.6318 7.274042 9.407739 
1 1 1    9    2  124 o   13.191   5.5546   4.7502   10.172   2.7677   12.955   7.9381   16.427   13.627   6.0017   15.831   6.8695 -2.204494 9.122016 
1 1 1    9    2  125 o   25.864   5.3261   33.060   10.855   34.335   13.927   31.088   17.326   25.049   6.6931   22.620   7.7746 2.428356 10.25877 
1 1 1    9    2  126 o   13.906   5.7494   6.6746   10.609   16.722   13.724  -8.2463   16.724   17.848   6.8019   12.810   6.0585 5.038318 9.108872 
1 1 1    9    2  127 o   14.948   5.8573   9.8457   10.387   10.174   13.301   9.3319   16.630   15.610   6.4443   16.014   6.9304 -0.4039011 9.463533 
1 1 1    9    2  128 o   22.834   5.8116   27.197   10.843   20.024   13.945   38.166   17.243   18.894   6.9247   24.928   7.7066 -6.033697 10.36062 
1 1 1    9    2  129 o   14.900   6.1481   8.9697   12.098   16.911   14.010 -14.3237   23.993   17.716   6.8415   14.059   6.8068 3.657753 9.650845 
1 1 1    9    2  130 o   22.280   6.3531   27.345   12.101   19.082   13.735   56.006   25.580   18.445   6.8524   27.041   9.4387 -8.595722 11.66376 
1 1 1    9    2  131 o   18.256   6.3151   18.085   11.438   10.516   16.009   25.978   16.348   16.038   6.8683   20.595   7.5056 -4.557318 10.17389 
1 1 1    9    3 -130 o   11.383   5.0423   0.5800   9.2699   8.3775   11.119 -17.1966   16.788   14.473   5.9245   11.537   5.6110 2.935703 8.159813 
1 1 1    9    3 -129 o   13.240   5.3901   6.4262   9.1421   3.1861   10.855   14.333   16.957   12.773   5.5628   17.071   7.1790 -4.298105 9.082020 
1 1 1    9    3 -128 o   21.840   5.7364   25.012   10.342   21.746   11.302   41.833   25.649   19.910   6.2523   23.241   9.1746 -3.331720 11.10246 
1 1 1    9    3 -127 o   30.190   4.5144   43.117   10.769   43.301   11.836   42.234   25.950   29.750   5.0620   23.446   9.2366 6.304321 10.53274 
1 1 1    9    3 -126 o   15.761   5.8769   12.026   10.121   15.298   11.147  -3.3257   24.143   17.180   6.2068   15.412   7.2863 1.768104 9.571542 
1 1 1    9    3 -125 o   34.314   3.5864   52.661   9.8838   55.745   11.782   45.333   18.159   34.715   4.2522   27.393   7.7735 7.322531 8.860437 
1 1 1    9    3 -124 o   19.003   5.6285   18.507   9.3366   21.289   11.150   11.981   17.078   19.979   6.2007   16.814   7.1440 3.164522 9.459703 
1 1 1    9    3 -123 o   21.687   5.2825   23.390   9.2507   26.729   11.042   15.531   16.941   22.716   5.9085   17.783   7.2999 4.932940 9.391384 
1 1 1    9    3 -122 o   15.717   5.6016   11.790   9.0453   13.084   10.847   8.8353   16.388   16.443   6.0932   16.058   6.9142 0.3845177 9.215868 
1 1 1    9    3 -121 o   22.270   5.1068   24.159   9.0726   30.168   10.792   9.6769   16.753   24.644   5.5107   16.426   7.0301 8.218328 8.932532 
1 1 1    9    3 -120 o   20.819   5.3779   21.442   9.1907   24.431   10.940   14.269   16.944   21.825   5.9754   17.713   7.2890 4.112087 9.425233 
1 1 1    9    3 -119 o   27.400   4.8053   35.339   10.341   34.509   13.092   36.717   16.865   25.862   6.2748   25.376   7.5766 0.4865341 9.837578 
1 1 1    9    3 -118 f   12.208   5.4545  -0.6509   11.087  -7.4086   15.748   5.9913   15.613   12.870   6.0213   15.495   6.7104 -2.625125 9.015860 
1 1 1    9    3 -117 o   31.233   4.2437   44.076   10.525   52.182   13.571   31.842   16.673   33.282   5.1699   23.926   7.6045 9.356552 9.195444 
1 1 1    9    3 -116 o   17.759   5.4790   15.081   8.7209   21.233   10.573   1.9872   15.424   20.721   5.9483   14.761   6.5231 5.959591 8.827954 
1 1 1    9    3 -115 o   39.328   2.9800   65.910   9.4821   61.367   11.417   76.013   17.024   37.443   3.7928   40.479   5.2856 -3.036289 6.505609 
1 1 1    9    3 -114 o   14.922   5.6204   8.8084   9.3053   4.9111   11.893   14.960   14.942   14.407   6.0324   18.442   7.0801 -4.034912 9.301513 
1 1 1    9    3 -113 o   49.410   2.7600  102.788   11.072  119.215   14.199   77.309   17.685   52.858   3.3121   41.004   5.4238 11.85424 6.355138 
1 1 1    9    3 -112 o   18.617   5.6836   16.120   9.4153   16.467   11.815   15.516   15.584   18.880   6.4220   19.024   7.2487 -0.1442032 9.684328 
1 1 1    9    3 -111 o   29.544   2.1838   36.333   5.2219   50.725   10.493   31.596   6.0203   34.266   3.8218   27.375   2.7345 6.891424 4.699324 
1 1 1    9    3 -110 o   13.906   3.9002   8.5007   4.5991   16.589   10.243   6.4583   5.1471   19.021   5.9493   12.551   4.2390 6.470724 7.304955 
1 1 1    9    3 -109 o   33.606   2.0503   46.755   5.5899   43.312   10.634   48.070   6.5709   31.552   4.2421   33.984   2.3871 -2.432091 4.867670 
1 1 1    9    3 -108 o   12.028   4.0553   5.8472   4.7108   11.657   10.027   4.2014   5.3365   16.770   5.9052   11.286   4.2551 5.483663 7.278531 
1 1 1    9    3 -107 o   8.3405   3.6593  -0.9160   4.7734  -3.8786   10.927  -0.2174   5.3065   11.887   5.3545   9.0993   3.9263 2.787787 6.639757 
1 1 1    9    3 -106 o   38.368   1.9824   60.734   6.1791   77.529   12.256   55.009   7.1550   42.828   3.5422   36.399   2.4253 6.428890 4.292944 
1 1 1    9    3 -105 o   30.050   2.4018   37.528   5.8344   30.680   11.680   39.805   6.7349   26.043   5.6634   30.876   2.7031 -4.832888 6.275427 
1 1 1    9    3 -104 o   19.136   3.4258   15.737   5.1475   22.956   9.9925   13.129   6.0056   22.575   5.4849   17.272   4.2859 5.302832 6.960828 
1 1 1    9    3 -103 o   62.845   1.5448  161.764   7.9139  169.866   12.986  156.979   9.9813   64.102   2.4901   61.779   1.9846 2.323177 3.184210 
1 1 1    9    3 -102 o   52.958   1.8506  115.199   7.9765  105.200   11.864  123.449   10.776   50.317   2.9048   54.674   2.4238 -4.356983 3.783217 
1 1 1    9    3 -101 o   16.478   4.5950   11.831   6.4033   7.1958   9.8010   15.283   8.4579   15.001   5.7405   18.639   5.3104 -3.637531 7.820058 
1 1 1    9    3 -100 o   96.898   1.5854  384.294   12.522  397.990   17.183  368.784   18.286   98.439   2.1414   94.647   2.3720 3.791595 3.195662 
1 1 1    9    3  -99 o   32.157   3.0897   43.145   7.9995   39.148   11.960   46.380   10.760   30.037   5.0648   33.080   4.0766 -3.043047 6.501608 
1 1 1    9    3  -98 f   60.470   1.9976  150.041   9.8331  143.901   12.466  160.153   15.997   59.082   2.5948   62.167   3.1673 -3.084320 4.094469 
1 1 1    9    3  -97 o   34.842   2.9114   50.358   8.1934   54.404   10.660   44.515   12.809   36.043   3.6796   32.173   5.0502 3.870506 6.248535 
1 1 1    9    3  -96 o   93.869   1.5972  360.216   12.221  343.093   16.464  381.232   18.239   91.484   2.2077   96.406   2.3209 -4.921486 3.203237 
1 1 1    9    3  -95 o   63.501   1.5261  164.763   7.8996  183.941   13.311  154.338   9.8146   66.919   2.4444   61.377   1.9642 5.541977 3.135781 
1 1 1    9    3  -94 o   76.563   1.4241  239.395   8.8877  228.559   14.461  245.972   11.267   74.640   2.3799   77.564   1.7819 -2.924194 2.973080 
1 1 1    9    3  -93 o  143.100   1.3698  836.021   15.979  850.532   25.103  826.137   20.718  144.164   2.1362  142.168   1.7878 1.995712 2.785566 
1 1 1    9    3  -92 o  119.814   1.3512  585.954   13.197  585.833   20.783  586.035   17.083  119.670   2.1305  119.762   1.7499 -0.9226227E-01 2.757051 
1 1 1    9    3  -91 o   70.097   1.5187  200.605   8.6776  190.320   14.370  206.509   10.887   68.117   2.5927   71.064   1.8811 -2.946861 3.203173 
1 1 1    9    3  -90 o   61.043   1.7139  152.296   8.5199  153.584   16.057  151.792   10.051   61.084   3.2364   60.908   2.0273 0.1762085 3.818943 
1 1 1    9    3  -89 f   77.344   1.5624  244.186   9.8502  236.215   15.842  249.210   12.577   75.930   2.5631   78.075   1.9778 -2.144264 3.237511 
1 1 1    9    3  -88 o   56.933   1.8570  132.511   8.6066  134.416   14.712  131.521   10.612   57.177   3.1689   56.674   2.3019 0.5036201 3.916713 
1 1 1    9    3  -87 o  150.973   1.4664  930.019   18.047  934.479   27.056  926.446   24.222  151.229   2.1948  150.614   1.9729 0.6150208 2.951227 
1 1 1    9    3  -86 o   30.313   2.6770   37.871   6.5468   42.552   11.595   35.680   7.9321   31.831   4.6022   29.316   3.3812 2.515396 5.710805 
1 1 1    9    3  -85 o   56.050   1.6765  128.321   7.6513  130.752   12.782  126.964   9.5519   56.474   2.7851   55.718   2.1069 0.7554626 3.492249 
1 1 1    9    3  -84 o   51.173   1.7679  106.997   7.3634  113.666   12.367  103.335   9.1648   52.639   2.8934   50.250   2.2431 2.388836 3.661063 
1 1 1    9    3  -83 o   70.452   1.5098  202.476   8.6707  204.522   14.134  201.241   10.979   70.713   2.4558   70.191   1.9208 0.5217133 3.117724 
1 1 1    9    3  -82 o   84.463   1.5160  291.005   10.437  282.719   18.375  294.951   12.682   83.131   2.7152   85.017   1.8300 -1.886520 3.274356 
1 1 1    9    3  -81 o   57.727   1.8821  136.131   8.8447  131.245   18.943  137.493   10.002   56.428   4.1472   57.998   2.1192 -1.569260 4.657249 
1 1 1    9    3  -80 o  152.503   1.5670  948.663   19.480  973.909   38.203  939.793   22.645  154.348   3.0365  151.766   1.8305 2.581589 3.545508 
1 1 1    9    3  -79 o   25.989   3.5317   28.135   7.2885   52.075   16.236   22.093   8.1565   35.100   5.8826   22.814   4.5457 12.28587 7.434270 
1 1 1    9    3  -78 o  110.750   1.5523  500.255   14.014  500.349   28.104  500.224   16.167  110.601   3.1204  110.734   1.7910 -0.1326065 3.597842 
1 1 1    9    3  -77 o  218.647   1.7980  1950.17   32.046  1924.12   61.336  1959.94   37.584  216.927   3.4687  219.160   2.1038 -2.233231 4.056829 
1 1 1    9    3  -76 o   54.468   1.9297  121.183   8.5542  115.240   15.093  123.995   10.383   52.975   3.5152   55.071   2.3181 -2.095543 4.210677 
1 1 1    9    3  -75 o  150.835   1.4813  927.771   18.213  900.034   30.060  943.860   22.893  148.493   2.4834  152.115   1.8463 -3.622635 3.094507 
1 1 1    9    3  -74 o   88.205   1.4685  317.251   10.559  326.951   16.492  310.513   13.745   89.485   2.2627   87.248   1.9326 2.237312 2.975709 
1 1 1    9    3  -73 o  104.004   1.4254  441.056   12.084  432.722   18.525  447.228   15.943  102.987   2.2067  104.714   1.8678 -1.727043 2.891067 
1 1 1    9    3  -72 o   60.575   1.8248  149.783   9.0000  153.236   14.144  147.434   11.667   61.202   2.8429   60.064   2.3876 1.138538 3.712497 
1 1 1    9    3  -71 o  130.656   1.5333  696.070   16.331  688.687   23.415  703.062   22.788  129.931   2.2108  131.284   2.1294 -1.353226 3.069472 
1 1 1    9    3  -70 o  126.017   1.5705  647.523   16.133  678.567   23.622  620.386   22.086  128.972   2.2469  123.321   2.1970 5.650436 3.142551 
1 1 1    9    3  -69 o  267.949   2.0440  2928.41   44.643  3009.51   69.638  2871.82   58.170  271.496   3.1466  265.275   2.6901 6.220978 4.139773 
1 1 1    9    3  -68 o   66.162   1.9124  178.671   10.303  182.939   16.422  175.900   13.231   66.877   3.0203   65.614   2.4783 1.262901 3.906915 
1 1 1    9    3  -67 o  152.336   1.5960  946.218   19.819  915.886   30.215  969.123   26.256  149.831   2.4739  154.146   2.0896 -4.314957 3.238282 
1 1 1    9    3  -66 o  125.349   1.6350  640.659   16.706  641.888   28.598  640.022   20.583  125.419   2.7973  125.273   2.0156 0.1458588 3.447834 
1 1 1    9    3  -65 o   70.379   1.8305  202.118   10.492  197.970   13.421  208.638   16.826   69.625   2.3682   71.444   2.8953 -1.819214 3.740466 
1 1 1    9    3  -64 o  169.404   1.4952  1170.02   20.647  1156.31   29.116  1183.90   29.282  168.380   2.1213  170.378   2.1084 -1.997955 2.990866 
1 1 1    9    3  -63 o   66.315   1.6188  179.303   8.7508  179.868   12.673  178.788   12.098   66.365   2.3464   66.170   2.2461 0.1942368 3.248177 
1 1 1    9    3  -62 o  139.648   1.5267  795.091   17.379  814.622   23.403  771.077   25.949  141.336   2.0313  137.495   2.3153 3.841003 3.080073 
1 1 1    9    3  -61 o  120.161   1.4996  588.653   14.688  586.535   19.560  591.391   22.241  119.930   2.0008  120.417   2.2658 -0.4864502 3.022782 
1 1 1    9    3  -60 o  155.803   1.5540  989.669   19.736  987.248   26.238  992.825   29.953  155.593   2.0687  156.019   2.3552 -0.4261169 3.134705 
1 1 1    9    3  -59 o  307.956   2.1946  3867.65   55.091  3898.81   73.438  3827.54   83.315  309.123   2.9144  306.234   3.3376 2.889099 4.430953 
1 1 1    9    3  -58 o  117.380   1.4040  561.690   13.434  575.558   19.297  548.649   18.713  118.805   1.9926  115.995   1.9791 2.810120 2.808457 
1 1 1    9    3  -57 o   80.419   1.5464  263.661   10.137  259.674   13.865  268.239   14.859   79.770   2.1343   81.070   2.2506 -1.300110 3.101667 
1 1 1    9    3  -56 o  159.908   1.4094  1042.42   18.371  1040.88   23.246  1044.98   29.981  159.779   1.7848  160.074   2.2977 -0.2954254 2.909478 
1 1 1    9    3  -55 o  181.632   1.5704  1344.96   23.252  1334.93   30.555  1358.76   35.839  180.935   2.0717  182.527   2.4087 -1.592346 3.177083 
1 1 1    9    3  -54 o  190.449   1.5113  1478.67   23.461  1467.12   29.585  1498.24   38.512  189.690   1.9133  191.666   2.4650 -1.976135 3.120432 
1 1 1    9    3  -53 o   89.242   1.4188  324.667   10.321  328.651   12.345  315.414   18.813   89.784   1.6868   87.899   2.6286 1.884682 3.123263 
1 1 1    9    3  -52 o   18.254   3.9094   14.125   5.6419   15.742   6.6322   9.8883   10.732   19.255   4.3307   16.972   6.0955 2.283775 7.477339 
1 1 1    9    3  -51 o  389.185   2.8195  6178.12   89.446  6224.81  110.258  6088.25  152.973  390.576   3.4631  386.048   4.8611 4.527710 5.968569 
1 1 1    9    3  -50 o  228.368   1.7761  2126.21   33.062  2114.75   39.099  2154.97   61.938  227.738   2.1062  229.823   3.3062 -2.085114 3.920034 
1 1 1    9    3  -49 o  178.487   1.4587  1298.68   21.223  1304.38   27.354  1290.05   33.638  178.867   1.8761  177.867   2.3201 0.9998779 2.983697 
1 1 1    9    3  -48 o  659.562   3.9217 17753.47  210.848 17982.42  270.086 17396.20  337.386  663.533   4.9935  652.205   6.3461 11.32813 8.075144 
1 1 1    9    3  -47 o  553.895   3.1414 12514.22  141.836 12527.27  190.791 12498.10  212.063  554.006   4.2248  553.267   4.7021 0.7396240 6.321311 
1 1 1    9    3  -46 o   97.025   1.3501  383.734   10.678  405.488   16.579  368.313   13.959   99.728   2.0394   95.050   1.8016 4.678185 2.721211 
1 1 1    9    3  -45 o  204.736   1.5650  1708.72   26.118  1704.47   37.746  1712.62   36.178  204.462   2.2648  204.953   2.1655 -0.4910431 3.133435 
1 1 1    9    3  -44 o  292.654   1.9539  3491.61   46.611  3502.65   66.807  3481.14   65.063  293.078   2.7964  292.180   2.7318 0.8981628 3.909310 
1 1 1    9    3  -43 o  153.812   1.4879  964.381   18.655  962.678   29.917  965.464   23.862  153.660   2.3885  153.892   1.9022 -0.2321472 3.053377 
1 1 1    9    3  -42 o   86.379   1.3115  304.137   9.2343  296.129   13.412  311.353   12.733   85.230   1.9305   87.394   1.7873 -2.164635 2.630855 
1 1 1    9    3  -41 o  191.525   1.4939  1495.23   23.323  1509.41   33.479  1481.87   32.508  192.418   2.1345  190.656   2.0917 1.762482 2.988542 
1 1 1    9    3  -40 o  500.355   3.0326 10208.59  123.690 10349.00  177.121 10074.94  172.808  503.663   4.3141  496.955   4.2659 6.708405 6.067103 
1 1 1    9    3  -39 o  228.344   1.7699  2125.44   32.944  2175.99   51.999  2091.55   42.580  231.018   2.7613  226.504   2.3062 4.513977 3.597685 
1 1 1    9    3  -38 f  224.251   1.5410  2049.85   28.169  2003.97   37.645  2108.23   42.463  221.717   2.0829  227.407   2.2907 -5.689835 3.096113 
1 1 1    9    3  -37 o  159.278   1.3184  1034.07   17.117  1042.22   23.465  1024.81   25.025  159.899   1.8003  158.556   1.9362 1.342819 2.643886 
1 1 1    9    3  -36 o  219.082   1.6124  1956.43   28.795  1977.49   41.507  1936.89   39.980  220.246   2.3119  217.975   2.2501 2.271317 3.226121 
1 1 1    9    3  -35 o  328.963   2.1278  4411.38   57.058  4413.13   81.185  4409.68   80.207  329.000   3.0272  328.872   2.9919 0.1271973 4.256243 
1 1 1    9    3  -34 o  388.174   2.4337  6142.57   77.008  6212.87  110.392  6075.94  107.478  390.346   3.4694  386.023   3.4156 4.323059 4.868588 
1 1 1    9    3  -33 o  658.620   4.1778 17690.16  224.294 17896.02  346.510 17541.71  294.258  662.175   6.4196  655.708   5.5053 6.467102 8.456912 
1 1 1    9    3  -32 o  454.894   2.9800  8436.27  110.499  8561.15  171.286  8347.26  144.617  458.159   4.5864  452.441   3.9212 5.718445 6.034133 
1 1 1    9    3  -31 o  158.744   1.6192  1027.15   20.952  944.773   29.505  1110.95   29.757  152.238   2.3776  165.087   2.2113 -12.84863 3.246947 
1 1 1    9    3  -30 o  444.920   2.9220  8070.06  105.973  8296.55  166.106  7914.59  137.618  451.044   4.5178  440.575   3.8319 10.46893 5.924071 
1 1 1    9    3  -29 o  633.683   4.0295 16373.53  208.140 16368.78  318.401 16377.07  275.044  633.404   6.1668  633.648   5.3250 -0.2435303 8.147665 
1 1 1    9    3  -28 o  583.299   3.7302 13872.16  177.363 13633.85  267.540 14059.03  236.902  578.130   5.6771  587.134   4.9499 -9.003967 7.531997 
1 1 1    9    3  -27 o  479.127   3.3741  9358.99  131.779  9204.29  184.068  9521.66  188.747  475.086   4.7530  483.205   4.7919 -8.119080 6.749362 
1 1 1    9    3  -26 o  260.944   2.0889  2775.52   44.432  2802.84   63.672  2749.58   62.033  262.211   2.9789  259.709   2.9302 2.502289 4.178551 
1 1 1    9    3  -25 o  271.408   2.1445  3002.60   47.445  3037.94   68.078  2969.23   66.157  272.986   3.0594  269.882   3.0072 3.104034 4.289876 
1 1 1    9    3  -24 o  317.764   2.4014  4115.94   62.203  4138.17   88.608  4094.34   87.341  318.600   3.4119  316.909   3.3810 1.691132 4.803346 
1 1 1    9    3  -23 o  122.343   1.4521  610.079   14.481  623.395   23.334  601.737   18.469  123.667   2.3147  121.502   1.8647 2.164856 2.972367 
1 1 1    9    3  -22 o  281.088   1.8951  3220.50   43.422  3251.57   62.164  3190.90   60.678  282.430   2.7002  279.784   2.6606 2.646576 3.790706 
1 1 1    9    3  -21 o  363.428   2.3051  5383.81   68.287  5349.54   96.378  5418.36   96.768  362.251   3.2639  364.574   3.2562 -2.322906 4.610382 
1 1 1    9    3  -20 o  302.591   2.1357  3732.11   52.679  3699.73   69.641  3775.44   80.542  301.264   2.8358  304.324   3.2467 -3.059448 4.310835 
1 1 1    9    3  -19 f  402.190   2.6813  6593.69   87.904  6484.84  115.149  6745.73  136.089  398.837   3.5418  406.764   4.1044 -7.926971 5.421299 
1 1 1    9    3  -18 o  103.011   1.5097  432.506   12.677  414.055   17.293  453.940   18.638  100.788   2.1048  105.530   2.1666 -4.742416 3.020653 
1 1 1    9    3  -17 f  310.988   2.3544  3942.18   59.684  3866.83   83.537  4020.74   85.302  307.986   3.3275  314.055   3.3321 -6.069305 4.709019 
1 1 1    9    3  -16 o  599.582   4.1339 14656.67  202.046 14822.87  288.671 14497.06  282.888  602.878   5.8741  596.219   5.8207 6.659241 8.269502 
1 1 1    9    3  -15 o  120.228   1.4992  589.159   14.692  588.177   22.640  589.873   19.310  120.124   2.3122  120.299   1.9692 -0.1746674 3.037092 
1 1 1    9    3  -14 o  155.255   1.6726  982.464   21.167  944.804   29.584  1021.97   30.299  152.246   2.3838  158.341   2.3474 -6.095230 3.345591 
1 1 1    9    3  -13 o  226.106   1.9333  2083.81   35.632  2100.49   50.731  2067.57   50.057  227.002   2.7416  225.216   2.7267 1.785278 3.866690 
1 1 1    9    3  -12 f  355.943   2.4475  5164.30   71.014  5111.03   93.494  5236.94  109.180  354.089   3.2392  358.414   3.7370 -4.324554 4.945428 
1 1 1    9    3  -11 o   17.827   5.5987   12.786   9.0622   3.9780   12.654   22.059   12.984   15.688   6.3582   22.998   6.5884 -7.309583 9.156074 
1 1 1    9    3  -10 o  508.334   3.3032 10533.74  136.874 10537.06  181.370 10529.33  208.614  508.379   4.3766  508.167   5.0362 0.2125549 6.672180 
1 1 1    9    3   -9 o  476.869   3.3757  9270.13  131.222  9142.99  184.030  9401.63  187.161  473.544   4.7675  480.195   4.7815 -6.650696 6.752154 
1 1 1    9    3   -8 o  274.750   2.2047  3076.93   49.377  3178.18   72.054  2987.28   67.801  279.223   3.1657  270.708   3.0725 8.514374 4.411592 
1 1 1    9    3   -7 o  542.459   3.2763 11995.42  144.872 12292.32  209.353 11722.59  200.682  549.082   4.6774  536.210   4.5913 12.87207 6.554265 
1 1 1    9    3   -6 o  168.552   1.5167  1157.95   20.839  1188.15   30.529  1131.60   28.516  170.733   2.1936  166.620   2.0995 4.112045 3.036443 
1 1 1    9    3   -5 o  209.778   1.6349  1793.67   27.957  1786.04   40.090  1800.90   39.006  209.326   2.3495  210.195   2.2765 -0.8694611 3.271516 
1 1 1    9    3   -4 o  492.147   3.2108  9873.40  128.807  9965.28  198.952  9807.08  169.010  494.376   4.9369  490.462   4.2274 3.914459 6.499514 
1 1 1    9    3   -3 o  207.852   2.0880  1760.94   35.377  1723.91   45.588  1816.99   56.090  205.650   2.7195  211.124   3.2592 -5.473801 4.244761 
1 1 1    9    3   -2 o  369.970   2.9796  5579.57   89.858  5567.93  142.013  5587.33  116.043  369.545   4.7144  370.210   3.8453 -0.6651306 6.083737 
1 1 1    9    3   -1 o  490.342   3.7754  9801.72  150.905  9514.92  328.958  9878.16  169.828  482.903   8.3569  492.236   4.2325 -9.333435 9.367607 
1 1 1    9    3    0 o  465.194   3.0528  8821.41  115.762  8342.74  169.030  9244.26  158.867  452.355   4.5840  476.185   4.0928 -23.82990 6.145292 
1 1 1    9    3    1 o  176.145   1.7473  1264.65   25.088  1273.49   36.113  1256.40   34.880  176.755   2.5064  175.566   2.4373 1.189713 3.496037 
1 1 1    9    3    2 o  434.763   3.1074  7705.10  110.123  7651.47  155.119  7759.59  156.365  433.215   4.3926  436.265   4.3970 -3.050049 6.215194 
1 1 1    9    3    3 o  228.268   2.7363  2123.97   50.915   0.0000   0.0000  2123.97   50.915  ?   ?   228.268   2.7363 0.000000 2.736321 
1 1 1    9    3    4 o  405.059   3.2031  6688.27  105.761  6502.12  163.794  6821.38  138.505  399.335   5.0318  409.047   4.1539 -9.712402 6.524878 
1 1 1    9    3    5 o  769.737   6.4155 24164.43  402.537 24209.87  570.184 24119.28  568.368  770.207   9.0818  768.766   9.0698 1.441040 12.83515 
1 1 1    9    3    6 o  508.181   3.9055 10528.08  161.784 10976.21  264.658 10260.71  204.427  518.784   6.2584  501.647   4.9992 17.13666 8.009979 
1 1 1    9    3    7 o  250.998   2.2541  2567.93   46.119  2568.68   73.270  2567.44   59.351  251.019   3.5808  250.967   2.9012 0.5160522E-01 4.608599 
1 1 1    9    3    8 o  397.804   2.8862  6450.64   93.590  6382.65  131.495  6520.44  133.233  395.675   4.0770  399.923   4.0870 -4.247772 5.772764 
1 1 1    9    3    9 o  189.698   1.9840  1466.77   30.679  1544.69   41.086  1368.56   46.124  194.668   2.5892  183.229   3.0882 11.43842 4.029973 
1 1 1    9    3   10 o  314.557   2.4025  4033.17   61.603  4090.34   88.254  3978.86   86.028  316.763   3.4179  312.417   3.3781 4.345764 4.805593 
1 1 1    9    3   11 o  242.213   2.0232  2391.28   39.946  2423.24   57.364  2361.19   55.660  243.817   2.8863  240.676   2.8371 3.140991 4.047194 
1 1 1    9    3   12 f  265.065   2.1373  2863.82   46.181  2808.68   64.920  2920.31   65.706  262.491   3.0341  267.657   3.0116 -5.165833 4.274962 
1 1 1    9    3   13 o   76.660   1.9277  239.685   12.036  250.685   18.044  230.868   16.155   78.370   2.8292   75.212   2.6392 3.157990 3.869091 
1 1 1    9    3   14 o  230.577   1.9636  2167.03   36.906  2198.12   53.056  2137.89   51.372  232.217   2.8029  229.014   2.7519 3.203003 3.927953 
1 1 1    9    3   15 o  460.193   3.5778  8633.42  134.211  8617.31  212.416  8644.13  173.153  459.685   5.6688  460.444   4.6134 -0.7586060 7.308778 
1 1 1    9    3   16 o  351.851   2.8621  5046.47   82.088  5022.64  129.840  5062.35  105.949  350.981   4.5383  352.387   3.6884 -1.406647 5.848105 
1 1 1    9    3   17 f  112.243   1.8461  513.513   16.891  551.051   28.660  493.536   20.908  116.228   3.0276  110.036   2.3310 6.191612 3.820956 
1 1 1    9    3   18 o  177.987   2.1459  1291.28   31.134  1276.16   44.675  1305.56   43.412  176.934   3.0975  178.962   2.9759 -2.028366 4.295398 
1 1 1    9    3   19 f  561.430   6.7457 12857.92  308.718   0.0000   0.0000 12857.92  308.718  ?   ?   561.430   6.7457 0.000000 6.745746 
1 1 1    9    3   20 o  443.728   3.8604  8027.23  139.633  7999.23  197.158  8055.41  197.785  442.890   5.4611  444.442   5.4594 -1.552490 7.721948 
1 1 1    9    3   21 o  479.301   4.1283  9366.32  161.292  9425.66  229.566  9308.48  226.663  480.734   5.8582  477.738   5.8204 2.995667 8.258110 
1 1 1    9    3   22 o  391.505   3.1015  6248.37   98.978  6361.44  158.908  6176.69  126.517  394.973   4.9356  389.228   3.9876 5.744171 6.345166 
1 1 1    9    3   23 o  441.130   3.4334  7933.16  123.458  7789.39  192.458  8033.69  160.934  437.034   5.4024  443.879   4.4478 -6.844421 6.997755 
1 1 1    9    3   24 o  620.922   4.6781 15721.25  236.781 15630.22  372.652 15782.89  306.636  618.902   7.3866  622.039   6.0474 -3.136841 9.546360 
1 1 1    9    3   25 o  475.092   3.6640  9202.24  141.897  9078.24  222.099  9287.75  184.449  471.775   5.7753  477.246   4.7413 -5.471191 7.472233 
1 1 1    9    3   26 o  171.112   1.8361  1193.44   25.611  1172.54   40.553  1207.30   33.031  169.597   2.9334  172.098   2.3546 -2.501266 3.761483 
1 1 1    9    3   27 o  188.731   1.9051  1451.88   29.308  1436.57   46.330  1462.08   37.843  187.721   3.0277  189.387   2.4513 -1.666946 3.895638 
1 1 1    9    3   28 o  517.981   3.9606 10939.81  167.227 10933.50  264.589 10944.00  215.792  517.674   6.2702  518.011   5.1105 -0.3367920 8.088993 
1 1 1    9    3   29 o   62.122   2.0580  157.477   10.407  190.485   17.631  139.829   12.892   68.281   3.1765   58.504   2.7107 9.776573 4.175847 
1 1 1    9    3   30 o  347.044   2.8104  4909.90   79.503  4953.30  126.862  4881.84  102.024  348.514   4.4655  346.025   3.6171 2.489014 5.746680 
1 1 1    9    3   31 o  206.781   2.2401  1742.98   37.759  1773.81   53.997  1713.48   52.819  208.586   3.1758  205.008   3.1607 3.577255 4.480603 
1 1 1    9    3   32 o  176.464   2.0977  1269.34   30.175  1272.58   42.762  1266.13   42.586  176.676   2.9692  176.228   2.9645 0.4481659 4.195798 
1 1 1    9    3   33 o  319.656   2.9619  4165.83   77.177  4170.28  109.233  4161.40  109.056  319.780   4.1905  319.439   4.1882 0.3407288 5.924641 
1 1 1    9    3   34 o  602.273   5.0960 14797.72  250.186 15161.48  361.146 14462.06  346.916  609.338   7.2709  595.136   7.1511 14.20239 10.19823 
1 1 1    9    3   35 o  365.200   2.9380  5437.62   87.461  5651.87  142.575  5308.34  110.746  372.231   4.6989  360.795   3.7656 11.43597 6.021566 
1 1 1    9    3   36 o   61.539   2.4491  154.633   12.261  147.349   17.588  161.519   17.102   60.003   3.6127   62.849   3.3503 -2.845665 4.927050 
1 1 1    9    3   37 o  264.425   2.3046  2850.42   49.675  2858.50   79.236  2845.18   63.760  264.754   3.6715  264.162   2.9610 0.5912781 4.716749 
1 1 1    9    3   38 f  443.996   3.4569  8038.92  125.113  8066.65  198.829  8020.75  160.977  444.578   5.4865  443.414   4.4537 1.163727 7.066606 
1 1 1    9    3   39 o  264.859   2.9862  2860.37   64.472  2858.03  110.787  2861.57   79.279  264.641   5.1357  264.886   3.6717 -0.2454224 6.313170 
1 1 1    9    3   40 o  429.988   3.7645  7541.06  131.946  7674.89  266.852  7497.75  151.801  433.313   7.5550  428.700   4.3439 4.613342 8.714770 
1 1 1    9    3   41 o  210.549   2.5595  1807.45   43.929  1638.98   72.311  1905.99   55.303  200.426   4.4261  216.193   3.1381 -15.76698 5.425667 
1 1 1    9    3   42 o  342.718   3.5794  4790.74   99.996  4846.89  175.178  4763.60  121.788  344.460   6.2389  341.684   4.3726 2.776581 7.618618 
1 1 1    9    3   43 o  166.336   2.0137  1127.94   27.304  1095.68   38.910  1159.24   38.323  163.917   2.9121  168.609   2.7883 -4.691605 4.031760 
1 1 1    9    3   44 o  273.766   2.6303  3056.07   58.697  3142.52   85.345  2978.48   80.857  277.544   3.7723  270.209   3.6710 7.334290 5.263694 
1 1 1    9    3   45 o  159.481   1.7895  1036.86   23.264  1042.18   37.614  1033.57   29.606  159.860   2.8865  159.216   2.2812 0.6437988 3.679092 
1 1 1    9    3   46 o  105.874   1.6978  456.958   14.652  458.420   24.144  456.106   18.435  105.986   2.7970  105.768   2.1382 0.2181320 3.520694 
1 1 1    9    3   47 o  291.637   2.4702  3468.19   58.724  3588.04   95.743  3395.91   74.353  296.519   3.9611  288.537   3.1613 7.982208 5.067926 
1 1 1    9    3   48 o  405.121   3.1997  6695.03  105.666  6802.13  169.655  6627.16  135.061  408.076   5.1002  402.949   4.1119 5.127289 6.551368 
1 1 1    9    3   49 o   63.760   1.8483  165.880   9.5961  154.820   14.954  173.622   12.512   61.536   2.9902   65.209   2.3577 -3.673386 3.807925 
1 1 1    9    3   50 o   93.103   1.6183  353.382   12.282  337.188   18.336  366.562   16.541   90.896   2.4770   94.815   2.1401 -3.918556 3.273454 
1 1 1    9    3   51 o  199.866   1.8140  1628.63   29.553  1654.95   43.033  1605.13   40.657  201.439   2.6208  198.389   2.5141 3.049805 3.631662 
1 1 1    9    3   52 o  140.912   1.7625  809.537   20.245  788.018   27.005  837.148   30.590  139.008   2.3833  143.267   2.6193 -4.259216 3.541317 
1 1 1    9    3   53 o  149.629   1.6395  912.772   19.996  906.364   29.276  918.376   27.378  149.079   2.4091  150.070   2.2380 -0.9908295 3.288266 
1 1 1    9    3   54 o  315.427   2.4058  4057.65   61.857  4195.55   90.482  3936.65   84.757  320.635   3.4619  310.598   3.3477 10.03729 4.815773 
1 1 1    9    3   55 o  249.276   2.0463  2533.77   41.581  2546.72   59.889  2521.72   57.776  249.850   2.9406  248.628   2.8507 1.222031 4.095565 
1 1 1    9    3   56 o  158.230   1.6609  1020.75   21.423  1053.44   31.792  993.569   28.994  160.714   2.4268  156.087   2.2788 4.627502 3.329001 
1 1 1    9    3   57 o   18.737   4.7999   14.896   7.3632   13.059   15.452   15.435   8.3752   19.922   7.2912   19.127   5.2248 0.7948036 8.970013 
1 1 1    9    3   58 o  109.480   1.4454  488.634   12.899  493.141   17.639  483.454   18.911  109.971   1.9677  108.882   2.1307 1.089859 2.900260 
1 1 1    9    3   59 o   98.802   1.5538  397.991   12.514  387.430   15.824  415.624   20.448   97.473   1.9916  100.944   2.4850 -3.470360 3.184597 
1 1 1    9    3   60 o  126.320   1.5670  650.555   16.135  648.212   20.356  654.515   26.463  126.080   1.9807  126.670   2.5629 -0.5899811 3.239052 
1 1 1    9    3   61 o  227.021   1.9347  2101.62   35.803  2073.32   44.044  2156.75   61.477  225.458   2.3965  229.873   3.2808 -4.414963 4.062919 
1 1 1    9    3   62 o  131.618   1.5848  706.295   17.003  720.574   25.054  694.103   23.149  132.916   2.3124  130.457   2.1769 2.458847 3.175833 
1 1 1    9    3   63 o  122.632   1.6245  613.165   16.239  630.734   23.377  596.780   22.575  124.353   2.3062  120.961   2.2896 3.392776 3.249684 
1 1 1    9    3   64 o   83.990   1.4328  287.601   9.8094  317.534   17.336  273.503   11.897   88.195   2.4137   81.899   1.7821 6.296577 3.000264 
1 1 1    9    3   65 o  158.891   1.4142  1029.28   18.317  976.272   26.282  1079.35   25.541  154.718   2.0839  162.688   1.9260 -7.970322 2.837621 
1 1 1    9    3   66 o  144.771   1.3723  854.474   16.195  847.133   23.802  860.802   22.099  144.123   2.0260  145.288   1.8659 -1.165100 2.754377 
1 1 1    9    3   67 o  159.417   1.9138  1036.42   24.869  1059.22   32.291  1003.17   38.988  161.130   2.4585  156.768   3.0510 4.362305 3.918239 
1 1 1    9    3   68 o  147.025   1.4064  881.322   16.855  865.863   24.966  894.271   22.849  145.700   2.1021  148.081   1.8929 -2.381348 2.828765 
1 1 1    9    3   69 o   25.989   2.8724   27.903   5.9835   22.464   12.809   29.421   6.7673   23.087   6.5207   26.656   3.1769 -3.568901 7.253439 
1 1 1    9    3   70 o  107.735   1.5769  473.277   13.848  482.718   19.829  464.289   19.348  108.780   2.2363  106.683   2.2249 2.096245 3.154524 
1 1 1    9    3   71 o   57.194   1.6858  133.509   7.8511  154.424   16.367  127.258   8.9478   61.406   3.2817   55.823   1.9695 5.582535 3.827290 
1 1 1    9    3   72 o   12.553   4.1014   6.1867   4.8279   18.177   13.253   4.3522   5.1841   21.249   6.7829   11.537   4.2231 9.711895 7.990131 
1 1 1    9    3   73 o  221.068   1.7621  1993.15   31.753  2015.37   50.845  1978.94   40.655  222.186   2.8074  220.232   2.2646 1.954346 3.606913 
1 1 1    9    3   74 o   91.474   1.6149  341.236   12.042  358.511   19.493  330.574   15.313   93.685   2.5549   90.016   2.0869 3.669083 3.298874 
1 1 1    9    3   75 o   44.772   2.0510   81.955   7.4655   74.872   13.970   84.786   8.8323   42.584   4.0743   45.516   2.3889 -2.932507 4.722984 
1 1 1    9    3   76 o  237.231   2.0034  2296.12   38.742  2275.26   55.533  2315.90   54.074  236.021   2.8865  238.137   2.7857 -2.115662 4.011430 
1 1 1    9    3   77 o  146.268   1.7513  872.694   20.881  853.470   29.100  893.097   29.979  144.589   2.4690  147.906   2.4865 -3.316895 3.504125 
1 1 1    9    3   78 o  181.091   2.0168  1338.14   29.771  1387.83   47.118  1305.12   38.409  184.271   3.1368  178.769   2.6357 5.501770 4.097185 
1 1 1    9    3   79 o   39.623   3.2933   64.638   10.541   54.263   15.995   72.604   14.015   35.891   5.6539   41.893   4.1588 -6.001961 7.018714 
1 1 1    9    3   80 o   60.150   2.3941  147.971   11.715  169.292   18.463  133.602   15.157   64.221   3.5405   57.061   3.2724 7.159870 4.821234 
1 1 1    9    3   81 o   16.879   5.5069   11.310   8.7052   15.437   12.175   6.9947   12.451   19.755   6.5163   16.500   6.4282 3.254673 9.153391 
1 1 1    9    3   82 o   51.834   2.6170  110.056   11.021  111.255   14.224  108.253   17.436   52.031   3.3718   51.201   4.2149 0.8295631 5.397618 
1 1 1    9    3   83 o   79.531   2.0723  258.402   13.423  246.411   17.237  276.881   21.398   77.595   2.7294   82.197   3.1997 -4.602219 4.205652 
1 1 1    9    3   84 o   79.291   2.0681  256.875   13.355  260.094   17.272  252.087   21.062   79.723   2.6615   78.398   3.3032 1.324493 4.241993 
1 1 1    9    3   85 o  183.274   1.8285  1371.07   27.317  1397.24   38.952  1345.75   38.319  184.876   2.5847  181.437   2.5909 3.439651 3.659725 
1 1 1    9    3   86 o   31.278   3.6765   40.674   9.1948   35.293   12.973   46.106   13.034   28.708   5.7444   33.079   4.9887 -4.371029 7.608221 
1 1 1    9    3   87 o   29.473   3.9848   36.330   9.3286   39.264   13.145   33.353   13.240   30.348   5.5170   27.829   6.0126 2.519300 8.160176 
1 1 1    9    3   88 o   53.064   2.5546  115.458   11.017  116.992   15.654  113.952   15.508   53.256   3.6277   52.553   3.6427 0.7022743 5.141008 
1 1 1    9    3   89 f   57.883   2.5356  137.364   11.935  151.693   18.302  126.763   15.742   60.633   3.7209   55.449   3.5007 5.184620 5.108816 
1 1 1    9    3   90 o  110.675   1.9097  500.482   17.229  466.646   26.390  525.616   22.745  106.624   3.0395  113.327   2.4622 -6.703644 3.911608 
1 1 1    9    3   91 o   91.343   1.9386  341.002   14.434  337.789   22.159  343.371   19.024   90.688   3.0017   91.532   2.5522 -0.8439178 3.940068 
1 1 1    9    3   92 o   72.591   2.0715  215.691   12.245  220.539   18.955  212.218   16.042   73.191   3.1847   71.888   2.7425 1.303261 4.202825 
1 1 1    9    3   93 o   63.185   2.0076  163.466   10.327  148.283   14.493  179.123   14.718   60.008   2.9722   66.016   2.7409 -6.007732 4.043091 
1 1 1    9    3   94 o   88.616   1.7209  320.992   12.431  313.516   14.735  339.449   23.152   87.522   2.0654   90.771   3.1338 -3.248787 3.753180 
1 1 1    9    3   95 o   33.751   2.9608   47.217   8.0632   45.757   9.4518   51.120   15.454   33.097   3.5592   34.403   5.7107 -1.305927 6.729077 
1 1 1    9    3   96 o   31.241   3.1078   40.617   7.8093   35.920   9.0792   53.974   15.310   29.176   3.9164   35.393   5.4839 -6.216711 6.738790 
1 1 1    9    3   97 o   28.690   3.0786   34.333   7.0872   43.681   9.1873   20.595   11.138   32.290   3.5489   21.641   6.0693 10.64897 7.030749 
1 1 1    9    3   98 f   29.924   2.9080   37.268   7.0040   37.960   8.9712   36.187   11.209   30.002   3.7500   28.940   4.9278 1.061756 6.192336 
1 1 1    9    3   99 o   14.597   5.0127   8.3722   7.2021  -2.3454   9.7433   21.283   10.694   11.731   5.1842   21.889   5.8722 -10.15735 7.833203 
1 1 1    9    3  100 o   16.878   4.9977   12.319   7.3620   17.410   9.9934   6.2772   10.887   19.876   5.8060   15.141   5.9772 4.735566 8.332863 
1 1 1    9    3  101 o   46.561   2.3001   89.409   8.7027   88.010   11.895   91.019   12.767   45.946   3.1959   46.667   3.3790 -0.7214813 4.650896 
1 1 1    9    3  102 o   42.855   2.2682   75.800   7.8954   88.015   10.457   59.608   12.041   46.043   2.7996   37.475   4.0035 8.567211 4.885215 
1 1 1    9    3  103 o   17.909   4.6738   14.157   6.8942   8.0902   9.1261   22.221   10.522   15.050   5.5867   22.190   5.7654 -7.139971 8.028158 
1 1 1    9    3  104 o   14.379   4.9019   8.3612   6.8843  -0.5543   8.9764   21.095   10.728   11.668   5.0704   21.565   5.9224 -9.896969 7.796417 
1 1 1    9    3  105 o   26.347   3.5260   29.579   7.3827   24.022   9.5963   37.636   11.556   23.143   5.2125   29.189   5.0390 -6.045763 7.249990 
1 1 1    9    3  106 o   98.707   1.7023  399.926   13.697  410.326   17.046  380.974   23.010   99.801   2.0953   95.620   2.9557 4.181023 3.623010 
1 1 1    9    3  107 o   27.486   3.3935   32.130   7.4419   33.241   9.8386   30.644   11.377   27.535   4.5417   26.001   5.5377 1.534081 7.161927 
1 1 1    9    3  108 o   12.377   4.8435   4.4677   7.0946  -4.6625   9.4659   16.170   10.717   10.766   4.9026   18.980   6.1035 -8.213858 7.828709 
1 1 1    9    3  109 o   47.275   2.2137   92.572   8.5070   97.156   11.333   86.655   12.876   48.161   2.9001   45.184   3.5237 2.977119 4.563719 
1 1 1    9    3  110 o   29.608   3.4272   37.469   8.1189   44.062   11.366   30.601   11.601   31.622   4.5396   25.719   5.6850 5.902750 7.275084 
1 1 1    9    3  111 o   17.123   5.4826   13.187   8.6537   11.543   13.384   14.368   11.344   17.341   6.6896   18.016   6.2857 -0.6744442 9.179390 
1 1 1    9    3  112 o   16.400   5.2123   12.103   7.8331   7.8754   10.960   16.518   11.199   15.230   6.0019   18.860   6.2508 -3.629581 8.665773 
1 1 1    9    3  113 o   45.884   2.3579   87.908   8.7894   83.897   11.575   93.369   13.507   44.366   3.2227   46.577   3.5852 -2.211323 4.820706 
1 1 1    9    3  114 o   30.614   3.2878   40.344   8.0761   45.461   10.623   33.338   12.431   32.025   4.1683   26.289   5.9413 5.736362 7.257615 
1 1 1    9    3  115 o   50.875   2.3735  108.412   9.8159  115.072   12.164   95.978   16.621   52.093   2.8756   46.322   4.4567 5.770851 5.303879 
1 1 1    9    3  116 o   49.000   2.4664  100.994   9.8197   90.707   11.969  122.173   17.174   45.934   3.2170   52.579   4.0380 -6.644897 5.162789 
1 1 1    9    3  117 o   43.288   2.7441   79.683   9.6331   75.950   11.746   87.353   16.837   41.734   3.4843   43.530   4.8260 -1.795345 5.952349 
1 1 1    9    3  118 f   60.599   2.0967  153.536   10.341  160.491   13.437  143.430   16.196   61.464   2.6884   57.316   3.4830 4.147636 4.399874 
1 1 1    9    3  119 o   24.198   4.4018   27.121   8.3627   24.091   10.653   31.984   13.499   21.797   5.8671   24.572   6.6000 -2.774635 8.830781 
1 1 1    9    3  120 o   27.560   4.9182   36.069   10.644   26.199   16.233   43.513   14.097   21.456   7.5169   29.254   6.1090 -7.798519 9.686245 
1 1 1    9    3  121 o   25.114   4.9567   30.254   9.7868   15.888   13.769   44.923   13.913   17.798   6.8057   29.832   5.9304 -12.03427 9.027021 
1 1 1    9    3  122 o   13.108   5.5647   4.2479   10.347   0.5817   13.355   9.7538   16.366   13.271   5.9534   16.276   6.9567 -3.004794 9.156383 
1 1 1    9    3  123 o   17.745   6.0521   16.192   10.494   24.437   13.804   4.9032   16.153   20.875   6.9405   15.055   6.6631 5.820315 9.621190 
1 1 1    9    3  124 o   17.154   6.3877   14.934   11.948   12.919   13.700   21.335   24.420   16.599   6.6550   19.470   8.4121 -2.871014 10.72622 
1 1 1    9    3  125 o   10.413   4.9682 -10.0070   11.744  -6.1630   13.460 -22.2669   24.037   11.860   5.5547   13.437   6.5739 -1.576744 8.606448 
1 1 1    9    3  126 o   15.408   5.9634   10.989   10.662   13.502   13.934   7.4384   16.560   16.691   6.7048   15.532   6.8151 1.158628 9.560321 
1 1 1    9    3  127 o   17.122   6.1045   15.280   10.743   8.3514   13.882   25.626   16.964   15.119   6.4329   20.446   7.6117 -5.327559 9.965977 
1 1 1    9    3  128 o   15.605   5.9800   11.750   10.646   3.6964   13.666   24.178   16.978   13.837   6.1261   19.880   7.5679 -6.042856 9.736679 
1 1 1    9    3  129 o   31.959   4.3502   47.959   11.039   39.524   14.120   61.220   17.704   26.789   6.5269   33.327   6.7486 -6.538036 9.388515 
1 1 1    9    3  130 o   9.7597   4.7214 -12.9857   11.482 -19.8038   16.639  -6.7881   15.864   11.189   5.4730   12.587   5.9373 -1.398492 8.075022 
1 1 1    9    4 -129 o   16.667   7.8222   4.5304   26.927   0.0000   0.0000   4.5304   26.927  ?   ?    16.667   7.8222 0.000000 7.822190 
1 1 1    9    4 -128 o   27.782   4.9360   37.747   10.769   43.280   11.918   13.133   25.137   29.599   5.1250   17.600   8.0048 11.99911 9.504901 
1 1 1    9    4 -127 o   12.990   5.5013   4.8857   10.071   3.7201   11.075   10.456   24.211   12.985   5.6375   17.087   7.8040 -4.101623 9.627252 
1 1 1    9    4 -126 o   10.627   4.8863  -3.2004   9.7089   1.0516   10.722 -22.5618   22.880   12.153   5.4008   12.950   6.3518 -0.7977133 8.337543 
1 1 1    9    4 -125 o   22.494   5.2049   25.320   9.3542   21.597   11.191   33.957   17.042   19.945   6.2153   23.357   7.7097 -3.412510 9.903022 
1 1 1    9    4 -124 o   10.825   4.8788  -1.2630   9.0868   5.8041   10.835 -18.0219   16.684   13.628   5.7352   11.461   5.5784 2.167066 8.000744 
1 1 1    9    4 -123 o   28.990   4.1943   38.879   9.6240   55.152   11.459  -0.0807   17.730   34.640   4.1401   14.409   6.6173 20.23084 7.805691 
1 1 1    9    4 -122 o   20.887   5.8040   22.619   10.236   23.723   11.274   17.438   24.419   21.112   6.1669   18.747   8.2491 2.364180 10.29942 
1 1 1    9    4 -121 o   16.636   5.8370   13.769   9.7905   10.451   10.729   30.287   23.941   15.335   5.9691   21.483   8.7313 -6.147403 10.57662 
1 1 1    9    4 -120 o   29.344   4.4837   40.135   10.385   51.553   13.005   20.040   17.253   32.821   5.0203   19.164   7.5369 13.65711 9.055879 
1 1 1    9    4 -119 o   10.759   4.8249  -1.2945   8.7630  -6.4872   10.340   11.940   16.508   10.418   4.8756   16.961   7.1047 -6.543275 8.616811 
1 1 1    9    4 -118 o   10.970   4.8522  -0.2263   8.5533  -2.7643   9.9951   6.7168   16.532   11.075   5.0413   15.759   6.8640 -4.683621 8.516432 
1 1 1    9    4 -117 o   17.557   5.5707   15.173   8.9504   22.550   10.645  -2.6233   16.534   21.040   5.9452   13.929   6.3943 7.111123 8.731127 
1 1 1    9    4 -116 o   23.694   4.9448   26.660   9.2412   33.426   10.987   10.301   17.084   26.342   5.3008   16.913   7.1640 9.428413 8.911815 
1 1 1    9    4 -115 o   12.318   5.1869   3.0586   8.8705   12.180   10.537 -19.1362   16.436   16.388   6.0172   11.598   5.6199 4.790025 8.233421 
1 1 1    9    4 -114 o   42.777   2.8836   77.866   9.9961   77.688   11.861   78.303   18.571   42.336   3.4674   40.476   5.7936 1.859131 6.751882 
1 1 1    9    4 -113 o   9.9677   4.5757  -4.3513   8.4650  -6.8097   10.172   1.1851   15.265   10.475   4.8804   14.646   6.4798 -4.170831 8.112140 
1 1 1    9    4 -112 o   33.300   3.3150   47.686   8.8787   45.388   10.803   52.470   15.586   31.959   4.2523   33.150   5.9884 -1.191082 7.344537 
1 1 1    9    4 -111 o   18.465   5.5822   15.957   9.1127   33.595   12.159  -6.6477   13.765   26.642   5.7663   12.538   5.7844 14.10362 8.167590 
1 1 1    9    4 -110 o   11.972   4.4886   5.0633   5.9204   2.1804   11.896   6.0124   6.8257   13.775   5.9104   12.874   4.8211 0.9010639 7.627369 
1 1 1    9    4 -109 o   13.570   4.6097   7.6655   6.0873   15.730   11.969   4.8518   7.0699   18.694   6.4604   12.455   4.8462 6.238754 8.076054 
1 1 1    9    4 -108 o   9.3549   4.1369  -1.3816   6.2144   13.095   14.288  -4.7594   6.9014   18.208   6.9399   8.8641   4.0916 9.344103 8.056311 
1 1 1    9    4 -107 o   40.649   2.1795   68.456   7.1954   97.775   13.319   56.373   8.5505   48.064   3.4219   36.648   2.8855 11.41658 4.476134 
1 1 1    9    4 -106 o   28.446   2.9250   34.071   6.6858   34.688   12.045   33.797   8.0377   27.651   5.5373   28.107   3.5899 -0.4563313 6.599163 
1 1 1    9    4 -105 o   65.335   1.7732  175.507   9.4350  181.853   14.735  171.097   12.283   66.110   2.7402   64.298   2.3475 1.812408 3.608299 
1 1 1    9    4 -104 o   15.717   4.5825   10.833   6.2304   18.484   11.049   7.2666   7.5441   20.192   6.1556   13.979   5.0980 6.212296 7.992581 
1 1 1    9    4 -103 f   46.585   2.0051   89.445   7.5963   87.861   12.957   90.274   9.3767   45.652   3.5088   46.666   2.4738 -1.014286 4.293152 
1 1 1    9    4 -102 o   65.644   1.6684  176.822   8.9206  167.233   14.773  182.325   11.191   63.423   2.8649   66.540   2.0658 -3.117149 3.532024 
1 1 1    9    4 -101 o   65.074   1.6976  173.736   8.9969  169.287   15.301  176.087   11.123   63.811   2.9497   65.402   2.0890 -1.591381 3.614527 
1 1 1    9    4 -100 o   51.727   2.0432  110.098   8.5981  117.488   12.085  102.522   12.236   53.220   2.7954   49.625   3.0394 3.594551 4.129414 
1 1 1    9    4  -99 o   55.589   1.7329  126.748   7.8426  133.528   12.596  122.455   10.023   56.796   2.7286   54.518   2.2602 2.278088 3.543137 
1 1 1    9    4  -98 o   52.573   1.7842  113.383   7.6352  113.678   12.012  113.184   9.8900   52.388   2.8234   52.410   2.3208 -0.2158737E-01 3.654763 
1 1 1    9    4  -97 o   62.969   1.5990  162.355   8.2011  154.722   12.870  167.574   10.641   61.242   2.5839   63.880   2.0462 -2.638397 3.296012 
1 1 1    9    4  -96 o  100.672   1.4114  414.247   11.582  407.347   17.510  419.616   15.443   99.642   2.1558  101.213   1.8718 -1.571655 2.855015 
1 1 1    9    4  -95 o   63.109   1.6079  162.979   8.2649  174.870   12.975  154.859   10.722   65.202   2.4456   61.419   2.1448 3.783604 3.252827 
1 1 1    9    4  -94 o   59.897   1.6462  146.808   8.0300  146.646   12.764  146.913   10.331   59.679   2.6302   59.839   2.1212 -0.1602554 3.379003 
1 1 1    9    4  -93 o   66.857   1.5805  182.680   8.6132  184.431   13.533  181.487   11.167   66.997   2.4824   66.543   2.0612 0.4541550 3.226531 
1 1 1    9    4  -92 o   50.766   2.1259  105.696   8.7779  109.750   11.947  100.941   12.940   51.606   2.8511   49.407   3.2307 2.199326 4.308884 
1 1 1    9    4  -91 o   54.180   2.2400  120.394   9.8718  115.133   12.343  129.736   16.447   52.874   2.8745   55.972   3.6242 -3.097595 4.625755 
1 1 1    9    4  -90 o   62.841   2.0705  161.694   10.591  162.490   13.081  160.177   18.047   62.920   2.5558   62.263   3.5707 0.6570663 4.391176 
1 1 1    9    4  -89 f   96.695   1.7004  381.912   13.403  388.127   17.364  372.751   21.081   97.410   2.1869   95.330   2.7156 2.079765 3.486676 
1 1 1    9    4  -88 o   67.163   1.9528  184.492   10.680  199.391   16.724  174.234   13.878   69.671   2.9515   65.175   2.6174 4.495750 3.944897 
1 1 1    9    4  -87 o   33.187   3.0881   45.546   8.2581   35.508   12.275   53.845   11.161   28.797   5.4284   35.974   3.8668 -7.176634 6.664853 
1 1 1    9    4  -86 o   98.582   1.6594  396.743   13.335  399.613   18.723  393.788   18.996   98.861   2.3234   98.131   2.3748 0.7301483 3.322299 
1 1 1    9    4  -85 o   79.048   1.7248  255.087   11.114  259.883   15.814  250.405   15.623   79.687   2.4373   78.217   2.4534 1.470108 3.458320 
1 1 1    9    4  -84 o   20.345   4.6313   17.719   7.5077   32.039   11.349   6.5754   10.011   27.403   5.2719   15.161   5.8017 12.24282 7.839191 
1 1 1    9    4  -83 o  138.937   1.5593  787.646   17.660  770.767   23.839  808.175   26.290  137.374   2.1288  140.644   2.2931 -3.270493 3.128948 
1 1 1    9    4  -82 o  114.724   1.5483  536.987   14.480  538.281   19.931  535.542   21.071  114.809   2.1297  114.503   2.2575 0.3062057 3.103533 
1 1 1    9    4  -81 o   39.038   2.5524   62.539   8.0776   68.322   12.107   57.900   10.844   40.667   3.6924   37.423   3.5992 3.243332 5.156346 
1 1 1    9    4  -80 o   81.753   1.6521  272.687   11.010  259.568   18.025  280.495   13.905   79.639   2.7808   82.892   2.0579 -3.252548 3.459478 
1 1 1    9    4  -79 o  145.390   1.5646  862.297   18.543  853.546   29.398  868.079   23.896  144.553   2.4949  145.835   2.0102 -1.282333 3.203949 
1 1 1    9    4  -78 o   93.688   1.5982  358.056   12.205  369.265   19.921  351.320   15.443   95.043   2.5737   92.777   2.0421 2.265816 3.285399 
1 1 1    9    4  -77 f   93.730   1.6229  358.368   12.400  375.144   20.033  347.950   15.787   95.804   2.5676   92.332   2.0976 3.472641 3.315488 
1 1 1    9    4  -76 o  113.922   1.6700  529.398   15.508  536.604   27.991  526.207   18.628  114.550   3.0002  113.557   2.0124 0.9932785 3.612655 
1 1 1    9    4  -75 o   52.066   2.2413  110.847   9.4903  108.181   17.360  111.983   11.334   51.225   4.1943   52.298   2.6674 -1.072571 4.970598 
1 1 1    9    4  -74 o   90.113   1.8533  331.266   13.613  334.177   22.747  329.642   16.992   90.383   3.0921   89.839   2.3223 0.5437317 3.867037 
1 1 1    9    4  -73 o  141.466   1.6584  816.231   19.124  821.264   27.866  811.749   26.294  141.847   2.4100  141.033   2.2872 0.8138123 3.322581 
1 1 1    9    4  -72 o  130.212   1.5398  691.437   16.344  698.415   22.412  683.511   23.887  130.836   2.1014  129.422   2.2642 1.414337 3.089099 
1 1 1    9    4  -71 o  109.570   1.5590  489.578   13.925  491.628   19.239  487.323   20.179  109.773   2.1501  109.285   2.2652 0.4878082 3.123158 
1 1 1    9    4  -70 o  110.911   1.5793  501.625   14.278  491.757   19.564  512.871   20.885  109.789   2.1861  112.116   2.2853 -2.327049 3.162490 
1 1 1    9    4  -69 f   75.413   2.0748  232.161   12.743  218.769   21.115  239.832   15.981   73.089   3.5547   76.618   2.5623 -3.529770 4.381958 
1 1 1    9    4  -68 o  135.139   1.7562  744.751   19.345  742.625   28.543  746.557   26.310  134.900   2.5957  135.270   2.3861 -0.3697052 3.525777 
1 1 1    9    4  -67 o  317.313   2.4707  4108.36   63.908  4159.53   92.082  4060.80   88.767  319.096   3.5401  315.303   3.4537 3.792542 4.945772 
1 1 1    9    4  -66 o  338.597   2.5761  4678.28   71.103  4660.13  101.050  4696.07  100.066  337.734   3.6705  339.045   3.6207 -1.310852 5.155792 
1 1 1    9    4  -65 o   37.585   3.0688   58.050   9.3203   68.940   14.475   50.337   12.182   40.824   4.4201   34.814   4.3900 6.009861 6.229733 
1 1 1    9    4  -64 o  133.326   1.8708  724.911   20.332  764.234   26.685  670.492   31.392  136.870   2.3918  128.166   3.0047 8.703430 3.840441 
1 1 1    9    4  -63 o  166.669   1.8632  1132.80   25.313  1140.55   33.578  1122.60   38.527  167.204   2.4636  165.856   2.8497 1.347809 3.766942 
1 1 1    9    4  -62 o  209.314   1.8666  1786.62   31.848  1755.25   45.032  1818.01   45.047  207.412   2.6635  211.091   2.6180 -3.678955 3.734686 
1 1 1    9    4  -61 o  175.267   1.7308  1252.56   24.728  1233.54   35.139  1271.21   34.805  173.891   2.4790  176.530   2.4187 -2.639252 3.463427 
1 1 1    9    4  -60 o   78.414   1.7269  250.712   11.038  256.703   16.180  245.496   15.097   79.287   2.5065   77.542   2.3914 1.744949 3.464291 
1 1 1    9    4  -59 o  121.696   1.4981  603.796   14.861  588.144   19.947  623.323   22.280  120.092   2.0377  123.625   2.2109 -3.533081 3.006719 
1 1 1    9    4  -58 o  255.792   1.9334  2668.09   40.313  2681.55   53.946  2651.06   60.667  256.386   2.5812  254.893   2.9199 1.493866 3.897214 
1 1 1    9    4  -57 o   53.123   1.9343  115.229   8.3623  114.976   11.709  115.492   11.947   53.018   2.7185   53.134   2.7678 -0.1156845 3.879541 
1 1 1    9    4  -56 o  191.602   1.7807  1496.87   27.812  1497.35   34.619  1496.00   46.702  191.612   2.2165  191.476   2.9922 0.1352844 3.723679 
1 1 1    9    4  -55 o  226.702   1.7755  2095.51   32.811  2097.02   39.004  2091.85   60.685  226.766   2.1100  226.397   3.2883 0.3691559 3.907109 
1 1 1    9    4  -54 o  216.476   1.7298  1910.66   30.523  1886.32   35.974  1973.20   57.674  215.077   2.0519  219.892   3.2176 -4.815201 3.816206 
1 1 1    9    4  -53 o   64.953   1.3575  171.986   7.1875  172.434   10.218  171.548   10.113   65.001   1.9305   64.834   1.9156 0.1668549 2.719599 
1 1 1    9    4  -52 o  310.623   1.9281  3934.20   48.821  4025.77   66.898  3829.85   71.409  314.161   2.6123  306.398   2.8591 7.763428 3.872806 
1 1 1    9    4  -51 o  212.260   1.6852  1836.86   29.158  1832.07   38.922  1842.99   44.019  211.957   2.2527  212.571   2.5404 -0.6144104 3.395337 
1 1 1    9    4  -50 o  276.534   1.7727  3117.81   39.959  3107.65   53.908  3130.21   59.531  276.044   2.3957  277.026   2.6363 -0.9820251 3.562229 
1 1 1    9    4  -49 o  177.501   1.3802  1284.39   19.970  1296.64   27.332  1270.37   29.247  178.330   1.8802  176.509   2.0327 1.821259 2.768999 
1 1 1    9    4  -48 o  274.563   1.8795  3073.60   42.064  3022.31   59.569  3124.61   59.407  272.212   2.6846  276.784   2.6331 -4.572174 3.760306 
1 1 1    9    4  -47 o  228.207   1.6703  2123.16   31.071  2110.55   44.577  2135.07   43.331  227.495   2.4038  228.816   2.3231 -1.321671 3.342953 
1 1 1    9    4  -46 o  319.082   2.2341  4151.62   58.108  4177.93   90.235  4132.98   75.953  319.986   3.4595  318.311   2.9272 1.674591 4.531734 
1 1 1    9    4  -45 o  164.837   1.3402  1107.60   18.007  1076.38   24.247  1146.00   26.889  162.485   1.8307  167.654   1.9675 -5.168716 2.687488 
1 1 1    9    4  -44 o  242.859   1.6230  2404.44   32.129  2430.17   43.745  2374.29   47.344  244.132   2.1982  241.299   2.4070 2.833527 3.259698 
1 1 1    9    4  -43 o  182.796   1.4730  1362.12   21.948  1334.75   27.887  1406.67   35.578  180.939   1.8908  185.736   2.3499 -4.796127 3.016112 
1 1 1    9    4  -42 o  252.362   1.7603  2596.31   36.212  2596.95   46.223  2595.30   58.268  252.374   2.2469  252.264   2.8336 0.1095276 3.616318 
1 1 1    9    4  -41 o  170.440   1.4333  1184.17   19.913  1181.19   25.618  1188.71   31.654  170.217   1.8463  170.747   2.2743 -0.5296021 2.929350 
1 1 1    9    4  -40 o  376.295   2.5366  5773.73   77.806  5873.79  104.842  5651.06  116.084  379.475   3.3893  372.170   3.8264 7.305054 5.111679 
1 1 1    9    4  -39 o  223.040   1.7458  2027.96   31.740  1994.47   42.140  2071.87   48.252  221.174   2.3374  225.414   2.6260 -4.240005 3.515597 
1 1 1    9    4  -38 o  174.854   1.5479  1246.30   22.062  1247.16   29.816  1245.25   32.799  174.904   2.0913  174.765   2.3023 0.1389923 3.110330 
1 1 1    9    4  -37 o  303.089   2.1373  3745.09   52.806  3589.33   78.668  3872.82   71.240  296.668   3.2531  308.184   2.8358 -11.51569 4.315591 
1 1 1    9    4  -36 o  278.782   2.0093  3168.34   45.660  3204.98   70.797  3142.24   59.746  280.347   3.0980  277.609   2.6402 2.737488 4.070447 
1 1 1    9    4  -35 o  201.603   1.7928  1656.82   29.462  1654.31   52.664  1657.96   35.545  201.414   3.2076  201.665   2.1623 -0.2517395 3.868400 
1 1 1    9    4  -34 o  536.254   3.4538 11727.40  150.975 11840.78  232.887 11645.21  198.285  538.626   5.3042  534.256   4.5531 4.369812 6.990367 
1 1 1    9    4  -33 o  324.307   2.2516  4287.67   59.524  4335.43   92.154  4253.49   77.970  326.055   3.4673  322.984   2.9615 3.071533 4.559885 
1 1 1    9    4  -32 o  368.676   2.3348  5541.17   70.166  5559.58   99.897  5523.24   98.575  369.243   3.3190  368.036   3.2858 1.206757 4.670339 
1 1 1    9    4  -31 o  194.598   1.6496  1543.59   26.167  1519.38   34.541  1576.18   40.088  193.057   2.1949  196.627   2.5011 -3.569504 3.327602 
1 1 1    9    4  -30 o  455.097   2.9897  8444.40  110.908  8376.60  145.921  8537.15  170.666  453.206   3.9499  457.480   4.5766 -4.273895 6.045370 
1 1 1    9    4  -29 o  459.313   3.0143  8601.49  112.858  8474.91  147.678  8779.20  174.985  455.863   3.9742  463.925   4.6272 -8.062042 6.099561 
1 1 1    9    4  -28 o  323.183   2.2508  4257.79   59.294  4156.48   89.484  4337.08   79.170  319.276   3.4383  326.156   2.9778 -6.880249 4.548548 
1 1 1    9    4  -27 o  270.952   1.9792  2992.60   43.713  3052.17   68.314  2951.30   56.883  273.609   3.0630  269.062   2.5935 4.546875 4.013512 
1 1 1    9    4  -26 o  442.658   3.1520  7988.89  113.735  7921.49  160.124  8057.53  161.577  440.713   4.4572  444.481   4.4595 -3.767975 6.305090 
1 1 1    9    4  -25 o  476.849   3.3628  9270.96  130.712  9198.38  184.063  9344.81  185.657  474.893   4.7548  478.658   4.7583 -3.764679 6.726779 
1 1 1    9    4  -24 f  120.389   1.5928  590.763   15.630  586.706   22.805  594.357   21.465  119.970   2.3320  120.751   2.1808 -0.7810440 3.192805 
1 1 1    9    4  -23 o  530.480   3.6999 11474.10  159.990 11401.80  225.506 11547.37  227.020  528.700   5.2325  532.065   5.2344 -3.364380 7.401227 
1 1 1    9    4  -22 o  309.544   2.3581  3905.87   59.501  3815.68   83.107  4000.72   85.226  305.925   3.3326  313.255   3.3376 -7.329834 4.716584 
1 1 1    9    4  -21 o  193.448   1.7743  1525.36   27.978  1543.57   40.400  1508.57   38.784  194.591   2.5470  192.373   2.4733 2.218201 3.550239 
1 1 1    9    4  -20 o  259.348   2.0842  2741.70   44.062  2810.46   63.865  2679.24   60.869  262.564   2.9839  256.363   2.9128 6.201263 4.169900 
1 1 1    9    4  -19 o  247.340   2.0226  2493.68   40.779  2443.54   57.427  2544.69   57.916  244.828   2.8775  249.844   2.8437 -5.016403 4.045610 
1 1 1    9    4  -18 o  289.574   2.0748  3417.98   48.975  3438.89   75.827  3403.01   64.150  290.437   3.2028  288.928   2.7238 1.508911 4.204412 
1 1 1    9    4  -17 o  111.850   1.4718  509.920   13.419  528.114   21.781  498.790   17.036  113.824   2.3475  110.621   1.8893 3.202591 3.013306 
1 1 1    9    4  -16 o  433.542   2.6762  7661.94   94.577  7560.23  132.617  7767.21  134.915  430.619   3.7781  436.473   3.7920 -5.854095 5.352852 
1 1 1    9    4  -15 o  439.127   2.7054  7860.65   96.839  7943.23  138.401  7781.44  135.547  441.391   3.8466  436.874   3.8062 4.516632 5.411475 
1 1 1    9    4  -14 o  474.104   3.0923  9163.15  119.506  9219.48  159.256  9090.54  180.800  475.521   4.1086  472.157   4.6976 3.363739 6.240821 
1 1 1    9    4  -13 o   60.852   1.8262  151.071   9.0481  146.580   12.636  155.798   12.963   59.910   2.5935   61.769   2.5802 -1.859089 3.658383 
1 1 1    9    4  -12 o  551.898   3.5462 12417.67  159.536 12375.81  210.791 12473.79  244.091  550.912   4.6939  553.046   5.4144 -2.133789 7.165817 
1 1 1    9    4  -11 o  149.366   1.5126  909.345   18.416  899.610   24.786  921.345   27.517  148.561   2.0467  150.344   2.2453 -1.782608 3.038193 
1 1 1    9    4  -10 o  421.597   3.0208  7245.73  103.815  7186.97  146.513  7304.98  147.123  419.844   4.2811  423.278   4.2640 -3.433655 6.042301 
1 1 1    9    4   -9 o  289.686   2.0885  3420.58   49.317  3263.98   73.544  3548.54   66.479  282.961   3.1885  295.045   2.7641 -12.08423 4.219822 
1 1 1    9    4   -8 o  348.272   2.8266  4944.41   80.245  4877.73  179.483  4961.06   89.711  345.803   6.3674  348.852   3.1548 -3.048889 7.106037 
1 1 1    9    4   -7 o  714.565   4.8776 20820.70  284.108 20979.18  495.607 20743.13  346.737  716.935   8.4805  713.149   5.9646 3.786682 10.36801 
1 1 1    9    4   -6 o  219.723   1.8949  1967.83   33.939  1973.79   59.431  1964.95   41.343  220.039   3.3134  219.558   2.3100 0.4808655 4.039177 
1 1 1    9    4   -5 o  583.116   3.7335 13862.28  177.463 13485.21  264.992 14168.92  238.963  575.029   5.6534  589.467   4.9732 -14.43890 7.529498 
1 1 1    9    4   -4 o  665.165   4.5582 18040.19  247.150 18096.34  429.059 18012.30  302.351  665.928   7.9041  664.583   5.5812 1.344482 9.675991 
1 1 1    9    4   -3 o  490.867   3.4526  9822.80  138.148  9549.26  190.952 10123.21  200.111  483.930   4.8407  498.257   4.9270 -14.32693 6.907052 
1 1 1    9    4   -2 o  348.078   2.5814  4938.74   73.244  4946.85  103.742  4930.68  103.424  348.341   3.6535  347.772   3.6483 0.5697021 5.163198 
1 1 1    9    4   -1 o  151.074   1.5258  930.257   18.790  964.135   29.450  906.997   24.402  153.795   2.3491  149.171   2.0068 4.624680 3.089571 
1 1 1    9    4    0 o  406.824   2.9350  6746.70   97.331  6772.20  138.195  6721.60  137.104  407.558   4.1597  406.033   4.1424 1.524597 5.870525 
1 1 1    9    4    1 o  383.585   2.5859  5997.71   80.855  6124.40  125.752  5908.43  105.569  387.581   3.9803  380.702   3.4019 6.879333 5.235985 
1 1 1    9    4    2 o  274.660   2.1742  3074.93   48.677  3122.55   69.833  3029.93   67.887  276.765   3.0954  272.630   3.0547 4.134796 4.348886 
1 1 1    9    4    3 o  665.435   4.2250 18053.78  229.176 18435.69  356.338 17784.38  299.284  672.277   6.5025  660.368   5.5598 11.90912 8.555334 
1 1 1    9    4    4 o  173.298   1.5895  1224.10   22.454  1238.96   34.846  1213.54   29.363  174.341   2.4520  172.546   2.0876 1.794830 3.220304 
1 1 1    9    4    5 o  627.203   3.9956 16038.33  204.280 15749.62  307.522 16266.35  273.289  621.405   6.0711  631.570   5.3084 -10.16541 8.064564 
1 1 1    9    4    6 o  298.562   2.8078  3633.65   68.335   0.0000   0.0000  3633.65   68.335  ?   ?   298.562   2.8078 0.000000 2.807823 
1 1 1    9    4    7 o  145.923   1.6360  867.914   19.460  849.119   34.034  877.044   23.721  144.326   2.8929  146.687   1.9838 -2.360565 3.507727 
1 1 1    9    4    8 o  182.048   1.7347  1350.85   25.742  1262.90   43.824  1397.18   31.808  176.011   3.0545  185.141   2.1076 -9.129761 3.711058 
1 1 1    9    4    9 o  256.476   2.5301  2681.36   52.896  2706.97  107.288  2673.14   60.799  257.646   5.1085  256.077   2.9127 1.569427 5.880468 
1 1 1    9    4   10 o  415.245   3.6462  7029.64  123.417  7000.95  246.588  7039.22  142.557  414.226   7.3030  415.509   4.2089 -1.283020 8.429022 
1 1 1    9    4   11 o  325.177   2.9890  4310.48   79.227  4333.26  159.857  4303.06   91.218  325.942   6.0167  324.887   3.4444 1.055481 6.932833 
1 1 1    9    4   12 o  347.954   3.1466  4935.61   89.247  4969.61  127.142  4902.59  125.306  349.113   4.4677  346.752   4.4332 2.361023 6.293952 
1 1 1    9    4   13 o  255.937   2.5119  2670.11   52.404  2752.12   75.933  2595.54   72.413  259.819   3.5853  252.320   3.5207 7.498077 5.024893 
1 1 1    9    4   14 o  450.968   3.4997  8291.14  128.650  8346.48  167.214  8210.87  201.391  452.429   4.5341  448.690   5.5063 3.738525 7.132783 
1 1 1    9    4   15 o   57.651   2.2396  135.684   10.505  139.353   14.338  131.430   15.435   58.389   3.0227   56.680   3.3558 1.708794 4.516448 
1 1 1    9    4   16 o  283.896   2.2084  3285.28   51.107  3375.45   73.851  3202.42   70.797  287.749   3.1485  280.278   3.0988 7.470947 4.417670 
1 1 1    9    4   17 o  155.473   1.6372  985.238   20.749  959.934   29.255  1010.85   29.432  153.458   2.3387  157.475   2.2928 -4.017517 3.275111 
1 1 1    9    4   18 o  568.440   3.9358 13174.64  182.372 13026.69  255.626 13328.00  260.261  565.134   5.5490  571.630   5.5855 -6.495789 7.873321 
1 1 1    9    4   19 o  313.339   2.3748  4002.17   60.657  4140.09   88.134  3878.06   83.608  318.668   3.3929  308.421   3.3256 10.24731 4.750902 
1 1 1    9    4   20 o  433.826   3.0912  7672.65  109.315  7631.75  154.080  7714.10  155.115  432.615   4.3693  434.942   4.3751 -2.327332 6.183191 
1 1 1    9    4   21 o  747.250   5.0893 22774.15  310.000 22777.83  438.598 22770.48  438.215  747.049   7.2025  746.929   7.1973 0.1197510 10.18221 
1 1 1    9    4   22 o  352.709   2.6028  5071.32   74.832  5122.46  106.817  5022.03  104.866  354.448   3.6970  350.958   3.6656 3.490784 5.206219 
1 1 1    9    4   23 o  379.664   2.7631  5876.27   85.514  5842.48  120.586  5910.45  121.287  378.529   3.9081  380.724   3.9081 -2.195282 5.526880 
1 1 1    9    4   24 f  280.166   2.1879  3199.62   49.967  3210.55   71.033  3188.93   70.300  280.622   3.1053  279.677   3.0836 0.9458008 4.376262 
1 1 1    9    4   25 o  360.433   2.6492  5296.05   77.836  5229.46  109.226  5364.76  110.949  358.120   3.7416  362.722   3.7524 -4.602631 5.299099 
1 1 1    9    4   26 o  139.286   1.7433  790.792   19.793  762.045   31.232  810.088   25.588  136.719   2.8024  140.970   2.2267 -4.250671 3.579338 
1 1 1    9    4   27 o  110.570   1.9681  498.359   17.739  479.222   24.734  518.627   25.455  108.383   2.8020  112.789   2.7686 -4.405983 3.939104 
1 1 1    9    4   28 o  172.446   1.8472  1212.17   25.965  1223.29   41.824  1205.20   33.121  173.218   2.9621  171.942   2.3631 1.275360 3.789242 
1 1 1    9    4   29 o  187.159   1.9050  1427.87   29.063  1442.65   46.590  1418.46   37.185  188.105   3.0385  186.533   2.4456 1.572250 3.900393 
1 1 1    9    4   30 o  289.414   2.4530  3414.67   57.870  3485.62   93.160  3370.08   73.845  292.351   3.9092  287.496   3.1511 4.855560 5.021069 
1 1 1    9    4   31 o  408.588   3.2180  6807.17  107.180  6780.87  169.261  6824.78  138.481  407.664   5.0935  409.057   4.1531 -1.392822 6.572073 
1 1 1    9    4   32 o  194.043   1.9325  1534.88   30.567  1548.10   48.913  1526.41   39.154  194.852   3.0795  193.497   2.4824 1.355560 3.955439 
1 1 1    9    4   33 o  209.885   2.0066  1795.77   34.330  1802.60   54.882  1791.38   44.000  210.253   3.2022  209.616   2.5751 0.6376648 4.109199 
1 1 1    9    4   34 o  188.036   4.2318  1442.34   64.863  1442.34   64.863   0.0000   0.0000  188.036   4.2318  ?   ?  0.000000 4.231755 
1 1 1    9    4   35 o  293.821   3.9310  3521.44   94.150  3406.52  129.410  3650.67  137.229  288.877   5.4957  299.038   5.6297 -10.16116 7.867381 
1 1 1    9    4   36 o  162.223   2.8614  1073.07   37.838  1029.24   51.818  1123.13   55.380  158.791   4.0065  165.925   4.0946 -7.133881 5.728654 
1 1 1    9    4   37 o  213.168   3.2141  1853.15   55.849  1868.41   78.825  1837.77   79.142  213.982   4.5191  212.216   4.5750 1.765152 6.430614 
1 1 1    9    4   38 o   19.875   5.6433   16.531   9.5679   17.758   13.494   15.290   13.568   21.187   6.8521   20.188   6.8817 0.9987526 9.711278 
1 1 1    9    4   39 o  251.221   2.2292  2573.12   45.651  2719.48   75.450  2488.60   57.337  258.201   3.5848  247.036   2.8473 11.16531 4.578003 
1 1 1    9    4   40 o  115.653   1.7026  545.262   16.051  522.969   25.660  559.593   20.573  113.245   2.7797  117.156   2.1543 -3.910797 3.516759 
1 1 1    9    4   41 o  162.341   1.8020  1074.40   23.846  1084.37   38.590  1068.23   30.329  163.061   2.9033  161.862   2.2987 1.198975 3.703088 
1 1 1    9    4   42 o  232.153   2.1284  2197.40   40.278  2204.11   64.507  2193.11   51.565  232.444   3.4045  231.900   2.7278 0.5434570 4.362537 
1 1 1    9    4   43 o  368.863   2.9619  5549.45   89.056  5623.64  142.751  5502.17  113.950  371.116   4.7188  367.203   3.8069 3.912689 6.062997 
1 1 1    9    4   44 o  258.023   2.2766  2714.67   47.883  2721.80   76.419  2710.06   61.439  258.272   3.6299  257.766   2.9240 0.5060120 4.661100 
1 1 1    9    4   45 o  142.741   1.7474  830.662   20.332  828.270   32.798  832.156   25.911  142.504   2.8235  142.857   2.2251 -0.3534393 3.594872 
1 1 1    9    4   46 o  233.590   2.1434  2224.86   40.813  2210.36   64.917  2234.34   52.483  232.749   3.4216  234.054   2.7508 -1.304932 4.390281 
1 1 1    9    4   47 o  473.299   3.3533  9140.26  129.372  9174.87  184.132  9106.52  181.810  473.927   4.7663  472.168   4.7237 1.759216 6.710538 
1 1 1    9    4   48 o  208.787   1.8613  1777.33   31.678  1783.77   45.819  1771.44   43.845  209.125   2.6878  208.407   2.5809 0.7181702 3.726345 
1 1 1    9    4   49 o  162.676   1.6854  1078.90   22.350  1056.88   32.400  1098.89   30.870  160.980   2.4691  164.154   2.3070 -3.174545 3.379163 
1 1 1    9    4   50 o  107.842   1.6034  474.134   14.095  463.612   21.072  482.653   18.960  106.619   2.4246  108.795   2.1380 -2.175041 3.232561 
1 1 1    9    4   51 o   82.321   1.6930  276.291   11.361  268.275   17.452  282.186   14.966   81.057   2.6449   83.156   2.2098 -2.099426 3.446499 
1 1 1    9    4   52 o  145.966   1.6381  868.644   19.491  877.725   28.780  860.949   26.492  146.701   2.4067  145.299   2.2367 1.402237 3.285579 
1 1 1    9    4   53 o  210.147   2.0419  1800.80   34.977  1773.30   45.788  1839.32   54.201  208.498   2.6941  212.312   3.1318 -3.813751 4.131129 
1 1 1    9    4   54 o  257.749   2.2922  2709.42   48.160  2707.33   63.100  2712.34   74.537  257.590   3.0051  257.773   3.5473 -0.1825256 4.649118 
1 1 1    9    4   55 o  101.234   2.4496  418.003   20.214  418.003   20.214   0.0000   0.0000  101.234   2.4496  ?   ?  0.000000 2.449592 
1 1 1    9    4   56 o  101.454   1.9532  419.719   16.153  422.853   25.741  417.683   20.747  101.747   3.1073  101.192   2.5152 0.5554047 3.997633 
1 1 1    9    4   57 o  187.651   1.9344  1435.89   29.589  1441.22   48.777  1432.79   37.220  187.921   3.1842  187.422   2.4362 0.4991302 4.009296 
1 1 1    9    4   58 o   43.978   2.4368   79.132   8.7014  102.743   18.051   71.985   9.9314   49.941   4.4817   41.900   2.9262 8.041199 5.352361 
1 1 1    9    4   59 o  126.842   1.6964  656.007   17.540  641.913   28.185  664.915   22.407  125.431   2.7566  127.685   2.1528 -2.253830 3.497660 
1 1 1    9    4   60 o  130.171   1.4813  690.825   15.717  691.688   21.439  689.824   23.110  130.234   2.0195  130.053   2.1799 0.1818085 2.971628 
1 1 1    9    4   61 o  153.473   1.5293  960.326   19.132  959.303   25.844  961.566   28.458  153.369   2.0672  153.540   2.2738 -0.1707153 3.072998 
1 1 1    9    4   62 o  118.423   1.4796  571.775   14.283  577.196   19.737  565.815   20.696  118.966   2.0353  117.783   2.1556 1.183197 2.964637 
1 1 1    9    4   63 o  228.722   1.9475  2133.44   36.310  2109.28   44.859  2179.34   61.831  227.386   2.4202  231.043   3.2830 -3.656540 4.078694 
1 1 1    9    4   64 o  144.393   1.7126  850.165   20.157  837.419   24.435  877.311   35.660  143.289   2.0920  146.608   2.9839 -3.319168 3.644245 
1 1 1    9    4   65 o   37.930   2.2346   58.890   6.8783   42.348   11.676   67.681   8.5122   31.847   4.6333   40.646   2.5825 -8.798443 5.304456 
1 1 1    9    4   66 o  162.615   1.6181  1078.28   21.449  1108.50   29.462  1044.20   31.288  164.846   2.1925  159.980   2.3993 4.866150 3.250168 
1 1 1    9    4   67 o   50.838   1.8260  105.537   7.5549  110.325   14.418  103.726   8.8700   51.859   3.4301   50.380   2.1649 1.479691 4.056157 
1 1 1    9    4   68 o   35.049   2.2110   50.311   6.2846   61.931   13.019   46.781   7.1761   38.694   4.1947   33.756   2.6287 4.938259 4.950285 
1 1 1    9    4   69 f  191.422   1.7018  1494.29   26.554  1460.04   35.577  1537.36   39.899  189.171   2.3072  194.096   2.5218 -4.925018 3.417943 
1 1 1    9    4   70 o  151.160   1.5679  931.755   19.319  927.329   26.487  936.786   28.240  150.767   2.1552  151.525   2.2864 -0.7577057 3.142063 
1 1 1    9    4   71 o  227.648   1.9583  2113.98   36.339  2109.50   52.000  2118.26   50.802  227.306   2.8064  227.787   2.7360 -0.4812317 3.919420 
1 1 1    9    4   72 o  136.607   1.8599  761.216   20.711  778.422   26.761  735.518   32.706  138.107   2.3771  134.195   2.9899 3.911743 3.819689 
1 1 1    9    4   73 o  114.326   1.8521  533.173   17.260  547.006   22.247  512.255   27.357  115.768   2.3574  111.942   3.0008 3.826103 3.816054 
1 1 1    9    4   74 o  123.880   1.8513  626.036   18.694  614.046   23.921  644.849   29.963  122.650   2.3926  125.642   2.9256 -2.991730 3.779385 
1 1 1    9    4   75 o  175.197   1.9418  1252.32   27.731  1295.48   36.330  1192.08   42.925  178.129   2.5020  170.795   3.0832 7.333710 3.970656 
1 1 1    9    4   76 o   70.917   2.1803  205.458   12.589  199.542   16.600  213.468   19.313   69.821   2.9231   72.180   3.2911 -2.359451 4.401782 
1 1 1    9    4   77 f   32.162   3.9579   42.999   10.158   27.823   12.317   75.257   17.958   25.477   6.0261   42.460   5.3038 -16.98305 8.027735 
1 1 1    9    4   78 o  118.510   1.8734  573.107   18.097  575.109   22.598  569.529   30.218  118.678   2.3360  117.970   3.1452 0.7074890 3.917773 
1 1 1    9    4   79 o  143.667   1.8807  842.304   22.024  828.479   27.589  866.592   36.569  142.429   2.3763  145.568   3.0818 -3.139160 3.891588 
1 1 1    9    4   80 o   50.071   2.4896  102.674   10.130   99.242   13.551  107.023   15.250   49.121   3.4053   50.980   3.6949 -1.858841 5.024762 
1 1 1    9    4   81 o  118.284   1.8480  571.028   17.819  580.075   22.803  556.841   28.555  119.167   2.3475  116.635   3.0059 2.531860 3.813966 
1 1 1    9    4   82 o  187.814   1.7125  1439.51   26.217  1411.32   33.926  1481.29   41.309  185.883   2.2390  190.350   2.6623 -4.467117 3.478643 
1 1 1    9    4   83 o  152.371   1.6311  947.424   20.259  919.308   26.166  989.510   32.013  150.026   2.1396  155.585   2.5242 -5.558395 3.308979 
1 1 1    9    4   84 o  105.942   1.6552  458.074   14.294  451.793   18.631  467.060   22.285  105.162   2.1735  106.876   2.5580 -1.713844 3.356668 
1 1 1    9    4   85 o   68.652   1.9643  192.652   10.981  179.951   14.309  210.849   17.127   66.268   2.6544   71.699   2.9367 -5.431145 3.958488 
1 1 1    9    4   86 o   59.727   2.1923  146.002   10.655  151.664   13.951  138.076   16.507   60.794   2.8229   57.890   3.5147 2.904350 4.507999 
1 1 1    9    4   87 o   62.358   2.0669  159.096   10.492  154.320   13.576  166.177   16.532   61.328   2.7225   63.566   3.2008 -2.237839 4.202036 
1 1 1    9    4   88 o  135.675   1.6025  751.591   17.723  767.544   23.294  729.660   27.311  137.022   2.0855  133.507   2.5095 3.514832 3.262976 
1 1 1    9    4   89 f  105.740   1.7459  456.755   15.048  468.969   18.114  429.548   27.035  107.094   2.0750  102.204   3.2492 4.890213 3.855264 
1 1 1    9    4   90 o   20.349   5.0168   17.898   8.2680   20.618   9.6461   10.366   16.051   21.806   5.4439   18.880   7.3143 2.926134 9.117857 
1 1 1    9    4   91 o   94.395   1.7462  364.179   13.436  358.971   15.999  376.642   24.750   93.661   2.0955   95.639   3.1791 -1.978127 3.807629 
1 1 1    9    4   92 o   98.135   1.5784  393.491   12.627  394.430   16.478  392.157   19.651   98.167   2.0593   97.763   2.4679 0.4037552 3.214216 
1 1 1    9    4   93 o   56.273   2.0649  129.841   9.4560  128.303   12.767  131.711   14.074   55.795   2.8162   56.475   3.0687 -0.6799736 4.165092 
1 1 1    9    4   94 o   34.036   2.8034   47.976   7.7091   41.638   10.055   57.016   12.008   31.419   4.0177   36.827   4.0679 -5.408060 5.717481 
1 1 1    9    4   95 o   42.289   2.5166   73.746   8.6359   73.938   11.974   73.538   12.467   42.112   3.5202   41.953   3.6829 0.1591339 5.094658 
1 1 1    9    4   96 o   35.024   2.8790   50.915   8.1467   47.929   11.252   54.206   11.811   33.632   4.1952   35.818   4.1202 -2.186287 5.880108 
1 1 1    9    4   97 o   51.968   2.1825  111.081   9.2248   95.474   12.516  129.642   13.649   47.909   3.2236   55.928   3.0049 -8.019295 4.406964 
1 1 1    9    4   98 o   32.731   2.7840   44.541   7.3576   52.657   9.7050   33.571   11.283   35.447   3.4005   27.681   5.1909 7.765520 6.205513 
1 1 1    9    4   99 o   20.576   4.2528   18.423   6.8972   23.157   9.0681   11.924   10.624   22.921   4.9949   17.306   6.0797 5.614691 7.868405 
1 1 1    9    4  100 o   69.683   1.7254  199.045   9.8006  178.886   12.715  228.559   15.384   65.852   2.3725   74.381   2.5411 -8.529587 3.476481 
1 1 1    9    4  101 o   21.566   4.1598   20.233   7.0475   9.6735   9.2138   35.121   10.941   15.803   5.6511   28.304   4.9205 -12.50125 7.493082 
1 1 1    9    4  102 o   16.305   4.8511   11.607   6.9233   9.3141   9.1977   14.605   10.516   15.599   5.6376   18.382   6.0558 -2.783707 8.273816 
1 1 1    9    4  103 f   44.144   2.2650   80.583   8.1233   73.446   10.643   90.542   12.573   41.859   3.1421   46.416   3.3454 -4.557526 4.589605 
1 1 1    9    4  104 o   82.105   1.6516  276.599   11.054  279.734   14.735  272.564   16.717   82.330   2.1975   81.103   2.5317 1.227043 3.352398 
1 1 1    9    4  105 o   9.7560   4.3933  -2.9995   7.3504  -2.0435   10.516  -3.9126   10.278   12.114   5.3680   11.488   5.1823 0.6254196 7.461362 
1 1 1    9    4  106 o   44.611   2.4220   82.630   8.7743   76.609   12.331   88.804   12.488   42.483   3.5945   45.870   3.3633 -3.386826 4.922581 
1 1 1    9    4  107 o   48.373   2.3059   97.042   9.0662  106.105   12.838   88.025   12.806   50.218   3.1520   45.568   3.4737 4.649647 4.690593 
1 1 1    9    4  108 o   30.587   3.1294   39.652   7.6928   47.576   10.227   29.326   11.675   33.225   3.8471   25.115   5.8171 8.110371 6.974123 
1 1 1    9    4  109 o   15.688   5.0414   10.840   7.3124   7.2782   9.6245   15.703   11.246   14.601   5.6618   18.603   6.2659 -4.001925 8.444993 
1 1 1    9    4  110 o   8.8175   4.1039  -5.5692   7.1630 -16.0081   9.3698   9.1111   11.111   8.4319   4.1207   15.753   6.0903 -7.321055 7.353379 
1 1 1    9    4  111 o   29.783   3.6041   38.441   8.5719   45.471   12.166   31.511   12.079   31.707   4.8619   25.706   5.8911 6.001379 7.638309 
1 1 1    9    4  112 o   24.472   4.2410   26.837   8.1537   32.845   10.234   16.399   13.491   26.774   4.8686   18.777   6.8219 7.997103 8.381043 
1 1 1    9    4  113 o   39.757   2.7784   66.951   8.9473   61.476   11.057   77.334   15.228   37.576   3.6561   41.461   4.5821 -3.884510 5.861962 
1 1 1    9    4  114 o   13.229   5.1476   6.1968   7.9767   3.7467   9.6967   11.325   14.029   13.005   5.4462   16.870   6.7442 -3.865142 8.668633 
1 1 1    9    4  115 o   9.6113   4.4191  -4.0926   7.9396 -10.4504   9.6712   9.0496   13.905   9.3826   4.4852   16.001   6.5957 -6.618685 7.976259 
1 1 1    9    4  116 o   8.4108   4.0132  -8.3612   7.6672 -13.2196   9.7452  -0.4680   12.422   8.9293   4.3268   12.859   5.7573 -3.930172 7.201968 
1 1 1    9    4  117 o   40.416   3.0488   70.503   9.9701   74.168   11.737   61.004   18.895   41.068   3.5406   33.779   7.0886 7.289307 7.923679 
1 1 1    9    4  118 o   17.370   5.3627   14.816   8.3530   17.548   10.627   10.400   13.512   18.544   6.0864   16.038   6.5440 2.506109 8.936904 
1 1 1    9    4  119 o   15.607   6.2220   10.239   11.907   0.3286   13.492   45.134   25.317   13.330   5.9817   25.439   9.3293 -12.10897 11.08226 
1 1 1    9    4  120 o   17.190   6.3692   14.745   11.851   13.727   13.529   18.103   24.571   16.966   6.6738   19.102   8.3433 -2.135714 10.68413 
1 1 1    9    4  121 o   22.093   6.2848   26.065   11.856   42.307   17.000   10.684   16.543   27.006   7.4705   16.467   7.0150 10.53896 10.24780 
1 1 1    9    4  122 o   38.199   3.7409   65.496   11.499   62.970   14.880   69.241   18.118   35.969   5.2278   36.443   6.3286 -0.4743538 8.208627 
1 1 1    9    4  123 o   13.279   5.6262   4.8738   10.543   5.3535   13.510   4.1268   16.859   14.344   6.2268   14.963   6.7026 -0.6193638 9.148647 
1 1 1    9    4  124 o   9.8736   4.7515 -11.7220   11.265 -12.0920   15.619 -11.3209   16.263   11.790   5.6529   12.141   5.8071 -0.3511286 8.104197 
1 1 1    9    4  125 o   49.417   3.3936  108.158   13.587  104.786   18.526  112.082   19.988   46.631   4.9495   47.852   5.2081 -1.221233 7.184810 
1 1 1    9    4  126 o   21.330   6.9139   26.444   13.734   17.530   22.995   31.388   17.124   18.251   8.0187   22.284   7.7260 -4.032900 11.13512 
1 1 1    9    4  127 o   12.063   5.6017  -3.8671   13.227 -32.3499   22.403   11.376   16.389   11.965   5.9442   16.236   6.9512 -4.271054 9.146179 
1 1 1    9    4  128 o   12.794   5.7036   1.6486   12.053   12.578   17.233  -8.8181   16.864   16.641   7.1264   12.597   5.9943 4.043708 9.312186 
1 1 1    9    4  129 o   31.211   9.6321   72.712   26.951   0.0000   0.0000   72.712   26.951  ?   ?    31.211   9.6321 0.000000 9.632135 
1 1 1    9    5 -127 o   12.733   5.5152   3.4768   10.550   10.295   13.160  -8.7873   17.650   15.447   6.3967   12.863   6.1241 2.583653 8.855638 
1 1 1    9    5 -126 o   17.791   5.7872   16.724   9.6177   24.426   11.447  -1.7637   17.735   21.064   6.2305   13.903   6.4665 7.160326 8.979696 
1 1 1    9    5 -125 o   15.382   5.6675   11.619   9.3612  -0.1493   10.978   42.981   17.921   11.916   5.3673   26.090   7.8151 -14.17407 9.480705 
1 1 1    9    5 -124 o   13.148   5.3567   6.2596   9.0367  -4.5009   10.649   33.937   17.079   10.813   5.0230   23.193   7.7204 -12.37978 9.210561 
1 1 1    9    5 -123 o   20.476   5.5015   21.569   9.3775   13.342   11.148   41.477   17.341   16.329   6.1515   26.073   7.6573 -9.743389 9.822152 
1 1 1    9    5 -122 o   16.673   5.7227   14.127   9.3866   9.8254   11.109   24.863   17.550   15.038   6.0050   20.210   7.6943 -5.172349 9.760232 
1 1 1    9    5 -121 f   17.410   5.7032   15.516   9.3324   18.922   11.047   7.0272   17.441   18.827   6.2070   15.680   6.9324 3.146437 9.305108 
1 1 1    9    5 -120 o   30.985   4.2286   44.340   10.402   45.001   11.492   41.345   24.470   30.785   4.7306   24.017   9.0990 6.768627 10.25523 
1 1 1    9    5 -119 o   13.886   5.5683   7.3543   9.5931   11.775   10.481 -15.4780   23.818   15.810   5.9626   14.130   6.8269 1.679728 9.064182 
1 1 1    9    5 -118 o   8.8429   4.2723 -11.6674   9.3258  -8.1582   10.133 -31.1035   23.847   9.9432   4.7066   12.776   6.3086 -2.833225 7.870876 
1 1 1    9    5 -117 o   33.996   3.7909   51.744   10.327   39.410   11.202  121.565   26.652   28.744   4.9599   47.650   7.0762 -18.90605 8.641374 
1 1 1    9    5 -116 o   12.590   5.3028   3.7499   9.2748   2.2091   10.066   12.414   23.869   12.442   5.3881   18.223   8.0807 -5.781327 9.712330 
1 1 1    9    5 -115 o   15.787   5.7879   11.457   9.7434   20.239   10.582 -37.4611   24.975   19.898   6.0153   12.784   6.3379 7.114777 8.738049 
1 1 1    9    5 -114 o   15.251   5.5022   10.470   8.7562   11.053   10.215   8.8561   17.001   15.757   5.8985   16.538   7.0802 -0.7816257 9.215318 
1 1 1    9    5 -113 o   22.200   5.0684   23.469   8.9695   18.843   10.672   34.597   16.553   19.418   6.0724   25.064   7.5115 -5.646255 9.659064 
1 1 1    9    5 -112 o   17.945   5.4067   15.379   8.5591   15.028   10.276   16.174   15.465   17.744   5.9896   18.651   7.1920 -0.9073410 9.359459 
1 1 1    9    5 -111 o   19.714   5.2963   18.481   8.6914   11.976   10.533   32.359   15.385   16.492   6.0224   24.889   7.1849 -8.397121 9.375050 
1 1 1    9    5 -110 o   29.161   3.8282   37.314   8.8803   30.726   10.660   52.255   16.053   25.627   5.2787   32.881   6.2172 -7.253874 8.155865 
1 1 1    9    5 -109 o   46.577   2.2261   90.336   8.4274   83.369   11.636   98.023   12.222   44.213   3.2513   48.029   3.1391 -3.815926 4.519379 
1 1 1    9    5 -108 o   65.547   1.6697  176.993   8.9141  176.286   13.532  177.535   11.848   64.951   2.5608   65.378   2.2265 -0.4266434 3.393399 
1 1 1    9    5 -107 o   51.717   1.9629  110.580   8.2599  103.357   11.659  117.859   11.704   49.584   2.8971   53.055   2.7153 -3.471134 3.970630 
1 1 1    9    5 -106 o   28.417   2.9416   34.129   6.7155   49.515   10.425   23.214   8.7800   33.898   3.8403   22.658   4.8968 11.23941 6.223063 
1 1 1    9    5 -105 o   27.576   3.0345   32.175   6.7083   29.985   10.371   33.750   8.7961   25.784   5.1152   27.898   3.9808 -2.113766 6.481619 
1 1 1    9    5 -104 o   58.254   1.8220  139.703   8.6414  134.884   14.039  142.643   10.965   56.734   3.0468   58.693   2.2963 -1.959183 3.815181 
1 1 1    9    5 -103 o   27.131   4.0672   31.881   8.7182   29.441   15.130   33.094   10.667   24.869   7.1080   27.278   4.9809 -2.408161 8.679460 
1 1 1    9    5 -102 o   21.637   4.2831   20.568   7.2868   10.911   14.645   23.745   8.4004   17.827   6.9640   23.173   4.6093 -5.346472 8.351233 
1 1 1    9    5 -101 o   42.152   2.3729   73.612   8.1204   71.430   16.220   74.341   9.3805   40.409   5.0331   42.249   2.7386 -1.839500 5.729909 
1 1 1    9    5 -100 o   25.338   3.5042   27.348   7.0441   17.080   13.508   31.184   8.2554   19.906   6.8638   26.967   3.8660 -7.060749 7.877666 
1 1 1    9    5  -99 o   46.342   2.0135   88.444   7.5882  100.755   12.894   81.921   9.3856   49.078   3.2412   44.443   2.6022 4.635033 4.156498 
1 1 1    9    5  -98 o   12.525   4.6385   5.3902   6.2844   8.8698   10.985   3.6972   7.6622   16.086   6.0960   12.454   4.9824 3.632356 7.873089 
1 1 1    9    5  -97 o   54.498   1.7928  121.897   7.9536  108.343   12.234  131.819   10.468   51.068   2.9514   56.557   2.2752 -5.488228 3.726590 
1 1 1    9    5  -96 o  109.336   1.4230  488.944   12.683  504.957   18.998  476.070   17.034  110.883   2.1018  107.725   1.9399 3.157532 2.860205 
1 1 1    9    5  -95 o   45.461   1.9703   84.916   7.2839   87.292   11.316   83.235   9.5179   45.841   3.0456   44.871   2.6135 0.9699020 4.013214 
1 1 1    9    5  -94 o   49.607   1.8828  100.968   7.5999   95.940   11.638  104.707   10.035   48.112   2.9820   50.404   2.4498 -2.291664 3.859272 
1 1 1    9    5  -93 o   82.612   1.4957  279.003   10.072  285.439   15.276  274.053   13.397   83.371   2.2498   81.776   2.0098 1.594421 3.016750 
1 1 1    9    5  -92 o   99.755   1.4482  406.644   11.776  395.186   17.284  416.570   16.088   98.183   2.1596  100.857   1.9569 -2.673714 2.914364 
1 1 1    9    5  -91 o   44.425   2.0771   81.009   7.5011   88.832   11.534   75.275   9.8744   46.337   3.0710   42.684   2.8544 3.652966 4.192687 
1 1 1    9    5  -90 o   12.560   4.6589   5.1681   6.3444   9.1651   9.9151   2.3969   8.2558   16.076   5.8472   12.426   5.0979 3.649826 7.757520 
1 1 1    9    5  -89 o   50.175   1.9120  103.114   7.8058  110.318   11.850   97.592   10.375   51.755   2.8195   48.704   2.6229 3.050587 3.850882 
1 1 1    9    5  -88 o   70.899   1.6181  205.343   9.3516  211.149   13.955  200.611   12.599   71.759   2.3891   69.974   2.2116 1.785057 3.255598 
1 1 1    9    5  -87 f   37.644   2.4864   58.288   7.5868   46.284   11.630   67.181   10.010   33.166   4.4110   40.335   3.0675 -7.168682 5.372740 
1 1 1    9    5  -86 o   57.085   1.9901  133.362   9.2465  145.840   13.280  121.621   12.882   59.593   2.7412   54.381   2.9167 5.212360 4.002656 
1 1 1    9    5  -85 o   52.132   2.3237  111.391   9.8496  106.397   14.717  115.442   13.256   50.750   3.5805   52.962   3.0838 -2.211937 4.725506 
1 1 1    9    5  -84 o   52.950   2.3049  114.864   9.9244   99.846   13.850  130.713   14.228   49.190   3.4765   56.377   3.1081 -7.187397 4.663263 
1 1 1    9    5  -83 o  126.371   1.6160  651.860   16.647  681.577   23.069  619.575   24.045  129.139   2.1915  123.092   2.3964 6.046913 3.247392 
1 1 1    9    5  -82 o   65.402   1.9392  174.837   10.327  156.478   14.115  195.983   15.149   61.770   2.8107   69.160   2.6923 -7.389614 3.892145 
1 1 1    9    5  -81 o  123.885   1.5867  626.294   16.023  596.573   21.268  665.303   24.366  120.846   2.1590  127.592   2.3428 -6.745674 3.185924 
1 1 1    9    5  -80 o   58.639   2.0268  140.574   9.6733  153.330   13.310  126.293   14.083   61.178   2.6755   55.455   3.1281 5.722664 4.116198 
1 1 1    9    5  -79 o   71.190   1.6926  206.809   9.8219  198.849   14.208  214.095   13.593   69.711   2.5044   72.358   2.3075 -2.647324 3.405385 
1 1 1    9    5  -78 o  118.766   1.4816  575.398   14.344  581.454   20.647  569.748   19.942  119.334   2.1225  118.132   2.0709 1.202232 2.965469 
1 1 1    9    5  -77 o  135.517   1.5668  749.191   17.308  761.746   23.585  734.539   25.479  136.595   2.1182  134.110   2.3307 2.485382 3.149407 
1 1 1    9    5  -76 o   56.532   2.2098  130.680   10.164  147.566   15.588  118.193   13.405   59.977   3.1999   53.673   3.0768 6.304504 4.439147 
1 1 1    9    5  -75 o  168.816   1.7649  1162.77   24.286  1157.73   35.062  1167.43   33.673  168.352   2.5549  169.071   2.4433 -0.7193604 3.535138 
1 1 1    9    5  -74 o   74.515   2.0986  226.802   12.734  202.586   21.621  239.663   15.757   70.240   3.7903   76.563   2.5282 -6.322777 4.556108 
1 1 1    9    5  -73 o   35.700   3.1539   52.501   9.0839   46.218   13.640   57.509   12.177   33.149   5.2205   37.252   4.0766 -4.103722 6.623554 
1 1 1    9    5  -72 o  105.824   1.8533  456.872   15.987  459.422   26.355  455.387   20.110  105.988   3.0537  105.622   2.3357 0.3657150 3.844544 
1 1 1    9    5  -71 o  204.843   1.8939  1711.85   31.624  1689.46   45.270  1733.19   44.196  203.394   2.7305  206.024   2.6317 -2.629974 3.792248 
1 1 1    9    5  -70 o  270.510   2.3974  2986.83   52.864  2964.96   84.166  3001.09   67.937  269.211   3.8354  271.027   3.0751 -1.816467 4.915926 
1 1 1    9    5  -69 o  109.380   1.8505  488.018   16.500  478.397   27.146  493.655   20.778  108.174   3.0816  109.984   2.3176 -1.809830 3.855884 
1 1 1    9    5  -68 o  172.908   1.7719  1219.38   24.974  1220.04   35.952  1218.77   34.717  172.889   2.5510  172.807   2.4646 0.8207703E-01 3.547097 
1 1 1    9    5  -67 o  185.913   1.7068  1409.58   25.866  1392.57   34.630  1431.05   38.903  184.741   2.2996  187.252   2.5487 -2.511063 3.432801 
1 1 1    9    5  -66 o  118.437   1.7464  572.061   16.860  557.940   21.274  595.914   27.649  116.943   2.2317  120.823   2.8073 -3.879440 3.586282 
1 1 1    9    5  -65 o  144.251   1.6437  848.522   19.327  861.628   26.506  833.644   28.242  145.329   2.2375  142.938   2.4239 2.391174 3.298697 
1 1 1    9    5  -64 o   64.291   2.9297  169.077   15.313  226.649   23.777  128.271   20.018   74.362   3.9365   55.824   4.4354 18.53753 5.930377 
1 1 1    9    5  -63 o  174.471   1.8574  1241.44   26.416  1269.57   32.782  1189.34   44.606  176.409   2.2797  170.664   3.2064 5.744370 3.934195 
1 1 1    9    5  -62 o  193.087   1.7288  1520.33   27.210  1519.24   36.592  1521.67   40.697  192.977   2.3262  193.109   2.5853 -0.1328583 3.477799 
1 1 1    9    5  -61 o   69.381   1.8390  196.447   10.391  192.853   14.279  200.492   15.151   68.703   2.5542   70.045   2.6584 -1.342354 3.686565 
1 1 1    9    5  -60 o  167.934   1.7464  1149.99   23.906  1225.89   35.602  1087.67   32.262  173.340   2.5196  163.283   2.4239 10.05780 3.496234 
1 1 1    9    5  -59 o  123.777   1.8074  624.752   18.236  695.853   25.382  548.886   26.218  130.606   2.3841  115.979   2.7733 14.62747 3.657142 
1 1 1    9    5  -58 o  357.402   2.9132  5212.87   84.872  5490.96  140.271  5052.27  106.599  366.436   4.6960  351.712   3.7182 14.72473 5.989786 
1 1 1    9    5  -57 o  234.113   1.9578  2235.12   37.361  2272.84   67.100  2218.18   44.979  235.935   3.4889  233.193   2.3662 2.741882 4.215641 
1 1 1    9    5  -56 o   92.058   1.5585  345.526   11.695  353.873   22.708  342.513   13.644   93.072   2.9970   91.650   1.8263 1.421967 3.509624 
1 1 1    9    5  -55 o  158.737   1.6327  1027.37   21.127  1035.42   38.604  1023.92   25.242  159.290   2.9731  158.458   1.9542 0.8317413 3.557836 
1 1 1    9    5  -54 o  278.750   2.1895  3168.98   49.751  3237.38   72.488  3108.07   68.406  281.644   3.1574  275.975   3.0408 5.668365 4.383539 
1 1 1    9    5  -53 o  272.346   1.7612  3024.30   39.099  3047.55   53.197  2996.99   57.660  273.344   2.3875  271.047   2.6097 2.296753 3.537079 
1 1 1    9    5  -52 o  274.108   1.7685  3063.56   39.515  3037.25   53.114  3096.17   59.136  272.884   2.3878  275.496   2.6333 -2.611908 3.554689 
1 1 1    9    5  -51 o   64.233   1.5512  168.208   8.1219  165.620   12.787  169.959   10.515   63.674   2.4683   64.528   2.0015 -0.8545341 3.177833 
1 1 1    9    5  -50 o  150.361   1.5928  921.750   19.522  931.877   28.931  913.283   26.453  151.157   2.3480  149.649   2.1685 1.508118 3.196171 
1 1 1    9    5  -49 o  124.872   1.4523  635.689   14.783  629.692   20.731  641.892   21.085  124.266   2.0466  125.463   2.0617 -1.197479 2.905026 
1 1 1    9    5  -48 o  117.337   1.4083  561.276   13.470  571.682   18.738  550.148   19.376  118.408   1.9413  116.153   2.0465 2.254402 2.820776 
1 1 1    9    5  -47 f  160.241   1.3362  1046.74   17.453  1055.13   23.927  1037.21   25.514  160.867   1.8247  159.491   1.9625 1.376205 2.679714 
1 1 1    9    5  -46 o  109.327   1.2688  487.232   11.307  470.404   15.498  506.386   16.533  107.413   1.7700  111.444   1.8200 -4.031334 2.538738 
1 1 1    9    5  -45 o  304.211   2.0195  3773.53   50.080  3896.67   72.943  3663.73   68.879  309.063   2.8953  299.690   2.8195 9.373138 4.041381 
1 1 1    9    5  -44 o  136.866   1.5888  763.684   17.726  720.464   25.064  806.936   25.073  132.917   2.3133  140.672   2.1866 -7.754776 3.183162 
1 1 1    9    5  -43 o  287.799   2.0765  3377.34   48.715  3355.74   64.533  3405.95   74.277  286.828   2.7601  288.932   3.1537 -2.103851 4.190932 
1 1 1    9    5  -42 o  142.041   1.4818  822.484   17.157  802.613   22.874  848.041   25.941  140.302   2.0001  144.212   2.2068 -3.909729 2.978289 
1 1 1    9    5  -41 o  196.248   1.6506  1570.12   26.405  1569.31   35.292  1571.15   39.796  196.178   2.2070  196.280   2.4873 -0.1026764 3.325255 
1 1 1    9    5  -40 o  131.651   1.4649  706.541   15.720  702.454   21.138  711.599   23.516  131.259   1.9756  132.105   2.1837 -0.8464203 2.944770 
1 1 1    9    5  -39 o  175.844   1.5745  1260.53   22.568  1267.64   30.310  1251.69   33.808  176.323   2.1088  175.202   2.3673 1.121872 3.170359 
1 1 1    9    5  -38 o  235.987   1.8224  2270.40   35.056  2320.12   47.367  2210.19   52.128  238.530   2.4361  232.795   2.7470 5.734894 3.671606 
1 1 1    9    5  -37 o  144.516   1.4931  851.367   17.589  840.744   23.637  864.549   26.331  143.601   2.0193  145.615   2.2183 -2.013855 2.999749 
1 1 1    9    5  -36 o  447.018   3.1912  8150.73  116.281  8160.11  142.563  8132.10  200.989  447.188   3.9109  446.159   5.5265 1.029114 6.770312 
1 1 1    9    5  -35 o  320.088   2.2473  4177.39   58.637  4301.96   79.443  4028.30   86.909  324.778   3.0008  314.250   3.3928 10.52866 4.529401 
1 1 1    9    5  -34 o  191.176   1.6412  1489.89   25.576  1543.46   34.700  1426.17   37.845  194.568   2.1878  187.020   2.4824 7.547775 3.308947 
1 1 1    9    5  -33 o   35.141   2.5718   50.621   7.3159   47.254   9.8017   54.856   10.993   33.844   3.6085   36.478   3.7504 -2.633938 5.204462 
1 1 1    9    5  -32 f  225.562   1.7676  2074.07   32.500  2030.71   43.027  2131.67   49.592  223.174   2.3652  228.644   2.6608 -5.469650 3.560048 
1 1 1    9    5  -31 f  170.952   1.6695  1191.31   23.265  1189.62   33.641  1192.86   32.209  170.815   2.4161  171.050   2.3100 -0.2351227 3.342705 
1 1 1    9    5  -30 o  418.276   2.9971  7134.35  102.190  7109.44  144.649  7159.17  144.387  417.437   4.2510  418.897   4.2285 -1.459595 5.995910 
1 1 1    9    5  -29 o  105.916   1.5513  457.286   13.394  428.996   19.386  483.124   18.527  102.579   2.3185  108.862   2.0878 -6.282211 3.119953 
1 1 1    9    5  -28 o  251.007   2.0318  2568.46   41.572  2611.92   60.072  2528.51   57.589  253.094   2.9118  249.022   2.8370 4.071396 4.065380 
1 1 1    9    5  -27 o  366.466   2.4890  5475.30   74.353  5369.33   97.338  5623.75  115.209  362.861   3.2908  371.324   3.8062 -8.463654 5.031610 
1 1 1    9    5  -26 o  397.116   2.4885  6429.40   80.554  6484.26  115.050  6376.65  112.824  398.746   3.5396  395.427   3.5003 3.319977 4.978010 
1 1 1    9    5  -25 o  577.178   3.4622 13585.16  162.891 13728.26  232.700 13447.67  228.094  580.046   4.9215  574.094   4.8741 5.952148 6.926620 
1 1 1    9    5  -24 o  103.612   1.4836  437.592   12.530  406.127   19.686  459.025   16.247   99.809   2.4196  106.116   1.8782 -6.306633 3.063034 
1 1 1    9    5  -23 o  124.749   1.4664  634.335   14.911  615.352   23.310  647.484   19.400  122.859   2.3276  126.031   1.8884 -3.171806 2.997242 
1 1 1    9    5  -22 o  188.749   1.6248  1452.19   24.998  1456.39   38.918  1449.25   32.617  189.008   2.5260  188.551   2.1222 0.4567566 3.299116 
1 1 1    9    5  -21 o  105.221   1.4766  451.284   12.665  458.855   20.223  446.399   16.245  106.093   2.3384  104.647   1.9043 1.446068 3.015707 
1 1 1    9    5  -20 o  285.500   2.0603  3322.67   47.948  3380.90   74.843  3282.14   62.445  287.958   3.1885  283.737   2.6999 4.221222 4.178028 
1 1 1    9    5  -19 o  209.129   1.7058  1782.71   29.079  1748.84   44.687  1807.58   38.297  207.117   2.6468  210.574   2.2311 -3.457367 3.461754 
1 1 1    9    5  -18 o  277.471   2.0206  3138.39   45.701  3218.61   71.679  3083.44   59.322  280.967   3.1297  275.017   2.6462 5.949371 4.098442 
1 1 1    9    5  -17 o  205.956   1.6897  1729.02   28.367  1790.71   44.946  1688.17   36.572  209.583   2.6309  203.502   2.2047 6.081329 3.432490 
1 1 1    9    5  -16 o  315.767   2.2175  4064.56   57.077  3881.18   84.862  4216.04   77.128  308.528   3.3743  321.577   2.9423 -13.04910 4.476957 
1 1 1    9    5  -15 o  297.382   2.2969  3605.05   55.679  3541.89   96.779  3636.29   68.073  294.712   4.0286  298.655   2.7962 -3.943665 4.903879 
1 1 1    9    5  -14 o  186.633   1.8996  1419.83   28.900  1402.17   65.389  1424.12   32.217  185.424   4.3262  186.912   2.1145 -1.488846 4.815286 
1 1 1    9    5  -13 o  314.898   2.3813  4042.25   61.125  4085.47  107.120  4021.39   74.432  316.519   4.1518  314.070   2.9073 2.448578 5.068532 
1 1 1    9    5  -12 o  109.324   1.5724  487.162   14.013  475.063   24.664  492.929   17.028  107.913   2.8063  109.968   1.8996 -2.054802 3.388745 
1 1 1    9    5  -11 o  147.321   1.4829  884.632   17.808  897.562   27.475  875.265   23.386  148.387   2.2715  146.535   1.9578 1.851746 2.998787 
1 1 1    9    5  -10 f   66.437   1.6934  180.029   9.1633  205.180   14.511  163.347   11.818   70.901   2.5147   63.261   2.2955 7.640057 3.404896 
1 1 1    9    5   -9 o  300.103   2.1265  3671.18   52.021  3633.12   78.957  3700.37   69.151  298.518   3.2448  301.279   2.8158 -2.761414 4.296151 
1 1 1    9    5   -8 o  262.167   2.2891  2801.74   48.919  2820.51   78.041  2789.59   62.785  263.014   3.6401  261.585   2.9445 1.428497 4.681871 
1 1 1    9    5   -7 o  520.612   3.9844 11051.73  169.090 10527.82  257.102 11451.08  224.466  507.959   6.2093  529.851   5.1971 -21.89200 8.097218 
1 1 1    9    5   -6 o  117.362   1.7468  561.431   16.711  580.601   21.830  534.294   25.973  119.345   2.2439  114.483   2.7832 4.862503 3.575116 
1 1 1    9    5   -5 o  270.305   2.1352  2978.31   47.047  2939.78   66.088  3017.90   66.991  268.534   3.0192  272.079   3.0205 -3.544769 4.270707 
1 1 1    9    5   -4 o  225.717   1.9141  2076.72   35.219  2120.71   61.969  2055.74   42.803  228.072   3.3332  224.568   2.3383 3.503510 4.071594 
1 1 1    9    5   -3 o   84.079   1.7011  288.150   11.659  310.411   20.847  278.017   14.064   87.210   2.9366   82.560   2.0915 4.650902 3.605313 
1 1 1    9    5   -2 o  482.929   3.7245  9509.04  146.617  9639.16  234.479  9425.50  187.875  486.083   5.9178  480.743   4.7942 5.339020 7.616075 
1 1 1    9    5   -1 o  490.507   3.7809  9809.89  151.174 10104.11  244.669  9628.21  192.265  497.659   6.0313  485.882   4.8544 11.77689 7.742192 
1 1 1    9    5    0 o  624.686   4.2992 15912.80  218.918 16051.20  382.395 15845.33  267.002  627.079   7.4809  623.283   5.2552 3.795593 9.142294 
1 1 1    9    5    1 o  476.058   3.3578  9239.72  130.302  9400.10  229.057  9162.99  158.435  480.023   5.8539  474.042   4.1001 5.980835 7.146980 
1 1 1    9    5    2 o  421.398   3.0172  7239.34  103.641  7051.02  143.550  7444.38  149.790  415.831   4.2350  427.270   4.3008 -11.43845 6.035850 
1 1 1    9    5    3 o  218.218   1.8762  1941.01   33.374  1937.44   47.231  1944.57   47.166  218.006   2.6578  218.407   2.6493 -0.4011383 3.752674 
1 1 1    9    5    4 o  146.376   1.4970  873.317   17.862  859.934   27.262  883.382   23.643  145.244   2.3026  147.214   1.9703 -1.969742 3.030523 
1 1 1    9    5    5 o  429.263   2.8371  7511.90   99.274  7464.43  150.954  7548.07  131.780  427.841   4.3284  430.259   3.7574 -2.418060 5.731745 
1 1 1    9    5    6 o  137.358   1.6024  769.035   17.942  748.530   25.343  789.638   25.404  135.510   2.2943  139.181   2.2391 -3.671722 3.205894 
1 1 1    9    5    7 o  442.027   3.1433  7965.72  113.260  7869.82  158.742  8065.17  161.644  439.297   4.4330  444.714   4.4591 -5.417389 6.287660 
1 1 1    9    5    8 o  172.760   2.0720  1216.59   29.178  1220.19   41.677  1213.13   40.864  173.004   2.9554  172.504   2.9060 0.4999237 4.144780 
1 1 1    9    5    9 o  539.353   4.1117 11862.25  180.771 11921.64  287.258 11823.31  232.603  540.499   6.5199  538.379   5.3002 2.120300 8.402455 
1 1 1    9    5   10 f  320.569   2.2382  4189.02   58.486  4285.51   91.010  4121.14   76.336  324.207   3.4437  317.943   2.9454 6.263123 4.531518 
1 1 1    9    5   11 o  341.852   2.5409  4763.96   70.804  4796.14  100.841  4732.66   99.438  342.971   3.6070  340.695   3.5806 2.276337 5.082404 
1 1 1    9    5   12 o  512.925   3.5867 10727.21  149.965 10825.26  213.874 10632.38  210.336  515.160   5.0931  510.553   5.0540 4.607086 7.175121 
1 1 1    9    5   13 o  298.123   2.1207  3622.93   51.536  3643.73   79.325  3607.74   67.792  298.949   3.2552  297.482   2.7956 1.467041 4.290896 
1 1 1    9    5   14 o  295.525   2.2771  3560.14   54.853  3610.20   96.398  3536.17   66.706  297.544   3.9745  294.516   2.7786 3.028168 4.849419 
1 1 1    9    5   15 o  536.627   3.7371 11742.27  163.470 11816.74  284.914 11705.72  199.590  538.074   6.4959  535.729   4.5704 2.344360 7.942601 
1 1 1    9    5   16 o   57.261   2.0308  133.824   9.4640  143.808   16.714  129.112   11.482   59.287   3.4737   56.221   2.5118 3.065170 4.286637 
1 1 1    9    5   17 o  574.937   3.9810 13479.92  186.572 13516.61  324.176 13461.75  228.144  575.398   6.9116  574.470   4.8720 0.9276733 8.456120 
1 1 1    9    5   18 o  320.649   2.4258  4191.40   63.405  4049.28   87.801  4346.29   91.661  315.133   3.4180  326.485   3.4442 -11.35184 4.852301 
1 1 1    9    5   19 o  118.238   1.7410  569.860   16.780  564.330   26.725  573.459   21.559  117.652   2.7866  118.606   2.2299 -0.9539566 3.568978 
1 1 1    9    5   20 o   94.890   1.6287  367.021   12.598  365.692   18.110  368.267   17.536   94.713   2.3456   95.047   2.2633 -0.3336258 3.259559 
1 1 1    9    5   21 o  295.987   2.2780  3571.42   54.961  3522.53   77.156  3621.78   78.310  293.924   3.2203  298.036   3.2234 -4.111816 4.556374 
1 1 1    9    5   22 o  354.157   2.6154  5113.52   75.505  5165.61  107.881  5063.50  105.712  355.906   3.7186  352.373   3.6803 3.532990 5.231869 
1 1 1    9    5   23 o  488.024   3.4309  9711.95  136.484  9789.16  194.350  9636.82  191.711  489.836   4.8674  486.013   4.8391 3.823578 6.863555 
1 1 1    9    5   24 o   97.002   1.6181  383.548   12.795  395.181   18.595  373.089   17.632   98.456   2.3169   95.665   2.2610 2.791077 3.237362 
1 1 1    9    5   25 o  249.391   2.0305  2535.42   41.278  2524.30   58.468  2546.47   58.284  248.820   2.8827  249.910   2.8611 -1.090561 4.061478 
1 1 1    9    5   26 o  434.345   3.3930  7693.35  120.132  7718.32  155.682  7656.59  188.874  434.969   4.3908  433.129   5.3496 1.839752 6.920773 
1 1 1    9    5   27 o  345.913   2.8098  4878.78   79.227  4878.68  102.501  4878.94  124.869  345.863   3.6357  345.818   4.4297 0.4571533E-01 5.730646 
1 1 1    9    5   28 o  376.767   3.3629  5789.06  103.282  5857.30  147.617  5723.63  144.558  378.867   4.7798  374.524   4.7351 4.343811 6.728121 
1 1 1    9    5   29 o  146.811   1.9607  878.647   23.464  907.482   34.172  852.922   32.276  149.184   2.8100  144.632   2.7377 4.552597 3.923129 
1 1 1    9    5   30 o  276.056   2.6490  3107.23   59.609  3116.91   84.790  3097.77   83.818  276.429   3.7629  275.581   3.7312 0.8482971 5.299213 
1 1 1    9    5   31 f  182.264   2.0998  1354.32   31.196  1447.01   64.943  1326.52   35.569  188.322   4.2306  180.376   2.4191 7.946518 4.873369 
1 1 1    9    5   32 f  115.790   1.7170  546.547   16.206  543.369   25.987  548.570   20.731  115.436   2.7617  115.997   2.1925 -0.5614471 3.526153 
1 1 1    9    5   33 o   62.003   2.0053  156.889   10.122  155.445   16.736  157.722   12.710   61.644   3.3431   62.144   2.5142 -0.5000458 4.182997 
1 1 1    9    5   34 o  102.709   1.7194  430.045   14.395  436.633   23.632  426.158   18.151  103.437   2.8054  102.238   2.1780 1.199631 3.551607 
1 1 1    9    5   35 o  240.485   2.1794  2357.95   42.722  2384.21   68.562  2341.27   54.624  241.756   3.4791  239.607   2.7967 2.149307 4.463826 
1 1 1    9    5   36 o  201.046   1.9760  1647.88   32.382  1699.48   52.683  1616.55   41.053  204.121   3.1663  199.106   2.5295 5.014832 4.052594 
1 1 1    9    5   37 o  116.375   1.7149  552.117   16.268  549.138   26.377  553.946   20.667  116.038   2.7886  116.560   2.1752 -0.5211411 3.536585 
1 1 1    9    5   38 o  117.939   1.7249  567.059   16.583  608.386   27.671  543.898   20.715  122.136   2.7793  115.496   2.2003 6.640480 3.544872 
1 1 1    9    5   39 o  155.617   2.0544  987.376   26.060  1003.19   36.893  971.630   36.815  156.830   2.8859  154.342   2.9262 2.488174 4.109903 
1 1 1    9    5   40 o   26.305   4.7461   29.126   9.8023   28.027   13.785   30.250   13.941   25.685   6.5612   26.663   6.4790 -0.9783611 9.220987 
1 1 1    9    5   41 o  232.983   2.4192  2213.59   45.945  2243.47   65.383  2184.45   64.577  234.484   3.4207  231.379   3.4239 3.105255 4.839847 
1 1 1    9    5   42 o  228.375   2.1168  2126.64   39.406  2106.10   62.458  2140.22   50.792  227.192   3.3726  229.070   2.7201 -1.877792 4.332810 
1 1 1    9    5   43 o  122.795   1.7347  614.753   17.364  589.405   27.681  631.198   22.296  120.206   2.8250  124.415   2.1985 -4.208725 3.579673 
1 1 1    9    5   44 o  243.643   2.2020  2420.67   43.732  2373.53   68.744  2452.72   56.680  241.165   3.4969  245.210   2.8357 -4.044312 4.502161 
1 1 1    9    5   45 o  127.255   1.6281  660.206   16.888  639.256   24.844  678.203   23.026  125.197   2.4344  128.963   2.1904 -3.765419 3.274780 
1 1 1    9    5   46 o   92.391   1.6709  348.013   12.584  347.190   19.203  348.632   16.660   92.227   2.5568   92.462   2.2104 -0.2351685 3.379790 
1 1 1    9    5   47 f  334.066   2.7568  4552.44   75.072  4585.78   98.358  4505.90  116.193  335.186   3.5999  332.152   4.2915 3.034302 5.601412 
1 1 1    9    5   48 o  200.713   2.0018  1642.71   32.752  1627.92   43.181  1662.73   50.255  199.773   2.6517  201.870   3.0540 -2.097565 4.044569 
1 1 1    9    5   49 o  225.415   2.1221  2072.08   38.993  2088.14   51.738  2050.97   59.327  226.241   2.8055  224.183   3.2465 2.058502 4.290750 
1 1 1    9    5   50 o  171.751   2.1191  1202.95   29.669  1157.53   43.675  1241.87   40.428  168.419   3.1813  174.469   2.8427 -6.049789 4.266336 
1 1 1    9    5   51 o  191.956   1.9754  1502.53   30.910  1545.46   52.095  1479.20   38.400  194.595   3.2842  190.433   2.4738 4.161621 4.111599 
1 1 1    9    5   52 o   25.800   3.9715   27.814   8.0848   20.058   17.196   30.016   9.1603   22.919   7.7480   26.765   4.3478 -3.845844 8.884481 
1 1 1    9    5   53 o  224.818   2.1293  2061.23   39.022  2150.24   65.687  2012.69   48.509  229.503   3.5112  222.116   2.6792 7.386414 4.416623 
1 1 1    9    5   54 o  207.473   1.8645  1755.24   31.533  1774.26   46.022  1738.41   43.292  208.540   2.7073  206.432   2.5728 2.107544 3.734781 
1 1 1    9    5   55 o   67.441   1.8451  185.603   10.134  194.474   16.243  179.950   12.967   68.975   2.8953   66.377   2.4006 2.598618 3.761060 
1 1 1    9    5   56 o  143.919   1.6486  844.525   19.341  846.246   28.668  843.088   26.202  144.033   2.4417  143.773   2.2357 0.2591705 3.310656 
1 1 1    9    5   57 o  150.791   1.6658  927.111   20.475  937.040   30.442  918.909   27.668  151.559   2.4641  150.096   2.2614 1.462875 3.344498 
1 1 1    9    5   58 o   26.353   3.8391   28.961   8.0047   31.510   17.293   28.265   9.0305   27.275   7.5305   25.936   4.4303 1.339071 8.737079 
1 1 1    9    5   59 o   69.747   1.8605  198.519   10.568  169.155   16.526  218.834   13.746   64.295   3.1630   73.208   2.3064 -8.912872 3.914553 
1 1 1    9    5   60 o   75.560   1.6395  232.799   10.098  235.018   14.653  230.792   13.937   75.865   2.3723   75.184   2.2767 0.6802216 3.288028 
1 1 1    9    5   61 o  141.036   1.7460  811.125   20.073  806.101   24.404  821.636   35.296  140.581   2.1296  141.872   3.0520 -1.291336 3.721608 
1 1 1    9    5   62 o   46.165   2.2481   87.145   8.4345   93.749   13.115   82.487   11.014   47.793   3.3885   44.849   3.0306 2.943558 4.546015 
1 1 1    9    5   63 o  211.781   1.9207  1829.26   33.158  1804.62   41.322  1873.80   55.566  210.310   2.4104  214.218   3.1821 -3.908585 3.991943 
1 1 1    9    5   64 o  141.828   1.8895  820.382   21.844  836.885   30.828  803.741   30.957  143.202   2.6409  140.333   2.7062 2.868851 3.781294 
1 1 1    9    5   65 o   61.095   1.9295  152.389   9.5973  161.404   15.014  146.159   12.480   62.810   2.9406   59.792   2.5665 3.018013 3.903088 
1 1 1    9    5   66 o  101.884   1.6633  423.306   13.814  418.396   20.978  427.065   18.355  101.222   2.5444  102.314   2.2008 -1.091965 3.364183 
1 1 1    9    5   67 o   82.362   1.5244  276.610   10.234  284.376   20.806  274.132   11.754   83.391   3.0660   81.985   1.7589 1.406441 3.534665 
1 1 1    9    5   68 o  134.611   1.6357  738.973   17.948  799.613   31.982  711.094   21.685  139.944   2.8036  132.027   2.0149 7.916962 3.452543 
1 1 1    9    5   69 o  113.395   1.6995  524.434   15.709  513.750   25.788  530.738   19.808  112.130   2.8236  114.052   2.1307 -1.921387 3.537271 
1 1 1    9    5   70 o   61.745   2.3493  155.827   11.803  157.389   14.808  153.106   19.544   62.004   2.9381   61.043   3.9489 0.9613342 4.922041 
1 1 1    9    5   71 o   76.400   1.9764  238.303   12.298  246.653   15.042  221.464   21.360   77.698   2.3777   73.502   3.5758 4.195747 4.294168 
1 1 1    9    5   72 o  161.158   1.9305  1059.65   25.360  1049.27   28.218  1103.28   57.824  160.345   2.1589  164.040   4.3282 -3.694855 4.836732 
1 1 1    9    5   73 o  182.406   2.2236  1358.07   33.062  1342.40   37.943  1407.49   67.381  181.306   2.5674  185.283   4.4613 -3.977188 5.147317 
1 1 1    9    5   74 o  179.645   1.9873  1316.99   29.102  1306.11   32.436  1361.91   65.901  178.872   2.2246  182.226   4.4365 -3.353653 4.963015 
1 1 1    9    5   75 o   32.680   3.6655   44.268   9.5964   44.599   11.612   43.554   17.045   32.671   4.4778   31.857   6.7725 0.8136768 8.118937 
1 1 1    9    5   76 o  107.622   1.9502  472.716   17.109  459.681   22.143  492.023   26.950  106.076   2.5609  109.653   3.0179 -3.577057 3.958042 
1 1 1    9    5   77 o  210.960   1.8073  1816.11   31.079  1855.60   41.156  1763.70   47.407  213.148   2.3688  207.716   2.7999 5.432526 3.667466 
1 1 1    9    5   78 o  201.092   1.7750  1650.22   29.095  1701.06   38.657  1583.78   44.188  204.074   2.3238  196.828   2.7541 7.246536 3.603518 
1 1 1    9    5   79 o   84.418   1.7886  290.848   12.308  292.793   15.893  287.934   19.455   84.630   2.3059   83.858   2.8502 0.7721863 3.666173 
1 1 1    9    5   80 o  211.591   1.8086  1827.47   31.194  1801.99   40.527  1864.52   48.864  209.999   2.3675  213.501   2.8077 -3.501617 3.672630 
1 1 1    9    5   81 o   86.908   1.7631  308.307   12.490  307.904   16.167  308.904   19.673   86.776   2.2875   86.849   2.7824 -0.7349396E-01 3.602024 
1 1 1    9    5   82 o   60.542   2.1342  149.934   10.516  151.901   13.705  147.118   16.398   60.864   2.7696   59.807   3.3773 1.056736 4.367717 
1 1 1    9    5   83 o   56.582   2.2706  131.079   10.451  132.057   13.688  129.711   16.186   56.702   2.9718   56.100   3.5578 0.6011238 4.635624 
1 1 1    9    5   84 o   87.376   2.3825  312.497   16.953  312.497   16.953   0.0000   0.0000   87.376   2.3825  ?   ?  0.000000 2.382468 
1 1 1    9    5   85 o   35.322   3.4860   51.753   9.9062   44.341   11.700   70.525   18.618   32.456   4.5469   40.767   5.7632 -8.311371 7.340837 
1 1 1    9    5   86 o   94.913   1.6936  367.929   13.103  363.138   16.956  375.031   20.644   94.224   2.2076   95.643   2.6505 -1.419533 3.449435 
1 1 1    9    5   87 f  198.546   1.7495  1610.59   28.315  1597.62   37.025  1628.86   43.945  197.571   2.2990  199.333   2.7046 -1.762268 3.549654 
1 1 1    9    5   88 o   44.338   2.4454   80.783   8.8041   80.911   11.375   80.592   13.905   44.250   3.1745   44.006   3.9172 0.2439461 5.042027 
1 1 1    9    5   89 o  105.462   1.5890  454.406   13.660  453.994   17.759  455.003   21.377  105.326   2.0684  105.347   2.4894 -0.2080536E-01 3.236566 
1 1 1    9    5   90 o   53.209   2.2809  116.227   9.8700  123.246   13.723  108.702   14.207   54.633   3.0940   51.222   3.4222 3.411274 4.613466 
1 1 1    9    5   91 o   97.264   1.7437  386.923   13.825  384.624   19.237  389.379   19.883   96.784   2.4403   97.360   2.5074 -0.5766983 3.498842 
1 1 1    9    5   92 o  100.408   1.7254  412.430   14.122  419.279   19.799  405.339   20.147  101.062   2.4034   99.311   2.4907 1.750916 3.461235 
1 1 1    9    5   93 o   29.810   3.1985   37.121   7.6507   34.868   10.023   40.267   11.843   28.557   4.4508   30.589   4.9161 -2.032187 6.631505 
1 1 1    9    5   94 o   44.684   2.2843   82.216   8.2929   90.632   10.897   70.634   12.784   46.786   2.8711   41.007   3.8702 5.779285 4.818835 
1 1 1    9    5   95 o   30.222   3.2715   38.286   7.9311   39.767   11.148   36.768   11.286   30.401   4.6457   29.114   4.9314 1.286549 6.775061 
1 1 1    9    5   96 o   20.970   4.3775   19.154   7.2405   21.215   9.4936   16.289   11.195   21.860   5.3678   19.426   6.2373 2.433599 8.229028 
1 1 1    9    5   97 o   29.290   3.1567   35.996   7.4180   40.918   9.8333   29.495   11.300   31.004   3.9827   25.740   5.5493 5.264675 6.830555 
1 1 1    9    5   98 o   26.685   3.4508   30.159   7.3306   23.417   9.5734   39.715   11.398   22.937   5.2359   30.220   4.7860 -7.283031 7.093706 
1 1 1    9    5   99 o   62.160   1.8391  158.744   9.3082  169.116   12.302  144.853   14.236   63.997   2.3623   58.997   2.9698 4.999390 3.794741 
1 1 1    9    5  100 o   67.781   1.8996  188.915   10.485  167.221   14.438  213.124   15.252   63.439   2.7988   71.719   2.6133 -8.279827 3.829214 
1 1 1    9    5  101 o   50.239   2.2335  104.288   9.1237   97.905   12.607  111.309   13.221   48.319   3.2190   51.559   3.1610 -3.239479 4.511503 
1 1 1    9    5  102 o   68.464   1.9022  192.909   10.606  190.127   14.982  195.704   15.016   67.625   2.7234   68.628   2.6894 -1.002769 3.827492 
1 1 1    9    5  103 o   30.933   2.9867   40.244   7.4374   47.080   9.8664   31.247   11.319   33.216   3.7071   26.281   5.4620 6.935026 6.601225 
1 1 1    9    5  104 o   33.404   2.8309   46.785   7.6357   43.059   10.080   51.803   11.697   31.599   4.0028   34.591   4.2367 -2.992151 5.828580 
1 1 1    9    5  105 o   13.051   4.8953   5.9793   7.0433   9.8090   9.2650   0.7357   10.841   15.674   5.6591   12.999   5.6105 2.675056 7.968893 
1 1 1    9    5  106 o   20.609   4.4185   18.972   7.2000   19.356   9.3822   18.423   11.230   20.477   5.5033   19.927   6.2288 0.5504704 8.311714 
1 1 1    9    5  107 o   32.452   3.0104   44.574   7.8728   40.758   10.290   49.960   12.225   30.468   4.2597   33.602   4.5827 -3.134302 6.256690 
1 1 1    9    5  108 o   36.093   3.1469   55.370   9.1661   49.640   11.775   64.184   14.603   33.507   4.4187   37.880   4.8396 -4.373070 6.553370 
1 1 1    9    5  109 o   17.929   5.1537   14.904   7.9320   23.789   10.065   0.3441   12.884   22.441   5.5369   13.647   5.9989 8.794322 8.163593 
1 1 1    9    5  110 o   14.069   5.0951   8.0874   7.5174   7.1924   9.8033   9.3648   11.712   14.418   5.6781   15.827   6.2144 -1.408628 8.417789 
1 1 1    9    5  111 o   38.723   2.9084   63.772   9.1133   48.084   12.630   80.811   13.163   32.352   4.9461   43.012   3.7931 -10.65962 6.233094 
1 1 1    9    5  112 o   36.388   2.8775   56.424   8.4657   63.510   10.996   46.113   13.265   38.179   3.5749   31.234   5.4056 6.945618 6.480796 
1 1 1    9    5  113 o   20.664   4.7282   20.047   7.7915   7.6367   9.9092   40.146   12.610   14.404   5.6974   28.840   5.5657 -14.43600 7.964754 
1 1 1    9    5  114 o   13.579   5.3928   6.5644   8.9116   4.7544   10.766   10.504   15.884   13.607   5.7211   16.714   6.9829 -3.106659 9.027326 
1 1 1    9    5  115 o   11.731   5.1884   0.0940   9.7780   4.0972   11.021 -14.7133   21.196   13.441   5.7258   13.725   6.5822 -0.2843685 8.724162 
1 1 1    9    5  116 o   9.7040   4.4866  -4.4443   8.3478  -0.9494   11.127  -8.9435   12.625   12.072   5.4234   11.158   5.2731 0.9142151 7.564270 
1 1 1    9    5  117 o   21.847   5.4776   23.821   9.7357   15.401   11.860   41.219   17.048   17.519   6.3916   26.837   7.5025 -9.317770 9.855978 
1 1 1    9    5  118 o   11.843   5.1031   2.1382   8.9401  -1.3544   10.606   10.709   16.615   11.662   5.2621   16.559   7.0414 -4.897160 8.790434 
1 1 1    9    5  119 o   16.441   5.9960   13.298   10.436   21.516   13.640   1.6982   16.206   19.701   6.8914   14.385   6.4965 5.315529 9.470778 
1 1 1    9    5  120 o   33.531   4.2929   52.023   11.465   56.793   14.684   44.573   18.349   33.830   5.5146   27.137   7.8503 6.692217 9.593637 
1 1 1    9    5  121 f   12.211   5.3966   1.2042   10.560   7.5957   13.574  -8.5950   16.807   14.942   6.3596   12.755   6.0448 2.186690 8.774018 
1 1 1    9    5  122 o   26.078   6.1287   35.987   12.806   45.742   18.658   27.299   17.608   27.153   7.9340   20.974   7.7648 6.179134 11.10136 
1 1 1    9    5  123 o   15.229   6.4788   8.6020   14.076   25.177   26.993   2.4114   16.496   19.845   8.7044   14.415   6.5280 5.429510 10.88032 
1 1 1    9    5  124 o   24.569   6.1598   32.471   12.312   39.569   18.015   26.250   16.865   24.911   7.9031   20.558   7.6015 4.352190 10.96543 
1 1 1    9    5  125 o   17.563   6.0497   16.493   10.493   10.173   13.347   26.723   16.979   15.407   6.4162   20.587   7.6243 -5.179915 9.964838 
1 1 1    9    5  126 o   18.008   6.0583   17.456   10.514   9.7545   13.418   29.704   16.922   15.304   6.4078   21.618   7.6660 -6.314222 9.991344 
1 1 1    9    5  127 o   18.410   6.6290   18.904   12.703   3.3373   18.092   34.037   17.839   14.892   6.7801   22.934   7.8886 -8.041987 10.40191 
1 1 1    9    6 -125 o   13.417   5.8269   4.4093   11.841  -7.0749   16.450   16.756   17.057   12.692   6.0046   17.642   7.2917 -4.949404 9.445868 
1 1 1    9    6 -124 o   14.180   5.7179   8.3720   10.176   7.5743   12.701   9.8018   17.005   14.507   6.1621   15.900   6.9431 -1.393869 9.283195 
1 1 1    9    6 -123 o   11.529   5.1694  -0.0331   10.054  -4.2016   12.528   7.5088   16.851   11.684   5.4343   15.372   6.8044 -3.688705 8.708126 
1 1 1    9    6 -122 o   14.005   5.7210   7.6595   10.341   2.1520   12.905   17.541   17.286   13.212   5.8951   17.896   7.3631 -4.683719 9.432191 
1 1 1    9    6 -121 o   14.943   5.5993   10.504   9.2097   16.043   10.936  -3.0026   17.078   17.422   6.1643   13.598   6.3315 3.824567 8.836617 
1 1 1    9    6 -120 o   24.446   4.9832   29.306   9.5928   30.312   11.435   26.918   17.624   24.063   5.8805   20.799   7.7553 3.263906 9.732692 
1 1 1    9    6 -119 o   9.8986   4.6789  -7.4855   9.9477 -12.0983   10.803   18.242   25.512   9.5750   4.6191   18.775   8.3381 -9.199765 9.532070 
1 1 1    9    6 -118 o   12.357   5.2470   3.5639   9.2020   8.9953   10.920  -9.7367   17.089   14.775   5.9353   12.712   6.0446 2.062661 8.471458 
1 1 1    9    6 -117 o   16.206   5.6787   12.946   9.2647   12.069   10.897   15.232   17.597   15.953   6.0655   17.695   7.3681 -1.741551 9.543568 
1 1 1    9    6 -116 o   14.305   5.4625   8.7816   8.8624   8.3426   10.476   9.8868   16.622   14.518   5.8198   16.323   6.9947 -1.805139 9.099254 
1 1 1    9    6 -115 o   30.880   3.8434   42.919   9.4657   35.286   11.083   63.499   18.198   26.918   5.2394   34.697   6.6766 -7.779007 8.486956 
1 1 1    9    6 -114 o   26.071   4.4711   31.647   9.1599   31.493   10.690   32.071   17.768   25.353   5.3415   23.192   7.8755 2.160816 9.516050 
1 1 1    9    6 -113 o   13.922   5.3826   7.7341   8.6790   13.009   10.172  -6.3870   16.643   16.493   5.9328   13.291   6.2091 3.201932 8.587867 
1 1 1    9    6 -112 o   21.272   5.4444   22.290   9.4790   18.354   10.229   46.207   25.217   19.075   5.9421   26.272   9.3540 -7.196646 11.08173 
1 1 1    9    6 -111 o   24.059   5.3813   27.993   10.289   27.993   10.289   0.0000   0.0000   24.059   5.3813  ?   ?  0.000000 5.381264 
1 1 1    9    6 -110 o   21.075   5.7936   21.845   10.260   21.845   10.260   0.0000   0.0000   21.075   5.7936  ?   ?  0.000000 5.793642 
1 1 1    9    6 -109 o   49.725   2.9401  105.138   11.864  105.138   11.864   0.0000   0.0000   49.725   2.9401  ?   ?  0.000000 2.940117 
1 1 1    9    6 -108 o   31.244   2.8010   41.440   7.0580   40.565   10.461   42.170   9.5623   30.071   4.3978   30.978   3.8710 -0.9076157 5.858786 
1 1 1    9    6 -107 o   39.879   2.3275   66.450   7.5332   60.427   11.140   71.525   10.226   37.324   3.7105   41.007   3.0817 -3.682827 4.823397 
1 1 1    9    6 -106 o   39.488   2.3134   65.033   7.4137   56.179   10.906   72.640   10.109   36.016   3.7705   41.420   3.0147 -5.403561 4.827509 
1 1 1    9    6 -105 o   56.838   1.8215  133.322   8.4284  125.051   12.556  140.105   11.371   54.568   2.8325   58.000   2.4103 -3.432575 3.719232 
1 1 1    9    6 -104 o   8.3121   3.8750  -5.3452   6.4276   0.8877   9.8003 -10.0499   8.5146   12.427   5.3486   8.8683   4.2309 3.558321 6.819712 
1 1 1    9    6 -103 f   54.265   1.9395  121.523   8.5652  123.154   13.653  120.464   10.999   54.108   3.1085   53.802   2.5149 0.3066216 3.998418 
1 1 1    9    6 -102 o   8.5407   3.9411  -4.5062   6.3954   7.0501   9.8517 -12.9236   8.4079   14.712   5.7218   8.3027   4.0222 6.409242 6.994060 
1 1 1    9    6 -101 o   82.907   1.5329  281.907   10.360  264.729   15.325  296.363   14.058   79.970   2.3535   84.805   2.0337 -4.834930 3.110420 
1 1 1    9    6 -100 o   56.733   1.7983  132.397   8.3060  130.164   12.448  134.189   11.151   55.915   2.7394   56.910   2.4093 -0.9949074 3.648190 
1 1 1    9    6  -99 o   36.772   2.3501   56.076   7.0074   57.237   10.758   55.221   9.2351   36.719   3.6424   36.240   3.1577 0.4784775 4.820565 
1 1 1    9    6  -98 o   19.687   4.1203   16.978   6.3996   29.323   9.8055   7.8182   8.4465   25.766   4.8465   14.613   5.3836 11.15240 7.243759 
1 1 1    9    6  -97 o   30.937   2.8958   40.054   7.2177   32.001   12.169   44.425   8.9649   26.617   5.7751   32.426   3.4443 -5.809925 6.724180 
1 1 1    9    6  -96 o   11.412   4.6117   2.7526   6.6356  -4.2834   11.046   6.7247   8.2999   11.948   5.3825   14.099   5.3086 -2.151110 7.559931 
1 1 1    9    6  -95 o   14.922   4.9720   9.1359   7.0834   15.508   13.706   6.8138   8.2740   19.466   6.8997   14.156   5.3066 5.310036 8.704399 
1 1 1    9    6  -94 o   20.031   4.4951   17.575   7.1590   25.480   13.499   14.482   8.4443   23.687   6.6956   18.187   5.3439 5.500010 8.566646 
1 1 1    9    6  -93 o   55.284   2.0307  125.603   9.1355  149.393   17.523  116.725   10.705   59.782   3.6128   53.184   2.4762 6.598877 4.379899 
1 1 1    9    6  -92 o   27.912   3.2379   32.686   7.2306   28.351   12.113   35.085   9.0122   25.203   5.9858   28.741   3.9512 -3.538305 7.172307 
1 1 1    9    6  -91 o   54.423   1.9536  121.538   8.6527  109.827   13.979  128.812   11.017   51.389   3.3555   55.930   2.4222 -4.541065 4.138414 
1 1 1    9    6  -90 o   26.075   3.2840   28.530   6.8256   38.566   10.504   21.197   8.9797   30.080   4.4155   22.008   5.1046 8.071703 6.749342 
1 1 1    9    6  -89 o   39.951   2.2946   65.684   7.4411   74.895   11.207   58.422   9.9510   42.470   3.2623   37.473   3.2911 4.996357 4.633966 
1 1 1    9    6  -88 o   37.861   2.4053   59.038   7.3849   55.420   11.073   61.937   9.9112   36.395   3.7876   38.638   3.1749 -2.242939 4.942233 
1 1 1    9    6  -87 o   27.217   3.2266   30.928   7.0195   19.335   10.459   40.428   9.4686   21.088   5.8697   31.039   3.8230 -9.951199 7.004887 
1 1 1    9    6  -86 o   22.572   3.9569   21.663   7.0152   30.739   10.499   14.342   9.4288   26.743   5.0001   18.457   5.6975 8.285606 7.580403 
1 1 1    9    6  -85 o  109.284   1.4784  487.685   13.170  478.277   18.856  496.645   18.402  108.113   2.1396  110.188   2.0488 -2.074547 2.962329 
1 1 1    9    6  -84 o   67.939   1.7449  188.703   9.6554  182.272   13.928  194.654   13.397   66.651   2.5683   68.912   2.3886 -2.260353 3.507369 
1 1 1    9    6  -83 o   22.512   4.6366   21.725   8.2252   26.419   12.819   18.440   10.724   24.639   6.3444   20.761   6.0000 3.878357 8.732227 
1 1 1    9    6  -82 o   19.052   4.9574   15.595   7.7717   26.013   11.400   6.5497   10.622   24.509   5.7977   15.392   5.9538 9.116231 8.310267 
1 1 1    9    6  -81 o   18.005   5.7987   13.177   9.6706   13.432   12.836   12.842   14.707   18.981   6.6815   19.345   7.1079 -0.3637257 9.755238 
1 1 1    9    6  -80 o   47.645   2.6942   93.202   10.421   94.096   13.804   92.018   15.890   47.742   3.5730   47.098   4.1823 0.6439705 5.500755 
1 1 1    9    6  -79 o  122.421   1.7394  611.807   17.358  602.329   21.797  628.240   28.700  121.410   2.2024  123.887   2.8420 -2.477684 3.595463 
1 1 1    9    6  -78 o  118.676   1.7807  574.935   17.226  582.609   21.152  559.824   29.684  119.420   2.1729  116.876   3.1185 2.544228 3.800858 
1 1 1    9    6  -77 o  110.560   1.7666  498.922   15.921  493.895   19.555  508.808   27.421  109.960   2.1817  111.455   3.0210 -1.494728 3.726444 
1 1 1    9    6  -76 o   45.549   2.6988   85.121   9.9753   86.366   12.223   82.639   17.263   45.808   3.2953   44.551   4.8307 1.257481 5.847652 
1 1 1    9    6  -75 o   15.416   5.5512   8.2490   8.9081   7.0592   10.990   10.528   15.210   15.835   6.0740   18.827   7.1640 -2.991255 9.392380 
1 1 1    9    6  -74 f   84.176   2.3341  289.614   16.000  285.751   18.212  302.678   33.493   83.574   2.6768   85.664   4.8158 -2.089294 5.509751 
1 1 1    9    6  -73 o   61.171   2.4606  153.091   12.244  153.350   13.561  151.947   28.487   61.196   2.7253   60.407   5.8588 0.7888794 6.461661 
1 1 1    9    6  -72 o   55.596   2.6513  126.571   11.981  128.988   13.268  115.895   27.885   56.098   2.9114   52.519   6.6633 3.579067 7.271585 
1 1 1    9    6  -71 o  117.636   1.9264  564.698   18.472  554.750   20.477  608.176   42.807  116.577   2.1548  121.705   4.3217 -5.127998 4.829153 
1 1 1    9    6  -70 o  111.796   1.9505  510.001   17.775  488.533   22.755  543.610   28.471  109.372   2.5523  115.286   3.0323 -5.913673 3.963436 
1 1 1    9    6  -69 o   19.630   6.2137   15.640   11.142  -2.2430   13.057   63.545   21.370   14.032   6.1062   38.629   7.0462 -24.59749 9.323826 
1 1 1    9    6  -68 o   25.863   5.2264   28.442   10.639   28.422   13.538   28.475   17.204   25.761   6.4594   25.991   7.6251 -0.2303009 9.993322 
1 1 1    9    6  -67 o   92.646   2.0560  350.220   15.527  318.272   19.589  404.221   25.468   88.240   2.7266   99.408   3.1469 -11.16872 4.163805 
1 1 1    9    6  -66 o  136.184   1.9350  756.596   21.480  752.574   27.672  762.696   34.073  135.779   2.5001  136.635   3.0592 -0.8567963 3.950913 
1 1 1    9    6  -65 o   88.857   2.0855  322.134   15.106  325.638   19.665  317.091   23.593   89.267   2.7056   88.030   3.2937 1.236702 4.262454 
1 1 1    9    6  -64 o  100.496   2.2784  412.101   18.665  406.664   26.375  417.555   26.417   99.719   3.2490  101.051   3.2112 -1.331795 4.568143 
1 1 1    9    6  -63 o  121.597   2.2276  603.261   22.080  594.959   31.523  611.257   30.936  120.648   3.2081  122.302   3.1057 -1.653397 4.465110 
1 1 1    9    6  -62 o   94.265   2.2994  362.544   17.668  388.933   27.340  343.619   23.153   97.512   3.4450   91.680   3.1026 5.831444 4.636122 
1 1 1    9    6  -61 o  103.591   1.6117  437.584   13.609  452.162   23.901  430.591   16.555  105.214   2.7892  102.747   1.9766 2.467102 3.418623 
1 1 1    9    6  -60 o  297.479   2.0422  3609.60   49.521  3617.37   71.515  3602.44   68.640  297.674   2.9473  297.077   2.8345 0.5967102 4.089101 
1 1 1    9    6  -59 o  134.440   1.4854  736.949   16.278  725.126   24.543  746.234   21.750  133.321   2.2584  135.263   1.9727 -1.941605 2.998629 
1 1 1    9    6  -58 o  158.228   1.4993  1020.81   19.337  1000.01   28.317  1038.99   26.471  156.570   2.2187  159.604   2.0346 -3.033585 3.010377 
1 1 1    9    6  -57 o   53.338   2.3753  116.292   10.301  120.397   13.189  109.870   16.497   54.227   2.9953   51.703   3.9440 2.524117 4.952459 
1 1 1    9    6  -56 o   69.357   1.5787  196.139   8.9254  209.184   14.365  187.936   11.391   71.563   2.4661   67.850   2.0620 3.712761 3.214595 
1 1 1    9    6  -55 o   55.282   1.7313  124.739   7.7919  117.833   12.789  128.815   9.8262   53.652   2.9354   56.157   2.1506 -2.504704 3.638917 
1 1 1    9    6  -54 o  269.526   1.8756  2962.39   41.207  2986.53   59.599  2940.28   57.037  270.543   2.7025  268.450   2.6065 2.092529 3.754640 
1 1 1    9    6  -53 o  291.047   1.9736  3454.51   46.824  3516.45   67.988  3398.63   64.581  293.553   2.8413  288.604   2.7451 4.948059 3.950768 
1 1 1    9    6  -52 o  189.168   1.5442  1458.99   23.812  1475.68   34.930  1444.50   32.547  190.209   2.2528  188.197   2.1216 2.012283 3.094575 
1 1 1    9    6  -51 o   81.355   1.4299  269.837   9.4825  242.388   14.109  292.454   12.806   77.057   2.2485   84.687   1.8551 -7.630547 2.915013 
1 1 1    9    6  -50 o   92.740   1.4395  350.646   10.882  349.543   17.172  351.385   14.067   92.574   2.2756   92.829   1.8590 -0.2547607 2.938385 
1 1 1    9    6  -49 o  193.918   1.7580  1533.29   27.790  1596.33   49.596  1504.44   33.551  197.778   3.0763  192.066   2.1430 5.712845 3.749156 
1 1 1    9    6  -48 o  175.589   1.6767  1257.08   23.998  1212.92   41.142  1279.86   29.545  172.412   2.9274  177.157   2.0460 -4.745041 3.571477 
1 1 1    9    6  -47 o   36.566   2.3138   54.751   6.8614   49.000   12.816   57.062   8.1237   34.307   4.7068   37.303   2.6897 -2.996063 5.421128 
1 1 1    9    6  -46 o   16.703   4.4232   11.805   6.1167   14.385   11.595   10.810   7.2001   19.225   6.3599   16.254   4.9717 2.970407 8.072552 
1 1 1    9    6  -45 o  133.700   1.3786  728.744   15.024  726.263   21.859  730.965   20.685  133.455   2.0094  133.890   1.8953 -0.4350433 2.762195 
1 1 1    9    6  -44 o   92.177   1.4526  346.388   10.915  352.672   15.317  339.905   15.557   92.998   2.0205   91.298   2.0904 1.700493 2.907317 
1 1 1    9    6  -43 o  244.467   1.8602  2436.83   37.070  2407.51   49.308  2474.96   56.218  242.952   2.4898  246.308   2.8000 -3.356094 3.746866 
1 1 1    9    6  -42 o  124.387   1.4516  630.761   14.719  613.617   20.038  650.850   21.691  122.672   2.0039  126.336   2.1063 -3.663895 2.907238 
1 1 1    9    6  -41 o  223.531   1.7878  2037.21   32.575  2085.33   43.859  1978.01   48.648  226.124   2.3795  220.207   2.7102 5.916702 3.606487 
1 1 1    9    6  -40 o  171.024   1.5899  1192.46   22.165  1169.43   29.233  1223.60   33.996  169.347   2.1177  173.212   2.4077 -3.865067 3.206533 
1 1 1    9    6  -39 o  246.399   2.0558  2475.62   41.291  2446.32   58.704  2504.31   58.089  244.878   2.9409  247.768   2.8762 -2.889984 4.113539 
1 1 1    9    6  -38 o  126.268   1.3716  649.949   14.117  677.054   20.776  626.699   19.242  128.860   1.9779  123.978   1.9040 4.882561 2.745429 
1 1 1    9    6  -37 o  140.209   1.5016  801.414   17.162  798.413   27.477  803.335   21.976  139.920   2.4091  140.366   1.9207 -0.4459229 3.081040 
1 1 1    9    6  -36 o   23.145   3.3507   22.311   6.1379   15.885   9.4018   27.084   8.1030   19.501   5.6126   25.446   4.0415 -5.945271 6.916281 
1 1 1    9    6  -35 f  201.727   1.5702  1658.96   25.819  1698.16   37.513  1623.68   35.591  204.070   2.2551  199.547   2.1880 4.522583 3.142119 
1 1 1    9    6  -34 f   47.812   1.8572   93.341   7.2244   92.728   10.773   93.842   9.7389   47.599   2.7886   47.904   2.5027 -0.3051071 3.747002 
1 1 1    9    6  -33 o   97.445   1.3807  387.081   10.967  400.029   16.175  376.064   14.921   99.052   2.0033   96.041   1.9059 3.011246 2.765091 
1 1 1    9    6  -32 o   74.804   1.4893  228.108   9.0810  230.494   13.448  226.108   12.312   75.153   2.1975   74.441   2.0310 0.7119751 2.992266 
1 1 1    9    6  -31 f  284.747   1.9306  3305.69   44.811  3258.19   63.211  3353.68   63.535  282.648   2.7435  286.762   2.7180 -4.113434 3.861958 
1 1 1    9    6  -30 o  148.547   1.4127  899.508   17.106  916.233   24.876  884.506   23.560  149.908   2.0357  147.292   1.9623 2.616608 2.827478 
1 1 1    9    6  -29 o  313.371   2.0697  4003.80   52.869  4057.34   75.980  3953.53   73.613  315.405   2.9553  311.348   2.9005 4.057129 4.140825 
1 1 1    9    6  -28 o  197.875   1.5608  1596.13   25.175  1612.98   36.380  1580.66   34.872  198.897   2.2439  196.896   2.1727 2.000656 3.123447 
1 1 1    9    6  -27 o  155.005   1.4274  979.410   18.035  997.141   26.370  963.828   24.721  156.389   2.0686  153.757   1.9724 2.632416 2.858227 
1 1 1    9    6  -26 o  285.070   1.9323  3313.00   44.902  3357.92   64.618  3271.07   62.440  286.956   2.7625  283.224   2.7046 3.732056 3.866004 
1 1 1    9    6  -25 o  450.369   2.9643  8271.82  108.824  8304.29  167.209  8247.95  143.335  451.070   4.5476  449.619   3.9109 1.450745 5.997928 
1 1 1    9    6  -24 o  209.559   1.7091  1790.19   29.194  1784.79   45.087  1794.10   38.310  209.214   2.6438  209.773   2.2404 -0.5583801 3.465392 
1 1 1    9    6  -23 o  357.675   2.6394  5216.42   76.954  5212.61  109.376  5220.16  108.292  357.464   3.7536  357.727   3.7137 -0.2622070 5.280293 
1 1 1    9    6  -22 o  345.145   2.3789  4856.88   66.928  4939.68  103.986  4798.31   87.448  347.992   3.6658  343.014   3.1275 4.977875 4.818659 
1 1 1    9    6  -21 o  303.511   2.3396  3755.73   57.882  3710.16   82.213  3800.52   81.508  301.614   3.3439  305.268   3.2755 -3.654938 4.680894 
1 1 1    9    6  -20 o  301.238   2.5440  3699.87   62.468  3778.18  101.987  3652.85   79.028  304.319   4.1113  299.284   3.2394 5.035309 5.234155 
1 1 1    9    6  -19 o  100.026   1.9260  407.872   15.704  446.244   34.141  397.576   17.686  104.513   4.0150   98.753   2.1971 5.760391 4.576791 
1 1 1    9    6  -18 o   54.265   2.4400  120.301   10.765  147.815   24.481  113.705   11.987   59.969   5.0551   52.733   2.7986 7.235897 5.778048 
1 1 1    9    6  -17 o  266.993   2.3174  2906.22   50.436  2862.55   79.186  2936.03   65.424  264.924   3.6668  268.334   2.9910 -3.410278 4.732017 
1 1 1    9    6  -16 o  115.041   1.7061  539.481   15.999  570.470   26.010  520.620   20.292  118.286   2.6976  113.007   2.2028 5.279343 3.482734 
1 1 1    9    6  -15 o  164.387   1.8131  1101.57   24.296  1160.98   39.622  1065.77   30.757  168.741   2.8806  161.685   2.3337 7.056290 3.707255 
1 1 1    9    6  -14 o  513.630   3.5931 10759.15  150.436 10840.39  262.414 10719.38  183.601  515.239   6.2480  512.600   4.3940 2.639038 7.638389 
1 1 1    9    6  -13 o   87.293   1.6463  310.613   11.715  297.964   20.302  316.926   14.343   85.435   2.9195   88.173   1.9956 -2.737450 3.536361 
1 1 1    9    6  -12 o  304.660   2.3278  3783.97   57.810  3806.75  100.723  3772.78   70.595  305.498   4.0447  304.191   2.8470 1.307709 4.946215 
1 1 1    9    6  -11 o   37.306   2.6738   57.033   8.0770   59.063   14.404   56.102   9.7549   37.747   4.7890   36.948   3.2727 0.7988625 5.800446 
1 1 1    9    6  -10 o  185.760   1.8921  1406.63   28.650  1422.94   64.519  1402.62   31.976  186.773   4.2378  185.492   2.1148 1.281845 4.736152 
1 1 1    9    6   -9 o  130.779   1.5821  697.154   16.865  721.378   29.803  685.743   20.456  133.017   2.7486  129.701   1.9348 3.316101 3.361323 
1 1 1    9    6   -8 o  158.833   1.6452  1028.34   21.301  1026.90   37.105  1029.05   26.015  158.702   2.8683  158.883   2.0087 -0.1808167 3.501657 
1 1 1    9    6   -7 o  250.111   2.0327  2550.05   41.442  2552.76   71.940  2548.71   50.700  250.199   3.5274  250.034   2.4875 0.1648560 4.316254 
1 1 1    9    6   -6 o  216.510   1.8656  1910.86   32.926  1835.20   55.669  1951.57   40.835  212.150   3.2191  218.796   2.2896 -6.646637 3.950295 
1 1 1    9    6   -5 f  209.077   1.6991  1781.86   28.958  1779.93   44.267  1783.31   38.287  208.947   2.5990  209.153   2.2457 -0.2060242 3.434805 
1 1 1    9    6   -4 o  216.993   1.8723  1919.38   33.117  1904.78   46.679  1934.17   46.990  216.150   2.6493  217.811   2.6466 -1.661118 3.744782 
1 1 1    9    6   -3 o  318.906   2.2316  4145.91   58.013  4165.69   88.969  4131.29   76.517  319.621   3.4148  318.318   2.9489 1.302795 4.511868 
1 1 1    9    6   -2 o  446.357   3.1735  8123.65  115.466  8038.23  161.978  8211.91  164.643  443.912   4.4763  448.680   4.5016 -4.768066 6.348397 
1 1 1    9    6   -1 o  195.151   1.9545  1552.44   31.092  1578.67   40.575  1515.13   48.390  196.782   2.5295  192.769   3.0795 4.013092 3.985226 
1 1 1    9    6    0 o  352.571   2.8569  5068.09   82.107  5254.20  108.899  4822.92  124.990  358.944   3.7219  343.854   4.4593 15.08981 5.808422 
1 1 1    9    6    1 o  490.935   3.7809  9829.03  151.305  9846.11  195.589  9803.58  238.768  491.265   4.8842  490.083   5.9768 1.181824 7.718655 
1 1 1    9    6    2 o  144.261   1.6232  848.301   19.088  872.933   27.322  824.815   26.678  146.332   2.2905  142.242   2.3009 4.090393 3.246599 
1 1 1    9    6    3 o  156.062   2.0350  992.830   25.888  1147.49   39.098  872.096   34.545  167.763   2.8591  146.253   2.8977 21.51085 4.070724 
1 1 1    9    6    4 o  322.547   2.2528  4241.16   59.232  4325.40   91.888  4181.27   77.476  325.688   3.4611  320.237   2.9680 5.451050 4.559428 
1 1 1    9    6    5 f  493.418   3.4677  9927.86  139.475  9880.09  196.551  9976.31  197.950  492.105   4.8998  494.494   4.9109 -2.389343 6.937221 
1 1 1    9    6    6 o  334.844   2.7553  4571.21   75.204  5010.81  127.178  4334.85   93.255  350.483   4.4515  326.039   3.5089 24.44379 5.668187 
1 1 1    9    6    7 o  182.816   1.9068  1362.39   28.415  1274.83   43.802  1426.01   37.338  176.822   3.0389  187.026   2.4491 -10.20352 3.902988 
1 1 1    9    6    8 o  587.841   4.0672 14094.17  194.890 14186.56  277.303 14003.98  273.959  589.549   5.7703  585.748   5.7377 3.801147 8.137430 
1 1 1    9    6    9 o  163.415   2.0560  1088.61   27.388  1123.98   39.610  1056.22   37.910  166.033   2.9267  160.951   2.8895 5.081421 4.112762 
1 1 1    9    6   10 o  403.373   2.6972  6633.80   88.687  6528.12  133.897  6716.40  118.377  400.061   4.1059  405.827   3.5784 -5.765076 5.446411 
1 1 1    9    6   11 o  615.055   4.2402 15430.88  212.587 15315.68  366.060 15489.50  261.135  612.253   7.3347  616.094   5.1997 -3.840881 8.990877 
1 1 1    9    6   12 o   79.206   1.6294  255.724   10.520  250.390   16.263  259.561   13.795   78.327   2.5506   79.766   2.1236 -1.439163 3.318914 
1 1 1    9    6   13 o  235.902   1.8223  2268.50   35.042  2255.84   53.478  2278.02   46.389  235.219   2.7891  236.383   2.4075 -1.164520 3.684448 
1 1 1    9    6   14 o  207.812   1.7026  1760.39   28.841  1774.08   44.441  1750.43   37.908  208.599   2.6136  207.213   2.2443 1.386261 3.444975 
1 1 1    9    6   15 o  164.176   1.5455  1098.69   20.684  1076.57   31.508  1115.44   27.418  162.501   2.3787  165.416   2.0334 -2.914108 3.129365 
1 1 1    9    6   16 o  127.660   1.4743  664.304   15.342  692.324   24.036  645.042   19.929  130.315   2.2628  125.791   1.9435 4.524300 2.982857 
1 1 1    9    6   17 o   97.444   1.5034  387.054   11.942  401.024   18.688  377.413   15.525   99.179   2.3115   96.219   1.9794 2.960472 3.043191 
1 1 1    9    6   18 o  432.872   3.0917  7640.95  109.093  7669.62  154.875  7612.72  153.694  433.571   4.3821  431.962   4.3649 1.609558 6.185115 
1 1 1    9    6   19 o  236.296   1.9647  2276.20   37.843  2252.57   53.448  2299.95   53.588  235.040   2.7897  237.500   2.7680 -2.460068 3.929910 
1 1 1    9    6   20 o  119.262   1.7206  579.807   16.727  557.558   26.679  594.217   21.471  116.935   2.7989  120.729   2.1818 -3.793526 3.548769 
1 1 1    9    6   21 o  141.692   1.7467  818.414   20.174  786.197   31.936  839.806   26.024  138.855   2.8215  143.524   2.2244 -4.668701 3.592883 
1 1 1    9    6   22 o  187.301   2.1242  1430.22   32.432  1438.49   65.585  1427.54   37.314  187.763   4.2851  187.117   2.4464 0.6461487 4.934215 
1 1 1    9    6   23 o  114.356   1.7079  533.092   15.921  562.740   36.889  526.306   17.649  117.385   3.8604  113.623   1.9056 3.762329 4.305126 
1 1 1    9    6   24 o  269.286   2.1363  2956.39   46.894  2895.04   80.206  2988.25   57.804  266.398   3.6935  270.712   2.6195 -4.314087 4.528098 
1 1 1    9    6   25 o  196.542   1.7771  1574.74   28.472  1594.37   49.970  1565.31   34.646  197.720   3.1004  195.942   2.1691 1.777756 3.783865 
1 1 1    9    6   26 o   71.850   1.6106  210.443   9.4330  212.345   15.068  209.217   12.097   72.118   2.5672   71.606   2.0747 0.5122070 3.300737 
1 1 1    9    6   27 o   20.703   4.2150   18.130   6.8712   18.635   11.633   17.859   8.5156   21.212   6.2825   20.512   5.1116 0.6998215 8.099247 
1 1 1    9    6   28 o  146.283   1.6160  872.332   19.269  888.725   27.847  857.272   26.691  147.636   2.3140  145.001   2.2582 2.634613 3.233212 
1 1 1    9    6   29 o  123.637   1.5841  623.150   15.965  614.346   23.018  631.310   22.161  122.747   2.3005  124.433   2.1848 -1.685715 3.172696 
1 1 1    9    6   30 o  228.785   1.9340  2134.00   36.069  2074.88   50.403  2196.04   51.637  225.559   2.7413  232.052   2.7299 -6.492905 3.868722 
1 1 1    9    6   31 f  108.911   1.5967  483.555   14.175  488.767   20.670  478.927   19.477  109.484   2.3161  108.378   2.2046 1.105400 3.197623 
1 1 1    9    6   32 o  121.323   1.5903  600.051   15.728  585.557   22.476  613.957   22.015  119.834   2.3010  122.708   2.2010 -2.874054 3.184144 
1 1 1    9    6   33 o   67.489   1.8257  185.834   10.034  169.480   14.679  200.182   13.749   64.401   2.8029   70.022   2.4123 -5.621681 3.698016 
1 1 1    9    6   34 f  344.375   2.5634  4836.58   71.960  4803.31  101.481  4870.23  102.054  343.081   3.6287  345.463   3.6240 -2.381927 5.128469 
1 1 1    9    6   35 f  121.844   1.5858  605.228   15.750  596.373   22.543  613.673   22.015  120.933   2.2868  122.677   2.2015 -1.743797 3.174314 
1 1 1    9    6   36 o  149.384   1.7846  909.820   21.731  861.857   34.347  941.834   28.061  145.355   2.8988  151.975   2.2652 -6.619675 3.678867 
1 1 1    9    6   37 o  140.393   1.9543  803.657   22.365  789.384   32.348  816.728   30.956  139.110   2.8527  141.506   2.6837 -2.395691 3.916646 
1 1 1    9    6   38 o   37.277   3.1118   57.088   9.3694   56.327   15.143   57.559   11.926   36.762   5.1983   37.338   3.9797 -0.5756760 6.546774 
1 1 1    9    6   39 o  176.570   1.8761  1271.17   27.003  1294.79   43.995  1256.90   34.204  178.147   3.0296  175.555   2.3902 2.592606 3.858956 
1 1 1    9    6   40 o  103.936   1.7366  440.435   14.713  465.695   24.591  426.350   18.362  106.808   2.8270  102.250   2.2031 4.557976 3.584039 
1 1 1    9    6   41 o  144.112   1.7748  846.756   20.849  891.052   34.583  821.464   26.132  147.791   2.8707  141.928   2.2588 5.863220 3.652774 
1 1 1    9    6   42 o   62.008   2.1485  156.983   10.843  156.828   15.575  157.129   15.106   61.920   3.0956   61.986   2.9985 -0.6652069E-01 4.309704 
1 1 1    9    6   43 o   51.716   3.5094  109.668   14.707  104.597   19.398  116.522   22.554   50.366   4.7821   53.122   5.2783 -2.756237 7.122380 
1 1 1    9    6   44 o  206.251   2.7176  1735.35   45.689  1753.11   57.111  1703.77   76.150  207.253   3.3805  204.197   4.5749 3.055832 5.688396 
1 1 1    9    6   45 o   62.073   2.7253  157.488   13.756  153.780   21.075  160.242   18.157   61.210   4.2503   62.551   3.5760 -1.341129 5.554508 
1 1 1    9    6   46 o  178.334   1.9410  1296.83   28.216  1240.15   46.204  1330.54   35.632  174.318   3.2516  180.613   2.4202 -6.294907 4.053448 
1 1 1    9    6   47 o  286.000   2.4749  3336.44   57.698  3459.50   95.636  3266.01   72.348  291.034   4.0313  282.897   3.1374 8.137878 5.108252 
1 1 1    9    6   48 o   64.389   1.9050  169.207   9.9875  162.529   15.858  173.597   12.858   63.033   3.0958   65.193   2.4238 -2.160160 3.931752 
1 1 1    9    6   49 o  180.823   1.7686  1333.21   26.068  1358.52   38.569  1311.92   35.370  182.487   2.5928  179.340   2.4194 3.147186 3.546335 
1 1 1    9    6   50 o  128.201   1.6441  670.118   17.181  684.423   26.027  659.071   22.872  129.531   2.4650  127.120   2.2073 2.410896 3.308826 
1 1 1    9    6   51 o   37.487   2.6976   57.630   8.1880   66.569   13.714   52.678   10.207   40.139   4.2562   35.744   3.5500 4.394962 5.542366 
1 1 1    9    6   52 o   47.561   2.2976   92.480   8.8812   94.378   14.674   91.382   11.156   47.922   3.7873   47.232   2.9118 0.6896057 4.777305 
1 1 1    9    6   53 o   32.253   3.2336   42.889   8.3869   33.873   15.505   46.618   9.9716   28.173   6.8246   33.583   3.7040 -5.410494 7.764991 
1 1 1    9    6   54 o   45.696   2.4911   85.439   9.2441   84.896   16.631   85.681   11.120   45.340   4.5617   45.720   3.0004 -0.3801842 5.459972 
1 1 1    9    6   55 o  250.299   2.2604  2555.51   46.119  2554.57   74.059  2556.10   58.943  250.092   3.6328  250.264   2.8894 -0.1713562 4.641711 
1 1 1    9    6   56 o   75.561   1.9370  233.000   11.921  254.952   21.482  223.232   14.330   78.948   3.3456   73.935   2.3808 5.013107 4.106266 
1 1 1    9    6   57 o  161.685   1.8791  1066.12   24.766  1058.00   40.437  1070.99   31.329  160.986   3.0814  162.025   2.3721 -1.038513 3.888695 
1 1 1    9    6   58 o  110.928   2.5721  502.112   23.258  503.187   40.181  501.570   28.522  110.828   4.4567  110.790   3.1614 0.3800201E-01 5.464172 
1 1 1    9    6   59 o  141.553   1.7395  817.121   20.072  816.414   30.336  817.672   26.769  141.441   2.6311  141.570   2.3197 -0.1290741 3.507670 
1 1 1    9    6   60 o   49.510   2.6182  100.313   10.529   91.306   18.196  104.847   12.910   46.986   4.8190   50.575   3.1471 -3.589405 5.755550 
1 1 1    9    6   61 o  241.008   2.0666  2369.29   40.599  2356.68   58.349  2381.13   56.525  240.262   2.9793  241.519   2.8712 -1.257217 4.137592 
1 1 1    9    6   62 o  201.611   1.8863  1657.84   30.999  1659.09   45.022  1656.70   42.746  201.609   2.7395  201.478   2.6027 0.1308746 3.778787 
1 1 1    9    6   63 o   83.980   1.7701  287.633   12.117  282.210   18.927  291.400   15.774   83.097   2.7982   84.478   2.2928 -1.381447 3.617559 
1 1 1    9    6   64 o   67.934   1.8776  188.386   10.387  175.937   14.862  200.275   14.523   65.586   2.7862   70.002   2.5495 -4.415863 3.776604 
1 1 1    9    6   65 o   32.513   2.6564   43.443   6.9790   39.370   11.898   45.580   8.6172   30.612   4.9357   33.246   3.2200 -2.634253 5.893193 
1 1 1    9    6   66 o   35.267   2.5392   51.036   7.2508   56.075   12.060   48.183   9.0738   36.791   4.0905   34.179   3.2977 2.612309 5.254235 
1 1 1    9    6   67 o   93.330   1.6403  355.272   12.479  356.722   17.178  353.651   18.159   93.491   2.2541   93.049   2.3961 0.4420319 3.289704 
1 1 1    9    6   68 o  133.836   1.6443  730.597   17.938  730.614   23.317  730.572   28.080  133.803   2.1378  133.762   2.5753 0.4187012E-01 3.346980 
1 1 1    9    6   69 o   96.886   2.0062  383.037   15.844  386.332   17.756  370.159   35.103   97.288   2.2390   94.906   4.5508 2.381889 5.071733 
1 1 1    9    6   70 o   53.114   2.7620  115.561   11.917  123.843   13.349   83.033   26.454   54.967   2.9905   44.145   7.6272 10.82172 8.192490 
1 1 1    9    6   71 o   88.779   1.8881  321.617   13.664  311.081   16.607  343.699   24.042   87.254   2.3370   91.617   3.2243 -4.362511 3.982195 
1 1 1    9    6   72 o  137.465   1.7526  771.006   19.638  760.534   23.955  792.471   34.295  136.491   2.1530  139.218   3.0220 -2.727127 3.710529 
1 1 1    9    6   73 o   88.744   1.8668  321.393   13.504  316.666   16.456  331.142   23.630   88.030   2.2952   89.908   3.2295 -1.877991 3.962070 
1 1 1    9    6   74 f   91.122   1.8458  338.862   13.710  335.383   16.802  345.794   23.717   90.594   2.2771   91.878   3.1715 -1.284332 3.904312 
1 1 1    9    6   75 o  140.326   1.9253  803.787   22.023  772.257   27.961  855.310   35.744  137.476   2.4951  144.592   3.0326 -7.116241 3.927150 
1 1 1    9    6   76 o   72.852   2.0326  216.875   12.059  215.372   14.693  219.975   21.105   72.553   2.4881   73.181   3.5484 -0.6281052 4.333846 
1 1 1    9    6   77 o   29.539   4.0404   36.482   9.4741   24.943   11.462   61.369   16.832   24.074   5.8900   38.145   5.5783 -14.07075 8.112319 
1 1 1    9    6   78 o   43.380   3.1785   77.490   11.162   80.535   12.627   66.611   23.867   44.176   3.5361   39.213   7.7417 4.963455 8.511044 
1 1 1    9    6   79 o   97.967   2.0402  392.040   16.292  390.244   18.304  398.892   35.748   97.713   2.2980   98.308   4.4727 -0.5943680 5.028520 
1 1 1    9    6   80 o  106.103   1.9117  459.808   16.534  455.350   19.615  470.749   30.731  105.540   2.2800  107.030   3.5272 -1.489922 4.199933 
1 1 1    9    6   81 o  112.621   1.8256  518.024   16.760  523.543   20.723  507.591   28.494  113.158   2.2467  111.209   3.1464 1.949471 3.866184 
1 1 1    9    6   82 o   66.340   2.0651  180.067   11.154  171.638   14.334  193.008   17.759   64.675   2.7249   68.507   3.1890 -3.831993 4.194625 
1 1 1    9    6   83 o   61.272   2.0791  153.675   10.369  146.142   13.253  165.565   16.651   59.656   2.7326   63.413   3.2318 -3.757019 4.232260 
1 1 1    9    6   84 o   67.107   1.9507  184.253   10.659  172.007   13.657  203.340   17.051   64.740   2.5932   70.324   2.9812 -5.583832 3.951200 
1 1 1    9    6   85 o   87.518   1.8593  313.111   13.264  304.376   18.334  322.705   19.215   86.124   2.6145   88.671   2.6614 -2.546753 3.730793 
1 1 1    9    6   86 o   37.990   3.0667   59.721   9.4161   56.243   13.247   63.273   13.387   36.528   4.5471   38.838   4.3005 -2.309994 6.258640 
1 1 1    9    6   87 o  129.120   1.7235  681.581   18.140  688.416   25.629  674.721   25.679  129.572   2.4266  128.267   2.4560 1.304733 3.452598 
1 1 1    9    6   88 o   43.693   2.4294   78.564   8.6184   74.001   11.299   84.913   13.328   42.226   3.3090   45.165   3.6512 -2.939285 4.927544 
1 1 1    9    6   89 o   62.975   1.9117  162.510   9.8020  161.555   12.981  163.777   14.951   62.659   2.5468   62.996   2.9195 -0.3366356 3.874234 
1 1 1    9    6   90 o   77.263   1.7461  244.289   10.997  235.969   14.464  255.689   16.930   75.777   2.3445   78.797   2.6395 -3.020248 3.530395 
1 1 1    9    6   91 o   10.074   4.4745  -2.3300   7.3495  -4.8770   9.6863   1.1259   11.283   11.036   4.9996   13.678   5.8090 -2.641869 7.664191 
1 1 1    9    6   92 o   56.458   2.0057  130.897   9.2159  134.091   12.270  126.763   13.960   56.985   2.6486   55.266   3.1113 1.719063 4.085996 
1 1 1    9    6   93 o   15.624   5.0406   10.195   7.3051   16.913   9.7680   1.6682   11.004   19.604   5.7440   13.635   5.7611 5.969506 8.135382 
1 1 1    9    6   94 o   35.388   2.7999   52.075   8.0111   56.180   10.802   47.059   11.942   36.511   3.6797   33.092   4.5473 3.418266 5.849613 
1 1 1    9    6   95 o   38.966   2.7778   63.106   8.7650   56.622   12.312   69.770   12.481   36.433   4.2239   40.646   3.8114 -4.212395 5.689305 
1 1 1    9    6   96 o   15.955   5.2554   10.674   7.9202   5.0537   11.181   16.334   11.221   14.734   5.9747   19.331   6.2482 -4.596972 8.645025 
1 1 1    9    6   97 o   21.676   4.3327   20.573   7.3877   13.405   9.6402   30.772   11.500   17.665   5.7970   26.171   5.5621 -8.506004 8.033765 
1 1 1    9    6   98 o   63.156   1.8581  164.017   9.5553  145.681   12.371  191.131   15.044   59.279   2.5663   67.843   2.7259 -8.563255 3.743806 
1 1 1    9    6   99 o   24.823   3.8002   26.529   7.4450   21.442   9.6947   33.842   11.623   21.744   5.4741   27.460   5.3851 -5.715900 7.678891 
1 1 1    9    6  100 o   40.872   2.4690   69.385   8.1876   73.597   10.731   63.518   12.667   41.849   3.1691   38.468   4.1028 3.380642 5.184218 
1 1 1    9    6  101 o   63.495   1.8860  166.022   9.7506  168.808   12.706  162.030   15.208   63.803   2.4475   62.236   3.0067 1.566757 3.876902 
1 1 1    9    6  102 o   34.764   2.8359   50.688   7.9666   47.732   10.323   55.043   12.528   33.326   3.8719   35.552   4.4178 -2.226315 5.874422 
1 1 1    9    6  103 f   17.517   5.0629   13.834   7.6352   11.534   9.4400   18.184   12.984   16.504   5.7356   19.961   6.7325 -3.456203 8.844362 
1 1 1    9    6  104 o   34.945   3.1861   51.786   8.9760   57.358   11.627   43.566   14.122   36.408   3.9825   30.659   5.8644 5.748627 7.088830 
1 1 1    9    6  105 o   19.145   5.2520   16.923   8.4418   16.587   10.752   17.463   13.631   18.924   6.1161   19.524   6.8843 -0.6002617 9.208681 
1 1 1    9    6  106 o   30.497   3.4271   39.995   8.3723   37.677   11.440   42.667   12.285   28.742   5.0681   30.602   5.1046 -1.859766 7.193206 
1 1 1    9    6  107 o   27.591   3.5153   33.016   7.7269   41.479   10.205   21.643   11.830   30.603   4.2014   21.051   6.3593 9.552132 7.621884 
1 1 1    9    6  108 o   9.9645   4.4451  -1.6795   7.3341  -4.8737   9.4677   3.1132   11.597   10.497   4.8261   13.726   5.8612 -3.228795 7.592433 
1 1 1    9    6  109 o   38.952   2.8899   64.544   9.1104   61.596   10.953   71.163   16.411   37.608   3.6175   39.114   5.2821 -1.506714 6.402082 
1 1 1    9    6  110 o   41.321   2.7882   72.546   9.3366   75.683   11.303   65.806   16.566   41.844   3.3415   37.138   5.6501 4.705288 6.564216 
1 1 1    9    6  111 o   35.181   3.0049   53.197   8.5349   53.935   11.123   52.139   13.310   34.757   3.9987   33.344   5.0551 1.413151 6.445478 
1 1 1    9    6  112 o   28.288   3.6672   35.545   8.2572   30.439   10.709   43.033   12.968   24.983   5.4149   29.712   5.5588 -4.728073 7.760190 
1 1 1    9    6  113 o   12.191   5.0075   4.1542   7.9778   8.7135   10.409  -2.3374   12.420   14.779   5.8413   12.357   5.6227 2.422016 8.107768 
1 1 1    9    6  114 o   32.688   3.6590   47.552   9.5827   40.289   11.431   64.728   17.577   29.046   5.0087   35.566   6.2931 -6.520430 8.042974 
1 1 1    9    6  115 o   20.337   5.6466   20.967   9.6923   20.142   10.688   24.788   22.993   19.684   6.0643   20.496   8.4684 -0.8126678 10.41584 
1 1 1    9    6  116 o   24.915   4.7779   29.648   9.3508   32.122   11.106   23.626   17.329   25.340   5.5324   20.189   7.6552 5.151043 9.445105 
1 1 1    9    6  117 o   41.324   3.0217   74.185   10.108   69.657   12.060   84.879   18.534   39.337   3.8085   41.269   5.6581 -1.931740 6.820468 
1 1 1    9    6  118 o   23.382   5.5518   27.743   10.423   31.795   13.045   20.590   17.333   24.185   6.4846   19.086   7.5396 5.098957 9.944688 
1 1 1    9    6  119 o   22.721   6.3750   28.095   12.285   23.260   17.594   32.696   17.161   19.777   7.6589   22.990   7.7400 -3.213211 10.88883 
1 1 1    9    6  120 o   24.128   6.9931   33.523   14.548   33.081   17.589   34.482   25.888   22.882   7.8343   21.740   8.9843 1.141977 11.92030 
1 1 1    9    6  121 o   29.227   5.5405   43.228   12.717   54.509   18.215   32.500   17.763   30.571   7.3916   22.548   7.8657 8.023497 10.79369 
1 1 1    9    6  122 o   14.147   5.9890   6.8247   11.929   20.676   17.150  -6.1584   16.604   18.764   7.4716   12.900   6.0815 5.863873 9.633745 
1 1 1    9    6  123 o   13.899   5.9372   6.1562   11.907   9.0727   16.718   3.1535   16.963   15.688   6.8663   14.526   6.5947 1.161170 9.520302 
1 1 1    9    6  124 o   13.678   6.0346   3.9643   13.150   2.5562   21.681   4.7838   16.540   15.441   7.1709   14.746   6.6194 0.6957979 9.758960 
1 1 1    9    6  125 o   11.422   5.3240  -4.7747   12.127 -31.9990   17.032   23.216   17.270   10.154   5.0669   19.464   7.5742 -9.310117 9.112700 
1 1 1    9    7 -123 o   21.537   7.0456   27.678   14.245   45.342   21.498   13.850   19.020   25.230   8.6606   17.043   7.3936 8.186338 11.38732 
1 1 1    9    7 -122 o   10.951   5.1500  -6.2658   11.775 -16.0325   16.455   3.9857   16.858   11.465   5.5713   14.629   6.6144 -3.163271 8.648103 
1 1 1    9    7 -121 o   10.816   5.0476  -4.9460   10.953  -8.2802   12.249   8.3628   24.472   10.813   5.1348   16.662   7.6961 -5.849169 9.251801 
1 1 1    9    7 -120 o   17.482   6.4697   16.578   12.222   20.151   16.992   12.749   17.592   18.552   7.4206   16.672   7.1709 1.880047 10.31928 
1 1 1    9    7 -119 o   11.597   5.3389  -2.9500   11.638   13.878   15.999 -21.8625   16.961   16.860   7.0235   11.079   5.4412 5.781223 8.884544 
1 1 1    9    7 -118 o   10.519   5.0216  -9.8872   12.033   2.1352   16.657 -23.0061   17.400   14.380   6.5308   11.153   5.4841 3.226601 8.528018 
1 1 1    9    7 -117 o   20.606   5.9423   22.519   10.529   34.665   13.168   0.9867   17.532   25.286   6.3875   14.459   6.6179 10.82661 9.197690 
1 1 1    9    7 -116 o   18.804   5.7237   18.353   9.5580   35.130   11.392 -21.5316   17.565   26.451   5.4645   11.429   5.5975 15.02193 7.822575 
1 1 1    9    7 -115 o   8.3922   4.0779 -12.2512   8.8161  -4.5603   10.379 -32.1705   16.704   10.747   4.9807   10.116   5.0431 0.6305389 7.088027 
1 1 1    9    7 -114 o   14.658   5.5564   9.5456   9.1281   13.893   10.793  -1.3728   17.105   16.705   6.0969   14.075   6.4770 2.629374 8.895149 
1 1 1    9    7 -113 o   19.794   5.5003   19.768   9.1925   23.742   10.810   9.3850   17.472   21.368   5.9744   16.398   7.1000 4.970877 9.279140 
1 1 1    9    7 -112 o   17.763   5.6113   15.812   9.0904   15.074   10.829   17.573   16.729   17.336   6.1339   18.494   7.3743 -1.157352 9.591959 
1 1 1    9    7 -111 o   14.810   5.6775   9.3769   9.5989   5.3767   10.492   29.920   23.777   13.593   5.6769   21.815   8.7600 -8.222525 10.43858 
1 1 1    9    7 -110 f   9.2004   4.3442  -7.2885   8.5338  -0.1419   10.286 -23.0755   15.287   11.911   5.2918   10.523   5.1674 1.388573 7.396328 
1 1 1    9    7 -109 o   27.124   4.1707   33.398   8.9267   32.794   10.555   34.916   16.729   26.224   5.1214   24.919   7.5698 1.305300 9.139521 
1 1 1    9    7 -108 o   33.169   3.5005   48.096   9.3219   42.957   11.049   60.788   17.364   30.632   4.5641   34.912   6.3348 -4.279926 7.807712 
1 1 1    9    7 -107 o   29.206   3.3976   37.104   7.9379   34.176   10.381   41.226   12.317   27.159   4.8680   29.570   5.3050 -2.410944 7.200050 
1 1 1    9    7 -106 o   20.179   5.0688   19.180   8.3255   11.419   11.753   26.998   11.795   16.503   6.2933   23.390   6.1178 -6.886532 8.776853 
1 1 1    9    7 -105 o   27.184   3.8497   32.515   8.2920   35.985   10.428   26.549   13.674   28.135   4.7135   22.923   6.8171 5.212564 8.287911 
1 1 1    9    7 -104 o   36.378   3.1640   56.430   9.2889   60.262   10.920   46.397   17.670   37.344   3.6330   30.267   7.2561 7.077631 8.114748 
1 1 1    9    7 -103 o   18.542   4.7281   15.710   7.1673   19.181   10.098   12.187   10.174   20.148   5.8222   16.768   5.9445 3.380520 8.320764 
1 1 1    9    7 -102 o   22.477   4.0771   22.316   7.1951   13.770   10.019   31.417   10.339   17.549   5.9142   26.320   5.0017 -8.770803 7.745640 
1 1 1    9    7 -101 o   51.088   1.9791  107.854   8.2261  114.524   12.110  102.140   11.209   52.265   2.8532   49.378   2.7964 2.887512 3.995023 
1 1 1    9    7 -100 o   11.598   4.6488   3.3479   6.6834   10.021   9.7740  -2.5122   9.1593   15.898   5.8020   11.093   4.9569 4.804801 7.631104 
1 1 1    9    7  -99 o   11.815   4.6669   3.8234   6.6400   2.5405   9.6382   4.9824   9.1607   12.956   5.4280   13.605   5.4462 -0.6494675 7.689247 
1 1 1    9    7  -98 o   8.5799   3.9877  -5.4138   6.7254   2.4559   9.9687 -11.9882   9.1115   13.128   5.5117   8.9823   4.3097 4.146188 6.996578 
1 1 1    9    7  -97 o   40.770   2.3316   68.906   7.7166   60.024   11.413   76.384   10.473   37.525   3.7828   42.692   3.0291 -5.166695 4.846173 
1 1 1    9    7  -96 o   18.036   4.6244   14.467   6.8304   5.9162   9.8380   22.425   9.4907   14.350   5.6767   22.290   5.3012 -7.939044 7.767101 
1 1 1    9    7  -95 o   58.744   1.8003  141.839   8.6105  149.823   12.701  135.050   11.713   60.106   2.5985   57.089   2.5232 3.017376 3.621978 
1 1 1    9    7  -94 o   15.667   4.7713   10.620   6.6408   15.807   9.9633   6.4742   8.9080   18.901   5.8605   14.225   5.4653 4.676513 8.013435 
1 1 1    9    7  -93 f   13.737   4.8171   7.3141   6.6672  -0.3577   10.025   13.398   8.9275   12.391   5.3717   17.589   5.5614 -5.197480 7.732031 
1 1 1    9    7  -92 o   50.964   1.9627  106.805   8.1384   93.095   11.928  118.746   11.132   47.255   3.1140   53.581   2.5562 -6.325901 4.028748 
1 1 1    9    7  -91 o   35.525   2.7295   52.427   7.8435   41.751   12.511   59.340   10.068   30.915   5.1452   37.645   3.3147 -6.730057 6.120504 
1 1 1    9    7  -90 o   7.6833   3.7407 -13.0155   7.5161 -13.6194   13.902 -12.7661   8.9345   11.826   5.5721   8.8031   4.2351 3.023255 6.998909 
1 1 1    9    7  -89 o   46.122   2.4270   87.745   9.0927   91.543   16.829   86.180   10.806   46.457   4.5002   45.586   2.9233 0.8714638 5.366381 
1 1 1    9    7  -88 o   15.780   5.0396   10.385   7.3154  -0.8677   11.849   17.315   9.2992   13.417   5.8281   19.865   5.5367 -6.447261 8.038699 
1 1 1    9    7  -87 o   59.120   1.9682  143.353   9.4719  147.755   15.197  140.557   12.112   59.738   3.1318   58.416   2.5498 1.322140 4.038523 
1 1 1    9    7  -86 o   41.986   2.3187   72.547   7.9048   88.153   11.689   59.395   10.730   46.124   3.1275   37.725   3.5304 8.398693 4.716442 
1 1 1    9    7  -85 o   94.918   1.6570  368.356   12.820  391.769   20.479  353.269   16.440   97.637   2.5754   92.848   2.1721 4.788612 3.369114 
1 1 1    9    7  -84 o   36.981   2.9739   56.609   8.8892   51.958   13.382   60.281   11.892   34.976   4.8218   37.967   3.8978 -2.990582 6.200183 
1 1 1    9    7  -83 o  105.883   1.7125  458.237   14.781  462.810   21.608  454.215   20.263  106.241   2.4951  105.283   2.3610 0.9580612 3.435104 
1 1 1    9    7  -82 f   56.188   2.0333  129.314   9.2972  114.555   12.742  146.118   13.596   52.726   2.9767   59.602   2.8063 -6.876160 4.091036 
1 1 1    9    7  -81 o  105.780   1.6186  457.028   13.956  467.432   19.239  445.472   20.277  106.879   2.2082  104.304   2.3848 2.575264 3.250188 
1 1 1    9    7  -80 f   51.650   2.3775  109.422   9.9830  106.277   15.121  111.852   13.291   50.676   3.6858   52.100   3.1443 -1.424221 4.844761 
1 1 1    9    7  -79 o   45.120   2.5158   83.597   9.2162   86.288   12.987   80.866   13.081   45.683   3.5144   44.188   3.6646 1.495052 5.077467 
1 1 1    9    7  -78 o   13.003   5.2743   2.9883   8.7159   2.8307   12.694   3.1288   11.989   15.153   6.2793   14.880   6.1281 0.2724781 8.773960 
1 1 1    9    7  -77 f   75.255   2.1076  231.623   12.916  235.087   19.300  228.813   17.383   75.659   3.1362   74.689   2.8604 0.9703217 4.244753 
1 1 1    9    7  -76 o   30.418   3.6562   38.526   8.8842   30.265   12.472   47.037   12.659   26.488   5.9248   33.435   4.7806 -6.947701 7.612923 
1 1 1    9    7  -75 o   69.206   1.9325  195.733   10.891  202.299   14.759  187.883   16.137   70.284   2.5805   67.682   2.9319 2.601784 3.905807 
1 1 1    9    7  -74 o   73.065   1.9703  218.153   11.724  205.094   14.992  238.713   18.811   70.773   2.6031   76.301   3.0305 -5.527893 3.994985 
1 1 1    9    7  -73 o   67.035   2.0450  183.668   11.162  193.521   14.364  168.650   17.734   68.756   2.5673   64.068   3.4079 4.687889 4.266707 
1 1 1    9    7  -72 o   42.344   2.6220   73.571   9.0057   61.538   12.058   88.748   13.543   38.540   3.8915   46.396   3.6092 -7.856148 5.307547 
1 1 1    9    7  -71 o   44.357   2.6867   80.719   9.6689   82.478   12.352   77.937   15.537   44.752   3.4119   43.332   4.4624 1.420105 5.617247 
1 1 1    9    7  -70 o   70.491   1.8541  202.928   10.645  213.540   14.518  190.589   15.654   72.257   2.4685   68.221   2.8210 4.035797 3.748512 
1 1 1    9    7  -69 o   57.424   2.0951  134.795   9.7906  134.849   13.351  134.731   14.401   57.363   2.8643   57.312   3.0940 0.5121613E-01 4.216248 
1 1 1    9    7  -68 o  111.622   1.6193  508.279   14.733  525.751   19.947  487.305   21.855  113.484   2.1563  109.229   2.4546 4.254280 3.267264 
1 1 1    9    7  -67 o  238.606   1.9016  2323.21   36.986  2317.34   49.146  2330.89   56.167  238.194   2.5312  238.814   2.8853 -0.6199341 3.838178 
1 1 1    9    7  -66 f  150.463   1.6303  923.471   19.995  929.266   26.855  916.262   29.954  150.885   2.1835  149.796   2.4531 1.088470 3.284070 
1 1 1    9    7  -65 o  143.826   1.7343  843.849   20.333  841.173   25.266  848.766   34.251  143.563   2.1590  144.128   2.9154 -0.5651703 3.627783 
1 1 1    9    7  -64 o   65.985   1.6909  177.717   9.0875  184.295   14.329  173.292   11.753   67.128   2.6237   65.123   2.2173 2.005081 3.435183 
1 1 1    9    7  -63 o   64.590   1.7163  170.286   9.0283  171.079   13.936  169.713   11.851   64.673   2.6491   64.445   2.2595 0.2279510 3.481871 
1 1 1    9    7  -62 o  166.150   1.7306  1126.00   23.439  1134.66   29.958  1112.35   37.637  166.747   2.2040  165.037   2.7977 1.710159 3.561549 
1 1 1    9    7  -61 o   60.341   1.7174  148.625   8.4386  154.618   14.032  145.229   10.562   61.470   2.8079   59.619   2.1769 1.850918 3.552894 
1 1 1    9    7  -60 o   85.878   1.5102  300.746   10.572  289.125   16.540  308.773   13.747   84.134   2.4142   87.002   1.9384 -2.867889 3.096109 
1 1 1    9    7  -59 o   61.940   1.8624  156.626   9.3928  146.716   14.676  163.502   12.225   59.863   3.0172   63.254   2.3751 -3.390812 3.839874 
1 1 1    9    7  -58 o  233.172   1.8797  2217.55   35.727  2138.68   55.144  2274.60   46.902  228.866   2.9558  236.094   2.4371 -7.228058 3.830971 
1 1 1    9    7  -57 o  165.475   1.7788  1116.71   23.994  1117.30   44.794  1116.47   28.414  165.391   3.3225  165.437   2.1070 -0.4550171E-01 3.934310 
1 1 1    9    7  -56 o  216.300   1.9770  1908.28   34.858  1816.56   62.006  1950.66   42.149  210.856   3.6075  218.654   2.3648 -7.797882 4.313539 
1 1 1    9    7  -55 o   47.443   2.7903   92.190   10.743   63.969   23.458   99.680   12.085   38.736   7.7003   49.319   3.0206 -10.58297 8.271525 
1 1 1    9    7  -54 o   77.361   2.3364  244.387   14.716  225.886   25.131  254.042   18.155   74.211   4.1712   78.841   2.8295 -4.629906 5.040310 
1 1 1    9    7  -53 o   70.990   1.8899  205.676   10.926  212.767   23.547  203.730   12.335   72.037   4.0260   70.640   2.1446 1.397011 4.561615 
1 1 1    9    7  -52 o  160.494   1.4900  1050.24   19.494  1033.33   28.263  1065.58   26.922  159.162   2.1784  161.635   2.0433 -2.472382 2.986741 
1 1 1    9    7  -51 o   46.648   2.0108   88.914   7.6280   82.770   12.604   92.465   9.5822   44.886   3.4717   47.542   2.4812 -2.655697 4.267193 
1 1 1    9    7  -50 o   68.333   1.6148  190.392   8.9947  188.792   14.188  191.467   11.631   67.975   2.5651   68.484   2.0859 -0.5090942 3.306160 
1 1 1    9    7  -49 o  142.126   1.6280  823.636   18.861  811.574   34.485  828.784   22.529  141.012   3.0001  142.557   1.9387 -1.545883 3.572035 
1 1 1    9    7  -48 o  158.499   1.5398  1024.28   19.894  1000.66   30.608  1041.56   26.177  156.620   2.3974  159.810   2.0095 -3.189926 3.128212 
1 1 1    9    7  -47 o  216.372   1.6484  1908.90   29.073  1885.17   41.604  1931.54   40.644  214.976   2.3742  217.610   2.2913 -2.634308 3.299511 
1 1 1    9    7  -46 o  142.516   1.5553  828.106   18.068  818.475   24.147  840.358   27.235  141.665   2.0911  143.535   2.3278 -1.870331 3.129075 
1 1 1    9    7  -45 o  189.657   1.6720  1466.62   25.849  1471.38   34.558  1460.58   38.945  189.935   2.2321  189.217   2.5250 0.7172394 3.370114 
1 1 1    9    7  -44 o  153.206   1.5668  956.986   19.567  945.647   26.031  971.716   29.670  152.275   2.0971  154.347   2.3582 -2.071976 3.155779 
1 1 1    9    7  -43 o  144.871   1.4226  855.641   16.800  843.241   24.432  866.763   23.139  143.795   2.0844  145.792   1.9470 -1.997284 2.852280 
1 1 1    9    7  -42 o  105.351   1.4016  452.480   12.037  425.629   17.688  475.637   16.427  102.160   2.1240  108.003   1.8659 -5.842346 2.827185 
1 1 1    9    7  -41 o  186.269   1.6128  1414.61   24.488  1387.59   37.391  1434.90   32.405  184.438   2.4870  187.576   2.1193 -3.138245 3.267534 
1 1 1    9    7  -40 o   56.179   1.7773  128.816   8.1290  135.525   13.356  124.868   10.245   57.563   2.8552   55.285   2.2783 2.278015 3.652804 
1 1 1    9    7  -39 o   65.697   1.7453  176.105   9.3384  184.848   16.903  172.264   11.203   67.233   3.0925   64.959   2.1186 2.273926 3.748597 
1 1 1    9    7  -38 o  103.739   1.6859  438.780   14.257  451.835   23.598  431.276   17.891  105.204   2.7541  102.837   2.1342 2.366776 3.484217 
1 1 1    9    7  -37 o  264.172   2.3026  2846.18   49.585  2753.13   77.105  2911.80   64.750  259.692   3.6424  267.143   2.9735 -7.450623 4.701959 
1 1 1    9    7  -36 o   63.323   1.8451  163.633   9.5136  160.006   14.602  166.309   12.541   62.560   2.8710   63.811   2.4153 -1.250744 3.751858 
1 1 1    9    7  -35 o   64.132   1.7374  167.816   9.0743  172.123   13.036  163.766   12.640   64.916   2.4680   63.319   2.4535 1.597054 3.480021 
1 1 1    9    7  -34 o  323.228   2.1251  4260.37   55.992  4198.63   78.892  4323.04   79.481  320.793   3.0170  325.514   2.9954 -4.720612 4.251430 
1 1 1    9    7  -33 o  216.302   1.6466  1907.48   29.033  1848.18   40.935  1967.50   41.182  212.879   2.3590  219.647   2.3001 -6.767441 3.294753 
1 1 1    9    7  -32 o  386.770   2.4478  6101.00   77.172  6095.53  109.543  6106.39  108.736  386.466   3.4773  386.815   3.4485 -0.3483582 4.897329 
1 1 1    9    7  -31 o  340.823   2.2123  4736.92   61.462  4742.51   87.502  4731.47   86.349  340.931   3.1486  340.538   3.1107 0.3926086 4.426058 
1 1 1    9    7  -30 o  170.782   1.6001  1189.07   22.275  1224.16   35.960  1167.23   28.374  173.247   2.5464  169.191   2.0574 4.055466 3.273633 
1 1 1    9    7  -29 o  156.190   1.4454  994.509   18.403  1035.42   27.081  959.410   25.085  159.352   2.0849  153.394   2.0062 5.957703 2.893335 
1 1 1    9    7  -28 o   94.369   1.4308  363.038   11.006  360.028   16.077  365.692   15.100   93.965   2.0990   94.704   1.9560 -0.7391205 2.869054 
1 1 1    9    7  -27 o  127.993   1.5121  667.845   15.776  667.913   25.380  667.801   20.140  127.976   2.4329  127.979   1.9305 -0.3341675E-02 3.105774 
1 1 1    9    7  -26 o  166.642   1.5865  1132.09   21.550  1141.59   34.366  1125.94   27.666  167.308   2.5199  166.175   2.0424 1.133026 3.243623 
1 1 1    9    7  -25 o   78.172   1.6378  249.124   10.436  251.628   17.565  247.757   12.975   78.497   2.7494   77.924   2.0444 0.5725479 3.426155 
1 1 1    9    7  -24 o   79.330   1.6980  256.565   10.980  243.285   19.845  262.424   13.181   77.159   3.1619   80.201   2.0179 -3.041519 3.750914 
1 1 1    9    7  -23 o  195.666   1.6514  1560.79   26.339  1555.04   40.334  1565.07   34.779  195.272   2.5339  195.916   2.1778 -0.6437836 3.341190 
1 1 1    9    7  -22 o  204.617   1.6885  1706.86   28.163  1661.44   42.541  1742.29   37.576  201.842   2.5856  206.710   2.2301 -4.868484 3.414452 
1 1 1    9    7  -21 o  199.822   1.6676  1627.78   27.162  1656.06   42.072  1607.57   35.568  201.517   2.5612  198.560   2.1975 2.956680 3.374753 
1 1 1    9    7  -20 o  162.905   1.5385  1081.83   20.430  1098.87   31.548  1069.53   26.811  164.160   2.3576  161.964   2.0308 2.196060 3.111613 
1 1 1    9    7  -19 o   62.293   1.7408  158.318   8.8310  161.293   13.655  156.179   11.578   62.833   2.6722   61.846   2.3006 0.9863663 3.526130 
1 1 1    9    7  -18 o  125.169   1.5704  638.688   16.023  673.560   28.067  621.829   19.516  128.517   2.6792  123.500   1.9386 5.016830 3.306988 
1 1 1    9    7  -17 o  251.490   2.0466  2578.63   41.956  2689.42   74.993  2528.15   50.620  256.747   3.5833  248.996   2.4940 7.751678 4.365738 
1 1 1    9    7  -16 o  126.781   1.7209  655.256   17.785  739.048   40.621  635.385   19.782  134.536   3.7076  124.840   1.9439 9.696579 4.186275 
1 1 1    9    7  -15 o  165.391   1.8243  1115.16   24.595  1093.10   53.621  1121.04   27.679  163.667   4.0192  165.821   2.0477 -2.153748 4.510778 
1 1 1    9    7  -14 o  251.173   2.0484  2572.09   41.939  2456.44   70.566  2635.25   52.148  245.386   3.5278  254.218   2.5165 -8.831619 4.333420 
1 1 1    9    7  -13 o   82.754   1.8320  279.181   12.358  340.838   27.769  263.953   13.800   91.325   3.7381   80.434   2.1065 10.89041 4.290774 
1 1 1    9    7  -12 o  360.054   2.6561  5286.39   77.956  5353.31  136.348  5253.89   95.018  362.142   4.6188  358.901   3.2478 3.241364 5.646424 
1 1 1    9    7  -11 f  370.095   2.7156  5585.42   81.925  5556.01  141.308  5600.31  100.549  368.930   4.6988  370.540   3.3289 -1.610260 5.758519 
1 1 1    9    7  -10 o  300.958   2.5336  3693.26   62.154  3725.92   99.030  3672.03   79.838  302.185   4.0203  300.048   3.2642 2.136627 5.178608 
1 1 1    9    7   -9 o  368.469   2.9630  5536.89   88.994  5658.61  143.269  5460.42  113.560  372.327   4.7205  365.845   3.8080 6.482025 6.064991 
1 1 1    9    7   -8 o  372.923   2.9948  5671.58   91.039  5847.35  147.376  5563.12  115.768  378.483   4.7769  369.268   3.8460 9.214539 6.132744 
1 1 1    9    7   -7 o  457.192   3.9806  8528.20  148.348  9030.37  219.635  8106.92  201.169  470.196   5.7304  445.539   5.5391 24.65768 7.969904 
1 1 1    9    7   -6 o   95.136   2.0053  368.985   15.551  389.227   22.573  350.699   21.454   97.656   2.8386   92.693   2.8428 4.963760 4.017394 
1 1 1    9    7   -5 o  309.719   2.8973  3911.81   73.146  4060.17  106.362  3778.68  100.754  315.448   4.1364  304.323   4.0615 11.12540 5.797052 
1 1 1    9    7   -4 o  277.956   2.6799  3150.35   60.720  3145.78   85.861  3154.93   85.883  277.690   3.7931  278.093   3.7886 -0.4036865 5.361102 
1 1 1    9    7   -3 o  282.679   2.7126  3258.36   62.505  3329.57   89.633  3190.96   87.207  285.683   3.8490  279.675   3.8253 6.007996 5.426548 
1 1 1    9    7   -2 o  101.608   1.4901  420.849   12.342  432.372   18.962  412.379   16.257  102.981   2.2589  100.575   1.9829 2.405334 3.005772 
1 1 1    9    7   -1 o   64.046   1.7406  167.340   9.0789  169.411   13.862  165.783   12.014   64.403   2.6461   63.725   2.3168 0.6783752 3.516974 
1 1 1    9    7    0 o   85.316   1.6740  296.717   11.642  289.906   16.466  303.524   16.462   84.289   2.3990   86.250   2.3436 -1.960739 3.353747 
1 1 1    9    7    1 o  203.234   1.6817  1683.76   27.859  1669.23   42.275  1694.90   37.040  202.332   2.5632  203.892   2.2286 -1.560120 3.396580 
1 1 1    9    7    2 o  191.214   1.6377  1490.46   25.527  1459.08   38.449  1515.19   34.136  189.169   2.4935  192.782   2.1722 -3.612335 3.306954 
1 1 1    9    7    3 o  186.890   1.6230  1423.81   24.726  1441.16   37.909  1410.96   32.620  188.004   2.4737  186.033   2.1511 1.970840 3.278116 
1 1 1    9    7    4 o  164.237   1.5517  1099.55   20.774  1138.00   32.144  1071.96   27.223  167.067   2.3603  162.154   2.0596 4.912888 3.132558 
1 1 1    9    7    5 o  124.523   1.7576  632.110   17.841  632.932   22.977  630.862   28.310  124.596   2.2624  124.381   2.7922 0.2147369 3.593733 
1 1 1    9    7    6 o  374.054   3.0086  5706.00   91.736  6107.02  124.606  5231.44  135.552  386.892   3.9511  358.015   4.6448 28.87735 6.097970 
1 1 1    9    7    7 o  322.349   2.6719  4237.04   70.208  4204.56   90.088  4287.27  112.044  321.061   3.4423  324.138   4.2406 -3.076630 5.461826 
1 1 1    9    7    8 o  124.569   1.7498  632.577   17.768  645.619   23.147  613.868   27.723  125.838   2.2565  122.694   2.7719 3.143906 3.574255 
1 1 1    9    7    9 o  193.008   1.7751  1518.63   27.928  1530.09   39.716  1507.42   39.278  193.715   2.5152  192.274   2.5061 1.440582 3.550585 
1 1 1    9    7   10 o  167.160   1.6799  1139.08   22.891  1122.45   32.265  1155.93   32.481  165.919   2.3856  168.375   2.3665 -2.456833 3.360297 
1 1 1    9    7   11 f   23.469   4.2145   23.162   7.7664   23.068   11.433   23.243   10.583   23.321   5.9847   23.389   5.6209 -0.6736565E-01 8.210423 
1 1 1    9    7   12 o   94.986   1.6109  367.796   12.473  362.959   17.781  372.482   17.502   94.350   2.3120   95.581   2.2463 -1.230843 3.223529 
1 1 1    9    7   13 o   83.796   1.5608  286.240   10.661  285.662   16.521  286.652   13.956   83.666   2.4250   83.851   2.0418 -0.1852264 3.170152 
1 1 1    9    7   14 o  214.811   2.2919  1881.43   40.132   0.0000   0.0000  1881.43   40.132  ?   ?   214.811   2.2919 0.000000 2.291899 
1 1 1    9    7   15 o  205.843   1.8305  1727.38   30.714  1709.76   53.022  1736.28   37.680  204.738   3.1770  206.359   2.2400 -1.620789 3.887307 
1 1 1    9    7   16 o   85.707   1.6666  299.454   11.643  293.144   20.409  302.498   14.176   84.728   2.9596   86.137   2.0190 -1.409149 3.582687 
1 1 1    9    7   17 o   68.997   1.8113  194.212   10.178  199.025   17.870  191.901   12.383   69.781   3.1497   68.568   2.2184 1.212967 3.852514 
1 1 1    9    7   18 o  116.175   1.5915  550.200   15.072  527.467   25.841  561.919   18.554  113.726   2.7875  117.400   1.9388 -3.674271 3.395495 
1 1 1    9    7   19 o  388.665   2.6216  6160.34   83.057  6039.26  125.153  6255.64  111.032  384.683   3.9912  391.576   3.4785 -6.892761 5.294310 
1 1 1    9    7   20 o  225.441   1.7859  2071.99   32.819  2043.02   49.880  2094.11   43.581  223.819   2.7340  226.618   2.3592 -2.799255 3.611138 
1 1 1    9    7   21 o   48.460   2.1141   95.934   8.3312   94.262   13.252   97.026   10.713   47.946   3.4132   48.701   2.7092 -0.7546158 4.357711 
1 1 1    9    7   22 o  194.140   1.6541  1536.53   26.176  1581.37   40.862  1505.33   34.089  196.919   2.5456  192.142   2.1765 4.777496 3.349227 
1 1 1    9    7   23 o  224.057   1.7782  2046.67   32.476  2039.75   49.800  2051.79   42.839  223.634   2.7319  224.313   2.3429 -0.6793365 3.598905 
1 1 1    9    7   24 o   90.201   1.5366  331.686   11.298  328.914   17.572  333.639   14.751   89.777   2.4033   90.460   2.0005 -0.6823883 3.126980 
1 1 1    9    7   25 o   60.795   1.7992  150.822   8.9065  147.935   14.127  152.726   11.474   60.153   2.8895   61.155   2.3059 -1.002121 3.696788 
1 1 1    9    7   26 o   32.666   2.9905   43.894   7.8749   45.555   14.651   43.218   9.3386   32.918   5.6642   32.344   3.6032 0.5748520 6.713108 
1 1 1    9    7   27 o  226.679   1.9324  2095.03   35.706  2078.25   62.173  2103.29   43.616  225.682   3.3796  227.104   2.3560 -1.421997 4.119799 
1 1 1    9    7   28 o  224.815   1.9225  2060.74   35.231  2072.16   61.890  2055.26   42.852  225.349   3.3692  224.496   2.3417 0.8531952 4.103039 
1 1 1    9    7   29 o  225.956   1.9322  2081.72   35.588  2112.34   62.834  2067.25   43.182  227.519   3.3880  225.148   2.3529 2.371399 4.124824 
1 1 1    9    7   30 o  139.090   1.4923  788.680   16.920  766.824   25.864  805.029   22.370  137.126   2.3139  140.512   1.9531 -3.386108 3.027992 
1 1 1    9    7   31 o   68.532   1.6703  191.482   9.3307  209.723   15.001  179.972   11.916   71.661   2.5722   66.397   2.2048 5.264709 3.387822 
1 1 1    9    7   32 o  224.315   1.7738  2051.51   32.434  2018.36   49.371  2076.68   43.020  222.443   2.7228  225.657   2.3388 -3.214752 3.589366 
1 1 1    9    7   33 o  192.443   1.6452  1509.87   25.808  1502.70   39.651  1515.15   33.995  191.945   2.5342  192.757   2.1636 -0.8124847 3.332158 
1 1 1    9    7   34 o   35.093   2.6172   50.512   7.4328   57.764   12.260   46.298   9.3463   37.389   4.0892   33.502   3.4727 3.887119 5.364853 
1 1 1    9    7   35 o  170.382   1.8392  1183.66   25.544  1166.91   41.015  1194.27   32.648  169.118   2.9752  171.124   2.3405 -2.005371 3.785480 
1 1 1    9    7   36 o  175.111   1.8589  1250.29   26.534  1289.69   43.435  1226.83   33.516  177.790   2.9971  173.438   2.3706 4.351715 3.821297 
1 1 1    9    7   37 o   59.897   2.0681  146.476   10.082  108.288   17.360  165.912   12.385   51.321   4.1861   63.735   2.3881 -12.41446 4.819392 
1 1 1    9    7   38 o  111.265   1.7185  504.759   15.586  498.307   25.806  508.464   19.555  110.478   2.8680  111.661   2.1485 -1.182892 3.583497 
1 1 1    9    7   39 o  124.448   1.4122  631.383   14.326  602.606   20.928  656.758   19.653  121.560   2.1121  126.911   1.8997 -5.351219 2.840710 
1 1 1    9    7   40 o   35.158   2.5925   50.697   7.3776   44.299   12.288   54.303   9.2254   32.579   4.7681   36.343   3.1450 -3.763287 5.711882 
1 1 1    9    7   41 o  162.769   1.8403  1080.29   24.417  1105.31   39.750  1065.14   30.943  164.584   2.9629  161.600   2.3490 2.983749 3.781114 
1 1 1    9    7   42 o  100.456   1.7786  411.471   14.564  395.015   23.944  421.135   18.348   98.343   2.9904  101.617   2.2151 -3.273476 3.721415 
1 1 1    9    7   43 o  130.652   1.7661  696.017   18.809  688.276   30.593  700.721   23.848  129.876   2.8897  131.076   2.2320 -1.199097 3.651347 
1 1 1    9    7   44 o   44.856   2.5678   82.351   9.3498   84.628   16.128   81.198   11.475   45.292   4.4247   44.489   3.1852 0.8021851 5.451935 
1 1 1    9    7   45 o  113.310   1.7660  523.519   16.311  527.796   26.927  521.040   20.501  113.691   2.9079  113.026   2.2252 0.6648865 3.661567 
1 1 1    9    7   46 o  101.189   1.7199  417.506   14.187  419.485   21.826  416.059   18.668  101.365   2.6437  100.998   2.2675 0.3669205 3.482937 
1 1 1    9    7   47 o  160.539   1.9601  1051.04   25.651  1033.89   33.589  1075.04   39.731  159.190   2.5885  162.299   3.0031 -3.108948 3.964710 
1 1 1    9    7   48 o  142.133   1.9274  823.836   22.331  812.896   29.361  838.851   34.395  141.156   2.5517  143.368   2.9432 -2.212128 3.895300 
1 1 1    9    7   49 o  125.650   1.9284  643.851   19.751  657.542   26.291  626.114   29.925  126.952   2.5406  123.858   2.9640 3.093704 3.903842 
1 1 1    9    7   50 o  220.179   1.9495  1977.08   34.990  1964.56   50.634  1988.53   48.407  219.406   2.8311  220.755   2.6901 -1.348160 3.905345 
1 1 1    9    7   51 o   23.348   4.5210   23.050   8.2936   26.339   14.230   21.359   10.206   24.929   6.8108   22.398   5.6043 2.531128 8.820155 
1 1 1    9    7   52 o   95.169   1.7649  369.345   13.691  374.127   21.205  365.926   17.929   95.710   2.7207   94.709   2.3224 1.000435 3.577152 
1 1 1    9    7   53 o   95.014   1.7958  368.155   13.908  345.619   21.327  384.832   18.347   91.976   2.8480   97.124   2.3174 -5.147499 3.671715 
1 1 1    9    7   54 o   51.597   2.4015  108.856   10.073  119.277   17.387  103.591   12.358   53.872   3.9877   50.282   3.0290 3.590656 5.007687 
1 1 1    9    7   55 o  147.186   2.3255  883.867   27.902  896.635   40.685  872.532   38.337  148.162   3.3687  146.171   3.2175 1.991150 4.658383 
1 1 1    9    7   56 o  111.716   1.9776  509.048   18.009  496.770   31.968  514.756   21.797  110.211   3.5631  112.322   2.3807 -2.110466 4.285213 
1 1 1    9    7   57 o   34.249   3.5100   48.422   9.6607   68.081   20.235   42.619   10.995   40.229   6.3838   31.991   4.3269 8.237137 7.711960 
1 1 1    9    7   58 o  156.302   1.9554  996.498   24.914  951.015   42.683  1020.00   30.684  152.569   3.4320  158.105   2.3808 -5.535767 4.176986 
1 1 1    9    7   59 o  230.840   2.4558  2174.69   46.210  2256.15   69.800  2111.13   61.656  234.940   3.6447  227.318   3.3274 7.621704 4.935127 
1 1 1    9    7   60 o  144.152   1.8574  847.596   21.826  857.332   30.310  837.111   31.454  144.926   2.5657  143.195   2.6947 1.730392 3.720777 
1 1 1    9    7   61 o  151.836   1.7068  940.291   21.124  934.336   27.037  949.624   33.846  151.320   2.1919  152.505   2.7226 -1.185120 3.495299 
1 1 1    9    7   62 o   85.776   1.7403  300.106   12.168  299.107   16.613  301.263   17.873   85.571   2.3840   85.865   2.5564 -0.2936859 3.495492 
1 1 1    9    7   63 o  145.409   1.5758  862.339   18.678  851.225   25.713  874.756   27.178  144.424   2.1841  146.399   2.2774 -1.974426 3.155455 
1 1 1    9    7   64 o  118.826   1.7872  575.995   17.311  620.428   25.090  535.630   23.914  123.272   2.4969  114.533   2.5615 8.738800 3.577082 
1 1 1    9    7   65 o  141.766   1.5659  819.721   18.096  789.634   24.703  854.565   26.584  139.093   2.1787  144.692   2.2539 -5.598694 3.134829 
1 1 1    9    7   66 f   63.249   1.7525  163.327   9.0267  184.695   14.362  149.376   11.605   67.194   2.6272   60.441   2.3600 6.752869 3.531590 
1 1 1    9    7   67 o   75.774   1.6383  234.222   10.119  231.630   15.403  236.190   13.422   75.266   2.5141   76.035   2.1678 -0.7688675 3.319653 
1 1 1    9    7   68 o   76.275   1.6264  237.341   10.112  230.191   15.316  242.866   13.464   75.028   2.5078   77.102   2.1443 -2.073883 3.299554 
1 1 1    9    7   69 o   96.308   1.8445  378.509   14.480  371.809   17.619  392.452   25.416   95.422   2.2652   97.894   3.1893 -2.471581 3.911824 
1 1 1    9    7   70 o   81.049   1.9458  268.121   12.855  269.152   15.829  266.125   22.032   81.139   2.3959   80.562   3.3624 0.5773087 4.128676 
1 1 1    9    7   71 o   24.353   4.9069   25.263   9.4037   18.773   11.374   39.281   16.717   21.114   6.2015   30.168   6.9420 -9.054346 9.308546 
1 1 1    9    7   72 o  135.831   1.9361  753.183   21.436  743.422   23.829  794.601   49.087  134.921   2.1666  139.003   4.3375 -4.082001 4.848504 
1 1 1    9    7   73 o  120.696   1.9344  594.749   19.032  590.991   21.214  610.245   43.080  120.289   2.1635  121.764   4.3473 -1.475327 4.855921 
1 1 1    9    7   74 o   74.828   2.2490  228.973   13.703  230.814   15.310  221.563   30.720   75.098   2.5045   73.076   5.1909 2.021660 5.763486 
1 1 1    9    7   75 o   66.550   2.4689  181.325   13.370  172.168   17.122  195.634   21.403   64.736   3.2551   68.918   3.8248 -4.181580 5.022462 
1 1 1    9    7   76 o   45.675   2.9587   85.797   10.956   84.197   13.302   89.172   19.320   45.141   3.6462   46.144   5.2284 -1.003075 6.374250 
1 1 1    9    7   77 f  124.058   2.0160  628.804   20.387  612.820   26.297  652.879   32.274  122.364   2.6365  126.191   3.1375 -3.826469 4.098146 
1 1 1    9    7   78 o  101.236   1.9210  418.715   15.853  404.252   19.440  447.423   27.389   99.405   2.3991  104.373   3.2231 -4.967720 4.017927 
1 1 1    9    7   79 o  149.418   1.9805  912.446   24.123  864.352   30.534  992.302   39.346  145.288   2.5782  155.509   3.1039 -10.22028 4.035035 
1 1 1    9    7   80 f   27.245   4.7860   31.632   10.241   17.541   13.583   50.195   15.590   20.791   6.8838   34.227   5.7944 -13.43603 8.997896 
1 1 1    9    7   81 o  110.750   1.9259  501.430   17.387  514.110   22.841  483.959   26.810  112.026   2.5013  108.520   3.0337 3.505730 3.931866 
1 1 1    9    7   82 f   70.770   2.0168  205.034   11.622  225.170   14.570  169.806   19.272   74.097   2.4155   64.052   3.7069 10.04457 4.424512 
1 1 1    9    7   83 o   44.820   2.6192   82.694   9.5277   87.553   11.975   74.311   15.729   46.010   3.2130   42.016   4.6713 3.993828 5.669598 
1 1 1    9    7   84 o   15.772   5.2937   9.8813   8.0275   1.3393   10.554   21.604   12.364   13.426   5.6561   22.271   6.4445 -8.844899 8.574530 
1 1 1    9    7   85 o   72.177   2.0079  213.473   11.802  178.925   16.201  252.537   17.228   65.844   3.0266   78.342   2.7018 -12.49785 4.057100 
1 1 1    9    7   86 o   22.010   4.7214   21.023   8.2168   13.968   10.751   30.934   12.742   18.438   6.1248   26.463   6.0403 -8.025244 8.602256 
1 1 1    9    7   87 o  106.371   1.7879  463.147   15.502  462.025   21.926  464.269   21.920  106.012   2.5373  106.271   2.5304 -0.2596893 3.583455 
1 1 1    9    7   88 o   21.716   5.0635   20.692   8.7976   17.796   12.506   23.528   12.378   20.396   6.5965   22.982   6.3812 -2.586805 9.177875 
1 1 1    9    7   89 o   95.919   1.9928  377.346   15.581  373.521   24.936  379.796   19.957   94.899   3.2281   96.005   2.5524 -1.106026 4.115279 
1 1 1    9    7   90 o   86.868   2.0329  309.727   14.395  322.331   23.358  302.009   18.278   88.077   3.2590   85.540   2.6244 2.537155 4.184340 
1 1 1    9    7   91 o   76.722   2.1038  242.021   13.145  224.928   20.806  253.375   16.957   73.402   3.4872   78.299   2.6607 -4.897026 4.386356 
1 1 1    9    7   92 o   50.359   2.4082  104.750   9.8569  103.967   14.167  105.485   13.723   49.801   3.5123   50.219   3.3720 -0.4180679 4.868944 
1 1 1    9    7   93 f   76.588   1.9402  241.081   12.103  237.911   17.281  244.131   16.956   75.739   2.8038   76.766   2.7139 -1.026619 3.902139 
1 1 1    9    7   94 o   24.853   4.7728   27.201   9.3180   29.311   14.904   25.847   11.939   25.065   7.0179   23.781   6.1226 1.284283 9.313213 
1 1 1    9    7   95 o   14.131   5.4430   6.3727   8.8511  -5.2901   14.274   13.658   11.282   13.443   6.0815   18.051   6.2704 -4.608627 8.735090 
1 1 1    9    7   96 o   14.554   5.4825   7.4023   8.8548   8.7815   14.629   6.6048   11.124   17.165   6.8785   15.151   6.0226 2.013330 9.142516 
1 1 1    9    7   97 o   16.415   5.3307   11.631   8.1622   20.047   11.798   3.9052   11.304   20.905   6.3583   14.283   5.9227 6.622358 8.689419 
1 1 1    9    7   98 o   19.432   5.8323   17.141   9.9736   17.267   14.114   17.015   14.095   19.879   7.0057   19.780   6.9983 0.9914589E-01 9.902280 
1 1 1    9    7   99 o   18.818   5.5861   16.063   9.1885   14.129   12.117   18.679   14.095   18.243   6.4854   20.357   7.0116 -2.113291 9.551050 
1 1 1    9    7  100 o   33.881   3.1747   48.572   8.6657   49.098   10.543   47.476   15.215   33.756   3.9033   32.046   6.0460 1.710148 7.196524 
1 1 1    9    7  101 o   21.775   4.4253   21.152   7.5868   19.708   9.8751   23.232   11.852   20.598   5.6922   22.150   6.2781 -1.551931 8.474429 
1 1 1    9    7  102 o   34.803   2.8939   51.094   8.1357   38.739   10.423   70.359   13.015   29.580   4.4614   40.288   4.0166 -10.70799 6.003132 
1 1 1    9    7  103 o   26.160   4.1058   30.183   8.4671   28.132   10.135   34.924   15.407   24.704   5.1977   26.473   7.0245 -1.768667 8.738409 
1 1 1    9    7  104 o   14.931   5.2784   9.4104   8.0173   13.429   9.7263   0.8919   14.161   17.202   5.8270   14.323   6.2927 2.879477 8.576263 
1 1 1    9    7  105 o   28.970   3.6997   36.669   8.5378   31.854   10.266   47.469   15.375   26.288   4.9729   31.275   6.2499 -4.986797 7.986912 
1 1 1    9    7  106 o   10.101   4.4984  -1.4898   7.4771  -1.8866   9.7550  -0.9247   11.642   11.387   5.0998   12.615   5.6157 -1.228000 7.585811 
1 1 1    9    7  107 o   13.466   5.0836   7.0004   7.6223   3.9913   9.8842   11.415   11.972   13.164   5.5047   16.456   6.3325 -3.292012 8.390623 
1 1 1    9    7  108 o   10.598   4.6426  -0.0811   7.6576   2.0736   9.9613  -3.1941   11.973   12.517   5.3901   12.118   5.5165 0.3997555 7.712671 
1 1 1    9    7  109 o   43.193   2.5401   78.999   8.9038   83.481   11.778   73.023   13.601   43.833   3.3211   40.242   4.2086 3.591312 5.361144 
1 1 1    9    7  110 f   15.824   5.4561   11.831   8.5352   10.997   11.803   12.746   12.357   15.941   6.2446   16.662   6.4278 -0.7210369 8.961652 
1 1 1    9    7  111 o   12.149   5.0171   4.0107   8.0650   3.9373   10.836   4.1020   12.076   13.266   5.6652   13.766   5.9314 -0.5002384 8.202183 
1 1 1    9    7  112 o   14.659   5.5169   9.4169   8.9618   6.4121   10.806   16.036   16.038   14.004   5.7975   17.994   7.2051 -3.990030 9.247950 
1 1 1    9    7  113 o   15.676   5.8125   11.511   9.8734   7.3291   12.264   19.212   16.644   14.673   6.1335   18.884   7.4101 -4.211243 9.619179 
1 1 1    9    7  114 o   19.366   5.8673   19.489   10.060   15.336   12.663   26.593   16.561   17.361   6.5528   21.163   7.5754 -3.801622 10.01628 
1 1 1    9    7  115 o   17.393   5.9940   15.583   10.301   20.696   13.061   7.1693   16.755   19.351   6.7451   15.594   6.8482 3.757531 9.612226 
1 1 1    9    7  116 o   9.7123   4.6369  -9.4921   10.267  -6.5338   12.941 -14.5164   16.865   11.561   5.4249   11.967   5.7727 -0.4057226 7.921688 
1 1 1    9    7  117 o   14.610   5.8069   9.0934   10.340   8.6957   12.873   9.8168   17.360   15.027   6.2830   16.182   7.0414 -1.154735 9.437018 
1 1 1    9    7  118 o   12.286   5.5493  -0.3070   11.830   4.9885   16.845  -5.4598   16.616   14.985   6.7070   13.061   6.1346 1.923385 9.089364 
1 1 1    9    7  119 o   17.695   6.4551   16.939   12.097  -0.0087   16.897   34.757   17.325   14.013   6.4442   23.397   7.7754 -9.384712 10.09876 
1 1 1    9    7  120 o   10.384   4.9576  -9.5692   11.738  -2.8342   16.574 -16.3455   16.625   13.382   6.2333   11.522   5.5989 1.860677 8.378688 
1 1 1    9    7  121 o   17.209   6.4410   16.018   12.180  -1.6683   17.074   34.346   17.380   13.673   6.3543   22.992   7.7893 -9.319546 10.05239 
1 1 1    9    7  122 o   12.684   5.6881   1.2437   12.178 -15.4917   16.968   19.025   17.490   11.716   5.6846   18.159   7.4315 -6.443347 9.356385 
1 1 1    9    7  123 o   10.779   5.2031 -13.0543   13.756 -32.2837   21.837  -0.4026   17.713   11.762   5.8474   14.089   6.5215 -2.327298 8.759148 
1 1 1    9    8 -120 o   19.766   6.8863   23.067   13.612   18.138   20.703   26.822   18.067   17.981   7.7569   20.294   7.7869 -2.313135 10.99110 
1 1 1    9    8 -119 o   23.334   6.0391   29.512   11.575   29.862   15.076   29.009   18.065   22.035   7.2504   20.949   7.8436 1.086092 10.68128 
1 1 1    9    8 -118 o   29.112   5.2590   42.535   12.021   47.938   15.791   35.091   18.537   29.132   6.7779   22.858   8.0307 6.274380 10.50866 
1 1 1    9    8 -117 o   18.459   6.0437   18.441   10.481   14.716   13.000   25.358   17.716   16.804   6.5620   20.031   7.7045 -3.227608 10.12019 
1 1 1    9    8 -116 o   17.811   6.1058   16.990   10.684   15.435   13.173   19.981   18.267   17.121   6.6280   18.575   7.5976 -1.454420 10.08236 
1 1 1    9    8 -115 o   27.712   5.0469   37.707   10.981   32.718   13.613   47.000   18.578   24.107   6.6913   27.481   7.8835 -3.374216 10.34037 
1 1 1    9    8 -114 o   21.687   5.8661   24.752   10.619   18.755   13.148   36.001   18.007   18.454   6.7302   23.812   7.9271 -5.357796 10.39878 
1 1 1    9    8 -113 o   19.762   6.0728   20.818   10.727   17.083   13.379   27.538   17.947   17.893   6.7394   21.073   7.8321 -3.179373 10.33259 
1 1 1    9    8 -112 o   19.540   6.5396   20.902   12.252   29.200   16.942   11.806   17.739   21.882   7.6784   16.810   7.2151 5.071705 10.53635 
1 1 1    9    8 -111 o   9.9206   4.7655 -11.5684   11.215   0.4517   15.583 -24.4832   16.152   13.942   6.3260   10.625   5.2359 3.317545 8.211763 
1 1 1    9    8 -110 o   19.448   5.9533   19.620   10.321   7.1221   13.121   39.905   16.716   14.842   6.2821   26.289   7.4574 -11.44710 9.750762 
1 1 1    9    8 -109 o   9.2683   4.3780  -7.2316   8.6823  -3.1525   10.281 -17.3754   16.212   11.090   5.0728   11.500   5.5746 -0.4103565 7.537232 
1 1 1    9    8 -108 o   26.776   4.8353   33.993   10.165   23.815   12.713   52.034   16.926   21.043   6.6344   31.227   6.8393 -10.18388 9.528469 
1 1 1    9    8 -107 o   12.961   5.2682   5.3133   8.7169  -4.2246   10.291   29.533   16.399   10.913   5.0226   22.729   7.5650 -11.81584 9.080553 
1 1 1    9    8 -106 o   15.719   4.8802   11.611   6.9063   7.6850   10.046   15.130   9.5099   14.395   5.7229   17.588   5.7569 -3.193433 8.117423 
1 1 1    9    8 -105 o   9.8474   4.3100  -0.2522   6.5865   8.9354   9.7744  -7.8943   8.9144   14.902   5.7251   9.3959   4.4376 5.506288 7.243541 
1 1 1    9    8 -104 o   23.024   3.9123   23.691   7.0802   26.486   10.423   21.296   9.6478   23.427   5.5447   20.962   5.5570 2.464779 7.850035 
1 1 1    9    8 -103 o   38.840   2.4727   63.427   7.7880   60.542   11.551   65.832   10.546   37.136   3.8726   39.088   3.3417 -1.952526 5.115058 
1 1 1    9    8 -102 o   9.6512   4.3516  -2.5238   7.2378   8.1519   11.141 -10.3203   9.5207   15.223   6.0349   9.4079   4.4843 5.815396 7.518564 
1 1 1    9    8 -101 o   67.650   1.7351  188.862   9.5605  184.778   13.796  192.635   13.261   66.439   2.5522   67.943   2.3981 -1.504166 3.502079 
1 1 1    9    8 -100 o   13.028   4.8783   6.2095   6.9879   18.217   10.263  -4.1677   9.5412   19.649   5.9206   10.804   4.9208 8.845456 7.698524 
1 1 1    9    8  -99 o   17.790   4.9815   14.440   7.5091   20.642   10.250   7.2582   11.031   20.957   5.8024   15.087   5.9973 5.870487 8.344745 
1 1 1    9    8  -98 o   54.824   2.0991  124.402   9.3634  125.567   12.786  123.055   13.750   54.717   2.8768   54.023   3.1359 0.6941566 4.255583 
1 1 1    9    8  -97 f   12.584   4.8157   5.1993   6.8978  -1.6207   10.053   11.267   9.4821   11.879   5.2568   16.385   5.7447 -4.506345 7.786924 
1 1 1    9    8  -96 o   13.596   5.0181   6.7913   7.3442   9.1318   9.9660   4.0096   10.865   15.608   5.8295   14.045   5.8137 1.563020 8.232943 
1 1 1    9    8  -95 f   42.378   2.4594   74.631   8.4592   75.485   11.504   73.625   12.482   42.271   3.3664   41.583   3.7217 0.6879654 5.018363 
1 1 1    9    8  -94 o   14.548   5.0464   8.5600   7.3063   11.274   9.9833   5.4295   10.721   16.617   5.8887   14.524   5.8647 2.092557 8.310908 
1 1 1    9    8  -93 o   53.404   2.0898  117.683   9.0799  106.725   12.382  130.429   13.355   50.515   3.0209   55.896   2.9414 -5.381367 4.216305 
1 1 1    9    8  -92 o   33.385   2.9274   46.680   7.8861   51.830   10.982   41.197   11.332   34.830   3.9368   30.715   4.6732 4.115496 6.110394 
1 1 1    9    8  -91 o   28.113   3.5119   33.570   7.8729   41.422   10.982   25.267   11.293   30.911   4.4896   23.557   5.8954 7.354145 7.410298 
1 1 1    9    8  -90 o   15.022   5.1226   9.1594   7.5182   12.366   10.553   5.8549   10.714   17.386   6.0629   14.795   5.9007 2.591919 8.460320 
1 1 1    9    8  -89 o   42.107   2.4751   73.382   8.4577   76.426   11.762   70.123   12.170   42.688   3.4086   40.775   3.7018 1.912788 5.032137 
1 1 1    9    8  -88 o   55.294   2.0573  125.770   9.2569  131.432   12.987  119.922   13.198   56.296   2.8392   53.704   3.0271 2.591618 4.150261 
1 1 1    9    8  -87 o   19.557   4.7746   16.829   7.5441   9.2028   10.622   24.590   10.716   16.153   6.0213   23.467   5.6667 -7.313574 8.268471 
1 1 1    9    8  -86 o   42.342   2.4418   74.027   8.3923   80.372   11.722   67.353   12.021   43.898   3.2999   40.036   3.7262 3.862545 4.977367 
1 1 1    9    8  -85 o   76.596   1.8856  240.421   11.773  235.432   17.455  244.586   15.947   75.487   2.8418   77.046   2.5426 -1.559052 3.813219 
1 1 1    9    8  -84 o   42.161   2.6704   73.459   9.1305   83.969   14.023   65.723   12.030   44.762   3.8815   39.594   3.7729 5.167141 5.413014 
1 1 1    9    8  -83 o   37.197   3.1093   57.485   9.3414   60.227   15.996   56.065   11.508   37.396   5.4041   36.526   3.9265 0.8694267 6.679924 
1 1 1    9    8  -82 o   12.103   4.9493   2.4444   7.7499   4.4241   12.163   1.0915   10.055   15.223   6.2099   13.023   5.5052 2.200025 8.298775 
1 1 1    9    8  -81 o   68.164   1.9697  190.345   10.933  183.895   16.335  195.579   14.714   66.770   3.0090   68.960   2.6224 -2.190384 3.991401 
1 1 1    9    8  -80 o   48.365   2.4151   96.145   9.4914  113.435   14.542   83.314   12.528   52.333   3.4278   44.810   3.4564 7.523010 4.867936 
1 1 1    9    8  -79 o   68.810   1.9736  193.850   11.058  182.837   16.512  202.806   14.891   66.617   3.0489   70.267   2.6043 -3.650818 4.009735 
1 1 1    9    8  -78 o   70.447   1.8580  203.018   10.660  189.583   14.627  218.238   15.568   67.944   2.6460   72.910   2.6238 -4.965775 3.726333 
1 1 1    9    8  -77 o   14.564   5.4609   6.7258   8.7634  -8.2254   13.054   18.991   11.824   12.522   5.7233   21.115   6.3531 -8.593623 8.550919 
1 1 1    9    8  -76 o   15.394   5.6001   8.2044   9.0953   2.6938   13.614   12.647   12.224   15.545   6.4774   18.429   6.5174 -2.884123 9.188755 
1 1 1    9    8  -75 o   73.784   2.0843  222.738   12.523  228.841   18.900  217.961   16.721   74.615   3.1142   72.872   2.8202 1.742798 4.201405 
1 1 1    9    8  -74 o  119.440   2.0092  582.975   19.562  588.698   26.247  575.824   29.339  119.902   2.6855  118.467   3.0407 1.434662 4.056786 
1 1 1    9    8  -73 o   55.143   2.4707  124.637   11.078  125.678   15.222  123.466   16.151   55.236   3.3973   54.702   3.6429 0.5334358 4.981221 
1 1 1    9    8  -72 o   50.136   2.4902  103.057   10.145   96.553   14.038  110.168   14.678   48.368   3.5861   51.697   3.5038 -3.328537 5.013681 
1 1 1    9    8  -71 o   91.766   1.7394  343.759   13.011  321.061   17.295  373.362   19.751   88.589   2.3971   95.517   2.5390 -6.927292 3.491810 
1 1 1    9    8  -70 o   29.478   3.8018   36.245   8.9227   30.160   12.027   43.694   13.307   26.494   5.7354   32.123   5.2643 -5.628733 7.785100 
1 1 1    9    8  -69 o  109.590   1.6425  490.106   14.672  517.184   20.021  458.689   21.565  112.523   2.1828  105.932   2.4974 6.590271 3.316808 
1 1 1    9    8  -68 o  116.033   1.7474  549.477   16.528  536.600   20.598  572.756   27.695  114.620   2.2046  118.331   2.8712 -3.711220 3.619957 
1 1 1    9    8  -67 o  107.271   1.5125  469.438   13.226  484.662   19.468  456.389   18.023  108.939   2.1923  105.724   2.0913 3.215836 3.029820 
1 1 1    9    8  -66 o   94.221   1.5555  362.169   11.946  355.151   17.578  368.194   16.286   93.250   2.3125   94.964   2.1039 -1.713997 3.126313 
1 1 1    9    8  -65 o  109.377   1.4382  487.973   12.823  488.067   19.608  487.903   16.949  109.330   2.2002  109.337   1.9017 -0.6713867E-02 2.908160 
1 1 1    9    8  -64 o   47.862   1.9609   93.653   7.6343  105.018   13.161   87.890   9.3722   50.566   3.2096   46.319   2.4914 4.247231 4.063075 
1 1 1    9    8  -63 o  104.493   1.4661  445.355   12.488  424.037   18.823  462.113   16.689  101.910   2.2659  106.413   1.9240 -4.503357 2.972554 
1 1 1    9    8  -62 o   30.253   2.9453   37.760   7.1715   39.182   12.249   37.017   8.8462   30.474   5.1118   29.843   3.7168 0.6309528 6.320222 
1 1 1    9    8  -61 o   99.467   1.6005  403.556   12.977  368.253   18.169  440.317   18.541   94.974   2.3469  103.863   2.1899 -8.889122 3.209928 
1 1 1    9    8  -60 o   35.941   2.4745   52.990   7.2051   63.334   12.908   48.308   8.6839   39.111   4.1101   34.235   3.1470 4.876465 5.176487 
1 1 1    9    8  -59 o   48.380   2.0286   95.676   7.9826   99.068   13.637   93.908   9.8455   49.103   3.4287   47.891   2.5310 1.211163 4.261664 
1 1 1    9    8  -58 o  274.660   1.9188  3077.72   42.959  3044.72   61.301  3109.56   60.220  273.040   2.7543  275.948   2.6772 -2.907440 3.841008 
1 1 1    9    8  -57 o  160.800   1.6125  1054.55   21.136  1016.43   33.551  1079.64   27.215  157.781   2.6086  162.667   2.0525 -4.885635 3.319278 
1 1 1    9    8  -56 o   97.392   1.8381  386.911   14.592  398.464   27.097  382.192   17.318   98.682   3.3735   96.779   2.1952 1.902786 4.024860 
1 1 1    9    8  -55 o  221.639   1.9589  2003.93   35.391  1977.49   51.272  2027.99   48.912  220.061   2.8583  222.877   2.6922 -2.815781 3.926560 
1 1 1    9    8  -54 o   30.758   3.4021   39.126   8.3875   39.186   15.496   39.101   9.9751   30.301   6.4703   30.648   4.0952 -0.3471546 7.657366 
1 1 1    9    8  -53 o   41.653   2.7241   71.126   9.1985   51.283   16.224   80.527   11.167   34.872   5.9188   44.296   3.1125 -9.424065 6.687307 
1 1 1    9    8  -52 o   43.279   2.5966   76.718   9.1183   81.779   17.557   74.848   10.670   44.417   4.9323   42.702   3.0862 1.714710 5.818290 
1 1 1    9    8  -51 o  117.536   2.0965  563.527   20.087  570.971   33.915  559.505   24.929  118.166   3.5249  117.088   2.6119 1.077721 4.387137 
1 1 1    9    8  -50 f  111.483   2.1238  506.994   19.300  431.442   24.422  632.653   31.496  102.761   2.9185  124.474   3.1042 -21.71264 4.260695 
1 1 1    9    8  -49 o   93.150   2.1205  353.950   16.101  373.349   25.595  341.248   20.712   95.554   3.2910   91.392   2.7835 4.161636 4.310216 
1 1 1    9    8  -48 o  162.954   1.6191  1082.80   21.507  1104.50   33.909  1068.19   27.818  164.521   2.5285  161.824   2.1089 2.697311 3.292505 
1 1 1    9    8  -47 o  115.290   1.6014  541.991   15.050  516.346   21.042  568.850   21.534  112.503   2.2945  118.087   2.2371 -5.584160 3.204634 
1 1 1    9    8  -46 o  207.067   1.7683  1748.49   29.847  1777.53   47.631  1729.71   38.298  208.694   2.7999  205.915   2.2816 2.779022 3.611863 
1 1 1    9    8  -45 o   25.801   3.5916   27.710   7.3492   27.575   12.216   27.787   9.2004   25.429   5.9922   25.686   4.5612 -0.2574177 7.530680 
1 1 1    9    8  -44 o  165.876   1.6117  1121.91   21.793  1141.51   35.310  1109.85   27.697  167.262   2.5898  164.960   2.0598 2.302155 3.309009 
1 1 1    9    8  -43 o  207.646   1.6322  1758.08   27.626  1791.42   40.272  1728.44   37.969  209.557   2.3576  205.848   2.2628 3.708984 3.267785 
1 1 1    9    8  -42 o  183.141   1.6616  1367.61   24.805  1357.86   39.417  1374.01   31.918  182.426   2.6507  183.542   2.1333 -1.116608 3.402524 
1 1 1    9    8  -41 o   22.509   3.9614   21.307   7.0029   17.840   11.298   23.470   8.9239   20.751   6.2027   23.530   4.8150 -2.778736 7.852233 
1 1 1    9    8  -40 o  161.666   1.4862  1065.58   19.586  1057.28   28.325  1073.19   27.111  161.005   2.1582  162.217   2.0503 -1.212494 2.976843 
1 1 1    9    8  -39 o  238.361   1.7489  2316.71   33.980  2308.39   48.685  2324.61   47.449  237.875   2.5108  238.716   2.4384 -0.8403778 3.500004 
1 1 1    9    8  -38 o  224.239   1.6918  2050.25   30.924  1997.32   43.816  2102.78   43.650  221.276   2.4292  227.048   2.3585 -5.772141 3.385736 
1 1 1    9    8  -37 o   40.391   2.3283   66.764   7.6334   54.128   11.739   76.023   10.048   36.176   4.0502   43.067   2.8787 -6.891354 4.968976 
1 1 1    9    8  -36 o   58.440   1.7996  139.392   8.5627  149.175   13.016  131.928   11.369   60.411   2.6496   56.817   2.4607 3.594234 3.616001 
1 1 1    9    8  -35 o  273.092   1.8942  3041.15   42.167  3052.40   60.355  3030.43   58.938  273.527   2.7069  272.546   2.6529 0.9805603 3.790154 
1 1 1    9    8  -34 o  161.329   1.4788  1061.11   19.447  1018.98   27.688  1102.14   27.319  158.068   2.1489  164.396   2.0386 -6.328415 2.962058 
1 1 1    9    8  -33 o   92.773   1.5878  350.912   12.008  358.840   19.785  346.289   15.109   93.754   2.5913   92.151   2.0114 1.602791 3.280334 
1 1 1    9    8  -32 o  278.486   2.2206  3162.96   50.410  3159.62   72.487  3166.08   70.151  278.242   3.1960  278.539   3.0897 -0.2968140 4.445250 
1 1 1    9    8  -31 o  190.146   1.8127  1474.22   28.097  1381.05   39.757  1567.19   39.713  183.994   2.6507  196.012   2.4855 -12.01830 3.633734 
1 1 1    9    8  -30 o  200.647   1.9902  1641.69   32.550  1614.23   51.810  1659.60   41.839  198.883   3.1958  201.706   2.5446 -2.823212 4.085110 
1 1 1    9    8  -29 o  159.664   1.8108  1039.44   23.567  1032.40   37.562  1044.02   30.266  159.071   2.8968  159.994   2.3207 -0.9230804 3.711763 
1 1 1    9    8  -28 o  159.382   1.6634  1035.70   21.611  1032.17   37.403  1037.47   26.479  159.056   2.8848  159.505   2.0365 -0.4489136 3.531208 
1 1 1    9    8  -27 o  251.218   2.0554  2573.54   42.090  2533.67   72.111  2594.15   51.837  249.138   3.5508  252.189   2.5216 -3.051544 4.355063 
1 1 1    9    8  -26 o   51.237   2.1435  107.243   8.9329   73.675   15.115  125.260   11.074   42.234   4.4578   55.363   2.4599 -13.12922 5.091455 
1 1 1    9    8  -25 o  187.437   1.7637  1432.43   26.948  1389.20   45.890  1455.19   33.293  184.520   3.0510  188.902   2.1621 -4.382523 3.739429 
1 1 1    9    8  -24 o  131.043   1.4916  700.078   15.933  688.544   24.306  708.768   21.098  129.936   2.2948  131.842   1.9631 -1.905197 3.019950 
1 1 1    9    8  -23 f   99.313   1.5068  402.095   12.199  383.729   18.398  416.502   16.295   97.001   2.3268  101.067   1.9780 -4.066093 3.053931 
1 1 1    9    8  -22 o  165.359   1.5652  1114.77   21.097  1118.77   32.378  1111.81   27.812  165.625   2.3982  165.123   2.0663 0.5017395 3.165568 
1 1 1    9    8  -21 o  126.849   1.4939  655.976   15.447  666.321   23.914  648.570   20.235  127.823   2.2951  126.119   1.9683 1.704224 3.023525 
1 1 1    9    8  -20 o  129.428   1.4969  682.919   15.793  684.596   24.385  681.707   20.728  129.564   2.3089  129.301   1.9666 0.2631226 3.032879 
1 1 1    9    8  -19 o  209.870   1.7263  1795.76   29.533  1831.84   45.758  1769.99   38.664  211.921   2.6488  208.333   2.2768 3.587875 3.492855 
1 1 1    9    8  -18 o  334.362   2.3285  4559.26   63.464  4544.72   96.811  4570.22   84.040  333.697   3.5591  334.689   3.0804 -0.9926453 4.707014 
1 1 1    9    8  -17 o  200.649   1.8170  1641.47   29.719  1641.59   51.429  1641.41   36.414  200.585   3.1454  200.627   2.2266 -0.4168701E-01 3.853710 
1 1 1    9    8  -16 o  206.743   1.8442  1742.70   31.079  1701.90   52.990  1764.09   38.372  204.236   3.1829  207.989   2.2633 -3.753204 3.905563 
1 1 1    9    8  -15 o  114.234   1.4894  531.984   13.869  534.396   21.205  530.180   18.333  114.475   2.2724  114.030   1.9723 0.4447784 3.009006 
1 1 1    9    8  -14 o  117.487   1.4898  562.711   14.268  572.704   21.995  555.451   18.747  118.507   2.2769  116.716   1.9704 1.790878 3.011131 
1 1 1    9    8  -13 o  301.813   2.5504  3715.12   62.745  3607.38   96.865  3793.01   82.359  297.260   3.9975  304.891   3.3138 -7.630371 5.192474 
1 1 1    9    8  -12 o  147.713   1.8050  889.580   21.734  849.750   33.545  918.394   28.532  144.332   2.8512  150.069   2.3324 -5.737015 3.683718 
1 1 1    9    8  -11 o   43.117   3.4776   76.356   12.119   92.122   19.939   67.118   15.262   47.185   5.2740   40.259   4.7416 6.926228 7.092070 
1 1 1    9    8  -10 o  208.246   2.6143  1768.71   44.378  1824.97   77.099  1740.83   54.269  211.393   4.4743  206.562   3.2230 4.831451 5.514251 
1 1 1    9    8   -9 o   70.733   1.9704  204.150   11.350  194.265   24.264  206.919   12.841   68.838   4.3463   71.200   2.2153 -2.362045 4.878314 
1 1 1    9    8   -8 o  275.818   3.0906  3103.55   69.488   0.0000   0.0000  3103.55   69.488  ?   ?   275.818   3.0906 0.000000 3.090649 
1 1 1    9    8   -7 o   77.650   1.9066  245.833   12.068  226.031   18.550  260.365   15.891   74.373   3.0664   79.866   2.4437 -5.492645 3.921035 
1 1 1    9    8   -6 o  116.918   1.7525  557.312   16.702  550.852   26.111  561.786   21.728  116.213   2.7564  117.375   2.2710 -1.161522 3.571411 
1 1 1    9    8   -5 o  148.885   1.7940  903.741   21.773  902.409   34.260  904.643   28.200  148.741   2.8256  148.944   2.3227 -0.2025909 3.657745 
1 1 1    9    8   -4 o  173.634   1.8803  1229.20   26.614  1245.09   42.289  1218.78   34.246  174.709   2.9694  172.877   2.4302 1.832138 3.837091 
1 1 1    9    8   -3 o   73.555   1.9433  220.743   11.641  232.280   18.599  213.314   14.926   75.399   3.0324   72.278   2.5374 3.120552 3.953960 
1 1 1    9    8   -2 o   78.946   1.8993  254.108   12.222  263.496   19.200  247.712   15.848   80.319   2.9376   77.897   2.4991 2.422127 3.856815 
1 1 1    9    8   -1 o   64.247   2.0810  168.478   10.884  179.368   17.254  161.280   14.027   66.230   3.2055   62.823   2.7458 3.406662 4.220731 
1 1 1    9    8    0 o  203.347   2.0047  1685.96   33.229  1666.41   52.174  1699.30   43.100  202.107   3.1669  204.124   2.5903 -2.016937 4.091324 
1 1 1    9    8    1 o  246.699   2.2280  2481.68   44.805  2557.44   72.218  2434.26   57.129  250.347   3.5389  244.293   2.8688 6.053894 4.555654 
1 1 1    9    8    2 o  270.605   2.3644  2986.12   52.155  2998.67   82.684  2977.84   67.213  271.065   3.7421  270.181   3.0519 0.8831787 4.828747 
1 1 1    9    8    3 o   92.305   1.6817  347.352   12.653  362.800   21.935  339.648   15.490   94.268   2.8579   91.269   2.0821 2.998917 3.535881 
1 1 1    9    8    4 o  307.517   2.5861  3856.76   64.827  3985.54  105.025  3777.50   82.396  312.455   4.1236  304.277   3.3220 8.177216 5.295234 
1 1 1    9    8    5 o   65.497   1.8927  175.050   10.095  167.881   14.178  182.421   14.376   64.099   2.7196   66.827   2.6443 -2.727180 3.793237 
1 1 1    9    8    6 o  208.844   1.8570  1778.26   31.614  1812.85   45.204  1745.14   44.230  210.830   2.6303  206.856   2.6231 3.974350 3.714705 
1 1 1    9    8    7 o  324.805   2.4573  4302.35   65.060  4297.33   91.945  4307.39   92.072  324.520   3.4758  324.899   3.4765 -0.3795471 4.916008 
1 1 1    9    8    8 o  261.777   2.3112  2794.46   49.319  2775.48   77.449  2807.40   63.964  260.785   3.6433  262.336   2.9912 -1.551025 4.713889 
1 1 1    9    8    9 o  142.969   1.7816  833.354   20.763  830.810   32.563  835.097   26.953  142.718   2.7990  143.104   2.3106 -0.3854218 3.629500 
1 1 1    9    8   10 o  201.402   1.9928  1653.89   32.717  1744.89   53.221  1598.61   41.480  206.807   3.1571  197.981   2.5703 8.825317 4.071028 
1 1 1    9    8   11 o  280.646   3.1319  3213.32   71.648  3146.61   86.235  3362.00  128.751  277.653   3.8102  286.770   5.5078 -9.117554 6.697281 
1 1 1    9    8   12 o  153.861   1.8267  965.188   22.910  965.398   35.806  965.043   29.812  153.840   2.8553  153.832   2.3774 0.8773804E-02 3.715458 
1 1 1    9    8   13 o  349.532   2.6044  4982.90   74.206  4959.14  104.458  5007.10  105.434  348.577   3.6762  350.257   3.6928 -1.679260 5.210741 
1 1 1    9    8   14 o  230.413   1.9622  2164.68   36.853  2200.01   52.494  2130.34   51.750  232.239   2.7729  228.533   2.7780 3.706909 3.925094 
1 1 1    9    8   15 o   90.937   1.6917  337.146   12.540  360.866   17.847  314.017   17.623   94.069   2.3275   87.713   2.4673 6.356033 3.391862 
1 1 1    9    8   16 o  234.028   1.8290  2233.03   34.891  2219.66   53.271  2243.07   46.173  233.271   2.8015  234.523   2.4153 -1.251892 3.698925 
1 1 1    9    8   17 o  234.092   1.9743  2234.41   37.673  2149.08   63.650  2280.42   46.739  229.484   3.4026  236.465   2.4248 -6.980682 4.178210 
1 1 1    9    8   18 o  225.144   1.7908  2066.71   32.866  2026.51   49.748  2097.83   43.780  222.892   2.7381  226.804   2.3681 -3.911514 3.620048 
1 1 1    9    8   19 o   97.869   1.5255  390.485   12.170  393.614   18.946  388.287   15.880   98.242   2.3658   97.584   1.9963 0.6583862 3.095517 
1 1 1    9    8   20 o   76.553   1.6342  238.923   10.198  244.981   15.967  234.749   13.253   77.460   2.5321   75.843   2.1459 1.617172 3.319131 
1 1 1    9    8   21 o   78.741   1.6097  252.777   10.332  268.125   16.222  242.301   13.402   81.044   2.4584   77.054   2.1358 3.989281 3.256562 
1 1 1    9    8   22 o  160.774   1.5605  1053.80   20.451  1079.38   31.767  1035.69   26.726  162.683   2.3955  159.371   2.0573 3.312622 3.157633 
1 1 1    9    8   23 f  289.768   2.0982  3423.93   49.560  3408.00   75.608  3435.94   65.624  288.995   3.2095  290.220   2.7740 -1.225586 4.242176 
1 1 1    9    8   24 o  169.357   1.5837  1169.34   21.863  1129.12   33.107  1200.44   29.114  166.386   2.4410  171.577   2.0816 -5.190216 3.208041 
1 1 1    9    8   25 o  106.073   1.6175  458.721   13.986  432.669   24.153  471.861   17.154  102.942   2.8812  107.574   1.9562 -4.631500 3.482531 
1 1 1    9    8   26 o   97.352   1.6340  386.394   12.967  399.843   23.163  380.255   15.649   98.957   2.8746   96.568   1.9880 2.388916 3.495036 
1 1 1    9    8   27 o  175.479   1.7225  1255.49   24.639  1238.42   42.593  1264.07   30.207  174.218   2.9992  176.062   2.1047 -1.844437 3.664041 
1 1 1    9    8   28 o  196.404   1.8053  1572.83   28.902  1697.06   52.543  1518.93   34.608  203.928   3.1608  192.991   2.1999 10.93753 3.851007 
1 1 1    9    8   29 o  128.984   1.7561  678.336   18.463  688.289   29.976  672.251   23.437  129.886   2.8312  128.389   2.2394 1.497971 3.609805 
1 1 1    9    8   30 o  164.412   1.6869  1102.12   22.608  1070.07   31.947  1134.28   31.998  161.972   2.4197  166.764   2.3538 -4.791962 3.375700 
1 1 1    9    8   31 o  306.691   2.5823  3836.93   64.558  3853.55  103.187  3826.24   82.755  307.149   4.1213  306.178   3.3158 0.9716492 5.289587 
1 1 1    9    8   32 o  201.548   1.8364  1656.36   30.171  1651.37   52.818  1658.77   36.758  201.151   3.2212  201.673   2.2360 -0.5215912 3.921222 
1 1 1    9    8   33 o   82.226   1.7127  275.672   11.479  302.873   21.254  264.468   13.640   86.098   3.0331   80.503   2.0804 5.594589 3.677956 
1 1 1    9    8   34 o   38.611   2.4689   61.059   7.7298   57.206   12.433   63.487   9.8691   37.189   4.1731   39.320   3.1043 -2.131069 5.201118 
1 1 1    9    8   35 o   61.402   1.8148  153.868   9.0734  140.236   14.290  163.076   11.744   58.545   3.0045   63.191   2.2838 -4.645729 3.773971 
1 1 1    9    8   36 o  157.990   1.4742  1017.65   18.985  1011.75   27.544  1022.99   26.204  157.505   2.1454  158.383   2.0296 -0.8773956 2.953313 
1 1 1    9    8   37 o   60.368   1.7774  148.730   8.7368  141.912   13.344  153.845   11.559   58.909   2.7868   61.371   2.3146 -2.462055 3.622696 
1 1 1    9    8   38 o  123.827   1.4349  625.125   14.483  626.684   21.378  623.803   19.691  123.960   2.1157  123.680   1.9531 0.2792892 2.879369 
1 1 1    9    8   39 o  167.279   1.6147  1140.92   22.017  1137.51   35.143  1143.13   28.249  166.979   2.5819  167.420   2.0699 -0.4411011 3.309185 
1 1 1    9    8   40 o  125.615   1.4436  643.317   14.781  609.298   21.449  674.086   20.399  122.225   2.1528  128.567   1.9464 -6.342270 2.902269 
1 1 1    9    8   41 o  157.086   1.4895  1006.07   19.073  1001.52   27.909  1010.06   26.125  156.700   2.1849  157.374   2.0365 -0.6742554 2.986879 
1 1 1    9    8   42 o  284.081   1.9559  3291.17   45.292  3331.21   65.408  3254.28   62.778  285.713   2.8084  282.405   2.7271 3.308136 3.914636 
1 1 1    9    8   43 o  179.969   1.5551  1320.59   22.814  1279.89   32.813  1358.68   31.741  177.135   2.2725  182.515   2.1335 -5.379974 3.117064 
1 1 1    9    8   44 o  241.204   1.7737  2372.45   34.873  2369.43   50.231  2375.27   48.454  240.983   2.5571  241.289   2.4635 -0.3060150 3.550737 
1 1 1    9    8   45 o  181.784   1.6858  1347.49   24.980  1303.23   39.383  1377.28   32.312  178.706   2.7035  183.755   2.1572 -5.048141 3.458678 
1 1 1    9    8   46 o  115.131   1.6774  540.512   15.742  547.539   28.809  537.521   18.796  115.772   3.0555  114.800   2.0086 0.9714813 3.656543 
1 1 1    9    8   47 o   60.200   2.0584  147.993   10.086  128.111   17.705  157.544   12.272   55.853   3.9137   62.092   2.4293 -6.239738 4.606325 
1 1 1    9    8   48 o   75.421   1.8401  231.984   11.313  262.049   19.657  217.094   13.833   80.060   3.0174   72.909   2.3305 7.150948 3.812631 
1 1 1    9    8   49 o   68.092   2.3380  189.393   12.958  190.812   25.175  188.881   15.114   68.137   4.5589   67.972   2.7333 0.1644287 5.315465 
1 1 1    9    8   50 f  171.590   2.3725  1201.32   33.184  1214.32   48.323  1189.72   45.649  172.413   3.4384  170.675   3.2811 1.738129 4.752705 
1 1 1    9    8   51 o  142.171   2.0522  824.480   23.783  877.843   40.107  795.540   29.536  146.600   3.3562  139.619   2.5952 6.980423 4.242549 
1 1 1    9    8   52 o  153.109   2.2806  956.449   28.463  943.163   41.743  967.994   38.912  151.948   3.3702  153.962   3.1005 -2.014099 4.579484 
1 1 1    9    8   53 o   65.565   2.0728  175.540   11.064  175.828   17.906  175.362   14.072   65.518   3.3640   65.493   2.6412 0.2454376E-01 4.276989 
1 1 1    9    8   54 o   87.640   1.8029  313.273   12.880  317.950   20.472  310.209   16.570   88.199   2.8513   87.158   2.3343 1.040359 3.684958 
1 1 1    9    8   55 o   76.972   1.8683  241.672   11.722  231.905   18.822  247.860   14.983   75.287   3.0735   77.897   2.3624 -2.610252 3.876463 
1 1 1    9    8   56 o   52.032   2.1298  110.649   9.0139  126.796   16.777  104.095   10.688   55.559   3.7259   50.428   2.6089 5.130352 4.548461 
1 1 1    9    8   57 o   73.719   1.7563  221.673   10.554  202.581   18.082  231.538   12.997   70.340   3.1616   75.298   2.1197 -4.958191 3.806417 
1 1 1    9    8   58 o   48.437   2.5479   96.053   10.024  101.969   20.841   94.273   11.434   49.566   5.2373   47.949   2.9395 1.617191 6.005801 
1 1 1    9    8   59 o   57.155   2.2780  133.549   10.592  140.813   21.134  131.112   12.240   58.447   4.4699   56.599   2.6604 1.847797 5.201719 
1 1 1    9    8   60 o   87.181   1.7624  310.061   12.524  309.928   19.942  310.148   16.095   87.056   2.8139   87.138   2.2678 -0.8190155E-01 3.613975 
1 1 1    9    8   61 o   45.734   2.2129   85.575   8.2252   79.165   12.909   89.955   10.672   43.833   3.6459   46.840   2.8079 -3.006405 4.601873 
1 1 1    9    8   62 o   36.995   2.5702   56.170   7.7027   72.827   12.653   46.362   9.7091   42.013   3.7335   33.464   3.6167 8.549049 5.198029 
1 1 1    9    8   63 o  135.036   1.5753  743.835   17.340  751.234   24.209  736.039   24.848  135.652   2.1893  134.265   2.2704 1.387222 3.153989 
1 1 1    9    8   64 o  124.555   1.6702  632.950   16.958  649.768   22.371  610.234   25.999  126.155   2.1754  122.211   2.6098 3.943954 3.397585 
1 1 1    9    8   65 o   38.925   2.3642   62.109   7.4661   68.313   12.713   58.843   9.2246   40.643   3.8845   37.813   3.0178 2.829849 4.918943 
1 1 1    9    8   66 o   90.614   1.7086  335.036   12.620  327.464   17.241  343.776   18.523   89.506   2.3651   91.697   2.4805 -2.190659 3.427300 
1 1 1    9    8   67 o   37.352   2.4617   57.251   7.4534   61.822   12.330   54.619   9.3565   38.621   3.9732   36.394   3.1860 2.227196 5.092821 
1 1 1    9    8   68 o   55.847   2.0158  127.508   9.1614  122.500   14.152  131.121   12.020   54.610   3.1931   56.575   2.6134 -1.965679 4.126276 
1 1 1    9    8   69 o   90.806   1.5828  336.464   11.716  335.609   17.350  337.180   15.885   90.597   2.3513   90.858   2.1448 -0.2617035 3.182636 
1 1 1    9    8   70 o  109.000   1.8250  485.037   16.215  478.984   19.857  497.149   28.090  108.272   2.2499  110.133   3.1322 -1.861473 3.856504 
1 1 1    9    8   71 o   62.655   2.3680  160.697   12.072  164.443   15.053  153.947   20.210   63.311   2.9248   61.060   4.0838 2.250992 5.023135 
1 1 1    9    8   72 o  102.220   1.9044  426.738   15.869  388.159   19.173  510.635   28.274   97.430   2.4141  111.586   3.1114 -14.15620 3.938160 
1 1 1    9    8   73 o   50.902   3.1441  106.629   12.982  114.932   17.255   95.797   19.708   52.692   4.0483   47.841   5.1337 4.850891 6.537879 
1 1 1    9    8   74 o   18.284   6.7299   11.366   13.194   19.759   15.473 -10.9961   25.257   22.110   7.3480   18.033   8.1302 4.076651 10.95874 
1 1 1    9    8   75 o  103.405   2.3370  437.464   19.698  437.955   28.535  437.017   27.227  103.190   3.3970  103.120   3.2430 0.6936646E-01 4.696504 
1 1 1    9    8   76 o   66.556   2.2475  181.428   12.176  188.645   15.137  168.200   20.493   67.787   2.7451   63.748   3.9633 4.039627 4.821118 
1 1 1    9    8   77 o   84.971   1.9430  295.168   13.458  287.425   16.576  310.143   23.053   83.743   2.4308   86.801   3.2639 -3.058304 4.069609 
1 1 1    9    8   78 o  116.812   1.7896  557.691   17.040  577.742   21.254  521.615   28.509  118.810   2.1946  112.613   3.1087 6.197281 3.805273 
1 1 1    9    8   79 o   81.442   1.9734  271.333   13.101  273.021   16.307  268.262   21.999   81.576   2.4551   80.632   3.3544 0.9438019 4.156883 
1 1 1    9    8   80 o   32.693   3.4981   44.592   9.1775   52.396   11.406   30.265   15.455   35.344   4.0310   26.138   7.0802 9.206661 8.147279 
1 1 1    9    8   81 o   14.000   5.3267   5.9855   8.4083   8.0294   10.471   2.2757   14.108   15.796   5.9594   15.547   6.5436 0.2492676 8.850637 
1 1 1    9    8   82 o   18.810   5.3024   15.332   8.4780   16.316   10.811   13.761   13.663   19.569   6.1106   19.102   6.8755 0.4670830 9.198463 
1 1 1    9    8   83 o   97.420   2.1664  389.187   17.204  413.713   25.221  367.845   23.527  100.080   3.0953   94.378   3.0622 5.702797 4.354094 
1 1 1    9    8   84 o   53.777   2.7840  119.459   12.163  112.528   17.395  126.089   17.012   51.766   4.1574   54.935   3.8229 -3.169464 5.647834 
1 1 1    9    8   85 o   18.485   5.9197   14.519   10.089   4.9702   14.346   23.861   14.190   16.274   6.7029   23.137   6.9596 -6.863049 9.662519 
1 1 1    9    8   86 o   46.665   2.7934   90.202   10.577   79.970   13.913  104.216   16.282   43.571   3.9604   49.748   4.0500 -6.177010 5.664572 
1 1 1    9    8   87 o   79.750   1.9479  260.951   12.663  264.621   17.794  257.185   18.025   80.008   2.7324   78.843   2.8091 1.165115 3.918817 
1 1 1    9    8   88 o   65.425   2.1377  176.131   11.385  162.141   15.640  191.904   16.607   62.449   3.0818   67.984   3.0041 -5.534988 4.303756 
1 1 1    9    8   89 o   20.387   4.9741   18.436   8.1916   10.175   10.688   30.196   12.753   16.515   6.0608   25.796   6.1516 -9.280653 8.635729 
1 1 1    9    8   90 o   31.823   3.4305   42.754   8.7585   36.561   11.661   50.770   13.266   28.780   5.1602   34.140   4.9079 -5.359510 7.121473 
1 1 1    9    8   91 o   73.736   1.8501  223.441   11.111  219.316   14.752  228.850   16.892   72.809   2.4893   74.233   2.7966 -1.423958 3.743982 
1 1 1    9    8   92 o   22.040   4.8741   21.638   8.5242   21.718   10.452   21.479   14.731   21.839   5.7814   21.741   7.1674 0.9735489E-01 9.208519 
1 1 1    9    8   93 o   44.973   2.5964   84.085   9.4777   79.838   11.571   92.744   16.522   43.563   3.2826   46.404   4.4213 -2.840607 5.506621 
1 1 1    9    8   94 o   37.003   3.0021   57.459   8.9775   52.391   10.983   67.664   15.585   34.969   3.9203   39.246   4.9839 -4.276798 6.340983 
1 1 1    9    8   95 f   13.367   5.0307   6.1886   7.4519  -2.4635   9.8300   17.879   11.426   11.567   5.1540   19.834   6.2943 -8.266777 8.135238 
1 1 1    9    8   96 o   12.502   4.9782   4.1792   7.6135   4.8137   10.046   3.3230   11.670   13.945   5.6602   14.198   5.9622 -0.2525692 8.221025 
1 1 1    9    8   97 f   13.277   5.0772   5.9126   7.6636   9.9573   10.046   0.2832   11.852   15.940   5.8716   13.369   5.8176 2.571409 8.265555 
1 1 1    9    8   98 o   20.475   5.1035   19.175   8.4875   16.630   10.237   24.769   15.179   19.017   5.9476   22.611   7.2632 -3.593740 9.387647 
1 1 1    9    8   99 o   18.233   5.5752   15.279   9.0550   6.5849   11.400   30.141   14.905   14.986   6.0488   24.708   7.0528 -9.722248 9.291389 
1 1 1    9    8  100 o   12.672   5.0019   4.8556   7.6235   3.3374   10.120   6.8472   11.591   13.288   5.5644   15.077   6.0944 -1.789005 8.252552 
1 1 1    9    8  101 o   21.488   4.6462   21.059   7.9006   25.338   10.563   15.627   11.903   23.110   5.6545   18.417   6.4378 4.692074 8.568512 
1 1 1    9    8  102 o   29.815   3.4039   38.423   8.1246   38.366   10.788   38.498   12.349   29.071   4.7139   28.623   5.4923 0.4481888 7.237798 
1 1 1    9    8  103 o   45.219   2.4196   85.780   8.8860   83.010   11.746   89.488   13.588   43.947   3.3030   45.337   3.7092 -1.390266 4.966679 
1 1 1    9    8  104 o   9.8759   4.4397  -2.1248   7.4705  -0.6878   9.7390  -4.1789   11.644   11.661   5.1666   11.804   5.3992 -0.1436825 7.472919 
1 1 1    9    8  105 o   19.054   4.9874   17.270   7.8354   12.869   10.070   24.021   12.474   16.650   5.9128   21.608   6.5307 -4.957722 8.809737 
1 1 1    9    8  106 o   10.506   4.6249  -0.2893   7.6840  -4.6930   10.069   5.8503   11.890   10.738   4.9513   14.362   6.0237 -3.624060 7.797469 
1 1 1    9    8  107 o   27.329   3.8947   33.618   8.4312   39.427   10.999   25.342   13.128   28.943   4.8324   21.726   6.7258 7.216274 8.281794 
1 1 1    9    8  108 o   12.550   5.1793   4.4738   8.5880  -0.2637   12.029   9.3990   12.265   12.625   5.6580   15.420   6.2560 -2.795310 8.435081 
1 1 1    9    8  109 o   15.276   5.8165   10.417   10.030   21.752   12.390 -11.1372   17.085   20.117   6.5701   12.651   6.0236 7.466428 8.913432 
1 1 1    9    8  110 o   31.331   4.2997   45.276   10.692   26.646   13.261   79.880   18.074   22.000   6.7508   40.140   5.6824 -18.13983 8.824005 
1 1 1    9    8  111 o   20.208   5.9443   21.351   10.443   24.383   13.199   16.275   17.077   20.938   6.7773   17.954   7.3450 2.983927 9.994015 
1 1 1    9    8  112 o   24.993   5.3924   31.238   10.663   22.022   13.174   48.749   18.159   19.864   6.7807   28.740   7.6260 -8.875961 10.20457 
1 1 1    9    8  113 o   11.616   5.2312  -0.8073   10.423  -1.4498   13.067   0.3168   17.283   12.592   5.7441   14.321   6.5607 -1.729511 8.719951 
1 1 1    9    8  114 o   11.254   5.2121  -4.1651   11.335 -12.7263   12.898   24.873   23.754   10.520   5.0681   19.871   8.4334 -9.351024 9.839141 
1 1 1    9    8  115 o   24.710   5.5580   31.251   10.923   22.048   13.583   48.096   18.377   19.604   6.8755   28.005   7.7751 -8.400297 10.37904 
1 1 1    9    8  116 o   15.029   5.8571   10.415   10.340   20.991   12.898  -8.6090   17.298   19.232   6.7029   12.781   6.0786 6.450736 9.048621 
1 1 1    9    8  117 o   13.125   5.5783   5.0225   10.418   6.7005   13.033   2.0518   17.340   14.356   6.1735   14.432   6.5964 -0.7567978E-01 9.034638 
1 1 1    9    8  118 o   36.304   4.5934   63.040   13.289   31.121   18.296   98.688   19.335   21.621   7.9305   44.178   5.4871 -22.55724 9.643714 
1 1 1    9    8  119 o   18.565   6.4496   19.422   11.936   17.533   16.938   21.285   16.823   17.696   7.2855   18.754   7.4218 -1.057613 10.40005 
1 1 1    9    8  120 o   13.250   5.8189   3.7263   12.096   2.2815   16.980   5.2151   17.236   14.311   6.5360   14.922   6.7229 -0.6107922 9.376371 
1 1 1    9    9    0 o  255.691   2.9527  2666.03   61.543  2758.29  108.935  2622.78   74.585  259.941   5.1411  253.577   3.6084 6.364456 6.281027 
1 1 1    9    9    1 o   89.131   1.8495  323.920   13.437  318.782   21.092  327.430   17.433   88.345   2.9330   89.568   2.3899 -1.223068 3.783366 
1 1 1    9    9    2 o  152.400   1.8287  946.996   22.718  952.078   50.546  945.710   25.431  152.634   4.0662  152.288   2.0486 0.3455963 4.553059 
1 1 1    9    9    3 o  103.810   1.7971  439.396   15.207  470.977   33.980  431.487   17.005  107.330   3.8904  102.867   2.0280 4.463364 4.387197 
1 1 1    9    9    4 o  169.875   1.8819  1176.65   26.060  1173.57   57.784  1177.44   29.197  169.511   4.1819  169.922   2.1079 -0.4114838 4.683132 
1 1 1    9    9    5 o  311.544   2.6195  3959.16   66.523  3735.56  142.296  4021.70   75.253  302.137   5.7777  313.961   2.9404 -11.82410 6.482875 
1 1 1    9    9    6 o  184.988   1.7732  1395.28   26.738  1344.99   45.347  1422.08   33.105  181.556   3.0641  186.739   2.1748 -5.183029 3.757450 
1 1 1    9    9    7 o  280.986   2.2205  3219.85   50.860  3226.79   88.180  3216.39   62.259  281.121   3.8481  280.793   2.7201 0.3275146 4.712364 
1 1 1    9    9    8 o  172.236   1.7238  1209.52   24.202  1167.90   41.108  1231.59   29.941  169.186   2.9807  173.785   2.1136 -4.598740 3.654046 
1 1 1    9    9    9 f  123.979   1.6230  626.677   16.402  580.443   27.631  651.832   20.381  119.279   2.8419  126.433   1.9776 -7.154533 3.462214 
1 1 1    9    9   10 f  165.315   1.6994  1114.25   22.900  1107.02   39.331  1117.96   28.167  164.719   2.9293  165.575   2.0869 -0.8554535 3.596634 
1 1 1    9    9   11 o  175.139   1.7296  1250.65   24.692  1245.03   42.527  1253.50   30.328  174.682   2.9866  175.323   2.1221 -0.6410675 3.663769 
1 1 1    9    9   12 f   73.586   1.6649  220.770   9.9863  214.245   15.153  225.781   13.278   72.427   2.5707   74.374   2.1925 -1.947197 3.378696 
1 1 1    9    9   13 o  109.426   1.6141  488.193   14.398  472.982   24.457  496.260   17.812  107.637   2.7898  110.317   1.9807 -2.680573 3.421396 
1 1 1    9    9   14 o   19.151   5.2347   15.477   8.4037   17.828   13.125   13.843   10.941   21.104   6.7514   18.801   6.1759 2.302711 9.150014 
1 1 1    9    9   15 o  119.215   1.6192  579.444   15.735  612.263   27.483  563.440   19.192  122.506   2.7522  117.546   2.0029 4.959183 3.403839 
1 1 1    9    9   16 o  130.347   1.6235  692.714   17.250  704.539   29.933  686.834   21.108  131.411   2.7944  129.781   1.9952 1.629623 3.433591 
1 1 1    9    9   17 o  140.287   1.8077  802.461   20.672  772.305   31.753  824.642   27.233  137.583   2.8313  142.191   2.3495 -4.608444 3.679225 
1 1 1    9    9   18 o  128.840   2.0212  676.921   21.227  650.655   29.083  706.865   31.053  126.283   2.8253  131.621   2.8943 -5.338356 4.044609 
1 1 1    9    9   19 o  223.620   2.1311  2039.34   38.847  1979.88   49.161  2138.19   63.387  220.293   2.7377  228.870   3.3976 -8.576416 4.363335 
1 1 1    9    9   20 o  107.693   2.8378  473.527   24.890  473.527   24.890   0.0000   0.0000  107.693   2.8378  ?   ?  0.000000 2.837808 
1 1 1    9    9   21 o  258.291   2.1064  2720.73   44.349  2728.51   62.889  2713.04   62.550  258.582   2.9836  257.849   2.9759 0.7331848 4.214021 
1 1 1    9    9   22 o  108.411   1.8043  479.230   15.945  476.742   20.656  482.897   25.081  108.113   2.3438  108.753   2.8317 -0.6402054 3.675841 
1 1 1    9    9   23 o  157.747   1.8438  1014.69   23.709  1006.88   30.716  1026.20   37.290  157.114   2.3984  158.586   2.8847 -1.472534 3.751449 
1 1 1    9    9   24 o   68.837   2.0524  193.416   11.504  194.122   15.164  192.459   17.657   68.926   2.7041   68.597   3.1662 0.3288193 4.163830 
1 1 1    9    9   25 o  172.084   1.8909  1207.55   26.524  1213.36   34.551  1199.21   41.389  172.468   2.4577  171.427   2.9619 1.040894 3.848743 
1 1 1    9    9   26 o   84.585   1.7490  291.728   12.059  301.635   17.260  282.280   16.855   85.955   2.4659   83.148   2.4897 2.807228 3.504138 
1 1 1    9    9   27 o  315.383   2.4172  4057.41   62.142  3971.14   86.573  4149.10   89.253  311.883   3.4053  318.790   3.4346 -6.907410 4.836599 
1 1 1    9    9   28 o  156.982   1.6876  1004.82   21.595  929.849   36.205  1046.22   26.905  150.948   2.9425  160.167   2.0608 -9.218933 3.592330 
1 1 1    9    9   29 o  284.507   2.0781  3301.18   48.194  3280.04   73.492  3317.13   63.838  283.473   3.1805  285.125   2.7467 -1.652802 4.202323 
1 1 1    9    9   30 o  261.774   1.9695  2794.55   42.026  2809.95   64.623  2783.27   55.321  262.391   3.0214  261.189   2.5984 1.202301 3.985007 
1 1 1    9    9   31 o   15.644   5.1217   9.6000   7.5270  -2.9406   11.894   17.977   9.7213   13.192   5.7825   20.624   5.6272 -7.431690 8.068575 
1 1 1    9    9   32 o   84.052   1.6321  288.062   11.182  288.116   17.602  288.026   14.479   83.995   2.5739   84.009   2.1160 -0.1342010E-01 3.332062 
1 1 1    9    9   33 o  103.754   1.4922  438.902   12.621  416.254   18.529  458.502   17.237  101.019   2.2502  106.031   1.9944 -5.011612 3.006775 
1 1 1    9    9   34 o  206.967   1.6424  1746.60   27.709  1711.82   39.473  1780.39   38.906  204.849   2.3639  208.917   2.2846 -4.068390 3.287462 
1 1 1    9    9   35 o   92.139   1.5473  346.151   11.621  327.712   17.199  361.640   15.764   89.598   2.3570   94.164   2.0537 -4.566544 3.126189 
1 1 1    9    9   36 o  301.034   2.1888  3696.43   53.710  3609.52   82.173  3761.25   70.968  297.309   3.3907  303.576   2.8679 -6.266693 4.440876 
1 1 1    9    9   37 o   66.829   1.9380  182.295   10.546  187.088   18.306  179.914   12.903   67.607   3.3320   66.365   2.3890 1.241478 4.099933 
1 1 1    9    9   38 o  139.853   1.6200  797.535   18.468  784.049   30.104  805.673   23.385  138.612   2.6643  140.546   2.0412 -1.934158 3.356344 
1 1 1    9    9   39 o  205.447   1.6670  1721.16   27.917  1665.23   39.914  1774.72   39.060  202.026   2.4237  208.573   2.2974 -6.546799 3.339538 
1 1 1    9    9   40 o  141.408   1.5890  815.371   18.316  795.558   28.375  829.523   23.982  139.632   2.4929  142.607   2.0630 -2.975128 3.235847 
1 1 1    9    9   41 o   36.024   3.0409   53.358   8.8462   74.621   14.105   39.572   11.357   42.524   4.1208   30.752   4.6781 11.77204 6.234235 
1 1 1    9    9   42 o  228.478   1.8902  2129.10   35.203  2039.10   53.977  2195.72   46.440  223.484   2.9629  231.970   2.4560 -8.485825 3.848468 
1 1 1    9    9   43 o  173.963   2.0703  1234.48   29.357  1181.91   49.168  1263.61   36.597  170.081   3.5465  175.965   2.5514 -5.884384 4.368883 
1 1 1    9    9   44 o   66.961   2.3771  183.177   12.954  212.172   21.624  166.945   16.179   71.960   3.6988   63.864   3.1173 8.095955 4.837213 
1 1 1    9    9   45 o  139.498   1.8037  793.635   20.510  760.206   30.488  821.274   27.721  136.470   2.7406  141.871   2.3971 -5.400375 3.641048 
1 1 1    9    9   46 o  111.432   1.6858  506.385   15.313  491.121   21.331  522.614   21.996  109.707   2.3853  113.170   2.3843 -3.462914 3.372654 
1 1 1    9    9   47 o  123.288   1.5582  619.831   15.660  604.858   22.970  632.833   21.405  121.751   2.3144  124.547   2.1084 -2.795898 3.130793 
1 1 1    9    9   48 o  267.491   2.1918  2919.41   47.792  2903.01   67.356  2936.03   67.821  266.595   3.0995  268.105   3.1033 -1.510986 4.386038 
1 1 1    9    9   49 o  194.878   1.7363  1548.96   27.582  1561.13   43.980  1541.07   35.411  195.536   2.7593  194.336   2.2353 1.200485 3.551113 
1 1 1    9    9   50 o   12.407   5.0155   2.6728   7.8511   13.340   15.224  -1.1915   9.1635   19.878   7.2433   11.901   5.1474 7.977551 8.885992 
1 1 1    9    9   51 o   47.938   2.3378   94.017   9.1076   85.625   16.387   97.767   10.955   45.501   4.4762   48.851   2.7624 -3.350288 5.259950 
1 1 1    9    9   52 o  169.749   1.6560  1175.29   22.914  1140.02   36.375  1198.49   29.504  167.083   2.6707  171.377   2.1120 -4.293839 3.404906 
1 1 1    9    9   53 o   75.336   1.8020  231.528   11.066  208.444   19.242  242.934   13.526   71.328   3.3186   77.124   2.1536 -5.796486 3.956193 
1 1 1    9    9   54 o   71.817   2.1278  210.675   12.443  214.345   18.871  207.853   16.550   72.340   3.2082   71.271   2.8544 1.069099 4.294248 
1 1 1    9    9   55 o   70.064   2.1802  200.558   12.436  207.005   18.830  195.570   16.562   71.078   3.2586   69.117   2.9464 1.961365 4.393207 
1 1 1    9    9   56 o  129.822   1.7902  687.620   18.945  714.792   28.006  664.697   25.723  132.288   2.5972  127.581   2.4735 4.707100 3.586538 
1 1 1    9    9   57 o   86.904   1.6694  308.099   11.826  300.947   20.416  311.711   14.508   85.757   2.9248   87.392   2.0365 -1.634727 3.563991 
1 1 1    9    9   58 o  124.019   1.5759  627.423   15.931  602.200   26.036  642.517   20.141  121.405   2.6309  125.471   1.9693 -4.065445 3.286318 
1 1 1    9    9   59 o   53.277   2.1708  116.081   9.4080  141.068   21.320  110.039   10.484   58.443   4.5101   51.842   2.4882 6.601234 5.150930 
1 1 1    9    9   60 o   48.851   2.2897   97.671   9.0923  122.960   16.314   86.276   10.951   54.663   3.6827   45.839   2.9463 8.823330 4.716265 
1 1 1    9    9   61 o   77.969   1.6913  248.053   10.749  245.934   16.002  249.795   14.511   77.539   2.5351   78.173   2.2796 -0.6338196 3.409331 
1 1 1    9    9   62 o   34.813   2.6817   49.834   7.5513   52.938   12.714   48.142   9.3864   35.619   4.4775   34.117   3.4213 1.501823 5.634986 
1 1 1    9    9   63 o  175.748   1.5567  1260.23   22.301  1239.76   32.539  1278.37   30.625  174.207   2.2914  176.928   2.1235 -2.720367 3.124064 
1 1 1    9    9   64 o   98.648   1.5894  397.089   12.781  407.515   18.792  388.114   17.434   99.870   2.3083   97.475   2.1942 2.394714 3.184809 
1 1 1    9    9   65 o   99.477   1.6013  403.829   12.984  375.185   21.681  419.849   16.214   95.723   2.7815  101.399   1.9616 -5.675995 3.403634 
1 1 1    9    9   66 o   90.118   1.6201  331.451   11.901  372.749   21.177  312.388   14.388   95.410   2.7257   87.455   2.0183 7.955063 3.391584 
1 1 1    9    9   67 o   84.957   1.6736  294.630   11.590  303.893   20.449  290.246   14.068   86.099   2.9178   84.291   2.0475 1.808052 3.564545 
1 1 1    9    9   68 o   26.169   3.5464   28.619   7.3705   22.915   15.502   30.285   8.3781   23.392   7.3192   26.859   3.9440 -3.467239 8.314184 
1 1 1    9    9   69 o  102.825   1.6582  431.675   13.898  433.368   20.650  430.273   18.791  102.919   2.4615  102.583   2.2472 0.3355331 3.332963 
1 1 1    9    9   70 o   65.350   1.7525  174.547   9.3272  176.209   15.653  173.632   11.614   65.496   2.9394   65.128   2.1908 0.3685532 3.666067 
1 1 1    9    9   71 o   32.674   2.4785   43.953   6.5520   51.003   12.752   41.424   7.6373   34.821   4.6053   31.639   2.9970 3.182123 5.494644 
1 1 1    9    9   72 o  137.667   1.7697  774.312   19.859  808.222   28.958  744.203   27.286  140.473   2.5289  134.807   2.4831 5.666260 3.544179 
1 1 1    9    9   73 o   96.534   1.8243  380.859   14.355  368.939   20.494  392.341   20.114   94.830   2.6538   97.824   2.5245 -2.993790 3.662754 
1 1 1    9    9   74 o   29.738   3.9131   37.136   9.2557   32.873   13.542   40.873   12.679   27.419   6.2044   30.900   5.2195 -3.481562 8.107892 
1 1 1    9    9   75 o   70.720   2.1857  204.978   12.585  222.500   20.917  195.036   15.756   73.370   3.5076   68.857   2.8130 4.512970 4.496271 
1 1 1    9    9   76 o   17.741   5.7588   12.948   9.5263   19.829   13.047   5.0908   13.942   21.541   6.7109   16.309   6.6500 5.231863 9.447700 
1 1 1    9    9   77 o  117.062   1.7522  560.446   16.720  547.299   24.021  572.803   23.287  115.458   2.5523  118.161   2.4177 -2.703659 3.515637 
1 1 1    9    9   78 o   74.238   1.9764  225.856   11.950  231.593   17.547  220.894   16.318   74.949   2.8774   73.235   2.7383 1.714539 3.972174 
1 1 1    9    9   79 o   25.359   4.3195   27.542   8.6092   26.856   12.913   28.091   11.551   24.567   6.3891   25.244   5.7431 -0.6771412 8.590910 
1 1 1    9    9   80 o   77.592   1.7845  246.484   11.287  246.206   15.405  246.807   16.584   77.359   2.4460   77.397   2.6324 -0.3730774E-01 3.593376 
1 1 1    9    9   81 o   50.524   2.2582  105.048   9.2767   99.597   12.692  111.298   13.593   48.955   3.1981   51.750   3.2385 -2.794495 4.551384 
1 1 1    9    9   82 o   55.961   2.2586  128.903   10.282  109.403   14.492  148.663   14.589   51.190   3.4940   59.885   2.9982 -8.695087 4.604054 
1 1 1    9    9   83 o   57.100   2.1087  134.100   9.7982  132.336   13.179  136.281   14.651   56.505   2.8707   57.246   3.1518 -0.7410774 4.263187 
1 1 1    9    9   84 o   52.921   2.1636  115.327   9.3138  105.895   12.648  126.503   13.767   50.436   3.0911   55.148   3.0747 -4.711243 4.359882 
1 1 1    9    9   85 o   56.334   2.0385  130.569   9.3456  136.290   12.748  123.923   13.741   57.344   2.7351   54.543   3.1034 2.800709 4.136675 
1 1 1    9    9   86 o   16.766   5.3305   12.075   8.1918   7.0342   10.178   21.348   13.804   15.019   5.8228   21.767   6.9194 -6.747134 9.043454 
1 1 1    9    9   87 o   43.145   2.6340   77.309   9.2195   83.989   11.516   65.383   15.387   44.792   3.1745   38.733   4.9891 6.058765 5.913412 
1 1 1    9    9   88 o   11.866   4.9536   1.8932   7.9838   8.2773   9.9776  -9.4697   13.311   15.381   5.8141   12.101   5.6195 3.279659 8.085922 
1 1 1    9    9   89 o   38.230   2.6352   60.861   8.1619   75.860   11.213   43.961   11.903   42.472   3.2640   31.679   4.7561 10.79275 5.768340 
1 1 1    9    9   90 o   15.721   4.9140   10.738   6.9895   15.608   9.8571   5.8144   9.9123   18.677   5.8353   14.315   5.6867 4.362716 8.147923 
1 1 1    9    9   91 o   11.148   4.6362   1.8258   6.9547   3.0904   9.7265   0.5029   9.9481   13.216   5.4884   12.494   5.3834 0.7220917 7.687921 
1 1 1    9    9   92 o   15.603   5.1927   10.370   7.7267   13.854   10.255   5.7957   11.751   17.809   5.9834   15.037   6.1150 2.772166 8.555362 
1 1 1    9    9   93 o   38.983   2.7301   63.579   8.6206   63.671   11.295   63.450   13.341   38.635   3.6291   38.198   4.3627 0.4363785 5.674850 
1 1 1    9    9   94 f   22.774   4.0801   22.797   7.2963   33.796   10.414   12.192   10.226   27.501   4.8210   16.945   5.9638 10.55627 7.668746 
1 1 1    9    9   95 o   41.829   2.4427   72.946   8.2925   66.722   11.927   78.770   11.537   39.400   3.7593   43.077   3.3110 -3.677826 5.009460 
1 1 1    9    9   96 o   29.272   3.2271   36.589   7.5725   30.174   10.948   42.474   10.486   25.528   5.4282   31.075   4.2507 -5.547268 6.894496 
1 1 1    9    9   97 o   37.768   2.5530   59.820   7.8136   56.704   11.215   62.759   10.892   36.119   3.8693   38.206   3.5377 -2.086506 5.242737 
1 1 1    9    9   98 o   28.537   3.2997   35.044   7.5344   30.205   10.887   39.492   10.438   25.380   5.4269   29.716   4.4453 -4.336725 7.015153 
1 1 1    9    9   99 o   24.960   3.8276   27.497   7.5397   23.598   10.898   31.076   10.442   22.024   5.9367   25.835   5.1393 -3.811071 7.852200 
1 1 1    9    9  100 o   50.603   2.0968  106.664   8.6302   95.927   12.506  116.424   11.924   47.262   3.2664   52.434   2.8000 -5.172264 4.302226 
1 1 1    9    9  101 o   36.841   2.7700   57.684   8.2577   64.297   13.346   53.583   10.511   37.768   4.4185   34.914   3.7522 2.854362 5.796762 
1 1 1    9    9  102 f   8.7027   4.0813  -5.9648   7.3071   3.6126   12.012 -11.5906   9.2064   13.828   5.9363   8.8874   4.2816 4.940907 7.319257 
1 1 1    9    9  103 o   11.392   4.7590   2.7371   7.3761   11.325   11.760  -2.8333   9.4708   16.139   6.2584   10.830   4.9209 5.309354 7.961334 
1 1 1    9    9  104 o   29.471   3.3763   38.181   7.9649   32.231   12.899   41.847   10.126   24.860   6.3451   30.285   4.2158 -5.425497 7.617900 
1 1 1    9    9  105 o   51.621   2.7948  114.135   11.716   86.276   14.419  168.283   20.102   43.663   4.0991   61.125   4.0574 -17.46178 5.767576 
1 1 1    9    9  106 o   10.387   4.7965  -4.3132   9.4985 -20.1179   11.632   27.322   16.456   9.0034   4.4381   21.603   7.5685 -12.59997 8.773748 
1 1 1    9    9  107 o   21.940   5.5647   24.353   9.9655   15.879   12.261   40.850   17.107   17.606   6.4862   26.438   7.5589 -8.832096 9.960300 
1 1 1    9    9  108 o   17.771   5.9555   16.301   10.161   20.766   12.725   8.4462   16.877   19.471   6.6638   15.949   6.9414 3.521416 9.622318 
1 1 1    9    9  109 o   15.485   5.8182   11.340   9.9583   3.8742   12.441   24.653   16.613   13.621   5.9433   20.337   7.5398 -6.716351 9.600646 
1 1 1    9    9  110 o   14.456   6.0378   7.5272   11.870   5.3524   16.302   9.9815   17.317   15.014   6.6667   16.237   7.0493 -1.222915 9.702469 
1 1 1    9    9  111 o   36.052   4.1222   59.943   11.897   61.008   15.103   58.202   19.311   34.915   5.4874   31.348   7.6301 3.566196 9.398442 
1 1 1    9    9  112 o   12.704   5.5297   3.0960   10.715   0.1100   13.393   8.4058   17.859   12.947   5.8707   15.858   7.0128 -2.910132 9.145686 
1 1 1    9    9  113 o   12.528   5.5784   1.4466   11.495  -4.1683   14.991   9.4610   17.910   12.660   5.9071   16.024   7.0571 -3.364241 9.203134 
1 1 1    9    9  114 o   16.253   6.5104   13.109   13.099   11.287   15.370   17.943   25.039   16.001   6.7871   18.244   8.1707 -2.243052 10.62194 
1 1 1    9    9  115 o   24.108   6.1996   31.836   12.251   43.173   16.240   16.864   18.663   26.880   7.2477   17.604   7.4734 9.276394 10.41060 
1 1 1    9    9  116 o   25.688   5.3987   33.809   10.945   43.869   13.597   15.292   18.447   28.671   6.0101   17.154   7.3601 11.51714 9.502275 
1 1 1    9    9  117 o   12.309   5.8499  -7.8560   15.961  -7.8560   15.961   0.0000   0.0000   12.309   5.8499  ?   ?  0.000000 5.849859 
1 1 1    9    9  118 o   16.139   7.3706   7.8496   21.595   7.8496   21.595   0.0000   0.0000   16.139   7.3706  ?   ?  0.000000 7.370642 
1 1 1   10    0 -132 o   10.408   7.3295 -15.0429   24.448 -15.0429   24.448 -15.0429   24.448   10.408   7.3295   10.408   7.3295 0.000000 0.000000 
1 1 1   10    0 -131 o   10.529   6.7708   4.0933   13.312   4.0933   13.312   4.0933   13.312   10.529   6.7708   10.529   6.7708 0.000000 0.000000 
1 1 1   10    0 -130 o   11.254   7.0748   6.5988   13.592   6.5988   13.592   6.5988   13.592   11.254   7.0748   11.254   7.0748 0.000000 0.000000 
1 1 1   10    0 -129 o   13.433   7.6951   13.252   13.345   13.252   13.345   13.252   13.345   13.433   7.6951   13.433   7.6951 0.000000 0.000000 
1 1 1   10    0 -128 o   8.9680   6.0706  -2.9722   13.125  -2.9722   13.125  -2.9722   13.125   8.9680   6.0706   8.9680   6.0706 0.000000 0.000000 
1 1 1   10    0 -127 o   8.4062   5.7887  -6.1916   13.095  -6.1916   13.095  -6.1916   13.095   8.4062   5.7887   8.4062   5.7887 0.000000 0.000000 
1 1 1   10    0 -126 f   48.596   3.9942  103.184   15.568  103.184   15.568  103.184   15.568   48.596   3.9942   48.596   3.9942 0.000000 0.000000 
1 1 1   10    0 -125 o   15.114   8.0434   16.971   13.415   16.971   13.415   16.971   13.415   15.114   8.0434   15.114   8.0434 0.000000 0.000000 
1 1 1   10    0 -124 o   24.146   7.7571   33.670   13.468   33.670   13.468   33.670   13.468   24.146   7.7571   24.146   7.7571 0.000000 0.000000 
1 1 1   10    0 -123 o   11.636   7.4819   5.1532   16.249   5.1532   16.249   5.1532   16.249   11.636   7.4819   11.636   7.4819 0.000000 0.000000 
1 1 1   10    0 -122 o   19.659   7.8003   24.405   12.055   24.405   12.055   24.405   12.055   19.659   7.8003   19.659   7.8003 0.000000 0.000000 
1 1 1   10    0 -121 o   16.331   8.2227   19.234   13.501   19.234   13.501   19.234   13.501   16.331   8.2227   16.331   8.2227 0.000000 0.000000 
1 1 1   10    0 -120 f   7.0020   4.9076  -9.3094   10.574  -9.3094   10.574  -9.3094   10.574   7.0020   4.9076   7.0020   4.9076 0.000000 0.000000 
1 1 1   10    0 -119 o   7.9985   5.4519  -4.6221   10.968  -4.6221   10.968  -4.6221   10.968   7.9985   5.4519   7.9985   5.4519 0.000000 0.000000 
1 1 1   10    0 -118 o   41.417   3.8853   74.239   12.836   74.239   12.836   74.239   12.836   41.417   3.8853   41.417   3.8853 0.000000 0.000000 
1 1 1   10    0 -117 o   5.6650   4.0992 -18.3041   9.9978 -18.3041   9.9978 -18.3041   9.9978   5.6650   4.0992   5.6650   4.0992 0.000000 0.000000 
1 1 1   10    0 -116 o   37.389   3.8678   60.514   11.474   60.514   11.474   60.514   11.474   37.389   3.8678   37.389   3.8678 0.000000 0.000000 
1 1 1   10    0 -115 o   34.227   4.3880   51.718   11.692   51.718   11.692   51.718   11.692   34.227   4.3880   34.227   4.3880 0.000000 0.000000 
1 1 1   10    0 -114 o   35.222   4.7312   55.099   12.896   55.099   12.896   55.099   12.896   35.222   4.7312   35.222   4.7312 0.000000 0.000000 
1 1 1   10    0 -113 o   38.053   3.8342   62.187   11.594   62.187   11.594   62.187   11.594   38.053   3.8342   38.053   3.8342 0.000000 0.000000 
1 1 1   10    0 -112 o   19.397   7.1507   21.563   10.464   21.563   10.464   21.563   10.464   19.397   7.1507   19.397   7.1507 0.000000 0.000000 
1 1 1   10    0 -111 o   43.547   3.4087   79.958   11.924   79.958   11.924   79.958   11.924   43.547   3.4087   43.547   3.4087 0.000000 0.000000 
1 1 1   10    0 -110 f   49.573   3.0943  102.605   12.391  102.605   12.391  102.605   12.391   49.573   3.0943   49.573   3.0943 0.000000 0.000000 
1 1 1   10    0 -109 o   31.605   5.1992   45.056   12.306   45.056   12.306   45.056   12.306   31.605   5.1992   31.605   5.1992 0.000000 0.000000 
1 1 1   10    0 -108 o   12.424   6.9094   9.3416   10.350   9.3416   10.350   9.3416   10.350   12.424   6.9094   12.424   6.9094 0.000000 0.000000 
1 1 1   10    0 -107 o   23.519   7.3001   29.261   12.258   29.261   12.258   29.261   12.258   23.519   7.3001   23.519   7.3001 0.000000 0.000000 
1 1 1   10    0 -106 o   50.550   3.4258  106.885   13.965  106.885   13.965  106.885   13.965   50.550   3.4258   50.550   3.4258 0.000000 0.000000 
1 1 1   10    0 -105 o   6.4386   4.6114 -17.2512   11.257 -17.2512   11.257 -17.2512   11.257   6.4386   4.6114   6.4386   4.6114 0.000000 0.000000 
1 1 1   10    0 -104 o   52.475   2.8736  114.112   12.207  114.112   12.207  114.112   12.207   52.475   2.8736   52.475   2.8736 0.000000 0.000000 
1 1 1   10    0 -103 f   27.405   5.2965   34.431   10.559   34.431   10.559   34.431   10.559   27.405   5.2965   27.405   5.2965 0.000000 0.000000 
1 1 1   10    0 -102 o   19.619   7.1593   21.462   10.546   21.462   10.546   21.462   10.546   19.619   7.1593   19.619   7.1593 0.000000 0.000000 
1 1 1   10    0 -101 o   10.946   6.5024   5.7348   10.113   5.7348   10.113   5.7348   10.113   10.946   6.5024   10.946   6.5024 0.000000 0.000000 
1 1 1   10    0 -100 o   27.077   5.5581   33.892   10.840   33.892   10.840   33.892   10.840   27.077   5.5581   27.077   5.5581 0.000000 0.000000 
1 1 1   10    0  -99 o   12.777   7.0116   9.6612   10.499   9.6612   10.499   9.6612   10.499   12.777   7.0116   12.777   7.0116 0.000000 0.000000 
1 1 1   10    0  -98 o   14.246   7.7190   12.226   12.560   12.226   12.560   12.226   12.560   14.246   7.7190   14.246   7.7190 0.000000 0.000000 
1 1 1   10    0  -97 o   24.573   9.0110   33.750   16.662   33.750   16.662   33.750   16.662   24.573   9.0110   24.573   9.0110 0.000000 0.000000 
1 1 1   10    0  -96 o   12.240   7.2615   7.0939   12.579   7.0939   12.579   7.0939   12.579   12.240   7.2615   12.240   7.2615 0.000000 0.000000 
1 1 1   10    0  -95 o   53.723   3.5235  119.769   15.276  119.769   15.276  119.769   15.276   53.723   3.5235   53.723   3.5235 0.000000 0.000000 
1 1 1   10    0  -94 o   7.8256   5.3470  -6.5089   10.689  -6.5089   10.689  -6.5089   10.689   7.8256   5.3470   7.8256   5.3470 0.000000 0.000000 
1 1 1   10    0  -93 o   37.382   4.1203   59.326   12.167   59.326   12.167   59.326   12.167   37.382   4.1203   37.382   4.1203 0.000000 0.000000 
1 1 1   10    0  -92 o   26.027   6.5435   32.614   12.007   32.614   12.007   32.614   12.007   26.027   6.5435   26.027   6.5435 0.000000 0.000000 
1 1 1   10    0  -91 f  118.907   2.2749  577.794   22.032  577.794   22.032  577.794   22.032  118.907   2.2749  118.907   2.2749 0.000000 0.000000 
1 1 1   10    0  -90 o   13.978   7.8431   10.933   13.481   10.933   13.481   10.933   13.481   13.978   7.8431   13.978   7.8431 0.000000 0.000000 
1 1 1   10    0  -89 o  138.362   2.4703  782.204   27.841  782.204   27.841  782.204   27.841  138.362   2.4703  138.362   2.4703 0.000000 0.000000 
1 1 1   10    0  -88 o   99.357   2.5003  403.696   20.221  403.696   20.221  403.696   20.221   99.357   2.5003   99.357   2.5003 0.000000 0.000000 
1 1 1   10    0  -87 o  122.103   2.1458  608.827   21.342  608.827   21.342  608.827   21.342  122.103   2.1458  122.103   2.1458 0.000000 0.000000 
1 1 1   10    0  -86 o  112.729   2.1759  519.012   19.978  519.012   19.978  519.012   19.978  112.729   2.1759  112.729   2.1759 0.000000 0.000000 
1 1 1   10    0  -85 o   67.101   2.6018  184.571   14.182  184.571   14.182  184.571   14.182   67.101   2.6018   67.101   2.6018 0.000000 0.000000 
1 1 1   10    0  -84 o   48.171   3.2232   96.011   12.524   96.011   12.524   96.011   12.524   48.171   3.2232   48.171   3.2232 0.000000 0.000000 
1 1 1   10    0  -83 o  248.236   2.5811  2515.14   52.216  2515.14   52.216  2515.14   52.216  248.236   2.5811  248.236   2.5811 0.000000 0.000000 
1 1 1   10    0  -82 o   24.784   6.5719   29.873   11.471   29.873   11.471   29.873   11.471   24.784   6.5719   24.784   6.5719 0.000000 0.000000 
1 1 1   10    0  -81 f   42.234   3.6858   74.485   12.457   74.485   12.457   74.485   12.457   42.234   3.6858   42.234   3.6858 0.000000 0.000000 
1 1 1   10    0  -80 o   18.797   7.6721   20.214   11.559   20.214   11.559   20.214   11.559   18.797   7.6721   18.797   7.6721 0.000000 0.000000 
1 1 1   10    0  -79 o  273.652   2.7212  3055.94   60.688  3055.94   60.688  3055.94   60.688  273.652   2.7212  273.652   2.7212 0.000000 0.000000 
1 1 1   10    0  -78 o  120.360   2.1353  591.315   20.935  591.315   20.935  591.315   20.935  120.360   2.1353  120.360   2.1353 0.000000 0.000000 
1 1 1   10    0  -77 o  155.487   2.5124  986.835   31.825  986.835   31.825  986.835   31.825  155.487   2.5124  155.487   2.5124 0.000000 0.000000 
1 1 1   10    0  -76 o  339.192   3.1562  4695.32   87.249  4695.32   87.249  4695.32   87.249  339.192   3.1562  339.192   3.1562 0.000000 0.000000 
1 1 1   10    0  -75 o  154.925   2.1606  979.272   27.274  979.272   27.274  979.272   27.274  154.925   2.1606  154.925   2.1606 0.000000 0.000000 
1 1 1   10    0  -74 o   18.956   7.7282   20.512   11.733   20.512   11.733   20.512   11.733   18.956   7.7282   18.956   7.7282 0.000000 0.000000 
1 1 1   10    0  -73 o   90.435   2.9975  334.695   22.042  334.695   22.042  334.695   22.042   90.435   2.9975   90.435   2.9975 0.000000 0.000000 
1 1 1   10    0  -72 o   30.348   8.9466   46.307   19.237   46.307   19.237   46.307   19.237   30.348   8.9466   30.348   8.9466 0.000000 0.000000 
1 1 1   10    0  -71 o  256.837   5.3889  2698.68  112.710  2698.68  112.710  2698.68  112.710  256.837   5.3889  256.837   5.3889 0.000000 0.000000 
1 1 1   10    0  -70 o  189.853   4.6749  1474.31   72.249  1474.31   72.249  1474.31   72.249  189.853   4.6749  189.853   4.6749 0.000000 0.000000 
1 1 1   10    0  -69 o  175.041   4.4999  1253.19   64.111  1253.19   64.111  1253.19   64.111  175.041   4.4999  175.041   4.4999 0.000000 0.000000 
1 1 1   10    0  -68 o   32.017   2.1575   42.360   5.5711   42.360   5.5711   42.360   5.5711   32.017   2.1575   32.017   2.1575 0.000000 0.000000 
1 1 1   10    0  -67 o   63.004   1.9981  162.322   10.238  162.322   10.238  162.322   10.238   63.004   1.9981   63.004   1.9981 0.000000 0.000000 
1 1 1   10    0  -66 o  251.061   2.2107  2570.46   45.235  2570.46   45.235  2570.46   45.235  251.061   2.2107  251.061   2.2107 0.000000 0.000000 
1 1 1   10    0  -65 o   60.086   2.0375  147.695   9.9535  147.695   9.9535  147.695   9.9535   60.086   2.0375   60.086   2.0375 0.000000 0.000000 
1 1 1   10    0  -64 o   37.670   3.0191   58.976   9.1293   58.976   9.1293   58.976   9.1293   37.670   3.0191   37.670   3.0191 0.000000 0.000000 
1 1 1   10    0  -63 o   7.2015   4.4776   1.3461   5.2905   1.3461   5.2905   1.3461   5.2905   7.2015   4.4776   7.2015   4.4776 0.000000 0.000000 
1 1 1   10    0  -62 o  265.499   2.5914  2874.97   56.072  2874.97   56.072  2874.97   56.072  265.499   2.5914  265.499   2.5914 0.000000 0.000000 
1 1 1   10    0  -61 o  232.705   2.7129  2208.94   51.445  2208.94   51.445  2208.94   51.445  232.705   2.7129  232.705   2.7129 0.000000 0.000000 
1 1 1   10    0  -60 o   76.742   1.9397  240.548   12.117  240.548   12.117  240.548   12.117   76.742   1.9397   76.742   1.9397 0.000000 0.000000 
1 1 1   10    0  -59 o  220.351   2.3104  1980.19   41.488  1980.19   41.488  1980.19   41.488  220.351   2.3104  220.351   2.3104 0.000000 0.000000 
1 1 1   10    0  -58 o  225.088   2.3334  2066.23   42.803  2066.23   42.803  2066.23   42.803  225.088   2.3334  225.088   2.3334 0.000000 0.000000 
1 1 1   10    0  -57 o  144.756   1.9366  854.668   22.842  854.668   22.842  854.668   22.842  144.756   1.9366  144.756   1.9366 0.000000 0.000000 
1 1 1   10    0  -56 o  116.552   1.8670  554.184   17.728  554.184   17.728  554.184   17.728  116.552   1.8670  116.552   1.8670 0.000000 0.000000 
1 1 1   10    0  -55 o  305.784   3.2891  3814.30   81.963  3814.30   81.963  3814.30   81.963  305.784   3.2891  305.784   3.2891 0.000000 0.000000 
1 1 1   10    0  -54 o  164.492   2.0164  1103.51   27.028  1103.51   27.028  1103.51   27.028  164.492   2.0164  164.492   2.0164 0.000000 0.000000 
1 1 1   10    0  -53 o  108.814   1.8755  483.092   16.625  483.092   16.625  483.092   16.625  108.814   1.8755  108.814   1.8755 0.000000 0.000000 
1 1 1   10    0  -52 o  229.915   2.3643  2155.67   44.300  2155.67   44.300  2155.67   44.300  229.915   2.3643  229.915   2.3643 0.000000 0.000000 
1 1 1   10    0  -51 o   64.767   2.0721  171.522   10.914  171.522   10.914  171.522   10.914   64.767   2.0721   64.767   2.0721 0.000000 0.000000 
1 1 1   10    0  -50 o  244.673   3.4998  2442.52   69.769  2442.52   69.769  2442.52   69.769  244.673   3.4998  244.673   3.4998 0.000000 0.000000 
1 1 1   10    0  -49 o  105.393   2.8229  453.813   24.212  453.813   24.212  453.813   24.212  105.393   2.8229  105.393   2.8229 0.000000 0.000000 
1 1 1   10    0  -48 o  578.825   6.9632 13682.17  328.433 13682.17  328.433 13682.17  328.433  578.825   6.9632  578.825   6.9632 0.000000 0.000000 
1 1 1   10    0  -47 o  104.873   2.8003  449.322   23.901  449.322   23.901  449.322   23.901  104.873   2.8003  104.873   2.8003 0.000000 0.000000 
1 1 1   10    0  -46 o  408.144   4.1571  6794.77  138.275  6794.77  138.275  6794.77  138.275  408.144   4.1571  408.144   4.1571 0.000000 0.000000 
1 1 1   10    0  -45 o   44.247   2.6022   80.633   9.3107   80.633   9.3107   80.633   9.3107   44.247   2.6022   44.247   2.6022 0.000000 0.000000 
1 1 1   10    0  -44 o  149.290   1.9562  908.925   23.797  908.925   23.797  908.925   23.797  149.290   1.9562  149.290   1.9562 0.000000 0.000000 
1 1 1   10    0  -43 o  520.316   4.4546 11041.48  188.905 11041.48  188.905 11041.48  188.905  520.316   4.4546  520.316   4.4546 0.000000 0.000000 
1 1 1   10    0  -42 f   54.201   2.5897  120.572   11.382  120.572   11.382  120.572   11.382   54.201   2.5897   54.201   2.5897 0.000000 0.000000 
1 1 1   10    0  -41 o  247.592   2.8633  2499.90   57.770  2499.90   57.770  2499.90   57.770  247.592   2.8633  247.592   2.8633 0.000000 0.000000 
1 1 1   10    0  -40 o  294.639   3.2175  3540.16   77.255  3540.16   77.255  3540.16   77.255  294.639   3.2175  294.639   3.2175 0.000000 0.000000 
1 1 1   10    0  -39 o  588.176   4.9836 14109.06  238.899 14109.06  238.899 14109.06  238.899  588.176   4.9836  588.176   4.9836 0.000000 0.000000 
1 1 1   10    0  -38 f  674.964   5.6628 18581.52  311.515 18581.52  311.515 18581.52  311.515  674.964   5.6628  674.964   5.6628 0.000000 0.000000 
1 1 1   10    0  -37 o   49.999   2.6375  102.746   10.681  102.746   10.681  102.746   10.681   49.999   2.6375   49.999   2.6375 0.000000 0.000000 
1 1 1   10    0  -36 f  855.576   7.1005 29862.08  495.125 29862.08  495.125 29862.08  495.125  855.576   7.1005  855.576   7.1005 0.000000 0.000000 
1 1 1   10    0  -35 o  284.415   2.4112  3297.91   55.893  3297.91   55.893  3297.91   55.893  284.415   2.4112  284.415   2.4112 0.000000 0.000000 
1 1 1   10    0  -34 o   98.339   1.9786  394.640   15.846  394.640   15.846  394.640   15.846   98.339   1.9786   98.339   1.9786 0.000000 0.000000 
1 1 1   10    0  -33 o  662.798   4.9720 17912.96  268.593 17912.96  268.593 17912.96  268.593  662.798   4.9720  662.798   4.9720 0.000000 0.000000 
1 1 1   10    0  -32 o   46.740   2.3927   89.744   9.0612   89.744   9.0612   89.744   9.0612   46.740   2.3927   46.740   2.3927 0.000000 0.000000 
1 1 1   10    0  -31 o  346.825   2.8080  4903.97   79.374  4903.97   79.374  4903.97   79.374  346.825   2.8080  346.825   2.8080 0.000000 0.000000 
1 1 1   10    0  -30 o   73.465   1.8628  220.406   11.139  220.406   11.139  220.406   11.139   73.465   1.8628   73.465   1.8628 0.000000 0.000000 
1 1 1   10    0  -29 o  217.780   2.0481  1933.64   36.351  1933.64   36.351  1933.64   36.351  217.780   2.0481  217.780   2.0481 0.000000 0.000000 
1 1 1   10    0  -28 o  624.261   4.7034 15889.25  239.308 15889.25  239.308 15889.25  239.308  624.261   4.7034  624.261   4.7034 0.000000 0.000000 
1 1 1   10    0  -27 o  629.276   5.2970 16147.00  271.667 16147.00  271.667 16147.00  271.667  629.276   5.2970  629.276   5.2970 0.000000 0.000000 
1 1 1   10    0  -26 o  741.755   7.1506 22441.15  432.266 22441.15  432.266 22441.15  432.266  741.755   7.1506  741.755   7.1506 0.000000 0.000000 
1 1 1   10    0  -25 o  977.240   9.3283 38963.16  742.933 38963.16  742.933 38963.16  742.933  977.240   9.3283  977.240   9.3283 0.000000 0.000000 
1 1 1   10    0  -24 o  137.266   2.3686  768.670   26.485  768.670   26.485  768.670   26.485  137.266   2.3686  137.266   2.3686 0.000000 0.000000 
1 1 1   10    0  -23 o  218.412   2.7131  1945.30   48.286  1945.30   48.286  1945.30   48.286  218.412   2.7131  218.412   2.7131 0.000000 0.000000 
1 1 1   10    0  -22 o  352.280   3.7067  5060.29  106.415  5060.29  106.415  5060.29  106.415  352.280   3.7067  352.280   3.7067 0.000000 0.000000 
1 1 1   10    0  -21 o  156.975   1.8609  1004.76   23.804  1004.76   23.804  1004.76   23.804  156.975   1.8609  156.975   1.8609 0.000000 0.000000 
1 1 1   10    0  -20 o  323.688   2.6797  4271.42   70.693  4271.42   70.693  4271.42   70.693  323.688   2.6797  323.688   2.6797 0.000000 0.000000 
1 1 1   10    0  -19 o  310.708   2.9008  3935.99   73.455  3935.99   73.455  3935.99   73.455  310.708   2.9008  310.708   2.9008 0.000000 0.000000 
1 1 1   10    0  -18 o   60.055   3.0973  148.177   15.070  148.177   15.070  148.177   15.070   60.055   3.0973   60.055   3.0973 0.000000 0.000000 
1 1 1   10    0  -17 f  398.607   3.5283  6477.96  114.621  6477.96  114.621  6477.96  114.621  398.607   3.5283  398.607   3.5283 0.000000 0.000000 
1 1 1   10    0  -16 o  356.170   3.2180  5172.01   93.412  5172.01   93.412  5172.01   93.412  356.170   3.2180  356.170   3.2180 0.000000 0.000000 
1 1 1   10    0  -15 o   11.633   6.5489   7.3119   9.4381   7.3119   9.4381   7.3119   9.4381   11.633   6.5489   11.633   6.5489 0.000000 0.000000 
1 1 1   10    0  -14 o  642.536   5.4034 16833.91  282.967 16833.91  282.967 16833.91  282.967  642.536   5.4034  642.536   5.4034 0.000000 0.000000 
1 1 1   10    0  -13 o  358.485   3.2292  5239.45   94.345  5239.45   94.345  5239.45   94.345  358.485   3.2292  358.485   3.2292 0.000000 0.000000 
1 1 1   10    0  -12 o  398.219   3.5179  6465.32  114.174  6465.32  114.174  6465.32  114.174  398.219   3.5179  398.219   3.5179 0.000000 0.000000 
1 1 1   10    0  -11 o  140.546   1.9349  805.571   22.158  805.571   22.158  805.571   22.158  140.546   1.9349  140.546   1.9349 0.000000 0.000000 
1 1 1   10    0  -10 o  196.170   2.9686  1569.62   47.446  1569.62   47.446  1569.62   47.446  196.170   2.9686  196.170   2.9686 0.000000 0.000000 
1 1 1   10    0   -9 o  252.217   3.4584  2594.39   71.073  2594.39   71.073  2594.39   71.073  252.217   3.4584  252.217   3.4584 0.000000 0.000000 
1 1 1   10    0   -8 o  847.512   7.0359 29291.09  485.999 29291.09  485.999 29291.09  485.999  847.512   7.0359  847.512   7.0359 0.000000 0.000000 
1 1 1   10    0   -7 o  286.887   3.1594  3355.94   73.865  3355.94   73.865  3355.94   73.865  286.887   3.1594  286.887   3.1594 0.000000 0.000000 
1 1 1   10    0   -6 o  657.802   6.3697 17645.71  341.477 17645.71  341.477 17645.71  341.477  657.802   6.3697  657.802   6.3697 0.000000 0.000000 
1 1 1   10    0   -5 o  931.366   8.8909 35383.37  674.862 35383.37  674.862 35383.37  674.862  931.366   8.8909  931.366   8.8909 0.000000 0.000000 
1 1 1   10    0   -4 o  922.862   8.8102 34739.75  662.631 34739.75  662.631 34739.75  662.631  922.862   8.8102  922.862   8.8102 0.000000 0.000000 
1 1 1   10    0   -3 o  210.553   2.5633  1807.76   43.980  1807.76   43.980  1807.76   43.980  210.553   2.5633  210.553   2.5633 0.000000 0.000000 
1 1 1   10    0   -2 o  431.848   5.3230  7605.86  187.317  7605.86  187.317  7605.86  187.317  431.848   5.3230  431.848   5.3230 0.000000 0.000000 
1 1 1   10    0   -1 o  271.962   3.6844  3016.49   81.646  3016.49   81.646  3016.49   81.646  271.962   3.6844  271.962   3.6844 0.000000 0.000000 
1 1 1   10    0    1 o  716.705   8.4665 20954.57  494.472 20954.57  494.472 20954.57  494.472  716.705   8.4665  716.705   8.4665 0.000000 0.000000 
1 1 1   10    0    2 o  682.310   8.0829 18990.84  449.416 18990.84  449.416 18990.84  449.416  682.310   8.0829  682.310   8.0829 0.000000 0.000000 
1 1 1   10    0    3 o  267.282   3.6434  2913.57   79.348  2913.57   79.348  2913.57   79.348  267.282   3.6434  267.282   3.6434 0.000000 0.000000 
1 1 1   10    0    4 o  243.479   3.4255  2417.80   67.956  2417.80   67.956  2417.80   67.956  243.479   3.4255  243.479   3.4255 0.000000 0.000000 
1 1 1   10    0    5 o  808.880   7.7637 26685.30  511.798 26685.30  511.798 26685.30  511.798  808.880   7.7637  808.880   7.7637 0.000000 0.000000 
1 1 1   10    0    6 o   51.135   3.0128  107.686   12.458  107.686   12.458  107.686   12.458   51.135   3.0128   51.135   3.0128 0.000000 0.000000 
1 1 1   10    0    7 o  1352.16   12.822 74622.43  1413.02 74622.43  1413.02 74622.43  1413.02  1352.16   12.822  1352.16   12.822 0.000000 0.000000 
1 1 1   10    0    8 o  860.780   8.2414 30221.29  578.148 30221.29  578.148 30221.29  578.148  860.780   8.2414  860.780   8.2414 0.000000 0.000000 
1 1 1   10    0    9 o  278.998   3.7489  3174.57   85.225  3174.57   85.225  3174.57   85.225  278.998   3.7489  278.998   3.7489 0.000000 0.000000 
1 1 1   10    0   10 o  200.941   2.5206  1646.52   41.272  1646.52   41.272  1646.52   41.272  200.941   2.5206  200.941   2.5206 0.000000 0.000000 
1 1 1   10    0   11 o  103.492   2.2620  437.176   19.062  437.176   19.062  437.176   19.062  103.492   2.2620  103.492   2.2620 0.000000 0.000000 
1 1 1   10    0   12 o  913.245   10.693 34033.82  795.789 34033.82  795.789 34033.82  795.789  913.245   10.693  913.245   10.693 0.000000 0.000000 
1 1 1   10    0   13 o  658.671   6.3851 17692.59  342.753 17692.59  342.753 17692.59  342.753  658.671   6.3851  658.671   6.3851 0.000000 0.000000 
1 1 1   10    0   14 o  497.425   4.9355 10089.40  200.078 10089.40  200.078 10089.40  200.078  497.425   4.9355  497.425   4.9355 0.000000 0.000000 
1 1 1   10    0   15 o  382.727   3.9410  5972.72  122.921  5972.72  122.921  5972.72  122.921  382.727   3.9410  382.727   3.9410 0.000000 0.000000 
1 1 1   10    0   16 o  328.613   3.4941  4403.13   93.572  4403.13   93.572  4403.13   93.572  328.613   3.4941  328.613   3.4941 0.000000 0.000000 
1 1 1   10    0   17 f  265.331   3.0051  2870.64   64.977  2870.64   64.977  2870.64   64.977  265.331   3.0051  265.331   3.0051 0.000000 0.000000 
1 1 1   10    0   18 o  146.907   2.3552  880.325   28.187  880.325   28.187  880.325   28.187  146.907   2.3552  146.907   2.3552 0.000000 0.000000 
1 1 1   10    0   19 o  410.927   4.1902  6885.38  140.325  6885.38  140.325  6885.38  140.325  410.927   4.1902  410.927   4.1902 0.000000 0.000000 
1 1 1   10    0   20 o  106.885   2.4420  466.376   21.252  466.376   21.252  466.376   21.252  106.885   2.4420  106.885   2.4420 0.000000 0.000000 
1 1 1   10    0   21 o  248.837   2.9111  2524.90   59.030  2524.90   59.030  2524.90   59.030  248.837   2.9111  248.837   2.9111 0.000000 0.000000 
1 1 1   10    0   22 o  398.280   4.0894  6468.14  132.732  6468.14  132.732  6468.14  132.732  398.280   4.0894  398.280   4.0894 0.000000 0.000000 
1 1 1   10    0   23 o   73.444   2.9325  220.913   17.493  220.913   17.493  220.913   17.493   73.444   2.9325   73.444   2.9325 0.000000 0.000000 
1 1 1   10    0   24 o   75.515   3.5740  234.004   21.887  234.004   21.887  234.004   21.887   75.515   3.5740   75.515   3.5740 0.000000 0.000000 
1 1 1   10    0   25 o   25.098   9.2920   34.419   17.629   34.419   17.629   34.419   17.629   25.098   9.2920   25.098   9.2920 0.000000 0.000000 
1 1 1   10    0   26 o  582.470   6.9924 13839.76  331.890 13839.76  331.890 13839.76  331.890  582.470   6.9924  582.470   6.9924 0.000000 0.000000 
1 1 1   10    0   27 o   25.865   7.2930   33.017   13.311   33.017   13.311   33.017   13.311   25.865   7.2930   25.865   7.2930 0.000000 0.000000 
1 1 1   10    0   28 o  327.426   4.2611  4372.48  113.686  4372.48  113.686  4372.48  113.686  327.426   4.2611  327.426   4.2611 0.000000 0.000000 
1 1 1   10    0   29 o  626.760   6.1029 16020.99  311.733 16020.99  311.733 16020.99  311.733  626.760   6.1029  626.760   6.1029 0.000000 0.000000 
1 1 1   10    0   30 o  338.158   4.3653  4663.87  120.284  4663.87  120.284  4663.87  120.284  338.158   4.3653  338.158   4.3653 0.000000 0.000000 
1 1 1   10    0   31 o  510.963   6.1960 10650.09  257.984 10650.09  257.984 10650.09  257.984  510.963   6.1960  510.963   6.1960 0.000000 0.000000 
1 1 1   10    0   32 o   95.694   2.8075  374.221   21.857  374.221   21.857  374.221   21.857   95.694   2.8075   95.694   2.8075 0.000000 0.000000 
1 1 1   10    0   33 o  109.963   2.7617  493.807   24.720  493.807   24.720  493.807   24.720  109.963   2.7617  109.963   2.7617 0.000000 0.000000 
1 1 1   10    0   34 o  161.446   2.8644  1063.45   37.669  1063.45   37.669  1063.45   37.669  161.446   2.8644  161.446   2.8644 0.000000 0.000000 
1 1 1   10    0   35 o  503.817   6.1204 10355.18  251.274 10355.18  251.274 10355.18  251.274  503.817   6.1204  503.817   6.1204 0.000000 0.000000 
1 1 1   10    0   36 f  541.435   6.5346 11960.46  288.311 11960.46  288.311 11960.46  288.311  541.435   6.5346  541.435   6.5346 0.000000 0.000000 
1 1 1   10    0   37 o   43.312   4.2587   78.672   14.678   78.672   14.678   78.672   14.678   43.312   4.2587   43.312   4.2587 0.000000 0.000000 
1 1 1   10    0   38 f  104.459   2.8015  445.742   23.816  445.742   23.816  445.742   23.816  104.459   2.8015  104.459   2.8015 0.000000 0.000000 
1 1 1   10    0   39 o  176.671   2.9713  1273.41   42.763  1273.41   42.763  1273.41   42.763  176.671   2.9713  176.671   2.9713 0.000000 0.000000 
1 1 1   10    0   40 o  234.184   3.3970  2237.10   64.816  2237.10   64.816  2237.10   64.816  234.184   3.3970  234.184   3.3970 0.000000 0.000000 
1 1 1   10    0   41 o   74.941   3.0696  230.091   18.680  230.091   18.680  230.091   18.680   74.941   3.0696   74.941   3.0696 0.000000 0.000000 
1 1 1   10    0   42 f   20.192   8.4353   23.441   13.894   23.441   13.894   23.441   13.894   20.192   8.4353   20.192   8.4353 0.000000 0.000000 
1 1 1   10    0   43 o  196.628   3.1040  1577.31   49.723  1577.31   49.723  1577.31   49.723  196.628   3.1040  196.628   3.1040 0.000000 0.000000 
1 1 1   10    0   44 o  467.707   5.7381  8926.68  218.691  8926.68  218.691  8926.68  218.691  467.707   5.7381  467.707   5.7381 0.000000 0.000000 
1 1 1   10    0   45 o  505.575   6.1509 10432.54  253.406 10432.54  253.406 10432.54  253.406  505.575   6.1509  505.575   6.1509 0.000000 0.000000 
1 1 1   10    0   46 o  367.699   6.6036  5522.42  197.785  5522.42  197.785  5522.42  197.785  367.699   6.6036  367.699   6.6036 0.000000 0.000000 
1 1 1   10    0   47 o   71.845   4.1336  212.564   24.023  212.564   24.023  212.564   24.023   71.845   4.1336   71.845   4.1336 0.000000 0.000000 
1 1 1   10    0   48 o  259.145   5.0928  2742.51  107.487  2742.51  107.487  2742.51  107.487  259.145   5.0928  259.145   5.0928 0.000000 0.000000 
1 1 1   10    0   49 o  351.004   6.3646  5033.37  181.969  5033.37  181.969  5033.37  181.969  351.004   6.3646  351.004   6.3646 0.000000 0.000000 
1 1 1   10    0   50 o  222.831   3.3160  2025.91   60.202  2025.91   60.202  2025.91   60.202  222.831   3.3160  222.831   3.3160 0.000000 0.000000 
1 1 1   10    0   51 o   25.142   7.3315   31.570   13.044   31.570   13.044   31.570   13.044   25.142   7.3315   25.142   7.3315 0.000000 0.000000 
1 1 1   10    0   52 o   45.259   4.1023   85.582   14.834   85.582   14.834   85.582   14.834   45.259   4.1023   45.259   4.1023 0.000000 0.000000 
1 1 1   10    0   53 o  337.669   4.3964  4653.49  120.965  4653.49  120.965  4653.49  120.965  337.669   4.3964  337.669   4.3964 0.000000 0.000000 
1 1 1   10    0   54 o   25.821   7.4178   33.146   13.536   33.146   13.536   33.146   13.536   25.821   7.4178   25.821   7.4178 0.000000 0.000000 
1 1 1   10    0   55 o   98.665   2.8191  397.891   22.631  397.891   22.631  397.891   22.631   98.665   2.8191   98.665   2.8191 0.000000 0.000000 
1 1 1   10    0   56 o  228.694   3.3828  2134.29   63.031  2134.29   63.031  2134.29   63.031  228.694   3.3828  228.694   3.3828 0.000000 0.000000 
1 1 1   10    0   57 o  290.371   3.9424  3441.16   93.276  3441.16   93.276  3441.16   93.276  290.371   3.9424  290.371   3.9424 0.000000 0.000000 
1 1 1   10    0   58 o  162.179   2.4655  1073.09   32.576  1073.09   32.576  1073.09   32.576  162.179   2.4655  162.179   2.4655 0.000000 0.000000 
1 1 1   10    0   59 o  320.251   3.4375  4184.30   89.713  4184.30   89.713  4184.30   89.713  320.251   3.4375  320.251   3.4375 0.000000 0.000000 
1 1 1   10    0   60 o  122.333   2.3801  610.841   23.714  610.841   23.714  610.841   23.714  122.333   2.3801  122.333   2.3801 0.000000 0.000000 
1 1 1   10    0   61 o   36.005   3.1972   54.106   9.2054   54.106   9.2054   54.106   9.2054   36.005   3.1972   36.005   3.1972 0.000000 0.000000 
1 1 1   10    0   62 o  300.220   2.8428  3676.35   69.556  3676.35   69.556  3676.35   69.556  300.220   2.8428  300.220   2.8428 0.000000 0.000000 
1 1 1   10    0   63 o   10.313   5.9808   5.2814   8.2119   5.2814   8.2119   5.2814   8.2119   10.313   5.9808   10.313   5.9808 0.000000 0.000000 
1 1 1   10    0   64 o  101.991   1.9692  424.542   16.357  424.542   16.357  424.542   16.357  101.991   1.9692  101.991   1.9692 0.000000 0.000000 
1 1 1   10    0   65 o  271.079   3.7090  2999.46   81.924  2999.46   81.924  2999.46   81.924  271.079   3.7090  271.079   3.7090 0.000000 0.000000 
1 1 1   10    0   66 o   98.932   2.2737  399.688   18.314  399.688   18.314  399.688   18.314   98.932   2.2737   98.932   2.2737 0.000000 0.000000 
1 1 1   10    0   67 o   91.195   2.3204  339.748   17.224  339.748   17.224  339.748   17.224   91.195   2.3204   91.195   2.3204 0.000000 0.000000 
1 1 1   10    0   68 o  102.550   2.2893  429.434   19.115  429.434   19.115  429.434   19.115  102.550   2.2893  102.550   2.2893 0.000000 0.000000 
1 1 1   10    0   69 o   66.137   2.2501  178.964   12.099  178.964   12.099  178.964   12.099   66.137   2.2501   66.137   2.2501 0.000000 0.000000 
1 1 1   10    0   70 o   83.505   2.0684  284.827   14.060  284.827   14.060  284.827   14.060   83.505   2.0684   83.505   2.0684 0.000000 0.000000 
1 1 1   10    0   71 o   7.1283   4.8848  -6.0904   9.0657  -6.0904   9.0657  -6.0904   9.0657   7.1283   4.8848   7.1283   4.8848 0.000000 0.000000 
1 1 1   10    0   72 o   41.603   3.1830   71.835   10.645   71.835   10.645   71.835   10.645   41.603   3.1830   41.603   3.1830 0.000000 0.000000 
1 1 1   10    0   73 o   37.460   7.5624   63.935   20.460   63.935   20.460   63.935   20.460   37.460   7.5624   37.460   7.5624 0.000000 0.000000 
1 1 1   10    0   74 o  117.842   2.0338  566.704   19.523  566.704   19.523  566.704   19.523  117.842   2.0338  117.842   2.0338 0.000000 0.000000 
1 1 1   10    0   75 o  145.726   2.0420  866.393   24.245  866.393   24.245  866.393   24.245  145.726   2.0420  145.726   2.0420 0.000000 0.000000 
1 1 1   10    0   76 o  191.077   2.2015  1489.42   34.280  1489.42   34.280  1489.42   34.280  191.077   2.2015  191.077   2.2015 0.000000 0.000000 
1 1 1   10    0   77 o   54.843   2.4148  123.381   10.748  123.381   10.748  123.381   10.748   54.843   2.4148   54.843   2.4148 0.000000 0.000000 
1 1 1   10    0   78 o  150.840   2.0194  928.301   24.820  928.301   24.820  928.301   24.820  150.840   2.0194  150.840   2.0194 0.000000 0.000000 
1 1 1   10    0   79 o   22.710   5.3356   24.246   8.5814   24.246   8.5814   24.246   8.5814   22.710   5.3356   22.710   5.3356 0.000000 0.000000 
1 1 1   10    0   80 o  101.984   1.9531  424.590   16.223  424.590   16.223  424.590   16.223  101.984   1.9531  101.984   1.9531 0.000000 0.000000 
1 1 1   10    0   81 f   47.712   2.6647   93.741   10.289   93.741   10.289   93.741   10.289   47.712   2.6647   47.712   2.6647 0.000000 0.000000 
1 1 1   10    0   82 o  304.349   2.8804  3781.20   71.446  3781.20   71.446  3781.20   71.446  304.349   2.8804  304.349   2.8804 0.000000 0.000000 
1 1 1   10    0   83 o   55.944   2.4269  128.402   11.020  128.402   11.020  128.402   11.020   55.944   2.4269   55.944   2.4269 0.000000 0.000000 
1 1 1   10    0   84 o   67.530   2.1817  186.604   11.981  186.604   11.981  186.604   11.981   67.530   2.1817   67.530   2.1817 0.000000 0.000000 
1 1 1   10    0   85 o   12.010   6.4972   8.3932   8.8845   8.3932   8.8845   8.3932   8.8845   12.010   6.4972   12.010   6.4972 0.000000 0.000000 
1 1 1   10    0   86 o   28.187   5.0940   35.520   10.570   35.520   10.570   35.520   10.570   28.187   5.0940   28.187   5.0940 0.000000 0.000000 
1 1 1   10    0   87 o   17.131   6.8168   16.634   9.1978   16.634   9.1978   16.634   9.1978   17.131   6.8168   17.131   6.8168 0.000000 0.000000 
1 1 1   10    0   88 o   24.030   5.0362   26.515   8.6899   26.515   8.6899   26.515   8.6899   24.030   5.0362   24.030   5.0362 0.000000 0.000000 
1 1 1   10    0   89 o   11.984   6.4959   8.3703   8.8985   8.3703   8.8985   8.3703   8.8985   11.984   6.4959   11.984   6.4959 0.000000 0.000000 
1 1 1   10    0   90 o  187.052   2.2108  1428.55   33.698  1428.55   33.698  1428.55   33.698  187.052   2.2108  187.052   2.2108 0.000000 0.000000 
1 1 1   10    0   91 f   89.850   2.1284  330.038   15.569  330.038   15.569  330.038   15.569   89.850   2.1284   89.850   2.1284 0.000000 0.000000 
1 1 1   10    0   92 o   47.799   2.6812   94.213   10.371   94.213   10.371   94.213   10.371   47.799   2.6812   47.799   2.6812 0.000000 0.000000 
1 1 1   10    0   93 o   19.223   6.1391   19.187   8.4742   19.187   8.4742   19.187   8.4742   19.223   6.1391   19.223   6.1391 0.000000 0.000000 
1 1 1   10    0   94 o   25.641   4.5736   29.399   8.6538   29.399   8.6538   29.399   8.6538   25.641   4.5736   25.641   4.5736 0.000000 0.000000 
1 1 1   10    0   95 o  147.665   2.0126  890.769   24.215  890.769   24.215  890.769   24.215  147.665   2.0126  147.665   2.0126 0.000000 0.000000 
1 1 1   10    0   96 o  157.430   2.0351  1012.65   26.107  1012.65   26.107  1012.65   26.107  157.430   2.0351  157.430   2.0351 0.000000 0.000000 
1 1 1   10    0   97 o   6.8909   4.6599  -3.6324   7.6954  -3.6324   7.6954  -3.6324   7.6954   6.8909   4.6599   6.8909   4.6599 0.000000 0.000000 
1 1 1   10    0   98 o   6.7309   4.5663  -3.8366   7.5081  -3.8366   7.5081  -3.8366   7.5081   6.7309   4.5663   6.7309   4.5663 0.000000 0.000000 
1 1 1   10    0   99 o   26.519   4.1680   30.978   8.3457   30.978   8.3457   30.978   8.3457   26.519   4.1680   26.519   4.1680 0.000000 0.000000 
1 1 1   10    0  100 o   31.885   3.4553   43.201   8.7136   43.201   8.7136   43.201   8.7136   31.885   3.4553   31.885   3.4553 0.000000 0.000000 
1 1 1   10    0  101 o   47.615   2.9222   94.040   11.243   94.040   11.243   94.040   11.243   47.615   2.9222   47.615   2.9222 0.000000 0.000000 
1 1 1   10    0  102 o  109.521   2.2446  491.538   20.020  491.538   20.020  491.538   20.020  109.521   2.2446  109.521   2.2446 0.000000 0.000000 
1 1 1   10    0  103 f   9.9899   6.0088   4.4276   8.8442   4.4276   8.8442   4.4276   8.8442   9.9899   6.0088   9.9899   6.0088 0.000000 0.000000 
1 1 1   10    0  104 o   66.247   2.1799  180.257   11.743  180.257   11.743  180.257   11.743   66.247   2.1799   66.247   2.1799 0.000000 0.000000 
1 1 1   10    0  105 o   16.788   6.3239   15.918   8.0961   15.918   8.0961   15.918   8.0961   16.788   6.3239   16.788   6.3239 0.000000 0.000000 
1 1 1   10    0  106 o   29.595   3.7562   37.892   8.6644   37.892   8.6644   37.892   8.6644   29.595   3.7562   29.595   3.7562 0.000000 0.000000 
1 1 1   10    0  107 o   37.179   3.0405   58.046   9.0680   58.046   9.0680   58.046   9.0680   37.179   3.0405   37.179   3.0405 0.000000 0.000000 
1 1 1   10    0  108 o   51.351   2.4969  109.041   10.395  109.041   10.395  109.041   10.395   51.351   2.4969   51.351   2.4969 0.000000 0.000000 
1 1 1   10    0  109 o   90.617   2.0198  336.910   14.903  336.910   14.903  336.910   14.903   90.617   2.0198   90.617   2.0198 0.000000 0.000000 
1 1 1   10    0  110 f   17.922   6.5055   18.034   8.7329   18.034   8.7329   18.034   8.7329   17.922   6.5055   17.922   6.5055 0.000000 0.000000 
1 1 1   10    0  111 o   5.2904   3.8061 -13.5252   8.0475 -13.5252   8.0475 -13.5252   8.0475   5.2904   3.8061   5.2904   3.8061 0.000000 0.000000 
1 1 1   10    0  112 o   96.793   2.0587  384.898   16.226  384.898   16.226  384.898   16.226   96.793   2.0587   96.793   2.0587 0.000000 0.000000 
1 1 1   10    0  113 o   37.924   3.2181   60.867   9.7773   60.867   9.7773   60.867   9.7773   37.924   3.2181   37.924   3.2181 0.000000 0.000000 
1 1 1   10    0  114 o   64.352   2.3044  171.060   12.053  171.060   12.053  171.060   12.053   64.352   2.3044   64.352   2.3044 0.000000 0.000000 
1 1 1   10    0  115 o   48.594   2.6239   98.382   10.324   98.382   10.324   98.382   10.324   48.594   2.6239   48.594   2.6239 0.000000 0.000000 
1 1 1   10    0  116 o   16.448   6.4179   15.993   8.2120   15.993   8.2120   15.993   8.2120   16.448   6.4179   16.448   6.4179 0.000000 0.000000 
1 1 1   10    0  117 o   18.192   6.5125   18.917   8.8206   18.917   8.8206   18.917   8.8206   18.192   6.5125   18.192   6.5125 0.000000 0.000000 
1 1 1   10    0  118 o   11.163   7.3741   0.4936   17.377   0.4936   17.377   0.4936   17.377   11.163   7.3741   11.163   7.3741 0.000000 0.000000 
1 1 1   10    0  119 o   12.555   8.0177   6.5850   18.265   6.5850   18.265   6.5850   18.265   12.555   8.0177   12.555   8.0177 0.000000 0.000000 
1 1 1   10    0  120 f   69.478   3.6869  205.827   20.745  205.827   20.745  205.827   20.745   69.478   3.6869   69.478   3.6869 0.000000 0.000000 
1 1 1   10    0  121 o  116.221   3.1688  567.862   29.970  567.862   29.970  567.862   29.970  116.221   3.1688  116.221   3.1688 0.000000 0.000000 
1 1 1   10    0  122 o   95.481   3.2999  384.969   25.614  384.969   25.614  384.969   25.614   95.481   3.2999   95.481   3.2999 0.000000 0.000000 
1 1 1   10    0  123 o   10.029   6.7379  -1.8910   15.601  -1.8910   15.601  -1.8910   15.601   10.029   6.7379   10.029   6.7379 0.000000 0.000000 
1 1 1   10    0  124 o   7.5035   5.2949 -12.3512   12.967 -12.3512   12.967 -12.3512   12.967   7.5035   5.2949   7.5035   5.2949 0.000000 0.000000 
1 1 1   10    0  125 o   29.128   6.9099   43.963   14.242   43.963   14.242   43.963   14.242   29.128   6.9099   29.128   6.9099 0.000000 0.000000 
1 1 1   10    0  126 f   19.007   8.4379   25.152   13.805   25.152   13.805   25.152   13.805   19.007   8.4379   19.007   8.4379 0.000000 0.000000 
1 1 1   10    0  127 o   11.146   7.0844   5.5654   14.059   5.5654   14.059   5.5654   14.059   11.146   7.0844   11.146   7.0844 0.000000 0.000000 
1 1 1   10    0  128 o   25.959   9.0637   42.418   17.345   42.418   17.345   42.418   17.345   25.959   9.0637   25.959   9.0637 0.000000 0.000000 
1 1 1   10    0  129 o   7.3094   5.2663 -22.8046   15.660 -22.8046   15.660 -22.8046   15.660   7.3094   5.2663   7.3094   5.2663 0.000000 0.000000 
1 1 1   10    0  130 o   12.621   7.8790   9.9326   16.551   9.9326   16.551   9.9326   16.551   12.621   7.8790   12.621   7.8790 0.000000 0.000000 
1 1 1   10    0  131 o   9.2092   6.6091 -26.7887   23.618 -26.7887   23.618 -26.7887   23.618   9.2092   6.6091   9.2092   6.6091 0.000000 0.000000 
1 1 1   10    0  132 o   22.354   11.433   45.332   26.333   45.332   26.333   45.332   26.333   22.354   11.433   22.354   11.433 0.000000 0.000000 
1 1 1   10    1 -131 o   15.502   7.3970  -4.6499   26.047   0.0000   0.0000  -4.6499   26.047  ?   ?    15.502   7.3970 0.000000 7.397008 
1 1 1   10    1 -130 o   23.533   5.2102   27.773   9.7307   31.920   13.796   23.669   13.726   23.635   6.7978   20.184   6.9206 3.451384 9.700756 
1 1 1   10    1 -129 o   11.495   5.0803   0.8587   9.3597   1.2031   13.267   0.5173   13.207   13.136   5.9099   12.964   5.8586 0.1718798 8.321688 
1 1 1   10    1 -128 o   16.480   5.4882   13.750   8.6307   22.865   11.161   0.1898   13.613   20.528   6.1715   13.071   5.9235 7.457649 8.554210 
1 1 1   10    1 -127 o   10.040   4.5720  -2.4035   8.2316  -6.9425   10.479   4.9110   13.302   10.282   4.8423   14.115   6.1525 -3.833163 7.829543 
1 1 1   10    1 -126 o   13.835   5.3312   8.1030   8.4941   16.177   10.812  -4.9167   13.729   17.600   6.1368   12.186   5.6752 5.413857 8.358686 
1 1 1   10    1 -125 o   18.492   5.4280   17.313   8.7158   17.412   11.310   17.170   13.677   18.172   6.2799   18.012   6.8074 0.1597195 9.261614 
1 1 1   10    1 -124 o   9.1864   4.3153  -6.1094   8.2276  -7.5480   10.455  -3.7696   13.334   10.215   4.8188   12.313   5.6848 -2.097565 7.452351 
1 1 1   10    1 -123 o   7.8843   3.8691 -14.4900   8.5244 -13.0244   11.247 -16.4681   13.067   9.7331   4.6998   10.182   4.9514 -0.4485111 6.826739 
1 1 1   10    1 -122 o   44.525   2.8429   85.183   10.264   68.960   13.887  104.720   15.239   38.596   4.4981   48.320   3.9021 -9.724224 5.954803 
1 1 1   10    1 -121 o   42.401   3.2108   78.195   11.015   66.018   13.466  102.815   19.147   37.881   4.4455   46.503   5.1366 -8.622089 6.793189 
1 1 1   10    1 -120 o   27.805   4.4926   35.819   9.8356   35.218   12.159   36.957   16.730   26.555   5.7813   25.481   7.5308 1.074272 9.494083 
1 1 1   10    1 -119 o   25.978   4.4918   31.228   9.1678   44.302   10.995   1.4047   16.606   31.043   4.4742   14.760   6.6287 16.28264 7.997383 
1 1 1   10    1 -118 o   17.990   5.4683   15.755   8.7283   15.644   11.936   15.881   12.797   17.899   6.4282   18.046   6.6302 -0.1462154 9.234774 
1 1 1   10    1 -117 o   13.116   5.2658   5.4474   8.5900 -11.6804   11.793   24.806   12.537   10.428   4.9761   21.993   6.5243 -11.56506 8.205357 
1 1 1   10    1 -116 o   25.496   4.4711   29.563   8.9537   33.189   12.309   25.488   13.049   26.094   5.9227   22.373   6.6608 3.720900 8.913180 
1 1 1   10    1 -115 o   9.0694   4.2333  -5.9486   7.7095 -12.5646   10.280   2.5542   11.654   9.4857   4.5582   13.590   5.8408 -4.104103 7.408900 
1 1 1   10    1 -114 o   16.838   5.2612   13.031   8.0129   12.340   10.534   13.981   12.344   16.788   6.0377   17.764   6.5144 -0.9756966 8.882075 
1 1 1   10    1 -113 o   17.218   5.4873   13.533   8.6766   7.8801   10.504   25.678   15.395   15.052   5.8925   22.657   7.3180 -7.604784 9.395497 
1 1 1   10    1 -112 o   37.100   2.9137   58.064   8.7410   41.877   11.220   83.061   13.942   30.673   4.6315   43.833   3.9442 -13.16006 6.083336 
1 1 1   10    1 -111 o   10.208   4.7274  -6.3568   9.3232  -5.3600   10.234 -11.2188   22.603   11.017   5.0476   15.653   7.2870 -4.636198 8.864492 
1 1 1   10    1 -110 o   49.519   2.5712  102.141   10.343  105.368   12.369   94.635   18.861   50.083   3.0441   46.244   5.0874 3.838078 5.928608 
1 1 1   10    1 -109 o   37.012   3.2165   57.822   9.6080   65.789   11.506   39.468   17.464   39.317   3.6311   28.486   7.4408 10.83057 8.279485 
1 1 1   10    1 -108 o   45.717   2.9650   87.468   10.990  105.375   13.755   55.860   18.275   49.999   3.3951   34.624   6.7174 15.37567 7.526647 
1 1 1   10    1 -107 o   47.433   2.4147   93.251   9.3057  103.086   12.280   79.986   14.261   49.637   3.0498   43.244   4.0945 6.393120 5.105464 
1 1 1   10    1 -106 o   37.816   2.8217   59.693   8.6353   72.301   11.476   43.235   13.112   41.415   3.4300   31.175   5.3523 10.24001 6.357029 
1 1 1   10    1 -105 o   27.248   4.4082   32.263   9.4571   44.721   14.554   23.159   12.442   31.522   5.8803   22.473   6.4529 9.049767 8.730325 
1 1 1   10    1 -104 o   22.418   4.7986   22.205   8.5041   20.144   11.732   24.488   12.345   21.131   6.3217   23.150   6.3512 -2.019028 8.961164 
1 1 1   10    1 -103 o   75.420   1.9301  233.679   11.856  254.350   16.641  212.370   16.896   78.435   2.6064   71.539   2.9034 6.895439 3.901636 
1 1 1   10    1 -102 o   34.761   3.1685   50.540   8.8794   47.178   10.911   57.135   15.280   33.286   4.1083   36.186   5.3403 -2.900105 6.737729 
1 1 1   10    1 -101 o   31.565   3.4428   41.889   8.7151   42.487   10.588   40.634   15.348   31.556   4.2218   30.024   6.4626 1.532164 7.719355 
1 1 1   10    1 -100 o   61.590   2.1630  155.939   10.842  162.460   13.247  142.704   18.872   62.749   2.5954   58.313   3.9944 4.436134 4.763572 
1 1 1   10    1  -99 o   36.676   3.1472   56.002   9.3183   56.596   11.062   54.551   17.292   36.713   3.7489   35.153   6.2642 1.559467 7.300329 
1 1 1   10    1  -98 o  100.340   1.6726  411.863   13.681  392.771   17.771  439.637   21.434   97.847   2.2281  103.419   2.5426 -5.571594 3.380665 
1 1 1   10    1  -97 o   42.749   2.5832   75.353   8.9597   82.445   11.921   66.148   13.582   44.564   3.3053   39.637   4.2711 4.927578 5.400697 
1 1 1   10    1  -96 o   11.986   4.9637   1.8282   7.9244  -2.4891   10.363   7.9080   12.297   12.163   5.3621   16.505   6.4000 -4.341286 8.349362 
1 1 1   10    1  -95 o   46.485   2.9756   89.201   11.216   77.210   18.129   96.637   14.276   42.620   5.3348   48.239   3.6579 -5.618378 6.468361 
1 1 1   10    1  -94 o   95.601   1.6877  373.475   13.152  376.266   17.304  369.658   20.240   95.868   2.2143   94.903   2.6189 0.9652710 3.429487 
1 1 1   10    1  -93 o   47.734   2.4082   93.544   9.3399   84.548   12.298  105.806   14.357   45.214   3.3608   50.577   3.5040 -5.363445 4.855214 
1 1 1   10    1  -92 o   37.461   2.9405   57.914   8.9073   45.441   11.540   76.294   14.009   32.869   4.4191   42.816   4.0624 -9.946770 6.002625 
1 1 1   10    1  -91 o   77.854   1.8593  247.629   11.799  249.563   15.620  245.059   18.007   78.049   2.4582   77.270   2.8638 0.7789993 3.774148 
1 1 1   10    1  -90 o   13.303   5.3011   3.8494   8.6398   9.0000   11.491  -2.8486   13.104   16.741   6.2583   13.814   6.0619 2.926966 8.712754 
1 1 1   10    1  -89 o   52.307   2.5511  112.198   10.845  115.730   14.529  107.755   16.295   53.006   3.3803   51.040   3.9473 1.966373 5.196876 
1 1 1   10    1  -88 o  100.393   2.0059  411.661   16.416  416.258   21.654  405.449   25.171  100.840   2.6366   99.437   3.1092 1.403343 4.076634 
1 1 1   10    1  -87 o  104.636   1.9620  447.074   16.734  455.301   22.100  436.017   25.621  105.523   2.5692  103.152   3.0504 2.371056 3.988229 
1 1 1   10    1  -86 o   75.887   2.1531  235.398   13.306  234.970   17.559  235.974   20.391   75.736   2.8493   75.832   3.3067 -0.9560394E-01 4.364947 
1 1 1   10    1  -85 o  108.305   2.0882  478.957   18.436  454.603   25.671  504.892   26.492  105.372   2.9918  111.062   2.9288 -5.690155 4.186685 
1 1 1   10    1  -84 o   62.550   2.1958  159.963   11.178  148.502   15.229  173.351   16.460   60.168   3.1157   65.020   3.1147 -4.851814 4.405536 
1 1 1   10    1  -83 o  142.710   1.9084  831.184   22.200  797.750   33.938  856.192   29.352  139.676   2.9807  144.774   2.4872 -5.097412 3.882107 
1 1 1   10    1  -82 o  118.252   1.6321  570.464   15.732  560.734   20.590  584.111   24.385  117.199   2.1552  119.584   2.5016 -2.384506 3.301966 
1 1 1   10    1  -81 o   96.013   1.3034  375.930   10.201  364.560   17.275  382.017   12.640   94.498   2.2427   96.773   1.6023 -2.275322 2.756265 
1 1 1   10    1  -80 o   90.162   1.3108  331.500   9.6341  328.965   16.592  332.789   11.833   89.741   2.2700   90.325   1.6071 -0.5842896 2.781355 
1 1 1   10    1  -79 o  163.792   1.3801  1094.03   18.426  1113.69   29.231  1081.06   23.737  165.191   2.1708  162.788   1.7888 2.403397 2.812834 
1 1 1   10    1  -78 o   85.878   1.3200  300.726   9.2404  290.521   15.738  306.094   11.415   84.337   2.2914   86.631   1.6165 -2.293373 2.804208 
1 1 1   10    1  -77 o   70.820   1.3839  204.519   7.9890  203.082   14.297  205.171   9.6333   70.489   2.4922   70.925   1.6662 -0.4367065 2.997879 
1 1 1   10    1  -76 o   85.647   1.3390  299.099   9.3484  290.591   15.834  303.652   11.582   84.353   2.3050   86.287   1.6467 -1.933815 2.832780 
1 1 1   10    1  -75 o  232.513   1.6145  2204.72   30.599  2209.34   46.979  2201.31   40.326  232.665   2.4771  232.283   2.1298 0.3819885 3.266768 
1 1 1   10    1  -74 o  109.371   1.3209  487.716   11.776  511.873   19.506  473.862   14.772  112.014   2.1363  107.794   1.6811 4.219734 2.718453 
1 1 1   10    1  -73 o  148.538   1.3777  899.583   16.681  889.674   26.224  906.317   21.619  147.677   2.1785  149.074   1.7791 -1.397781 2.812631 
1 1 1   10    1  -72 o  155.787   1.4925  989.568   18.954  971.969   32.601  998.553   23.295  154.332   2.5915  156.477   1.8263 -2.144608 3.170337 
1 1 1   10    1  -71 o  127.142   1.7438  659.211   18.073  646.817   34.361  663.951   21.250  125.804   3.3537  127.585   2.0432 -1.781677 3.927099 
1 1 1   10    1  -70 o   79.001   1.6984  254.502   10.938  251.801   18.792  255.885   13.451   78.486   2.9425   79.178   2.0858 -0.6919632 3.606798 
1 1 1   10    1  -69 o   25.461   3.1188   26.859   6.3379   24.747   14.282   27.377   7.0724   24.245   6.8985   25.660   3.4701 -1.415113 7.722069 
1 1 1   10    1  -68 o  243.436   1.8757  2416.70   37.221  2350.75   70.116  2442.57   43.920  239.912   3.5853  244.710   2.2018 -4.798309 4.207416 
1 1 1   10    1  -67 o  143.635   1.5609  841.180   18.275  840.654   28.284  841.557   23.945  143.552   2.4171  143.648   2.0449 -0.9553528E-01 3.166067 
1 1 1   10    1  -66 o   88.906   1.6243  322.283   11.771  328.399   17.810  317.539   15.686   89.690   2.4383   88.235   2.1809 1.455223 3.271287 
1 1 1   10    1  -65 o  154.947   1.6504  978.910   20.845  961.519   29.953  995.242   29.027  153.531   2.3934  156.206   2.2796 -2.675186 3.305295 
1 1 1   10    1  -64 o  133.533   1.8153  727.077   19.759  727.379   25.021  726.578   32.209  133.542   2.2985  133.436   2.9612 0.1060333 3.748571 
1 1 1   10    1  -63 o  139.954   1.7291  798.645   19.726  807.945   24.190  780.191   34.077  140.753   2.1084  138.270   3.0234 2.482727 3.685933 
1 1 1   10    1  -62 o  124.280   1.6794  629.748   17.013  640.559   20.502  605.839   30.489  125.332   2.0068  121.806   3.0731 3.525864 3.670363 
1 1 1   10    1  -61 o   80.761   1.5138  265.913   9.9658  265.928   11.117  265.847   22.486   80.761   1.6887   80.630   3.4290 0.1305923 3.822331 
1 1 1   10    1  -60 o  140.270   1.7561  802.234   20.079  800.199   22.120  811.763   47.863  140.086   1.9371  140.914   4.1715 -0.8276520 4.599319 
1 1 1   10    1  -59 o  184.751   1.7627  1391.69   26.546  1349.00   31.292  1501.28   50.135  181.880   2.1106  191.804   3.2066 -9.923706 3.838928 
1 1 1   10    1  -58 o  117.086   1.8898  558.983   18.036  558.983   18.036   0.0000   0.0000  117.086   1.8898  ?   ?  0.000000 1.889772 
1 1 1   10    1  -57 o  279.969   1.9132  3195.99   43.662  3309.79   63.075  3091.29   60.499  284.850   2.7165  275.289   2.6960 9.560913 3.827250 
1 1 1   10    1  -56 o  211.821   1.6036  1829.22   27.688  1821.31   38.920  1837.34   39.399  211.333   2.2593  212.260   2.2771 -0.9271851 3.207707 
1 1 1   10    1  -55 o   55.681   1.5902  126.498   7.2103  114.287   9.9925  139.762   10.414   52.887   2.3235   58.503   2.1877 -5.615601 3.191331 
1 1 1   10    1  -54 o  113.484   1.4160  525.011   13.099  528.829   19.637  521.950   17.581  113.882   2.1153  113.144   1.9063 0.7381134 2.847565 
1 1 1   10    1  -53 o  221.363   1.6430  1997.70   29.647  1962.14   41.368  2035.26   42.511  219.354   2.3136  223.403   2.3344 -4.048615 3.286628 
1 1 1   10    1  -52 o  283.922   1.9225  3286.69   44.493  3345.04   63.695  3231.09   62.177  286.380   2.7285  281.461   2.7100 4.918701 3.845672 
1 1 1   10    1  -51 o   98.261   1.3608  393.590   10.899  402.649   15.575  384.896   15.258   99.377   1.9227   97.162   1.9265 2.215530 2.721792 
1 1 1   10    1  -50 o  164.380   1.4368  1101.50   19.252  1107.94   27.253  1095.08   27.201  164.846   2.0281  163.886   2.0361 0.9599762 2.873891 
1 1 1   10    1  -49 o  290.716   2.1006  3445.90   49.779  3578.52   78.622  3357.16   64.310  296.183   3.2565  286.912   2.7498 9.270844 4.262154 
1 1 1   10    1  -48 o  206.786   1.7100  1743.19   28.824  1739.73   44.458  1745.70   37.860  206.548   2.6406  206.918   2.2446 -0.3696442 3.465667 
1 1 1   10    1  -47 o  269.410   2.1430  2959.23   47.062  2923.93   66.866  2993.89   66.249  267.752   3.0636  270.940   2.9997 -3.188019 4.287624 
1 1 1   10    1  -46 o  201.239   1.8148  1650.93   29.769  1568.67   41.846  1735.21   42.359  196.138   2.6173  206.291   2.5190 -10.15256 3.632610 
1 1 1   10    1  -45 o  159.811   1.6071  1041.09   20.935  1033.04   29.521  1049.23   29.692  159.178   2.2752  160.421   2.2706 -1.242722 3.214381 
1 1 1   10    1  -44 o  246.805   2.1829  2483.34   43.915  2455.96   56.427  2525.40   69.936  245.418   2.8206  248.834   3.4479 -3.416306 4.454658 
1 1 1   10    1  -43 o  230.860   1.9209  2172.66   36.149  2184.47   51.124  2160.85   51.121  231.463   2.7096  230.208   2.7242 1.255341 3.842325 
1 1 1   10    1  -42 o  106.578   1.4216  463.002   12.350  463.297   18.448  462.763   16.626  106.605   2.1229  106.546   1.9144 0.5906677E-01 2.858592 
1 1 1   10    1  -41 o  406.731   2.3887  6744.36   79.197  6755.81  119.155  6735.30  105.999  407.006   3.5915  406.414   3.1996 0.5924072 4.810035 
1 1 1   10    1  -40 o  188.847   1.4188  1453.67   21.841  1443.57   32.860  1461.67   29.232  188.179   2.1422  189.359   1.8938 -1.180130 2.859302 
1 1 1   10    1  -39 o  239.902   1.6126  2345.96   31.535  2300.54   46.953  2383.28   42.564  237.551   2.4247  241.792   2.1596 -4.240524 3.247016 
1 1 1   10    1  -38 o  320.315   2.0893  4182.50   54.551  4128.75   88.553  4215.37   69.252  318.204   3.4140  321.554   2.6420 -3.350372 4.316907 
1 1 1   10    1  -37 f  143.060   1.2956  834.201   15.109  863.614   23.221  812.609   19.897  145.555   1.9572  141.193   1.7287 4.361420 2.611322 
1 1 1   10    1  -36 o  224.582   1.5509  2055.85   28.391  2085.78   43.172  2033.04   37.688  226.198   2.3414  223.325   2.0703 2.873413 3.125389 
1 1 1   10    1  -35 o  165.646   1.3517  1118.40   18.252  1150.19   28.017  1094.96   24.057  167.977   2.0462  163.898   1.8006 4.079651 2.725636 
1 1 1   10    1  -34 o  263.218   1.7146  2824.09   36.789  2889.61   56.290  2775.23   48.607  266.238   2.5937  260.922   2.2854 5.316498 3.456924 
1 1 1   10    1  -33 o  365.978   2.1882  5459.80   65.280  5534.84   99.145  5402.37   86.734  368.451   3.3011  364.027   2.9229 4.423279 4.409163 
1 1 1   10    1  -32 f  354.419   2.1347  5120.31   61.673  5192.65   93.609  5064.83   81.981  356.885   3.2178  352.476   2.8533 4.408752 4.300622 
1 1 1   10    1  -31 o  416.937   2.4407  7086.22   82.952  7247.22  126.862  6965.97  109.637  421.604   3.6914  413.359   3.2538 8.245331 4.920747 
1 1 1   10    1  -30 o  304.119   2.0149  3769.97   49.950  3665.86   69.019  3884.48   72.382  299.876   2.8235  308.687   2.8766 -8.811218 4.030747 
1 1 1   10    1  -29 o  560.431   3.0082 12803.94  137.425 12752.19  193.669 12856.43  195.034  559.237   4.2484  561.518   4.2610 -2.280273 6.017076 
1 1 1   10    1  -28 o  673.366   3.7651 18486.22  206.665 18489.64  277.184 18481.94  310.118  673.342   5.0501  673.153   5.6517 0.1893311 7.579218 
1 1 1   10    1  -27 o  323.679   1.9902  4270.45   52.510  4283.29   70.456  4254.40   78.758  324.155   2.6664  323.053   2.9908 1.101410 4.006808 
1 1 1   10    1  -26 o  282.169   1.7991  3245.29   41.381  3267.52   55.672  3217.85   61.858  283.126   2.4122  280.961   2.7009 2.164307 3.621309 
1 1 1   10    1  -25 o  544.685   3.2800 12094.59  145.632 12085.65  205.668 12103.59  206.243  544.424   4.6344  544.828   4.6439 -0.4036255 6.560760 
1 1 1   10    1  -24 o  449.333   2.6029  8230.02   95.338  8171.42  142.155  8277.92  128.530  447.694   3.8953  450.615   3.4992 -2.920868 5.236186 
1 1 1   10    1  -23 o  204.427   1.4943  1703.34   24.900  1686.98   37.149  1716.69   33.553  203.438   2.2402  205.223   2.0057 -1.785141 3.006896 
1 1 1   10    1  -22 o  727.157   4.0501 21557.36  240.065 21438.39  358.237 21654.33  323.431  725.011   6.0616  728.701   5.4450 -3.690247 8.148076 
1 1 1   10    1  -21 o  463.079   3.0307  8741.55  114.403  8752.64  174.941  8733.26  151.219  463.321   4.6321  462.830   4.0082 0.4903870 6.125493 
1 1 1   10    1  -20 o  512.967   3.3207 10726.80  138.853 10812.79  213.501 10663.77  182.791  514.951   5.0863  511.420   4.3847 3.530670 6.715334 
1 1 1   10    1  -19 o  277.840   2.1744  3146.53   49.246  3101.37   69.397  3192.35   69.895  275.828   3.0865  279.844   3.0640 -4.016693 4.349110 
1 1 1   10    1  -18 o  497.005   3.4828 10069.74  141.101  9845.87  196.228 10309.43  203.039  491.400   4.8988  502.832   4.9536 -11.43262 6.966803 
1 1 1   10    1  -17 o  672.685   4.2653 18448.56  233.883 18379.73  356.313 18500.67  310.020  671.293   6.5115  673.557   5.6465 -2.264343 8.618768 
1 1 1   10    1  -16 o  479.147   2.9265  9358.50  114.300  9372.08  162.090  9345.06  161.203  479.461   4.1473  478.770   4.1306 0.6911316 5.853378 
1 1 1   10    1  -15 o  385.674   2.4334  6063.01   76.502  6072.82  108.599  6053.34  107.787  385.967   3.4518  385.348   3.4314 0.6190491 4.867180 
1 1 1   10    1  -14 o  513.196   3.1120 10735.96  130.183 10722.75  184.157 10749.15  184.057  512.841   4.4052  513.472   4.3975 -0.6311646 6.224443 
1 1 1   10    1  -13 o  200.802   1.7003  1643.46   27.832  1628.65   37.111  1662.51   42.075  199.891   2.2776  201.956   2.5558 -2.064575 3.423381 
1 1 1   10    1  -12 o  488.456   3.1824  9725.82  126.711  9695.89  167.505  9765.87  193.735  487.674   4.2137  489.409   4.8562 -1.734222 6.429488 
1 1 1   10    1  -11 o  476.037   3.1113  9237.47  120.729  9069.15  157.581  9476.69  187.857  471.654   4.0987  482.112   4.7802 -10.45810 6.296750 
1 1 1   10    1  -10 o  155.006   1.5516  979.304   19.605  943.998   26.022  1025.65   29.814  152.184   2.0977  158.628   2.3057 -6.444061 3.117166 
1 1 1   10    1   -9 o  355.584   2.4320  5153.84   70.493  5184.42   94.018  5114.56  106.537  356.625   3.2342  354.206   3.6898 2.419464 4.906597 
1 1 1   10    1   -8 o  283.828   2.0562  3283.55   47.572  3406.62   64.934  3140.96   69.892  289.091   2.7555  277.585   3.0888 11.50513 4.139305 
1 1 1   10    1   -7 o  544.788   3.7923 12099.19  168.411 12072.38  238.327 12125.93  238.012  544.125   5.3733  545.331   5.3543 -1.206482 7.585552 
1 1 1   10    1   -6 o  351.490   2.4144  5035.83   69.176  5037.52   91.810  5033.61  105.212  351.538   3.2039  351.392   3.6731 0.1451416 4.874135 
1 1 1   10    1   -5 o  531.998   4.0691 11538.10  176.461 11559.89  197.496 11451.86  392.941  532.484   4.5500  529.743   9.0997 2.740662 10.17385 
1 1 1   10    1   -4 o  595.127   4.1143 14438.94  199.592 14521.24  245.680 14279.18  342.299  596.782   5.0503  591.678   7.0972 5.104858 8.710643 
1 1 1   10    1   -3 o  191.396   1.9664  1493.13   30.680  1471.03   39.734  1525.77   48.278  189.970   2.5659  193.469   3.0612 -3.498352 3.994402 
1 1 1   10    1   -2 o  278.605   2.4155  3163.90   54.857  3190.29   71.624  3126.45   85.319  279.757   3.1408  276.934   3.7795 2.822632 4.914180 
1 1 1   10    1   -1 o  909.924   6.7431 33768.29  500.150 33792.47  646.413 33732.20  789.487  910.044   8.7139  908.978   10.655 1.065369 13.76451 
1 1 1   10    1    0 o  486.662   3.4303  9654.64  136.079  9997.86  198.334  9349.37  187.051  495.191   4.9135  478.866   4.7919 16.32495 6.863277 
1 1 1   10    1    1 o  733.071   4.9981 21910.86  298.668 21660.81  418.491 22170.42  426.382  728.743   7.0449  737.262   7.0948 -8.518738 9.998357 
1 1 1   10    1    2 o  314.860   2.3895  4040.90   61.327  3917.67   85.017  4174.59   88.551  310.009   3.3643  320.012   3.3946 -10.00342 4.779326 
1 1 1   10    1    3 o  117.430   1.6218  562.058   15.524  557.235   22.158  566.708   21.756  116.923   2.3248  117.913   2.2635 -0.9898758 3.244736 
1 1 1   10    1    4 o  385.175   2.8015  6047.46   87.960  6117.37  125.641  5980.26  123.185  387.372   3.9789  383.007   3.9456 4.364777 5.603562 
1 1 1   10    1    5 o  319.770   2.4208  4167.91   63.100  4136.43   88.938  4199.82   89.540  318.546   3.4251  320.977   3.4222 -2.431671 4.841805 
1 1 1   10    1    6 o  571.806   3.9614 13329.26  184.645 13299.11  260.676 13359.61  261.580  571.092   5.5996  572.389   5.6063 -1.297119 7.923806 
1 1 1   10    1    7 o  289.194   2.2554  3408.93   53.168  3582.86   78.030  3258.19   72.641  296.468   3.2288  282.717   3.1521 13.75058 4.512318 
1 1 1   10    1    8 o  540.785   4.1271 11922.51  181.930 12030.58  236.732 11766.61  284.334  543.182   5.3466  537.135   6.4940 6.047668 8.411729 
1 1 1   10    1    9 o   22.158   5.5213   20.811   9.9360   15.109   13.484   27.586   14.698   20.111   6.8601   25.581   6.8938 -5.469765 9.725539 
1 1 1   10    1   10 o  533.056   3.7208 11583.61  161.678 11501.10  227.499 11667.81  229.812  531.097   5.2550  534.932   5.2703 -3.834595 7.442513 
1 1 1   10    1   11 o  482.389   3.4039  9485.91  133.846  9407.74  188.178  9565.95  190.415  480.354   4.8059  484.376   4.8226 -4.021454 6.808390 
1 1 1   10    1   12 o  380.673   3.0447  5907.08   94.477  5918.19  149.589  5899.71  121.857  380.989   4.8167  380.417   3.9297 0.5722656 6.216356 
1 1 1   10    1   13 o  162.987   1.7316  1082.76   23.006  1035.45   32.305  1131.44   32.770  159.383   2.4865  166.607   2.4130 -7.223923 3.464838 
1 1 1   10    1   14 o  134.182   1.8885  733.867   20.656  811.101   27.847  639.389   30.800  141.063   2.4218  125.241   3.0169 15.82198 3.868695 
1 1 1   10    1   15 o  725.359   4.9547 21452.92  292.958 21612.19  417.121 21297.88  411.546  727.899   7.0300  722.591   6.9870 5.308716 9.911543 
1 1 1   10    1   16 o  426.082   3.0613  7400.47  106.323  7355.36  149.743  7446.33  150.993  424.748   4.3249  427.366   4.3343 -2.618073 6.123007 
1 1 1   10    1   17 o  564.744   3.9217 13002.36  180.538 13023.08  255.750 12981.78  254.889  565.121   5.5519  564.225   5.5420 0.8964233 7.844522 
1 1 1   10    1   18 o  383.387   3.4350  5991.94  107.350  6217.14  156.725  5792.90  147.341  390.483   4.9238  376.929   4.7954 13.55408 6.873138 
1 1 1   10    1   19 o  225.373   2.7522  2070.46   50.562  2152.20   90.036  2032.80   61.107  229.747   4.8076  223.307   3.3570 6.440506 5.863684 
1 1 1   10    1   20 o  691.017   6.6907 19477.30  376.876 19393.02  650.652 19519.85  462.331  688.973   11.585  691.633   8.2005 -2.660156 14.19400 
1 1 1   10    1   21 o   96.114   4.4233  377.441   34.562  377.441   34.562   0.0000   0.0000   96.114   4.4233  ?   ?  0.000000 4.423303 
1 1 1   10    1   22 o  195.211   4.4925  1553.74   71.488  1553.74   71.488   0.0000   0.0000  195.211   4.4925  ?   ?  0.000000 4.492526 
1 1 1   10    1   23 o  338.660   3.0945  4675.33   85.426  4678.50  120.864  4672.17  120.758  338.743   4.3771  338.514   4.3763 0.2290955 6.189598 
1 1 1   10    1   24 o  497.745   3.8218 10100.55  155.064 10075.77  244.738 10117.17  200.428  497.027   6.0407  498.107   4.9363 -1.079590 7.801053 
1 1 1   10    1   25 o   55.171   2.5268  124.337   11.333  158.655   16.598   94.360   15.513   62.298   3.2801   47.942   4.0061 14.35680 5.177634 
1 1 1   10    1   26 o  436.149   3.4014  7755.00  120.929  7591.29  187.859  7870.84  158.023  431.444   5.3416  439.358   4.4123 -7.913940 6.928298 
1 1 1   10    1   27 o  185.945   1.9035  1409.32   28.852  1343.85   44.522  1456.73   37.883  181.564   3.0082  189.042   2.4584 -7.477249 3.884988 
1 1 1   10    1   28 o  121.920   1.7371  605.881   17.263  610.472   27.343  602.837   22.261  122.375   2.7411  121.611   2.2456 0.7642746 3.543497 
1 1 1   10    1   29 o  242.637   2.1823  2399.78   43.162  2486.74   69.834  2346.03   54.904  246.973   3.4688  239.896   2.8077 7.077393 4.462699 
1 1 1   10    1   30 o  243.394   2.4494  2414.86   48.596  2395.22   68.373  2434.91   69.083  242.385   3.4605  244.384   3.4679 -1.999649 4.899119 
1 1 1   10    1   31 o   81.077   1.8603  267.941   12.295  254.349   19.403  277.058   15.892   78.930   3.0213   82.408   2.3682 -3.478226 3.838868 
1 1 1   10    1   32 f  282.901   2.4148  3262.48   55.686  3195.98   86.916  3308.78   72.527  279.969   3.8085  284.886   3.1232 -4.916931 4.925330 
1 1 1   10    1   33 o  268.150   2.3286  2931.10   50.900  2972.84   81.384  2904.28   65.232  270.020   3.6975  266.906   2.9982 3.113556 4.760371 
1 1 1   10    1   34 o   61.119   2.1391  152.456   10.641  175.105   16.877  137.515   13.708   65.459   3.1724   58.006   2.9085 7.453281 4.303882 
1 1 1   10    1   35 o  307.800   2.5693  3862.25   64.465  3712.28   99.131  3972.15   84.858  301.716   4.0306  312.125   3.3353 -10.40851 5.231629 
1 1 1   10    1   36 o  250.785   2.5015  2563.92   51.138  2624.61   73.437  2506.79   71.252  253.707   3.5510  247.948   3.5253 5.759476 5.003752 
1 1 1   10    1   37 f  378.460   3.3842  5840.25  104.403  5938.21  149.442  5746.86  145.916  381.537   4.8051  375.342   4.7691 6.195221 6.770040 
1 1 1   10    1   38 o  148.889   2.0168  903.651   24.477  923.328   34.947  884.702   34.295  150.489   2.8489  147.307   2.8560 3.181549 4.033992 
1 1 1   10    1   39 o  485.615   4.1912  9618.69  165.906  9576.14  233.751  9661.88  235.512  484.359   5.9204  486.521   5.9385 -2.161438 8.385512 
1 1 1   10    1   40 o  650.289   5.4759 17258.81  290.269 17351.83  412.547 17167.61  408.489  651.591   7.7672  648.130   7.7318 3.460144 10.95946 
1 1 1   10    1   41 o   22.500   5.3508   21.495   9.6695   31.929   13.682   11.084   13.667   27.419   6.2598   18.600   6.8489 8.819601 9.278620 
1 1 1   10    1   42 o  170.471   2.8807  1184.94   40.030  1269.78   58.189  1108.71   55.154  176.432   4.0460  164.861   4.1042 11.57100 5.763179 
1 1 1   10    1   43 o  341.161   4.3902  4748.83  122.089  4673.97  170.393  4827.81  175.020  338.285   6.1792  343.799   6.2452 -5.514374 8.785519 
1 1 1   10    1   44 o  420.628   4.2558  7218.82  145.921  7326.89  255.829  7166.70  177.655  423.306   7.4141  418.997   5.2015 4.309143 9.056762 
1 1 1   10    1   46 o  231.012   2.1303  2175.75   40.116  2166.08   63.497  2182.17   51.752  230.445   3.3803  231.329   2.7445 -0.8848419 4.354118 
1 1 1   10    1   47 o   94.831   1.7762  366.613   13.730  354.936   21.823  374.264   17.665   93.247   2.8745   95.809   2.2619 -2.561623 3.657696 
1 1 1   10    1   48 o  112.112   1.9597  512.432   17.909  508.303   25.211  516.638   25.445  111.643   2.7703  112.554   2.7734 -0.9115372 3.919936 
1 1 1   10    1   49 o  220.842   2.0824  1988.49   37.487  2005.23   59.845  1977.67   48.092  221.709   3.3114  220.215   2.6791 1.494598 4.259429 
1 1 1   10    1   50 o  191.851   1.9479  1500.65   30.462  1504.83   48.516  1497.92   39.139  192.070   3.0988  191.656   2.5052 0.4140778 3.984791 
1 1 1   10    1   51 o  452.369   3.5256  8350.00  130.006  8337.85  205.609  8358.09  167.810  451.652   5.5847  452.417   4.5503 -0.7645874 7.203793 
1 1 1   10    1   52 o  353.477   2.8737  5096.51   82.801  5162.24  132.451  5054.34  106.086  355.534   4.5702  351.920   3.6981 3.613892 5.879001 
1 1 1   10    1   53 o  109.617   2.0056  489.931   17.921  514.800   25.655  466.235   25.044  112.343   2.8015  106.872   2.8773 5.471191 4.015932 
1 1 1   10    1   54 o   42.753   3.0782   74.954   10.656   71.597   14.767   78.600   15.391   41.638   4.4182   43.653   4.3846 -2.014660 6.224576 
1 1 1   10    1   55 o  165.129   2.0869  1111.86   28.091  1139.17   40.189  1085.79   39.278  167.105   2.9504  163.143   2.9536 3.962418 4.174771 
1 1 1   10    1   56 o   99.098   1.8557  400.403   14.990  399.863   19.693  401.148   23.115   99.017   2.4398   99.123   2.8638 -0.1056290 3.762205 
1 1 1   10    1   57 o  236.152   2.1996  2274.19   42.342  2303.35   55.341  2233.00   65.760  237.617   2.8571  233.911   3.4488 3.706055 4.478586 
1 1 1   10    1   58 o  108.765   1.8422  482.341   16.333  483.776   21.471  480.371   25.161  108.911   2.4186  108.475   2.8480 0.4356079 3.736347 
1 1 1   10    1   59 o  318.318   2.9959  4134.28   77.736  4161.85  111.062  4107.80  108.842  319.199   4.2684  317.129   4.2104 2.069946 5.995582 
1 1 1   10    1   60 o   51.509   2.1303  108.383   8.9254  103.948   10.726  118.370   16.095   50.412   2.6190   53.719   3.6982 -3.306610 4.531627 
1 1 1   10    1   61 o   58.971   2.2405  142.033   10.751  144.645   11.786  129.101   26.227   59.501   2.4352   55.858   5.8464 3.642296 6.333334 
1 1 1   10    1   62 o  122.222   1.7266  609.084   17.202  599.411   22.822  621.810   26.177  121.229   2.3094  123.462   2.6010 -2.232651 3.478335 
1 1 1   10    1   63 o   77.677   1.7338  246.019   10.978  246.217   15.820  245.835   15.247   77.651   2.5027   77.596   2.4134 0.5513000E-01 3.476770 
1 1 1   10    1   64 o  279.526   2.2132  3186.76   50.428  3213.51   71.783  3160.68   70.858  280.601   3.1383  278.286   3.1236 2.314423 4.427888 
1 1 1   10    1   65 o  152.664   1.6506  950.279   20.540  938.042   29.173  962.307   28.925  151.647   2.3600  153.598   2.3102 -1.951401 3.302521 
1 1 1   10    1   66 o  237.570   1.7288  2301.34   33.480  2291.15   47.193  2311.66   47.503  236.991   2.4429  238.049   2.4481 -1.057999 3.458463 
1 1 1   10    1   67 o   97.430   1.4964  387.024   11.885  394.099   18.027  381.584   15.806   98.295   2.2498   96.729   2.0046 1.565430 3.013321 
1 1 1   10    1   68 o   34.308   2.5617   48.290   7.1123   57.506   10.351   40.046   9.7894   37.370   3.4363   31.058   3.9565 6.312403 5.240383 
1 1 1   10    1   69 o  291.678   1.9946  3469.80   47.423  3553.30   68.286  3392.01   65.909  295.065   2.8391  288.296   2.8046 6.769562 3.990771 
1 1 1   10    1   70 o  258.455   1.9986  2724.48   42.106  2700.53   54.963  2758.50   65.512  257.251   2.6210  259.936   3.0918 -2.684723 4.053313 
1 1 1   10    1   71 o   80.951   1.6888  267.223   11.144  290.922   16.364  246.726   15.218   84.409   2.3807   77.727   2.4048 6.682587 3.383887 
1 1 1   10    1   72 o   90.284   1.7612  332.413   12.962  326.171   16.454  342.621   21.042   89.388   2.2600   91.576   2.8221 -2.188431 3.615552 
1 1 1   10    1   73 o   73.602   1.7932  220.933   10.758  206.727   17.222  230.024   13.777   71.096   2.9783   75.054   2.2545 -3.958321 3.735389 
1 1 1   10    1   74 o   44.051   2.1060   79.344   7.5403   74.453   11.136   83.486   10.247   42.572   3.2331   45.136   2.7988 -2.563576 4.276255 
1 1 1   10    1   75 o   95.105   1.4322  368.816   11.103  354.665   15.776  382.705   15.630   93.239   2.0757   96.859   1.9796 -3.619858 2.868292 
1 1 1   10    1   76 o  101.943   1.4156  423.774   11.763  429.028   16.960  418.903   16.329  102.548   2.0289  101.333   1.9769 1.214745 2.832759 
1 1 1   10    1   77 o  126.062   1.3944  648.024   14.329  655.326   20.481  641.024   20.055  126.738   1.9825  125.349   1.9627 1.389420 2.789731 
1 1 1   10    1   78 o  243.302   1.7582  2414.67   34.870  2375.91   48.902  2454.76   49.737  241.241   2.4868  245.211   2.4883 -3.969757 3.517911 
1 1 1   10    1   79 o  113.100   1.4003  521.646   12.910  508.827   18.234  534.529   18.281  111.669   2.0032  114.458   1.9593 -2.788391 2.802099 
1 1 1   10    1   80 o  109.514   1.4686  489.139   13.110  488.025   19.877  489.997   17.442  109.342   2.2302  109.582   1.9526 -0.2400436 2.964161 
1 1 1   10    1   81 o   43.401   2.0657   77.053   7.2869   80.328   11.353   74.758   9.5026   44.209   3.1715   42.687   2.7455 1.521732 4.194725 
1 1 1   10    1   82 o   99.874   1.6537  406.935   13.463  388.622   20.429  420.993   17.899   97.501   2.5727  101.550   2.1623 -4.048904 3.360727 
1 1 1   10    1   83 o  182.513   1.8674  1359.41   27.782  1395.25   37.041  1313.32   42.005  184.817   2.4587  179.235   2.8750 5.581589 3.782957 
1 1 1   10    1   84 o  108.791   1.4564  482.787   12.916  461.750   17.215  509.882   19.536  106.357   1.9856  111.748   2.1447 -5.391533 2.922737 
1 1 1   10    1   85 o   43.961   1.9228   79.039   6.8736   79.688   10.047   78.467   9.4246   44.056   2.8123   43.733   2.6563 0.3229141 3.868430 
1 1 1   10    1   86 o  113.546   1.3870  525.928   12.838  499.071   17.877  554.525   18.448  110.558   1.9837  116.543   1.9418 -5.984848 2.775921 
1 1 1   10    1   87 o   39.376   2.4762   63.630   7.9076   68.194   9.8708   55.452   13.212   40.707   2.9957   36.429   4.5481 4.278095 5.446081 
1 1 1   10    1   88 o   97.234   1.6014  385.865   12.693  365.892   16.048  419.241   20.744   94.640   2.0802  101.252   2.5134 -6.611565 3.262569 
1 1 1   10    1   89 o   73.300   1.8099  219.401   10.814  228.680   13.782  204.539   17.443   74.760   2.2642   70.588   3.0386 4.172089 3.789424 
1 1 1   10    1   90 o   20.542   4.5914   18.101   7.4944   10.828   9.1923   32.518   12.943   16.709   5.6647   27.432   5.9589 -10.72314 8.221789 
1 1 1   10    1   91 o   80.845   1.6503  266.886   10.876  266.148   13.867  268.065   17.529   80.657   2.1110   80.858   2.6632 -0.2007599 3.398336 
1 1 1   10    1   92 o   16.615   4.7610   11.715   6.7794   12.440   8.5541   10.490   11.117   17.343   5.4385   17.169   6.1989 0.1740265 8.246439 
1 1 1   10    1   93 o   58.979   1.8095  142.294   8.6894  143.906   11.040  139.670   14.087   59.249   2.2901   58.252   2.9766 0.9964600 3.755681 
1 1 1   10    1   94 o   17.249   4.5114   12.802   6.4143   3.2973   7.9659   30.327   10.817   12.631   5.0710   26.524   5.1889 -13.89313 7.255318 
1 1 1   10    1   95 o   66.804   1.4753  182.288   8.0335  190.424   11.865  175.401   10.917   68.164   2.1380   65.433   2.0493 2.731873 2.961477 
1 1 1   10    1   96 o   73.925   1.4270  223.236   8.5993  231.873   12.620  215.752   11.749   75.222   2.0602   72.571   1.9879 2.650406 2.862892 
1 1 1   10    1   97 o   45.084   1.9225   83.362   7.0491   81.579   9.6773   85.378   10.289   44.467   2.6823   45.472   2.7892 -1.004940 3.869650 
1 1 1   10    1   98 o   80.608   1.6294  265.754   10.706  279.599   15.678  253.658   14.655   82.497   2.3338   78.586   2.2902 3.911667 3.269795 
1 1 1   10    1   99 o   69.807   1.6754  199.423   9.5337  200.462   13.918  198.505   13.086   69.786   2.4504   69.481   2.3137 0.3048630 3.370153 
1 1 1   10    1  100 o   46.203   1.8928   87.645   7.1137   66.496   11.280  101.613   9.1665   39.860   3.5073   49.678   2.2696 -9.817753 4.177570 
1 1 1   10    1  101 o   92.639   1.3736  350.906   10.373  333.594   14.779  367.711   14.561   90.159   2.0110   94.696   1.8864 -4.537178 2.757271 
1 1 1   10    1  102 o   67.215   1.5073  184.901   8.2583  169.928   11.936  198.650   11.438   64.225   2.2836   69.527   2.0203 -5.301140 3.048973 
1 1 1   10    1  103 o   32.636   2.2806   44.061   6.0290   40.284   9.0176   47.115   8.1074   30.838   3.6585   33.580   2.9932 -2.741583 4.726915 
1 1 1   10    1  104 o   41.015   1.9459   69.262   6.4874   57.256   9.6433   79.187   8.7682   36.944   3.2347   43.732   2.4697 -6.787247 4.069772 
1 1 1   10    1  105 o   24.409   3.0171   25.127   5.8754   35.411   9.7565   19.276   7.3594   28.607   4.3184   20.927   4.4513 7.679882 6.201773 
1 1 1   10    1  106 o   16.747   3.9746   12.308   5.3439   9.2103   9.4183   13.779   6.4896   15.584   5.6942   17.638   4.4998 -2.053970 7.257564 
1 1 1   10    1  107 o   54.280   1.6822  121.037   7.4340  122.140   12.253  120.394   9.3518   54.158   2.7849   54.008   2.1284 0.1504211 3.505125 
1 1 1   10    1  108 o   53.387   2.1245  117.708   9.2272  131.626   12.384  100.338   13.835   56.234   2.7096   48.731   3.5062 7.502548 4.431219 
1 1 1   10    1  109 o   14.068   5.0657   7.6390   7.4177   10.798   9.9663   3.7152   11.107   16.353   5.8738   14.079   5.8573 2.273952 8.295181 
1 1 1   10    1  110 o   75.016   1.7193  231.352   10.514  250.313   13.813  205.238   16.211   77.797   2.1803   70.080   2.8436 7.716751 3.583261 
1 1 1   10    1  111 o   46.942   2.2114   91.404   8.4379   84.646   10.831  101.839   13.459   44.851   2.9793   48.992   3.3911 -4.140575 4.513958 
1 1 1   10    1  112 o   61.434   1.9145  155.917   9.5760  147.085   12.269  169.682   15.317   59.364   2.5413   63.502   2.9673 -4.137787 3.906819 
1 1 1   10    1  113 o   26.095   4.0038   29.956   8.2452   28.193   11.262   31.992   12.104   24.420   5.7530   25.993   5.8539 -1.572981 8.207648 
1 1 1   10    1  114 o   64.292   2.2719  172.200   11.888  163.018   14.321  192.542   21.316   62.180   2.8330   66.565   3.9462 -4.384823 4.857796 
1 1 1   10    1  115 o   21.076   5.0522   20.799   8.5670   23.619   10.835   16.097   13.993   22.042   5.9099   18.663   6.9197 3.378429 9.099924 
1 1 1   10    1  116 o   45.203   2.5008   85.939   9.1788   84.424   11.205   89.030   16.004   44.427   3.1137   44.554   4.4668 -0.1269302 5.444931 
1 1 1   10    1  117 o   30.174   4.1213   40.804   9.8721   43.971   13.377   37.017   14.630   30.228   5.6361   26.795   6.7127 3.433044 8.765077 
1 1 1   10    1  118 o   24.686   5.0463   28.940   9.8113   41.554   15.913   21.205   12.462   27.977   6.9967   20.238   6.5878 7.739265 9.609999 
1 1 1   10    1  119 o   69.081   2.1654  199.867   12.178  192.829   17.208  206.929   17.238   66.841   3.1673   69.379   3.0555 -2.538277 4.400887 
1 1 1   10    1  120 o   75.356   2.1217  237.761   13.020  229.938   18.306  245.770   18.521   73.037   3.0817   75.606   3.0111 -2.569023 4.308609 
1 1 1   10    1  121 o   9.8946   4.6201  -5.9034   9.1959 -11.4995   13.111  -0.4853   12.901   10.977   5.2404   12.946   5.8260 -1.969856 7.836111 
1 1 1   10    1  122 o   12.667   5.3393   3.9238   9.4146   17.372   13.424  -9.0951   13.208   18.287   6.7779   11.368   5.3789 6.918490 8.652898 
1 1 1   10    1  123 o   20.674   5.5711   21.673   9.5991   23.962   13.736   19.488   13.420   20.735   6.9241   18.995   6.8168 1.739183 9.716614 
1 1 1   10    1  124 o   8.5509   4.1676 -13.7120   9.4008  -0.7286   13.633 -25.4835   12.981   13.044   5.9180   9.0923   4.5183 3.952113 7.445637 
1 1 1   10    1  125 o   16.110   6.1016   12.475   11.002   14.314   14.223   9.7345   17.359   17.084   6.8037   16.314   7.0703 0.7695827 9.812232 
1 1 1   10    1  126 o   19.685   6.1507   20.744   10.951   16.542   14.303   26.697   17.025   17.736   6.8953   20.955   7.6559 -3.218601 10.30332 
1 1 1   10    1  127 o   31.064   5.2043   47.430   12.713   44.709   14.539   56.266   26.197   28.957   6.3361   27.201   9.5478 1.755764 11.45888 
1 1 1   10    1  128 o   14.937   6.1187   9.2247   11.870   4.6749   13.671   23.161   23.927   14.110   6.1916   19.435   8.3611 -5.325020 10.40405 
1 1 1   10    1  129 o   16.853   6.7044   14.490   13.796   2.1009   24.277   20.399   16.766   15.959   7.4696   18.732   7.4104 -2.773134 10.52180 
1 1 1   10    1  130 o   18.053   6.7689   18.002   13.464   29.135   22.950   12.160   16.625   20.653   8.4893   16.503   7.0314 4.150272 11.02310 
1 1 1   10    1  131 o   18.094   7.4393   17.954   17.629   9.7921   24.018   27.487   25.957   17.057   7.7837   20.190   8.6976 -3.133265 11.67195 
1 1 1   10    2 -129 o   16.273   5.7154   13.470   9.3885   7.0258   11.037   30.336   17.856   13.987   5.8306   21.706   7.8537 -7.718455 9.781410 
1 1 1   10    2 -128 o   11.556   5.0747   1.3533   9.1985   2.0981   10.993  -0.3863   16.800   12.519   5.5207   13.908   6.4068 -1.388270 8.457222 
1 1 1   10    2 -127 f   21.017   5.7474   23.211   10.128   18.725   11.170   43.938   24.011   18.564   6.2445   24.235   9.0491 -5.671515 10.99460 
1 1 1   10    2 -126 o   14.601   5.7349   9.2997   9.9777   6.7652   11.033   20.678   23.377   13.963   5.8256   18.993   8.2182 -5.030834 10.07360 
1 1 1   10    2 -125 o   14.907   5.7468   10.031   9.8726   15.512   12.506   0.9648   16.084   17.284   6.5145   14.080   6.4036 3.204389 9.134768 
1 1 1   10    2 -124 o   22.573   5.3204   25.521   9.6287   12.893   13.085   40.436   14.220   16.463   6.5357   27.428   6.4664 -10.96534 9.193985 
1 1 1   10    2 -123 o   36.740   3.3958   59.648   10.055   56.022   13.796   63.757   14.686   34.003   5.1372   36.341   5.0975 -2.337364 7.237066 
1 1 1   10    2 -122 o   11.773   5.2521  -0.1293   10.239   19.698   16.504 -12.5365   13.056   18.960   7.3967   10.710   5.1438 8.250270 9.009473 
1 1 1   10    2 -121 f   20.792   5.4736   21.721   9.4025   13.687   12.971   30.618   13.650   16.894   6.5667   23.644   6.7493 -6.750147 9.416755 
1 1 1   10    2 -120 o   12.121   5.1975   2.5077   9.1880   11.644   13.117  -6.2937   12.874   16.307   6.5206   11.727   5.4726 4.580458 8.512823 
1 1 1   10    2 -119 o   11.548   5.1353  -0.3657   9.7101 -10.1318   12.194   16.555   16.051   10.755   5.1118   18.276   7.2442 -7.521478 8.866161 
1 1 1   10    2 -118 o   29.042   3.9390   37.948   9.0850   28.709   10.758   60.923   16.964   24.078   5.5889   34.733   6.2200 -10.65448 8.362074 
1 1 1   10    2 -117 o   10.749   4.7907  -1.0692   8.4989   4.4687   10.157 -13.9994   15.520   13.284   5.5693   11.792   5.6491 1.491915 7.932842 
1 1 1   10    2 -116 o   27.529   3.7430   33.591   8.1821   35.619   10.768   30.820   12.587   27.565   4.9752   24.671   6.2521 2.893740 7.990038 
1 1 1   10    2 -115 o   13.197   5.1298   6.1718   7.9153   7.3470   10.350   4.5165   12.284   14.535   5.7990   14.296   6.0659 0.2390842 8.391852 
1 1 1   10    2 -114 o   12.554   5.0641   4.4848   7.9850  -1.8660   10.581   12.886   12.170   11.852   5.3094   17.156   6.4349 -5.304439 8.342481 
1 1 1   10    2 -113 o   16.482   5.7466   12.135   9.4805  -3.6092   12.052   37.693   15.355   12.252   5.5609   27.316   6.8962 -15.06352 8.858918 
1 1 1   10    2 -112 o   16.786   5.4802   12.794   8.6204   7.9920   11.986   17.940   12.407   15.540   6.2266   19.451   6.5813 -3.911183 9.059999 
1 1 1   10    2 -111 o   17.465   5.4899   13.925   8.7115   18.523   12.384   9.4206   12.257   19.825   6.5732   16.215   6.3600 3.610315 9.146405 
1 1 1   10    2 -110 o   33.256   3.1509   46.932   8.4398   51.762   11.080   40.256   13.026   34.534   4.0106   29.561   5.6108 4.973211 6.896851 
1 1 1   10    2 -109 o   15.200   5.3168   9.5405   8.1191   1.7149   10.504   21.154   12.796   13.087   5.5830   21.196   6.6524 -8.109476 8.684689 
1 1 1   10    2 -108 o   28.787   3.8902   35.783   8.8952   22.331   11.927   52.643   13.353   21.844   6.3320   34.509   4.8830 -12.66508 7.996141 
1 1 1   10    2 -107 o   44.133   2.5057   80.969   8.9771   74.241   11.495   91.488   14.373   41.911   3.3937   46.328   3.8405 -4.417442 5.125041 
1 1 1   10    2 -106 o   10.147   4.5533  -2.8472   7.8183  -3.8749   10.137  -1.3386   12.283   11.414   5.1479   13.273   5.8449 -1.858843 7.788683 
1 1 1   10    2 -105 o   35.810   2.9291   53.692   8.4757   57.409   11.124   48.550   13.086   36.727   3.7693   33.222   4.9860 3.505360 6.250437 
1 1 1   10    2 -104 o   27.920   3.6190   33.229   8.0429   41.783   10.515   21.167   12.486   31.119   4.2567   21.525   6.5398 9.594154 7.803159 
1 1 1   10    2 -103 o   31.278   3.4653   41.376   8.6873   32.142   11.558   53.365   13.170   26.801   5.4759   35.071   4.7272 -8.270063 7.234112 
1 1 1   10    2 -102 o   25.087   4.8978   27.716   9.6564   38.926   11.764   4.5591   16.907   29.797   5.0216   16.984   7.1569 12.81325 8.742866 
1 1 1   10    2 -101 o   10.090   4.6642  -6.6245   9.0168  -7.2355   10.838  -5.2506   16.251   11.168   5.1452   14.540   6.5413 -3.371221 8.322375 
1 1 1   10    2 -100 o   14.094   5.5215   5.5966   9.2284   5.2327   11.098   6.4118   16.612   14.835   5.9752   17.478   7.2074 -2.642835 9.362166 
1 1 1   10    2  -99 o   71.533   2.0471  210.178   11.924  223.212   14.171  178.571   22.069   73.625   2.3643   65.130   4.1789 8.495766 4.801345 
1 1 1   10    2  -98 o   77.329   1.8176  244.959   11.457  240.609   14.631  251.854   18.421   76.475   2.3498   78.054   2.9003 -1.579109 3.732719 
1 1 1   10    2  -97 o   54.349   2.5922  121.797   11.451  122.973   14.378  119.758   18.936   54.432   3.2553   53.320   4.3957 1.111530 5.469872 
1 1 1   10    2  -96 f   97.400   1.8169  388.295   14.425  366.220   17.172  441.228   26.591   94.490   2.2294  103.339   3.1604 -8.849304 3.867592 
1 1 1   10    2  -95 o   71.168   1.5989  207.057   9.2758  220.362   14.336  197.476   12.166   73.241   2.4045   69.384   2.1536 3.857124 3.227932 
1 1 1   10    2  -94 o   31.721   1.8434   41.299   4.7459   38.006   10.977   42.056   5.2633   29.859   4.6621   31.988   2.0290 -2.128839 5.084440 
1 1 1   10    2  -93 o  105.577   1.3097  455.069   11.271  433.191   18.524  467.931   14.203  102.849   2.2095  107.010   1.6283 -4.160835 2.744637 
1 1 1   10    2  -92 o   63.465   1.4334  164.466   7.4156  157.575   13.441  167.481   8.8913   61.926   2.6690   63.998   1.7059 -2.071815 3.167618 
1 1 1   10    2  -91 o   61.523   1.4569  154.535   7.3066  163.146   13.470  150.944   8.6975   63.039   2.6270   60.755   1.7581 2.283722 3.161001 
1 1 1   10    2  -90 o   79.968   1.3747  261.001   8.9611  268.773   15.611  257.181   10.944   81.005   2.3667   79.352   1.6919 1.653099 2.909264 
1 1 1   10    2  -89 o  101.870   1.3490  423.480   11.202  452.299   18.951  408.004   13.888  105.169   2.2106   99.954   1.7045 5.215096 2.791405 
1 1 1   10    2  -88 o   66.269   1.5530  179.260   8.3893  176.475   15.534  180.407   9.9678   65.564   2.9139   66.435   1.8424 -0.8708267 3.447532 
1 1 1   10    2  -87 o   7.0537   3.3758  -7.6773   5.5122 -10.0086   12.491  -7.1135   6.1426   11.864   5.4862   7.7787   3.6768 4.084813 6.604349 
1 1 1   10    2  -86 o  152.963   1.4007  954.606   17.465  974.116   27.589  941.560   22.561  154.403   2.1920  151.860   1.8225 2.543091 2.850716 
1 1 1   10    2  -85 o   72.352   1.4933  213.589   8.8071  215.932   14.679  212.271   11.009   72.636   2.4828   72.082   1.8752 0.5546494 3.111362 
1 1 1   10    2  -84 o   39.332   2.0310   63.337   6.4895   57.779   12.093   65.585   7.6907   37.301   4.0416   39.994   2.3697 -2.693150 4.685102 
1 1 1   10    2  -83 f   97.554   1.3904  388.193   11.057  371.757   17.426  399.268   14.305   95.405   2.2408   98.911   1.7742 -3.506020 2.858166 
1 1 1   10    2  -82 o   90.693   1.4019  335.493   10.364  340.622   16.548  332.183   13.295   91.330   2.2227   90.221   1.8077 1.108879 2.865035 
1 1 1   10    2  -81 o  142.575   1.3587  829.060   15.791  848.029   25.012  816.490   20.362  144.125   2.1290  141.457   1.7658 2.668732 2.766007 
1 1 1   10    2  -80 o  110.999   1.4001  502.505   12.668  518.634   22.061  494.569   15.474  112.691   2.4015  110.099   1.7242 2.591759 2.956404 
1 1 1   10    2  -79 o  136.360   1.6912  758.557   18.798  776.153   33.007  750.110   22.869  137.801   2.9385  135.566   2.0695 2.234207 3.594060 
1 1 1   10    2  -78 o   70.561   1.9287  203.311   11.083  214.663   19.622  197.993   13.430   72.373   3.3350   69.598   2.3708 2.775383 4.091815 
1 1 1   10    2  -77 o  153.943   1.7208  966.713   21.594  968.683   37.558  965.741   26.392  153.967   2.9925  153.833   2.1047 0.1340179 3.658520 
1 1 1   10    2  -76 o   79.376   1.7572  257.011   11.369  266.394   18.305  251.118   14.507   80.713   2.7864   78.406   2.2722 2.307091 3.595397 
1 1 1   10    2  -75 o   92.274   1.6808  347.282   12.642  348.658   19.660  346.312   16.508   92.372   2.6136   92.121   2.1984 0.2510452 3.415215 
1 1 1   10    2  -74 o  129.558   1.4964  684.498   15.804  689.572   22.574  679.621   22.132  130.001   2.1302  129.061   2.1038 0.9397278 2.993915 
1 1 1   10    2  -73 o  137.953   1.3733  775.991   15.444  775.436   23.938  776.387   20.212  137.863   2.1302  137.968   1.7972 -0.1049347 2.787040 
1 1 1   10    2  -72 o   73.868   1.5601  222.506   9.3941  232.427   15.175  216.342   11.962   75.427   2.4714   72.797   2.0177 2.630005 3.190466 
1 1 1   10    2  -71 o   48.933   2.0321   97.838   8.0878   99.631   13.512   96.837   10.096   49.270   3.3849   48.645   2.5551 0.6250153 4.240950 
1 1 1   10    2  -70 o  240.674   1.9272  2362.47   37.809  2350.86   58.442  2370.82   49.584  239.965   2.9877  241.039   2.5236 -1.073792 3.910869 
1 1 1   10    2  -69 o   92.758   1.7819  350.880   13.474  379.616   23.041  335.948   16.609   96.389   2.9359   90.747   2.2453 5.641991 3.696117 
1 1 1   10    2  -68 o   89.355   1.7338  325.600   12.629  322.025   20.913  327.652   15.844   88.774   2.8939   89.623   2.1687 -0.8492813 3.616307 
1 1 1   10    2  -67 o   66.745   1.8876  181.825   10.259  177.678   17.375  184.045   12.712   65.887   3.2452   67.127   2.3266 -1.240242 3.993062 
1 1 1   10    2  -66 o   48.840   2.2947   97.518   9.1101   99.912   17.457   96.622   10.680   49.239   4.3955   48.585   2.7073 0.6541061 5.162357 
1 1 1   10    2  -65 o   80.379   1.6493  263.437   10.806  265.362   17.467  262.243   13.754   80.601   2.6622   80.158   2.1068 0.4425583 3.394999 
1 1 1   10    2  -64 o   78.369   1.6387  250.419   10.469  239.073   16.389  258.240   13.606   76.503   2.6320   79.545   2.1002 -3.041908 3.367240 
1 1 1   10    2  -63 o   69.037   1.9957  194.533   11.219  204.751   15.195  182.284   16.636   70.793   2.6378   66.760   3.0652 4.032738 4.043918 
1 1 1   10    2  -62 o  112.558   1.5065  516.531   13.823  517.279   21.441  515.999   18.082  112.613   2.3357  112.487   1.9720 0.1268005 3.056856 
1 1 1   10    2  -61 o  128.877   1.3648  677.124   14.337  702.685   19.949  649.815   20.620  131.272   1.8643  126.232   2.0039 5.039696 2.737014 
1 1 1   10    2  -60 o   46.261   2.1391   87.464   8.0447   80.293   10.986   95.755   11.813   44.251   3.0645   48.347   3.0124 -4.096092 4.297206 
1 1 1   10    2  -59 o   98.062   1.5132  392.043   12.096  393.124   16.482  390.782   17.807   98.184   2.0593   97.887   2.2317 0.2976074 3.036625 
1 1 1   10    2  -58 o   88.728   1.3617  320.946   9.8485  324.651   12.354  314.487   16.312   89.233   1.6984   87.783   2.2816 1.450417 2.844383 
1 1 1   10    2  -57 o  100.382   1.2827  410.777   10.496  408.289   13.780  414.215   16.199  100.070   1.6893  100.787   1.9717 -0.7171860 2.596435 
1 1 1   10    2  -56 o  201.767   1.4840  1659.67   24.407  1669.43   32.669  1647.35   36.717  202.338   1.9807  200.982   2.2411 1.355576 2.990982 
1 1 1   10    2  -55 o  217.977   1.5423  1937.08   27.404  1910.02   36.340  1972.75   41.725  216.425   2.0599  219.936   2.3274 -3.510376 3.108016 
1 1 1   10    2  -54 o  319.006   2.0947  4149.73   54.469  4084.97   75.816  4218.82   78.308  316.431   2.9393  321.568   2.9874 -5.137329 4.190954 
1 1 1   10    2  -53 o  161.960   1.4438  1069.35   19.061  1044.97   23.724  1113.73   32.013  160.092   1.8180  165.254   2.3765 -5.161819 2.992094 
1 1 1   10    2  -52 f  221.161   1.6503  1994.12   29.752  1985.46   37.399  2009.03   49.102  220.662   2.0792  221.932   2.7142 -1.269867 3.419051 
1 1 1   10    2  -51 o  154.400   1.5252  971.870   19.196  952.072   24.935  1000.68   30.078  152.806   2.0019  156.646   2.3555 -3.839325 3.091265 
1 1 1   10    2  -50 o   51.222   1.8738  107.114   7.8107  104.840   10.165  110.392   12.205   50.642   2.4698   51.941   2.8942 -1.299099 3.804707 
1 1 1   10    2  -49 o  325.232   2.4745  4313.70   65.602  4359.72   93.825  4269.68   91.760  326.862   3.5214  323.474   3.4800 3.388306 4.950834 
1 1 1   10    2  -48 o  393.457   2.8743  6314.45   92.186  6386.31  131.839  6245.69  128.952  395.534   4.0891  391.162   4.0442 4.372253 5.751177 
1 1 1   10    2  -47 o  201.504   1.8522  1655.41   30.423  1651.45   43.398  1659.24   42.661  201.231   2.6457  201.708   2.5946 -0.4765167 3.705609 
1 1 1   10    2  -46 o  194.334   1.5310  1539.54   24.253  1491.00   33.966  1590.03   34.643  191.227   2.1790  197.476   2.1521 -6.249069 3.062624 
1 1 1   10    2  -45 o  235.964   1.6007  2269.79   30.789  2285.46   46.564  2257.61   41.041  236.746   2.4129  235.311   2.1397 1.435028 3.224918 
1 1 1   10    2  -44 o  256.188   1.6862  2675.56   35.212  2682.08   53.061  2670.44   47.071  256.465   2.5381  255.921   2.2564 0.5439606 3.396063 
1 1 1   10    2  -43 o  256.592   1.6873  2683.98   35.291  2706.31   53.396  2666.66   47.027  257.624   2.5427  255.742   2.2558 1.881683 3.399091 
1 1 1   10    2  -42 o  245.418   1.7281  2455.31   34.572  2454.10   49.381  2456.46   48.417  245.333   2.4693  245.452   2.4199 -0.1197662 3.457304 
1 1 1   10    2  -41 o  316.570   2.0688  4085.66   53.386  4088.96   76.036  4082.45   74.974  316.655   2.9458  316.405   2.9069 0.2496338 4.138560 
1 1 1   10    2  -40 o  463.815   3.0296  8772.62  114.542  8741.60  174.799  8795.96  151.635  462.829   4.6332  464.339   4.0062 -1.509918 6.125015 
1 1 1   10    2  -39 o   82.360   1.4485  276.499   9.7245  278.247   15.500  275.365   12.488   82.581   2.3048   82.188   1.8640 0.3927231 2.964233 
1 1 1   10    2  -38 f  322.767   2.4235  4247.33   63.763  4109.73  108.964  4318.98   78.631  317.398   4.2115  325.453   2.9639 -8.055054 5.149959 
1 1 1   10    2  -37 o  188.660   1.5920  1450.84   24.482  1430.54   37.522  1465.88   32.306  187.320   2.4574  189.627   2.0900 -2.307556 3.225961 
1 1 1   10    2  -36 o  229.994   1.7755  2156.27   33.288  2112.68   50.879  2188.89   44.015  227.635   2.7420  231.715   2.3303 -4.080536 3.598423 
1 1 1   10    2  -35 o  235.923   1.6875  2268.82   32.453  2238.37   45.933  2299.18   45.859  234.319   2.4048  237.482   2.3690 -3.162369 3.375662 
1 1 1   10    2  -34 o  375.032   2.3659  5733.81   72.327  5742.93  102.860  5724.90  101.721  375.286   3.3624  374.698   3.3304 0.5880737 4.732564 
1 1 1   10    2  -33 o  195.155   1.5240  1552.41   24.244  1567.62   34.976  1538.34   33.635  196.100   2.1880  194.261   2.1241 1.838440 3.049458 
1 1 1   10    2  -32 o  220.830   1.6259  1987.76   29.268  1943.68   41.298  2032.24   41.485  218.356   2.3202  223.277   2.2793 -4.920013 3.252496 
1 1 1   10    2  -31 o  381.753   2.5733  5941.18   80.077  6076.02  107.982  5776.42  119.363  386.026   3.4316  376.366   3.8907 9.659912 5.187794 
1 1 1   10    2  -30 o   83.191   1.6905  282.098   11.464  313.211   17.052  256.439   15.486   87.622   2.3897   79.277   2.3991 8.344566 3.386174 
1 1 1   10    2  -29 o  343.898   2.5541  4821.21   71.600  4811.84  101.416  4830.52  101.099  343.528   3.6217  344.195   3.6034 -0.6668396 5.108885 
1 1 1   10    2  -28 o  373.738   2.5251  5694.09   76.928  5705.63  101.973  5678.86  117.192  374.090   3.3441  373.190   3.8524 0.8990784 5.101354 
1 1 1   10    2  -27 o  563.793   3.6174 12960.12  166.249 12893.68  219.064 13050.37  255.294  562.267   4.7796  565.610   5.5372 -3.342590 7.314705 
1 1 1   10    2  -26 o  417.052   2.5849  7090.32   87.876  7050.96  124.024  7130.00  124.528  415.855   3.6587  418.179   3.6531 -2.324615 5.170277 
1 1 1   10    2  -25 o  476.248   2.9022  9246.29  112.667  9186.46  158.762  9307.00  159.915  474.652   4.1033  477.756   4.1063 -3.103485 5.805041 
1 1 1   10    2  -24 o  304.543   2.0078  3780.47   49.843  3803.14   71.077  3758.54   69.915  305.439   2.8547  303.643   2.8247 1.795532 4.016028 
1 1 1   10    2  -23 o  354.173   2.2563  5113.16   65.141  5027.93   91.217  5201.86   93.059  351.187   3.1864  357.210   3.1959 -6.022400 4.512990 
1 1 1   10    2  -22 o  128.728   1.5764  675.420   16.541  729.270   25.332  635.391   21.840  133.756   2.3233  124.852   2.1460 8.904503 3.162764 
1 1 1   10    2  -21 o  758.030   4.4660 23430.01  275.959 23235.31  387.704 23629.94  392.877  754.708   6.3021  761.086   6.3327 -6.378845 8.934162 
1 1 1   10    2  -20 o  598.659   3.5744 14611.16  174.427 14808.10  249.743 14423.60  243.721  602.594   5.0843  594.723   5.0274 7.871033 7.150175 
1 1 1   10    2  -19 o  361.304   2.2944  5321.09   67.575  5305.96   95.682  5336.14   95.448  360.770   3.2536  361.795   3.2364 -1.024780 4.589168 
1 1 1   10    2  -18 o  198.834   1.7788  1611.45   28.831  1709.68   52.598  1569.26   34.471  204.790   3.1508  196.211   2.1553 8.579346 3.817413 
1 1 1   10    2  -17 o  234.947   1.8032  2249.96   34.534  2246.27   46.128  2254.67   52.092  234.748   2.4106  235.183   2.7172 -0.4349823 3.632407 
1 1 1   10    2  -16 o  214.156   1.7140  1869.36   29.921  1862.35   39.938  1878.32   45.174  213.750   2.2922  214.661   2.5817 -0.9113770 3.452406 
1 1 1   10    2  -15 o  156.165   1.6534  994.026   21.048  1047.61   31.741  951.970   28.119  160.315   2.4289  152.822   2.2572 7.492096 3.315828 
1 1 1   10    2  -14 o  317.736   2.3980  4115.15   62.109  4040.44   86.902  4193.17   88.801  314.821   3.3863  320.716   3.3967 -5.894714 4.796357 
1 1 1   10    2  -13 o  361.272   2.9069  5320.39   85.607  5182.87  108.582  5546.27  139.161  356.554   3.7359  368.816   4.6288 -12.26215 5.948386 
1 1 1   10    2  -12 o  518.281   3.6228 10950.71  153.054 10907.18  215.759 10994.79  217.150  517.188   5.1178  519.260   5.1302 -2.072388 7.246481 
1 1 1   10    2  -11 o  374.736   2.7408  5724.21   83.721  5673.72  117.667  5775.96  119.145  373.054   3.8694  376.400   3.8832 -3.345734 5.481943 
1 1 1   10    2  -10 o  402.392   2.9092  6600.41   95.425  6554.58  134.333  6647.09  135.579  400.962   4.1100  403.781   4.1192 -2.819305 5.818916 
1 1 1   10    2   -9 o  347.961   2.5907  4935.38   73.484  4875.47  103.166  4997.08  104.694  345.823   3.6597  350.109   3.6685 -4.285919 5.181811 
1 1 1   10    2   -8 o  782.024   4.9280 24936.35  314.145 25829.06  495.101 24334.74  406.441  795.660   7.6336  772.414   6.4552 23.24561 9.997101 
1 1 1   10    2   -7 o  272.832   2.3986  3034.17   53.344  3327.96   92.256  2886.61   65.382  285.710   3.9613  266.107   3.0142 19.60321 4.977637 
1 1 1   10    2   -6 o  639.451   4.8268 16672.35  251.595 16550.57  396.981 16754.10  325.259  636.916   7.6463  640.930   6.2256 -4.014404 9.860235 
1 1 1   10    2   -5 o  571.424   3.9677 13311.96  184.814 13333.74  262.334 13290.50  260.408  571.812   5.6281  570.886   5.5959 0.9260864 7.936619 
1 1 1   10    2   -4 o  284.201   2.2468  3292.27   52.050  3371.12   75.643  3221.37   71.732  287.571   3.2269  281.113   3.1304 6.458557 4.495800 
1 1 1   10    2   -3 o  919.570   5.7613 34484.50  431.858 35076.18  580.036 33748.54  646.900  927.221   7.6742  909.369   8.7269 17.85205 11.62124 
1 1 1   10    2   -2 o  258.369   2.1187  2720.94   44.622  2748.00   55.264  2670.27   75.635  259.645   2.6111  255.933   3.6255 3.711975 4.467872 
1 1 1   10    2   -1 o   75.055   1.9949  229.775   12.194  231.561   18.168  228.310   16.450   75.311   2.9653   74.791   2.7026 0.5205002 4.012129 
1 1 1   10    2    0 o  349.882   2.8587  4990.12   81.533  4966.21  105.213  5026.05  129.000  349.027   3.6981  351.103   4.5073 -2.076416 5.830229 
1 1 1   10    2    1 o  581.455   3.7323 13782.96  176.898 13622.18  231.951 14006.49  273.494  578.003   4.9230  586.057   5.7250 -8.053833 7.550574 
1 1 1   10    2    2 o  616.347   3.9377 15487.15  197.837 15519.92  262.491 15444.07  301.015  616.936   5.2196  615.380   6.0008 1.555603 7.953235 
1 1 1   10    2    3 o  799.296   5.4355 26052.07  354.145 26174.42  503.305 25932.08  498.402  800.965   7.7087  797.253   7.6692 3.712402 10.87384 
1 1 1   10    2    4 o  550.194   3.8355 12340.94  172.020 12654.22  248.923 12054.56  237.991  557.060   5.4819  543.706   5.3698 13.35339 7.673708 
1 1 1   10    2    5 o  818.706   5.5611 27333.52  371.131 27445.39  456.413 27115.19  637.617  820.269   6.8260  814.998   9.5977 5.271057 11.77752 
1 1 1   10    2    6 o  713.063   4.8751 20732.04  283.368 20872.96  349.321 20460.86  484.575  715.407   5.9901  708.096   8.3952 7.311035 10.31318 
1 1 1   10    2    7 o  443.268   2.9307  8009.49  105.893  8057.01  141.059  7948.13  160.288  444.556   3.8926  441.523   4.4536 3.032196 5.914983 
1 1 1   10    2    8 o  161.110   1.7226  1057.97   22.623  1060.67   32.931  1055.56   31.131  161.310   2.5045  160.923   2.3732 0.3875885 3.450301 
1 1 1   10    2    9 o  110.449   1.8146  497.228   16.337  521.519   26.903  483.036   20.563  113.072   2.9212  108.859   2.3173 4.212288 3.728728 
1 1 1   10    2   10 o  476.579   3.6861  9259.39  143.200  9456.54  230.523  9135.51  182.732  481.535   5.8729  473.343   4.7359 8.192535 7.544505 
1 1 1   10    2   11 o  188.970   1.9436  1455.53   29.939  1423.29   47.144  1477.32   38.757  186.855   3.0952  190.375   2.4975 -3.520004 3.977148 
1 1 1   10    2   12 o  157.040   2.3379  1005.24   29.928   0.0000   0.0000  1005.24   29.928  ?   ?   157.040   2.3379 0.000000 2.337923 
1 1 1   10    2   13 o  264.067   2.5946  2842.42   55.849  2903.37  114.176  2823.25   64.032  266.831   5.2493  263.169   2.9849 3.661194 6.038597 
1 1 1   10    2   14 o  476.624   4.1172  9261.86  159.959  9508.85  327.343  9184.38  183.340  482.698   8.3194  474.602   4.7391 8.096313 9.574486 
1 1 1   10    2   15 o  230.051   2.7512  2157.33   51.592  2145.07   90.024  2163.32   62.956  229.362   4.8151  230.362   3.3527 -1.000305 5.867301 
1 1 1   10    2   16 o  241.623   2.8236  2379.86   55.614  2302.40   95.275  2419.89   68.494  237.620   4.9188  243.637   3.4488 -6.016769 6.007426 
1 1 1   10    2   17 o  531.475   4.5346 11517.33  196.454 11200.71  271.512 11865.23  284.607  524.014   6.3564  539.326   6.4738 -15.31226 9.072665 
1 1 1   10    2   18 o  647.763   5.4436 17112.13  287.434 17129.76  406.935 17094.57  406.053  647.899   7.7052  647.234   7.6964 0.6649170 10.89053 
1 1 1   10    2   19 o  145.779   1.7682  866.216   21.011  828.403   32.902  892.256   27.304  142.555   2.8314  147.951   2.2640 -5.396545 3.625272 
1 1 1   10    2   20 o  361.835   2.9063  5337.11   85.720  5388.29  136.655  5303.91  110.067  363.515   4.6118  360.686   3.7436 2.829285 5.939958 
1 1 1   10    2   21 o  605.623   4.5713 14955.91  225.672 14870.49  355.079 15013.79  292.300  603.680   7.2158  606.698   5.9104 -3.017822 9.327403 
1 1 1   10    2   22 o  322.731   2.6577  4245.78   69.918  4218.61  110.118  4264.14   90.501  321.657   4.1998  323.410   3.4329 -1.752838 5.424304 
1 1 1   10    2   23 o  196.877   1.9489  1579.92   31.277  1609.87   50.256  1560.98   39.958  198.721   3.1025  195.687   2.5050 3.033081 3.987530 
1 1 1   10    2   24 o  219.642   2.0565  1966.45   36.819  1977.89   58.688  1959.02   47.281  220.262   3.2687  219.219   2.6459 1.043259 4.205381 
1 1 1   10    2   25 o   78.320   1.8826  250.027   12.019  258.278   19.787  245.203   15.130   79.537   3.0577   77.521   2.3972 2.015549 3.885342 
1 1 1   10    2   26 o  466.270   3.6079  8864.10  137.130  8844.60  216.754  8877.12  177.072  465.631   5.7107  466.556   4.6560 -0.9250488 7.368163 
1 1 1   10    2   27 o  245.399   2.1974  2454.78   43.956  2483.76   70.286  2436.18   56.330  246.817   3.4935  244.456   2.8269 2.360672 4.493932 
1 1 1   10    2   28 o   29.771   3.6948   36.694   8.7742   37.723   14.267   36.068   11.127   29.868   6.0670   29.356   4.8171 0.5121956 7.746823 
1 1 1   10    2   29 o  319.266   2.6381  4155.36   68.657  4210.13  109.920  4120.32   87.916  321.309   4.1968  317.894   3.3927 3.415039 5.396634 
1 1 1   10    2   30 o  334.613   2.7356  4564.59   74.616  4704.54  120.933  4478.56   94.815  339.638   4.3681  331.418   3.5097 8.219971 5.603381 
1 1 1   10    2   31 o  508.025   3.8959 10524.65  161.335 10832.03  261.514 10335.78  204.993  515.177   6.2273  503.360   4.9960 11.81732 7.983748 
1 1 1   10    2   32 o  119.344   1.7296  580.567   16.826  596.633   27.368  570.804   21.334  120.973   2.7754  118.332   2.2118 2.641479 3.548899 
1 1 1   10    2   33 o  172.168   1.8490  1208.28   25.949  1170.59   40.827  1233.83   33.612  169.444   2.9558  173.971   2.3701 -4.527832 3.788751 
1 1 1   10    2   34 o   15.587   5.3750   8.9451   8.2838   16.208   13.694   4.7531   10.403   20.604   6.9139   14.761   5.8380 5.842827 9.049014 
1 1 1   10    2   35 o  155.168   1.7848  981.453   22.575  966.559   35.773  991.309   29.101  153.969   2.8502  155.938   2.2894 -1.968613 3.655866 
1 1 1   10    2   36 o  337.508   2.7554  4644.35   75.806  4576.61  118.808  4690.87   98.452  334.950   4.3514  339.154   3.5612 -4.204163 5.622849 
1 1 1   10    2   37 o  177.308   2.3715  1281.68   34.275  1216.86   57.950  1316.56   42.508  172.718   4.1160  179.692   2.9021 -6.973953 5.036231 
1 1 1   10    2   38 f  277.259   3.0677  3134.64   69.332  3128.92  119.575  3137.54   85.097  276.872   5.2982  277.353   3.7640 -0.4803162 6.499057 
1 1 1   10    2   39 o  197.124   3.0639  1584.56   49.232  1580.48   69.218  1588.74   70.039  196.820   4.3143  197.332   4.3542 -0.5120087 6.129643 
1 1 1   10    2   40 o  204.959   3.1245  1713.12   52.202  1704.44   73.423  1722.01   74.233  204.381   4.4071  205.431   4.4330 -1.049362 6.250929 
1 1 1   10    2   41 o  238.999   3.4433  2329.80   67.081  2329.80   67.081   0.0000   0.0000  238.999   3.4433  ?   ?  0.000000 3.443254 
1 1 1   10    2   42 o  306.592   2.8791  3833.25   71.954  3919.07  103.331  3752.45  100.255  309.919   4.0902  303.262   4.0556 6.656830 5.759988 
1 1 1   10    2   43 o  189.434   2.1690  1463.07   33.493  1399.82   46.087  1533.86   48.759  185.264   3.0518  193.930   3.0844 -8.666092 4.339015 
1 1 1   10    2   44 o  225.057   2.0960  2065.07   38.452  2106.58   62.013  2039.15   49.011  227.249   3.3477  223.616   2.6888 3.633102 4.293789 
1 1 1   10    2   45 o  169.458   1.8454  1170.70   25.490  1171.18   40.731  1170.39   32.682  169.457   2.9487  169.421   2.3665 0.3608704E-01 3.780855 
1 1 1   10    2   46 o  314.339   2.6187  4029.51   67.101  4035.36  106.552  4025.67   86.381  314.429   4.1572  314.129   3.3734 0.3001404 5.353737 
1 1 1   10    2   47 o   60.946   2.0753  151.622   10.295  141.603   16.464  158.054   13.192   58.812   3.4495   62.200   2.6077 -3.388165 4.324202 
1 1 1   10    2   48 o  295.646   2.5069  3564.54   60.415  3521.25   95.088  3593.85   78.236  293.715   3.9716  296.801   3.2337 -3.085907 5.121553 
1 1 1   10    2   49 o  187.616   1.9268  1435.17   29.468  1448.65   47.334  1426.63   37.654  188.443   3.0815  187.036   2.4698 1.407196 3.949080 
1 1 1   10    2   50 o  212.488   2.0407  1841.01   35.347  1862.58   56.782  1827.36   45.165  213.660   3.2603  211.670   2.6176 1.989517 4.181054 
1 1 1   10    2   51 o  193.253   1.9426  1522.76   30.602  1552.32   49.390  1504.34   38.988  195.061   3.1062  192.057   2.4904 3.004013 3.981312 
1 1 1   10    2   52 f  119.347   1.7347  580.720   16.876  598.685   27.693  570.106   21.286  121.147   2.8042  118.239   2.2084 2.908020 3.569452 
1 1 1   10    2   53 o  179.936   1.8912  1320.11   27.739  1341.52   44.837  1306.83   35.307  181.333   3.0334  179.006   2.4197 2.326599 3.880235 
1 1 1   10    2   54 o  177.124   1.8768  1279.19   27.098  1314.24   43.987  1257.75   34.400  179.479   3.0066  175.611   2.4031 3.867615 3.848992 
1 1 1   10    2   55 o  142.654   1.6436  829.684   19.113  824.484   28.002  834.220   26.152  142.180   2.4161  143.024   2.2432 -0.8437500 3.296861 
1 1 1   10    2   56 o   67.046   1.8746  183.435   10.235  183.902   15.612  183.082   13.554   67.078   2.8619   66.951   2.4879 0.1269989 3.792102 
1 1 1   10    2   57 o  203.444   2.0195  1687.78   33.491  1714.71   44.438  1652.37   50.955  205.023   2.6590  201.229   3.1064 3.793808 4.089026 
1 1 1   10    2   58 o  261.404   2.6042  2787.44   55.490  2823.07   80.843  2755.70   76.303  262.945   3.7718  259.809   3.6029 3.135925 5.216039 
1 1 1   10    2   59 o  196.866   2.2385  1580.63   35.923  1657.74   54.067  1519.70   48.066  201.534   3.2912  192.980   3.0555 8.554504 4.490894 
1 1 1   10    2   60 o   67.631   2.0614  186.700   11.351  204.348   20.718  179.130   13.569   70.654   3.6092   66.219   2.5183 4.435287 4.400891 
1 1 1   10    2   61 o   48.889   2.2071   97.681   8.7731   79.962   12.810  113.336   12.040   44.108   3.5938   52.629   2.8169 -8.520218 4.566176 
1 1 1   10    2   62 o  290.141   2.0990  3433.19   49.642  3449.20   66.186  3412.59   75.056  290.747   2.7926  289.151   3.1844 1.595581 4.235474 
1 1 1   10    2   63 o  214.391   1.7499  1874.19   30.581  1956.77   41.694  1778.04   44.990  219.025   2.3353  208.758   2.6438 10.26628 3.527533 
1 1 1   10    2   64 o   98.964   1.4759  399.306   11.906  403.308   16.738  395.208   16.939   99.443   2.0649   98.438   2.1110 1.005142 2.952979 
1 1 1   10    2   65 o  317.390   2.2292  4108.98   57.673  4159.91   77.823  4046.93   85.899  319.251   2.9904  314.830   3.3471 4.421295 4.488449 
1 1 1   10    2   66 o   40.427   2.1978   66.863   7.2155   79.960   11.530   58.432   9.2508   44.138   3.2271   37.714   3.0347 6.424217 4.429852 
1 1 1   10    2   67 o  257.716   2.0014  2708.88   42.044  2718.63   55.207  2695.40   64.873  258.116   2.6239  256.951   3.0973 1.164856 4.059301 
1 1 1   10    2   68 o  167.209   1.4416  1139.96   19.649  1141.10   30.101  1139.12   25.938  167.251   2.2079  167.124   1.9040 0.1262817 2.915469 
1 1 1   10    2   69 o  238.480   1.8720  2319.47   36.391  2300.77   56.362  2332.84   47.657  237.410   2.9124  239.113   2.4450 -1.703110 3.802681 
1 1 1   10    2   70 o   88.517   1.4645  319.474   10.567  326.326   16.847  315.030   13.567   89.405   2.3136   87.888   1.8938 1.517189 2.989849 
1 1 1   10    2   71 o  148.324   1.3847  897.002   16.742  919.982   25.992  880.708   21.887  150.173   2.1233  146.950   1.8272 3.223312 2.801221 
1 1 1   10    2   72 o  134.199   1.4667  734.349   16.045  735.684   22.689  733.014   22.693  134.290   2.0727  134.046   2.0768 0.2441101 2.934141 
1 1 1   10    2   73 o   66.177   2.1696  178.873   11.688  173.575   16.476  184.240   16.582   65.114   3.1132   67.095   3.0398 -1.981895 4.351086 
1 1 1   10    2   74 o  174.417   1.5221  1240.59   21.640  1273.56   31.178  1209.95   30.059  176.669   2.1650  172.202   2.1414 4.466660 3.045156 
1 1 1   10    2   75 o  133.952   1.4401  731.704   15.724  741.117   22.555  722.802   21.934  134.773   2.0530  133.100   2.0216 1.673584 2.881305 
1 1 1   10    2   76 o  205.339   1.8443  1720.08   30.870  1726.48   44.211  1713.99   43.122  205.621   2.6377  204.884   2.5820 0.7367859 3.691087 
1 1 1   10    2   77 o   68.342   1.7301  190.649   9.6303  173.864   14.722  203.204   12.732   65.182   2.7771   70.525   2.2175 -5.342667 3.553834 
1 1 1   10    2   78 o   35.618   2.2299   51.987   6.4416   41.014   11.664   56.802   7.7268   31.272   4.7227   37.207   2.5634 -5.934471 5.373506 
1 1 1   10    2   79 o  172.953   1.4772  1220.04   20.826  1215.81   30.312  1223.82   28.662  172.582   2.1547  173.165   2.0305 -0.5828400 2.960683 
1 1 1   10    2   80 o  246.838   1.8694  2486.34   37.614  2546.09   51.656  2418.89   54.877  249.658   2.5383  243.290   2.7671 6.367874 3.754999 
1 1 1   10    2   81 o  178.254   1.4158  1296.00   20.573  1362.61   32.265  1250.36   26.706  182.687   2.1666  175.039   1.8717 7.647934 2.863119 
1 1 1   10    2   82 o   19.713   3.4115   16.362   5.2836   5.3706   9.7853   20.885   6.2773   14.589   5.6943   22.307   3.5728 -7.717829 6.722348 
1 1 1   10    2   83 f  135.256   1.3091  746.160   14.434  755.888   22.539  739.397   18.793  136.066   2.0321  134.607   1.7128 1.458649 2.657609 
1 1 1   10    2   84 o   28.184   2.3975   32.692   5.4558   34.510   10.013   31.925   6.5065   28.645   4.4309   27.783   2.9164 0.8620949 5.304539 
1 1 1   10    2   85 o   87.513   1.3147  312.406   9.3786  300.007   15.202  320.025   11.917   85.669   2.1786   88.553   1.6509 -2.883728 2.733492 
1 1 1   10    2   86 o   40.415   1.8281   66.825   6.0069   70.710   11.091   65.212   7.1456   41.403   3.3140   39.889   2.2062 1.514256 3.981214 
1 1 1   10    2   87 o   44.072   1.7697   79.433   6.3446   64.418   11.886   85.416   7.5030   39.425   3.7433   45.681   2.0199 -6.256290 4.253520 
1 1 1   10    2   88 o   26.796   2.4708   29.622   5.3360   12.521   10.428   35.688   6.2107   17.885   6.0336   29.413   2.6177 -11.52802 6.576951 
1 1 1   10    2   89 o   49.573   1.8340  100.527   7.3984   83.637   12.179  110.404   9.3137   45.008   3.3436   51.914   2.2059 -6.906384 4.005759 
1 1 1   10    2   90 o   93.268   1.3913  355.054   10.578  350.461   15.436  359.120   14.524   92.587   2.0453   93.743   1.9007 -1.156403 2.792141 
1 1 1   10    2   91 o   15.239   4.8596   9.4754   6.8043   8.1284   8.5810   11.757   11.167   15.135   5.4486   17.707   6.2323 -2.571890 8.278183 
1 1 1   10    2   92 o   59.166   2.1469  143.449   10.337  142.234   12.384  146.242   18.771   58.843   2.5882   59.377   3.8999 -0.5339355 4.680620 
1 1 1   10    2   93 o   65.156   2.0307  173.893   10.772  186.203   13.135  148.597   18.829   67.360   2.3959   59.821   3.8822 7.538940 4.562015 
1 1 1   10    2   94 o   27.560   3.7705   31.983   8.2488   33.890   9.7588   27.213   15.437   28.234   4.3822   24.843   7.2045 3.391390 8.432584 
1 1 1   10    2   95 o   22.028   4.4438   20.923   7.7039   16.050   10.809   25.955   10.983   19.452   6.1153   24.320   5.6487 -4.868292 8.324920 
1 1 1   10    2   96 f   52.369   2.2306  112.694   9.5003  108.504   13.662  116.617   13.220   51.139   3.2948   53.085   3.0682 -1.945705 4.502141 
1 1 1   10    2   97 o   15.914   4.8929   10.716   6.9621   3.3142   9.2228   20.523   10.615   13.278   5.4107   21.559   5.8794 -8.281462 7.990186 
1 1 1   10    2   98 o   18.164   4.5135   14.397   6.6533   10.586   8.3557   21.000   10.998   16.129   5.4006   21.749   6.0058 -5.620029 8.076883 
1 1 1   10    2   99 o   98.077   1.5346  393.583   12.269  391.671   15.776  396.509   19.516   97.711   1.9806   98.148   2.4393 -0.4371796 3.142143 
1 1 1   10    2  100 o   53.668   1.9278  118.316   8.4200  109.081   10.752  132.959   13.539   51.369   2.5760   56.608   2.9442 -5.239059 3.912096 
1 1 1   10    2  101 o   54.220   1.9322  120.824   8.5262  113.937   10.923  131.562   13.640   52.485   2.5609   56.263   2.9848 -3.778553 3.932832 
1 1 1   10    2  102 o   63.838   1.7771  167.304   9.2384  155.972   11.881  184.635   14.692   61.462   2.3759   66.754   2.7057 -5.291752 3.600813 
1 1 1   10    2  103 o   63.288   1.7987  164.534   9.2701  185.730   12.270  136.344   14.150   67.100   2.2465   57.184   3.0466 9.915249 3.785281 
1 1 1   10    2  104 o   41.654   2.3130   71.807   7.8227   63.802   10.076   83.952   12.411   38.982   3.1991   44.655   3.4360 -5.672642 4.694780 
1 1 1   10    2  105 o   16.877   4.8027   12.606   6.9221   12.756   9.1047   12.400   10.656   17.188   5.6333   17.328   6.0888 -0.1393490 8.295023 
1 1 1   10    2  106 o   33.261   2.8083   46.298   7.5428   51.263   9.8667   39.318   11.701   34.756   3.5316   29.800   4.9932 4.956135 6.115936 
1 1 1   10    2  107 o   50.642   2.0674  105.899   8.5164  102.938   11.186  109.982   13.135   49.672   2.7737   51.172   3.1645 -1.500362 4.208012 
1 1 1   10    2  108 o   24.325   3.9887   25.775   7.6351   27.774   10.584   23.607   11.024   24.680   5.4107   22.545   5.9231 2.135433 8.022369 
1 1 1   10    2  109 o   26.058   3.9197   29.520   8.0682   20.589   11.125   39.431   11.719   20.983   6.1249   29.657   5.0269 -8.674303 7.923632 
1 1 1   10    2  110 o   7.9698   3.8312  -9.8809   7.2791 -20.5900   9.9149   2.6395   10.721   8.1956   4.0506   13.427   5.6807 -5.231874 6.976939 
1 1 1   10    2  111 o   31.122   3.0770   41.166   7.7040   31.658   9.9753   55.219   12.127   26.482   4.7976   35.457   4.2826 -8.974499 6.430998 
1 1 1   10    2  112 o   52.891   2.2348  116.429   9.6133  104.246   11.768  140.867   16.667   49.679   2.9188   57.276   3.5879 -7.596863 4.625201 
1 1 1   10    2  113 o   91.636   1.7868  346.851   13.347  335.718   16.280  369.675   23.310   89.827   2.2233   93.360   3.0672 -3.533058 3.788247 
1 1 1   10    2  114 o   48.472   2.4170   98.502   9.5201   97.961   11.611   99.613   16.629   47.993   2.9828   47.305   4.3614 0.6879539 5.283844 
1 1 1   10    2  115 o   25.257   4.0745   28.594   8.1033   26.379   10.180   32.425   13.387   23.457   5.4312   25.329   6.4635 -1.872494 8.442467 
1 1 1   10    2  116 o   27.587   4.2128   34.414   9.1735   25.096   10.559   63.109   18.528   22.558   5.7314   35.192   6.7036 -12.63328 8.819660 
1 1 1   10    2  117 o   9.1742   4.4077 -11.1869   9.6026  -9.7815   12.731 -13.0415   14.625   11.148   5.2763   11.533   5.5138 -0.3853054 7.631628 
1 1 1   10    2  118 o   50.117   2.9764  107.955   12.105   84.431   15.455  145.289   19.470   42.925   4.4829   56.703   4.2431 -13.77774 6.172498 
1 1 1   10    2  119 o   13.319   5.4856   5.4294   9.6080   20.882   13.821  -9.0230   13.366   19.730   6.9342   11.505   5.4338 8.225040 8.809608 
1 1 1   10    2  120 o   27.094   5.1526   35.459   10.964   21.853   17.225   44.727   14.216   19.844   7.6060   29.626   6.0903 -9.782757 9.743874 
1 1 1   10    2  121 f   16.073   5.7903   12.423   9.6932  -2.3055   13.678   27.282   13.739   12.790   5.8507   22.169   6.8832 -9.379404 9.033772 
1 1 1   10    2  122 o   13.583   5.7028   5.4804   10.672  -3.8869   13.650   20.213   17.118   12.427   5.7426   19.118   7.5109 -6.690619 9.454701 
1 1 1   10    2  123 o   19.748   6.5997   21.322   12.479   28.850   14.514  -0.0141   24.435   22.444   7.0904   16.054   7.5075 6.390192 10.32649 
1 1 1   10    2  124 o   23.982   6.3648   31.019   12.647   35.012   14.579   18.874   25.424   24.920   6.9276   18.963   8.3776 5.957235 10.87086 
1 1 1   10    2  125 o   19.144   6.1695   19.660   10.946   9.2821   14.414   33.794   16.823   15.543   6.5819   23.473   7.6551 -7.929502 10.09560 
1 1 1   10    2  126 o   16.916   6.3399   14.734   11.808   42.046   17.161  -9.8261   16.273   26.407   7.5774   12.323   5.8708 14.08331 9.585584 
1 1 1   10    2  127 f   11.278   5.2448  -4.6206   11.661 -11.6699   16.694   2.0963   16.296   12.182   5.8420   14.255   6.4685 -2.073310 8.716148 
1 1 1   10    2  128 o   18.190   6.0970   17.813   10.649   17.343   13.889   18.483   16.588   17.786   6.8267   18.151   7.3071 -0.3651905 9.999880 
1 1 1   10    2  129 o   12.680   5.4882   3.4105   10.431   9.0021   13.497  -4.8821   16.437   15.151   6.3902   13.058   6.1230 2.093354 8.850134 
1 1 1   10    3 -128 o   10.677   4.8409  -1.6716   9.1053  -0.1744   10.682  -5.6491   17.412   11.812   5.3098   13.250   6.2407 -1.437549 8.193933 
1 1 1   10    3 -127 o   25.900   5.1168   33.322   10.419   32.716   12.849   34.485   17.804   24.367   6.3910   23.074   7.8827 1.293034 10.14801 
1 1 1   10    3 -126 o   14.024   5.6518   8.0052   9.9353  -3.2207   12.225   29.841   17.050   11.779   5.4401   21.674   7.6941 -9.895394 9.423088 
1 1 1   10    3 -125 o   24.942   5.3340   31.316   10.516   31.907   13.024   30.208   17.826   24.006   6.4982   21.734   7.8494 2.272089 10.19019 
1 1 1   10    3 -124 o   15.685   5.8386   11.942   9.9806   19.838   12.283  -3.4059   17.124   18.967   6.5449   13.590   6.3319 5.377862 9.106460 
1 1 1   10    3 -123 f   13.783   5.6491   6.8885   10.125   6.3005   12.459   8.0323   17.376   14.262   6.0822   15.837   6.9639 -1.574574 9.246059 
1 1 1   10    3 -122 o   22.921   5.2951   26.223   9.6943   27.361   11.458   23.356   18.185   22.760   6.0663   19.865   7.7600 2.895386 9.849749 
1 1 1   10    3 -121 o   14.960   5.7494   9.9465   9.8604   15.316   10.792 -17.1960   24.264   17.311   6.1236   14.059   6.8161 3.251977 9.162812 
1 1 1   10    3 -120 o   13.435   5.5161   6.0119   9.6750   9.6762   10.596 -12.3686   23.731   15.030   5.9079   14.471   6.9464 0.5586014 9.118934 
1 1 1   10    3 -119 o   19.442   5.8051   19.365   9.9001   35.736   12.373  -9.7733   16.506   26.517   5.8784   12.622   5.9841 13.89528 8.388344 
1 1 1   10    3 -118 o   11.460   4.9986   1.0129   8.7926   9.4818   10.387 -20.3964   16.515   15.021   5.8657   11.305   5.5131 3.715760 8.049855 
1 1 1   10    3 -117 o   10.816   4.8284  -0.9954   8.6691   1.9324   10.193  -8.6502   16.482   12.431   5.4025   12.869   6.0644 -0.4372940 8.121859 
1 1 1   10    3 -116 o   32.288   3.6046   46.088   9.3256   38.707   11.156   63.211   16.991   28.605   4.9643   35.571   6.0781 -6.966024 7.847762 
1 1 1   10    3 -115 o   21.738   5.4993   23.194   9.7502   33.678   10.845 -21.0231   22.271   26.554   5.1963   13.498   6.5406 13.05674 8.353505 
1 1 1   10    3 -114 o   12.697   5.1808   4.5323   8.4694   0.2488   10.167   14.245   15.310   12.100   5.3235   17.905   7.0819 -5.804681 8.859618 
1 1 1   10    3 -113 o   39.955   3.3220   68.839   10.722   69.339   13.652   68.033   17.320   39.374   4.3245   37.722   5.8197 1.652050 7.250556 
1 1 1   10    3 -112 o   10.834   4.9183  -3.3761   9.4343   8.3065   12.214 -20.6568   14.855   15.557   6.2675   10.832   5.2704 4.725171 8.188911 
1 1 1   10    3 -111 o   23.159   5.2485   25.106   9.6784   24.137   12.687   26.456   14.969   22.065   6.5674   22.783   7.2011 -0.7176838 9.746140 
1 1 1   10    3 -110 f   29.681   4.2560   38.972   10.003   37.815   13.200   40.534   15.330   28.249   5.9220   28.752   6.6704 -0.5033913 8.919838 
1 1 1   10    3 -109 o   28.408   3.9527   35.240   8.9057   39.148   11.151   28.358   14.798   29.531   4.7969   23.923   7.0859 5.608021 8.556864 
1 1 1   10    3 -108 o   50.297   2.4881  105.427   10.169  116.108   12.782   87.005   16.786   52.532   2.9974   44.432   4.7062 8.099422 5.579663 
1 1 1   10    3 -107 o   20.049   5.7790   18.559   9.9605   15.997   13.724   21.412   14.479   19.178   6.8922   21.365   7.1083 -2.187630 9.901029 
1 1 1   10    3 -106 o   14.353   3.5325   9.0251   4.1046   17.985   11.582   7.7380   4.3896   19.842   6.3414   13.334   3.8342 6.508256 7.410468 
1 1 1   10    3 -105 o   25.905   2.3462   27.969   4.9008   14.969   10.564   31.534   5.5321   18.412   6.0698   27.480   2.4968 -9.068060 6.563283 
1 1 1   10    3 -104 o   40.735   1.7817   68.301   5.9020   62.773   10.869   70.613   7.0283   38.507   3.5010   41.344   2.0923 -2.836212 4.078590 
1 1 1   10    3 -103 f   40.029   1.9123   66.033   6.2217   73.284   10.973   62.597   7.5532   41.753   3.2496   38.848   2.3969 2.905010 4.037948 
1 1 1   10    3 -102 o   32.238   2.1845   43.016   5.7066   50.873   10.655   39.855   6.7577   34.553   3.8481   30.897   2.7106 3.655636 4.706892 
1 1 1   10    3 -101 o   37.825   1.9846   58.971   6.0979   69.089   11.219   54.730   7.2646   40.523   3.4287   36.324   2.4681 4.199081 4.224608 
1 1 1   10    3 -100 o   22.198   3.1130   20.852   5.4783   25.039   10.529   19.298   6.4150   23.616   5.5619   21.136   3.8657 2.479193 6.773344 
1 1 1   10    3  -99 o   61.180   1.7187  153.530   8.5627  135.017   17.766  159.131   9.7726   56.636   3.8716   62.236   1.9286 -5.600719 4.325385 
1 1 1   10    3  -98 o   49.271   1.7929   99.640   7.1890  102.445   13.511   98.532   8.4905   49.531   3.3665   48.925   2.1341 0.6060715 3.985913 
1 1 1   10    3  -97 o   22.705   3.1178   21.727   5.6182   9.0039   11.451   25.761   6.4475   16.404   6.2223   24.717   3.2811 -8.312336 7.034385 
1 1 1   10    3  -96 o   90.374   1.5820  334.160   11.654  332.175   16.426  336.171   16.538   89.932   2.2407   90.471   2.2426 -0.5387344 3.170129 
1 1 1   10    3  -95 o   15.024   4.7995   9.3567   6.6346   12.563   10.213   7.0163   8.7265   17.611   5.9711   14.551   5.4508 3.060230 8.084865 
1 1 1   10    3  -94 o   20.033   4.1927   17.319   6.6263   24.724   10.046   11.615   8.8161   23.762   5.3193   16.838   5.5446 6.923916 7.683588 
1 1 1   10    3  -93 o   22.172   4.1283   21.061   7.1869   24.292   10.242   17.927   10.087   23.557   5.4431   20.303   5.8041 3.253986 7.957090 
1 1 1   10    3  -92 f  120.113   1.5761  589.588   15.431  587.524   20.720  592.158   23.123  119.772   2.1223  120.175   2.3605 -0.4025040 3.174249 
1 1 1   10    3  -91 f   46.797   1.9527   89.744   7.4323   88.209   11.791   90.756   9.5740   46.192   3.1502   46.977   2.5093 -0.7848778 4.027421 
1 1 1   10    3  -90 o   37.036   2.3814   56.417   7.1512   63.772   12.933   53.178   8.5827   39.052   4.1249   35.861   2.9625 3.191021 5.078483 
1 1 1   10    3  -89 o   37.527   2.1664   57.807   6.5989   57.362   11.332   58.035   8.1171   37.111   3.7997   37.533   2.6706 -0.4219131 4.644325 
1 1 1   10    3  -88 o   80.338   1.4300  263.455   9.3646  264.001   15.280  263.127   11.851   80.285   2.3374   80.251   1.8116 0.3468323E-01 2.957233 
1 1 1   10    3  -87 o   84.724   1.4311  292.974   9.8837  280.308   15.966  300.842   12.585   82.737   2.3698   85.819   1.7990 -3.081825 2.975303 
1 1 1   10    3  -86 o   55.152   1.8067  124.363   8.1115  121.031   13.931  126.072   9.9772   54.231   3.1652   55.487   2.2103 -1.256603 3.860519 
1 1 1   10    3  -85 o   47.230   2.0582   91.314   7.9048   92.994   13.718   90.478   9.6720   47.459   3.5723   46.960   2.5361 0.4987869 4.380967 
1 1 1   10    3  -84 o   25.976   3.2547   28.082   6.7408   30.572   11.718   26.851   8.2408   26.689   5.5667   25.230   4.1513 1.459225 6.944181 
1 1 1   10    3  -83 o  141.273   1.3880  814.213   15.984  818.440   24.705  811.170   20.963  141.546   2.1412  140.960   1.8244 0.5864105 2.813003 
1 1 1   10    3  -82 o   48.573   1.9018   96.468   7.5157  100.593   12.459   94.109   9.4231   49.474   3.1051   47.927   2.4198 1.547176 3.936673 
1 1 1   10    3  -81 o  140.331   1.4430  803.350   16.507  777.050   24.171  826.336   22.597  137.940   2.1496  142.273   1.9484 -4.332443 2.901260 
1 1 1   10    3  -80 o   80.064   1.5315  261.513   9.9951  270.221   15.543  255.372   13.052   81.301   2.3477   79.065   2.0268 2.236214 3.101573 
1 1 1   10    3  -79 o   37.540   2.4209   57.801   7.3686   72.263   12.028   49.112   9.3229   41.858   3.5589   34.479   3.3597 7.379864 4.894193 
1 1 1   10    3  -78 o   39.538   2.3329   64.059   7.4852   63.527   12.102   64.389   9.5259   39.192   3.8372   39.574   2.9748 -0.3812294 4.855257 
1 1 1   10    3  -77 o   57.755   1.7905  136.229   8.4191  141.099   13.384  133.041   10.830   58.693   2.8056   57.033   2.3345 1.659988 3.649857 
1 1 1   10    3  -76 o   57.794   1.7970  136.409   8.4554  146.432   13.439  129.842   10.878   59.803   2.7643   56.342   2.3739 3.461456 3.643720 
1 1 1   10    3  -75 o  180.143   1.4746  1323.49   21.654  1301.52   32.486  1341.06   29.048  178.567   2.2318  181.289   1.9657 -2.722244 2.974033 
1 1 1   10    3  -74 o   58.870   1.9779  141.564   9.4781  144.664   15.340  139.649   12.054   59.409   3.1793   58.428   2.5370 0.9809036 4.067460 
1 1 1   10    3  -73 o   54.596   2.0544  121.796   9.1266  120.974   14.665  122.315   11.660   54.300   3.3293   54.669   2.6240 -0.3695221 4.239058 
1 1 1   10    3  -72 o  160.463   1.6137  1050.12   21.108  1065.30   32.461  1039.00   27.783  161.548   2.4651  159.571   2.1359 1.976059 3.261707 
1 1 1   10    3  -71 o  197.135   1.6155  1584.90   25.961  1565.14   36.697  1604.69   36.731  195.841   2.2987  198.302   2.2723 -2.461334 3.232266 
1 1 1   10    3  -70 o  137.914   1.4854  775.594   16.699  776.334   24.083  774.910   23.174  137.943   2.1418  137.822   2.0628 0.1215363 2.973621 
1 1 1   10    3  -69 f   74.639   1.9261  227.386   11.709  241.551   21.164  221.137   14.056   76.818   3.3882   73.580   2.3466 3.238510 4.121464 
1 1 1   10    3  -68 o  203.749   1.9473  1693.25   32.341  1621.12   55.882  1729.57   39.658  199.206   3.4414  205.887   2.3630 -6.681198 4.174524 
1 1 1   10    3  -67 f   73.847   2.2008  222.660   13.233  230.221   24.522  219.553   15.718   74.937   4.0291   73.301   2.6349 1.636467 4.814212 
1 1 1   10    3  -66 o  125.306   1.9266  640.390   19.678  714.465   35.632  607.883   23.605  132.267   3.3049  122.062   2.3724 10.20460 4.068180 
1 1 1   10    3  -65 o   76.740   1.9317  240.331   12.074  252.626   19.026  232.041   15.623   78.611   2.9745   75.367   2.5466 3.244072 3.915694 
1 1 1   10    3  -64 o   54.441   2.2546  121.112   9.9838  127.046   15.777  117.148   12.894   55.664   3.4946   53.490   2.9689 2.174160 4.585474 
1 1 1   10    3  -63 o   69.722   2.0520  198.436   11.650  198.583   16.723  198.296   16.239   69.690   2.9504   69.646   2.8665 0.4421997E-01 4.113595 
1 1 1   10    3  -62 o  132.622   1.8663  717.263   20.176  731.959   26.518  697.060   31.092  133.949   2.4287  130.689   2.9186 3.259338 3.796896 
1 1 1   10    3  -61 o   80.980   1.6369  267.387   10.805  255.685   14.974  280.102   15.608   79.138   2.3237   82.834   2.3139 -3.696190 3.279268 
1 1 1   10    3  -60 o  138.159   1.3887  778.197   15.639  751.892   19.603  824.261   25.941  135.792   1.7710  142.157   2.2386 -6.365112 2.854405 
1 1 1   10    3  -59 o  200.001   1.6601  1630.95   27.065  1601.62   35.387  1672.28   42.009  198.165   2.1907  202.465   2.5454 -4.299530 3.358329 
1 1 1   10    3  -58 f  126.926   1.4371  656.803   14.869  641.850   19.389  678.151   23.168  125.460   1.8959  128.947   2.2041 -3.487587 2.907338 
1 1 1   10    3  -57 o  118.192   1.5970  569.554   15.387  550.211   22.164  587.549   21.377  116.145   2.3410  120.026   2.1849 -3.881989 3.202252 
1 1 1   10    3  -56 o   45.367   1.8829   84.070   6.9481   86.193   8.9066   80.769   11.105   45.907   2.3883   44.381   3.0890 1.526104 3.904600 
1 1 1   10    3  -55 o  237.450   1.8288  2298.99   35.398  2312.11   42.325  2268.46   64.567  238.105   2.1807  235.747   3.3599 2.357819 4.005530 
1 1 1   10    3  -54 f  275.965   2.0178  3105.53   45.391  3068.07   53.559  3201.03   85.516  274.266   2.3957  280.000   3.7467 -5.733185 4.447164 
1 1 1   10    3  -53 o  109.285   1.5119  486.912   13.469  502.798   16.787  458.205   22.566  111.046   1.8545  105.985   2.6120 5.060699 3.203385 
1 1 1   10    3  -52 o  173.140   1.5629  1222.16   22.058  1248.18   26.635  1165.36   39.356  174.963   1.8676  169.011   2.8567 5.951630 3.412980 
1 1 1   10    3  -51 o  337.544   2.3475  4646.69   64.591  4663.71   86.117  4624.79   97.660  338.078   3.1249  336.608   3.5592 1.470337 4.736345 
1 1 1   10    3  -50 o   67.274   1.4926  184.503   8.1850  170.193   12.880  194.197   10.601   64.552   2.4522   68.987   1.8869 -4.435547 3.094136 
1 1 1   10    3  -49 o   54.550   1.7500  121.446   7.7714  120.880   12.196  121.833   10.084   54.367   2.7610   54.611   2.2702 -0.2444878 3.574436 
1 1 1   10    3  -48 o  407.192   2.3957  6761.94   79.517  6816.79  107.767  6696.40  117.812  408.737   3.2345  405.062   3.5681 3.674438 4.815898 
1 1 1   10    3  -47 o  198.387   1.4540  1604.46   23.513  1658.40   32.590  1545.90   33.957  201.675   1.9824  194.708   2.1395 6.966690 2.916745 
1 1 1   10    3  -46 o  300.173   1.8794  3673.71   45.986  3660.95   61.940  3689.39   68.643  299.608   2.5362  300.748   2.8000 -1.140411 3.777847 
1 1 1   10    3  -45 o  158.678   1.3370  1026.39   17.294  1002.57   23.361  1055.28   25.722  156.814   1.8276  160.879   1.9614 -4.065140 2.680919 
1 1 1   10    3  -44 o  470.183   2.8764  9017.28  110.245  9043.84  156.717  8991.25  155.116  470.690   4.0845  469.324   4.0546 1.365112 5.755278 
1 1 1   10    3  -43 o  184.703   1.4887  1390.72   22.414  1426.49   32.660  1358.87   30.817  187.043   2.1421  182.559   2.0709 4.484589 2.979447 
1 1 1   10    3  -42 o  104.607   1.5433  446.085   13.160  462.924   20.604  434.483   17.102  106.549   2.3723  103.230   2.0324 3.318428 3.123902 
1 1 1   10    3  -41 o  249.555   1.8724  2539.00   38.089  2586.27   51.634  2482.57   56.414  251.839   2.5152  246.723   2.8050 5.115738 3.767586 
1 1 1   10    3  -40 o   52.550   1.7469  112.703   7.4726  114.656   10.801  110.910   10.349   52.967   2.5089   52.096   2.4437 0.8704910 3.502342 
1 1 1   10    3  -39 o  147.551   1.4656  887.474   17.628  876.987   23.864  900.068   26.151  146.666   1.9961  148.580   2.1592 -1.913757 2.940483 
1 1 1   10    3  -38 o  324.843   2.2560  4302.34   59.739  4282.99   79.301  4327.74   90.837  324.068   3.0020  325.726   3.4212 -1.658295 4.551500 
1 1 1   10    3  -37 o  321.571   2.2390  4216.00   58.690  4193.99   77.903  4244.88   89.251  320.690   2.9801  322.602   3.3940 -1.912140 4.516658 
1 1 1   10    3  -36 o  301.862   2.3026  3715.05   56.658  3684.70   80.379  3745.03   79.876  300.576   3.2806  303.030   3.2337 -2.453278 4.606396 
1 1 1   10    3  -35 o  137.776   1.5498  773.774   17.406  743.904   30.262  788.541   21.278  135.070   2.7485  139.080   1.8768 -4.009598 3.328180 
1 1 1   10    3  -34 o  257.595   2.2655  2705.23   47.571  2641.33   74.130  2749.96   62.027  254.481   3.5736  259.691   2.9301 -5.210114 4.621278 
1 1 1   10    3  -33 o  268.116   2.3266  2930.72   50.848  2976.03   81.405  2901.73   65.112  270.122   3.6971  266.762   2.9943 3.360352 4.757557 
1 1 1   10    3  -32 o  113.654   1.7039  526.544   15.786  541.622   25.322  516.959   20.189  115.257   2.6952  112.609   2.1994 2.647957 3.478711 
1 1 1   10    3  -31 o  359.110   2.6505  5257.81   77.588  5057.94  106.920  5480.14  112.766  352.161   3.7246  366.561   3.7739 -14.39996 5.302386 
1 1 1   10    3  -30 f  316.930   2.2146  4094.76   57.214  4285.48   91.081  3970.45   73.532  324.176   3.4468  312.057   2.8907 12.11816 4.498493 
1 1 1   10    3  -29 o   12.731   4.7333   5.0169   6.5559   0.2474   11.591   7.2606   7.9498   13.928   5.9002   14.593   5.2455 -0.6649475 7.894791 
1 1 1   10    3  -28 o  283.356   2.0412  3272.99   47.148  3290.10   72.969  3260.72   61.774  284.062   3.1513  282.807   2.6797 1.255066 4.136579 
1 1 1   10    3  -27 o  251.940   1.8899  2587.39   38.812  2557.28   59.565  2609.60   51.165  250.446   2.9177  253.006   2.4809 -2.560516 3.829858 
1 1 1   10    3  -26 o  335.417   2.3156  4586.30   63.311  4578.55   97.261  4592.01   83.400  335.087   3.5608  335.600   3.0486 -0.5135498 4.687585 
1 1 1   10    3  -25 o  405.311   2.7033  6697.28   89.313  6719.17  137.450  6681.28  117.499  405.901   4.1542  404.788   3.5610 1.112854 5.471592 
1 1 1   10    3  -24 o  371.252   2.5130  5618.75   76.050  5617.29  100.741  5620.67  115.960  371.173   3.3296  371.262   3.8317 -0.8862305E-01 5.076229 
1 1 1   10    3  -23 o  257.400   1.9167  2700.69   40.217  2692.07   53.310  2712.08   61.266  256.976   2.5450  257.921   2.9141 -0.9443970 3.868923 
1 1 1   10    3  -22 o  382.232   2.5735  5955.98   80.183  5927.77  105.853  5993.96  122.821  381.295   3.4057  383.395   3.9300 -2.099152 5.200334 
1 1 1   10    3  -21 o  275.124   2.0069  3085.43   45.008  3020.99   58.863  3176.14   69.837  272.223   2.6526  279.115   3.0695 -6.892456 4.056898 
1 1 1   10    3  -20 o  420.664   2.7909  7214.01   95.699  7165.09  126.069  7280.55  147.011  419.199   3.6894  422.534   4.2683 -3.335022 5.641768 
1 1 1   10    3  -19 o  469.769   3.0716  8996.90  117.622  8966.15  155.320  9038.23  180.103  468.918   4.0634  470.762   4.6934 -1.843658 6.207992 
1 1 1   10    3  -18 o  460.879   2.8239  8659.16  106.090  8686.74  150.694  8632.06  149.382  461.560   4.0053  460.107   3.9829 1.453796 5.648540 
1 1 1   10    3  -17 o  525.599   3.1747 11262.43  136.017 11190.89  191.646 11335.05  193.076  523.856   4.4880  527.219   4.4926 -3.362915 6.350256 
1 1 1   10    3  -16 o  576.118   3.4520 13532.08  162.114 13500.81  229.109 13563.44  229.420  575.362   4.8850  576.696   4.8803 -1.333374 6.905124 
1 1 1   10    3  -15 o  192.112   1.5310  1504.32   23.976  1489.21   34.157  1519.00   33.663  191.139   2.1923  193.042   2.1393 -1.902603 3.063077 
1 1 1   10    3  -14 o  495.060   3.0079  9991.22  121.385  9888.76  170.495 10096.54  172.857  492.460   4.2472  497.606   4.2615 -5.146088 6.016597 
1 1 1   10    3  -13 o  372.855   2.3589  5666.89   71.694  5525.19   99.701  5818.61  103.169  368.140   3.3224  377.788   3.3501 -9.647919 4.718235 
1 1 1   10    3  -12 o  363.588   2.4711  5388.75   73.237  5395.60  112.577  5383.71   96.433  363.783   3.7964  363.399   3.2554 0.3845215 5.001018 
1 1 1   10    3  -11 o  254.628   2.0571  2642.79   42.696  2569.35   60.027  2717.99   60.743  251.053   2.9332  258.213   2.8859 -7.160568 4.114869 
1 1 1   10    3  -10 o   69.492   1.8198  196.973   10.300  194.441   15.766  198.859   13.604   69.007   2.8086   69.805   2.3943 -0.7978439 3.690665 
1 1 1   10    3   -9 o   17.531   5.1161   12.755   7.7628   11.697   12.597   13.402   9.8568   18.448   6.6064   18.339   5.8491 0.1091042 8.823614 
1 1 1   10    3   -8 o  290.293   2.0834  3434.97   49.299  3430.24   65.653  3441.08   74.650  290.083   2.7765  290.534   3.1521 -0.4508667 4.200538 
1 1 1   10    3   -7 o  471.835   3.0830  9075.63  118.575  9056.40  156.972  9101.19  180.955  471.297   4.0859  472.433   4.6989 -1.135956 6.226908 
1 1 1   10    3   -6 o  132.677   1.5118  717.495   16.351  724.768   26.412  712.976   20.819  133.342   2.4300  132.256   1.9312 1.086029 3.103873 
1 1 1   10    3   -5 o  325.607   2.2775  4321.58   60.449  4366.77   94.141  4289.89   78.852  327.279   3.5288  324.398   2.9819 2.881226 4.619973 
1 1 1   10    3   -4 o  462.968   3.2700  8737.92  123.405  8635.62  211.641  8790.61  151.899  460.145   5.6425  464.335   4.0132 -4.189728 6.924088 
1 1 1   10    3   -3 o  277.375   2.1682  3136.06   49.024  3199.07   86.217  3105.95   59.596  280.119   3.7758  276.034   2.6486 4.085602 4.612167 
1 1 1   10    3   -2 o  459.565   3.0107  8609.61  112.785  8680.85  173.663  8557.65  148.322  461.402   4.6174  458.143   3.9716 3.258789 6.090475 
1 1 1   10    3   -1 o  141.885   1.5053  820.538   17.410  803.124   26.845  833.180   22.873  140.366   2.3462  142.971   1.9626 -2.604950 3.058847 
1 1 1   10    3    0 o  616.064   4.6562 15476.00  233.826 16080.35  311.656 14697.70  353.675  627.875   6.0893  600.178   7.2292 27.69708 9.451993 
1 1 1   10    3    1 o   23.117   5.2346   22.665   9.6338   16.760   12.950   29.982   14.416   20.653   6.7151   26.592   6.6646 -5.939148 9.460919 
1 1 1   10    3    2 o  481.093   3.3953  9435.64  133.150  9904.88  195.809  9032.04  181.598  492.846   4.8740  470.637   4.7336 22.20923 6.794313 
1 1 1   10    3    3 o  369.562   2.9635  5567.54   89.273  5547.73  115.221  5597.30  141.209  368.881   3.8319  370.497   4.6756 -1.615723 6.045240 
1 1 1   10    3    4 o   75.911   1.7930  234.882   11.095  241.836   16.417  229.036   15.052   76.979   2.6201   74.918   2.4682 2.061478 3.599580 
1 1 1   10    3    5 o  271.444   2.3547  3003.45   52.103  3046.01   83.875  2976.70   66.487  273.335   3.7644  270.223   3.0184 3.112854 4.825113 
1 1 1   10    3    6 o  613.211   5.1736 15334.86  258.604 15140.72  512.438 15401.20  299.545  608.787   10.326  614.476   5.9803 -5.688965 11.93290 
1 1 1   10    3    7 o  464.318   4.6359  8791.08  175.464   0.0000   0.0000  8791.08  175.464  ?   ?   464.318   4.6359 0.000000 4.635936 
1 1 1   10    3    8 o  672.520   5.0475 18444.33  276.707 18519.45  439.263 18394.91  356.284  673.600   7.9999  671.492   6.5091 2.107239 10.31344 
1 1 1   10    3    9 o  149.500   1.7927  911.003   21.847  978.346   36.842  874.482   27.131  154.918   2.9175  146.469   2.2724 8.448456 3.698039 
1 1 1   10    3   10 o  334.783   2.7382  4568.86   74.725  4616.62   97.510  4500.89  116.313  336.509   3.5548  332.242   4.2948 4.266724 5.575076 
1 1 1   10    3   11 o   57.475   2.2913  134.868   10.714  129.812   14.546  140.863   15.839   56.339   3.1802   58.687   3.3246 -2.347851 4.600712 
1 1 1   10    3   12 o  322.606   2.6596  4242.53   69.940  4208.43   90.002  4294.51  111.127  321.289   3.4365  324.536   4.2007 -3.246796 5.427285 
1 1 1   10    3   13 o  451.349   3.9155  8305.99  144.056  8297.72  203.656  8314.27  203.794  451.040   5.5392  451.490   5.5374 -0.4495239 7.832358 
1 1 1   10    3   14 o  181.214   1.8736  1338.52   27.675  1342.96   44.027  1335.62   35.584  181.502   2.9758  181.012   2.4117 0.4905243 3.830350 
1 1 1   10    3   15 o  415.162   3.2593  7026.81  110.301  6852.55  170.991  7151.00  144.350  409.901   5.1175  418.776   4.2286 -8.875244 6.638533 
1 1 1   10    3   16 o  178.057   1.8640  1292.30   27.054  1292.72   43.003  1292.02   34.806  178.074   2.9626  178.033   2.3984 0.4104614E-01 3.811671 
1 1 1   10    3   17 o  146.508   1.7544  874.912   20.952  847.048   32.980  893.769   27.131  144.147   2.8068  148.074   2.2478 -3.927673 3.595892 
1 1 1   10    3   18 o  221.316   2.0623  1996.56   37.205  1965.38   58.531  2017.71   48.195  219.561   3.2704  222.476   2.6575 -2.915207 4.213994 
1 1 1   10    3   19 o  172.031   1.8401  1206.31   25.803  1218.71   41.509  1198.50   32.942  172.899   2.9452  171.468   2.3568 1.431747 3.772113 
1 1 1   10    3   20 o  305.746   2.5517  3810.75   63.597  3826.95  101.197  3800.18   81.759  306.350   4.0524  305.302   3.2853 1.048157 5.216812 
1 1 1   10    3   21 o   56.250   2.2113  129.178   10.120  119.340   16.301  135.346   12.908   53.971   3.7282   57.553   2.7594 -3.581944 4.638322 
1 1 1   10    3   22 o   81.816   1.8560  272.853   12.378  269.204   19.990  275.123   15.764   81.203   3.0253   82.119   2.3574 -0.9156265 3.835286 
1 1 1   10    3   23 o  165.983   2.3436  1123.08   31.708   0.0000   0.0000  1123.08   31.708  ?   ?   165.983   2.3436 0.000000 2.343557 
1 1 1   10    3   24 o  301.403   2.5303  3703.38   62.167  3696.47   98.421  3707.96   80.189  301.071   4.0103  301.567   3.2621 -0.4960022 5.169531 
1 1 1   10    3   25 o  279.873   2.3993  3193.14   54.737  3141.11   85.788  3228.86   71.088  277.540   3.7920  281.415   3.0989 -3.874298 4.897187 
1 1 1   10    3   26 o  239.207   2.1660  2332.55   42.235  2339.27   67.172  2328.16   54.315  239.519   3.4404  238.968   2.7883 0.5509033 4.428476 
1 1 1   10    3   27 o  271.947   2.3537  3014.87   52.176  3072.14   83.968  2978.85   66.592  274.472   3.7530  270.299   3.0223 4.173004 4.818686 
1 1 1   10    3   28 o  319.888   2.6449  4171.84   68.967  4052.14  106.935  4257.10   90.245  315.199   4.1620  323.109   3.4264 -7.910126 5.390922 
1 1 1   10    3   29 o  286.590   2.4383  3348.41   56.961  3332.08   90.053  3359.30   73.542  285.835   3.8650  287.031   3.1432 -1.196564 4.981732 
1 1 1   10    3   30 f  210.441   2.0160  1805.28   34.583  1818.28   55.307  1796.94   44.315  211.167   3.2130  209.941   2.5895 1.225693 4.126633 
1 1 1   10    3   31 o  232.584   2.3800  2205.37   45.123  2171.06   63.743  2239.83   63.885  230.736   3.3891  234.363   3.3441 -3.627350 4.761166 
1 1 1   10    3   32 o  351.375   3.6612  5035.45  104.864  5059.04  182.754  5023.87  128.040  351.959   6.3700  350.913   4.4762 1.046326 7.785450 
1 1 1   10    3   33 o  251.217   2.8579  2573.30   58.524  2577.15  101.790  2571.40   71.528  251.296   4.9692  251.098   3.4946 0.1986084 6.074943 
1 1 1   10    3   34 o  220.358   2.6384  1979.84   47.392  1963.69   82.164  1987.89   58.016  219.372   4.5948  220.785   3.2236 -1.413101 5.612815 
1 1 1   10    3   35 o   97.772   2.1518  389.718   17.150  395.035   30.465  387.251   20.749   98.335   3.8079   97.421   2.6153 0.9142151 4.619493 
1 1 1   10    3   36 o  222.825   2.0825  2024.18   37.826  1993.57   59.853  2044.54   48.808  221.089   3.3211  223.923   2.6740 -2.834732 4.263819 
1 1 1   10    3   37 o  282.147   2.4153  3245.79   55.549  3176.19   87.074  3293.55   72.134  279.025   3.8283  284.179   3.1139 -5.153961 4.934843 
1 1 1   10    3   38 o   51.693   2.2633  109.158   9.5140  124.795   16.279  101.046   11.725   55.190   3.6389   49.692   2.9073 5.497211 4.657618 
1 1 1   10    3   39 o  202.239   1.9793  1667.48   32.630  1654.88   52.027  1675.66   41.894  201.428   3.1686  202.716   2.5353 -1.287308 4.058084 
1 1 1   10    3   40 o  119.544   1.7128  582.590   16.691  584.651   27.237  581.350   21.121  119.733   2.7906  119.409   2.1699 0.3243332 3.534984 
1 1 1   10    3   41 o  208.913   2.2738  1779.59   38.721  1814.50   55.413  1746.28   54.130  210.907   3.2232  206.906   3.2095 4.001755 4.548563 
1 1 1   10    3   42 o  150.052   2.0186  917.996   24.690  947.126   35.439  890.520   34.419  152.388   2.8529  147.764   2.8575 4.624115 4.037895 
1 1 1   10    3   43 o  180.482   2.1385  1328.17   31.461  1354.06   44.807  1302.98   44.185  182.196   3.0170  178.726   3.0328 3.470245 4.277866 
1 1 1   10    3   44 o  188.226   2.1781  1444.63   33.419  1482.23   47.867  1408.87   46.680  190.617   3.0806  185.840   3.0814 4.777557 4.357204 
1 1 1   10    3   45 o  398.987   3.5539  6496.16  115.585  6594.78  165.193  6401.56  161.783  401.754   5.0442  395.831   5.0140 5.923370 7.112296 
1 1 1   10    3   46 o   71.121   1.9075  206.382   11.048  214.332   18.254  201.785   13.880   72.416   3.0994   70.300   2.4257 2.116013 3.935809 
1 1 1   10    3   47 o  131.963   1.7346  709.985   18.660  709.593   30.151  710.228   23.755  131.894   2.8044  131.973   2.2082 -0.7951355E-01 3.569430 
1 1 1   10    3   48 o  192.693   1.9421  1513.95   30.505  1482.04   48.271  1535.17   39.361  190.591   3.1070  194.013   2.4889 -3.422302 3.980974 
1 1 1   10    3   49 o  165.996   1.8321  1123.47   24.790  1132.92   39.900  1117.53   31.638  166.644   2.9373  165.538   2.3446 1.106812 3.758325 
1 1 1   10    3   50 o  174.921   1.8673  1247.56   26.625  1255.17   42.876  1242.79   33.967  175.399   2.9988  174.565   2.3871 0.8346710 3.832895 
1 1 1   10    3   51 o   86.002   1.7699  301.562   12.408  310.984   20.452  296.074   15.608   87.261   2.8793   85.176   2.2499 2.085022 3.654065 
1 1 1   10    3   52 o  227.581   2.3558  2112.34   43.704  2129.85   62.852  2095.96   60.811  228.442   3.3753  226.625   3.2918 1.816925 4.714725 
1 1 1   10    3   53 o  146.706   2.0259  877.648   24.227  865.127   36.259  887.747   32.564  145.609   3.0549  147.518   2.7080 -1.909439 4.082343 
1 1 1   10    3   54 f   96.572   2.0217  380.302   15.915  418.719   25.899  356.994   20.173  101.246   3.1419   93.511   2.6492 7.735733 4.109678 
1 1 1   10    3   55 o   75.676   1.9385  233.675   11.948  235.071   22.197  233.106   14.177   75.796   3.6029   75.566   2.3043 0.2304535 4.276740 
1 1 1   10    3   56 o  213.661   2.0733  1861.67   36.109  1905.83   60.036  1836.64   45.198  216.076   3.4085  212.184   2.6132 3.891754 4.294991 
1 1 1   10    3   57 o  208.717   1.8686  1776.36   31.791  1760.27   45.787  1791.34   44.175  207.716   2.7042  209.550   2.5862 -1.834213 3.741796 
1 1 1   10    3   58 f  153.155   1.6738  956.393   20.896  990.934   31.213  928.339   28.130  155.860   2.4567  150.866   2.2874 4.994492 3.356736 
1 1 1   10    3   59 o   50.344   2.1341  103.555   8.7380  110.963   14.232   99.072   11.070   52.026   3.3740   49.198   2.7716 2.828472 4.366439 
1 1 1   10    3   60 o  104.991   1.8045  449.487   15.443  455.376   27.615  446.807   18.628  105.572   3.2127  104.665   2.1834 0.9068451 3.884408 
1 1 1   10    3   61 o   76.567   1.7899  239.056   11.171  201.776   17.012  267.315   14.812   70.251   2.9776   80.923   2.2476 -10.67286 3.730649 
1 1 1   10    3   62 o  178.566   1.6183  1300.12   23.556  1280.42   31.403  1325.47   35.619  177.179   2.1743  180.252   2.4242 -3.073013 3.256441 
1 1 1   10    3   63 o   38.606   2.4689   61.055   7.7287   59.687   11.547   62.164   10.402   38.038   3.7737   38.879   3.3139 -0.8405380 5.022240 
1 1 1   10    3   64 o   98.604   1.8013  396.492   14.478  388.651   17.598  412.914   25.469   97.610   2.2118  100.521   3.1120 -2.911385 3.817904 
1 1 1   10    3   65 o  176.559   1.6635  1271.16   23.941  1271.31   32.188  1270.97   35.817  176.533   2.2368  176.491   2.4896 0.4225159E-01 3.346851 
1 1 1   10    3   66 o  196.006   1.8264  1566.79   29.180  1561.59   37.523  1574.73   46.416  195.641   2.3529  196.410   2.8991 -0.7691803 3.733763 
1 1 1   10    3   67 f  156.087   1.6250  993.461   20.676  979.900   28.106  1009.46   30.525  154.985   2.2247  157.295   2.3807 -2.309753 3.258361 
1 1 1   10    3   68 o  106.953   1.5818  466.447   13.790  468.502   19.348  464.325   19.660  107.163   2.2149  106.682   2.2607 0.4809265 3.164957 
1 1 1   10    3   69 f   70.690   1.7276  203.793   9.9549  182.622   14.106  224.799   14.051   66.841   2.5939   74.189   2.3263 -7.347382 3.484237 
1 1 1   10    3   70 o  127.871   1.5164  666.760   15.806  662.155   21.720  671.944   23.046  127.399   2.0915  128.331   2.2030 -0.9314804 3.037744 
1 1 1   10    3   71 o  121.148   1.4319  598.475   14.140  625.253   23.585  583.448   17.668  123.779   2.3375  119.600   1.8122 4.178894 2.957722 
1 1 1   10    3   72 o   28.389   2.5843   33.174   5.9149   16.787   11.969   38.469   6.8038   20.347   6.4402   30.569   2.7601 -10.22228 7.006770 
1 1 1   10    3   73 o  107.115   1.7504  468.013   15.284  490.251   26.859  457.363   18.587  109.502   3.0119  105.867   2.1538 3.634903 3.702742 
1 1 1   10    3   74 o   26.923   2.5822   29.868   5.5976   28.936   10.875   30.204   6.5290   26.080   5.2962   27.022   3.0154 -0.9414806 6.094491 
1 1 1   10    3   75 o   89.115   1.5632  323.906   11.355  299.609   15.737  350.298   16.401   85.644   2.2561   92.643   2.1719 -6.998833 3.131630 
1 1 1   10    3   76 o   56.732   1.5437  131.374   7.1321  132.680   12.510  130.744   8.6811   56.926   2.7037   56.575   1.8850 0.3509521 3.295992 
1 1 1   10    3   77 o  105.623   1.3030  454.960   11.218  484.475   18.558  437.964   14.083  108.946   2.0897  103.612   1.6674 5.333618 2.673428 
1 1 1   10    3   78 o   88.733   1.3416  321.109   9.7040  311.602   15.845  326.815   12.276   87.331   2.2275   89.501   1.6826 -2.169579 2.791619 
1 1 1   10    3   79 o  141.727   1.3240  819.216   15.296  803.104   23.985  830.260   19.857  140.257   2.0979  142.648   1.7077 -2.391464 2.705089 
1 1 1   10    3   80 o  214.212   1.8812  1872.89   32.848  1822.76   46.307  1923.66   46.603  211.169   2.6901  216.948   2.6352 -5.778900 3.765810 
1 1 1   10    3   81 o  188.170   1.6642  1444.85   25.526  1479.78   39.586  1419.99   33.397  190.278   2.5522  186.462   2.1972 3.816467 3.367745 
1 1 1   10    3   82 o  104.483   1.7459  445.557   14.870  413.433   19.871  486.437   22.416  100.580   2.4237  109.088   2.5209 -8.507423 3.497036 
1 1 1   10    3   83 o   62.059   2.1535  157.518   10.878  158.255   14.754  156.640   16.100   62.114   2.9222   61.755   3.2094 0.3589020 4.340415 
1 1 1   10    3   84 o   87.262   1.8522  310.921   13.175  294.288   17.849  330.835   19.529   84.783   2.5856   89.885   2.6684 -5.102280 3.715615 
1 1 1   10    3   85 o   45.026   2.6154   83.235   9.5578   96.279   12.598   65.544   14.671   48.353   3.2145   39.595   4.6331 8.757416 5.639005 
1 1 1   10    3   86 o   43.405   2.6279   77.402   9.2545   74.472   12.123   81.496   14.328   42.434   3.5368   44.315   4.0097 -1.881294 5.346664 
1 1 1   10    3   87 o   49.742   2.4986  101.533   10.099   99.319   11.828  107.488   19.401   49.127   2.9673   50.751   4.7446 -1.623482 5.596119 
1 1 1   10    3   88 o   84.047   1.8336  288.628   12.562  279.257   14.832  312.408   23.627   82.596   2.2049   87.129   3.3328 -4.532310 3.996135 
1 1 1   10    3   89 o   14.064   5.2536   6.3325   8.0950   2.5470   9.3337   17.824   16.262   13.174   5.4144   21.467   7.5234 -8.293335 9.269143 
1 1 1   10    3   90 o  112.783   1.5594  519.565   14.337  529.630   18.665  505.085   22.389  113.788   2.0123  111.017   2.4740 2.770798 3.189110 
1 1 1   10    3   91 f   41.371   2.8292   70.626   9.4836   42.769   13.507   97.714   13.319   31.524   5.4536   48.577   3.3847 -17.05350 6.418572 
1 1 1   10    3   92 f   13.987   5.0886   6.8312   7.5099   7.7295   10.129   5.7343   11.192   15.538   5.8614   15.246   6.0472 0.2922869 8.421628 
1 1 1   10    3   93 o   35.092   2.9011   51.025   8.2247   45.303   11.227   57.653   12.083   32.719   4.3146   37.040   4.0687 -4.321724 5.930475 
1 1 1   10    3   94 o   36.022   2.5992   53.614   7.5809   43.110   9.6468   70.578   12.259   32.024   3.7675   41.096   3.6989 -9.072441 5.279721 
1 1 1   10    3   95 o   27.663   3.2369   32.057   7.1610   36.137   9.2835   26.064   11.252   29.196   4.0063   24.267   5.7728 4.929155 7.026836 
1 1 1   10    3   96 o   54.334   1.9402  121.168   8.5793  126.242   11.112  113.678   13.500   55.343   2.4693   52.316   3.1807 3.026669 4.026729 
1 1 1   10    3   97 o   38.124   2.4518   60.069   7.5790   55.342   9.6949   67.498   12.154   36.379   3.3054   40.062   3.7659 -3.683605 5.010737 
1 1 1   10    3   98 o   45.105   2.1792   83.809   7.9887   80.087   10.334   89.337   12.594   43.908   2.9035   46.240   3.3642 -2.331841 4.443886 
1 1 1   10    3   99 o   34.768   2.6639   50.212   7.4923   46.089   9.6829   56.362   11.827   33.025   3.6581   36.421   4.0523 -3.396126 5.459229 
1 1 1   10    3  100 o   77.737   1.6619  247.691   10.531  235.777   13.613  265.449   16.620   75.651   2.2099   80.134   2.5475 -4.483612 3.372499 
1 1 1   10    3  101 o   35.204   2.6459   51.557   7.5374   48.752   9.7261   55.774   11.926   33.947   3.5680   36.122   4.1241 -2.174927 5.453378 
1 1 1   10    3  102 o   45.839   2.1802   86.771   8.1231   76.556   10.567  101.528   12.701   42.781   3.0502   49.242   3.1812 -6.461487 4.407232 
1 1 1   10    3  103 f   60.495   1.8676  150.567   9.1986  158.075   12.051  140.085   14.239   61.801   2.3967   57.910   3.0268 3.891987 3.860800 
1 1 1   10    3  104 o   68.522   1.8886  193.240   10.539  188.050   14.511  199.032   15.331   67.279   2.6512   69.183   2.7239 -1.903267 3.801058 
1 1 1   10    3  105 o   60.360   2.0067  150.249   9.8595  157.821   13.775  142.296   14.118   61.550   2.7525   58.330   2.9791 3.220158 4.056062 
1 1 1   10    3  106 o   28.909   3.2349   35.464   7.4924   31.852   9.9434   40.208   11.396   26.795   4.7250   30.142   4.7991 -3.346401 6.734755 
1 1 1   10    3  107 o   57.492   1.9600  136.426   9.1720  130.461   11.932  145.041   14.340   55.942   2.6239   58.791   3.0023 -2.849281 3.987287 
1 1 1   10    3  108 o   29.605   3.4215   37.513   8.1050   38.090   10.140   36.490   13.488   29.415   4.3608   27.848   6.1099 1.567122 7.506513 
1 1 1   10    3  109 o   32.445   3.1542   44.775   8.2368   46.506   10.224   41.575   13.904   32.716   3.9112   29.765   5.9388 2.950861 7.111035 
1 1 1   10    3  110 f   22.984   4.3800   23.709   7.9065   21.516   9.8050   27.785   13.369   21.357   5.5738   23.747   6.6459 -2.390350 8.673850 
1 1 1   10    3  111 o   30.258   3.2615   39.336   7.9175   37.107   10.269   42.602   12.433   28.718   4.5372   30.384   5.2071 -1.665182 6.906510 
1 1 1   10    3  112 o   27.463   3.6583   33.014   7.9863   30.231   10.420   36.977   12.434   25.411   5.2056   27.857   5.6686 -2.446280 7.696198 
1 1 1   10    3  113 o   17.769   5.1511   14.921   7.8928   11.023   10.341   20.361   12.217   16.004   5.9457   20.172   6.5193 -4.167999 8.823426 
1 1 1   10    3  114 o   16.669   5.2556   13.126   7.9779   3.9060   10.308   26.896   12.598   13.266   5.5891   22.913   6.4652 -9.647693 8.546139 
1 1 1   10    3  115 o   25.945   4.0763   30.430   8.3370   30.015   10.904   31.013   12.936   24.785   5.5368   24.521   6.4033 0.2643452 8.465137 
1 1 1   10    3  116 o   23.950   4.3277   26.439   8.1381   26.042   10.579   27.014   12.738   22.836   5.7010   22.626   6.5392 0.2094917 8.675363 
1 1 1   10    3  117 o   40.095   3.9095   71.974   12.615   82.765   14.856   44.067   23.890   42.585   4.3401   25.701   9.1091 16.88417 10.09026 
1 1 1   10    3  118 o   14.029   5.7689   6.5824   10.604   6.5337   13.572   6.6587   16.990   14.899   6.3507   15.813   6.9217 -0.9143457 9.393665 
1 1 1   10    3  119 o   10.558   4.9367  -6.2666   10.557  -7.0763   13.299  -4.8864   17.362   11.744   5.5070   13.672   6.3720 -1.928082 8.421971 
1 1 1   10    3  120 o   9.5231   4.5218  -8.3424   9.4942   3.1445   13.806 -18.6502   13.078   13.986   6.1763   9.9033   4.8458 4.082894 7.850430 
1 1 1   10    3  121 o   10.663   4.9605  -5.2270   10.444  -9.6144   13.751   0.7546   16.056   11.456   5.4403   14.144   6.4190 -2.687585 8.414295 
1 1 1   10    3  122 o   22.152   5.8807   25.599   10.795   18.395   14.196   35.477   16.622   18.414   6.9407   24.314   7.5747 -5.900002 10.27374 
1 1 1   10    3  123 f   33.021   4.9665   52.675   12.955   82.201   18.865   26.326   17.821   40.063   5.9576   20.680   7.7805 19.38292 9.799487 
1 1 1   10    3  124 o   15.817   6.3208   11.543   12.317   5.5471   17.604   17.294   17.240   15.322   6.8573   17.995   7.3730 -2.672587 10.06891 
1 1 1   10    3  125 o   13.427   5.7065   5.2937   10.901   6.0715   14.101   4.1384   17.186   14.548   6.3380   14.884   6.7088 -0.3359613 9.229227 
1 1 1   10    3  126 o   17.592   6.0704   16.517   10.566   18.183   13.599   13.980   16.784   18.069   6.7969   16.927   7.1318 1.141048 9.851943 
1 1 1   10    3  127 o   20.818   6.0561   23.477   10.893   19.386   14.245   29.237   16.903   18.458   6.9536   21.494   7.6578 -3.035723 10.34379 
1 1 1   10    3  128 o   23.770   5.7946   29.605   11.124   18.839   14.236   46.489   17.828   18.308   6.9392   27.607   7.6554 -9.298925 10.33235 
1 1 1   10    4 -126 o   12.571   5.4375   3.3911   10.226   5.8287   12.849  -0.8189   16.887   14.092   6.0952   13.826   6.3884 0.2661638 8.829719 
1 1 1   10    4 -125 o   8.3043   4.0991 -17.6995   10.039 -10.2459   12.338 -32.3016   17.269   10.563   5.0539   10.215   5.0978 0.3479109 7.178396 
1 1 1   10    4 -124 o   12.128   5.1976   3.2502   9.1794   7.5009   10.812  -7.7261   17.374   14.064   5.8085   12.915   6.1277 1.149651 8.443211 
1 1 1   10    4 -123 o   10.028   4.6510  -4.3221   9.0761  -2.4308   10.666  -9.2870   17.281   11.284   5.1634   12.712   6.0542 -1.428355 7.956984 
1 1 1   10    4 -122 o   22.386   5.5957   25.804   10.182   21.841   11.136   46.018   25.152   20.079   6.1906   24.645   9.2494 -4.566462 11.12990 
1 1 1   10    4 -121 o   30.766   4.9387   45.737   11.967   47.811   13.494   38.102   25.894   30.834   5.5740   22.678   9.1295 8.155476 10.69660 
1 1 1   10    4 -120 o   11.555   5.1540  -0.0861   9.8557  -4.5069   10.748   23.274   24.707   10.943   5.0706   19.759   8.4984 -8.815620 9.896091 
1 1 1   10    4 -119 o   17.413   5.6663   15.390   9.2196   13.204   10.778   21.354   17.801   16.402   6.0745   19.372   7.6444 -2.969492 9.764021 
1 1 1   10    4 -118 o   12.585   5.2502   4.3702   8.9588   4.4085   10.529   4.2698   17.051   13.199   5.6088   15.158   6.7689 -1.959320 8.790652 
1 1 1   10    4 -117 o   25.923   4.8822   32.128   9.9383   35.159   10.913   17.398   24.056   26.920   5.1610   18.974   8.2721 7.945557 9.750055 
1 1 1   10    4 -116 o   15.243   5.6903   10.464   9.4937   9.4178   10.502   15.141   22.201   15.017   5.8882   18.479   8.0022 -3.461181 9.935079 
1 1 1   10    4 -115 o   17.902   5.7917   16.041   9.6403   15.713   10.633   17.558   22.852   17.704   6.0902   19.130   8.1996 -1.425764 10.21390 
1 1 1   10    4 -114 o   17.135   5.8022   14.343   9.6438   10.233   10.681   32.475   22.435   15.469   5.9738   22.871   8.7013 -7.401779 10.55451 
1 1 1   10    4 -113 o   21.563   5.1597   22.382   8.9478   24.361   10.790   18.024   16.010   22.041   5.8923   19.000   7.3199 3.041027 9.396807 
1 1 1   10    4 -112 o   18.299   5.4325   16.149   8.6899   8.8338   10.347   33.657   16.008   15.035   5.8593   24.952   7.3647 -9.916232 9.411156 
1 1 1   10    4 -111 o   41.153   2.9198   72.108   9.7313   70.304   11.701   76.154   17.524   40.186   3.6106   40.262   5.4817 -0.7577515E-01 6.563924 
1 1 1   10    4 -110 o   28.473   3.9177   35.790   8.8521   34.824   10.665   37.928   15.873   27.488   4.9411   27.129   7.0974 0.3590851 8.647991 
1 1 1   10    4 -109 o   45.048   2.6962   85.455   9.8554   87.881   12.047   80.546   17.138   45.339   3.2818   42.052   5.1038 3.286182 6.067880 
1 1 1   10    4 -108 o   25.889   4.3654   29.910   8.8852   34.249   11.014   21.823   15.036   27.321   5.1339   21.132   7.2433 6.189049 8.878221 
1 1 1   10    4 -107 o   31.142   3.0175   41.137   7.5642   49.111   10.814   33.497   10.585   33.565   4.0330   27.188   4.9587 6.376991 6.391663 
1 1 1   10    4 -106 o   10.273   4.2313   1.8685   5.7169  -7.3013   10.767   5.4690   6.7466   10.902   5.0596   12.610   4.7776 -1.708105 6.958868 
1 1 1   10    4 -105 o   44.582   2.0338   82.185   7.3717   73.079   11.452   88.629   9.6330   41.492   3.4161   46.105   2.5734 -4.612556 4.276889 
1 1 1   10    4 -104 f   19.449   3.9927   16.641   6.1177   11.310   11.560   18.714   7.2100   16.963   6.2895   20.506   4.4422 -3.542341 7.700004 
1 1 1   10    4 -103 o   26.572   3.0243   29.833   6.4343   26.701   11.846   31.144   7.6632   23.997   6.0565   26.975   3.5729 -2.977417 7.031824 
1 1 1   10    4 -102 o   12.219   4.6265   4.9171   6.3240   9.3603   13.672   3.7076   7.1329   16.993   6.7014   12.074   4.8150 4.919046 8.251863 
1 1 1   10    4 -101 o   39.376   2.3584   64.276   7.5351   42.211   15.187   71.482   8.6787   30.258   6.3597   41.464   2.5805 -11.20630 6.863265 
1 1 1   10    4 -100 o   25.339   3.1752   27.169   6.4148   26.787   11.814   27.328   7.6390   24.186   6.0170   25.208   3.8387 -1.021936 7.137159 
1 1 1   10    4  -99 o   11.558   4.3921   4.2154   5.7119   13.785   9.7346  -0.8092   7.0538   17.868   5.8230   10.277   4.4798 7.590925 7.346815 
1 1 1   10    4  -98 o   78.981   1.4816  255.401   9.5389  253.457   14.873  256.760   12.433   78.386   2.3302   79.067   1.9290 -0.6810455 3.025084 
1 1 1   10    4  -97 o   42.731   2.0037   75.155   6.9598   72.245   11.353   76.908   8.8093   41.518   3.3838   43.106   2.5181 -1.588013 4.217947 
1 1 1   10    4  -96 f   65.159   1.6521  174.004   8.7679  177.640   14.942  172.095   10.828   65.497   2.8051   64.702   2.0557 0.7956314 3.477683 
1 1 1   10    4  -95 o   20.418   3.8620   17.953   6.1926   30.802   11.382   12.551   7.3805   26.396   5.4698   17.015   4.9949 9.381056 7.407331 
1 1 1   10    4  -94 f   67.172   1.6271  184.665   8.9092  199.995   15.231  176.691   10.985   69.606   2.6894   65.593   2.0570 4.012726 3.385813 
1 1 1   10    4  -93 o   85.925   1.5218  301.917   10.659  317.707   17.778  293.056   13.317   87.866   2.4847   84.568   1.9319 3.297302 3.147360 
1 1 1   10    4  -92 o   71.921   1.5270  211.475   8.9525  212.747   13.899  210.573   11.704   71.943   2.3733   71.661   2.0056 0.2822418 3.107224 
1 1 1   10    4  -91 o   28.970   3.0481   34.961   7.0903   33.773   10.416   35.987   9.6786   28.055   4.7223   29.125   4.1977 -1.069553 6.318279 
1 1 1   10    4  -90 o   15.196   4.7966   9.5578   6.6436   24.573   9.9691  -2.4376   8.9106   23.745   5.2864   11.216   4.9571 12.52906 7.246975 
1 1 1   10    4  -89 o   66.239   1.7491  179.505   9.4358  177.837   13.561  181.071   13.138   65.793   2.5333   66.410   2.4310 -0.6172028 3.511013 
1 1 1   10    4  -88 o   51.347   2.1183  108.087   8.8470   91.894   13.691  119.695   11.592   47.068   3.5957   53.953   2.6438 -6.884789 4.463089 
1 1 1   10    4  -87 o   11.917   4.6970   3.4092   6.7135   0.9386   10.224   5.2820   8.9013   13.147   5.5541   13.995   5.4400 -0.8477068 7.774415 
1 1 1   10    4  -86 o   53.325   2.1175  116.480   9.1858  127.137   12.639  104.551   13.373   55.614   2.7971   50.335   3.2772 5.279003 4.308520 
1 1 1   10    4  -85 o   61.422   2.0348  154.387   10.174  158.518   14.023  149.796   14.783   62.132   2.7757   60.354   3.0143 1.777660 4.097633 
1 1 1   10    4  -84 o   78.544   2.0208  252.285   12.927  251.198   15.842  254.452   22.365   78.307   2.4850   78.618   3.4986 -0.3113937 4.291331 
1 1 1   10    4  -83 o   74.312   1.8545  225.550   11.234  235.347   16.186  216.443   15.605   75.785   2.6240   72.672   2.6386 3.113205 3.721269 
1 1 1   10    4  -82 o   20.201   4.9403   17.524   8.0665   26.963   12.262   10.323   10.710   24.975   6.0808   17.011   6.0916 7.964497 8.607222 
1 1 1   10    4  -81 o   84.042   1.6963  288.298   11.620  297.352   16.425  279.225   16.443   85.258   2.3656   82.606   2.4446 2.651955 3.401786 
1 1 1   10    4  -80 o  114.002   1.4891  530.265   13.838  536.216   20.437  525.226   18.805  114.569   2.1883  113.406   2.0342 1.162430 2.987761 
1 1 1   10    4  -79 o  176.964   1.5500  1277.74   22.359  1258.11   31.974  1296.54   31.279  175.496   2.2351  178.171   2.1536 -2.674301 3.103834 
1 1 1   10    4  -78 o   98.828   1.6044  398.505   12.925  396.221   17.915  400.985   18.666   98.494   2.2313   99.077   2.3113 -0.5827560 3.212595 
1 1 1   10    4  -77 o  152.839   1.5903  953.039   19.813  941.141   26.741  967.520   29.501  151.818   2.1608  153.905   2.3515 -2.086868 3.193529 
1 1 1   10    4  -76 o   98.965   1.5877  399.556   12.808  403.066   17.833  395.816   18.407   99.356   2.2019   98.451   2.2937 0.9052200 3.179533 
1 1 1   10    4  -75 o   47.006   2.2852   90.435   8.7298   90.439   12.642   90.432   12.069   46.897   3.3288   46.914   3.1747 -0.1705170E-01 4.599951 
1 1 1   10    4  -74 o   77.821   1.7151  247.077   10.880  264.646   15.576  230.339   15.203   80.469   2.3773   75.057   2.4883 5.412025 3.441392 
1 1 1   10    4  -73 o   99.096   1.5924  400.556   12.863  418.756   18.139  382.144   18.245  101.285   2.1970   96.748   2.3134 4.537041 3.190417 
1 1 1   10    4  -72 o  183.649   1.6727  1375.76   25.041  1359.71   33.643  1395.70   37.496  182.512   2.2614  184.882   2.4880 -2.369949 3.362146 
1 1 1   10    4  -71 o   49.120   2.3579   98.716   9.4135   82.895   14.323  110.748   12.490   44.828   3.9604   51.980   2.9600 -7.152203 4.944295 
1 1 1   10    4  -70 o  108.783   1.5774  482.632   13.988  475.666   19.205  490.503   20.414  107.963   2.1822  109.627   2.2844 -1.664238 3.159222 
1 1 1   10    4  -69 o  104.633   1.6737  446.531   14.275  451.208   21.208  442.657   19.303  105.135   2.4747  104.147   2.2737 0.9884491 3.360649 
1 1 1   10    4  -68 o   75.218   1.8515  230.785   11.352  226.929   17.053  233.853   15.213   74.495   2.8134   75.653   2.4702 -1.157570 3.743912 
1 1 1   10    4  -67 o   98.678   1.7200  397.129   13.835  405.490   20.579  390.234   18.689   99.641   2.5358   97.790   2.3445 1.850792 3.453519 
1 1 1   10    4  -66 o   21.439   5.0632   19.589   8.7062   16.834   13.463   21.569   11.414   20.724   6.8531   22.539   6.0754 -1.815660 9.158369 
1 1 1   10    4  -65 o  216.516   1.9575  1912.12   34.549  1939.50   43.547  1865.61   56.755  218.013   2.4504  213.723   3.2578 4.290909 4.076461 
1 1 1   10    4  -64 o  211.361   1.9550  1822.07   33.682  1838.18   49.135  1807.79   46.262  212.208   2.8405  210.463   2.6966 1.745712 3.916600 
1 1 1   10    4  -63 o   89.628   2.1083  327.684   15.403  326.497   26.367  328.299   18.978   89.321   3.6289   89.656   2.5995 -0.3351822 4.463947 
1 1 1   10    4  -62 o  134.493   1.7621  737.655   19.318  743.970   28.789  732.482   26.055  135.021   2.6157  133.989   2.3855 1.032455 3.540095 
1 1 1   10    4  -61 o   98.516   2.0581  395.858   16.528  382.779   21.557  414.512   25.744   96.809   2.7345  100.712   3.1398 -3.903145 4.163591 
1 1 1   10    4  -60 o  197.612   2.0412  1592.71   32.881  1707.52   56.257  1533.15   40.523  204.486   3.3751  193.842   2.5646 10.64337 4.238878 
1 1 1   10    4  -59 o  235.329   1.9833  2258.56   38.046  2331.73   55.067  2191.74   52.626  239.032   2.8262  231.749   2.7858 7.282440 3.968351 
1 1 1   10    4  -58 o  172.630   1.7133  1215.18   24.109  1273.19   34.901  1162.22   33.343  176.662   2.4236  168.788   2.4234 7.873932 3.427318 
1 1 1   10    4  -57 o  333.071   2.5081  4525.79   68.095  4512.14   96.268  4539.46   96.334  332.409   3.5528  333.415   3.5445 -1.006378 5.018572 
1 1 1   10    4  -56 o  220.823   1.9099  1988.52   34.379  2020.27   49.225  1958.27   48.036  222.518   2.7138  219.079   2.6899 3.438919 3.821040 
1 1 1   10    4  -55 o   52.802   1.6307  113.784   7.0102  103.640   10.677  121.470   9.2943   50.335   2.6111   54.535   2.0947 -4.200466 3.347451 
1 1 1   10    4  -54 o  159.980   1.5250  1043.47   19.888  1032.80   31.524  1050.53   25.632  159.120   2.4304  160.503   1.9592 -1.382614 3.121729 
1 1 1   10    4  -53 o   17.347   4.2186   12.786   5.9068   12.680   11.395   12.825   6.9072   18.408   6.3058   17.431   4.7381 0.9766216 7.887500 
1 1 1   10    4  -52 o  113.810   1.5424  528.087   14.309  537.449   21.945  521.162   18.873  114.791   2.3453  113.048   2.0481 1.742859 3.113648 
1 1 1   10    4  -51 o  314.003   2.2141  4021.16   56.671  4139.66   89.264  3941.14   73.349  318.454   3.4387  310.793   2.8953 7.660065 4.495234 
1 1 1   10    4  -50 o   65.274   1.4105  173.697   7.5050  178.605   10.682  168.912   10.547   66.152   1.9832   64.328   2.0138 1.823219 2.826360 
1 1 1   10    4  -49 o   24.967   2.7548   25.739   5.5136   25.094   7.6900   26.423   7.9093   24.475   3.9920   25.129   3.9948 -0.6541138 5.647550 
1 1 1   10    4  -48 o   83.486   1.3516  284.135   9.1982  275.741   12.109  295.589   14.143   82.236   1.8063   85.140   2.0379 -2.903717 2.723240 
1 1 1   10    4  -47 o  129.712   1.3357  685.897   14.123  696.705   18.493  670.774   21.875  130.721   1.7356  128.255   2.0924 2.466080 2.718519 
1 1 1   10    4  -46 o   54.342   1.6852  120.512   7.4557  118.078   10.612  122.885   10.478   53.752   2.4282   54.842   2.3492 -1.089943 3.378575 
1 1 1   10    4  -45 o  223.224   1.5518  2031.45   28.236  2011.74   38.038  2055.64   42.140  222.114   2.1009  224.513   2.3026 -2.399338 3.117004 
1 1 1   10    4  -44 o  171.266   1.3735  1195.74   19.175  1187.32   26.051  1205.70   28.328  170.647   1.8728  171.957   2.0210 -1.310440 2.755309 
1 1 1   10    4  -43 o  326.109   2.0045  4336.30   53.284  4370.47   72.304  4295.68   78.829  327.334   2.7098  324.494   2.9802 2.839722 4.027956 
1 1 1   10    4  -42 o   83.885   1.3781  286.856   9.4230  284.440   13.781  288.977   12.913   83.522   2.0242   84.188   1.8817 -0.6659317 2.763716 
1 1 1   10    4  -41 o   41.843   1.8394   71.521   6.2587   61.856   8.9410   80.807   8.7638   38.838   2.8439   44.447   2.4281 -5.609779 3.739452 
1 1 1   10    4  -40 o  175.042   1.4680  1249.06   20.946  1193.19   29.463  1306.15   29.785  171.063   2.1129  178.980   2.0415 -7.917175 2.938048 
1 1 1   10    4  -39 o  212.603   1.6014  1842.69   27.752  1881.93   40.264  1807.17   38.305  214.828   2.2993  210.520   2.2322 4.307404 3.204552 
1 1 1   10    4  -38 o  203.547   2.0185  1689.25   33.491  1679.13   42.959  1704.93   53.478  202.912   2.5972  204.432   3.2092 -1.519867 4.128463 
1 1 1   10    4  -37 o  114.672   1.7795  536.094   16.634  505.353   20.956  588.447   27.348  111.325   2.3093  120.117   2.7931 -8.791451 3.624138 
1 1 1   10    4  -36 o  100.267   2.3173  409.934   18.940  409.934   18.940   0.0000   0.0000  100.267   2.3173  ?   ?  0.000000 2.317336 
1 1 1   10    4  -35 o  316.880   2.6500  4094.87   68.452  4164.56   89.424  3996.25  106.379  319.505   3.4335  312.912   4.1706 6.592560 5.402118 
1 1 1   10    4  -34 o   98.893   1.5810  398.677   12.745  411.917   18.860  387.549   17.290  100.511   2.3019   97.495   2.1756 3.016205 3.167353 
1 1 1   10    4  -33 o   27.454   3.2782   31.180   7.1914   21.916   11.128   37.823   9.4235   22.744   5.9389   30.194   3.9212 -7.449833 7.116672 
1 1 1   10    4  -32 o  161.593   1.8051  1064.51   23.777  1071.02   31.546  1055.94   36.180  162.073   2.3878  160.918   2.7582 1.155624 3.648194 
1 1 1   10    4  -31 o  196.039   1.7745  1566.68   28.357  1612.81   41.560  1526.50   38.790  198.881   2.5636  193.490   2.4594 5.391357 3.552517 
1 1 1   10    4  -30 o   62.622   1.7781  159.991   9.0675  162.173   14.194  158.487   11.786   63.003   2.7706   62.304   2.3247 0.6987991 3.616710 
1 1 1   10    4  -29 o  355.400   2.8628  5150.56   82.935  5005.70  129.079  5252.40  108.231  350.238   4.5212  358.837   3.7001 -8.599274 5.842303 
1 1 1   10    4  -28 o  144.398   1.7378  849.975   20.455  812.342   32.891  873.709   26.121  141.145   2.8588  146.393   2.1889 -5.248444 3.600557 
1 1 1   10    4  -27 o  341.458   2.7737  4754.05   77.203  4764.07  123.072  4747.56   99.133  341.706   4.4185  341.177   3.5645 0.5289307 5.677014 
1 1 1   10    4  -26 o  231.847   2.1188  2191.35   40.044  2273.83   65.856  2142.97   50.440  236.125   3.4215  229.256   2.6991 6.868546 4.357954 
1 1 1   10    4  -25 f  222.459   1.9015  2017.36   34.481  1967.23   48.892  2066.98   48.637  219.656   2.7306  225.158   2.6500 -5.502792 3.805090 
1 1 1   10    4  -24 o  244.312   1.8591  2433.14   37.023  2447.06   57.460  2423.26   48.413  244.980   2.8774  243.801   2.4361 1.179901 3.770127 
1 1 1   10    4  -23 o  135.709   1.4723  750.702   16.287  759.129   25.939  745.216   20.927  136.458   2.3319  135.208   1.8987 1.250412 3.007156 
1 1 1   10    4  -22 o   48.607   2.0210   96.481   7.9903   79.556   13.087  106.539   10.089   44.014   3.6814   51.062   2.4308 -7.048748 4.411552 
1 1 1   10    4  -21 o  410.890   2.7372  6883.34   91.677  6882.55  140.605  6883.93  120.913  410.775   4.1992  410.857   3.6103 -0.8273315E-01 5.537819 
1 1 1   10    4  -20 o  287.982   1.9374  3380.70   45.481  3391.33   64.819  3370.38   63.831  288.411   2.7571  287.520   2.7235 0.8912048 3.875444 
1 1 1   10    4  -19 o  225.210   1.6558  2067.42   30.397  2110.65   43.935  2027.73   42.100  227.539   2.3688  223.025   2.3157 4.513062 3.312658 
1 1 1   10    4  -18 o   66.632   1.5741  180.974   8.5497  191.860   12.810  172.230   11.481   68.565   2.2952   64.963   2.1711 3.601494 3.159413 
1 1 1   10    4  -17 o   69.365   1.6846  196.127   9.5252  205.638   15.873  190.775   11.907   70.968   2.7491   68.377   2.1390 2.590958 3.483196 
1 1 1   10    4  -16 o  197.891   1.6680  1596.26   26.906  1528.97   41.086  1646.79   35.603  193.661   2.6027  200.992   2.1730 -7.330612 3.390582 
1 1 1   10    4  -15 o  565.731   3.6335 13050.77  167.560 13013.29  255.906 13078.90  221.691  564.735   5.5590  566.238   4.8030 -1.503113 7.346547 
1 1 1   10    4  -14 o  107.053   1.6378  467.135   14.292  372.766   26.196  507.128   17.053   95.556   3.3684  111.539   1.8756 -15.98354 3.855380 
1 1 1   10    4  -13 o  372.559   2.3608  5658.22   71.696  5556.84  100.346  5763.96  102.474  369.170   3.3346  375.986   3.3435 -6.816742 4.722141 
1 1 1   10    4  -12 o   95.587   1.4238  372.419   11.094  379.195   16.370  366.664   15.087   96.449   2.0822   94.842   1.9514 1.606148 2.853717 
1 1 1   10    4  -11 o  325.984   2.1253  4331.76   56.474  4291.00   79.710  4372.84   80.023  324.422   3.0142  327.501   2.9975 -3.079529 4.250932 
1 1 1   10    4  -10 o  370.553   2.3514  5597.40   71.026  5595.68  100.795  5599.10  100.101  370.462   3.3378  370.576   3.3138 -0.1143494 4.703412 
1 1 1   10    4   -9 o  413.664   2.5774  6975.84   86.908  7050.23  124.337  6904.79  121.524  415.818   3.6683  411.509   3.6228 4.309021 5.155683 
1 1 1   10    4   -8 f  406.278   2.5387  6728.88   84.076  6711.01  119.036  6746.67  118.766  405.696   3.5995  406.773   3.5818 -1.077362 5.077983 
1 1 1   10    4   -7 o  497.608   3.2344 10095.43  131.193 10039.02  199.923 10138.09  173.865  496.106   4.9437  498.596   4.2779 -2.490448 6.537606 
1 1 1   10    4   -6 o  186.137   1.6348  1412.24   24.804  1379.67   33.011  1454.48   37.590  183.972   2.2012  188.890   2.4413 -4.918747 3.287171 
1 1 1   10    4   -5 o  177.327   1.7328  1281.72   25.047  1293.07   36.544  1271.68   34.397  178.100   2.5172  176.623   2.3891 1.477539 3.470494 
1 1 1   10    4   -4 o  119.616   1.7485  583.212   17.049  579.404   27.762  585.518   21.603  119.216   2.8568  119.849   2.2113 -0.6333847 3.612597 
1 1 1   10    4   -3 o  335.993   2.7455  4602.21   75.194  4580.60  119.010  4616.58   97.012  335.145   4.3563  336.492   3.5368 -1.346863 5.611253 
1 1 1   10    4   -2 o  395.159   3.1307  6366.19  100.845  6419.26  160.996  6331.93  129.369  396.713   4.9786  394.056   4.0275 2.656647 6.403646 
1 1 1   10    4   -1 o  131.015   1.9769  699.684   21.112  702.823   30.579  696.826   29.185  131.301   2.8571  130.740   2.7385 0.5600891 3.957555 
1 1 1   10    4    0 o  305.038   2.5551  3793.15   63.533  3915.04  103.266  3718.91   80.591  309.853   4.0885  302.019   3.2735 7.833649 5.237540 
1 1 1   10    4    1 o  264.067   2.3181  2842.53   49.897  2834.94   79.179  2847.53   64.263  263.681   3.6838  264.285   2.9830 -0.6036377 4.740093 
1 1 1   10    4    2 o  337.841   2.3333  4652.68   64.257  4541.06   96.562  4741.39   86.084  333.728   3.5496  341.025   3.0967 -7.297546 4.710545 
1 1 1   10    4    3 o  382.562   2.7847  5966.40   86.840  5899.13  121.899  6035.71  123.744  380.354   3.9317  384.732   3.9457 -4.377502 5.570168 
1 1 1   10    4    4 o  464.271   3.2840  8788.04  124.281  8804.38  176.220  8771.88  175.303  464.625   4.6528  463.767   4.6372 0.8572083 6.569049 
1 1 1   10    4    5 o  167.278   1.6845  1140.57   22.970  1097.38   32.151  1185.60   32.827  164.073   2.4040  170.541   2.3614 -6.468323 3.369754 
1 1 1   10    4    6 o  104.459   2.3745  444.814   20.218  444.814   20.218   0.0000   0.0000  104.459   2.3745  ?   ?  0.000000 2.374457 
1 1 1   10    4    7 o  621.558   4.2800 15755.15  216.851 15660.50  305.276 15851.56  308.091  619.510   6.0452  623.275   6.0640 -3.765259 8.562528 
1 1 1   10    4    8 f  294.484   2.4904  3535.22   59.782  3414.15   92.335  3622.60   78.442  289.355   3.9147  298.081   3.2283 -8.725861 5.074144 
1 1 1   10    4    9 o  240.571   2.7976  2359.42   54.861   0.0000   0.0000  2359.42   54.861  ?   ?   240.571   2.7976 0.000000 2.797596 
1 1 1   10    4   10 o  213.603   1.8592  1859.82   32.373  1852.49   45.968  1867.03   45.597  213.169   2.6454  214.005   2.6139 -0.8354492 3.718942 
1 1 1   10    4   11 o  408.022   2.9368  6787.33   97.676  6818.84  138.886  6756.48  137.397  408.907   4.1667  407.035   4.1410 1.872498 5.874519 
1 1 1   10    4   12 o  352.012   2.6025  5051.53   74.676  5151.54  107.400  4957.92  103.901  355.437   3.7069  348.696   3.6554 6.741394 5.206040 
1 1 1   10    4   13 o  300.363   2.3073  3677.73   56.493  3727.46   80.945  3630.51   78.881  302.358   3.2842  298.401   3.2429 3.956696 4.615475 
1 1 1   10    4   14 o  180.668   1.7259  1330.50   25.418  1312.18   36.053  1348.60   35.840  179.410   2.4652  181.883   2.4173 -2.473114 3.452652 
1 1 1   10    4   15 o  297.746   2.2915  3613.95   55.617  3663.65   79.665  3566.70   77.680  299.757   3.2603  295.765   3.2220 3.991760 4.583790 
1 1 1   10    4   16 o  291.133   2.2572  3455.19   53.568  3488.88   76.512  3422.79   75.024  292.520   3.2087  289.738   3.1766 2.782440 4.515151 
1 1 1   10    4   17 o  445.431   3.1703  8089.74  115.111  7874.37  159.473  8324.02  166.325  439.378   4.4526  451.744   4.5168 -12.36600 6.342463 
1 1 1   10    4   18 o  158.421   2.3118  1023.11   29.854   0.0000   0.0000  1023.11   29.854  ?   ?   158.421   2.3118 0.000000 2.311831 
1 1 1   10    4   19 o  274.542   2.3688  3072.73   53.013  3040.22   83.447  3094.72   68.645  273.039   3.7493  275.502   3.0567 -2.462952 4.837408 
1 1 1   10    4   20 o  133.316   1.7418  724.479   18.929  749.238   30.727  709.336   24.030  135.561   2.7807  131.910   2.2348 3.651489 3.567411 
1 1 1   10    4   21 o  129.830   1.9661  687.117   20.807  694.310   29.742  680.221   29.119  130.497   2.7960  129.166   2.7656 1.330276 3.932686 
1 1 1   10    4   22 o  494.866   3.8101  9987.77  153.693 10188.08  247.236  9861.60  196.213  499.551   6.0715  491.625   4.8962 7.925629 7.799718 
1 1 1   10    4   23 o  379.814   2.7706  5881.72   85.778  5916.03  122.103  5848.28  120.528  380.850   3.9331  378.665   3.9048 2.184845 5.542262 
1 1 1   10    4   24 o  454.874   3.5369  8438.28  131.145  8647.53  211.727  8308.02  167.048  460.263   5.6433  451.261   4.5413 9.002380 7.243625 
1 1 1   10    4   25 f  158.669   2.0179  1026.32   26.100  1049.13   37.678  1005.28   36.189  160.406   2.8816  157.019   2.8274 3.386902 4.037038 
1 1 1   10    4   26 o  332.386   3.0518  4505.10   82.687  4282.90  113.057  4760.66  121.246  324.009   4.2806  341.597   4.3543 -17.58813 6.106010 
1 1 1   10    4   27 o  184.958   2.4306  1394.74   36.645  1375.84   62.933  1404.43   45.075  183.641   4.2041  185.584   2.9796 -1.943146 5.152937 
1 1 1   10    4   28 o  200.009   2.5213  1631.04   41.106  1457.10   67.001  1736.02   52.054  188.976   4.3495  206.326   3.0950 -17.35034 5.338274 
1 1 1   10    4   29 o  136.563   2.2070  760.327   24.569  745.071   42.312  768.088   30.177  135.092   3.8463  137.249   2.6973 -2.157028 4.697808 
1 1 1   10    4   30 o  154.006   1.7949  966.872   22.533  932.877   35.534  989.734   29.140  151.250   2.8822  155.806   2.2944 -4.555908 3.683907 
1 1 1   10    4   31 o  173.597   1.8560  1228.53   26.264  1219.81   41.739  1234.25   33.792  172.949   2.9607  173.988   2.3826 -1.038834 3.800339 
1 1 1   10    4   32 o  135.490   1.7475  748.363   19.300  782.060   31.522  728.156   24.410  138.484   2.7924  133.639   2.2408 4.845001 3.580279 
1 1 1   10    4   33 o  174.516   1.8593  1241.61   26.450  1225.80   42.082  1251.94   34.006  173.367   2.9778  175.226   2.3808 -1.858780 3.812521 
1 1 1   10    4   34 o  171.382   1.8469  1197.43   25.801  1181.57   40.966  1207.85   33.218  170.209   2.9526  172.112   2.3677 -1.902756 3.784664 
1 1 1   10    4   35 o  132.608   1.7337  716.882   18.740  713.392   30.200  719.067   23.898  132.259   2.8012  132.800   2.2076 -0.5407410 3.566575 
1 1 1   10    4   36 o  130.772   1.7330  697.179   18.474  711.115   29.981  688.649   23.455  132.046   2.7854  129.959   2.2141 2.087173 3.558171 
1 1 1   10    4   37 o  168.554   1.8362  1158.27   25.229  1147.81   40.183  1165.08   32.415  167.752   2.9386  169.033   2.3525 -1.280609 3.764270 
1 1 1   10    4   38 o  217.329   2.0614  1925.78   36.518  1933.56   58.513  1920.82   46.738  217.702   3.2972  217.022   2.6420 0.6801758 4.225150 
1 1 1   10    4   39 o   66.561   1.9778  180.798   10.719  190.235   17.900  175.523   13.384   68.210   3.2286   65.557   2.5092 2.652733 4.089005 
1 1 1   10    4   40 o  403.920   3.2008  6656.25  105.387  6778.60  169.449  6579.07  134.583  407.302   5.1037  401.441   4.1128 5.861084 6.554605 
1 1 1   10    4   41 o  145.510   1.7780  863.240   21.089  841.464   33.582  877.419   27.098  143.626   2.8684  146.686   2.2663 -3.059296 3.655655 
1 1 1   10    4   42 o  286.233   2.4492  3341.31   57.145  3345.02   90.972  3338.90   73.444  286.255   3.8987  286.072   3.1495 0.1834412 5.011904 
1 1 1   10    4   43 o  168.388   1.8507  1156.08   25.402  1180.31   41.023  1141.00   32.351  170.095   2.9587  167.267   2.3727 2.828491 3.792544 
1 1 1   10    4   44 o   96.565   2.0268  380.225   15.954  392.680   22.643  367.946   22.483   98.072   2.8354   94.926   2.9090 3.145973 4.062240 
1 1 1   10    4   45 o  109.077   1.9884  485.134   17.680  508.829   25.171  462.060   24.839  111.686   2.7648  106.387   2.8668 5.298439 3.982824 
1 1 1   10    4   46 o   98.778   2.3526  397.929   18.943  407.987   23.119  377.383   33.043   99.964   2.8401   96.034   4.2314 3.930183 5.096165 
1 1 1   10    4   47 o  185.684   4.3835  1408.43   66.348   0.0000   0.0000  1408.43   66.348  ?   ?   185.684   4.3835 0.000000 4.383497 
1 1 1   10    4   48 o   51.891   2.7461  110.152   11.574  113.507   23.168  109.036   13.361   52.391   5.5072   51.593   3.1926 0.7983551 6.365690 
1 1 1   10    4   49 o  207.593   2.5893  1757.90   43.815  1804.69   79.432  1737.44   52.530  210.145   4.6370  206.342   3.1231 3.802597 5.590668 
1 1 1   10    4   50 o  167.244   2.0564  1140.61   28.035  1182.90   59.331  1128.46   31.810  170.109   4.2822  166.337   2.3461 3.772507 4.882701 
1 1 1   10    4   51 o  174.279   1.9110  1238.51   27.148  1148.86   43.526  1295.60   34.731  167.782   3.1825  178.226   2.3906 -10.44377 3.980379 
1 1 1   10    4   52 o   72.967   1.8302  217.235   10.877  204.293   16.914  226.363   14.204   70.697   2.9414   74.461   2.3431 -3.763741 3.760557 
1 1 1   10    4   53 o  145.789   1.6667  866.601   19.807  855.328   29.068  876.372   27.063  144.805   2.4626  146.585   2.2649 -1.779922 3.345731 
1 1 1   10    4   54 o  133.008   1.6492  721.325   17.881  750.781   27.105  698.628   23.793  135.666   2.4510  130.879   2.2302 4.787308 3.313790 
1 1 1   10    4   55 o  117.884   1.6338  566.606   15.700  577.470   23.651  558.048   20.992  118.981   2.4386  116.972   2.2016 2.008728 3.285386 
1 1 1   10    4   56 o  133.358   1.6534  725.140   17.974  712.043   26.628  736.102   24.361  132.115   2.4725  134.341   2.2246 -2.225052 3.326006 
1 1 1   10    4   57 o  175.920   1.7612  1261.95   25.256  1242.70   36.671  1279.32   34.833  174.526   2.5777  177.090   2.4130 -2.564316 3.530878 
1 1 1   10    4   58 o   86.184   1.7402  302.879   12.226  289.675   18.786  312.580   16.102   84.211   2.7403   87.510   2.2592 -3.299545 3.551511 
1 1 1   10    4   59 o  188.512   1.8126  1449.15   27.853  1433.59   40.479  1463.14   38.386  187.440   2.6493  189.375   2.4866 -1.935150 3.633450 
1 1 1   10    4   60 o  133.699   1.8487  728.971   20.147  728.916   34.745  729.000   24.729  133.618   3.1900  133.682   2.2694 -0.6413269E-01 3.914899 
1 1 1   10    4   61 o   25.653   5.4931   27.989   11.140   34.690   14.825   19.297   16.884   28.507   6.5217   22.538   7.6768 5.968920 10.07301 
1 1 1   10    4   62 o  149.079   1.7529  906.323   21.301  902.362   31.773  909.558   28.709  148.701   2.6213  149.311   2.3588 -0.6096039 3.526308 
1 1 1   10    4   63 o   79.515   2.6113  258.300   16.903  239.230   23.376  279.196   24.470   76.421   3.7641   82.584   3.6439 -6.163322 5.238962 
1 1 1   10    4   64 o   36.153   2.9314   53.706   8.5647   48.734   13.370   57.166   11.154   34.152   4.9464   37.218   3.7265 -3.065914 6.193057 
1 1 1   10    4   65 o   39.062   2.7348   62.586   8.6531   49.106   13.270   72.560   11.414   34.291   4.8853   42.013   3.3608 -7.722519 5.929656 
1 1 1   10    4   66 o   35.678   3.0316   52.355   8.7334   56.442   13.842   49.653   11.256   36.831   4.7189   34.608   4.0678 2.223377 6.230177 
1 1 1   10    4   67 o  138.163   1.8327  778.597   20.641  708.149   33.902  820.091   26.019  131.667   3.1587  141.769   2.2515 -10.10260 3.879006 
1 1 1   10    4   68 o  108.848   1.6374  483.195   14.528  458.140   24.722  496.413   17.956  105.880   2.8671  110.310   1.9969 -4.429344 3.493959 
1 1 1   10    4   69 o  215.799   1.8585  1899.70   32.693  1951.73   48.595  1856.68   44.189  218.624   2.7268  213.260   2.5419 5.363708 3.727880 
1 1 1   10    4   70 o   72.357   1.5982  213.529   9.4267  227.518   16.373  206.594   11.529   74.594   2.6972   71.131   1.9903 3.463043 3.352080 
1 1 1   10    4   71 o  155.468   1.6062  985.828   20.355  1021.68   31.275  959.481   26.811  158.196   2.4253  153.333   2.1451 4.863556 3.237836 
1 1 1   10    4   72 o   13.504   4.2500   7.3718   5.2192   1.2802   11.693   8.8876   5.8325   14.236   5.9725   14.697   4.4707 -0.4603167 7.460437 
1 1 1   10    4   73 o  106.281   1.5312  460.723   13.265  466.293   27.299  459.000   15.178  106.749   3.1406  106.070   1.7554 0.6791840 3.597909 
1 1 1   10    4   74 o  136.921   1.3895  764.585   15.508  741.447   23.429  782.630   20.690  134.773   2.1326  138.493   1.8327 -3.720123 2.811934 
1 1 1   10    4   75 o  139.800   1.5271  797.222   17.403  829.602   24.529  764.402   24.695  142.557   2.1108  136.829   2.2141 5.727371 3.059042 
1 1 1   10    4   76 o   59.894   1.6528  146.470   8.0618  156.539   13.370  140.718   10.105   61.836   2.6588   58.672   2.1164 3.164063 3.398267 
1 1 1   10    4   77 o  156.093   1.6633  994.137   21.163  979.953   27.195  1015.91   33.698  154.918   2.1536  157.666   2.6220 -2.747467 3.393034 
1 1 1   10    4   78 o  186.836   1.7352  1424.55   26.426  1398.75   34.078  1463.47   41.853  185.055   2.2591  189.198   2.7138 -4.142670 3.531043 
1 1 1   10    4   79 o   28.580   3.9750   34.158   9.0103   16.104   11.387   64.387   14.735   19.840   6.2820   39.281   4.6947 -19.44182 7.842448 
1 1 1   10    4   80 o  135.912   1.6288  753.838   18.045  750.963   23.468  757.997   28.224  135.592   2.1233  136.161   2.5429 -0.5693817 3.312844 
1 1 1   10    4   81 o   82.401   1.8245  277.220   12.255  271.514   15.881  285.619   19.268   81.464   2.3941   83.491   2.8353 -2.027611 3.710890 
1 1 1   10    4   82 o   72.841   2.1871  217.025   12.971  218.924   15.276  212.115   24.559   73.110   2.5673   71.662   4.2229 1.447685 4.942071 
1 1 1   10    4   83 o   65.225   2.3858  174.231   12.663  158.646   14.770  217.475   24.603   62.160   2.9232   72.544   4.1783 -10.38444 5.099315 
1 1 1   10    4   84 o  188.610   1.9055  1453.40   29.297  1436.22   35.188  1492.20   52.890  187.388   2.3036  190.610   3.4040 -3.221497 4.110244 
1 1 1   10    4   85 o   84.465   1.7726  291.429   12.204  292.981   15.960  289.244   18.939   84.590   2.3167   83.966   2.7709 0.6241684 3.611760 
1 1 1   10    4   86 o   52.366   2.2143  112.387   9.4304  125.334   12.469   95.084   14.415   55.220   2.7790   47.904   3.7207 7.315838 4.643981 
1 1 1   10    4   87 o   65.856   2.0500  177.564   10.992  198.551   15.583  156.783   15.506   69.519   2.7554   61.696   3.0931 7.822704 4.142385 
1 1 1   10    4   88 o   84.020   1.8360  288.626   12.574  260.555   17.386  319.415   18.208   79.644   2.6818   88.227   2.5344 -8.582878 3.689878 
1 1 1   10    4   89 o   38.762   2.8503   62.069   8.9432   62.469   12.661   61.670   12.634   38.620   4.0835   38.364   4.1038 0.2555618 5.789260 
1 1 1   10    4   90 o   26.934   3.6033   30.503   7.7130   20.022   10.093   45.217   11.959   21.402   5.6883   32.621   4.6270 -11.21898 7.332564 
1 1 1   10    4   91 o   35.757   2.7573   52.897   7.9746   41.990   10.352   68.816   12.507   31.521   4.1281   40.559   3.8281 -9.038473 5.629817 
1 1 1   10    4   92 o   49.890   2.1365  102.241   8.6685   93.575   11.243  114.945   13.613   47.563   2.9138   52.661   3.1860 -5.098137 4.317508 
1 1 1   10    4   93 o   82.543   1.6682  278.806   11.225  282.089   14.746  274.283   17.308   82.881   2.1845   81.596   2.6056 1.284920 3.400159 
1 1 1   10    4   94 f   13.126   4.8884   5.7609   6.9980   13.640   9.1513  -5.3352   10.860   17.879   5.6277   11.670   5.2894 6.209393 7.723290 
1 1 1   10    4   95 o   47.409   2.1400   92.500   8.2489   94.350   10.781   89.887   12.811   47.724   2.7834   46.390   3.4117 1.334431 4.403117 
1 1 1   10    4   96 f   17.233   4.7767   12.994   6.9425   18.182   9.0785   5.6863   10.774   20.236   5.4025   14.842   5.9181 5.394507 8.013126 
1 1 1   10    4   97 o   48.036   2.1256   95.047   8.3027  105.032   10.881   81.132   12.845   50.354   2.6604   43.927   3.6195 6.427036 4.492019 
1 1 1   10    4   98 o   8.8414   4.0641  -4.5644   6.7092  -8.7543   8.7509   1.4106   10.450   9.4084   4.4291   13.172   5.5922 -3.764080 7.133725 
1 1 1   10    4   99 o   19.044   4.7504   16.096   7.3494   12.251   9.9664   20.679   10.881   17.174   5.8968   21.352   6.0028 -4.177536 8.414590 
1 1 1   10    4  100 o   31.402   3.0973   41.460   7.8252   35.806   10.669   48.043   11.512   28.575   4.7466   33.367   4.3350 -4.791662 6.428281 
1 1 1   10    4  101 o   34.837   2.6949   50.631   7.5934   38.901   9.8831   67.532   11.863   30.018   4.1499   39.889   3.6903 -9.871004 5.553345 
1 1 1   10    4  102 o   42.170   2.2963   73.664   7.8638   75.984   10.408   70.578   12.005   42.585   3.0177   40.778   3.6501 1.807068 4.736010 
1 1 1   10    4  103 o   47.509   2.1513   93.321   8.3098   92.636   10.998   94.233   12.686   47.070   2.8801   47.286   3.3122 -0.2155952 4.389217 
1 1 1   10    4  104 f   29.806   3.2789   37.722   7.8351   35.392   9.7340   42.008   13.204   28.445   4.3349   30.446   5.5238 -2.000914 7.021655 
1 1 1   10    4  105 o   29.255   3.3918   36.521   7.9389   34.879   9.8416   39.582   13.433   28.148   4.4360   29.299   5.8294 -1.151455 7.325322 
1 1 1   10    4  106 o   27.888   3.5939   33.503   7.9802   29.860   9.7589   40.854   13.864   25.769   4.8231   29.600   5.9526 -3.830698 7.661262 
1 1 1   10    4  107 o   38.010   2.6547   60.616   8.1736   51.004   10.514   75.297   12.994   34.323   3.8228   41.748   3.8621 -7.424332 5.434087 
1 1 1   10    4  108 o   19.753   4.7854   17.897   7.6230   20.306   9.8976   14.384   11.952   20.711   5.6889   17.960   6.4346 2.750870 8.588856 
1 1 1   10    4  109 o   10.380   4.5410  -0.4142   7.3036  -2.6601   9.5893   2.6884   11.271   11.154   5.0208   13.518   5.7755 -2.364366 7.652772 
1 1 1   10    4  110 o   29.256   3.3004   36.950   7.7336   36.487   10.143   37.594   11.952   28.401   4.5336   28.295   5.3786 0.1058407 7.034365 
1 1 1   10    4  111 o   16.502   5.0669   12.690   7.4692   7.2658   9.7079   20.561   11.693   14.312   5.6461   20.308   6.3571 -5.996215 8.502367 
1 1 1   10    4  112 o   20.673   4.7394   20.009   7.8156   16.801   10.141   24.704   12.266   18.525   5.9352   21.995   6.4346 -3.470009 8.753939 
1 1 1   10    4  113 o   22.363   4.8599   23.644   8.6056   16.691   10.162   41.265   16.179   18.352   5.9472   27.737   7.1200 -9.384581 9.277086 
1 1 1   10    4  114 o   13.094   5.2744   5.6667   8.6487   7.6085   10.268   0.9260   16.044   14.375   5.7621   14.461   6.5032 -0.8620548E-01 8.688671 
1 1 1   10    4  115 o   10.346   4.6282  -1.2778   8.0095  -9.9079   10.278   12.065   12.780   9.7582   4.6535   16.449   6.4816 -6.691322 7.979105 
1 1 1   10    4  116 o   12.239   5.0362   4.2296   8.0884   2.0886   10.446   7.4351   12.782   12.556   5.4628   14.930   6.2528 -2.374352 8.302940 
1 1 1   10    4  117 o   22.604   5.3331   25.296   9.6667   22.075   13.724   28.468   13.618   20.050   6.9183   22.743   6.8125 -2.692522 9.709479 
1 1 1   10    4  118 o   17.622   6.2857   15.965   11.392   19.174   16.049   12.707   16.173   18.803   7.3057   16.943   7.0600 1.859875 10.15955 
1 1 1   10    4  119 o   22.167   7.7142   29.817   17.080   64.361   23.667  -7.7262   24.673   31.422   8.8598   15.153   7.2218 16.26858 11.43026 
1 1 1   10    4  120 o   31.706   6.1434   52.241   15.304   84.603   26.939   36.818   18.597   35.743   9.1939   24.119   8.0566 11.62411 12.22445 
1 1 1   10    4  121 o   21.265   7.0368   26.168   14.194   34.022   23.793   21.828   17.686   22.021   8.7899   19.330   7.6223 2.691336 11.63449 
1 1 1   10    4  122 o   26.798   5.2792   35.752   11.122   45.208   14.557   22.492   17.237   29.101   6.3181   19.462   7.5687 9.638474 9.859175 
1 1 1   10    4  123 o   20.545   6.4979   23.594   12.186   16.672   17.000   30.911   17.479   17.725   7.2982   22.049   7.7938 -4.324585 10.67737 
1 1 1   10    4  124 o   14.036   5.7799   7.5293   10.663   9.5265   13.711   4.4729   16.962   15.314   6.4487   14.834   6.6776 0.4799633 9.283108 
1 1 1   10    4  125 o   13.500   5.8732   4.4794   12.074   20.815   17.539 -10.2370   16.647   18.732   7.5231   12.301   5.8816 6.431048 9.549361 
1 1 1   10    4  126 o   18.883   6.5763   20.073   12.414   24.397   17.629   15.819   17.483   19.784   7.6652   17.423   7.3059 2.361475 10.58922 
1 1 1   10    5 -125 o   22.339   9.3228   40.909   28.265   0.0000   0.0000   40.909   28.265  ?   ?    22.339   9.3228 0.000000 9.322778 
1 1 1   10    5 -124 o   15.312   5.9985   11.110   10.892   6.9229   14.169   17.157   17.028   14.669   6.3725   17.692   7.2965 -3.022588 9.687489 
1 1 1   10    5 -123 o   18.503   6.2912   18.907   11.339   17.435   14.632   21.120   17.940   17.719   6.9493   18.757   7.5820 -1.038671 10.28487 
1 1 1   10    5 -122 f   12.832   5.4705   4.4226   10.073   3.3126   12.319   6.6627   17.500   13.282   5.8511   15.365   6.8595 -2.082570 9.016005 
1 1 1   10    5 -121 o   11.314   5.0262   0.3485   9.2768   0.7713   10.907  -0.7572   17.637   12.154   5.4214   14.100   6.5200 -1.946424 8.479445 
1 1 1   10    5 -120 o   10.888   4.9058  -1.1073   9.1792  -3.4873   10.742   5.3360   17.674   11.099   5.1165   15.260   6.8470 -4.161054 8.547578 
1 1 1   10    5 -119 o   18.768   5.9763   18.652   10.293   23.738   11.159 -10.3792   26.659   21.016   6.1342   15.132   7.2889 5.884050 9.526613 
1 1 1   10    5 -118 o   30.741   4.0401   43.328   9.8791   39.433   11.533   54.060   19.144   28.346   5.1824   30.159   7.7469 -1.813395 9.320459 
1 1 1   10    5 -117 o   15.966   5.6386   12.482   9.1470   19.860   10.890  -5.1946   16.856   19.339   6.1457   13.325   6.2326 6.014173 8.752950 
1 1 1   10    5 -116 o   11.793   5.0870   2.1365   8.9015   13.417   10.596 -24.9181   16.410   16.506   6.0383   10.694   5.2714 5.812211 8.015564 
1 1 1   10    5 -115 o   14.920   5.5562   10.042   9.0405   7.6672   10.705   15.947   16.881   14.367   5.8387   17.976   7.3222 -3.609756 9.365056 
1 1 1   10    5 -114 o   13.767   5.5409   6.8410   9.5365   10.655   10.448 -12.2057   23.347   15.470   5.9252   14.518   6.9481 0.9519625 9.131427 
1 1 1   10    5 -113 o   20.374   5.7375   21.030   9.9318   15.725   10.880   47.557   24.329   17.686   6.1567   26.517   9.2082 -8.831408 11.07683 
1 1 1   10    5 -112 f   9.9962   4.6380  -5.1315   9.0388  -5.4359   9.8131  -3.4276   23.216   10.386   4.8235   15.739   7.3463 -5.352974 8.788305 
1 1 1   10    5 -111 o   29.786   3.8960   39.657   9.2329   42.875   10.895   31.458   17.392   30.552   4.5101   23.480   7.7899 7.072104 9.001299 
1 1 1   10    5 -110 o   55.044   2.5902  127.980   11.589  122.018   12.746  156.434   27.845   53.478   2.9350   56.594   6.1338 -3.115406 6.799825 
1 1 1   10    5 -109 o   32.351   3.8010   46.081   9.8327   42.391   10.839   63.232   23.366   30.588   4.4800   33.403   8.5473 -2.815060 9.650254 
1 1 1   10    5 -108 o   42.688   2.8109   77.200   9.7264   74.587   11.760   82.857   17.304   41.523   3.5072   42.478   5.0991 -0.9551811 6.188818 
1 1 1   10    5 -107 o   33.866   3.6134   49.763   9.8211   53.028   10.830   34.648   23.300   34.812   3.8826   24.817   8.9725 9.995079 9.776503 
1 1 1   10    5 -106 f   47.275   2.1692   92.936   8.3369   83.766   11.693  102.418   11.890   44.325   3.2589   49.207   2.9782 -4.882523 4.414819 
1 1 1   10    5 -105 o   32.833   2.8377   45.518   7.5203   47.114   10.909   44.073   10.382   32.769   4.1787   31.715   4.1124 1.054014 5.862921 
1 1 1   10    5 -104 o   32.210   2.8971   43.792   7.5253   44.148   11.056   43.484   10.272   31.657   4.4035   31.575   4.0867 0.8220482E-01 6.007683 
1 1 1   10    5 -103 o   21.116   3.8192   19.501   6.3320   13.475   10.469   22.978   7.9512   17.568   6.0433   22.720   4.4526 -5.151703 7.506468 
1 1 1   10    5 -102 o   41.535   2.1530   71.450   7.2646   66.903   11.653   74.341   9.2909   39.602   3.6509   42.173   2.7171 -2.571152 4.551033 
1 1 1   10    5 -101 o   60.277   1.6881  149.364   8.2861  148.243   12.945  150.143   10.785   59.670   2.6680   60.255   2.1996 -0.5850563 3.457824 
1 1 1   10    5 -100 o   34.915   2.4002   50.660   6.7896   41.324   10.781   56.798   8.7409   30.801   4.4203   36.808   2.9376 -6.006748 5.307384 
1 1 1   10    5  -99 o   20.646   3.8334   18.529   6.2140   18.799   10.077   18.364   7.8935   20.324   5.7983   20.258   4.8454 0.6593513E-01 7.556367 
1 1 1   10    5  -98 o   30.205   2.6624   38.097   6.4884   42.494   10.547   35.418   8.2303   31.376   4.2314   28.839   3.5778 2.537409 5.541192 
1 1 1   10    5  -97 f   36.363   2.3015   54.748   6.7869   59.726   10.926   51.620   8.6606   37.571   3.6119   35.094   3.0580 2.477657 4.732543 
1 1 1   10    5  -96 o   52.541   1.8956  113.523   8.1054  113.090   14.132  113.736   9.8945   51.953   3.3550   52.475   2.3189 -0.5222588 4.078399 
1 1 1   10    5  -95 f   46.637   2.1869   89.687   8.2907  121.621   16.902   79.568   9.5139   53.691   3.8882   43.792   2.6780 9.898678 4.721179 
1 1 1   10    5  -94 f   48.753   2.0374   97.792   8.0789   97.733   14.106   97.821   9.8555   48.257   3.6120   48.646   2.4937 -0.3890877 4.389232 
1 1 1   10    5  -93 o   52.124   1.9638  111.642   8.3289  120.142   14.304  107.282   10.245   53.689   3.2842   50.972   2.4730 2.716835 4.111146 
1 1 1   10    5  -92 o   44.429   2.0536   81.180   7.4174   66.516   11.531   91.530   9.6877   39.826   3.5903   47.075   2.5340 -7.248444 4.394484 
1 1 1   10    5  -91 o   61.323   1.8005  154.153   8.9905  153.852   14.976  154.323   11.242   60.945   3.0240   61.256   2.2552 -0.3113136 3.772328 
1 1 1   10    5  -90 o   25.511   3.4293   27.417   6.9509   36.153   12.297   23.315   8.4262   28.772   5.4424   23.195   4.6190 5.577393 7.138278 
1 1 1   10    5  -89 o   63.682   1.7878  166.098   9.2712  175.981   15.506  160.598   11.566   65.289   2.9209   62.524   2.2732 2.765141 3.701245 
1 1 1   10    5  -88 o   24.204   3.5010   24.701   6.7072   32.767   10.648   19.396   8.6356   27.581   4.9166   21.086   5.0838 6.494238 7.072345 
1 1 1   10    5  -87 o   36.630   2.4387   55.278   7.2402   66.959   11.334   47.224   9.4107   40.120   3.5006   33.647   3.4814 6.473885 4.937016 
1 1 1   10    5  -86 o   12.636   4.7334   5.0600   6.5806   3.5557   10.534   6.0227   8.4272   14.167   5.7790   14.048   5.3357 0.1181431 7.865505 
1 1 1   10    5  -85 o   74.002   1.7155  223.797   10.348  231.898   16.980  219.009   13.052   75.116   2.7778   73.112   2.1926 2.004631 3.538886 
1 1 1   10    5  -84 o   13.755   4.8647   6.8992   6.8103   10.959   10.551   3.9998   8.9164   17.152   6.0561   13.483   5.3812 3.669337 8.101447 
1 1 1   10    5  -83 o   67.915   1.7369  188.546   9.6078  185.988   14.275  190.665   12.991   67.328   2.6060   68.214   2.3397 -0.8861237 3.502173 
1 1 1   10    5  -82 o   69.857   1.7447  199.330   9.9352  209.144   14.773  191.224   13.425   71.425   2.5413   68.313   2.4147 3.112740 3.505554 
1 1 1   10    5  -81 o   89.127   1.7060  324.384   12.395  333.448   17.465  315.188   17.593   90.252   2.3761   87.730   2.4625 2.522049 3.421974 
1 1 1   10    5  -80 o   92.304   1.8777  348.000   14.128  350.387   18.452  344.618   21.966   92.519   2.4488   91.665   2.9435 0.8536530 3.828972 
1 1 1   10    5  -79 o   89.179   1.8421  324.759   13.391  319.038   17.421  333.023   20.937   88.296   2.4227   90.143   2.8529 -1.846458 3.742782 
1 1 1   10    5  -78 o   61.177   2.1505  153.094   10.707  161.839   14.457  142.467   15.936   62.821   2.8304   58.860   3.3351 3.960720 4.374228 
1 1 1   10    5  -77 o   97.799   1.6314  390.337   13.006  382.005   17.936  399.577   18.887   96.691   2.2756   98.882   2.3431 -2.191368 3.266284 
1 1 1   10    5  -76 o   50.204   2.2029  103.149   8.9930  102.459   12.550  103.877   12.892   49.935   3.0986   50.272   3.1621 -0.3372002 4.427190 
1 1 1   10    5  -75 o   90.080   1.7899  331.169   13.143  315.579   16.741  356.215   21.219   87.860   2.3396   93.291   2.7934 -5.430916 3.643725 
1 1 1   10    5  -74 o  165.199   1.9126  1113.93   25.755  1084.26   33.534  1156.60   40.217  162.896   2.5255  168.168   2.9338 -5.271759 3.871052 
1 1 1   10    5  -73 o   40.480   2.8591   67.323   9.3735   80.796   12.437   49.604   14.263   44.289   3.4726   34.324   5.2654 9.964859 6.307394 
1 1 1   10    5  -72 o   83.557   1.8378  284.909   12.517  289.281   16.125  278.279   19.857   84.130   2.3536   82.447   2.9595 1.683708 3.781247 
1 1 1   10    5  -71 o   65.314   1.9263  174.242   10.244  169.497   14.326  179.208   14.655   64.347   2.7375   66.169   2.7229 -1.822205 3.861092 
1 1 1   10    5  -70 o  131.236   1.5788  702.527   16.890  680.085   22.772  729.969   25.181  129.077   2.1643  133.713   2.3103 -4.636032 3.165673 
1 1 1   10    5  -69 o  125.712   1.5814  644.593   16.205  652.420   22.189  635.647   23.723  126.431   2.1530  124.780   2.3323 1.651077 3.174129 
1 1 1   10    5  -68 o  155.714   1.7316  989.091   21.980  972.311   27.481  1018.89   36.618  154.348   2.1842  157.927   2.8445 -3.578308 3.586346 
1 1 1   10    5  -67 o   37.070   2.8989   56.478   8.6902   47.515   12.356   65.251   12.225   33.739   4.6134   39.752   3.8196 -6.012924 5.989383 
1 1 1   10    5  -66 o  192.221   1.7148  1507.09   26.870  1502.31   35.964  1513.14   40.424  191.856   2.2996  192.513   2.5760 -0.6565399 3.453119 
1 1 1   10    5  -65 o  225.205   1.8351  2068.83   33.687  2062.29   44.938  2077.21   50.898  224.776   2.4526  225.541   2.7685 -0.7656250 3.698626 
1 1 1   10    5  -64 o   29.706   3.6250   36.606   8.5962   52.639   12.319   21.389   12.001   35.601   4.3340   22.490   6.2977 13.11094 7.644939 
1 1 1   10    5  -63 o  189.568   1.8368  1465.74   28.384  1461.27   40.583  1470.03   39.712  189.205   2.6313  189.778   2.5671 -0.5734711 3.676112 
1 1 1   10    5  -62 o  219.948   1.9753  1973.31   35.416  1954.38   50.439  1991.72   49.740  218.798   2.8281  220.886   2.7625 -2.088593 3.953376 
1 1 1   10    5  -61 o  181.376   1.8491  1341.70   27.338  1361.47   39.683  1323.85   37.715  182.641   2.6655  180.109   2.5689 2.532166 3.701894 
1 1 1   10    5  -60 o  115.893   1.9002  547.789   17.951  524.294   21.881  596.161   31.396  113.359   2.3679  120.785   3.1916 -7.425934 3.974069 
1 1 1   10    5  -59 o  148.776   1.5264  902.533   18.512  896.288   27.582  907.652   24.971  148.221   2.2829  149.171   2.0536 -0.9505920 3.070617 
1 1 1   10    5  -58 o   84.036   1.4547  287.939   9.9646  280.086   14.062  295.859   14.122   82.839   2.0842   85.168   2.0341 -2.328995 2.912309 
1 1 1   10    5  -57 o   44.358   2.1496   80.450   7.7496   84.790   10.763   75.779   11.167   45.484   2.9184   42.961   3.2121 2.522793 4.339920 
1 1 1   10    5  -56 o   96.659   1.6320  380.965   12.859  380.160   14.861  383.363   25.652   96.549   1.8883   96.843   3.2541 -0.2938461 3.762294 
1 1 1   10    5  -55 o  172.567   1.7676  1214.35   24.864  1248.82   37.115  1186.29   33.491  174.947   2.6026  170.524   2.4094 4.422562 3.546641 
1 1 1   10    5  -54 o  280.606   2.4494  3212.28   56.026  3245.69   74.092  3167.67   85.618  281.963   3.2236  278.469   3.7719 3.494415 4.961709 
1 1 1   10    5  -53 o  166.441   1.6739  1129.57   22.710  1132.07   32.451  1127.18   31.793  166.587   2.3897  166.230   2.3463 0.3572998 3.349042 
1 1 1   10    5  -52 o   89.145   1.8097  324.051   13.150  329.430   22.696  321.332   16.134   89.785   3.1058   88.731   2.2325 1.054573 3.824893 
1 1 1   10    5  -51 o   78.526   1.6837  251.430   10.778  217.003   15.487  283.765   15.009   72.885   2.6109   83.381   2.2101 -10.49676 3.420729 
1 1 1   10    5  -50 o  325.954   2.4658  4334.08   65.517  4333.58   93.194  4334.56   92.125  325.790   3.5093  325.834   3.4685 -0.4357910E-01 4.934131 
1 1 1   10    5  -49 o   85.670   1.6243  299.243   11.343  277.112   16.453  319.294   15.661   82.385   2.4526   88.481   2.1713 -6.095543 3.275679 
1 1 1   10    5  -48 o   75.692   1.5180  233.585   9.3662  208.089   14.773  250.723   12.112   71.377   2.5431   78.413   1.8949 -7.036308 3.171413 
1 1 1   10    5  -47 o  160.423   1.6107  1049.27   21.063  1066.98   36.928  1040.73   25.644  161.715   2.8013  159.755   1.9692 1.959412 3.424231 
1 1 1   10    5  -46 o  124.914   1.5255  636.149   15.533  602.393   26.430  653.961   19.199  121.516   2.6683  126.641   1.8598 -5.124756 3.252478 
1 1 1   10    5  -45 o  236.262   1.9521  2276.18   37.596  2241.90   64.619  2293.73   46.225  234.362   3.3825  237.142   2.3913 -2.780090 4.142389 
1 1 1   10    5  -44 o  112.916   1.4164  519.789   13.037  519.514   20.277  519.982   17.022  112.866   2.2040  112.927   1.8492 -0.6095886E-01 2.876976 
1 1 1   10    5  -43 f  159.924   1.6170  1042.73   21.080  1030.79   30.196  1054.07   29.442  158.978   2.3301  160.768   2.2466 -1.789154 3.236760 
1 1 1   10    5  -42 o  146.718   1.6307  877.625   19.503  896.052   24.318  844.409   32.650  148.238   2.0125  143.871   2.7841 4.366974 3.435269 
1 1 1   10    5  -41 o  114.604   1.5971  535.473   14.920  544.665   18.689  519.322   24.773  115.575   1.9838  112.832   2.6935 2.742630 3.345185 
1 1 1   10    5  -40 o  305.170   2.3482  3798.06   58.414  3738.25   70.982  3923.54  102.817  302.710   2.8766  309.976   4.0691 -7.265472 4.983267 
1 1 1   10    5  -39 o  185.990   1.5095  1410.24   22.885  1453.19   33.418  1372.32   31.404  188.775   2.1717  183.450   2.1001 5.324844 3.021030 
1 1 1   10    5  -38 o   70.299   1.4832  201.468   8.4994  210.252   12.751  194.445   11.402   71.772   2.1820   69.026   2.0286 2.746117 2.979331 
1 1 1   10    5  -37 o  131.323   1.3731  703.037   14.699  680.642   21.079  724.234   20.507  129.200   2.0015  133.276   1.8876 -4.076233 2.751203 
1 1 1   10    5  -36 o  212.361   1.6104  1838.53   27.876  1822.61   39.848  1853.80   39.011  211.409   2.3123  213.213   2.2446 -1.804291 3.222584 
1 1 1   10    5  -35 o   72.364   1.4892  213.477   8.7842  189.869   13.014  233.236   11.906   68.194   2.3446   75.608   1.9333 -7.414268 3.038867 
1 1 1   10    5  -34 o   73.639   1.4685  221.061   8.8150  209.986   13.012  230.455   11.984   71.726   2.2282   75.155   1.9579 -3.429443 2.966142 
1 1 1   10    5  -33 o   75.263   1.5646  230.926   9.5989  223.066   15.562  235.753   12.195   73.911   2.5870   76.015   1.9698 -2.104195 3.251528 
1 1 1   10    5  -32 o  137.862   1.4779  774.790   16.608  742.792   25.842  797.306   21.678  134.964   2.3490  139.842   1.9017 -4.877289 3.022271 
1 1 1   10    5  -31 o  244.314   1.8649  2433.54   37.139  2482.40   58.218  2400.01   48.226  246.700   2.8950  242.598   2.4387 4.101944 3.785302 
1 1 1   10    5  -30 o  129.003   1.5753  678.419   16.565  703.172   24.850  658.622   22.223  131.318   2.3214  127.095   2.1451 4.223633 3.160777 
1 1 1   10    5  -29 o   27.970   3.0126   32.279   6.7604   41.355   11.634   27.652   8.3067   31.485   4.6749   25.712   4.1010 5.773201 6.218787 
1 1 1   10    5  -28 o  148.876   1.5025  903.519   18.233  903.938   28.682  903.235   23.621  148.891   2.3633  148.844   1.9468 0.4705811E-01 3.061870 
1 1 1   10    5  -27 o  244.024   1.8631  2427.67   37.059  2476.41   58.089  2394.22   48.126  246.414   2.8920  242.314   2.4365 4.100143 3.781514 
1 1 1   10    5  -26 o  112.328   1.4610  514.346   13.377  503.878   21.240  521.229   17.222  111.165   2.3439  113.072   1.8685 -1.906342 2.997543 
1 1 1   10    5  -25 o  106.086   1.4710  458.763   12.721  442.820   20.423  468.868   16.260  104.212   2.4041  107.243   1.8600 -3.030396 3.039641 
1 1 1   10    5  -24 f  152.797   1.5216  951.716   18.951  885.690   28.922  1001.39   25.087  147.384   2.4074  156.726   1.9637 -9.342072 3.106714 
1 1 1   10    5  -23 o  391.180   2.8385  6240.17   90.512  6277.77  158.280  6221.91  110.332  392.137   4.9517  390.555   3.4656 1.582672 6.043986 
1 1 1   10    5  -22 o  367.600   2.9601  5510.69   88.699  5763.20  209.107  5455.29   97.947  375.462   6.8323  365.723   3.2855 9.739014 7.581222 
1 1 1   10    5  -21 o  155.077   1.8147  980.380   22.939  914.884   55.085  994.120   25.231  149.659   4.5206  156.157   1.9822 -6.498718 4.936073 
1 1 1   10    5  -20 o  307.248   2.8784  3849.50   72.090  3853.47  148.533  3848.28   82.453  307.153   5.9324  307.175   3.2929 -0.2185059E-01 6.785079 
1 1 1   10    5  -19 o  206.708   2.0240  1741.91   34.104  1661.02   54.487  1794.02   43.729  201.810   3.3122  209.762   2.5575 -7.951431 4.184623 
1 1 1   10    5  -18 o   75.123   1.7363  230.055   10.632  232.324   16.150  228.318   14.125   75.439   2.6304   74.798   2.3195 0.6403732 3.506954 
1 1 1   10    5  -17 o   88.686   1.6577  320.616   11.984  330.040   18.169  313.358   15.945   89.937   2.4806   87.643   2.2337 2.294632 3.338075 
1 1 1   10    5  -16 o  283.359   2.2217  3273.40   51.317  3229.72   72.606  3317.00   72.539  281.423   3.1650  285.203   3.1202 -3.779419 4.444459 
1 1 1   10    5  -15 o  193.017   1.7827  1518.69   28.048  1546.86   40.911  1493.71   38.528  194.781   2.5767  191.408   2.4693 3.372726 3.568874 
1 1 1   10    5  -14 o  209.565   1.8533  1790.29   31.660  1793.12   45.645  1787.66   43.950  209.711   2.6702  209.394   2.5749 0.3165283 3.709436 
1 1 1   10    5  -13 o  261.618   2.1084  2790.23   44.962  2774.95   64.091  2805.04   63.094  260.870   3.0140  262.283   2.9511 -1.413361 4.218156 
1 1 1   10    5  -12 o  322.877   2.4442  4250.22   64.330  4233.92   91.454  4266.18   90.507  322.208   3.4820  323.436   3.4329 -1.227936 4.889682 
1 1 1   10    5  -11 o  378.165   2.5628  5830.55   79.000  6070.69  125.180  5671.61  101.842  385.786   3.9806  372.932   3.3501 12.85349 5.202767 
1 1 1   10    5  -10 o  328.515   2.4656  4399.93   66.027  4343.11  113.459  4429.03   81.191  326.291   4.2658  329.575   3.0221 -3.284271 5.227820 
1 1 1   10    5   -9 o  164.808   1.5529  1107.17   20.862  1071.32   31.663  1134.66   27.734  162.105   2.3962  166.835   2.0393 -4.729507 3.146477 
1 1 1   10    5   -8 o  433.109   2.8632  7648.37  101.085  7617.38  154.026  7671.82  133.973  432.119   4.3728  433.709   3.7895 -1.590271 5.786310 
1 1 1   10    5   -7 o  207.557   1.6993  1756.06   28.750  1790.02   44.550  1731.81   37.636  209.535   2.6083  206.109   2.2401 3.426468 3.438213 
1 1 1   10    5   -6 f  356.481   2.4367  5180.80   70.807  5044.09  106.123  5290.50   95.060  351.682   3.7019  360.197   3.2376 -8.514587 4.917912 
1 1 1   10    5   -5 o  455.255   2.9918  8450.73  111.025  8225.16  166.179  8632.59  149.213  449.018   4.5402  460.055   3.9789 -11.03705 6.036965 
1 1 1   10    5   -4 o  134.853   1.7519  741.287   19.258  786.907   31.728  714.676   24.232  138.925   2.8017  132.404   2.2452 6.520981 3.590305 
1 1 1   10    5   -3 o   68.091   1.7127  189.111   9.4985  192.241   14.811  186.924   12.380   68.616   2.6529   67.677   2.2472 0.9392090 3.476772 
1 1 1   10    5   -2 o  132.048   1.6042  710.752   17.268  732.433   24.978  690.906   23.898  134.039   2.2861  130.184   2.2520 3.854797 3.209004 
1 1 1   10    5   -1 o  490.528   3.4511  9812.20  137.993  9840.69  195.669  9784.01  194.640  491.108   4.8878  489.693   4.8761 1.415100 6.904085 
1 1 1   10    5    0 f  207.297   2.0249  1751.75   34.217  1811.98   44.961  1668.86   52.744  210.818   2.6164  202.305   3.1984 8.512360 4.132208 
1 1 1   10    5    1 o  133.224   1.7956  723.488   19.500  706.417   24.798  751.146   31.565  131.636   2.3110  135.731   2.8529 -4.094955 3.671501 
1 1 1   10    5    2 o  325.338   3.0065  4315.70   79.732  4373.23   92.920  4155.10  155.264  327.476   3.4809  319.036   5.9703 8.440308 6.910960 
1 1 1   10    5    3 o  248.153   2.0318  2510.30   41.100  2497.26   58.066  2523.40   58.181  247.484   2.8783  248.776   2.8691 -1.292160 4.064019 
1 1 1   10    5    4 o  138.417   1.6189  780.974   18.267  756.539   25.631  806.192   26.039  136.226   2.3082  140.626   2.2716 -4.399918 3.238497 
1 1 1   10    5    5 o  200.728   1.8009  1642.44   29.467  1625.11   50.833  1651.20   36.163  199.637   3.1237  201.256   2.2043 -1.618698 3.823180 
1 1 1   10    5    6 f  103.804   1.7659  439.234   14.942  464.987   24.190  423.345   19.001  106.756   2.7821  101.904   2.2874 4.851929 3.601707 
1 1 1   10    5    7 o  380.308   2.5703  5896.73   79.680  5894.23  121.881  5898.60  105.298  380.149   3.9332  380.325   3.3965 -0.1759949 5.196750 
1 1 1   10    5    8 o  550.523   3.5467 12359.89  159.161 12316.29  242.613 12392.83  210.882  549.333   5.4180  551.132   4.6941 -1.799683 7.168633 
1 1 1   10    5    9 o  139.639   1.6309  794.828   18.564  809.016   33.052  788.289   22.437  140.861   2.8785  139.059   1.9794 1.801590 3.493419 
1 1 1   10    5   10 o  246.806   1.8772  2483.09   37.765  2493.74   58.086  2475.30   49.705  247.306   2.8814  246.403   2.4747 0.9030762 3.798200 
1 1 1   10    5   11 o  407.292   3.2175  6764.56  106.821  6723.85  168.463  6791.94  138.144  405.909   5.0914  408.046   4.1532 -2.137115 6.570553 
1 1 1   10    5   12 o  136.559   1.6075  760.162   17.894  743.283   31.212  768.425   21.839  135.016   2.8360  137.296   1.9514 -2.279160 3.442475 
1 1 1   10    5   13 o   17.073   4.9619   12.120   7.3152   18.865   11.857   7.9748   9.2951   21.363   6.3466   15.540   5.6601 5.822883 8.503918 
1 1 1   10    5   14 o  213.392   1.7269  1856.23   30.038  1865.59   46.313  1849.43   39.465  213.907   2.6561  212.989   2.2731 0.9177704 3.495993 
1 1 1   10    5   15 o  286.803   2.0704  3353.31   48.404  3390.77   74.749  3326.26   63.521  288.356   3.1801  285.620   2.7283 2.735992 4.190069 
1 1 1   10    5   16 o  148.826   1.5136  902.858   18.363  933.925   28.787  881.544   23.844  151.352   2.3333  147.052   1.9892 4.299728 3.066092 
1 1 1   10    5   17 o  248.229   2.0352  2511.96   41.182  2560.47   59.124  2466.25   57.394  250.585   2.8945  245.932   2.8630 4.652618 4.071194 
1 1 1   10    5   18 o   73.149   1.9562  218.290   11.654  219.963   15.316  215.990   17.960   73.405   2.5636   72.714   3.0368 0.6904907 3.974193 
1 1 1   10    5   19 o   76.065   1.9229  236.018   11.913  234.990   15.771  237.383   18.179   75.874   2.5536   76.241   2.9305 -0.3674698 3.887049 
1 1 1   10    5   20 o  174.510   1.8675  1241.48   26.565  1256.94   34.820  1219.96   41.092  175.580   2.4329  172.964   2.9145 2.615814 3.796480 
1 1 1   10    5   21 o  354.445   3.2041  5123.75   92.575  5088.89  130.477  5159.08  131.370  353.123   4.5328  355.550   4.5327 -2.427094 6.410327 
1 1 1   10    5   22 o  383.422   3.0595  5995.51   95.624  5855.17  148.633  6094.62  124.905  378.737   4.8144  386.498   3.9646 -7.760925 6.236699 
1 1 1   10    5   23 o  330.039   3.0303  4442.31   81.525  4573.45  166.709  4401.09   93.463  334.556   6.1130  328.471   3.4907 6.084167 7.039424 
1 1 1   10    5   24 f  215.224   2.2829  1888.63   40.051  1885.85   79.999  1889.56   46.267  214.948   4.5658  215.264   2.6367 -0.3158875 5.272446 
1 1 1   10    5   25 o  265.076   2.3236  2864.96   50.207  2808.78   78.762  2903.42   65.162  262.386   3.6825  266.815   2.9960 -4.428314 4.747315 
1 1 1   10    5   26 o  236.825   2.1614  2286.73   41.726  2340.44   67.319  2253.22   53.171  239.525   3.4479  235.057   2.7750 4.468262 4.425912 
1 1 1   10    5   27 o   60.400   1.9565  148.888   9.6201  143.457   14.178  153.521   13.096   59.234   2.9456   61.301   2.6269 -2.066360 3.946812 
1 1 1   10    5   28 o  144.923   1.6295  856.203   19.250  860.157   27.692  852.506   26.779  145.241   2.3390  144.595   2.2720 0.6456146 3.260779 
1 1 1   10    5   29 o  241.496   2.1947  2377.95   43.204  2377.67   68.743  2378.14   55.545  241.407   3.4933  241.474   2.8219 -0.6710815E-01 4.490724 
1 1 1   10    5   30 o  218.471   2.0750  1946.06   36.953  1957.02   58.992  1938.99   47.406  219.022   3.3042  218.047   2.6671 0.9750214 4.246339 
1 1 1   10    5   31 o  213.748   2.0526  1862.83   35.764  1929.12   58.199  1822.62   45.334  217.453   3.2833  211.402   2.6307 6.050674 4.207268 
1 1 1   10    5   32 o   63.184   2.0785  162.953   10.691  173.856   17.893  156.900   13.332   65.190   3.3788   61.969   2.6454 3.221134 4.291165 
1 1 1   10    5   33 o   36.400   2.9937   54.413   8.8042   49.924   14.700   56.924   10.994   34.541   5.3975   37.167   3.6770 -2.625523 6.530904 
1 1 1   10    5   34 o  141.900   1.7740  820.933   20.519  799.802   32.542  834.880   26.437  140.027   2.8510  143.086   2.2667 -3.058899 3.642206 
1 1 1   10    5   35 o  158.646   1.8201  1026.15   23.538  1063.76   38.348  1003.42   29.815  161.484   2.9133  156.862   2.3317 4.622498 3.731481 
1 1 1   10    5   36 o  186.748   2.1840  1422.11   33.246  1428.12   46.973  1416.08   47.062  187.096   3.0800  186.305   3.0989 0.7911682 4.369141 
1 1 1   10    5   37 o  186.616   1.9282  1419.97   29.331  1400.86   46.514  1432.58   37.793  185.299   3.0794  187.419   2.4738 -2.120132 3.949999 
1 1 1   10    5   38 o  172.850   1.8728  1218.19   26.388  1197.68   41.919  1231.65   33.960  171.338   3.0014  173.781   2.3974 -2.443939 3.841328 
1 1 1   10    5   39 o  199.737   1.9833  1626.72   32.291  1640.88   51.756  1617.70   41.319  200.536   3.1662  199.154   2.5452 1.382050 4.062378 
1 1 1   10    5   40 o   9.1592   4.2645  -7.2432   7.7450   0.7909   13.216 -11.4452   9.5581   14.993   6.3234   9.6576   4.5713 5.335833 7.802752 
1 1 1   10    5   41 o  172.214   2.3846  1209.57   33.475  1224.68   60.596  1202.94   40.158  173.158   4.2930  171.716   2.8690 1.441589 5.163450 
1 1 1   10    5   42 o  123.224   2.2080  619.229   22.179  649.126   41.818  607.527   26.161  126.010   4.0765  122.039   2.6298 3.970543 4.851158 
1 1 1   10    5   43 f   78.811   2.3257  253.537   14.924  233.085   27.982  261.668   17.644   75.389   4.5749   80.044   2.7080 -4.655342 5.316284 
1 1 1   10    5   44 o  319.620   2.9703  4168.25   77.386  4358.02  161.401  4111.61   88.184  326.242   6.0692  317.385   3.4085 8.857208 6.960797 
1 1 1   10    5   45 o  229.083   2.1357  2140.15   39.881  2036.24   62.074  2213.18   52.043  223.352   3.4094  232.915   2.7411 -9.563248 4.374707 
1 1 1   10    5   46 o  150.375   1.7941  922.017   21.991  959.506   36.027  899.753   27.764  153.350   2.8821  148.528   2.2932 4.822052 3.683048 
1 1 1   10    5   47 o   61.234   2.4772  153.200   12.339  170.624   17.491  135.936   17.410   64.569   3.3345   57.578   3.7295 6.990276 5.002770 
1 1 1   10    5   48 o   12.404   5.2828  -0.1300   9.3771  -0.2676   12.602   0.0407   14.036   14.344   6.1171   15.224   6.4727 -0.8799858 8.905917 
1 1 1   10    5   49 o   80.907   2.0543  267.122   13.537  260.825   17.936  275.459   20.636   79.907   2.7577   82.097   3.0891 -2.190689 4.141007 
1 1 1   10    5   50 o   49.813   2.2493  101.412   9.1098  102.367   14.714  100.818   11.600   49.937   3.6397   49.623   2.8802 0.3143845 4.641470 
1 1 1   10    5   51 o  205.602   1.8727  1723.79   31.385  1734.22   45.747  1714.51   43.138  206.164   2.7221  205.001   2.5815 1.163391 3.751543 
1 1 1   10    5   52 o   70.035   1.8860  200.165   10.757  212.636   17.336  192.357   13.717   72.122   2.9550   68.624   2.4562 3.497864 3.842519 
1 1 1   10    5   53 o   95.862   1.6981  374.711   13.269  388.830   20.589  364.680   17.354   97.589   2.5905   94.555   2.2516 3.034065 3.432270 
1 1 1   10    5   54 o   84.172   1.7708  288.907   12.150  280.201   18.941  294.994   15.838   82.815   2.8098   85.009   2.2876 -2.193863 3.623331 
1 1 1   10    5   55 o   98.332   1.8047  394.303   14.465  417.531   24.552  381.953   17.902  101.097   2.9826   96.765   2.2696 4.331589 3.747916 
1 1 1   10    5   56 o   71.904   2.0186  211.032   11.819  244.791   21.035  195.457   14.288   77.353   3.3440   69.166   2.5385 8.187233 4.198368 
1 1 1   10    5   57 o  180.913   1.9651  1334.88   28.980  1281.32   45.870  1370.46   37.387  177.149   3.1765  183.269   2.5026 -6.120193 4.043911 
1 1 1   10    5   58 o   76.851   2.5243  241.257   15.792  229.640   21.946  253.732   22.741   74.886   3.6058   78.730   3.5526 -3.844032 5.061885 
1 1 1   10    5   59 o  155.811   1.9116  990.146   24.279  1020.26   40.252  972.922   30.440  158.072   3.1239  154.418   2.4183 3.654419 3.950582 
1 1 1   10    5   60 o  214.741   2.7116  1882.08   47.466   0.0000   0.0000  1882.08   47.466  ?   ?   214.741   2.7116 0.000000 2.711639 
1 1 1   10    5   61 o  149.879   2.1288  916.380   26.008  940.903   59.698  910.636   28.894  151.514   4.8398  149.393   2.3727 2.121765 5.390113 
1 1 1   10    5   62 o  127.881   1.8625  667.009   19.415  630.304   32.643  687.101   24.151  124.182   3.2275  129.770   2.2831 -5.587524 3.953415 
1 1 1   10    5   63 o   69.970   1.9328  199.856   11.013  188.428   17.961  206.742   13.942   67.837   3.2576   71.136   2.4078 -3.298569 4.050869 
1 1 1   10    5   64 o   81.772   1.7834  272.733   11.887  247.503   15.846  305.202   17.977   77.830   2.5010   86.432   2.5543 -8.601440 3.574820 
1 1 1   10    5   65 o   79.460   1.7600  257.532   11.400  259.787   15.653  254.985   16.636   79.744   2.4108   78.988   2.5873 0.7552338 3.536360 
1 1 1   10    5   66 o   54.364   2.0861  120.770   9.2272  124.408   13.296  117.391   12.815   55.105   2.9711   53.526   2.9486 1.578876 4.185848 
1 1 1   10    5   67 o  103.037   1.5573  432.990   13.080  425.570   18.345  440.664   18.655  102.116   2.2039  103.911   2.2024 -1.795158 3.115725 
1 1 1   10    5   68 o   62.232   1.8080  158.127   9.1618  145.645   13.539  168.671   12.444   59.647   2.7923   64.234   2.3807 -4.587502 3.669392 
1 1 1   10    5   69 o   68.008   1.7242  188.800   9.5505  196.579   14.267  182.482   12.856   69.336   2.5284   66.814   2.3642 2.521652 3.461598 
1 1 1   10    5   70 o   58.920   1.6474  141.726   7.9042  149.924   13.438  137.390   9.7737   60.516   2.7312   57.983   2.0712 2.533516 3.427749 
1 1 1   10    5   71 o  108.430   1.3711  479.495   12.118  493.901   19.515  470.453   15.460  109.992   2.1766  107.380   1.7663 2.612755 2.803093 
1 1 1   10    5   72 o   98.437   1.3719  395.203   11.009  396.514   17.972  394.416   13.927   98.545   2.2373   98.319   1.7378 0.2257843 2.832901 
1 1 1   10    5   73 o  136.115   1.6551  755.909   18.364  799.866   28.293  723.906   24.141  139.927   2.4805  133.147   2.2243 6.779572 3.331701 
1 1 1   10    5   74 o   41.176   2.9830   69.709   9.9444   68.784   12.095   71.640   17.470   40.808   3.6753   41.368   5.3027 -0.5593109 6.451890 
1 1 1   10    5   75 o  208.814   2.1403  1780.62   36.432  1726.65   46.361  1867.77   58.908  205.491   2.7677  213.552   3.3841 -8.061478 4.371748 
1 1 1   10    5   76 o  142.883   1.9110  833.460   22.258  849.534   28.793  809.591   35.087  144.177   2.4499  140.640   3.0605 3.537262 3.920324 
1 1 1   10    5   77 o   51.957   2.7821  110.751   11.740  106.247   12.905  132.372   28.273   50.841   3.1291   56.123   6.2881 -5.282055 7.023661 
1 1 1   10    5   78 o  122.964   1.9564  617.478   19.609  618.980   21.785  611.065   45.016  123.085   2.1713  121.711   4.5453 1.373360 5.037285 
1 1 1   10    5   79 o   75.458   2.1695  232.870   13.330  232.668   15.463  233.457   26.304   75.380   2.5201   75.173   4.3107 0.2063675 4.993339 
1 1 1   10    5   80 o  121.569   1.7245  603.441   17.089  605.411   22.197  600.575   26.778  121.692   2.2377  121.118   2.7122 0.5732727 3.516165 
1 1 1   10    5   81 o   31.014   3.8863   40.191   9.6099   42.719   12.283   36.201   15.430   31.773   4.8999   28.828   6.6948 2.944794 8.296340 
1 1 1   10    5   82 o  160.372   1.8310  1050.75   23.936  1047.79   33.486  1053.85   34.226  159.962   2.5681  160.410   2.6176 -0.4474792 3.666967 
1 1 1   10    5   83 o   68.897   2.1302  194.323   11.949  167.244   16.475  224.379   17.357   63.734   3.1812   73.907   2.8866 -10.17266 4.295650 
1 1 1   10    5   84 o   37.106   3.2045   57.006   9.5978   63.527   13.495   50.333   13.653   38.951   4.3231   34.448   5.0087 4.502277 6.616401 
1 1 1   10    5   85 o  112.690   1.6171  518.812   14.855  516.224   19.421  522.461   23.060  112.312   2.1214  112.897   2.5057 -0.5853806 3.283132 
1 1 1   10    5   86 o   45.153   2.4042   83.804   8.8171   84.956   11.590   82.222   13.584   45.325   3.1568   44.445   3.7855 0.8795547 4.929030 
1 1 1   10    5   87 o   44.349   2.3863   80.887   8.5949   86.440   11.306   73.284   13.229   45.724   3.0510   41.882   3.9204 3.841610 4.967719 
1 1 1   10    5   88 o   81.266   1.7238  270.115   11.419  281.477   15.023  254.567   17.573   82.830   2.2270   78.633   2.7458 4.197052 3.535425 
1 1 1   10    5   89 o   55.274   2.0904  125.396   9.4017  119.604   12.237  133.742   14.688   53.831   2.7983   56.829   3.1835 -2.998459 4.238578 
1 1 1   10    5   90 o   49.047   2.2219   98.920   8.8602   97.406   11.474  101.154   13.944   48.516   2.9149   49.283   3.4936 -0.7676926 4.549892 
1 1 1   10    5   91 o   80.681   1.7036  266.478   11.204  270.935   14.711  260.323   17.290   81.197   2.2248   79.445   2.6736 1.752258 3.478204 
1 1 1   10    5   92 o   61.872   1.9167  157.115   9.6552  144.958   12.623  174.258   14.989   59.247   2.6202   64.898   2.8402 -5.650639 3.864229 
1 1 1   10    5   93 o   51.455   2.1288  108.954   8.9095  107.393   11.834  110.996   13.537   50.887   2.8644   51.615   3.2337 -0.7282753 4.319943 
1 1 1   10    5   94 f   21.369   5.0878   20.241   8.7345   16.747   13.309   22.884   11.576   19.905   6.8150   22.526   6.1383 -2.620382 9.171844 
1 1 1   10    5   95 f   15.692   5.2242   10.206   7.8204  -0.8857   10.916   21.901   11.209   12.768   5.5693   22.014   6.0571 -9.245749 8.228296 
1 1 1   10    5   96 o   36.832   2.6719   56.415   7.9673   51.469   10.544   62.998   12.164   34.825   3.7745   38.504   3.9308 -3.679317 5.449564 
1 1 1   10    5   97 f   15.176   4.9755   9.6763   7.1024  -1.0798   9.4035   23.962   10.837   11.765   5.1496   22.961   5.7915 -11.19616 7.749884 
1 1 1   10    5   98 o   10.832   4.5813   0.9281   6.9692   0.4864   9.2291   1.5143   10.631   12.120   5.2031   13.230   5.6294 -1.110641 7.665710 
1 1 1   10    5   99 o   21.118   4.3166   19.640   7.1796   16.453   9.4188   24.059   11.092   19.110   5.6514   22.890   5.9057 -3.779379 8.174079 
1 1 1   10    5  100 o   46.371   2.3319   89.101   8.7860   79.814   10.807  107.210   15.090   43.622   3.0585   50.269   3.7087 -6.646740 4.807141 
1 1 1   10    5  101 o   41.011   3.2077   70.883   10.638   70.883   10.638   0.0000   0.0000   41.011   3.2077  ?   ?  0.000000 3.207720 
1 1 1   10    5  102 o   45.067   2.3940   84.395   8.7634   82.080   10.839   88.763   14.891   44.192   3.0273   45.427   4.0642 -1.234791 5.067768 
1 1 1   10    5  103 o   49.591   2.1383  101.840   8.6236   96.204   11.271  109.797   13.393   47.880   2.9014   50.985   3.2393 -3.104656 4.348701 
1 1 1   10    5  104 o   21.247   4.3981   20.202   7.3663   14.575   9.5878   28.309   11.508   17.916   5.7742   24.562   5.8348 -6.646305 8.208920 
1 1 1   10    5  105 o   40.402   2.5215   68.302   8.2630   57.426   10.708   84.310   12.991   36.515   3.6462   44.313   3.6283 -7.798073 5.143900 
1 1 1   10    5  106 f   27.979   3.4422   33.796   7.6855   27.975   9.9530   42.392   12.095   24.612   5.1276   30.493   5.0422 -5.881262 7.191367 
1 1 1   10    5  107 o   30.378   3.4188   39.871   8.3190   44.631   11.473   34.595   12.080   31.476   4.6081   27.000   5.6694 4.476536 7.305957 
1 1 1   10    5  108 o   38.616   3.1598   63.864   9.8595   57.425   12.323   75.318   16.436   35.886   4.2981   40.489   5.0924 -4.603008 6.663776 
1 1 1   10    5  109 o   12.649   5.2042   4.0795   8.6358   6.5619   10.588  -0.8541   14.926   14.336   5.8138   13.992   6.2840 0.3437099 8.560908 
1 1 1   10    5  110 o   28.941   3.6842   36.956   8.4945   35.348   11.390   38.972   12.752   27.231   5.3219   28.316   5.7216 -1.084906 7.814085 
1 1 1   10    5  111 o   12.429   4.9518   5.0348   7.5364   9.4787   9.8395  -1.2722   11.722   15.049   5.7535   12.373   5.5620 2.675613 8.002382 
1 1 1   10    5  112 f   47.168   2.7346   94.899   10.469  102.463   15.655   88.780   14.081   47.776   4.0581   44.598   3.9130 3.177628 5.637322 
1 1 1   10    5  113 o   22.762   4.5925   24.395   8.2269   29.427   10.972   17.933   12.434   24.259   5.6536   18.597   6.5735 5.662077 8.670321 
1 1 1   10    5  114 o   26.030   4.0947   30.973   8.4015   37.697   11.030   21.682   12.966   28.061   5.0058   20.041   6.7278 8.020485 8.385740 
1 1 1   10    5  115 o   34.754   3.3597   53.153   9.3992   43.881   12.844   63.842   13.791   29.826   5.4850   36.897   4.6914 -7.070330 7.217619 
1 1 1   10    5  116 o   24.345   5.3196   29.380   10.261   24.451   12.638   38.916   17.578   21.117   6.6086   25.425   7.7666 -4.308748 10.19777 
1 1 1   10    5  117 o   45.213   3.7847   91.850   13.821   83.895   19.626   99.676   19.466   40.344   6.1631   45.050   5.4089 -4.705738 8.199975 
1 1 1   10    5  118 o   19.572   6.0890   20.390   10.745   19.001   13.530   22.761   17.681   18.619   6.8214   19.665   7.6605 -1.046604 10.25739 
1 1 1   10    5  119 o   11.311   5.1472  -1.9661   10.412   7.1074   13.286 -16.4098   16.762   14.685   6.2722   11.672   5.6604 3.013009 8.448667 
1 1 1   10    5  120 o   12.614   5.6609   0.6156   12.088  -1.6545   13.824   7.9877   24.913   12.774   5.8577   16.954   7.8072 -4.180508 9.760337 
1 1 1   10    5  121 o   11.660   5.3859  -3.4124   11.987 -10.5693   17.161   3.4056   16.750   12.484   5.9698   14.616   6.6024 -2.132128 8.901131 
1 1 1   10    5  122 f   11.354   5.2924  -4.7906   11.982  -8.6958   16.796  -0.7437   17.098   12.574   5.9829   13.898   6.4242 -1.324430 8.778666 
1 1 1   10    5  123 o   13.806   5.9315   5.7441   12.011  -3.6738   16.599   16.094   17.401   13.232   6.1879   17.428   7.2971 -4.196292 9.567540 
1 1 1   10    5  124 o   19.292   6.5136   21.039   12.153   36.396   17.439   6.5380   16.946   23.783   7.7964   15.185   6.7667 8.597421 10.32332 
1 1 1   10    5  125 o   17.026   7.8841   9.0666   25.925   0.0000   0.0000   9.0666   25.925  ?   ?    17.026   7.8841 0.000000 7.884084 
1 1 1   10    6 -123 o   17.925   8.3010   14.309   28.750   0.0000   0.0000   14.309   28.750  ?   ?    17.925   8.3010 0.000000 8.301049 
1 1 1   10    6 -122 o   10.651   5.0592  -8.3202   11.908 -21.6049   16.297   6.8956   17.442   10.792   5.3067   15.325   6.8444 -4.532993 8.660634 
1 1 1   10    6 -121 o   13.771   6.0771   4.2420   13.345  -2.0468   20.588   8.7992   17.526   14.508   6.8184   15.722   6.9503 -1.214762 9.736393 
1 1 1   10    6 -120 o   20.858   7.0881   26.089   14.393   42.868   22.917   15.159   18.495   23.969   8.8612   17.286   7.3923 6.683142 11.53979 
1 1 1   10    6 -119 o   18.102   6.2945   17.850   11.370   20.265   14.884   14.465   17.620   18.730   7.0962   17.130   7.2665 1.599617 10.15670 
1 1 1   10    6 -118 o   13.017   5.5457   4.5762   10.340   3.5711   12.960   6.3370   17.153   13.605   5.9971   15.309   6.8158 -1.704280 9.078528 
1 1 1   10    6 -117 o   11.494   5.1836  -0.8692   10.275  -2.4598   12.893   1.8995   17.010   12.267   5.6371   14.460   6.5801 -2.193102 8.664558 
1 1 1   10    6 -116 o   9.2787   4.4660 -10.9838   9.9618  -6.6046   12.554 -18.4289   16.369   11.366   5.3364   11.297   5.5047 0.6876850E-01 7.666735 
1 1 1   10    6 -115 o   19.040   5.6334   18.667   9.3571   17.779   11.187   20.737   17.072   18.307   6.2486   19.110   7.5030 -0.8028431 9.764168 
1 1 1   10    6 -114 o   15.074   5.5712   10.552   9.0577   6.1371   10.794   21.061   16.653   13.796   5.7597   19.291   7.4565 -5.494972 9.421927 
1 1 1   10    6 -113 o   19.397   5.6426   19.195   9.4559   10.718   11.256   39.520   17.431   15.550   6.0962   25.786   7.7035 -10.23600 9.823813 
1 1 1   10    6 -112 o   21.498   5.3646   22.985   9.3702   19.890   11.050   30.905   17.679   19.485   6.1905   22.676   7.8507 -3.191071 9.997813 
1 1 1   10    6 -111 o   28.481   4.1043   36.987   9.2539   30.017   10.908   54.890   17.481   24.530   5.5811   31.984   6.9075 -7.453510 8.880415 
1 1 1   10    6 -110 o   10.610   4.7812  -1.8544   8.7235  -2.6313   10.284   0.1391   16.473   11.267   5.1226   14.379   6.5163 -3.112661 8.288762 
1 1 1   10    6 -109 o   12.213   5.2208   2.5007   9.2190   3.6197   10.030  -3.5928   23.405   12.934   5.4842   15.830   7.3845 -2.895694 9.198267 
1 1 1   10    6 -108 o   13.031   5.2631   5.3157   8.6368  -1.0619   10.202   21.449   16.226   11.722   5.2349   20.188   7.4576 -8.466164 9.111497 
1 1 1   10    6 -107 o   30.511   3.7014   40.962   9.0178   44.002   10.661   33.318   16.906   31.254   4.2984   24.668   7.6316 6.585775 8.758852 
1 1 1   10    6 -106 o   18.654   5.6513   16.732   9.3329   10.210   10.245   48.559   22.630   15.660   5.8976   28.844   8.8127 -13.18391 10.60396 
1 1 1   10    6 -105 o   28.484   3.5541   35.334   8.0733   50.589   11.992   22.690   10.918   33.560   4.4968   21.558   5.9957 12.00157 7.494620 
1 1 1   10    6 -104 o   7.6831   3.7325 -11.5776   7.3746 -15.1869   10.917  -8.5485   10.001   9.4935   4.5953   10.073   4.7398 -0.5791416 6.601676 
1 1 1   10    6 -103 o   36.098   2.5519   54.661   7.4607   51.928   10.919   57.054   10.218   34.509   3.9528   36.449   3.4814 -1.940281 5.267346 
1 1 1   10    6 -102 o   18.065   4.4120   14.726   6.4400   16.689   10.116   13.388   8.3506   18.947   5.9103   17.175   5.3716 1.771322 7.986585 
1 1 1   10    6 -101 o   18.896   4.3877   16.022   6.6285   27.118   10.616   8.9327   8.4857   24.215   5.5037   14.960   5.4139 9.255489 7.720154 
1 1 1   10    6 -100 o   17.423   4.5134   13.614   6.4609   21.601   10.111   8.1041   8.3991   21.593   5.6724   14.585   5.3694 7.007109 7.810670 
1 1 1   10    6  -99 o   30.682   2.8285   39.557   6.9946   36.000   10.532   42.364   9.3556   28.527   4.6924   31.427   3.7244 -2.900166 5.990777 
1 1 1   10    6  -98 o   14.245   4.7427   8.4830   6.4453   12.945   10.087   5.4040   8.3791   17.375   5.9332   13.428   5.2611 3.947043 7.929844 
1 1 1   10    6  -97 o   16.749   4.6432   12.455   6.5593   16.319   10.090   9.6279   8.6321   19.043   5.8965   15.484   5.4767 3.559713 8.047583 
1 1 1   10    6  -96 o   33.439   2.6111   46.618   7.0610   39.395   10.722   52.148   9.3829   30.051   4.5166   35.147   3.3141 -5.095959 5.602075 
1 1 1   10    6  -95 o   43.752   2.1532   79.067   7.6557   77.425   11.799   80.261   10.061   42.873   3.4040   43.874   2.8283 -1.000561 4.425669 
1 1 1   10    6  -94 o   17.146   4.6452   12.987   6.6521   22.761   10.406   6.2326   8.6506   22.411   5.6875   13.997   5.3837 8.414558 7.831411 
1 1 1   10    6  -93 f   24.233   3.5405   25.042   6.7874   37.665   10.652   16.413   8.8068   29.447   4.5870   19.188   5.4026 10.25920 7.087193 
1 1 1   10    6  -92 o   26.916   3.1456   30.490   6.7717   31.824   10.615   29.575   8.7934   26.899   5.0259   26.167   4.2696 0.7320023 6.594659 
1 1 1   10    6  -91 o   28.282   3.2316   33.637   7.3166   36.128   12.172   32.228   9.1549   28.595   5.4205   27.377   4.2392 1.217539 6.881361 
1 1 1   10    6  -90 o   50.790   2.0478  106.083   8.4609   96.089   13.883  111.988   10.672   47.892   3.5822   52.069   2.5218 -4.176075 4.380819 
1 1 1   10    6  -89 f   14.539   4.9792   8.3529   7.1050 -21.3621   12.038   24.239   8.8016   9.5876   4.6823   23.570   4.7455 -13.98200 6.666641 
1 1 1   10    6  -88 o   59.383   1.7829  144.547   8.6205  130.236   12.696  156.789   11.742   56.132   2.7834   61.725   2.3380 -5.592415 3.635035 
1 1 1   10    6  -87 o   18.491   4.8421   14.912   7.3833   26.457   12.532   8.7743   9.1374   24.366   6.2727   15.522   5.6179 8.843888 8.420639 
1 1 1   10    6  -86 o   60.188   2.0381  148.605   9.9848  138.254   18.673  152.751   11.816   57.518   4.0076   60.951   2.3828 -3.432762 4.662519 
1 1 1   10    6  -85 o   63.223   2.3728  164.232   12.207  170.833   19.269  159.808   15.775   64.117   3.7026   62.181   3.1223 1.936184 4.843353 
1 1 1   10    6  -84 o   61.510   2.6228  155.641   13.120  148.986   19.295  161.364   17.894   59.820   3.9796   62.402   3.5323 -2.582455 5.321095 
1 1 1   10    6  -83 o   61.346   2.6308  154.727   13.125  169.605   19.003  141.156   18.149   63.979   3.6590   58.298   3.8405 5.680218 5.304482 
1 1 1   10    6  -82 o   75.861   1.9645  235.547   12.138  246.412   14.978  214.755   20.718   77.518   2.3731   72.089   3.5365 5.428535 4.258929 
1 1 1   10    6  -81 o   56.685   2.3085  131.770   10.644  125.085   13.120  144.645   18.208   55.122   2.9304   59.094   3.8000 -3.972366 4.798692 
1 1 1   10    6  -80 o  102.037   1.8149  425.434   15.096  412.707   18.436  451.325   26.295  100.429   2.2520  104.799   3.0814 -4.369499 3.816669 
1 1 1   10    6  -79 o   54.090   2.4358  119.997   10.712  120.991   13.170  118.054   18.416   54.228   2.9909   53.302   4.2742 0.9254799 5.216752 
1 1 1   10    6  -78 o  111.676   1.8250  509.455   16.613  517.036   20.465  494.801   28.451  112.441   2.2328  109.761   3.1832 2.679909 3.888234 
1 1 1   10    6  -77 o   63.743   2.4329  166.458   12.618  170.849   15.686  158.405   21.240   64.496   2.9917   61.855   4.2382 2.640953 5.187737 
1 1 1   10    6  -76 o   86.954   2.1932  309.221   15.533  297.237   19.939  327.722   24.774   85.146   2.8770   89.306   3.4094 -4.160240 4.461049 
1 1 1   10    6  -75 o   73.924   2.1216  223.451   12.771  225.029   15.619  220.269   22.185   74.127   2.5889   73.148   3.7330 0.9784546 4.542856 
1 1 1   10    6  -74 o   30.290   3.7190   38.208   8.9902   37.394   11.944   39.271   13.656   29.689   5.1200   30.314   5.7364 -0.6248283 7.689020 
1 1 1   10    6  -73 o   82.896   1.8467  280.524   12.478  286.638   16.098  271.319   19.752   83.719   2.3612   81.366   2.9831 2.353172 3.804491 
1 1 1   10    6  -72 o   43.762   2.6490   78.581   9.4052   71.331   12.134   89.489   14.885   41.560   3.6179   46.532   3.9620 -4.971336 5.365293 
1 1 1   10    6  -71 o   92.172   1.7694  346.714   13.294  348.214   16.951  344.318   21.426   92.334   2.2522   91.711   2.8696 0.6226578 3.647835 
1 1 1   10    6  -70 o   80.265   1.7506  262.892   11.454  264.128   15.689  261.482   16.760   80.375   2.3973   79.952   2.5749 0.4232941 3.518177 
1 1 1   10    6  -69 o   63.166   1.9734  163.017   10.148  161.503   13.890  164.751   14.863   62.803   2.7197   63.415   2.8829 -0.6116829 3.963316 
1 1 1   10    6  -68 o   33.960   3.0977   47.555   8.4809   65.855   11.822   28.153   12.173   39.934   3.6729   25.617   5.9447 14.31703 6.987779 
1 1 1   10    6  -67 o   51.428   2.4323  108.256   10.168  104.731   13.031  113.743   16.257   50.505   3.1813   52.560   3.8206 -2.054729 4.971732 
1 1 1   10    6  -66 o  117.301   1.7254  561.337   16.498  547.865   20.623  585.287   27.497  115.851   2.1838  119.681   2.8185 -3.830261 3.565523 
1 1 1   10    6  -65 o   42.272   2.8175   73.327   9.6531   81.306   12.676   62.312   14.894   44.442   3.5280   38.670   4.8299 5.771618 5.981160 
1 1 1   10    6  -64 o  211.444   1.9323  1824.17   33.305  1813.74   41.144  1843.98   56.722  210.778   2.3947  212.375   3.2765 -1.596985 4.058316 
1 1 1   10    6  -63 o  120.595   1.5122  593.119   14.866  585.450   21.174  600.572   20.875  119.773   2.1688  121.315   2.1110 -1.541084 3.026514 
1 1 1   10    6  -62 o   61.777   1.6898  155.781   8.5015  143.184   13.960  163.207   10.718   59.134   2.9049   63.209   2.0831 -4.075005 3.574591 
1 1 1   10    6  -61 o   32.388   2.6349   43.110   6.8964   42.694   12.347   43.298   8.3142   31.907   4.9041   32.397   3.1896 -0.4902668 5.850099 
1 1 1   10    6  -60 f  141.113   1.5577  812.067   17.918  835.715   25.034  787.228   25.657  143.116   2.1459  138.894   2.2661 4.222443 3.120943 
1 1 1   10    6  -59 f  150.733   1.5922  926.557   19.564  935.085   27.067  917.228   28.309  151.387   2.1934  149.925   2.3164 1.461792 3.190082 
1 1 1   10    6  -58 o  136.639   1.4766  761.300   16.447  762.453   24.665  760.378   22.070  136.703   2.2134  136.531   1.9830 0.1722107 2.971835 
1 1 1   10    6  -57 o  174.046   1.7770  1235.41   25.210  1261.53   37.886  1214.66   33.773  175.808   2.6436  172.533   2.4014 3.275040 3.571486 
1 1 1   10    6  -56 o  126.902   1.5994  656.687   16.545  677.855   27.639  644.866   20.654  128.877   2.6309  125.737   2.0152 3.140564 3.313998 
1 1 1   10    6  -55 o   99.327   1.9039  402.384   15.415  446.511   22.296  361.972   21.337  104.600   2.6149   94.130   2.7838 10.47024 3.819328 
1 1 1   10    6  -54 o   90.398   1.5063  333.205   11.100  350.197   16.085  317.758   15.337   92.654   2.1297   88.259   2.1317 4.395653 3.013296 
1 1 1   10    6  -53 o   70.649   1.5903  203.527   9.1587  208.299   13.199  199.097   12.719   71.420   2.2701   69.825   2.2375 1.594910 3.187448 
1 1 1   10    6  -52 o   97.807   1.4540  390.041   11.592  381.930   16.993  397.101   15.854   96.764   2.1544   98.673   1.9711 -1.909660 2.920007 
1 1 1   10    6  -51 o  182.186   1.5397  1353.35   22.866  1399.98   33.610  1313.17   31.199  185.257   2.2256  179.427   2.1331 5.829514 3.082776 
1 1 1   10    6  -50 o  146.918   1.3613  880.017   16.303  888.386   22.560  870.869   23.585  147.595   1.8751  146.128   1.9800 1.467270 2.726997 
1 1 1   10    6  -49 o   68.200   1.7512  189.790   9.7272  162.248   17.091  202.986   11.830   62.949   3.3427   70.518   2.0603 -7.568520 3.926607 
1 1 1   10    6  -48 o  119.861   1.3944  585.727   13.624  571.806   19.937  597.922   18.660  118.407   2.0656  121.087   1.8905 -2.680374 2.800125 
1 1 1   10    6  -47 o   62.930   1.6132  161.579   8.2684  182.424   12.857  146.877   10.797   66.832   2.3637   59.968   2.2127 6.863972 3.237761 
1 1 1   10    6  -46 o  173.467   1.7420  1226.98   24.632  1256.45   35.411  1199.35   34.286  175.498   2.4753  171.465   2.4530 4.032761 3.484903 
1 1 1   10    6  -45 o  161.029   1.7297  1057.32   22.705  1031.81   27.387  1113.39   40.602  159.058   2.1123  165.171   3.0156 -6.112579 3.681807 
1 1 1   10    6  -44 o  121.358   1.5220  600.466   15.056  582.228   19.858  625.128   23.091  119.485   2.0388  123.799   2.2882 -4.314186 3.064729 
1 1 1   10    6  -43 o   42.187   2.0208   72.745   6.9291   68.319   10.744   75.897   9.0667   40.782   3.2589   43.055   2.5955 -2.272293 4.166166 
1 1 1   10    6  -42 o  162.346   1.4498  1074.52   19.186  1081.56   27.842  1068.15   26.475  162.852   2.0974  161.843   2.0068 1.009186 2.902826 
1 1 1   10    6  -41 o  133.963   1.3893  731.625   15.171  690.523   21.534  772.121   21.375  130.127   2.0302  137.605   1.9056 -7.478302 2.784428 
1 1 1   10    6  -40 o  134.467   1.3957  737.137   15.298  696.315   21.844  776.435   21.432  130.671   2.0507  137.989   1.9054 -7.318329 2.799283 
1 1 1   10    6  -39 o   99.292   1.5514  401.949   12.557  392.187   21.999  406.666   15.292   98.007   2.7563   99.866   1.8785 -1.858414 3.335608 
1 1 1   10    6  -38 o  257.700   2.0736  2708.16   43.559  2648.83   74.547  2738.91   53.676  254.723   3.5903  259.124   2.5412 -4.401047 4.398591 
1 1 1   10    6  -37 o   51.015   2.1605  106.323   8.9641   90.875   14.438  116.015   11.435   47.025   3.7988   53.264   2.6420 -6.239166 4.627180 
1 1 1   10    6  -36 o  374.795   2.9975  5731.52   91.577  5497.86  140.536  5903.96  120.729  366.782   4.7005  380.247   3.8950 -13.46552 6.104567 
1 1 1   10    6  -35 o   44.250   2.3504   80.084   8.4477   89.106   14.091   75.023   10.555   46.569   3.7435   42.772   3.0473 3.797291 4.826971 
1 1 1   10    6  -34 o  108.378   1.5960  478.872   14.099  506.719   21.554  458.043   18.641  111.465   2.3722  105.982   2.1578 5.482803 3.206747 
1 1 1   10    6  -33 f  284.689   1.9384  3304.73   44.984  3365.90   65.059  3248.69   62.266  287.247   2.7785  282.207   2.7068 5.039459 3.879015 
1 1 1   10    6  -32 o  328.966   2.1522  4413.02   57.711  4415.14   82.161  4410.97   81.082  328.957   3.0640  328.806   3.0252 0.1510010 4.305785 
1 1 1   10    6  -31 o  390.151   2.4627  6208.20   78.321  6331.52  112.982  6094.11  108.668  393.868   3.5190  386.424   3.4499 7.444366 4.927981 
1 1 1   10    6  -30 o   68.908   1.5665  193.582   8.7990  176.021   12.841  209.126   12.081   65.653   2.4035   71.584   2.0726 -5.931519 3.173692 
1 1 1   10    6  -29 o  125.064   1.3922  637.618   14.193  663.909   21.040  615.668   19.225  127.601   2.0228  122.881   1.9193 4.720512 2.788470 
1 1 1   10    6  -28 o  229.762   1.8096  2152.34   33.893  2010.06   50.297  2270.69   45.871  221.985   2.7796  235.964   2.3848 -13.97824 3.662454 
1 1 1   10    6  -27 o  211.876   1.8808  1830.32   32.484  1874.20   59.245  1811.45   38.843  214.312   3.3913  210.764   2.2609 3.548477 4.075856 
1 1 1   10    6  -26 o  113.237   1.6274  522.754   15.021  472.830   28.033  542.864   17.791  107.605   3.1995  115.389   1.8915 -7.783714 3.716779 
1 1 1   10    6  -25 o  240.820   2.0163  2364.65   39.581  2478.64   72.879  2316.97   47.138  246.445   3.6278  238.358   2.4261 8.086655 4.364307 
1 1 1   10    6  -24 o  165.747   1.5692  1119.96   21.201  1135.96   33.523  1109.30   27.370  166.898   2.4641  164.943   2.0357 1.954422 3.196182 
1 1 1   10    6  -23 o  362.499   2.4814  5358.86   73.321  5493.17  114.878  5266.54   95.244  366.863   3.8415  359.287   3.2521 7.576080 5.033168 
1 1 1   10    6  -22 o  275.250   2.0254  3089.06   45.444  3106.70   70.515  3076.53   59.432  275.962   3.1347  274.654   2.6546 1.308075 4.107690 
1 1 1   10    6  -21 f  158.970   1.5534  1030.22   20.129  1046.12   31.833  1019.63   25.983  160.166   2.4382  158.139   2.0157 2.027298 3.163506 
1 1 1   10    6  -20 o  173.644   1.5938  1229.21   22.560  1207.04   35.088  1244.83   29.454  172.043   2.5020  174.731   2.0680 -2.687790 3.246003 
1 1 1   10    6  -19 f   23.827   3.8389   23.755   7.2028   26.075   12.195   22.512   8.9262   24.765   6.0852   23.043   4.9029 1.722109 7.814639 
1 1 1   10    6  -18 o  204.667   1.7079  1707.68   28.494  1722.33   44.686  1697.65   36.990  205.506   2.6675  204.047   2.2239 1.459473 3.472971 
1 1 1   10    6  -17 o  358.623   2.6547  5244.87   77.604  5148.70  133.505  5293.95   95.371  355.111   4.6121  360.244   3.2478 -5.133789 5.640851 
1 1 1   10    6  -16 o  109.757   1.6026  491.088   14.338  507.138   26.510  484.451   17.047  111.471   2.9200  109.008   1.9184 2.463158 3.493834 
1 1 1   10    6  -15 o  264.250   2.3074  2847.21   49.701  2971.89  113.683  2817.75   55.262  269.744   5.1702  262.866   2.5790 6.878418 5.777774 
1 1 1   10    6  -14 o   65.728   1.9721  176.289   10.554  153.497   22.514  182.709   11.949   61.151   4.5493   66.906   2.1939 -5.754242 5.050638 
1 1 1   10    6  -13 o  215.979   2.0447  1901.82   35.998  1864.29   78.676  1911.76   40.484  213.705   4.5164  216.534   2.2936 -2.828934 5.065425 
1 1 1   10    6  -12 o   68.638   1.7965  192.195   10.043  171.320   17.473  202.495   12.273   64.722   3.3230   70.442   2.1398 -5.719795 3.952338 
1 1 1   10    6  -11 o   70.090   1.7980  200.404   10.264  212.388   18.457  195.038   12.350   72.092   3.1484   69.129   2.1944 2.963326 3.837637 
1 1 1   10    6  -10 o  250.864   1.8961  2565.64   38.773  2519.20   58.636  2601.72   51.686  248.540   2.8942  252.597   2.5102 -4.056686 3.831142 
1 1 1   10    6   -9 o  125.708   1.4774  644.169   15.139  680.843   23.582  618.455   19.746  129.224   2.2387  123.166   1.9667 6.057762 2.979897 
1 1 1   10    6   -8 o  221.711   1.7615  2003.90   31.836  2070.88   49.637  1957.10   41.495  225.352   2.7021  219.089   2.3235 6.263107 3.563715 
1 1 1   10    6   -7 o  148.436   1.7917  898.225   21.679  914.745   28.190  874.309   33.917  149.784   2.3088  146.422   2.8417 3.362061 3.661381 
1 1 1   10    6   -6 o   20.832   4.7615   18.426   7.9087   11.505   11.096   25.572   11.276   17.817   6.2167   24.531   5.7411 -6.713476 8.462104 
1 1 1   10    6   -5 o   50.866   2.3859  105.725   9.8652  104.472   12.826  107.541   15.438   50.515   3.1301   51.208   3.7239 -0.6926231 4.864635 
1 1 1   10    6   -4 o  135.953   1.9728  753.532   21.863  794.315   31.875  717.301   30.044  139.565   2.8018  132.627   2.7790 6.937775 3.946258 
1 1 1   10    6   -3 o  232.647   2.1403  2206.66   40.590  2253.37   65.378  2177.36   51.778  235.040   3.4123  231.074   2.7489 3.966125 4.381810 
1 1 1   10    6   -2 f  180.951   1.7324  1334.79   25.553  1346.14   36.448  1323.83   35.834  181.699   2.4608  180.188   2.4397 1.511566 3.465226 
1 1 1   10    6   -1 f   59.870   1.9751  146.287   9.6260  136.150   13.775  155.961   13.457   57.706   2.9382   61.786   2.6782 -4.080811 3.975644 
1 1 1   10    6    0 f  156.518   1.6501  998.649   21.053  1029.69   30.368  969.928   29.213  158.916   2.3443  154.237   2.3236 4.679703 3.300717 
1 1 1   10    6    1 f  120.842   1.5972  595.277   15.733  613.388   22.808  578.837   21.731  122.656   2.2812  119.152   2.2374 3.503738 3.195316 
1 1 1   10    6    2 f   72.166   1.9576  212.471   11.505  213.336   15.148  211.292   17.687   72.286   2.5749   71.915   3.0239 0.3711472 3.971689 
1 1 1   10    6    3 o  255.364   2.0730  2658.59   43.151  2682.00   61.324  2635.62   60.730  256.448   2.9336  254.221   2.9306 2.226929 4.146580 
1 1 1   10    6    4 o  155.643   1.5321  987.492   19.438  975.719   29.579  996.441   25.789  154.696   2.3457  156.337   2.0236 -1.641525 3.097960 
1 1 1   10    6    5 o  237.315   1.8349  2295.93   35.495  2251.03   53.569  2331.07   47.393  234.947   2.7971  239.104   2.4316 -4.156586 3.706251 
1 1 1   10    6    6 o  229.043   1.9467  2138.72   36.345  2132.01   51.285  2145.48   51.515  228.654   2.7516  229.374   2.7552 -0.7209015 3.893854 
1 1 1   10    6    7 o  228.309   2.1278  2125.15   39.600  2130.27   51.150  2117.48   62.563  228.560   2.7454  227.842   3.3686 0.7178040 4.345670 
1 1 1   10    6    8 o  197.504   2.2152  1590.41   35.664  1658.83   42.130  1417.41   66.991  201.696   2.5625  186.357   4.4100 15.33849 5.100409 
1 1 1   10    6    9 o  164.141   2.0677  1098.43   27.666  1089.95   31.807  1124.76   56.075  163.498   2.3866  166.020   4.1436 -2.521683 4.781730 
1 1 1   10    6   10 o  284.902   2.4455  3309.68   56.794  3375.90   74.372  3217.04   87.966  287.695   3.1713  280.797   3.8432 6.898560 4.982674 
1 1 1   10    6   11 o  175.251   1.7122  1252.06   24.459  1268.07   34.923  1236.63   34.268  176.350   2.4294  174.150   2.4139 2.199600 3.424773 
1 1 1   10    6   12 o  266.499   2.1301  2895.65   46.273  2907.20   65.818  2884.36   65.068  266.984   3.0243  265.934   3.0017 1.049286 4.261008 
1 1 1   10    6   13 o  251.921   1.9030  2587.34   39.080  2585.07   59.799  2589.03   51.630  251.763   2.9138  251.977   2.5137 -0.2138824 3.848242 
1 1 1   10    6   14 o  136.397   1.9564  758.479   21.752   0.0000   0.0000  758.479   21.752  ?   ?   136.397   1.9564 0.000000 1.956391 
1 1 1   10    6   15 o   81.547   1.6974  271.097   11.283  280.010   20.164  267.033   13.614   82.803   2.9923   80.903   2.0661 1.900192 3.636242 
1 1 1   10    6   16 o  186.663   2.4892  1420.83   37.875   0.0000   0.0000  1420.83   37.875  ?   ?   186.663   2.4892 0.000000 2.489171 
1 1 1   10    6   17 o  277.802   2.1891  3146.65   49.573  3185.79   86.901  3127.77   60.357  279.411   3.8154  276.940   2.6736 2.471466 4.658968 
1 1 1   10    6   18 o  266.047   2.1282  2885.95   46.154  2907.89   80.696  2875.29   56.265  266.952   3.7084  265.530   2.5995 1.421967 4.528733 
1 1 1   10    6   19 f   99.144   1.5161  400.707   12.253  404.127   19.164  398.342   15.935   99.552   2.3616   98.844   1.9777 0.7079773 3.080336 
1 1 1   10    6   20 o  156.671   1.5401  1000.64   19.669  1019.75   30.699  987.324   25.617  158.137   2.3815  155.614   2.0195 2.523590 3.122506 
1 1 1   10    6   21 f  251.710   1.9082  2583.15   39.154  2631.64   60.830  2548.86   51.160  254.003   2.9379  250.003   2.5104 4.000427 3.864419 
1 1 1   10    6   22 o  264.634   1.9687  2855.31   42.468  2879.71   65.523  2837.65   55.766  265.697   3.0253  263.779   2.5936 1.917969 3.984861 
1 1 1   10    6   23 o   38.369   2.5008   60.294   7.7789   54.473   12.642   63.840   9.8682   36.266   4.3641   39.438   3.0944 -3.172352 5.349847 
1 1 1   10    6   24 o  184.415   1.6251  1386.46   24.430  1433.68   38.417  1354.41   31.655  187.495   2.5136  182.253   2.1307 5.241455 3.295182 
1 1 1   10    6   25 o  111.477   1.4913  506.605   13.552  513.796   21.262  501.685   17.587  112.247   2.3238  110.925   1.9450 1.321922 3.030369 
1 1 1   10    6   26 o  245.206   1.8774  2451.45   37.525  2410.03   57.039  2483.05   49.827  243.067   2.8788  246.749   2.4773 -3.681747 3.797922 
1 1 1   10    6   27 o  259.135   1.9424  2737.96   41.031  2683.32   62.205  2780.04   54.590  256.469   2.9755  261.081   2.5651 -4.612122 3.928512 
1 1 1   10    6   28 o  203.771   2.0086  1693.07   33.363  1711.49   53.609  1681.43   42.623  204.809   3.2111  203.041   2.5753 1.767548 4.116183 
1 1 1   10    6   29 o  118.747   1.9589  574.951   18.962  552.576   27.176  596.175   26.469  116.386   2.8645  120.897   2.6859 -4.510818 3.926770 
1 1 1   10    6   30 o  192.113   1.9574  1504.88   30.653  1511.90   49.126  1500.40   39.226  192.497   3.1308  191.801   2.5089 0.6963501 4.012021 
1 1 1   10    6   31 o   99.890   1.7676  406.818   14.393  416.518   23.538  401.025   18.189  101.005   2.8617   99.165   2.2502 1.839348 3.640447 
1 1 1   10    6   32 o   63.212   1.9030  163.071   9.7944  165.307   14.399  161.145   13.362   63.597   2.7842   62.800   2.6159 0.7967758 3.820326 
1 1 1   10    6   33 f   54.863   2.0819  122.917   9.2936  126.566   14.098  120.112   12.359   55.607   3.1228   54.189   2.8075 1.417782 4.199263 
1 1 1   10    6   34 o   82.211   2.0541  275.603   13.765  290.905   29.678  271.409   15.538   84.280   4.3344   81.544   2.3400 2.736496 4.925688 
1 1 1   10    6   35 o  200.965   2.5552  1647.35   41.859  1651.66   74.534  1645.37   50.591  201.058   4.5478  200.808   3.0907 0.2500305 5.498600 
1 1 1   10    6   36 o   59.620   2.6723  145.293   12.954  131.255   25.015  150.438   15.143   56.378   5.5136   60.641   3.0734 -4.263527 6.312341 
1 1 1   10    6   37 o   25.258   5.1516   27.034   10.247   52.754   21.516   19.490   11.653   35.171   7.7172   21.599   6.2583 13.57261 9.935874 
1 1 1   10    6   38 o  147.358   1.7992  885.391   21.611  869.511   34.458  895.688   27.747  145.983   2.8957  148.194   2.2970 -2.210556 3.696068 
1 1 1   10    6   39 o  148.824   1.7976  903.093   21.807  935.923   35.663  883.489   27.559  151.455   2.8887  147.180   2.2971 4.274475 3.690677 
1 1 1   10    6   40 o   94.464   1.7944  363.851   13.818  330.805   22.211  384.714   17.648   89.986   3.0324   97.123   2.2292 -7.137512 3.763588 
1 1 1   10    6   41 o  416.933   3.2955  7095.28  112.002  7159.05  178.867  7054.14  143.651  418.336   5.2453  415.524   4.2411 2.812195 6.745344 
1 1 1   10    6   42 o  266.231   2.3472  2891.01   50.939  2868.16   80.743  2906.11   65.653  265.024   3.7375  266.860   3.0181 -1.836304 4.803956 
1 1 1   10    6   43 o  204.378   2.0190  1703.42   33.636  1694.97   53.776  1708.85   43.110  203.779   3.2374  204.666   2.5840 -0.8866119 4.142196 
1 1 1   10    6   44 o   99.692   1.7867  405.248   14.519  397.371   23.812  409.911   18.319   98.634   2.9650  100.250   2.2417 -1.616318 3.717016 
1 1 1   10    6   45 o  172.831   1.8898  1218.08   26.625  1214.31   42.794  1220.47   34.008  172.492   3.0435  172.972   2.4120 -0.4805450 3.883382 
1 1 1   10    6   46 o  160.518   1.8572  1050.70   24.301  1032.01   39.045  1062.51   31.047  159.018   3.0122  161.392   2.3599 -2.374741 3.826576 
1 1 1   10    6   47 o  252.066   2.2754  2591.66   46.753  2567.62   74.353  2607.38   60.126  250.740   3.6378  252.765   2.9182 -2.024811 4.663622 
1 1 1   10    6   48 o  129.105   1.6870  679.647   17.753  688.303   26.963  673.022   23.588  129.887   2.5466  128.452   2.2528 1.435791 3.400066 
1 1 1   10    6   49 o  138.725   1.7013  784.730   19.239  811.989   29.424  764.374   25.427  141.073   2.5587  136.889   2.2787 4.183899 3.426304 
1 1 1   10    6   50 o  140.455   1.9395  804.539   22.205  801.354   29.430  808.749   33.834  140.143   2.5762  140.764   2.9486 -0.6213074 3.915527 
1 1 1   10    6   51 o  214.744   2.1733  1881.04   38.043  1893.45   49.777  1863.60   58.992  215.391   2.8351  213.623   3.3877 1.767349 4.417500 
1 1 1   10    6   52 o   60.498   2.7277  149.669   13.417  159.713   18.089  137.383   20.005   62.428   3.5695   57.809   4.2756 4.618809 5.569727 
1 1 1   10    6   53 o   90.362   1.8581  333.003   13.686  329.149   21.491  335.633   17.751   89.747   2.9416   90.667   2.4040 -0.9201126 3.798984 
1 1 1   10    6   54 o   50.572   2.6811  104.671   11.013  132.325   20.342   93.205   13.098   56.702   4.4364   47.649   3.3945 9.053513 5.586058 
1 1 1   10    6   55 o  188.569   2.4146  1450.87   37.116  1502.02   54.764  1407.42   50.477  191.747   3.5037  185.631   3.3359 6.116241 4.837777 
1 1 1   10    6   56 o  109.852   1.9557  492.201   17.513  514.549   31.689  482.374   21.013  112.177   3.4697  108.731   2.3709 3.445457 4.202353 
1 1 1   10    6   57 o  107.949   1.9599  475.312   17.246  470.304   30.271  477.719   20.984  107.235   3.4676  108.202   2.3791 -0.9673309 4.205284 
1 1 1   10    6   58 o   92.282   1.9707  347.372   14.825  310.117   20.924  384.918   21.006   87.099   2.9514   97.072   2.6572 -9.973366 3.971341 
1 1 1   10    6   59 f  122.551   1.8628  612.603   18.609  636.195   26.448  589.470   26.189  124.843   2.5989  120.165   2.6736 4.677208 3.728608 
1 1 1   10    6   60 f   36.442   3.2389   54.686   9.5214   40.571   15.325   63.561   12.151   30.856   6.3059   39.235   3.8489 -8.379244 7.387678 
1 1 1   10    6   61 o  138.502   1.8683  782.524   21.093  823.333   37.097  763.025   25.642  141.947   3.2061  136.735   2.3006 5.212326 3.946083 
1 1 1   10    6   62 o  125.871   1.6928  646.233   17.369  640.940   26.238  650.362   23.174  125.293   2.5690  126.236   2.2520 -0.9431305 3.416324 
1 1 1   10    6   63 o  101.059   1.7323  416.599   14.271  397.130   22.066  430.597   18.711   98.570   2.7489  102.715   2.2347 -4.145126 3.542640 
1 1 1   10    6   64 o   88.591   1.6421  320.126   11.858  314.457   17.015  325.480   16.536   87.733   2.3814   89.268   2.2743 -1.534714 3.292917 
1 1 1   10    6   65 o   92.373   1.6260  348.052   12.243  333.690   17.543  361.687   17.094   90.374   2.3835   94.132   2.2278 -3.757629 3.262515 
1 1 1   10    6   66 o   67.190   1.8883  184.354   10.332  191.891   14.804  177.197   14.426   68.487   2.6568   65.805   2.6950 2.682045 3.784428 
1 1 1   10    6   67 o  107.011   1.5699  467.124   13.694  458.313   19.435  475.811   19.299  105.950   2.2504  107.959   2.1930 -2.008362 3.142210 
1 1 1   10    6   68 o   74.862   1.6905  228.655   10.316  217.735   15.305  237.748   13.966   72.958   2.5775   76.273   2.2487 -3.315369 3.420594 
1 1 1   10    6   69 o   45.397   2.1436   84.326   7.9098   99.494   13.110   75.645   9.9186   49.200   3.2877   42.922   2.8511 6.277710 4.351759 
1 1 1   10    6   70 o  102.498   1.5514  428.593   12.962  427.578   18.632  429.546   18.044  102.324   2.2338  102.566   2.1583 -0.2419205 3.106152 
1 1 1   10    6   71 o  136.746   1.6643  763.026   18.552  751.328   23.908  780.728   29.410  135.640   2.1623  138.207   2.6106 -2.566879 3.389789 
1 1 1   10    6   72 o  104.024   1.4452  441.440   12.254  434.440   18.772  446.638   16.177  103.130   2.2330  104.599   1.8972 -1.469795 2.930126 
1 1 1   10    6   73 o   44.454   2.2375   80.935   8.0818   72.857   14.783   84.378   9.6519   41.866   4.3973   45.352   2.6220 -3.485909 5.119739 
1 1 1   10    6   74 o  142.316   1.9725  827.103   22.883  827.833   29.742  826.044   35.822  142.283   2.5644  142.022   3.0942 0.2604523 4.018741 
1 1 1   10    6   75 o  105.660   1.8351  455.841   15.806  447.645   19.376  472.138   27.324  104.656   2.2713  107.303   3.1273 -2.647377 3.865027 
1 1 1   10    6   76 o   66.486   2.2894  180.925   12.389  166.398   15.103  210.809   21.663   63.673   2.9176   71.536   3.7278 -7.863556 4.733819 
1 1 1   10    6   77 o   51.800   3.0441  110.367   12.797  133.700   17.092   80.606   19.304   56.913   3.7044   43.725   5.5401 13.18801 6.664436 
1 1 1   10    6   78 o   67.817   2.6777  188.647   14.774  170.770   20.785  206.902   21.003   64.265   3.9873   70.839   3.6496 -6.574020 5.405349 
1 1 1   10    6   79 o   38.159   3.5507   60.393   10.918   53.111   14.069   71.419   17.311   35.447   5.0083   41.129   5.2855 -5.682190 7.281435 
1 1 1   10    6   80 o   41.361   2.9028   70.519   9.7246   69.925   11.837   71.753   17.056   41.066   3.5715   41.224   5.1905 -0.1578255 6.300579 
1 1 1   10    6   81 o   30.401   3.7447   38.671   9.0841   35.994   11.160   43.928   15.639   29.053   4.8855   31.798   6.2566 -2.745333 7.938019 
1 1 1   10    6   82 o   37.096   3.1060   56.973   9.3060   55.841   11.461   59.163   15.944   36.559   3.9063   37.244   5.4097 -0.6856918 6.672620 
1 1 1   10    6   83 o   56.771   2.1782  132.177   10.061  122.092   12.710  149.105   16.467   54.432   2.8747   60.049   3.3777 -5.617077 4.435400 
1 1 1   10    6   84 o   68.572   1.9370  192.583   10.816  176.915   13.877  216.840   17.267   65.592   2.6005   72.544   2.9259 -6.952690 3.914528 
1 1 1   10    6   85 o   82.081   1.7838  275.637   11.935  270.406   15.536  283.171   18.645   81.152   2.3510   82.932   2.7619 -1.779648 3.627017 
1 1 1   10    6   86 o   32.992   3.1745   45.338   8.4321   49.322   10.924   39.465   13.262   34.221   3.9911   30.078   5.6157 4.142208 6.889480 
1 1 1   10    6   87 o   25.827   3.9732   28.381   8.0969   32.781   10.503   21.935   12.713   27.543   4.8553   22.290   6.5588 5.253283 8.160389 
1 1 1   10    6   88 o   39.126   2.9326   63.545   9.2850   74.209   12.960   52.300   13.308   42.045   3.8233   34.926   4.8016 7.119282 6.137817 
1 1 1   10    6   89 f   29.006   3.7802   35.638   8.7253   27.531   12.177   44.192   12.509   24.785   6.0751   31.959   4.9625 -7.174133 7.844326 
1 1 1   10    6   90 o   74.749   1.9340  229.378   11.774  214.491   16.208  246.010   17.132   72.010   2.7664   77.141   2.7288 -5.131599 3.885792 
1 1 1   10    6   91 o   50.450   2.2153  104.881   9.0880   98.628   11.909  113.598   14.062   48.693   3.0152   52.160   3.3246 -3.466995 4.488276 
1 1 1   10    6   92 o   30.727   3.2676   39.708   8.0591   28.073   10.498   56.403   12.575   25.137   5.2913   36.302   4.3352 -11.16485 6.840446 
1 1 1   10    6   93 f   12.254   4.8871   3.6970   7.3488   5.9624   9.5364   0.3850   11.531   14.309   5.6108   13.438   5.7929 0.8714333 8.064657 
1 1 1   10    6   94 o   13.608   5.0203   6.6162   7.3493   15.062   9.6767  -4.8964   11.297   18.484   5.7826   11.919   5.3993 6.565675 7.911449 
1 1 1   10    6   95 o   48.976   2.3879   99.316   9.5042  109.221   11.706   80.158   16.280   51.212   2.8150   43.003   4.7219 8.208824 5.497283 
1 1 1   10    6   96 o   15.681   5.4420   10.060   8.4969   11.611   10.876   7.6293   13.612   17.019   6.1332   16.434   6.6180 0.5849285 9.022946 
1 1 1   10    6   97 o   26.167   4.2794   29.875   8.8127   32.744   11.399   25.612   13.893   26.956   5.3766   23.332   6.8542 3.623653 8.711322 
1 1 1   10    6   98 o   60.770   2.1016  152.496   10.395  155.754   14.439  148.991   14.976   61.056   2.9097   59.618   3.0922 1.437614 4.245924 
1 1 1   10    6   99 o   36.707   2.9186   56.589   8.6612   43.071   11.877   71.944   12.658   31.188   4.8274   41.001   3.8318 -9.812828 6.163263 
1 1 1   10    6  100 o   36.156   2.9985   55.078   8.7580   65.793   12.280   43.985   12.494   39.115   3.9035   31.347   5.0620 7.767643 6.392236 
1 1 1   10    6  101 o   33.100   2.9766   46.282   7.9458   47.130   10.271   45.019   12.539   33.004   3.8927   31.661   5.0261 1.343504 6.357284 
1 1 1   10    6  102 o   17.716   5.2317   14.372   8.0765   20.133   9.6746   1.1250   14.670   20.741   5.5946   14.719   6.4376 6.021819 8.528944 
1 1 1   10    6  103 o   39.916   2.8568   67.239   9.2336   62.802   11.042   77.554   16.836   38.195   3.5887   41.427   5.0928 -3.231762 6.230166 
1 1 1   10    6  104 o   13.013   5.1544   5.2672   8.1204   7.3502   9.7907   0.6757   14.536   14.520   5.6876   14.387   6.3461 0.1329737 8.521856 
1 1 1   10    6  105 o   33.815   2.9513   48.700   8.0534   49.354   10.529   47.779   12.502   33.502   3.9301   32.335   4.8961 1.167248 6.278374 
1 1 1   10    6  106 o   33.268   3.0713   47.429   8.2348   44.511   10.704   51.662   12.890   31.521   4.2761   33.582   4.8489 -2.061115 6.465093 
1 1 1   10    6  107 o   24.434   4.1194   26.899   7.9133   27.123   10.346   26.582   12.283   23.734   5.4615   22.909   6.3551 0.8248749 8.379459 
1 1 1   10    6  108 o   8.4998   4.0303  -7.4237   7.4923  -1.6377   9.8722 -15.2831   11.506   11.398   5.1154   9.6792   4.6929 1.718353 6.941950 
1 1 1   10    6  109 o   35.985   2.9085   55.616   8.4588   62.017   11.354   47.631   12.681   37.378   3.7783   31.716   5.0760 5.661949 6.327855 
1 1 1   10    6  110 o   30.888   3.4241   41.991   8.4768   31.441   11.272   55.722   12.860   25.145   5.6389   34.598   4.6798 -9.453047 7.327891 
1 1 1   10    6  111 o   27.247   4.2135   34.080   9.0567   16.553   12.775   51.791   12.842   18.006   6.6230   33.068   4.9132 -15.06260 8.246413 
1 1 1   10    6  112 o   12.466   5.1978   4.1340   8.7743   9.4817   12.199  -1.5976   12.629   15.368   6.2376   12.528   5.6886 2.839897 8.441998 
1 1 1   10    6  113 o   8.3322   4.0492 -12.3049   8.6986 -14.1440   10.349  -7.8778   16.056   9.0605   4.4062   12.691   5.9822 -3.630353 7.429757 
1 1 1   10    6  114 o   20.562   5.4761   21.443   9.3418   19.934   11.071   25.175   17.407   19.354   6.2017   20.537   7.6975 -1.183228 9.884903 
1 1 1   10    6  115 o   37.133   3.3832   60.997   10.128   60.325   12.078   62.590   18.593   36.217   4.1670   33.692   6.9988 2.524418 8.145378 
1 1 1   10    6  116 o   19.426   6.8849   21.273   13.647   24.009   17.036   16.370   22.802   20.032   7.5913   18.231   7.9983 1.800463 11.02729 
1 1 1   10    6  117 o   14.193   6.0178   6.5940   12.075   25.109   17.057 -12.0095   17.097   20.280   7.6156   12.317   5.9082 7.962744 9.638699 
1 1 1   10    6  118 o   11.297   5.2527  -4.6023   11.690  -9.5190   16.279   0.6337   16.799   12.330   5.8734   14.124   6.4696 -1.794030 8.738002 
1 1 1   10    6  119 o   16.863   6.4525   14.832   12.383   2.4549   17.169   28.248   17.875   14.503   6.6039   20.979   7.8128 -6.475376 10.22991 
1 1 1   10    6  120 o   8.3619   4.1709 -24.2659   11.495 -26.1705   16.247 -22.3566   16.267   10.338   5.1232   10.718   5.2765 -0.3794146 7.354517 
1 1 1   10    6  121 o   12.315   5.5644   0.1137   11.905  -9.3853   16.518   10.383   17.175   12.331   5.8858   16.008   6.9841 -3.676715 9.133454 
1 1 1   10    6  122 o   18.062   6.9379   18.556   14.353  -3.1851   17.083   70.744   26.466   13.435   6.2809   30.463   9.5680 -17.02828 11.44541 
1 1 1   10    6  123 o   16.229   7.6652   2.4988   26.605   0.0000   0.0000   2.4988   26.605  ?   ?    16.229   7.6652 0.000000 7.665172 
1 1 1   10    7 -120 o   10.047   4.7591  -7.4486   10.395  -3.0750   12.757 -16.0887   17.930   11.965   5.5371   11.968   5.8156 -0.3265381E-02 8.030004 
1 1 1   10    7 -119 o   28.102   5.0817   39.273   11.212   45.381   13.826   27.539   19.164   29.235   6.0028   20.327   7.9586 8.908571 9.968633 
1 1 1   10    7 -118 o   17.977   6.0776   17.595   10.581   15.408   12.999   21.891   18.215   16.964   6.5793   18.872   7.6356 -1.908522 10.07921 
1 1 1   10    7 -117 o   17.998   6.2539   17.708   11.223   26.080   14.971   6.9656   16.958   20.716   7.2215   15.278   6.7908 5.438326 9.912900 
1 1 1   10    7 -116 f   13.822   5.8199   6.4375   11.167   13.349   14.958  -2.2634   16.783   16.581   6.8385   13.574   6.3056 3.007037 9.301871 
1 1 1   10    7 -115 o   13.357   5.9730   2.0436   13.328   7.4677   23.077  -0.6709   16.325   16.554   7.5825   13.749   6.3271 2.804703 9.875583 
1 1 1   10    7 -114 o   14.529   6.0983   7.6045   12.199   0.7307   17.512   14.085   17.004   14.389   6.5963   17.123   7.1942 -2.734099 9.760513 
1 1 1   10    7 -113 o   13.017   5.7569   2.1478   12.038   31.561   17.342 -25.2014   16.723   22.514   7.7766   10.724   5.2928 11.79031 9.406860 
1 1 1   10    7 -112 o   35.270   4.6896   58.937   13.149   64.733   19.127   53.744   18.106   34.109   7.1101   30.646   7.3438 3.462982 10.22181 
1 1 1   10    7 -111 o   14.359   5.7522   8.2114   10.227   6.2709   12.785   11.658   17.040   14.432   6.1583   16.738   7.1247 -2.305395 9.417316 
1 1 1   10    7 -110 o   10.141   4.6750  -4.0008   8.9686   0.7079   10.608 -15.7994   16.792   12.178   5.3942   11.885   5.7397 0.2931337 7.876630 
1 1 1   10    7 -109 o   27.948   4.3830   36.227   9.6573   35.936   11.504   36.922   17.773   27.009   5.4139   24.817   7.8468 2.192005 9.533269 
1 1 1   10    7 -108 o   8.0743   3.9593 -14.8996   8.8724 -13.7532   10.564 -17.6438   16.345   9.2777   4.4979   11.547   5.5973 -2.269528 7.180618 
1 1 1   10    7 -107 o   10.385   4.7421  -3.1925   8.9341  -9.3956   10.670   11.357   16.341   10.078   4.7875   16.878   7.0693 -6.800119 8.537895 
1 1 1   10    7 -106 f   18.814   5.8910   17.719   10.040   20.463   12.470   12.662   16.931   19.835   6.5966   17.473   7.2473 2.362122 9.799912 
1 1 1   10    7 -105 f   13.989   5.3997   7.5244   8.7242   8.4030   10.337   5.3486   16.266   14.821   5.8325   15.672   6.8176 -0.8501711 8.972003 
1 1 1   10    7 -104 o   13.098   5.1671   5.7917   8.1309   8.9819   11.538   2.6442   11.460   15.454   6.1366   13.407   5.7775 2.046480 8.428363 
1 1 1   10    7 -103 o   17.224   5.0651   13.904   7.5836   11.684   10.119   16.748   11.455   16.272   5.9087   18.630   6.3235 -2.357327 8.654429 
1 1 1   10    7 -102 o   12.228   4.7480   4.9647   6.7751   8.1525   10.224   2.4692   9.0462   14.913   5.8207   12.348   5.2209 2.565243 7.819108 
1 1 1   10    7 -101 o   9.8410   4.3079  -0.5558   6.5824   3.0515   10.097  -3.2225   8.6809   13.113   5.5285   10.458   4.7356 2.655702 7.279472 
1 1 1   10    7 -100 o   48.962   2.0280   99.374   8.0765   95.074   12.079  102.851   10.862   47.333   3.1484   49.493   2.7025 -2.160179 4.149234 
1 1 1   10    7  -99 o   14.441   4.9738   8.7554   7.0925   5.7394   10.220   11.557   9.8508   14.208   5.7299   16.472   5.8482 -2.263616 8.187408 
1 1 1   10    7  -98 o   17.961   5.0890   14.689   7.7890   18.092   10.301   10.143   11.903   19.724   5.9288   16.479   6.3211 3.244865 8.666417 
1 1 1   10    7  -97 o   39.889   2.5603   66.404   8.2809   74.347   11.572   58.068   11.855   41.843   3.4227   36.658   4.0339 5.184727 5.290259 
1 1 1   10    7  -96 o   20.152   4.6151   18.191   7.4174   25.228   10.459   11.070   10.521   23.436   5.5593   16.583   6.0244 6.853477 8.197518 
1 1 1   10    7  -95 o   13.869   4.9976   7.3809   7.2213   8.2324   9.9682   6.4404   10.476   15.260   5.8014   14.753   5.8508 0.5068388 8.239407 
1 1 1   10    7  -94 o   44.543   2.1700   82.052   7.8552   77.110   11.341   86.610   10.891   42.782   3.2768   45.490   2.9530 -2.708130 4.411083 
1 1 1   10    7  -93 o   39.212   2.3721   63.780   7.5466   56.207   10.913   70.720   10.447   36.328   3.7387   41.033   3.1474 -4.704712 4.887085 
1 1 1   10    7  -92 o   57.970   1.8434  138.223   8.7000  135.199   12.822  140.803   11.843   57.008   2.7675   58.289   2.4984 -1.280834 3.728432 
1 1 1   10    7  -91 o   21.860   4.1310   20.826   7.0916   22.817   10.302   19.033   9.7770   22.441   5.6391   20.527   5.6604 1.914135 7.989919 
1 1 1   10    7  -90 o   15.645   4.9117   10.487   6.9753   8.3974   10.087   12.402   9.6563   15.519   5.8503   17.192   5.8061 -1.673118 8.242343 
1 1 1   10    7  -89 f   44.420   2.2547   81.450   8.1373   79.901   11.950   82.789   11.112   43.652   3.3847   44.545   3.0792 -0.8927002 4.575750 
1 1 1   10    7  -88 o   26.776   3.4184   30.316   7.2911   34.338   10.534   26.617   10.102   28.085   4.7719   24.512   5.2161 3.572447 7.069569 
1 1 1   10    7  -87 o   12.090   4.8615   3.2333   7.3337   0.5363   10.220   6.0967   10.530   12.827   5.4903   14.885   5.8777 -2.057905 8.043051 
1 1 1   10    7  -86 o   21.355   4.4876   19.881   7.5632   16.712   10.779   22.955   10.615   19.593   6.0991   22.685   5.7374 -3.092209 8.373563 
1 1 1   10    7  -85 o   17.126   5.2422   12.565   8.0029   17.304   12.348   9.1326   10.509   20.116   6.5585   16.139   5.9942 3.976334 8.885039 
1 1 1   10    7  -84 o   46.037   2.4542   87.371   9.1764   91.201   13.873   84.391   12.235   46.717   3.6726   45.021   3.3582 1.696236 4.976503 
1 1 1   10    7  -83 o   47.753   2.4070   93.890   9.3390  106.986   14.170   83.832   12.418   50.722   3.4475   44.880   3.4201 5.842640 4.856201 
1 1 1   10    7  -82 o   48.986   2.2342   98.609   8.8980   94.726   12.574  102.504   12.594   47.792   3.2468   49.756   3.1208 -1.963573 4.503440 
1 1 1   10    7  -81 o   65.372   1.8905  175.034   10.064  170.288   14.038  180.051   14.434   64.319   2.6835   66.141   2.6827 -1.821259 3.794476 
1 1 1   10    7  -80 o   24.463   4.5738   25.684   8.7853   45.801   15.486   16.137   10.668   32.424   6.0825   19.516   6.0664 12.90801 8.590596 
1 1 1   10    7  -79 o   67.827   2.1350  188.521   11.789  200.192   20.446  182.708   14.430   69.552   3.6188   66.673   2.6604 2.879028 4.491510 
1 1 1   10    7  -78 o   48.759   2.6401   97.783   10.454   91.259   17.890  101.166   12.882   46.616   4.7754   49.492   3.2105 -2.875820 5.754285 
1 1 1   10    7  -77 o   37.698   3.2298   58.836   9.8295   67.806   17.408   54.637   11.910   39.949   5.4908   36.138   4.1162 3.810921 6.862415 
1 1 1   10    7  -76 o   23.679   4.7125   24.026   8.7759   27.554   13.286   21.296   11.689   25.133   6.4526   22.206   6.2140 2.926640 8.958231 
1 1 1   10    7  -75 o   13.176   5.3369   3.1709   8.9093 -21.7331   13.648   21.666   11.761   10.635   5.1454   22.406   6.2197 -11.77149 8.072124 
1 1 1   10    7  -74 o   95.828   1.7433  375.033   13.618  415.631   18.992  332.079   19.536  100.804   2.3113   90.013   2.6655 10.79150 3.528027 
1 1 1   10    7  -73 o   90.570   1.9552  335.122   14.435  331.075   18.235  341.914   23.622   89.921   2.4902   91.251   3.1805 -1.330078 4.039426 
1 1 1   10    7  -72 o   10.968   4.8723  -3.0733   8.7166  -5.4813   12.185  -0.5498   12.474   12.648   5.6795   14.075   6.0458 -1.426286 8.295089 
1 1 1   10    7  -71 o   45.257   2.5875   84.050   9.5059   86.343   13.102   81.502   13.813   45.739   3.5417   44.378   3.8567 1.361023 5.236162 
1 1 1   10    7  -70 o   71.339   1.9212  207.961   11.162  199.781   15.205  217.522   16.438   69.836   2.6759   72.862   2.7728 -3.025856 3.853422 
1 1 1   10    7  -69 o   23.482   4.6595   23.486   8.6042   27.126   11.846   19.421   12.518   25.101   5.8915   21.541   6.5488 3.559933 8.808899 
1 1 1   10    7  -68 o   41.500   2.9059   70.800   9.7681   71.513   12.516   69.688   15.623   41.595   3.7311   40.873   4.7793 0.7222404 6.063211 
1 1 1   10    7  -67 o  154.358   1.7625  972.372   22.176  956.384   27.579  1001.62   37.304  153.026   2.2109  156.482   2.9245 -3.456390 3.666167 
1 1 1   10    7  -66 o  111.616   1.5211  508.233   13.839  529.357   20.401  490.226   18.835  113.855   2.1982  109.574   2.1088 4.280533 3.046160 
1 1 1   10    7  -65 o   52.049   1.8365  110.696   7.7795  103.815   13.060  114.481   9.6853   50.270   3.2038   52.900   2.2512 -2.629665 3.915622 
1 1 1   10    7  -64 o   15.091   4.6439   9.3453   6.2699   12.799   11.721   7.9610   7.4209   18.478   6.3926   14.666   5.0860 3.812792 8.168978 
1 1 1   10    7  -63 o  126.847   1.4416  656.274   14.906  663.245   22.541  650.857   19.871  127.460   2.1695  126.286   1.9303 1.174294 2.903910 
1 1 1   10    7  -62 o   25.869   3.3297   27.821   6.8586   22.929   12.123   30.124   8.3177   23.182   6.2669   26.841   3.9171 -3.658945 7.390395 
1 1 1   10    7  -61 o   99.796   1.4764  406.187   12.010  398.313   18.361  412.075   15.877   98.777   2.2804  100.491   1.9383 -1.714714 2.992828 
1 1 1   10    7  -60 o   77.541   1.5936  245.247   10.073  233.271   15.859  253.345   13.041   75.534   2.5795   78.766   2.0328 -3.232002 3.284169 
1 1 1   10    7  -59 o   35.076   2.6961   50.544   7.6497   50.071   12.413   50.834   9.7134   34.665   4.4989   35.091   3.4400 -0.4251823 5.663358 
1 1 1   10    7  -58 o   66.947   1.8428  182.978   10.047  198.602   15.235  170.952   13.366   69.685   2.6870   64.657   2.5409 5.027664 3.698123 
1 1 1   10    7  -57 f  249.731   1.9336  2544.36   39.361  2528.15   53.063  2564.19   58.692  248.832   2.6161  250.553   2.8737 -1.720459 3.886148 
1 1 1   10    7  -56 o  106.293   1.5649  460.767   13.559  465.855   19.694  456.182   18.696  106.843   2.2613  105.733   2.1692 1.109657 3.133537 
1 1 1   10    7  -55 o   91.197   1.4923  339.152   11.093  345.066   15.158  332.332   16.279   91.968   2.0219   90.247   2.2129 1.721527 2.997479 
1 1 1   10    7  -54 o  140.283   1.5608  802.515   17.847  785.314   24.622  821.559   25.907  138.735   2.1772  141.896   2.2398 -3.160934 3.123616 
1 1 1   10    7  -53 o   26.097   3.6802   28.383   7.6117   29.743   12.637   27.608   9.5355   26.394   6.0088   25.560   4.7514 0.8333740 7.660405 
1 1 1   10    7  -52 o  134.316   1.4902  735.631   16.316  733.912   24.069  737.091   22.193  134.123   2.2015  134.423   2.0254 -0.3004150 2.991479 
1 1 1   10    7  -51 o   85.628   2.1196  299.105   14.794  306.251   22.877  293.968   19.396   86.533   3.2491   84.815   2.8093 1.717842 4.295205 
1 1 1   10    7  -50 o   81.906   2.2900  273.914   15.274  357.309   24.342  219.747   19.617   93.484   3.1990   73.277   3.2927 20.20683 4.590788 
1 1 1   10    7  -49 o  159.916   1.8457  1042.98   24.060  1083.42   34.669  1005.41   33.418  162.933   2.6103  156.958   2.6120 5.975769 3.692697 
1 1 1   10    7  -48 o  104.605   1.5314  446.171   13.058  450.690   19.613  442.573   17.499  105.105   2.2893  104.163   2.0610 0.9410782 3.080300 
1 1 1   10    7  -47 o  128.012   1.4886  668.168   15.533  670.721   23.023  666.036   21.044  128.226   2.2027  127.786   2.0202 0.4395981 2.988869 
1 1 1   10    7  -46 o  140.576   1.6012  805.795   18.348  797.747   29.845  810.685   23.264  139.819   2.6186  140.983   2.0243 -1.163498 3.309828 
1 1 1   10    7  -45 o   84.715   1.5434  292.623   10.658  275.639   16.031  306.077   14.268   82.162   2.3961   86.628   2.0205 -4.466644 3.134281 
1 1 1   10    7  -44 o  152.295   1.4663  945.656   18.204  927.254   26.477  962.152   25.068  150.775   2.1543  153.594   2.0022 -2.819168 2.941078 
1 1 1   10    7  -43 o  188.252   1.5585  1444.96   23.915  1441.22   34.615  1448.38   33.080  187.967   2.2591  188.441   2.1535 -0.4732971 3.121127 
1 1 1   10    7  -42 o  107.475   1.4295  470.939   12.524  472.831   18.742  469.413   16.833  107.670   2.1355  107.287   1.9248 0.3826218 2.874895 
1 1 1   10    7  -41 o   65.598   1.6505  175.567   8.8186  164.949   13.488  183.494   11.654   63.530   2.6102   67.040   2.1354 -3.510418 3.372362 
1 1 1   10    7  -40 f  198.135   1.5874  1600.65   25.638  1621.46   37.209  1581.84   35.377  199.378   2.2895  196.933   2.2038 2.445129 3.177775 
1 1 1   10    7  -39 o  177.239   1.5188  1280.78   21.942  1291.43   31.849  1271.15   30.274  177.941   2.1957  176.544   2.1037 1.397491 3.040824 
1 1 1   10    7  -38 o  120.906   1.4107  595.977   13.903  596.233   20.375  595.754   19.018  120.912   2.0673  120.868   1.9303 0.4375458E-01 2.828354 
1 1 1   10    7  -37 o  126.071   1.4183  647.978   14.576  633.214   21.135  661.368   20.128  124.605   2.0808  127.351   1.9389 -2.745209 2.844147 
1 1 1   10    7  -36 o  216.780   1.6498  1916.08   29.154  1928.88   41.987  1904.17   40.511  217.459   2.3687  216.066   2.3001 1.392746 3.301704 
1 1 1   10    7  -35 o  231.270   1.7096  2180.83   32.230  2169.62   45.996  2191.65   45.174  230.626   2.4467  231.798   2.3908 -1.172318 3.420848 
1 1 1   10    7  -34 o  244.600   1.7635  2439.51   35.161  2442.00   50.366  2437.14   49.107  244.670   2.5253  244.432   2.4646 0.2384033 3.528700 
1 1 1   10    7  -33 o   80.028   1.6624  261.124   10.845  261.734   18.213  260.789   13.499   80.045   2.7957   79.941   2.0732 0.1039047 3.480520 
1 1 1   10    7  -32 o  386.378   2.6239  6090.17   82.642  6118.43  127.758  6069.84  108.367  387.029   4.0496  385.604   3.4476 1.424438 5.318367 
1 1 1   10    7  -31 o   88.013   1.8863  315.866   13.533  292.699   23.808  326.924   16.448   84.607   3.4593   89.503   2.2563 -4.895950 4.130114 
1 1 1   10    7  -30 o  110.691   1.6555  499.559   14.938  449.275   22.059  542.144   20.300  104.946   2.5786  115.298   2.1599 -10.35234 3.363692 
1 1 1   10    7  -29 o  167.357   1.8261  1142.03   24.912  1132.98   39.559  1147.97   32.070  166.638   2.9123  167.768   2.3450 -1.130554 3.739070 
1 1 1   10    7  -28 o  131.806   1.7284  708.337   18.570  670.929   28.940  734.523   24.213  128.241   2.7684  134.204   2.2133 -5.963303 3.544403 
1 1 1   10    7  -27 o  271.370   2.1599  3003.16   47.778  3037.09   83.412  2986.59   58.286  272.740   3.7518  270.581   2.6426 2.158539 4.589092 
1 1 1   10    7  -26 o  157.938   1.6562  1017.01   21.323  982.010   36.317  1035.42   26.341  155.145   2.8717  159.348   2.0279 -4.203232 3.515512 
1 1 1   10    7  -25 o  199.086   1.8087  1616.06   29.352  1584.42   50.231  1632.46   36.171  197.051   3.1272  200.074   2.2178 -3.022690 3.833822 
1 1 1   10    7  -24 o   84.402   1.6652  290.436   11.457  313.515   20.151  279.413   13.926   87.619   2.8251   82.777   2.0639 4.841545 3.498679 
1 1 1   10    7  -23 o  177.059   1.7180  1278.18   24.796  1254.64   42.653  1290.19   30.475  175.361   2.9838  177.874   2.1018 -2.513489 3.649774 
1 1 1   10    7  -22 o  157.506   1.5695  1011.40   20.150  1003.46   31.594  1016.85   26.163  156.853   2.4710  157.915   2.0325 -1.061279 3.199486 
1 1 1   10    7  -21 o  231.074   1.8274  2177.07   34.421  2179.39   53.433  2175.42   45.002  231.135   2.8360  230.955   2.3904 0.1798096 3.709014 
1 1 1   10    7  -20 o  107.107   1.7418  467.727   15.208  490.022   24.713  454.139   19.293  109.567   2.7692  105.528   2.2428 4.038681 3.563538 
1 1 1   10    7  -19 o  220.577   1.9092  1983.83   34.328  2033.41   60.554  1960.34   41.671  223.224   3.3279  219.246   2.3317 3.978363 4.063434 
1 1 1   10    7  -18 o  209.519   1.8567  1789.86   31.711  1770.74   54.748  1799.51   38.901  208.317   3.2241  210.063   2.2718 -1.746399 3.944069 
1 1 1   10    7  -17 o  103.992   1.6040  440.889   13.597  453.759   23.678  434.558   16.608  105.434   2.7575  103.235   1.9736 2.198730 3.390950 
1 1 1   10    7  -16 o   40.533   2.6957   67.309   8.8562   57.219   18.346   70.374   10.112   36.875   6.3313   41.423   3.0155 -4.548336 7.012715 
1 1 1   10    7  -15 o  157.738   1.6616  1014.39   21.364  972.338   36.225  1036.82   26.455  154.388   2.8784  159.461   2.0353 -5.072601 3.525290 
1 1 1   10    7  -14 o  227.281   1.9356  2106.23   35.860  2188.39   63.479  2067.72   43.459  231.580   3.3627  225.172   2.3677 6.407700 4.112669 
1 1 1   10    7  -13 o  251.818   2.2605  2585.90   46.400  2589.96   73.284  2583.19   59.947  251.915   3.5688  251.641   2.9225 0.2741547 4.612699 
1 1 1   10    7  -12 o  229.308   2.1410  2144.14   40.019  2151.52   63.338  2139.23   51.630  229.621   3.3839  229.009   2.7658 0.6121063 4.370373 
1 1 1   10    7  -11 o   92.349   1.8262  347.715   13.748  326.615   21.522  362.260   17.868   89.430   2.9564   94.251   2.3257 -4.821022 3.761508 
1 1 1   10    7  -10 o  105.144   2.2735  450.824   19.486  398.648   31.711  482.477   24.699   98.742   3.9478  108.723   2.7892 -9.980774 4.833702 
1 1 1   10    7   -9 o  153.872   1.7970  965.310   22.540  932.958   48.720  974.120   25.424  151.125   3.9583  154.566   2.0179 -3.440964 4.442998 
1 1 1   10    7   -8 o   49.551   2.4159  100.366   9.7288   88.015   20.554  103.932   11.044   46.064   5.5881   50.407   2.6977 -4.343185 6.205201 
1 1 1   10    7   -7 o  188.803   2.1645  1453.54   33.312   0.0000   0.0000  1453.54   33.312  ?   ?   188.803   2.1645 0.000000 2.164482 
1 1 1   10    7   -6 o  181.704   1.7430  1346.06   25.816  1334.62   44.594  1351.83   31.661  180.875   3.0245  182.079   2.1332 -1.204147 3.701143 
1 1 1   10    7   -5 o  180.682   1.9108  1331.04   28.142  1386.56   45.482  1296.60   35.823  184.361   3.0265  178.308   2.4647 6.053665 3.903084 
1 1 1   10    7   -4 o  191.433   1.9579  1494.18   30.552  1529.18   49.143  1472.13   39.007  193.607   3.1139  189.992   2.5186 3.614563 4.005009 
1 1 1   10    7   -3 o  248.983   2.2443  2527.89   45.549  2569.52   72.860  2501.19   58.358  250.931   3.5620  247.624   2.8912 3.306946 4.587714 
1 1 1   10    7   -2 o  108.937   1.6221  483.803   14.404  486.634   20.405  480.990   20.336  109.241   2.2914  108.606   2.2970 0.6354675 3.244529 
1 1 1   10    7   -1 o  166.130   1.6983  1125.19   22.998  1113.01   32.326  1137.68   32.726  165.205   2.4004  167.026   2.4036 -1.821182 3.396999 
1 1 1   10    7    0 o  295.942   2.2976  3571.42   55.427  3607.19   78.908  3536.59   77.874  297.343   3.2556  294.420   3.2448 2.922943 4.596463 
1 1 1   10    7    1 o  186.624   1.6387  1419.89   24.928  1449.87   38.440  1398.13   32.748  188.551   2.5010  185.171   2.1696 3.380722 3.310915 
1 1 1   10    7    2 o  102.700   1.5096  429.975   12.638  441.907   19.377  421.141   16.672  104.100   2.2835  101.631   2.0125 2.469620 3.043745 
1 1 1   10    7    3 o  154.924   1.6630  978.497   21.001  982.509   29.797  974.537   29.604  155.220   2.3550  154.589   2.3493 0.6308136 3.326422 
1 1 1   10    7    4 o  168.942   1.5865  1163.56   21.848  1189.49   33.672  1144.70   28.712  170.786   2.4187  167.552   2.1022 3.233917 3.204626 
1 1 1   10    7    5 o  157.505   1.6698  1011.38   21.438  1036.85   30.839  987.547   29.823  159.454   2.3726  155.617   2.3511 3.836899 3.340179 
1 1 1   10    7    6 o   98.368   1.5336  394.468   12.297  421.613   19.088  375.205   16.079  101.681   2.3029   95.927   2.0563 5.754173 3.087338 
1 1 1   10    7    7 o  433.167   2.8744  7653.77  101.495  7627.17  154.596  7673.93  134.553  432.177   4.3884  433.602   3.8069 -1.425720 5.809455 
1 1 1   10    7    8 o  236.588   1.9898  2282.26   38.375  2384.34   68.299  2235.17   46.390  241.724   3.4662  234.112   2.4309 7.611847 4.233651 
1 1 1   10    7    9 o  125.536   1.7628  642.513   18.039  616.948   28.449  659.702   23.328  122.983   2.8378  127.192   2.2500 -4.209152 3.621582 
1 1 1   10    7   10 o  313.233   2.6200  4001.69   66.897  3957.51  105.072  4031.81   86.753  311.336   4.1402  314.336   3.3857 -2.999847 5.348314 
1 1 1   10    7   11 o  114.293   1.9664  532.621   18.320  520.750   25.924  544.464   25.893  112.989   2.8147  115.535   2.7494 -2.546097 3.934696 
1 1 1   10    7   12 o   49.586   2.5600  100.547   10.312  117.166   13.325   75.727   16.284   53.503   3.0681   42.794   4.7480 10.70881 5.653013 
1 1 1   10    7   13 o  254.936   2.2843  2650.36   47.471  2612.15   60.697  2710.55   76.178  253.046   2.9426  257.707   3.6263 -4.661835 4.670021 
1 1 1   10    7   14 o  372.328   3.0031  5655.50   91.146  5627.40  117.196  5698.51  144.999  371.285   3.8723  373.472   4.7629 -2.186920 6.138374 
1 1 1   10    7   15 o  124.250   1.8006  629.429   18.237  665.877   23.851  578.129   28.296  127.783   2.2898  119.045   2.9160 8.737503 3.707558 
1 1 1   10    7   16 o  264.253   2.3407  2847.77   50.419  2820.76   64.598  2889.86   80.652  262.946   3.0138  266.079   3.7185 -3.132996 4.786444 
1 1 1   10    7   17 o  173.726   1.8830  1230.56   26.665  1214.40   42.257  1241.25   34.373  172.530   3.0047  174.457   2.4171 -1.927261 3.856234 
1 1 1   10    7   18 o  185.113   1.9297  1397.20   29.119  1403.65   46.603  1393.07   37.295  185.480   3.0823  184.815   2.4756 0.6656494 3.953404 
1 1 1   10    7   19 o   70.884   1.7531  204.855   10.129  222.744   15.973  192.822   13.100   73.850   2.6578   68.721   2.3420 5.128510 3.542437 
1 1 1   10    7   20 o  429.153   2.8549  7513.27   99.872  7680.58  155.512  7395.82  130.291  433.631   4.3996  425.642   3.7552 7.988464 5.784254 
1 1 1   10    7   21 o   79.607   1.7795  258.385   11.547  223.536   20.491  274.602   13.978   73.931   3.4094   82.035   2.0921 -8.104332 4.000095 
1 1 1   10    7   22 o  239.643   1.8575  2341.57   36.285  2310.94   55.264  2364.78   48.107  238.006   2.8485  240.792   2.4509 -2.785995 3.757786 
1 1 1   10    7   23 o  126.465   1.5068  652.023   15.533  616.552   23.601  679.131   20.632  122.954   2.3548  129.056   1.9612 -6.101768 3.064555 
1 1 1   10    7   24 o  292.979   2.2834  3500.63   54.533  3532.52   95.416  3485.16   66.456  294.127   3.9797  292.287   2.7893 1.839935 4.859853 
1 1 1   10    7   25 o  186.361   1.7681  1416.05   26.859  1430.69   47.267  1409.06   32.641  187.250   3.0967  185.884   2.1542 1.366089 3.772293 
1 1 1   10    7   26 o  256.603   2.0889  2685.10   43.692  2608.43   74.585  2725.16   53.911  252.779   3.6197  258.476   2.5587 -5.696838 4.432762 
1 1 1   10    7   27 o   87.995   1.6818  315.699   12.064  304.349   21.532  320.892   14.564   86.310   3.0653   88.709   2.0141 -2.399437 3.667787 
1 1 1   10    7   28 o  151.450   1.8042  935.236   22.273  953.652   36.265  924.082   28.223  152.884   2.9100  150.525   2.3002 2.358948 3.709288 
1 1 1   10    7   29 o  218.523   1.9013  1947.16   33.867  1895.10   47.603  2000.52   48.192  215.531   2.7095  221.447   2.6697 -5.916321 3.803799 
1 1 1   10    7   30 o   31.769   3.1535   41.593   8.0587   40.889   12.328   42.117   10.649   31.236   5.0112   31.836   4.2064 -0.5997086 6.542596 
1 1 1   10    7   31 o   35.470   2.8282   51.657   8.1097   60.564   12.320   44.847   10.773   38.300   4.0052   32.881   4.1087 5.418987 5.737852 
1 1 1   10    7   32 o  232.437   1.8224  2202.98   34.530  2089.65   51.337  2296.60   46.661  226.313   2.7828  237.286   2.4124 -10.97255 3.682910 
1 1 1   10    7   33 o  143.599   1.6400  840.751   19.197  837.838   34.105  842.102   23.226  143.294   2.9198  143.702   1.9828 -0.4085846 3.529453 
1 1 1   10    7   34 o   52.429   2.1290  112.287   9.0799  111.117   16.862  112.765   10.776   52.004   4.0086   52.517   2.5245 -0.5127220 4.737336 
1 1 1   10    7   35 o  166.726   1.6993  1133.41   23.095  1106.15   40.156  1146.88   28.231  164.639   2.9921  167.698   2.0652 -3.058395 3.635661 
1 1 1   10    7   36 o   85.663   1.5842  299.188   11.062  316.382   17.859  288.483   14.091   88.032   2.4912   84.106   2.0553 3.925461 3.229655 
1 1 1   10    7   37 o   93.516   1.5382  356.552   11.725  361.158   18.664  353.548   15.070   94.062   2.4363   93.110   1.9856 0.9518204 3.142932 
1 1 1   10    7   38 o  122.736   1.5086  614.177   15.093  611.052   23.756  616.292   19.546  122.393   2.3811  122.933   1.9505 -0.5404129 3.077997 
1 1 1   10    7   39 o   35.694   2.9087   52.337   8.3898   62.443   16.030   48.524   9.8460   38.720   5.2111   34.287   3.5753 4.432571 6.319705 
1 1 1   10    7   40 f  145.774   1.6613  866.459   19.740  884.805   35.493  858.243   23.753  147.242   2.9572  145.067   2.0087 2.174850 3.574859 
1 1 1   10    7   41 o   80.156   1.9522  262.020   12.755  267.836   21.684  258.943   15.773   80.930   3.2938   79.634   2.4326 1.295815 4.094755 
1 1 1   10    7   42 o  192.094   1.9850  1504.89   31.082  1474.96   49.565  1524.29   39.902  190.079   3.1989  193.290   2.5325 -3.211029 4.080055 
1 1 1   10    7   43 o   73.822   2.0072  222.425   12.067  253.076   21.074  207.472   14.719   78.661   3.2939   71.265   2.5379 7.396492 4.158185 
1 1 1   10    7   44 o  152.518   1.7475  948.569   21.726  971.961   32.694  930.070   29.073  154.340   2.5987  150.992   2.3622 3.347824 3.511827 
1 1 1   10    7   45 o   39.200   3.0086   63.095   9.5402   69.759   16.137   59.515   11.829   40.995   4.9277   37.968   3.8762 3.026516 6.269565 
1 1 1   10    7   46 o   53.495   2.4285  116.999   10.562  121.661   17.489  114.322   13.252   54.416   3.9700   52.827   3.0909 1.588810 5.031347 
1 1 1   10    7   47 o   94.511   1.8601  364.284   14.330  370.639   22.407  359.886   18.641   95.245   2.8895   93.886   2.4378 1.359802 3.780446 
1 1 1   10    7   48 o   78.940   2.0327  254.349   13.069  256.530   20.884  252.945   16.755   79.191   3.2421   78.685   2.6159 0.5058746 4.165803 
1 1 1   10    7   49 o   48.381   3.1343   95.982   12.295  112.438   24.013   90.136   14.313   52.047   5.7562   46.811   3.7832 5.235771 6.888114 
1 1 1   10    7   50 o  117.387   2.2816  562.192   21.832  515.286   34.771  592.717   28.050  112.219   3.8066  120.498   2.8557 -8.278557 4.758746 
1 1 1   10    7   51 o  103.024   2.2438  433.022   18.843  391.353   30.011  460.140   24.210   97.781   3.7722  106.135   2.8008 -8.353416 4.698356 
1 1 1   10    7   52 o  100.366   2.4187  411.053   19.788  418.438   23.295  391.916   37.499  101.202   2.8266   97.724   4.7214 3.477356 5.502877 
1 1 1   10    7   53 o   92.951   2.4920  352.858   18.864  345.648   22.106  372.175   36.184   91.957   2.9530   95.223   4.6760 -3.265587 5.530334 
1 1 1   10    7   54 o   89.455   2.1945  326.501   16.002  346.153   21.298  301.032   24.247   92.030   2.8425   85.755   3.4758 6.275215 4.490139 
1 1 1   10    7   55 o   81.610   2.2243  271.973   14.783  272.190   19.416  271.672   22.804   81.586   2.9243   81.456   3.4421 0.1295929 4.516562 
1 1 1   10    7   56 o   74.702   1.9322  227.808   11.756  228.348   18.673  227.453   15.131   74.700   3.0731   74.605   2.4915 0.9518433E-01 3.956229 
1 1 1   10    7   57 f   28.306   3.8230   33.370   8.5959   52.335   14.947   23.999   10.507   35.310   5.3615   23.701   5.5387 11.60913 7.708619 
1 1 1   10    7   58 o   41.028   2.7804   69.065   9.2437   63.664   15.663   71.951   11.450   39.072   5.0349   41.815   3.3883 -2.742870 6.068799 
1 1 1   10    7   59 o  116.201   1.7190  550.802   16.283  536.976   24.855  561.196   21.551  114.666   2.6591  117.257   2.2548 -2.590729 3.486396 
1 1 1   10    7   60 o  145.323   1.7310  861.518   20.505  809.114   30.017  907.368   28.078  140.753   2.6162  149.088   2.3104 -8.334808 3.490349 
1 1 1   10    7   61 o  154.679   2.3500  976.837   29.631   0.0000   0.0000  976.837   29.631  ?   ?   154.679   2.3500 0.000000 2.350021 
1 1 1   10    7   62 o  187.346   2.0116  1432.44   30.720  1480.36   52.434  1407.40   37.907  190.220   3.3816  185.632   2.5051 4.587952 4.208432 
1 1 1   10    7   63 o   49.073   2.3664   98.570   9.4381   71.148   15.860  113.607   11.744   41.344   4.7947   52.655   2.7457 -11.31087 5.525152 
1 1 1   10    7   64 o   59.671   2.0616  145.520   10.013  143.204   16.644  146.834   12.534   59.044   3.4735   59.894   2.5733 -0.8506126 4.322887 
1 1 1   10    7   65 o   69.775   1.9162  198.858   10.888  186.452   17.828  206.237   13.750   67.423   3.2535   71.018   2.3786 -3.595497 4.030305 
1 1 1   10    7   66 o   56.975   2.3768  132.835   11.015  139.910   16.261  126.836   14.972   58.352   3.4338   55.565   3.3208 2.787701 4.776916 
1 1 1   10    7   67 o   85.655   1.9174  299.496   13.388  307.646   19.724  292.534   18.230   86.693   2.7948   84.553   2.6482 2.139313 3.850207 
1 1 1   10    7   68 o   42.452   2.5483   73.927   8.7776   77.744   15.345   72.071   10.701   43.268   4.4125   41.840   3.1610 1.428257 5.427923 
1 1 1   10    7   69 o   97.008   1.7063  384.077   13.493  384.895   21.546  383.550   17.307   96.969   2.7285   96.898   2.1911 0.7107544E-01 3.499399 
1 1 1   10    7   70 o   71.457   1.8391  208.602   10.703  215.682   18.489  205.033   13.126   72.499   3.1361   70.798   2.2775 1.701027 3.875804 
1 1 1   10    7   71 o   96.232   1.8567  378.135   14.565  361.294   27.131  384.953   17.263   93.768   3.5561   97.061   2.1819 -3.293777 4.172056 
1 1 1   10    7   72 o   46.294   2.2933   87.825   8.6272  103.582   21.582   84.829   9.4118   49.717   5.4127   45.466   2.5498 4.251369 5.983191 
1 1 1   10    7   73 o   63.822   3.0679  167.362   15.914  191.531   24.144  148.798   21.160   68.013   4.3783   59.917   4.3624 8.095882 6.180564 
1 1 1   10    7   74 o   27.808   5.2206   33.082   11.399   26.033   15.074   42.497   17.421   24.576   7.1170   31.198   7.0205 -6.621908 9.996970 
1 1 1   10    7   75 o   28.132   5.6499   34.103   12.506   39.512   14.652   19.586   24.002   30.214   6.1582   24.014   9.0306 6.200548 10.93048 
1 1 1   10    7   76 o   35.223   3.8733   51.739   10.938   45.343   14.527   60.109   16.619   32.514   5.6883   37.576   5.5961 -5.061707 7.979560 
1 1 1   10    7   77 o   34.534   3.9009   49.818   10.789   40.749   14.067   62.775   16.815   30.721   5.8306   38.402   5.5309 -7.680944 8.036589 
1 1 1   10    7   78 o   23.636   5.3456   24.237   10.057   30.760   13.341   15.650   15.307   26.500   6.2736   20.398   7.2850 6.102348 9.614019 
1 1 1   10    7   79 o   21.955   5.5491   21.001   9.9341   15.163   12.952   29.341   15.482   19.572   6.7222   25.786   7.1277 -6.213312 9.797544 
1 1 1   10    7   80 o   36.433   3.8411   55.516   11.236   63.886   16.300   47.936   15.510   38.696   5.3072   33.233   5.9435 5.462311 7.968151 
1 1 1   10    7   81 o   14.615   5.5670   6.5587   9.1901  -0.9134   12.083   16.812   14.155   13.612   5.8991   20.434   7.0269 -6.821701 9.174822 
1 1 1   10    7   82 o   64.617   2.3096  171.518   12.146  170.994   16.079  172.214   18.535   64.325   3.0754   64.411   3.5438 -0.8541107E-01 4.692202 
1 1 1   10    7   83 o   58.453   2.7064  140.909   12.860  152.967   18.764  130.227   17.661   60.563   3.8203   55.833   3.9051 4.729969 5.462990 
1 1 1   10    7   84 o   60.486   2.6443  150.893   13.006  143.868   18.699  157.478   18.104   58.640   3.9346   61.478   3.6286 -2.838745 5.352399 
1 1 1   10    7   85 o   40.631   3.5762   69.123   11.724   54.250   16.616   83.865   16.543   35.087   6.0268   44.405   4.6387 -9.317738 7.605249 
1 1 1   10    7   86 o   90.440   2.0502  335.731   15.115  339.696   23.642  332.989   19.657   90.458   3.2113   89.805   2.6882 0.6531601 4.187963 
1 1 1   10    7   87 o   42.867   2.7774   76.239   9.6527   67.618   13.095   86.495   14.284   39.949   4.0785   45.296   3.9068 -5.346069 5.647728 
1 1 1   10    7   88 o   45.942   2.6318   87.431   9.8150   87.381   13.444   87.489   14.363   45.596   3.6475   45.523   3.9083 0.7254410E-01 5.345941 
1 1 1   10    7   89 f   54.990   2.3300  124.813   10.421  111.673   14.074  140.757   15.504   51.656   3.3606   58.048   3.2899 -6.391647 4.702913 
1 1 1   10    7   90 o   63.376   2.1564  165.528   11.124  164.723   13.338  167.367   20.162   63.064   2.6001   62.920   3.9510 0.1441650 4.729763 
1 1 1   10    7   91 o   9.4996   4.3988  -6.0527   8.0696  -9.0735   9.5882   1.2828   14.942   9.9083   4.6557   15.272   6.5891 -5.363850 8.067899 
1 1 1   10    7   92 o   18.258   5.3255   14.873   8.4130   15.787   10.125   12.836   15.122   18.841   5.9179   18.627   7.1298 0.2136288 9.265856 
1 1 1   10    7   93 o   15.409   5.1305   9.9979   7.5426   14.868   9.9275   3.3483   11.600   18.332   5.8725   14.253   5.9622 4.078721 8.368619 
1 1 1   10    7   94 o   33.618   2.9942   47.490   8.1195   51.900   10.771   41.686   12.357   34.823   3.8593   30.607   5.1344 4.215349 6.423125 
1 1 1   10    7   95 o   41.650   2.5217   72.181   8.5214   65.470   11.209   81.371   13.116   39.269   3.5397   43.725   3.7152 -4.455322 5.131505 
1 1 1   10    7   96 o   45.927   2.3388   87.538   8.7268   78.539   11.441  100.057   13.495   43.121   3.2796   48.622   3.4267 -5.501530 4.743212 
1 1 1   10    7   97 o   31.636   3.7564   43.058   9.4981   48.006   11.917   34.439   15.728   33.045   4.5441   26.587   7.1165 6.457556 8.443566 
1 1 1   10    7   98 o   38.384   3.0061   62.156   9.3309   62.603   11.316   61.206   16.493   38.207   3.6789   36.556   5.7223 1.651047 6.802852 
1 1 1   10    7   99 o   43.507   2.6789   79.354   9.4545   78.432   11.580   81.196   16.373   42.928   3.3355   42.761   4.7790 0.1665382 5.827880 
1 1 1   10    7  100 o   19.483   4.8316   17.427   7.6357   26.164   10.127   5.9175   11.624   23.697   5.3676   14.761   6.0516 8.936721 8.089096 
1 1 1   10    7  101 o   30.229   3.3608   39.340   8.1417   36.309   10.740   43.436   12.485   28.258   4.8362   30.750   5.1637 -2.492075 7.074816 
1 1 1   10    7  102 o   29.073   3.5122   36.720   8.1549   34.656   10.829   39.426   12.395   27.385   5.0364   28.974   5.4480 -1.588760 7.419297 
1 1 1   10    7  103 o   25.454   3.9853   28.854   7.9977   29.910   10.373   27.305   12.559   25.208   5.2202   23.317   6.4097 1.891165 8.266428 
1 1 1   10    7  104 o   16.593   5.1742   12.921   7.7541   8.4743   9.9624   19.754   12.350   14.823   5.7570   19.825   6.5639 -5.001489 8.730856 
1 1 1   10    7  105 f   37.044   2.8409   58.581   8.5131   49.091   11.018   72.638   13.409   33.038   4.1850   40.295   4.1414 -7.256432 5.887747 
1 1 1   10    7  106 f   19.534   5.1795   18.516   8.3806   14.782   11.484   22.772   12.258   17.451   6.3004   20.880   6.5047 -3.429415 9.055737 
1 1 1   10    7  107 o   12.451   5.0899   4.5759   8.1934   1.5519   11.327   7.8950   11.867   12.821   5.6306   14.880   6.1091 -2.058995 8.308060 
1 1 1   10    7  108 o   27.321   3.8746   33.692   8.3870   34.702   11.000   32.290   12.962   26.724   5.2368   24.760   6.3820 1.964375 8.255598 
1 1 1   10    7  109 o   28.527   3.7537   36.557   8.5170   32.746   11.288   41.592   12.977   25.621   5.5646   28.820   5.7257 -3.198875 7.984282 
1 1 1   10    7  110 o   24.107   5.2591   28.630   10.043   34.108   12.671   19.374   16.471   25.566   6.1547   18.903   7.3849 6.663086 9.613368 
1 1 1   10    7  111 o   9.7137   4.5995  -7.8607   9.6922  -2.4934   12.204 -17.0293   15.950   12.075   5.5245   11.356   5.5102 0.7190237 7.802767 
1 1 1   10    7  112 o   17.172   6.3067   15.167   11.576   11.374   16.267   19.059   16.478   16.460   6.9821   18.591   7.3491 -2.131157 10.13702 
1 1 1   10    7  113 o   9.7313   4.6338  -8.8664   10.114  -4.1785   12.733 -16.8799   16.648   11.897   5.5148   11.586   5.6238 0.3111134 7.876532 
1 1 1   10    7  114 o   9.7142   4.6311  -9.0150   10.163  -5.7293   12.833 -14.5440   16.647   11.619   5.4358   11.835   5.7156 -0.2167015 7.887708 
1 1 1   10    7  115 o   25.644   5.4232   33.284   10.982   24.027   13.750   49.588   18.249   20.340   6.9278   28.614   7.6687 -8.273703 10.33457 
1 1 1   10    7  116 f   11.090   5.2892  -9.7154   13.284 -10.4380   16.704  -8.4722   21.910   12.320   5.8908   14.105   6.7451 -1.785596 8.955348 
1 1 1   10    7  117 o   17.681   6.4976   17.153   12.291   0.7819   16.846   35.788   17.973   14.061   6.4549   23.371   7.9210 -9.309752 10.21800 
1 1 1   10    7  118 o   16.639   6.3749   14.563   12.097   28.593   17.094   0.4878   17.121   21.035   7.6735   14.029   6.4646 7.006247 10.03358 
1 1 1   10    7  119 o   20.043   6.5566   23.055   12.336   37.526   17.380   8.3635   17.513   24.085   7.7754   15.592   6.9174 8.492923 10.40706 
1 1 1   10    7  120 o   22.349   6.9233   29.537   13.908   24.090   16.964   40.708   24.292   19.618   7.5407   22.876   8.9595 -3.258783 11.71044 
1 1 1   10    8 -118 o   18.929   7.0098   21.234   14.352   22.613   16.903   17.672   27.167   19.126   7.4786   18.158   8.2830 0.9682236 11.15963 
1 1 1   10    8 -117 o   11.555   5.3138  -2.3653   11.486   4.3920   13.090 -24.9783   23.945   13.678   6.0283   12.848   6.3398 0.8301554 8.748345 
1 1 1   10    8 -116 o   11.027   5.0596  -2.4103   10.333  -9.2920   13.085   8.9926   16.843   10.984   5.2415   15.563   6.8493 -4.578735 8.624688 
1 1 1   10    8 -115 o   11.432   5.1648  -0.6420   10.254 -13.8277   12.910   21.897   16.878   10.266   4.9757   18.931   7.4520 -8.665693 8.960424 
1 1 1   10    8 -114 o   23.907   5.5852   29.647   10.687   29.149   13.610   30.446   17.258   22.355   6.8351   21.709   7.7374 0.6457672 10.32406 
1 1 1   10    8 -113 o   16.239   6.0484   13.424   10.714   11.756   13.466   16.301   17.684   15.912   6.5175   17.562   7.3548 -1.650508 9.827061 
1 1 1   10    8 -112 o   13.061   5.7129   3.3148   11.556   2.4535   13.182   6.1734   24.016   13.392   5.9678   16.477   7.6151 -3.084636 9.674956 
1 1 1   10    8 -111 o   10.671   5.0168  -6.6127   11.158  -1.9729   15.236 -11.9806   16.388   13.207   6.0902   12.057   5.7836 1.149924 8.398820 
1 1 1   10    8 -110 o   32.573   4.7921   50.796   12.344   36.530   16.284   70.066   18.926   24.699   7.4611   35.987   6.6982 -11.28783 10.02668 
1 1 1   10    8 -109 o   26.356   5.5943   35.191   11.647   49.448   15.699   17.740   17.369   30.317   6.5446   18.218   7.4247 12.09892 9.897400 
1 1 1   10    8 -108 o   14.335   5.9667   7.1584   11.534   1.5370   15.765   13.632   16.918   14.185   6.4067   17.195   7.1970 -3.009938 9.635450 
1 1 1   10    8 -107 o   17.487   5.9346   15.570   10.089   20.076   12.582   7.4540   16.886   19.278   6.6253   15.802   6.9090 3.475555 9.572315 
1 1 1   10    8 -106 o   19.726   6.3703   20.696   11.666   21.067   15.571   20.222   17.613   19.504   7.2862   19.219   7.5978 0.2853127 10.52686 
1 1 1   10    8 -105 o   34.758   4.4920   55.951   12.430   47.019   16.792   66.775   18.486   29.249   7.1128   35.749   6.5864 -6.500137 9.693966 
1 1 1   10    8 -104 f   14.719   5.7601   8.8368   10.034   5.8465   12.773   13.656   16.216   14.511   6.1724   17.451   7.1505 -2.940174 9.446042 
1 1 1   10    8 -103 f   14.046   5.1049   8.5063   7.5554   29.517   12.151  -4.7379   9.6472   24.018   6.1729   10.470   4.8344 13.54887 7.840700 
1 1 1   10    8 -102 o   29.054   3.1641   36.568   7.3727   39.595   10.974   34.077   9.9536   29.220   4.7719   27.141   4.6673 2.079613 6.674913 
1 1 1   10    8 -101 o   18.773   4.6545   16.459   7.0871   9.1553   10.786   22.009   9.4016   15.300   5.9765   21.363   5.3977 -6.062343 8.053221 
1 1 1   10    8 -100 o   25.210   3.6832   27.998   7.3454   23.539   10.939   31.658   9.9124   21.867   5.9706   26.188   4.8211 -4.320877 7.674019 
1 1 1   10    8  -99 o   32.173   2.9735   44.150   7.7099   39.410   11.421   48.119   10.451   29.272   4.9636   33.057   3.9568 -3.784836 6.347744 
1 1 1   10    8  -98 o   15.852   5.1845   11.304   7.7137   8.4419   10.573   14.561   11.279   15.197   5.9227   17.847   6.2648 -2.649536 8.621216 
1 1 1   10    8  -97 o   50.960   2.1970  107.979   9.1049  116.104   12.504   98.811   13.283   52.443   2.9368   48.078   3.4116 4.365532 4.501537 
1 1 1   10    8  -96 o   21.170   4.6227   20.294   7.7531   20.440   10.494   20.119   11.505   20.785   5.9128   20.555   6.2842 0.2299824 8.628538 
1 1 1   10    8  -95 o   13.033   5.0001   5.7056   7.4485   15.871   9.9974  -6.9767   11.167   18.592   5.8861   11.199   5.1817 7.393126 7.841937 
1 1 1   10    8  -94 f   30.522   3.3103   39.674   8.1044   48.954   11.071   28.958   11.896   33.563   4.1339   24.880   5.9466 8.682768 7.242323 
1 1 1   10    8  -93 o   82.226   1.9976  278.821   13.389  275.233   17.602  283.749   20.626   81.288   2.6600   82.236   3.0823 -0.9478531 4.071432 
1 1 1   10    8  -92 o   25.816   4.1362   29.063   8.4102   23.588   10.633   38.211   13.745   22.612   5.7552   28.747   6.0569 -6.135403 8.355179 
1 1 1   10    8  -91 o   9.7997   4.4587  -3.9890   7.8074 -12.9009   11.547   3.5167   10.597   10.408   4.9548   13.791   5.7281 -3.382783 7.573670 
1 1 1   10    8  -90 o   46.363   2.3135   89.040   8.7157   74.961   11.681  106.727   13.092   42.118   3.4319   50.410   3.2025 -8.291779 4.694032 
1 1 1   10    8  -89 o   16.990   5.3349   12.640   8.2285   19.053   10.492   2.3952   13.262   20.453   5.9420   14.751   6.2824 5.702706 8.647279 
1 1 1   10    8  -88 o   20.523   4.9088   18.810   8.1012   26.271   10.268   6.5058   13.185   24.167   5.3534   15.970   6.4838 8.196357 8.408227 
1 1 1   10    8  -87 o   24.552   4.3566   26.275   8.3998   23.607   10.562   30.866   13.856   22.827   5.6952   25.824   6.5679 -2.997908 8.693274 
1 1 1   10    8  -86 o   30.699   3.2007   39.635   7.8921   43.681   10.844   35.078   11.508   31.877   4.2814   28.164   5.2042 3.712612 6.738989 
1 1 1   10    8  -85 f   53.951   2.1207  119.869   9.3081  115.788   12.796  124.456   13.565   52.755   2.9877   54.674   3.0559 -1.919456 4.273778 
1 1 1   10    8  -84 o   38.477   2.6727   61.431   8.3307   47.367   11.433   77.353   12.164   33.266   4.3178   42.939   3.5057 -9.673244 5.561822 
1 1 1   10    8  -83 o   29.516   3.3161   36.623   7.8408   30.176   11.068   43.118   11.109   26.125   5.3766   31.712   4.4173 -5.587013 6.958522 
1 1 1   10    8  -82 f   43.725   2.4563   78.941   8.7195   78.784   12.157   79.109   12.513   43.407   3.4646   43.466   3.5628 -0.5870819E-01 4.969654 
1 1 1   10    8  -81 o   51.433   2.2812  108.888   9.5401  118.164   14.353  101.548   12.769   53.296   3.3203   49.432   3.1858 3.863060 4.601545 
1 1 1   10    8  -80 o   46.025   2.3743   87.255   8.8775   88.444   12.427   86.016   12.686   46.107   3.3289   45.432   3.4514 0.6749496 4.795170 
1 1 1   10    8  -79 o   65.010   2.0306  173.363   10.747  178.802   16.027  168.918   14.488   65.778   2.9969   63.991   2.7841 1.786983 4.090553 
1 1 1   10    8  -78 o   57.841   2.1836  137.353   10.277  120.517   15.366  150.977   13.823   53.858   3.5194   60.505   2.8105 -6.647408 4.503896 
1 1 1   10    8  -77 o   46.056   2.7419   87.494   10.247   84.561   17.259   89.091   12.735   44.726   4.8093   46.330   3.3955 -1.604099 5.887177 
1 1 1   10    8  -76 o   50.722   2.4210  105.744   9.9810  100.695   12.940  113.159   15.683   49.330   3.2358   52.187   3.7108 -2.856991 4.923459 
1 1 1   10    8  -75 o   63.306   1.9746  164.123   10.177  177.048   14.224  150.565   14.568   65.627   2.6644   60.449   2.9656 5.178879 3.986733 
1 1 1   10    8  -74 o   86.479   1.7211  305.630   12.133  304.392   16.445  307.109   17.974   86.174   2.3433   86.513   2.5515 -0.3385544 3.464271 
1 1 1   10    8  -73 o   60.156   2.1889  148.278   10.716  133.149   15.210  163.189   15.100   56.805   3.2990   62.980   2.9494 -6.174774 4.425218 
1 1 1   10    8  -72 o   61.942   2.1933  157.159   11.057  175.661   16.137  140.785   15.180   65.346   3.0377   58.454   3.1981 6.891533 4.410821 
1 1 1   10    8  -71 o   37.426   3.2144   57.934   9.7115   66.434   14.013   50.080   13.471   39.864   4.3849   34.416   4.9435 5.447910 6.607931 
1 1 1   10    8  -70 o   50.927   2.6127  106.476   10.810  109.403   15.711  103.845   14.896   51.425   3.7742   50.115   3.6720 1.310005 5.265714 
1 1 1   10    8  -69 o   91.972   1.6636  345.371   12.472  312.835   21.529  361.807   15.302   87.302   3.0298   94.098   1.9949 -6.796158 3.627609 
1 1 1   10    8  -68 f   82.754   1.6963  279.595   11.443  265.370   20.000  286.518   13.952   80.410   3.0569   83.740   2.0440 -3.330284 3.677279 
1 1 1   10    8  -67 o  102.580   1.6028  429.492   13.402  415.674   22.391  437.206   16.730  100.743   2.7291  103.458   1.9839 -2.714584 3.373988 
1 1 1   10    8  -66 o   56.687   1.9530  131.386   9.0111  140.879   16.340  127.237   10.802   58.512   3.4411   55.740   2.3830 2.771919 4.185610 
1 1 1   10    8  -65 o  116.674   1.4573  555.403   13.860  553.935   20.982  556.539   18.461  116.440   2.2106  116.746   1.9399 -0.3058014 2.941090 
1 1 1   10    8  -64 o   76.129   1.5972  236.498   9.9119  218.264   15.531  249.028   12.875   73.016   2.6136   78.066   2.0250 -5.049286 3.306277 
1 1 1   10    8  -63 o   52.108   1.9362  111.002   8.2100   97.377   13.582  118.847   10.306   48.631   3.4486   53.883   2.3521 -5.251415 4.174318 
1 1 1   10    8  -62 o   33.101   2.9796   45.181   7.9535   32.183   12.576   53.846   10.268   27.403   5.8105   36.082   3.5363 -8.679491 6.802006 
1 1 1   10    8  -61 o   70.164   1.7445  200.892   9.9772  199.960   15.210  201.596   13.219   69.893   2.6746   70.216   2.3126 -0.3237305 3.535772 
1 1 1   10    8  -60 o   70.202   1.7433  201.099   9.9757  197.163   15.155  204.107   13.251   69.404   2.6838   70.657   2.3038 -1.252342 3.537040 
1 1 1   10    8  -59 o   57.726   1.8558  136.128   8.7212  120.137   14.116  146.000   11.091   54.094   3.2158   59.750   2.2814 -5.656509 3.942889 
1 1 1   10    8  -58 o  146.854   1.4891  879.675   17.825  873.023   26.420  885.234   24.151  146.228   2.2165  147.270   2.0118 -1.041718 2.993317 
1 1 1   10    8  -57 o   53.171   2.2372  115.624   9.6748   99.870   16.311  124.176   12.017   49.193   4.1050   55.065   2.6853 -5.871937 4.905272 
1 1 1   10    8  -56 o  130.660   1.6980  696.451   18.085  656.546   34.251  711.877   21.295  126.653   3.3205  132.077   1.9780 -5.423943 3.864941 
1 1 1   10    8  -55 o   73.098   2.1119  218.256   12.570  217.220   18.770  219.098   16.927   72.824   3.1695   73.174   2.8433 -0.3498306 4.257935 
1 1 1   10    8  -54 o   53.043   2.3437  115.081   10.109  110.939   13.759  119.938   14.901   51.989   3.2631   54.050   3.3994 -2.060055 4.712062 
1 1 1   10    8  -53 o  165.922   1.6653  1122.94   22.524  1104.90   29.887  1146.65   34.267  164.533   2.2284  167.582   2.5085 -3.048615 3.355318 
1 1 1   10    8  -52 o  147.197   1.4845  883.624   17.812  900.107   26.423  869.895   24.115  148.512   2.1826  146.011   2.0261 2.500595 2.978063 
1 1 1   10    8  -51 o   87.959   1.6235  315.552   11.640  317.527   18.836  314.331   14.806   88.146   2.6244   87.770   2.0695 0.3762894 3.342180 
1 1 1   10    8  -50 o   69.923   1.7158  199.417   9.7796  183.383   15.068  211.087   12.855   66.957   2.7668   71.889   2.1962 -4.932655 3.532487 
1 1 1   10    8  -49 o   52.621   2.0052  113.126   8.5854  111.021   13.751  114.471   10.991   52.024   3.2589   52.893   2.5567 -0.8691330 4.142147 
1 1 1   10    8  -48 o   38.788   3.3953   61.949   10.627  103.122   16.657   33.687   13.801   50.036   4.1205   28.087   6.1946 21.94957 7.439899 
1 1 1   10    8  -47 o   45.321   2.4727   84.075   9.1005   67.911   13.647   97.019   12.212   40.528   4.1912   48.641   3.0962 -8.112450 5.210821 
1 1 1   10    8  -46 o   44.480   2.5566   81.014   9.2308   93.808   14.086   71.384   12.221   47.771   3.6447   41.635   3.6373 6.135681 5.149188 
1 1 1   10    8  -45 o   58.418   2.3310  139.462   11.078  122.939   17.902  149.715   14.102   54.683   4.0448   60.490   2.8681 -5.806911 4.958441 
1 1 1   10    8  -44 o  243.077   2.0953  2410.28   41.517  2385.69   59.607  2433.44   57.860  241.721   3.0251  244.145   2.9073 -2.423798 4.195704 
1 1 1   10    8  -43 o  128.034   2.2251  668.773   23.223  784.756   39.016  605.135   28.900  138.599   3.4534  121.748   2.9120 16.85011 4.517273 
1 1 1   10    8  -42 o   52.312   2.4547  111.911   10.438   85.160   17.831  125.858   12.875   45.344   4.9021   55.452   2.8580 -10.10821 5.674367 
1 1 1   10    8  -41 o   96.181   1.5989  377.221   12.536  370.980   18.635  382.380   16.942   95.323   2.4002   96.818   2.1468 -1.494598 3.220152 
1 1 1   10    8  -40 o  141.680   1.5097  818.482   17.435  820.178   25.507  816.994   23.887  141.793   2.2068  141.525   2.0706 0.2679138 3.026089 
1 1 1   10    8  -39 o   54.266   2.0358  120.278   8.9893  114.452   13.590  124.811   11.986   52.850   3.1691   55.238   2.6699 -2.388710 4.143827 
1 1 1   10    8  -38 o   85.757   1.7056  299.894   11.923  323.504   20.773  288.296   14.560   88.981   2.8677   84.044   2.1270 4.937660 3.570452 
1 1 1   10    8  -37 o   74.280   1.8360  225.006   11.117  215.524   18.687  230.200   13.830   72.588   3.1657   75.087   2.2621 -2.498978 3.890903 
1 1 1   10    8  -36 o  224.548   1.8324  2056.21   33.539  2017.72   52.118  2083.41   43.818  222.345   2.8756  225.985   2.3787 -3.639572 3.731889 
1 1 1   10    8  -35 o   95.053   1.5215  368.389   11.789  346.642   17.280  387.325   16.124   92.183   2.2996   97.451   2.0298 -5.268738 3.067283 
1 1 1   10    8  -34 o  172.911   1.5340  1219.04   21.621  1229.55   31.427  1209.60   29.792  173.619   2.2206  172.211   2.1223 1.408264 3.071638 
1 1 1   10    8  -33 o  120.056   1.4533  587.646   14.223  549.034   20.430  623.959   19.812  116.021   2.1602  123.692   1.9650 -7.671272 2.920200 
1 1 1   10    8  -32 o  138.783   1.4573  785.274   16.486  804.990   24.203  768.211   22.516  140.489   2.1135  137.246   2.0126 3.242493 2.918482 
1 1 1   10    8  -31 o   83.078   1.5570  281.413   10.545  291.840   15.748  272.938   14.197   84.555   2.2869   81.777   2.1316 2.777618 3.126246 
1 1 1   10    8  -30 o   87.540   1.5137  312.444   10.802  312.052   15.940  312.777   14.689   87.439   2.2383   87.574   2.0576 -0.1352158 3.040343 
1 1 1   10    8  -29 o   82.481   1.5477  277.374   10.405  272.991   15.285  281.159   14.205   81.777   2.2953   83.003   2.1012 -1.225754 3.111810 
1 1 1   10    8  -28 o  106.748   1.4612  464.582   12.715  452.290   18.407  475.799   17.584  105.307   2.1443  108.014   1.9971 -2.707031 2.930309 
1 1 1   10    8  -27 o  327.978   2.1628  4387.25   57.823  4358.49   81.864  4415.88   81.684  326.788   3.0732  328.937   3.0464 -2.148346 4.327271 
1 1 1   10    8  -26 o  116.694   1.4501  555.181   13.794  537.591   19.900  571.449   19.138  114.811   2.1264  118.376   1.9833 -3.565193 2.907768 
1 1 1   10    8  -25 o  212.995   1.7475  1849.84   30.341  1888.52   46.986  1822.18   39.736  215.148   2.6791  211.363   2.3063 3.785172 3.535070 
1 1 1   10    8  -24 o  256.688   2.0947  2687.08   43.830  2598.00   60.863  2783.04   63.171  252.320   2.9591  261.151   2.9675 -8.830322 4.190772 
1 1 1   10    8  -23 o  278.737   2.2074  3168.73   50.155  3196.04   71.560  3142.36   70.317  279.839   3.1371  277.483   3.1088 2.356354 4.416539 
1 1 1   10    8  -22 o   79.220   1.8996  255.911   12.267  287.061   19.875  236.743   15.590   83.825   2.9131   76.140   2.5154 7.684792 3.848806 
1 1 1   10    8  -21 o  214.826   2.3065  1882.32   40.390  1868.29   56.922  1896.54   57.320  213.947   3.2639  215.558   3.2621 -1.611603 4.614624 
1 1 1   10    8  -20 o   44.952   3.0488   82.839   11.105   73.486   14.918   94.463   16.632   42.180   4.4037   47.891   4.3063 -5.711525 6.159288 
1 1 1   10    8  -19 o  140.194   2.3242  801.639   26.561  777.169   43.347  816.350   33.610  137.897   3.8600  141.446   2.9150 -3.548325 4.837047 
1 1 1   10    8  -18 o   57.562   2.5355  135.421   11.868  137.831   16.045  132.509   17.635   58.009   3.4083   56.836   3.8287 1.172741 5.125910 
1 1 1   10    8  -17 o  141.452   2.0244  815.936   23.343  794.056   32.044  840.673   34.072  139.507   2.8179  143.539   2.9120 -4.031555 4.052172 
1 1 1   10    8  -16 o  121.693   1.7672  603.831   17.531  617.907   27.629  594.346   22.681  123.068   2.7542  120.716   2.3049 2.351288 3.591389 
1 1 1   10    8  -15 o  125.140   1.7653  638.520   18.008  626.687   28.020  646.846   23.505  123.939   2.7735  125.936   2.2897 -1.997475 3.596502 
1 1 1   10    8  -14 o  121.984   2.0029  606.789   19.916  687.532   29.023  534.933   27.379  129.818   2.7426  114.463   2.9368 15.35497 4.018302 
1 1 1   10    8  -13 o  257.826   2.2970  2711.14   48.276  2862.43   79.105  2621.35   60.940  264.786   3.6650  253.466   2.9495 11.31993 4.704428 
1 1 1   10    8  -12 o  167.960   1.7045  1150.21   23.337  1230.47   41.704  1113.62   28.159  173.658   2.9461  165.252   2.0904 8.406403 3.612357 
1 1 1   10    8  -11 o  118.961   1.6122  576.975   15.634  587.227   27.352  572.000   19.053  119.974   2.7968  118.438   1.9735 1.536659 3.422945 
1 1 1   10    8  -10 o   28.842   3.4714   34.445   7.9977   43.405   13.781   29.894   9.8209   32.134   5.4558   26.657   4.6908 5.477064 7.195079 
1 1 1   10    8   -9 o   87.255   1.6910  310.410   12.028  306.790   20.933  312.194   14.695   86.662   2.9676   87.497   2.0604 -0.8355331 3.612768 
1 1 1   10    8   -8 o  204.320   1.8421  1702.19   30.681  1738.41   53.836  1684.77   37.337  206.396   3.1999  203.250   2.2536 3.145142 3.913819 
1 1 1   10    8   -7 o  100.047   1.6524  408.093   13.476  403.144   23.261  410.594   16.534   99.364   2.8748  100.345   2.0214 -0.9812469 3.514333 
1 1 1   10    8   -6 o  167.271   1.7136  1140.79   23.366  1095.29   39.581  1165.12   28.948  163.844   2.9636  169.031   2.1009 -5.186996 3.632737 
1 1 1   10    8   -5 o  376.466   2.7680  5781.75   84.944  5630.09  144.100  5862.52  105.157  371.158   4.7629  378.996   3.4038 -7.838165 5.854167 
1 1 1   10    8   -4 o  376.324   3.0302  5778.44   92.954  6076.15  215.586  5710.46  103.022  385.013   6.8692  374.053   3.3788 10.96045 7.655241 
1 1 1   10    8   -3 o  163.540   1.8595  1090.53   24.789  1096.77   54.969  1088.94   27.774  163.823   4.1196  163.412   2.0850 0.4106445 4.617169 
1 1 1   10    8   -2 o   59.281   2.2199  143.518   10.708  178.029   23.814  134.771   11.988   65.862   4.4620   57.424   2.5677 8.438622 5.148010 
1 1 1   10    8   -1 o  101.032   1.8016  416.193   14.837  387.024   32.126  424.103   16.728   97.266   4.0608  101.983   2.0123 -4.717064 4.532060 
1 1 1   10    8    0 o  142.757   1.6477  830.887   19.174  825.599   32.936  833.598   23.581  142.256   2.8403  142.978   2.0233 -0.7216034 3.487284 
1 1 1   10    8    1 o  238.062   2.1863  2311.20   42.426  2288.03   66.748  2326.90   54.956  236.764   3.4585  238.824   2.8229 -2.059677 4.464326 
1 1 1   10    8    2 o  115.539   1.8011  544.291   16.963  571.240   38.505  537.801   18.896  118.206   4.0019  114.842   2.0185 3.364151 4.482115 
1 1 1   10    8    3 o   14.933   5.2872   7.8813   8.0468   23.262   14.252   0.6830   9.7496   23.630   6.9421   12.917   5.4385 10.71323 8.818698 
1 1 1   10    8    4 o  221.811   2.1059  2006.35   38.076  2000.19   60.267  2010.44   49.122  221.381   3.3397  221.998   2.7145 -0.6172638 4.303715 
1 1 1   10    8    5 o  166.776   1.7110  1134.04   23.261  1112.38   39.993  1145.11   28.595  165.117   2.9714  167.574   2.0934 -2.456650 3.634729 
1 1 1   10    8    6 o  131.601   1.5111  706.062   16.211  697.859   24.691  712.276   21.491  130.809   2.3156  132.165   1.9948 -1.355377 3.056378 
1 1 1   10    8    7 o  104.763   1.5255  447.455   13.027  448.723   19.977  446.518   17.184  104.892   2.3364  104.643   2.0145 0.2490845 3.084998 
1 1 1   10    8    8 o  174.865   1.6103  1246.67   22.954  1297.14   35.846  1211.59   29.885  178.332   2.4659  172.367   2.1269 5.964462 3.256482 
1 1 1   10    8    9 o   36.223   2.9346   53.884   8.5909   50.764   12.243   56.911   12.058   34.978   4.3904   37.111   4.0517 -2.132683 5.974272 
1 1 1   10    8   10 o  291.184   2.1116  3457.66   50.120  3463.34   76.728  3453.43   66.193  291.315   3.2311  290.946   2.7910 0.3693848 4.269690 
1 1 1   10    8   11 o  295.346   2.1306  3557.24   51.293  3583.07   78.839  3538.28   67.543  296.303   3.2641  294.495   2.8136 1.807526 4.309413 
1 1 1   10    8   12 o  179.646   1.6222  1315.79   23.756  1294.39   36.132  1332.09   31.529  178.139   2.4882  180.733   2.1401 -2.594040 3.281972 
1 1 1   10    8   13 o  141.896   1.5375  820.875   17.783  803.614   27.181  833.793   23.515  140.367   2.3755  142.993   2.0174 -2.625641 3.116564 
1 1 1   10    8   14 o  421.722   3.3305  7258.96  114.491  7081.27  177.456  7385.66  149.851  416.097   5.2319  425.181   4.3236 -9.083893 6.787261 
1 1 1   10    8   15 o  103.654   1.6592  438.061   14.020  463.490   24.617  425.854   17.056  106.546   2.8369  102.190   2.0475 4.355873 3.498597 
1 1 1   10    8   16 o  140.597   1.6546  805.959   18.962  773.116   32.327  823.189   23.414  137.653   2.8810  142.079   2.0216 -4.426697 3.519515 
1 1 1   10    8   17 o  218.039   1.9087  1938.57   33.924  1953.65   59.090  1931.16   41.433  218.780   3.3134  217.596   2.3359 1.184326 4.053994 
1 1 1   10    8   18 o  138.360   1.6523  780.520   18.635  800.390   32.626  770.898   22.703  140.060   2.8577  137.492   2.0257 2.567810 3.502842 
1 1 1   10    8   19 o   49.589   2.3426  100.520   9.4424  106.144   13.438   95.035   13.271   50.893   3.2562   48.131   3.4045 2.761635 4.711016 
1 1 1   10    8   20 o  168.029   1.8843  1151.28   25.809  1137.75   40.361  1160.64   33.570  166.980   2.9652  168.683   2.4414 -1.703247 3.840964 
1 1 1   10    8   21 o   88.300   1.7243  317.912   12.411  305.563   17.362  330.818   17.749   86.515   2.4644   90.025   2.4208 -3.509499 3.454500 
1 1 1   10    8   22 o   43.132   2.5226   76.149   8.8304   82.158   13.129   71.184   11.933   44.711   3.6335   41.605   3.5525 3.105637 5.081614 
1 1 1   10    8   23 o  113.694   1.6282  527.034   15.089  498.251   21.364  555.685   21.315  110.523   2.3714  116.724   2.2402 -6.201286 3.262218 
1 1 1   10    8   24 o   87.795   1.6962  314.283   12.139  315.907   17.666  312.830   16.708   87.968   2.4660   87.545   2.3434 0.4229050 3.401881 
1 1 1   10    8   25 o   28.442   3.4206   33.501   7.7716   24.383   12.394   39.407   9.9764   23.958   6.2736   30.793   4.0744 -6.834688 7.480602 
1 1 1   10    8   26 o  195.980   1.8260  1566.17   29.171  1544.61   41.193  1587.86   41.316  194.579   2.5971  197.287   2.5691 -2.707687 3.653151 
1 1 1   10    8   27 o  273.947   2.1929  3060.86   48.970  3027.69   68.906  3094.71   69.606  272.363   3.1037  275.361   3.1010 -2.998230 4.387383 
1 1 1   10    8   28 o  204.147   1.8581  1699.47   30.921  1687.18   43.825  1711.65   43.634  203.355   2.6438  204.827   2.6134 -1.471863 3.717437 
1 1 1   10    8   29 o   80.191   1.8185  262.220   11.887  251.276   17.105  272.442   16.531   78.431   2.6794   81.683   2.4856 -3.252411 3.654799 
1 1 1   10    8   30 o  211.121   2.0752  1817.82   35.713  1727.10   55.336  1882.57   46.753  205.684   3.3004  214.802   2.6701 -9.118820 4.245272 
1 1 1   10    8   31 o   57.843   2.1538  136.654   10.137  148.061   15.016  127.099   13.742   60.151   3.0726   55.721   3.0370 4.429512 4.320194 
1 1 1   10    8   32 o  347.448   2.6074  4925.44   73.848  4904.36  104.383  4946.56  104.491  346.519   3.6954  348.009   3.6834 -1.490051 5.217640 
1 1 1   10    8   33 o  168.937   1.7483  1163.76   24.075  1166.70   34.522  1160.98   33.592  169.107   2.5044  168.695   2.4428 0.4112549 3.498468 
1 1 1   10    8   34 o  282.250   2.2436  3249.58   51.619  3283.30   73.797  3217.27   72.228  283.594   3.1923  280.733   3.1563 2.860962 4.489224 
1 1 1   10    8   35 o   73.545   1.9024  220.729   11.395  217.072   16.679  223.930   15.605   72.878   2.8129   74.037   2.5896 -1.159370 3.823458 
1 1 1   10    8   36 o   98.940   1.7164  399.173   13.843  378.520   19.793  418.947   19.367   96.286   2.5241  101.339   2.3445 -5.053513 3.444953 
1 1 1   10    8   37 o   50.851   2.3749  105.721   9.8168  118.882   14.683   95.083   13.201   53.852   3.3617   48.135   3.3859 5.716602 4.771360 
1 1 1   10    8   38 o  221.509   2.1425  2001.42   38.685  2009.70   62.254  1996.21   49.375  221.826   3.4429  221.164   2.7388 0.6617279 4.399345 
1 1 1   10    8   39 o   78.485   1.9139  251.225   12.245  252.462   22.447  250.700   14.610   78.539   3.5151   78.358   2.2897 0.1801605 4.195119 
1 1 1   10    8   40 o  147.170   1.6473  883.208   19.762  897.904   32.533  874.615   24.877  148.328   2.6907  146.430   2.0842 1.897156 3.403459 
1 1 1   10    8   41 o  185.023   1.6186  1395.97   24.413  1388.84   35.696  1402.23   33.461  184.498   2.3735  185.398   2.2141 -0.9002380 3.245907 
1 1 1   10    8   42 o   80.104   2.1480  261.950   14.013  243.251   22.254  274.236   18.039   77.078   3.5515   81.924   2.7049 -4.845947 4.464277 
1 1 1   10    8   43 o  206.199   2.1658  1734.51   36.403  1688.81   60.311  1760.69   45.657  203.295   3.6394  207.697   2.6968 -4.402359 4.529685 
1 1 1   10    8   44 o   46.436   3.3862   88.548   12.729   54.908   24.349  101.200   14.932   35.749   8.4838   49.624   3.7185 -13.87540 9.262994 
1 1 1   10    8   45 o   83.041   2.3042  281.569   15.582  232.346   33.351  295.316   17.624   75.079   5.4874   85.028   2.5457 -9.949333 6.049103 
1 1 1   10    8   46 o   89.610   1.9450  327.537   14.207  314.802   22.167  336.414   18.508   87.742   3.1042   90.758   2.5041 -3.015678 3.988302 
1 1 1   10    8   47 o   93.686   1.7333  357.965   13.237  371.069   22.236  350.772   16.473   95.289   2.8660   92.723   2.1795 2.566284 3.600572 
1 1 1   10    8   48 o  112.341   1.6390  514.695   15.009  564.642   25.639  488.655   18.513  117.606   2.6745  109.442   2.0752 8.163757 3.385133 
1 1 1   10    8   49 o  103.469   1.8643  436.707   15.724  438.444   23.777  435.357   20.963  103.582   2.8187  103.276   2.4901 0.3058090 3.761047 
1 1 1   10    8   50 o   80.370   1.7751  263.471   11.629  266.850   20.266  261.811   14.200   80.761   3.0840   80.071   2.1776 0.6903763 3.775354 
1 1 1   10    8   51 o   84.672   1.7145  292.429   11.834  298.560   20.467  289.350   14.504   85.441   2.9431   84.182   2.1153 1.258881 3.624424 
1 1 1   10    8   52 o   24.456   4.1444   25.161   7.9674   14.016   14.641   29.850   9.4965   19.920   7.1237   26.623   4.5386 -6.702089 8.446672 
1 1 1   10    8   53 o  136.773   1.5979  762.996   17.815  749.504   28.996  771.178   22.580  135.476   2.6257  137.475   2.0150 -1.999817 3.309733 
1 1 1   10    8   54 o  154.158   1.6180  969.335   20.333  988.168   33.188  958.019   25.726  155.552   2.6174  153.219   2.0598 2.332626 3.330710 
1 1 1   10    8   55 o   41.038   2.6343   69.066   8.7657   66.347   16.155   70.200   10.435   39.875   5.0857   41.324   3.1211 -1.448807 5.967043 
1 1 1   10    8   56 o   70.178   2.1866  201.232   12.493  219.151   18.950  187.457   16.615   73.140   3.1861   67.653   3.0206 5.487488 4.390355 
1 1 1   10    8   57 o   53.482   2.5760  117.110   11.197  124.630   16.993  111.340   14.885   55.033   3.8117   52.039   3.5300 2.993927 5.195181 
1 1 1   10    8   58 o   28.069   5.0939   33.387   11.226   37.487   14.976   28.128   16.961   29.559   6.4011   25.776   7.5734 3.783115 9.916127 
1 1 1   10    8   59 o   53.172   2.3241  115.682   10.049  114.056   16.953  116.562   12.477   52.597   3.9838   53.319   2.8815 -0.7217255 4.916677 
1 1 1   10    8   60 o   27.081   4.1272   30.761   8.8232   28.066   14.814   32.243   10.984   25.581   6.9328   27.566   5.0751 -1.985302 8.591879 
1 1 1   10    8   61 o   62.889   2.4118  161.811   12.341  168.306   22.794  159.117   14.679   63.865   4.4054   62.311   2.8979 1.554054 5.273094 
1 1 1   10    8   62 o   45.774   2.6284   85.925   9.7660   81.161   15.641   88.969   12.503   44.232   4.3961   46.497   3.3206 -2.264904 5.509275 
1 1 1   10    8   63 o   68.124   1.9802  189.640   10.985  199.913   18.387  183.938   13.698   69.799   3.2405   67.039   2.5111 2.760292 4.099521 
1 1 1   10    8   64 o   91.828   1.7613  344.181   13.184  366.191   21.071  330.021   16.901   94.583   2.7358   89.843   2.3097 4.739830 3.580449 
1 1 1   10    8   65 o  129.956   1.6980  689.312   17.988  697.948   27.303  682.689   23.910  130.648   2.5638  129.257   2.2693 1.390656 3.423811 
1 1 1   10    8   66 o   55.013   2.1675  123.845   9.7010  125.667   16.846  122.941   11.866   55.197   3.7667   54.756   2.6665 0.4412537 4.615024 
1 1 1   10    8   67 o  180.336   1.8512  1328.01   27.213  1319.38   34.843  1341.51   43.574  179.638   2.3795  180.984   2.9536 -1.346237 3.792840 
1 1 1   10    8   68 f  103.891   1.6548  440.629   14.014  451.383   20.716  431.555   19.029  105.054   2.4191  102.742   2.2722 2.312157 3.318850 
1 1 1   10    8   69 o   86.839   1.7232  307.933   12.198  321.740   18.873  298.029   15.985   88.616   2.6156   85.337   2.3001 3.279594 3.483080 
1 1 1   10    8   70 o   25.627   3.3670   27.425   6.8634   10.272   13.074   33.951   8.0639   17.820   6.6726   28.526   3.5441 -10.70638 7.555403 
1 1 1   10    8   71 o  103.184   1.6143  434.767   13.578  439.845   20.000  430.425   18.493  103.671   2.3666  102.581   2.2116 1.089531 3.239153 
1 1 1   10    8   72 o   27.757   3.0504   32.002   6.7882   19.149   14.488   35.617   7.6838   21.610   7.1074   29.261   3.2777 -7.650822 7.826791 
1 1 1   10    8   73 o   31.999   2.5060   42.205   6.4846   46.687   12.332   40.492   7.6235   33.234   4.6819   31.257   3.0301 1.977142 5.576874 
1 1 1   10    8   74 o   81.720   1.9553  273.131   13.025  273.280   16.111  272.850   22.130   81.632   2.4239   81.342   3.3448 0.2900543 4.130724 
1 1 1   10    8   75 o   48.389   2.8149   96.492   11.055   82.350   14.172  118.477   17.670   44.443   3.9531   53.329   4.0961 -8.885723 5.692528 
1 1 1   10    8   76 o   15.041   5.6786   7.1692   9.5113   9.2235   12.483   4.3261   14.685   17.074   6.4918   16.412   6.7729 0.6623058 9.381722 
1 1 1   10    8   77 o   54.397   3.3665  122.610   14.855  143.494   18.342   82.804   25.323   58.720   3.8533   43.220   7.4573 15.50041 8.393971 
1 1 1   10    8   78 o   97.101   2.2166  386.617   17.545  402.780   25.094  371.158   24.541   98.770   3.1207   94.786   3.1807 3.983971 4.455928 
1 1 1   10    8   79 o   14.003   5.5824   4.6728   9.5848   6.2496   12.728   2.6073   14.567   16.043   6.4204   15.780   6.6460 0.2627544 9.240716 
1 1 1   10    8   80 o   60.900   2.2310  152.430   11.057  150.187   13.781  156.484   18.523   60.302   2.8113   61.254   3.7273 -0.9519806 4.668674 
1 1 1   10    8   81 o   95.885   1.8365  376.666   14.354  373.938   17.785  381.765   24.314   95.401   2.2869   96.021   3.1105 -0.6198807 3.860703 
1 1 1   10    8   82 f   43.486   2.9875   78.561   10.525   78.047   13.829   79.268   16.227   43.028   3.9882   43.096   4.6951 -0.6813049E-01 6.160316 
1 1 1   10    8   83 o   30.537   3.6640   39.421   8.9386   41.178   11.351   36.551   14.503   30.897   4.6509   28.434   6.4110 2.462959 7.920280 
1 1 1   10    8   84 o   48.923   2.7352   99.217   10.864  103.338   12.388   85.488   22.611   49.827   3.0649   43.711   6.5473 6.115753 7.229122 
1 1 1   10    8   85 f   35.915   3.4912   54.308   10.092   52.063   11.354   62.758   22.026   34.963   4.0592   36.668   7.6181 -1.705479 8.632097 
1 1 1   10    8   86 o   70.233   2.2087  203.307   12.629  209.433   14.269  181.160   27.130   71.189   2.4627   64.687   5.1887 6.502228 5.743500 
1 1 1   10    8   87 o   34.747   3.2373   50.762   9.0637   39.554   11.015   74.266   15.951   30.141   4.6310   41.392   4.8174 -11.25102 6.682384 
1 1 1   10    8   88 o   21.006   4.9099   19.697   8.2553   21.032   10.569   17.607   13.221   21.488   5.8693   20.029   6.7935 1.458858 8.977780 
1 1 1   10    8   89 o   24.157   4.3133   25.527   8.1817   23.291   10.665   28.725   12.755   22.569   5.7742   24.893   6.2856 -2.324636 8.535211 
1 1 1   10    8   90 o   12.020   4.9393   2.7264   7.7663   0.2807   9.9639   6.5122   12.397   12.449   5.3759   15.586   6.3017 -3.136850 8.283194 
1 1 1   10    8   91 o   17.726   5.4497   14.008   8.6373   11.935   10.180   19.339   16.321   16.938   5.9512   20.935   7.5171 -3.997082 9.587637 
1 1 1   10    8   92 o   24.559   4.7470   26.867   9.1593   30.079   10.891   19.106   16.930   25.750   5.3630   20.871   7.6330 4.878464 9.328681 
1 1 1   10    8   93 o   13.047   5.2960   4.0766   8.7951   8.8688   10.640  -6.2617   15.628   15.688   5.9866   13.730   6.2704 1.958058 8.669337 
1 1 1   10    8   94 f   11.740   4.9017   2.1217   7.8187   7.0430   10.211  -4.8537   12.156   14.780   5.8027   12.249   5.5694 2.531405 8.042978 
1 1 1   10    8   95 o   24.808   4.2129   27.162   8.2150   11.355   10.836   48.529   12.598   16.649   6.1037   32.985   4.8284 -16.33561 7.782609 
1 1 1   10    8   96 o   13.557   5.1584   6.5198   7.8851  -1.6779   10.560   16.848   11.854   12.055   5.3586   19.078   6.4329 -7.022519 8.372376 
1 1 1   10    8   97 o   19.208   5.0686   17.093   8.0501   24.352   10.795   7.9999   12.083   22.611   5.8221   15.598   6.2511 7.012636 8.542409 
1 1 1   10    8   98 o   24.586   4.2341   27.018   8.1794   36.460   11.111   15.847   12.085   28.189   5.0195   18.474   6.4848 9.715025 8.200502 
1 1 1   10    8   99 o   18.881   5.1017   16.753   8.0366   26.495   10.946   5.3625   11.837   23.428   5.7703   14.490   6.0390 8.938208 8.352641 
1 1 1   10    8  100 o   23.582   4.7765   25.744   8.8669   16.676   12.508   34.905   12.572   18.623   6.5921   26.775   5.9177 -8.152124 8.858584 
1 1 1   10    8  101 o   11.665   4.9742   1.8456   8.3326 -12.8119   11.730   16.775   11.839   10.222   4.9008   18.531   6.4240 -8.308835 8.079914 
1 1 1   10    8  102 o   23.017   4.8457   24.913   8.8035   26.623   12.390   23.169   12.511   22.758   6.4080   21.158   6.5684 1.599798 9.176444 
1 1 1   10    8  103 f   37.499   2.8919   60.315   8.7714   53.369   11.696   69.243   13.260   34.278   4.2788   39.138   4.2232 -4.859756 6.011955 
1 1 1   10    8  104 f   17.996   5.1372   15.808   7.9075   11.070   10.522   21.958   11.987   15.705   5.9626   20.399   6.4435 -4.693968 8.779045 
1 1 1   10    8  105 o   20.740   5.1281   21.061   8.6200   18.397   11.919   23.983   12.481   18.754   6.4483   21.121   6.5612 -2.366453 9.199440 
1 1 1   10    8  106 o   13.474   5.3015   6.9827   8.5395   14.290   11.811  -1.0202   12.361   17.008   6.3475   12.527   5.6640 4.480626 8.507145 
1 1 1   10    8  107 o   13.505   5.3059   7.1155   8.5430   8.0038   11.714   6.1065   12.486   14.710   6.0577   14.348   6.1027 0.3619061 8.598818 
1 1 1   10    8  108 o   16.666   5.8556   13.927   9.8551   0.4937   11.889   43.432   17.619   12.612   5.6405   27.043   7.6512 -14.43085 9.505532 
1 1 1   10    8  109 o   14.152   5.6656   8.0242   9.9142   13.513   12.050  -3.4739   17.441   16.544   6.3565   13.734   6.3961 2.810552 9.017491 
1 1 1   10    8  110 o   14.086   5.7528   7.5309   10.454  -0.1447   12.970   21.764   17.662   12.812   5.7964   19.285   7.6131 -6.473690 9.568583 
1 1 1   10    8  111 o   19.528   6.1241   20.578   10.847   5.9732   13.543   46.704   18.114   14.408   6.2446   27.684   7.7316 -13.27614 9.938469 
1 1 1   10    8  112 o   18.514   7.4210   19.663   17.031   19.663   17.031   0.0000   0.0000   18.514   7.4210  ?   ?  0.000000 7.420966 
1 1 1   10    8  113 o   31.445   4.6282   47.317   11.509   33.545   14.514   70.636   18.887   23.942   6.9982   35.842   6.7111 -11.90034 9.696037 
1 1 1   10    8  114 o   15.074   5.9016   10.625   10.537  -0.5264   13.170   30.462   17.565   12.661   5.7722   21.638   7.7947 -8.977553 9.699294 
1 1 1   10    8  115 o   17.298   6.7540   16.391   13.770   24.025   17.128   2.4441   23.152   19.550   7.5607   15.598   7.2986 3.952565 10.50876 
1 1 1   10    8  116 o   13.176   6.1198  -2.0190   15.800 -29.6686   21.339   31.535   23.507   11.739   5.8268   20.683   8.5556 -8.943719 10.35133 
1 1 1   10    8  117 o   12.038   5.9436 -25.4007   21.152 -25.4007   21.152   0.0000   0.0000   12.038   5.9436  ?   ?  0.000000 5.943624 
1 1 1   10    9 -115 o   16.431   6.9151   13.269   15.751   13.269   15.751   0.0000   0.0000   16.431   6.9151  ?   ?  0.000000 6.915072 
1 1 1   10    9 -114 o   13.098   5.8723   2.2238   12.971   2.2238   12.971   0.0000   0.0000   13.098   5.8723  ?   ?  0.000000 5.872297 
1 1 1   10    9 -113 o   11.400   5.3829  -6.6374   13.105  -6.6374   13.105   0.0000   0.0000   11.400   5.3829  ?   ?  0.000000 5.382942 
1 1 1   10    9 -112 o   18.869   6.8535   20.897   13.615   20.897   13.615   0.0000   0.0000   18.869   6.8535  ?   ?  0.000000 6.853465 
1 1 1   10    9 -111 o   11.783   5.3905  -1.7207   11.614   4.2336   13.229 -21.7359   24.254   13.730   6.0553   13.256   6.5095 0.4738722 8.890452 
1 1 1   10    9 -110 o   16.211   6.0852   13.416   10.888   12.151   13.678   15.604   17.986   16.021   6.5660   17.358   7.3515 -1.337450 9.856844 
1 1 1   10    9 -109 o   22.288   5.9325   26.515   10.968   27.340   14.000   25.204   17.648   21.551   6.9800   20.055   7.6959 1.496050 10.38977 
1 1 1   10    9 -108 o   10.924   5.0502  -3.8406   10.572  -1.6027   13.472  -7.4273   17.055   12.632   5.7888   12.897   6.1053 -0.2658339 8.413352 
1 1 1   10    9 -107 o   18.118   6.0840   17.451   10.603   29.514   13.283  -3.7380   17.604   22.894   6.6956   13.672   6.3866 9.221951 9.253038 
1 1 1   10    9 -106 o   12.201   5.4619   0.2705   11.177 -13.5569   14.613   19.763   17.350   11.179   5.3876   18.721   7.4948 -7.542001 9.230282 
1 1 1   10    9 -105 o   14.450   5.9055   8.0132   11.026   5.6034   14.533   11.281   16.923   14.690   6.4164   16.559   7.0759 -1.868985 9.551913 
1 1 1   10    9 -104 o   20.047   6.1922   21.367   11.135   17.059   14.587   27.383   17.238   18.045   6.9776   21.335   7.7170 -3.289942 10.40374 
1 1 1   10    9 -103 o   52.693   2.8727  119.542   12.292  106.257   15.188  144.769   20.929   48.641   3.8622   55.684   4.6533 -7.043491 6.047317 
1 1 1   10    9 -102 o   39.797   3.2743   69.306   10.528   61.644   15.845   75.363   14.088   35.222   5.7144   40.505   4.3340 -5.282188 7.172031 
1 1 1   10    9 -101 o   12.328   4.9707   4.8655   7.6899  -5.0703   12.550   10.839   9.7308   11.816   5.4763   15.446   5.7620 -3.630484 7.949263 
1 1 1   10    9 -100 o   21.440   4.7094   21.751   8.0050   29.577   13.015   16.989   10.153   23.683   6.5308   18.384   5.9433 5.299400 8.830277 
1 1 1   10    9  -99 o   21.838   4.2822   21.917   7.3503   9.4583   10.924   32.224   9.9357   15.317   6.0054   26.229   4.8248 -10.91215 7.703473 
1 1 1   10    9  -98 o   12.596   4.9923   5.1920   7.6225  -0.1322   12.121   8.6749   9.8037   12.913   5.7403   14.809   5.7220 -1.896005 8.105095 
1 1 1   10    9  -97 o   31.222   3.6243   42.697   9.0529   63.781   17.114   34.505   10.668   36.287   5.9950   27.209   4.9936 9.078140 7.802296 
1 1 1   10    9  -96 o   40.945   2.6769   70.835   8.8854   78.199   14.073   65.953   11.458   42.013   4.1639   38.917   3.6547 3.096085 5.540299 
1 1 1   10    9  -95 o   28.923   3.4435   36.238   7.9594   26.956   11.605   44.481   10.937   23.530   6.0251   31.552   4.3697 -8.021629 7.442847 
1 1 1   10    9  -94 o   38.156   2.6670   61.286   8.2430   72.022   11.970   51.602   11.368   40.843   3.6331   34.226   4.1600 6.616768 5.523191 
1 1 1   10    9  -93 o   33.274   2.9740   46.939   7.9814   52.941   11.536   41.429   11.054   34.744   4.1556   30.449   4.5967 4.294842 6.196653 
1 1 1   10    9  -92 o   61.721   2.0281  157.655   10.190  149.995   13.599  167.462   15.387   59.792   2.7979   63.050   3.0026 -3.257324 4.104156 
1 1 1   10    9  -91 o   30.526   3.4286   39.864   8.3841   39.951   11.127   39.751   12.753   29.960   4.7114   29.446   5.5157 0.5133495 7.253954 
1 1 1   10    9  -90 o   73.478   1.8310  222.339   10.967  222.233   14.660  222.473   16.527   73.118   2.4631   72.960   2.7840 0.1574020 3.717229 
1 1 1   10    9  -89 o   16.803   5.1705   12.564   7.7726  -1.5816   10.426   30.260   11.662   12.118   5.3587   25.617   5.7285 -13.49862 7.844230 
1 1 1   10    9  -88 o   27.588   3.6760   32.687   8.0612   23.583   10.660   44.847   12.320   22.606   5.7670   31.821   4.9072 -9.215017 7.572304 
1 1 1   10    9  -87 o   13.820   5.2281   6.5876   8.0717   1.7724   10.052   15.327   13.542   12.943   5.4894   19.026   6.8454 -6.082879 8.774604 
1 1 1   10    9  -86 o   29.884   3.6720   38.174   8.7571   41.247   10.966   32.767   14.548   30.735   4.5113   26.351   6.7450 4.384182 8.114657 
1 1 1   10    9  -85 o   43.719   2.4446   79.299   8.6773   74.719   11.704   84.888   12.931   42.071   3.4428   44.802   3.5702 -2.731010 4.959791 
1 1 1   10    9  -84 o   44.407   2.5996   81.924   9.3690   86.931   13.580   77.375   12.943   45.314   3.7088   42.715   3.7553 2.598862 5.278078 
1 1 1   10    9  -83 o   29.806   3.4030   37.591   8.1200   39.025   11.040   35.902   11.985   29.910   4.6813   28.380   5.3777 1.530409 7.129792 
1 1 1   10    9  -82 o   24.942   4.0029   26.801   7.8633   23.547   10.561   30.850   11.779   22.835   5.6938   26.188   5.6815 -3.352880 8.043498 
1 1 1   10    9  -81 o   28.480   3.9160   34.644   8.8505   43.767   11.134   18.981   14.588   31.893   4.3997   20.932   7.1357 10.96105 8.383031 
1 1 1   10    9  -80 o   30.786   3.6401   40.105   8.9584   33.842   11.304   50.679   14.688   27.724   5.1929   33.943   5.4965 -6.218994 7.561572 
1 1 1   10    9  -79 o   12.983   5.1850   4.0644   8.2836   5.7682   10.509   1.2690   13.461   14.753   5.8572   14.743   6.3056 0.1005363E-01 8.606267 
1 1 1   10    9  -78 o   33.262   3.3739   46.399   9.0213   44.712   11.465   49.142   14.617   32.306   4.4737   33.488   5.5488 -1.182091 7.127652 
1 1 1   10    9  -77 o   12.061   4.9071   2.7454   7.5718   6.4232   10.428  -1.3561   11.012   15.019   5.8736   12.780   5.5838 2.238712 8.104263 
1 1 1   10    9  -76 o   52.388   2.1988  112.842   9.3688  121.613   12.812  102.764   13.734   54.214   2.9099   49.680   3.4122 4.533905 4.484485 
1 1 1   10    9  -75 o   52.428   2.2171  112.981   9.4537  119.929   13.042  105.288   13.723   53.839   2.9834   50.331   3.3643 3.507629 4.496533 
1 1 1   10    9  -74 o   24.656   5.0083   26.422   9.7219   2.5416   16.679   38.709   11.964   16.722   7.0805   29.954   5.0815 -13.23197 8.715237 
1 1 1   10    9  -73 o   22.127   4.9026   21.285   8.6097   12.919   12.777   28.244   11.653   18.533   6.6514   25.355   5.7685 -6.821074 8.804379 
1 1 1   10    9  -72 o   65.150   1.6854  173.652   8.9434  155.232   15.857  182.245   10.830   61.293   3.1847   66.694   1.9944 -5.400471 3.757625 
1 1 1   10    9  -71 o   48.484   1.9937   96.359   7.8627   89.241   14.472   99.339   9.3655   46.284   3.8713   49.176   2.3431 -2.892193 4.525134 
1 1 1   10    9  -70 o   74.514   1.5565  226.822   9.4545  214.950   14.881  234.858   12.243   72.358   2.5269   75.742   1.9847 -3.384224 3.213090 
1 1 1   10    9  -69 o   39.146   2.2172   62.927   7.0460   70.547   12.444   59.331   8.5484   41.184   3.7477   37.923   2.7847 3.261131 4.669012 
1 1 1   10    9  -68 o   38.094   2.3300   59.631   7.2006   46.180   12.131   66.948   8.9473   33.067   4.6271   40.313   2.7390 -7.245808 5.377022 
1 1 1   10    9  -67 o   28.470   3.0264   33.637   6.9158   22.842   11.898   39.145   8.4990   22.945   6.2109   30.659   3.4611 -7.714214 7.110168 
1 1 1   10    9  -66 o  103.992   1.5175  441.509   12.864  418.693   19.453  459.239   17.148  101.149   2.3593  105.996   1.9847 -4.847351 3.083092 
1 1 1   10    9  -65 f   55.503   2.0798  126.107   9.3930  106.306   16.180  136.171   11.536   50.651   3.9501   57.630   2.4613 -6.978329 4.654149 
1 1 1   10    9  -64 o  102.314   1.7664  427.515   14.732  448.772   23.437  413.630   18.942  104.642   2.7500  100.567   2.3107 4.074699 3.591889 
1 1 1   10    9  -63 o   78.490   1.7686  251.567   11.316  246.087   19.483  254.357   13.901   77.419   3.0934   78.857   2.1645 -1.438103 3.775493 
1 1 1   10    9  -62 o  122.611   1.5970  613.611   15.961  574.243   25.455  639.118   20.489  118.465   2.6360  125.081   2.0096 -6.615730 3.314635 
1 1 1   10    9  -61 o   94.664   1.5794  365.729   12.187  367.724   19.026  364.341   15.871   94.800   2.4642   94.440   2.0616 0.3597488 3.212886 
1 1 1   10    9  -60 o   95.062   1.7572  368.898   13.616  359.467   27.646  371.919   15.646   93.530   3.6331   95.428   2.0113 -1.897263 4.152646 
1 1 1   10    9  -59 o   23.646   5.6888   24.055   10.831   15.789   19.368   27.816   13.065   21.849   8.1333   25.389   6.3339 -3.540302 10.30872 
1 1 1   10    9  -58 o  105.630   2.0138  455.604   17.339  446.770   29.215  460.409   21.544  104.359   3.4391  106.133   2.4902 -1.773895 4.245979 
1 1 1   10    9  -57 o  113.091   1.7046  521.938   15.714  572.123   31.657  505.529   18.102  118.154   3.2901  111.273   1.9957 6.880562 3.848050 
1 1 1   10    9  -56 o   32.315   3.2528   43.176   8.4520   41.427   15.413   43.928   10.107   31.086   6.2988   32.500   3.8925 -1.413574 7.404470 
1 1 1   10    9  -55 o   50.819   2.3115  105.700   9.5505   83.935   16.700  116.278   11.642   44.958   4.6227   53.268   2.6899 -8.310627 5.348405 
1 1 1   10    9  -54 o  115.247   1.7119  541.948   16.082  539.523   25.108  543.635   20.942  114.894   2.6809  115.381   2.2266 -0.4867401 3.484968 
1 1 1   10    9  -53 o   33.617   3.1573   46.635   8.5507   64.357   16.042   39.602   10.106   39.219   5.1417   30.804   4.1285 8.414583 6.594078 
1 1 1   10    9  -52 o   63.368   1.8193  163.992   9.3876  177.977   15.255  155.469   11.910   65.924   2.8455   61.654   2.3742 4.270672 3.705903 
1 1 1   10    9  -51 o  121.502   1.5043  602.157   14.899  576.831   22.130  623.152   20.149  118.859   2.2841  123.565   2.0004 -4.705956 3.036211 
1 1 1   10    9  -50 o   55.272   2.0607  124.859   9.2681  126.842   16.145  123.884   11.319   55.555   3.5842   55.017   2.5307 0.5387878 4.387603 
1 1 1   10    9  -49 o   25.295   3.8299   26.782   7.6500   29.026   13.138   25.631   9.4097   26.013   6.2700   24.562   4.8718 1.450987 7.940199 
1 1 1   10    9  -48 o   24.820   3.9506   25.842   7.7251   33.031   13.119   22.027   9.5579   27.798   5.9680   22.704   5.2667 5.094551 7.959594 
1 1 1   10    9  -47 o   58.399   1.9542  139.309   9.2898  155.362   14.992  129.303   11.836   61.588   2.9953   56.211   2.5901 5.376915 3.959823 
1 1 1   10    9  -46 o  209.912   1.6716  1797.32   28.602  1770.77   40.970  1822.56   39.949  208.267   2.4133  211.304   2.3193 -3.036804 3.347109 
1 1 1   10    9  -45 o  161.875   1.8214  1068.96   24.034  1040.01   29.236  1129.30   42.208  159.630   2.2468  166.235   3.1149 -6.605423 3.840644 
1 1 1   10    9  -44 o   77.803   1.8422  246.938   11.683  253.393   16.777  240.860   16.280   78.734   2.6177   76.761   2.6055 1.973083 3.693422 
1 1 1   10    9  -43 o   75.429   2.0419  232.302   12.543  224.947   19.815  237.219   16.203   74.118   3.2880   76.180   2.6131 -2.062897 4.199904 
1 1 1   10    9  -42 o  154.482   1.7876  973.417   22.511  958.499   33.322  985.942   30.531  153.220   2.6680  155.423   2.4098 -2.202759 3.595194 
1 1 1   10    9  -41 o  188.274   1.8703  1445.91   28.703  1465.33   42.420  1429.51   38.983  189.444   2.7470  187.136   2.5555 2.307724 3.751878 
1 1 1   10    9  -40 o  104.279   1.8475  443.540   15.705  450.764   24.112  438.218   20.697  105.033   2.8188  103.621   2.4503 1.412216 3.734883 
1 1 1   10    9  -39 o   18.952   5.6598   14.903   9.4101   24.675   13.957   6.7576   12.742   24.158   6.8009   16.595   6.4919 7.562870 9.401960 
1 1 1   10    9  -38 o  175.611   1.8705  1257.86   26.776  1264.62   39.681  1252.20   36.281  176.006   2.7658  175.162   2.5410 0.8444366 3.755796 
1 1 1   10    9  -37 o  181.194   2.0805  1339.30   30.729  1320.80   40.931  1363.19   46.517  179.875   2.7916  182.701   3.1234 -2.826752 4.189113 
1 1 1   10    9  -36 o   61.998   2.7899  157.218   14.063  127.086   20.012  186.620   19.768   55.554   4.4565   67.484   3.6066 -11.93000 5.733071 
1 1 1   10    9  -35 o  211.823   2.2089  1830.51   38.141  1800.81   50.561  1869.71   58.099  210.017   2.9534  213.947   3.3314 -3.929688 4.452074 
1 1 1   10    9  -34 o   71.479   2.3598  208.695   13.731  199.228   18.256  221.026   20.836   69.770   3.2186   73.470   3.4890 -3.700058 4.746861 
1 1 1   10    9  -33 o  173.719   1.7319  1230.71   24.524  1228.81   33.484  1232.92   36.020  173.540   2.3670  173.816   2.5422 -0.2758331 3.473564 
1 1 1   10    9  -32 o  123.234   1.5722  619.266   15.794  634.266   23.644  607.180   21.223  124.683   2.3263  122.002   2.1341 2.681305 3.156912 
1 1 1   10    9  -31 o   90.653   1.6758  335.120   12.384  319.521   18.570  347.613   16.618   88.449   2.5783   92.309   2.2085 -3.860626 3.394927 
1 1 1   10    9  -30 o  126.576   1.5461  653.282   15.952  639.257   23.608  665.065   21.639  125.176   2.3137  127.690   2.0789 -2.513893 3.110508 
1 1 1   10    9  -29 o   88.413   1.6458  318.749   11.861  314.016   17.879  322.470   15.852   87.690   2.5038   88.911   2.1872 -1.220566 3.324572 
1 1 1   10    9  -28 o  117.907   1.5804  566.865   15.189  568.884   23.703  565.458   19.786  118.080   2.4625  117.743   2.0616 0.3372269 3.211560 
1 1 1   10    9  -27 o  183.787   1.6692  1377.36   25.007  1424.29   38.980  1344.53   32.599  186.831   2.5595  181.551   2.2028 5.279846 3.376860 
1 1 1   10    9  -26 o  243.130   2.0565  2411.00   40.758  2436.15   57.904  2386.31   57.380  244.306   2.9076  241.794   2.9113 2.512192 4.114567 
1 1 1   10    9  -25 f  149.835   1.7109  915.476   20.896  899.193   29.154  932.678   29.965  148.460   2.4091  151.198   2.4313 -2.737656 3.422698 
1 1 1   10    9  -24 o  126.657   1.6937  654.138   17.486  660.784   24.732  647.494   24.727  127.269   2.3840  125.981   2.4078 1.287498 3.388395 
1 1 1   10    9  -23 o  169.186   1.7329  1167.21   23.898  1187.26   41.498  1157.26   29.232  170.550   2.9850  168.442   2.1290 2.108109 3.666446 
1 1 1   10    9  -22 o   48.942   2.3644   97.943   9.4048   95.134   15.919   99.449   11.657   48.074   4.1014   49.277   2.9150 -1.202374 5.031748 
1 1 1   10    9  -21 o  173.439   1.6161  1226.54   22.848  1196.77   34.467  1249.88   30.516  171.273   2.4688  175.054   2.1385 -3.780502 3.266237 
1 1 1   10    9  -20 o   21.554   4.4666   19.698   7.5895   8.1020   11.299   29.231   10.245   16.456   6.1943   26.303   4.9601 -9.847086 7.935486 
1 1 1   10    9  -19 o  164.923   1.7158  1109.10   23.066  1090.46   39.286  1118.91   28.495  163.457   2.9485  165.631   2.1105 -2.174042 3.625978 
1 1 1   10    9  -18 o  127.296   1.6513  660.729   17.134  629.350   28.899  677.741   21.278  124.184   2.8548  128.911   2.0249 -4.726646 3.500011 
1 1 1   10    9  -17 o   40.992   2.8888   68.915   9.5909   57.606   14.696   77.305   12.658   37.198   4.9710   43.358   3.6143 -6.159733 6.146096 
1 1 1   10    9  -16 o   81.196   1.9428  268.860   12.859  269.054   20.083  268.725   16.741   81.134   3.0420   81.120   2.5348 0.1471710E-01 3.959665 
1 1 1   10    9  -15 o  189.103   1.9657  1458.33   30.300  1469.41   47.952  1450.97   39.094  189.736   3.1004  188.587   2.5431 1.148972 4.009942 
1 1 1   10    9  -14 o   52.536   2.2450  112.781   9.5921  117.957   16.238  110.007   11.888   53.611   3.7392   51.845   2.8236 1.766266 4.685537 
1 1 1   10    9  -13 o  145.723   1.6664  865.855   19.794  856.642   33.978  870.589   24.354  144.886   2.8769  146.106   2.0449 -1.219666 3.529631 
1 1 1   10    9  -12 o   45.046   2.4685   83.025   9.0295   58.135   15.044   97.040   11.289   37.358   5.0710   48.681   2.8574 -11.32330 5.820628 
1 1 1   10    9  -11 o  201.336   1.8428  1652.99   30.245  1623.56   51.791  1668.22   37.257  199.436   3.1858  202.236   2.2601 -2.799866 3.906044 
1 1 1   10    9  -10 o   21.137   4.8230   19.001   8.1258   31.672   13.868   12.377   10.027   27.254   6.3592   17.847   5.9148 9.406460 8.684694 
1 1 1   10    9   -9 o   35.049   3.0408   50.511   8.6016   40.812   14.626   55.639   10.635   31.043   5.9973   36.738   3.5974 -5.695368 6.993478 
1 1 1   10    9   -8 o  122.558   1.6392  612.432   16.376  619.816   28.326  608.726   20.069  123.246   2.8195  122.174   2.0152 1.072662 3.465642 
1 1 1   10    9   -7 o   72.854   1.8268  216.570   10.841  228.107   18.808  210.831   13.266   74.695   3.0957   71.860   2.2675 2.835068 3.837326 
1 1 1   10    9   -6 o  102.312   1.6591  426.811   13.837  432.952   23.977  423.744   16.943  102.965   2.8594  101.934   2.0391 1.031937 3.512018 
1 1 1   10    9   -5 f   77.097   1.9699  242.552   12.370  306.040   29.626  229.148   13.613   86.440   4.2173   74.921   2.2315 11.51851 4.771266 
1 1 1   10    9   -4 o  189.083   1.9747  1458.00   30.436  1495.62   69.299  1449.01   33.878  191.288   4.4443  188.486   2.2050 2.801498 4.961224 
1 1 1   10    9   -3 o  187.636   1.9699  1435.77   30.130  1581.39   71.201  1404.00   33.254  196.697   4.4407  185.536   2.1988 11.16031 4.955275 
1 1 1   10    9   -2 o  277.684   2.7066  3146.06   61.266  3289.93  127.058  3102.48   69.933  283.494   5.4982  275.707   3.1117 7.787109 6.317685 
1 1 1   10    9   -1 o   69.806   1.8999  198.856   10.801  210.286   18.852  193.271   13.178   71.703   3.2337   68.795   2.3535 2.908180 3.999489 
1 1 1   10    9    0 o  133.004   1.6460  721.280   17.846  738.344   31.283  713.048   21.728  134.515   2.8530  132.230   2.0158 2.285553 3.493283 
1 1 1   10    9    1 o   83.400   1.7739  283.619   12.059  305.069   21.061  273.155   14.710   86.408   2.9946   81.807   2.2079 4.601273 3.720505 
1 1 1   10    9    2 o  316.555   2.9707  4089.39   76.656   0.0000   0.0000  4089.39   76.656  ?   ?   316.555   2.9707 0.000000 2.970717 
1 1 1   10    9    3 o  270.112   2.3797  2976.10   52.396  2936.88  116.084  2986.14   58.718  267.888   5.3160  270.539   2.6626 -2.650085 5.945505 
1 1 1   10    9    4 o   48.598   2.8956   96.716   11.419   87.804   22.676   99.744   13.217   45.875   6.2245   49.320   3.3066 -3.445957 7.048254 
1 1 1   10    9    5 f  136.885   1.8284  764.065   20.402  801.748   46.127  754.899   22.748  140.030   4.0453  136.053   2.0512 3.976715 4.535623 
1 1 1   10    9    6 o  118.732   1.6522  574.801   15.991  571.620   27.598  576.409   19.620  118.356   2.8606  118.886   2.0246 -0.5300140 3.504533 
1 1 1   10    9    7 o  128.146   1.6511  669.565   17.247  659.784   29.499  674.645   21.258  127.157   2.8460  128.619   2.0276 -1.461586 3.494415 
1 1 1   10    9    8 o  226.065   1.9554  2084.08   36.032  2075.42   62.185  2088.46   44.211  225.468   3.3835  226.270   2.3970 -0.8020935 4.146508 
1 1 1   10    9    9 o  100.678   1.6801  413.296   13.788  379.340   23.316  431.557   17.098   96.366   2.9718  102.868   2.0391 -6.502914 3.604079 
1 1 1   10    9   10 o  146.687   1.5579  877.292   18.628  856.792   28.204  893.155   24.809  144.928   2.3874  147.987   2.0566 -3.059555 3.151066 
1 1 1   10    9   11 o  125.018   1.5338  637.244   15.631  619.313   23.689  651.071   20.802  123.217   2.3585  126.351   2.0197 -3.133736 3.105119 
1 1 1   10    9   12 o  142.357   1.5456  826.262   17.935  824.245   27.342  827.785   23.762  142.149   2.3597  142.469   2.0461 -0.3196259 3.123225 
1 1 1   10    9   13 o   68.374   1.7821  190.759   9.9238  188.193   15.177  192.675   13.116   67.857   2.7495   68.687   2.3460 -0.8299789 3.614370 
1 1 1   10    9   14 o  174.584   1.6200  1242.76   23.054  1234.39   35.090  1249.12   30.581  173.949   2.4747  175.004   2.1437 -1.055771 3.274102 
1 1 1   10    9   15 o   35.372   3.0652   51.449   8.7509   56.010   12.590   47.185   12.172   36.773   4.2800   33.670   4.5512 3.103580 6.247585 
1 1 1   10    9   16 o  118.929   1.6554  576.723   16.049  551.214   22.344  603.905   23.065  116.244   2.3581  121.675   2.3255 -5.430595 3.311898 
1 1 1   10    9   17 o  213.379   1.9006  1856.74   33.058  1837.70   46.463  1876.27   47.045  212.223   2.6858  214.438   2.6914 -2.214600 3.802273 
1 1 1   10    9   18 o  204.717   1.8667  1709.03   31.150  1711.66   44.171  1706.43   43.937  204.818   2.6456  204.506   2.6357 0.3119659 3.734443 
1 1 1   10    9   19 o  138.447   1.5468  781.516   17.456  770.259   26.528  790.113   23.183  137.412   2.3683  139.187   2.0433 -1.775375 3.127934 
1 1 1   10    9   20 o  133.292   1.5435  724.402   16.770  707.277   25.438  737.568   22.303  131.673   2.3700  134.479   2.0346 -2.805847 3.123516 
1 1 1   10    9   21 o  167.176   1.6060  1139.55   21.885  1124.38   33.227  1151.17   29.086  166.013   2.4553  168.000   2.1239 -1.987183 3.246479 
1 1 1   10    9   22 o  141.589   1.5595  817.405   17.999  796.949   27.250  833.235   23.972  139.769   2.3918  142.933   2.0575 -3.163727 3.154959 
1 1 1   10    9   23 o  180.456   1.7765  1327.93   26.132  1305.16   44.916  1339.58   32.130  178.809   3.0816  181.223   2.1750 -2.413406 3.771862 
1 1 1   10    9   24 o  128.376   1.5569  671.966   16.292  661.434   24.820  679.938   21.595  127.331   2.3913  129.116   2.0518 -1.785004 3.150903 
1 1 1   10    9   25 f   24.770   4.6801   25.920   9.1035   38.087   12.791   13.431   12.959   30.041   5.4229   19.207   6.7172 10.83406 8.632993 
1 1 1   10    9   26 o  253.831   2.1126  2628.01   43.711  2606.12   61.452  2650.42   62.189  252.676   2.9836  254.813   2.9941 -2.137314 4.226819 
1 1 1   10    9   27 o   79.827   1.9148  259.883   12.460  280.945   17.811  239.694   17.437   82.933   2.6380   76.585   2.7979 6.348083 3.845402 
1 1 1   10    9   28 o   17.978   5.3106   13.429   8.3210   28.508   13.555   4.3104   10.541   25.849   6.4533   14.638   5.8480 11.21106 8.708838 
1 1 1   10    9   29 o   74.657   1.8504  227.305   11.261  228.476   17.925  226.542   14.473   74.755   2.9474   74.478   2.3870 0.2775192 3.792763 
1 1 1   10    9   30 o  146.659   1.6201  877.066   19.368  842.207   30.002  901.975   25.361  143.663   2.5619  148.703   2.0923 -5.040085 3.307735 
1 1 1   10    9   31 o  242.107   1.9223  2390.69   37.938  2321.85   57.546  2443.61   50.455  238.483   2.9602  244.710   2.5294 -6.227585 3.893667 
1 1 1   10    9   32 o   56.403   2.3055  130.012   10.578  111.657   16.816  142.029   13.607   52.110   3.9892   58.918   2.8416 -6.807980 4.897756 
1 1 1   10    9   33 o  171.122   1.8321  1194.28   25.557  1193.14   36.918  1195.33   35.414  170.979   2.6488  171.146   2.5385 -0.1666107 3.668813 
1 1 1   10    9   34 o  101.040   1.9371  416.403   15.954  383.488   23.400  444.995   21.809   96.870   2.9669  104.422   2.5622 -7.551521 3.920123 
1 1 1   10    9   35 o   79.577   2.1616  258.527   14.009  289.660   21.716  236.339   18.334   84.159   3.1712   76.025   2.9641 8.133965 4.340799 
1 1 1   10    9   36 o  316.808   2.7003  4096.66   69.733  4049.41  110.304  4128.11   90.000  314.625   4.3009  317.871   3.4734 -3.246063 5.528350 
1 1 1   10    9   37 o  150.880   1.8463  928.473   22.707  882.579   33.565  967.204   30.835  147.037   2.8004  153.953   2.4571 -6.916260 3.725515 
1 1 1   10    9   38 o   38.184   3.2522   59.987   10.026   50.255   17.981   64.379   12.079   34.384   6.6559   39.503   3.7978 -5.119251 7.663162 
1 1 1   10    9   39 o   47.979   2.4581   94.190   9.5814   94.638   15.064   93.886   12.417   47.952   3.8871   47.835   3.2028 0.1170349 5.036612 
1 1 1   10    9   40 o  267.860   2.0475  2927.07   44.707  2915.16   69.747  2935.38   58.247  267.131   3.2031  268.151   2.6647 -1.020264 4.166584 
1 1 1   10    9   41 o   55.597   2.1485  126.304   9.7184  118.385   15.068  131.945   12.717   53.709   3.4602   56.780   2.7558 -3.071457 4.423481 
1 1 1   10    9   42 o   51.228   2.3752  107.337   9.8915   78.754   17.190  121.485   12.094   43.556   4.9282   54.478   2.7322 -10.92207 5.634923 
1 1 1   10    9   43 o   88.691   1.7472  320.845   12.632  328.460   21.701  316.943   15.534   89.622   2.9746   88.132   2.1624 1.490723 3.677521 
1 1 1   10    9   44 o   47.942   2.4691   94.076   9.6167  120.313   17.518   82.758   11.505   54.071   4.0028   44.891   3.1644 9.179924 5.102584 
1 1 1   10    9   45 o   75.404   1.9841  232.148   12.185  215.836   16.744  250.510   17.765   72.636   2.8333   78.266   2.7890 -5.629669 3.975682 
1 1 1   10    9   46 o   63.737   2.0430  165.937   10.601  165.844   15.713  166.014   14.361   63.634   3.0380   63.693   2.7727 -0.5854797E-01 4.113109 
1 1 1   10    9   47 o  115.564   1.8732  544.872   17.646  522.655   28.972  557.973   22.249  113.035   3.1474  116.912   2.3346 -3.877304 3.918741 
1 1 1   10    9   48 o   62.048   2.2217  157.348   11.219  193.225   18.717  137.230   14.016   68.656   3.3546   57.872   2.9812 10.78419 4.487808 
1 1 1   10    9   49 o  168.248   1.8073  1154.92   24.787  1184.49   37.283  1131.49   33.183  170.283   2.6860  166.462   2.4455 3.820404 3.632454 
1 1 1   10    9   50 o   53.089   2.3972  115.321   10.347  139.395   17.326  101.975   12.901   58.240   3.6682   49.836   3.1924 8.403965 4.862890 
1 1 1   10    9   51 o   43.591   2.7589   77.959   9.7530   79.083   16.379   77.341   12.140   43.641   4.6771   43.335   3.4655 0.3056488 5.821110 
1 1 1   10    9   52 o   93.793   1.8309  358.982   13.998  385.194   22.437  342.278   17.911   97.034   2.8396   91.514   2.4031 5.519936 3.720034 
1 1 1   10    9   53 o  115.547   1.9211  544.913   18.095  546.890   25.406  542.878   25.778  115.679   2.6942  115.248   2.7440 0.4309616 3.845551 
1 1 1   10    9   54 o  143.512   1.9173  840.616   22.429  824.213   30.685  859.437   32.868  142.012   2.6507  144.995   2.7808 -2.983017 3.841788 
1 1 1   10    9   55 o   63.922   2.2831  167.093   11.877  153.962   17.970  177.278   15.827   61.196   3.6186   65.770   2.9597 -4.574268 4.674865 
1 1 1   10    9   56 o   31.578   3.6662   41.410   9.2619   49.876   19.593   38.974   10.510   33.985   7.2911   30.504   4.3500 3.481150 8.490139 
1 1 1   10    9   57 o   48.008   2.6387   94.504   10.286  109.798   21.804   90.125   11.666   51.329   5.2867   46.828   3.0732 4.500977 6.115080 
1 1 1   10    9   58 o   84.234   1.9846  289.712   13.627  325.842   26.524  276.755   15.884   89.065   3.6611   82.263   2.3712 6.802017 4.361926 
1 1 1   10    9   59 o   65.648   2.8849  176.694   15.400  176.312   23.632  176.976   20.303   65.310   4.4659   65.557   3.8158 -0.2468185 5.874078 
1 1 1   10    9   60 o  183.524   2.0797  1375.78   31.113  1373.75   40.720  1378.63   48.227  183.244   2.7261  183.432   3.2254 -0.1871948 4.223110 
1 1 1   10    9   61 o   83.349   2.0220  283.761   13.738  300.140   26.383  277.668   16.091   85.402   3.7994   82.378   2.3988 3.024544 4.493313 
1 1 1   10    9   62 o   26.437   4.0845   29.410   8.5189   12.079   15.532   36.867   10.188   19.385   7.2698   29.613   4.3502 -10.22755 8.471987 
1 1 1   10    9   63 o  175.991   1.9880  1265.39   28.520  1273.71   47.482  1260.69   35.672  176.198   3.3059  175.544   2.4929 0.6539154 4.140466 
1 1 1   10    9   64 o   45.640   2.4400   85.466   9.0449   90.665   16.558   83.255   10.798   46.674   4.4042   44.973   2.9620 1.700840 5.307564 
1 1 1   10    9   65 f   63.289   1.9498  163.836   10.047  128.272   17.668  180.832   12.214   55.673   3.9181   66.455   2.2580 -10.78145 4.522205 
1 1 1   10    9   66 o   30.492   2.9751   38.495   7.3008   32.502   14.521   40.522   8.4460   27.281   6.6017   31.225   3.3717 -3.944359 7.412920 
1 1 1   10    9   67 o   17.530   4.6665   13.183   6.7857   16.385   13.356   12.069   7.8781   20.254   6.8284   16.997   5.2009 3.257774 8.583514 
1 1 1   10    9   68 o   11.314   4.4096   3.2985   5.8611   18.101   11.624  -1.7479   6.7870   20.666   6.3163   9.8867   4.3496 10.77966 7.669105 
1 1 1   10    9   69 o   74.397   1.5842  226.089   9.6075  213.602   15.462  233.943   12.262   72.124   2.6344   75.603   1.9914 -3.478806 3.302388 
1 1 1   10    9   70 o   81.728   1.6301  272.931   10.860  281.304   16.265  266.197   14.588   82.813   2.4121   80.596   2.2226 2.217384 3.279963 
1 1 1   10    9   71 o   52.031   1.9006  110.893   8.0472  116.028   15.566  109.020   9.4009   52.878   3.6335   51.538   2.2431 1.340324 4.270072 
1 1 1   10    9   72 o   42.104   2.2434   72.854   7.6716   85.076   18.171   70.203   8.4628   44.800   5.0645   41.282   2.5270 3.517406 5.659949 
1 1 1   10    9   73 o   84.296   1.6627  290.566   11.425  349.320   23.723  272.824   13.036   91.977   3.1689   81.630   1.9591 10.34770 3.725577 
1 1 1   10    9   74 o   62.795   1.6303  161.369   8.3380  176.056   14.286  153.781   10.268   65.369   2.6868   61.225   2.0604 4.143635 3.385869 
1 1 1   10    9   75 o   46.821   2.4268   90.305   9.2306   91.757   12.759   88.710   13.370   46.974   3.3542   46.118   3.5847 0.8555069 4.909290 
1 1 1   10    9   76 o   67.567   2.0426  187.372   11.237  214.101   16.616  164.842   15.255   72.001   2.8366   63.122   2.9731 8.879509 4.109222 
1 1 1   10    9   77 o   11.975   5.0651   0.9517   8.5207  -4.7075   10.850   10.059   13.764   11.812   5.3269   17.640   6.7893 -5.827497 8.629629 
1 1 1   10    9   78 o   12.622   5.1741   2.8085   8.4955  -1.0979   10.790   9.1815   13.781   12.700   5.5382   17.305   6.7567 -4.605435 8.736424 
1 1 1   10    9   79 o   26.048   4.7966   29.596   9.8095   31.203   11.261   24.540   19.972   26.563   5.3854   23.750   8.3366 2.812721 9.924773 
1 1 1   10    9   80 o   44.300   2.6887   81.370   9.6635   89.237   12.339   68.891   15.541   46.206   3.2978   39.968   4.8705 6.238213 5.881917 
1 1 1   10    9   81 o   91.005   1.8141  339.781   13.458  345.023   19.445  334.962   18.645   91.347   2.6141   90.039   2.5429 1.308098 3.646904 
1 1 1   10    9   82 o   39.912   2.7015   66.218   8.7372   53.240   11.944   81.153   12.814   35.251   4.2420   43.881   3.6143 -8.629932 5.572936 
1 1 1   10    9   83 o   38.987   2.7054   63.257   8.5446   59.149   11.643   68.054   12.579   37.285   3.8878   40.011   3.9066 -2.725410 5.511482 
1 1 1   10    9   84 o   12.789   5.1620   3.8061   8.3023  -2.5442   11.711   10.223   11.772   12.701   5.6445   16.757   6.3193 -4.055391 8.473151 
1 1 1   10    9   85 o   12.929   5.0394   4.9753   7.6550   8.6562   10.342   0.5151   11.384   15.628   5.9166   13.313   5.7477 2.315125 8.248763 
1 1 1   10    9   86 o   41.726   2.7946   72.706   9.4503   73.930   11.539   70.214   16.469   41.833   3.4135   39.868   5.1906 1.964886 6.212479 
1 1 1   10    9   87 o   51.913   2.4345  111.830   10.273  118.208   12.660   99.531   17.579   53.165   2.9326   47.913   4.5558 5.252209 5.418073 
1 1 1   10    9   88 o   64.650   1.9800  172.378   10.422  168.584   13.760  177.485   15.963   63.635   2.6585   65.101   3.0162 -1.466198 4.020604 
1 1 1   10    9   89 o   37.477   2.8521   58.925   8.6475   55.309   11.386   63.853   13.293   35.833   3.9642   38.338   4.3293 -2.504776 5.870111 
1 1 1   10    9   90 o   34.194   3.0570   49.387   8.4309   50.981   11.257   47.351   12.723   34.275   4.1112   32.589   4.9443 1.686039 6.430220 
1 1 1   10    9   91 o   21.815   4.6479   21.424   8.0118   16.731   10.697   27.422   12.092   19.061   6.0947   24.058   6.1447 -4.996666 8.654615 
1 1 1   10    9   92 o   12.827   4.9509   5.4298   7.3339   20.780   10.479  -9.3087   10.268   20.981   5.8881   10.161   4.7879 10.81973 7.589061 
1 1 1   10    9   93 o   25.594   3.7490   28.581   7.5897   37.008   11.010   20.950   10.477   28.582   4.9019   20.989   5.8866 7.592932 7.660290 
1 1 1   10    9   94 o   13.155   5.1202   5.7832   7.8938   8.0207   12.333   4.2302   10.274   15.635   6.2983   13.594   5.6426 2.041870 8.456182 
1 1 1   10    9   95 o   58.568   2.0734  142.539   9.8832  128.780   15.064  152.936   13.095   54.794   3.3893   60.291   2.6712 -5.497383 4.315427 
1 1 1   10    9   96 o   35.624   3.0214   54.212   8.6910   61.964   13.566   48.815   11.319   37.050   4.5900   33.032   4.3061 4.018185 6.293680 
1 1 1   10    9   97 o   8.8777   4.1242  -4.9940   7.1808  -9.2886   10.377  -1.0485   9.9467   10.065   4.7640   11.671   5.1934 -1.605387 7.047503 
1 1 1   10    9   98 o   22.302   4.2225   22.656   7.3951   25.505   10.993   20.302   9.9944   22.668   5.8950   20.284   5.7705 2.383884 8.249198 
1 1 1   10    9   99 o   26.733   3.7587   31.816   7.9648   42.838   12.898   25.022   10.126   29.773   5.5176   22.575   5.5441 7.198009 7.821775 
1 1 1   10    9  100 o   20.532   5.0368   20.357   8.3651   15.951   15.517   22.163   9.9319   18.133   7.1428   21.042   5.6654 -2.909611 9.116768 
1 1 1   10    9  101 o   46.594   2.3889   91.789   9.0429   96.784   14.730   88.767   11.456   46.467   3.9255   45.246   3.1253 1.221291 5.017686 
1 1 1   10    9  102 o   13.857   5.2739   8.0310   8.2439   6.6536   14.883   8.6408   9.9018   15.208   6.5688   14.527   5.7109 0.6815376 8.704247 
1 1 1   10    9  103 o   7.5244   3.6810 -12.3854   7.5340   10.812   12.575 -25.3747   9.4098   15.820   6.3643   7.1581   3.5993 8.661894 7.311604 
1 1 1   10    9  104 o   20.858   5.3284   21.787   9.0912   21.899   12.709   21.669   13.010   19.979   6.6600   19.836   6.7390 0.1431446 9.474689 
1 1 1   10    9  105 o   32.584   4.1153   48.781   10.687   52.132   13.420   42.971   17.671   32.650   5.2178   26.752   7.6931 5.897335 9.295701 
1 1 1   10    9  106 o   10.406   4.8595  -5.5243   10.179  -8.0226   12.968  -1.5158   16.427   11.297   5.3407   13.717   6.3248 -2.419672 8.278066 
1 1 1   10    9  107 o   11.371   5.2463  -3.5558   11.328  -2.4095   15.195  -4.9898   16.996   13.127   6.0636   13.287   6.2291 -0.1604710 8.693031 
1 1 1   10    9  108 o   36.044   4.4881   61.287   12.902   58.098   17.477   65.107   19.126   32.361   6.8397   33.891   7.1487 -1.529186 9.893658 
1 1 1   10    9  109 o   19.339   6.9059   21.654   13.755   35.666   16.564  -9.4746   24.689   23.960   7.5751   14.628   7.0380 9.332331 10.34005 
1 1 1   10    9  110 o   12.748   5.6526   2.1593   11.678   7.2706   13.433 -13.6540   23.628   14.593   6.2713   13.900   6.7359 0.6932182 9.203341 
1 1 1   10    9  111 o   13.853   6.1897   3.4801   14.280 -18.2273   17.155   52.450   25.766   11.465   5.5970   25.486   9.4006 -14.02174 10.94063 
1 1 1   10    9  112 o   22.421   6.8313   29.614   13.611   29.614   13.611   0.0000   0.0000   22.421   6.8313  ?   ?  0.000000 6.831270 
1 1 1   10    9  113 o   35.384   5.0709   62.176   14.209   62.176   14.209   0.0000   0.0000   35.384   5.0709  ?   ?  0.000000 5.070888 
1 1 1   10    9  114 o   10.748   5.1848 -12.3071   13.611 -12.3071   13.611   0.0000   0.0000   10.748   5.1848  ?   ?  0.000000 5.184788 
1 1 1   10    9  115 o   14.289   6.7697  -3.8495   21.057  -3.8495   21.057   0.0000   0.0000   14.289   6.7697  ?   ?  0.000000 6.769742 
1 1 1   10   10    0 o  134.167   2.3925  734.036   26.166  705.281   44.691  749.034   32.277  131.380   4.1784  135.514   2.9219 -4.134750 5.098691 
1 1 1   10   10    1 o  103.346   1.7154  435.527   14.451  418.152   24.931  444.318   17.734  101.163   3.0268  104.371   2.0844 -3.207436 3.675070 
1 1 1   10   10    2 o   47.517   2.5781   92.403   9.9487  106.864   17.242   85.186   12.181   50.957   4.1878   45.555   3.3027 5.401596 5.333475 
1 1 1   10   10    3 o  162.701   1.7441  1079.49   23.131  1123.99   40.861  1058.50   28.060  165.932   3.0209  161.090   2.1369 4.841980 3.700300 
1 1 1   10   10    4 o  114.860   1.6986  537.980   15.903  553.346   27.692  530.418   19.427  116.395   2.9209  114.035   2.0899 2.359512 3.591586 
1 1 1   10   10    5 o  172.228   1.9299  1209.77   27.094  1229.23   43.407  1197.34   34.679  173.521   3.0688  171.305   2.4835 2.216614 3.947832 
1 1 1   10   10    6 o  137.903   1.7005  775.487   19.116  805.552   33.427  760.876   23.302  140.480   2.9191  136.579   2.0930 3.900986 3.591877 
1 1 1   10   10    7 o  131.398   1.8717  704.128   20.047  670.328   30.942  728.583   26.318  128.145   2.9621  133.632   2.4161 -5.487152 3.822534 
1 1 1   10   10    8 o   87.872   2.0032  314.932   14.349  326.864   22.550  306.814   18.601   89.423   3.0982   86.669   2.6359 2.753807 4.067799 
1 1 1   10   10    9 o  161.456   2.1505  1063.35   28.303  1088.39   57.058  1055.18   32.596  163.087   4.2957  160.812   2.4866 2.275101 4.963500 
1 1 1   10   10   10 o  256.519   2.6097  2685.22   54.568  2592.33  106.734  2718.09   63.493  251.581   5.2046  258.030   3.0187 -6.448837 6.016701 
1 1 1   10   10   11 o  133.790   1.9173  730.032   20.910  726.552   46.186  730.929   23.450  133.228   4.2583  133.860   2.1491 -0.6325989 4.769874 
1 1 1   10   10   12 o  205.816   2.0903  1727.87   35.069  1750.01   78.792  1722.40   39.162  206.799   4.6741  205.469   2.3382 1.329697 5.226343 
1 1 1   10   10   13 o  200.002   1.8871  1631.40   30.765  1562.50   51.571  1669.47   38.334  195.608   3.2343  202.288   2.3247 -6.679520 3.983090 
1 1 1   10   10   14 o   82.696   1.9244  278.915   12.972  264.162   21.864  286.930   16.115   80.354   3.3454   83.828   2.3608 -3.474091 4.094452 
1 1 1   10   10   15 o  103.427   1.7927  436.254   15.114  450.691   26.131  428.996   18.527  105.020   3.0556  102.547   2.2164 2.473007 3.774830 
1 1 1   10   10   16 o   57.316   2.4042  134.278   11.208  142.631   19.267  130.005   13.779   58.929   4.0353   56.349   3.0108 2.579487 5.034750 
1 1 1   10   10   17 f   31.935   4.0754   42.368   10.367   27.224   17.868   50.054   12.729   25.651   7.8293   34.672   4.6188 -9.020330 9.090150 
1 1 1   10   10   18 o  290.042   2.1532  3431.79   50.908  3340.65   76.450  3504.40   68.237  285.994   3.2793  292.993   2.8571 -6.999237 4.349374 
1 1 1   10   10   19 o  223.308   1.8694  2033.84   34.028  2007.64   51.710  2053.84   45.191  221.763   2.8605  224.346   2.4712 -2.583328 3.780113 
1 1 1   10   10   20 o  245.156   2.1107  2451.77   42.180  2444.69   59.830  2458.77   59.473  244.690   2.9996  245.398   2.9731 -0.7079468 4.223425 
1 1 1   10   10   21 o  101.855   1.9289  423.151   16.015  395.259   22.766  450.481   22.535   98.356   2.8425  105.025   2.6343 -6.669083 3.875450 
1 1 1   10   10   22 o   78.270   2.3443  250.185   14.940  240.949   24.213  255.864   18.985   76.674   3.8868   79.108   2.9493 -2.434334 4.879051 
1 1 1   10   10   23 o  109.327   1.8828  487.498   16.779  489.405   24.358  485.777   23.147  109.498   2.7290  109.098   2.6027 0.3992157 3.771158 
1 1 1   10   10   24 o   9.6035   4.6195 -15.9961   10.621 -13.7254   15.733 -17.8972   14.396   13.186   6.1183   11.724   5.5672 1.461390 8.272063 
1 1 1   10   10   25 o  149.485   1.8128  911.359   22.089  844.171   31.001  980.650   31.483  143.815   2.6444  155.017   2.4915 -11.20244 3.633249 
1 1 1   10   10   26 o  104.051   2.0213  441.643   17.144  425.089   27.951  451.627   21.708  101.951   3.3680  105.196   2.5315 -3.244965 4.213275 
1 1 1   10   10   27 o  135.113   1.6573  744.485   18.253  766.106   28.874  730.094   23.557  137.004   2.5855  133.774   2.1602 3.230179 3.369196 
1 1 1   10   10   28 o   73.888   1.9630  222.857   11.813  224.695   19.148  221.728   15.010   74.101   3.1774   73.665   2.5033 0.4354324 4.045039 
1 1 1   10   10   29 o  215.061   1.9579  1886.70   34.323  1884.87   60.313  1887.57   41.740  214.765   3.4452  215.067   2.3809 -0.3019257 4.187829 
1 1 1   10   10   30 o   88.960   1.9031  322.821   13.801  318.352   24.427  324.916   16.726   88.197   3.4040   89.202   2.3022 -1.005119 4.109479 
1 1 1   10   10   31 o   66.315   2.4620  179.738   13.286  176.835   21.167  181.626   17.066   65.628   3.9754   66.603   3.1523 -0.9754639 5.073601 
1 1 1   10   10   32 o   52.379   2.6240  112.285   11.168  111.712   15.978  112.831   15.616   52.127   3.7862   52.402   3.6791 -0.2743835 5.279338 
1 1 1   10   10   33 o   99.538   1.7613  404.134   14.291  384.118   19.331  428.256   21.222   96.976   2.4474  102.423   2.5419 -5.446564 3.528604 
1 1 1   10   10   34 o   81.022   1.7188  267.761   11.352  271.242   17.191  265.069   15.116   81.467   2.5920   80.557   2.3043 0.9100037 3.468170 
1 1 1   10   10   35 o   97.126   1.6114  384.751   12.758  378.209   19.345  389.785   16.971   96.220   2.4685   97.734   2.1302 -1.513771 3.260597 
1 1 1   10   10   36 o   42.298   2.6391   73.342   9.0540   81.948   14.253   67.520   11.723   44.570   3.9645   40.473   3.5906 4.097221 5.348810 
1 1 1   10   10   37 o  207.414   1.8038  1755.03   30.497  1732.09   48.118  1770.43   39.428  205.910   2.8668  208.259   2.3226 -2.349747 3.689538 
1 1 1   10   10   38 o  124.823   1.5419  635.472   15.689  655.540   23.769  619.977   20.885  126.725   2.3009  123.257   2.0787 3.467949 3.100837 
1 1 1   10   10   39 o   47.397   2.3950   91.951   9.2234   84.504   14.498   97.015   11.955   45.256   3.9701   48.628   3.0309 -3.371899 4.994847 
1 1 1   10   10   40 o  113.389   1.5606  524.415   14.425  543.284   21.935  510.037   19.147  115.358   2.3327  111.790   2.1012 3.567909 3.139520 
1 1 1   10   10   41 o   30.919   3.4952   39.607   8.6549   46.303   13.681   35.138   11.176   33.170   5.2330   28.857   4.9278 4.312767 7.187998 
1 1 1   10   10   42 o   65.351   2.1504  174.519   11.440  157.035   15.883  193.364   16.490   61.891   3.1587   68.718   2.9507 -6.826927 4.322531 
1 1 1   10   10   43 o   68.286   1.8538  190.411   10.309  191.128   15.992  189.901   13.485   68.323   2.8779   68.147   2.4315 0.1753235 3.767503 
1 1 1   10   10   44 o  195.645   1.6441  1561.56   26.220  1508.75   37.418  1612.51   36.753  192.205   2.3882  198.724   2.2689 -6.519089 3.294159 
1 1 1   10   10   45 o   72.613   1.7986  215.154   10.646  196.255   16.446  228.786   13.967   69.222   2.9211   74.815   2.2930 -5.593307 3.713564 
1 1 1   10   10   46 o  111.521   1.5457  507.357   14.051  479.156   20.978  530.302   18.923  108.310   2.3761  113.976   2.0367 -5.666641 3.129554 
1 1 1   10   10   47 o   64.486   2.2808  170.043   11.970  167.697   23.762  170.840   13.857   63.717   4.6061   64.601   2.6370 -0.8840218 5.307576 
1 1 1   10   10   48 f   54.730   2.5172  122.652   11.200  133.857   22.818  119.095   12.855   56.814   4.9773   53.883   2.9378 2.930840 5.779587 
1 1 1   10   10   49 o  165.925   2.1173  1124.20   28.637  1134.38   61.045  1121.33   32.426  166.064   4.5138  165.669   2.4011 0.3948212 5.112688 
1 1 1   10   10   50 o   26.987   3.8983   30.485   8.3276   17.786   15.801   35.368   9.7989   21.559   7.4240   29.042   4.2663 -7.482306 8.562551 
1 1 1   10   10   51 o   86.231   1.7381  303.482   12.217  293.471   21.593  308.195   14.817   84.609   3.1363   86.872   2.0924 -2.262352 3.770193 
1 1 1   10   10   52 o   55.205   2.1918  124.691   9.8434  113.528   19.122  128.716   11.481   52.334   4.5270   56.056   2.5191 -3.722706 5.180681 
1 1 1   10   10   53 o   49.226   2.3900   99.273   9.5614   85.415   19.504  103.656   10.970   45.145   5.4076   50.270   2.6868 -5.125053 6.038354 
1 1 1   10   10   54 o   75.642   1.8556  233.621   11.442  240.273   22.082  231.180   13.378   76.448   3.5532   75.188   2.1850 1.259720 4.171265 
1 1 1   10   10   55 o  103.762   1.9042  439.686   16.106  440.297   27.874  439.380   19.734  103.577   3.3056  103.675   2.3351 -0.9753418E-01 4.047198 
1 1 1   10   10   56 o   36.436   3.0049   54.753   8.8456   56.178   17.176   54.239   10.319   36.299   6.0152   36.180   3.5444 0.1192665 6.981806 
1 1 1   10   10   57 o  111.499   1.6784  507.567   15.255  512.857   26.044  504.805   18.821  111.861   2.8585  111.145   2.0774 0.7163391 3.533665 
1 1 1   10   10   58 o  145.863   1.6952  868.756   20.156  868.175   33.325  869.092   25.310  145.579   2.8082  145.813   2.1295 -0.2337036 3.524295 
1 1 1   10   10   59 o   45.675   2.6084   85.699   9.6711   60.087   18.267   95.674   11.400   37.450   6.2006   48.224   2.9136 -10.77428 6.851055 
1 1 1   10   10   60 o   52.371   2.2170  112.383   9.4432   98.876   17.301  118.114   11.270   48.723   4.4036   53.642   2.5850 -4.919083 5.106277 
1 1 1   10   10   61 o   92.392   1.8000  348.779   13.556  358.230   27.950  345.872   15.501   93.196   3.6864   91.969   2.0677 1.226944 4.226715 
1 1 1   10   10   62 o  102.851   1.8741  432.366   15.712  420.686   23.257  442.174   21.311  101.232   2.8211  103.892   2.5164 -2.660431 3.780338 
1 1 1   10   10   63 o   90.446   1.9087  334.460   14.072  306.911   20.618  358.487   19.255   86.409   2.9314   93.495   2.5288 -7.085335 3.871439 
1 1 1   10   10   64 o   76.741   1.5825  240.583   9.8993  217.365   15.538  256.445   12.843   72.752   2.6244   79.153   1.9921 -6.401070 3.294853 
1 1 1   10   10   65 o   30.770   2.8419   39.219   7.0478   34.858   13.922   40.722   8.1724   28.198   6.2235   31.283   3.2522 -3.084866 7.022031 
1 1 1   10   10   66 o   15.081   4.6709   9.4739   6.3310   2.2210   13.204   11.639   7.2143   15.108   6.3431   16.575   4.9570 -1.466742 8.050258 
1 1 1   10   10   67 o   16.609   4.9314   11.731   7.1602   18.317   15.019   9.7934   8.1455   21.208   7.2399   15.746   5.3325 5.461741 8.991742 
1 1 1   10   10   68 o   86.948   1.6158  309.090   11.452  305.068   16.708  312.655   15.728   86.190   2.3804   87.300   2.2119 -1.110580 3.249397 
1 1 1   10   10   69 o   12.393   4.6084   5.0466   6.2147   7.3499   10.996   3.9655   7.5332   15.699   6.0615   12.603   4.9731 3.095529 7.840450 
1 1 1   10   10   70 o   17.870   4.5407   13.889   6.6266   23.070   11.257   9.0203   8.1974   22.821   5.9804   15.310   5.3433 7.510476 8.019709 
1 1 1   10   10   71 o   84.844   1.7347  294.682   11.997  299.029   16.596  289.925   17.363   85.267   2.3901   83.908   2.5415 1.358688 3.488837 
1 1 1   10   10   72 o   19.335   4.4679   16.309   6.9005   26.228   13.187   12.569   8.0976   24.152   6.5391   17.141   5.2780 7.010340 8.403376 
1 1 1   10   10   73 o   9.9842   4.2229   0.5366   5.9218 -13.8779   10.710   6.8834   7.1069   9.8439   4.7096   13.739   4.9570 -3.895385 6.837547 
1 1 1   10   10   74 o   41.553   2.1931   71.168   7.4021   74.786   12.227   69.075   9.2998   42.213   3.5873   40.788   2.8143 1.424904 4.559561 
1 1 1   10   10   75 o   37.427   2.3832   57.930   7.2329   57.873   11.716   57.964   9.1941   36.950   3.9511   37.267   3.0533 -0.3169594 4.993409 
1 1 1   10   10   76 o   14.969   5.4327   8.3308   8.5529   11.195   10.831   3.5870   13.940   16.992   6.1209   15.544   6.5212 1.447451 8.943780 
1 1 1   10   10   77 o   30.146   3.7091   38.618   8.9226   38.246   11.101   39.297   14.997   29.623   4.7583   29.322   6.4501 0.3014488 8.015289 
1 1 1   10   10   78 o   49.296   2.5351  100.703   10.153  107.671   12.585   87.713   17.182   50.791   3.0537   45.071   4.7480 5.720745 5.645243 
1 1 1   10   10   79 o   49.867   2.4650  103.026   9.9888   98.982   12.169  111.380   17.490   48.654   3.0841   51.065   4.2399 -2.411137 5.242976 
1 1 1   10   10   80 o   25.039   4.9205   27.851   9.6847   30.900   10.856   15.960   21.436   26.272   5.2529   21.020   8.3587 5.252123 9.872205 
1 1 1   10   10   81 o   37.189   3.4276   58.506   10.274   54.889   11.440   73.582   23.355   35.782   3.9900   39.276   7.5692 -3.494030 8.556478 
1 1 1   10   10   82 o   11.402   4.9237   0.0528   8.3575   5.6890   10.082 -12.3302   14.943   14.322   5.7201   12.396   5.8207 1.925869 8.160869 
1 1 1   10   10   83 o   17.986   5.3872   14.528   8.5159   11.781   10.377   20.192   14.902   16.895   6.0021   21.050   7.2110 -4.154808 9.382117 
1 1 1   10   10   84 o   52.515   2.1993  114.145   9.3936  109.298   12.276  120.992   14.591   51.070   2.9617   53.533   3.3606 -2.463295 4.479382 
1 1 1   10   10   85 o   37.147   2.8744   57.944   8.6359   53.307   11.281   64.509   13.422   35.137   4.0105   38.507   4.3522 -3.370396 5.918232 
1 1 1   10   10   86 o   70.941   2.0555  208.015   11.874  196.498   16.540  220.262   17.057   68.430   2.9723   72.512   2.8915 -4.081902 4.146696 
1 1 1   10   10   87 o   42.651   2.5781   76.023   8.9213   67.442   11.657   88.154   13.861   39.673   3.6453   45.311   3.7872 -5.638565 5.256533 
1 1 1   10   10   88 o   13.697   5.3434   6.1531   8.6127  -3.0698   12.156   15.450   12.205   12.569   5.6558   18.533   6.5159 -5.963618 8.628162 
1 1 1   10   10   89 o   33.584   3.4405   48.433   9.2855   50.262   13.322   46.706   12.949   33.282   5.0705   32.024   5.1339 1.258011 7.215793 
1 1 1   10   10   90 o   21.715   5.0955   21.919   8.8635   15.855   12.441   28.171   12.631   18.549   6.5736   23.979   6.3589 -5.430321 9.145967 
1 1 1   10   10   91 o   41.809   2.6737   73.685   9.0643   79.106   11.979   66.421   13.865   42.859   3.4581   38.550   4.4965 4.308842 5.672492 
1 1 1   10   10   92 o   52.832   2.2946  116.695   9.8584  111.698   13.324  122.739   14.654   51.072   3.2168   53.410   3.3833 -2.337887 4.668509 
1 1 1   10   10   93 o   17.169   5.2497   13.924   8.0286   21.707   10.733   4.0353   12.098   20.948   5.9865   14.080   5.9986 6.868274 8.474714 
1 1 1   10   10   94 o   25.279   4.4673   29.276   8.8688   25.373   12.727   32.961   12.365   22.186   6.5716   25.784   5.9968 -3.597746 8.896523 
1 1 1   10   10   95 o   18.153   5.0534   15.795   7.7518   24.764   12.030   9.4274   10.137   21.936   6.3596   15.131   5.8258 6.804956 8.624651 
1 1 1   10   10   96 o   13.596   5.1367   7.4972   7.7863   14.439   12.612   3.2220   9.8976   17.359   6.5422   12.738   5.4264 4.620398 8.499791 
1 1 1   10   10   97 o   34.265   3.2484   51.284   8.9647   38.336   15.837   57.388   10.875   26.253   7.1903   35.853   3.7777 -9.600027 8.122261 
1 1 1   10   10   98 o   12.773   5.1557   5.4630   8.2820  -1.2505   14.820   8.5120   9.9871   13.440   6.1259   14.501   5.7247 -1.060311 8.384498 
1 1 1   10   10   99 o   13.007   5.1889   6.1219   8.2865   22.388   14.774  -1.3435   10.009   19.950   7.1534   11.352   5.1180 8.598407 8.795742 
1 1 1   10   10  100 o   18.187   5.1715   16.451   8.0290   11.380   13.128   19.481   10.148   16.044   6.4857   19.337   5.9001 -3.293367 8.767811 
1 1 1   10   10  101 o   12.939   5.3960   4.9898   9.4592  -8.5802   14.060   16.212   12.786   11.718   5.5459   17.619   6.5983 -5.900445 8.619435 
1 1 1   10   10  102 o   19.880   5.9784   20.983   10.472   5.3097   12.851   51.959   18.066   14.092   6.0954   29.868   7.4465 -15.77639 9.623104 
1 1 1   10   10  103 o   46.142   3.5983   95.340   13.427   96.517   15.154   91.040   28.969   45.828   4.0998   35.702   9.7027 10.12557 10.53327 
1 1 1   10   10  104 o   18.226   6.4437   18.160   11.948   27.478   13.468 -16.2841   25.893   21.856   6.8195   14.286   6.9526 7.569519 9.738838 
1 1 1   10   10  105 o   19.889   6.5566   22.352   12.327   13.442   13.765   58.436   27.700   16.481   6.6487   26.649   9.7608 -10.16788 11.81009 
1 1 1   10   10  106 o   26.584   6.5811   39.464   14.185   39.464   14.185   0.0000   0.0000   26.584   6.5811  ?   ?  0.000000 6.581130 
1 1 1   10   10  107 o   12.464   5.6954  -0.9079   12.915  -0.9079   12.915   0.0000   0.0000   12.464   5.6954  ?   ?  0.000000 5.695397 
1 1 1   10   10  108 o   31.395   5.6955   51.086   14.039   51.086   14.039   0.0000   0.0000   31.395   5.6955  ?   ?  0.000000 5.695475 
1 1 1   10   10  109 o   12.483   5.8746  -5.1807   15.373  -5.1807   15.373   0.0000   0.0000   12.483   5.8746  ?   ?  0.000000 5.874565 
1 1 1   10   10  110 o   19.888   7.5747   25.779   17.013   25.779   17.013   0.0000   0.0000   19.888   7.5747  ?   ?  0.000000 7.574684 
1 1 1   10   10  111 o   16.835   7.7558   11.249   24.622   11.249   24.622   0.0000   0.0000   16.835   7.7558  ?   ?  0.000000 7.755770 
1 1 1   10   10  112 o   27.336   8.8299   54.680   22.413   54.680   22.413   0.0000   0.0000   27.336   8.8299  ?   ?  0.000000 8.829912 
1 1 1   11    0 -130 o   9.9620   7.0618 -18.5408   23.958 -18.5408   23.958 -18.5408   23.958   9.9620   7.0618   9.9620   7.0618 0.000000 0.000000 
1 1 1   11    0 -129 o   17.008   8.9217   23.161   16.315   23.161   16.315   23.161   16.315   17.008   8.9217   17.008   8.9217 0.000000 0.000000 
1 1 1   11    0 -128 f   23.652   8.1074   34.127   14.045   34.127   14.045   34.127   14.045   23.652   8.1074   23.652   8.1074 -0.000000 0.000000 
1 1 1   11    0 -127 o   6.9701   4.9978 -17.9208   13.380 -17.9208   13.380 -17.9208   13.380   6.9701   4.9978   6.9701   4.9978 0.000000 0.000000 
1 1 1   11    0 -126 o   28.798   7.2561   44.333   14.731   44.333   14.731   44.333   14.731   28.798   7.2561   28.798   7.2561 -0.000000 0.000000 
1 1 1   11    0 -125 o   35.910   5.4283   60.744   14.817   60.744   14.817   60.744   14.817   35.910   5.4283   35.910   5.4283 0.000000 0.000000 
1 1 1   11    0 -124 o   49.068   4.1395  105.742   16.276  105.742   16.276  105.742   16.276   49.068   4.1395   49.068   4.1395 -0.000000 0.000000 
1 1 1   11    0 -123 o   6.3926   4.6348 -23.4325   13.108 -23.4325   13.108 -23.4325   13.108   6.3926   4.6348   6.3926   4.6348 0.000000 0.000000 
1 1 1   11    0 -122 o   37.514   5.0063   64.580   14.546   64.580   14.546   64.580   14.546   37.514   5.0063   37.514   5.0063 0.000000 0.000000 
1 1 1   11    0 -121 o   17.492   8.3360   21.870   13.584   21.870   13.584   21.870   13.584   17.492   8.3360   17.492   8.3360 0.000000 0.000000 
1 1 1   11    0 -120 o   12.083   7.3078   8.8440   13.228   8.8440   13.228   8.8440   13.228   12.083   7.3078   12.083   7.3078 -0.000000 0.000000 
1 1 1   11    0 -119 o   28.663   6.3815   41.146   13.028   41.146   13.028   41.146   13.028   28.663   6.3815   28.663   6.3815 0.000000 0.000000 
1 1 1   11    0 -118 o   9.8540   6.3935   1.7914   12.225   1.7914   12.225   1.7914   12.225   9.8540   6.3935   9.8540   6.3935 0.000000 0.000000 
1 1 1   11    0 -117 o   10.862   6.7728   5.3280   12.192   5.3280   12.192   5.3280   12.192   10.862   6.7728   10.862   6.7728 -0.000000 0.000000 
1 1 1   11    0 -116 o   34.959   6.5099   59.009   16.664   59.009   16.664   59.009   16.664   34.959   6.5099   34.959   6.5099 0.000000 0.000000 
1 1 1   11    0 -115 o   14.434   8.2643   14.163   15.380   14.163   15.380   14.163   15.380   14.434   8.2643   14.434   8.2643 0.000000 0.000000 
1 1 1   11    0 -114 o   40.337   5.4490   73.756   16.997   73.756   16.997   73.756   16.997   40.337   5.4490   40.337   5.4490 -0.000000 0.000000 
1 1 1   11    0 -113 o   13.714   8.2707   10.948   16.846   10.948   16.846   10.948   16.846   13.714   8.2707   13.714   8.2707 -0.000000 0.000000 
1 1 1   11    0 -112 o   12.769   7.8944   7.7365   16.216   7.7365   16.216   7.7365   16.216   12.769   7.8944   12.769   7.8944 -0.000000 0.000000 
1 1 1   11    0 -111 o   25.542   9.0662   38.181   17.181   38.181   17.181   38.181   17.181   25.542   9.0662   25.542   9.0662 -0.000000 0.000000 
1 1 1   11    0 -110 f   17.645   9.1294   21.333   16.915   21.333   16.915   21.333   16.915   17.645   9.1294   17.645   9.1294 -0.000000 0.000000 
1 1 1   11    0 -109 o   60.807   3.2496  154.329   16.002  154.329   16.002  154.329   16.002   60.807   3.2496   60.807   3.2496 -0.000000 0.000000 
1 1 1   11    0 -108 o   13.154   7.4421   10.527   12.268   10.527   12.268   10.527   12.268   13.154   7.4421   13.154   7.4421 -0.000000 0.000000 
1 1 1   11    0 -107 o   12.272   7.2361   8.1312   12.356   8.1312   12.356   8.1312   12.356   12.272   7.2361   12.272   7.2361 -0.000000 0.000000 
1 1 1   11    0 -106 o   41.870   4.1507   75.000   13.823   75.000   13.823   75.000   13.823   41.870   4.1507   41.870   4.1507 -0.000000 0.000000 
1 1 1   11    0 -105 o   23.575   7.5765   29.904   12.845   29.904   12.845   29.904   12.845   23.575   7.5765   23.575   7.5765 -0.000000 0.000000 
1 1 1   11    0 -104 o   13.000   7.3672   9.9937   12.049   9.9937   12.049   9.9937   12.049   13.000   7.3672   13.000   7.3672 -0.000000 0.000000 
1 1 1   11    0 -103 f   13.099   7.3517   10.246   11.849   10.246   11.849   10.246   11.849   13.099   7.3517   13.099   7.3517 -0.000000 0.000000 
1 1 1   11    0 -102 o   17.419   7.9638   18.916   12.310   18.916   12.310   18.916   12.310   17.419   7.9638   17.419   7.9638 -0.000000 0.000000 
1 1 1   11    0 -101 o   22.679   7.7059   28.052   12.763   28.052   12.763   28.052   12.763   22.679   7.7059   22.679   7.7059 -0.000000 0.000000 
1 1 1   11    0 -100 o   18.879   8.8152   22.458   15.124   22.458   15.124   22.458   15.124   18.879   8.8152   18.879   8.8152 -0.000000 0.000000 
1 1 1   11    0  -99 o   48.536   4.4603   99.905   17.286   99.905   17.286   99.905   17.286   48.536   4.4603   48.536   4.4603 -0.000000 0.000000 
1 1 1   11    0  -98 o   33.130   6.5191   50.711   15.664   50.711   15.664   50.711   15.664   33.130   6.5191   33.130   6.5191 -0.000000 0.000000 
1 1 1   11    0  -97 o   58.068   4.2347  141.239   19.794  141.239   19.794  141.239   19.794   58.068   4.2347   58.068   4.2347 -0.000000 0.000000 
1 1 1   11    0  -96 o   16.400   8.0688   16.758   12.862   16.758   12.862   16.758   12.862   16.400   8.0688   16.400   8.0688 -0.000000 0.000000 
1 1 1   11    0  -95 o   49.560   3.5868  102.389   14.312  102.389   14.312  102.389   14.312   49.560   3.5868   49.560   3.5868 -0.000000 0.000000 
1 1 1   11    0  -94 o   18.658   8.0108   20.700   12.473   20.700   12.473   20.700   12.473   18.658   8.0108   18.658   8.0108 0.000000 0.000000 
1 1 1   11    0  -93 o   55.691   3.2698  128.339   14.725  128.339   14.725  128.339   14.725   55.691   3.2698   55.691   3.2698 -0.000000 0.000000 
1 1 1   11    0  -92 o  142.030   2.4921  825.122   28.832  825.122   28.832  825.122   28.832  142.030   2.4921  142.030   2.4921 0.000000 0.000000 
1 1 1   11    0  -91 o   9.4723   6.2077  -1.5498   11.945  -1.5498   11.945  -1.5498   11.945   9.4723   6.2077   9.4723   6.2077 0.000000 0.000000 
1 1 1   11    0  -90 o  106.165   2.5897  461.293   22.381  461.293   22.381  461.293   22.381  106.165   2.5897  106.165   2.5897 -0.000000 0.000000 
1 1 1   11    0  -89 o   58.707   3.3952  142.399   16.122  142.399   16.122  142.399   16.122   58.707   3.3952   58.707   3.3952 -0.000000 0.000000 
1 1 1   11    0  -88 o   47.467   4.3454   94.622   16.473   94.622   16.473   94.622   16.473   47.467   4.3454   47.467   4.3454 0.000000 0.000000 
1 1 1   11    0  -87 o  283.771   3.2874  3293.13   76.020  3293.13   76.020  3293.13   76.020  283.771   3.2874  283.771   3.2874 -0.000000 0.000000 
1 1 1   11    0  -86 o   57.292   3.5242  135.706   16.314  135.706   16.314  135.706   16.314   57.292   3.5242   57.292   3.5242 -0.000000 0.000000 
1 1 1   11    0  -85 o   72.478   2.9616  215.611   17.431  215.611   17.431  215.611   17.431   72.478   2.9616   72.478   2.9616 0.000000 0.000000 
1 1 1   11    0  -84 o   35.852   5.1807   55.839   14.222   55.839   14.222   55.839   14.222   35.852   5.1807   35.852   5.1807 0.000000 0.000000 
1 1 1   11    0  -83 o   84.870   3.1591  295.381   21.786  295.381   21.786  295.381   21.786   84.870   3.1591   84.870   3.1591 0.000000 0.000000 
1 1 1   11    0  -82 o  118.664   2.9286  575.887   28.289  575.887   28.289  575.887   28.289  118.664   2.9286  118.664   2.9286 0.000000 0.000000 
1 1 1   11    0  -81 o   88.172   3.2063  318.698   22.976  318.698   22.976  318.698   22.976   88.172   3.2063   88.172   3.2063 0.000000 0.000000 
1 1 1   11    0  -80 o   11.834   7.4459   2.8236   15.093   2.8236   15.093   2.8236   15.093   11.834   7.4459   11.834   7.4459 0.000000 0.000000 
1 1 1   11    0  -79 o   22.599   7.9823   27.530   13.358   27.530   13.358   27.530   13.358   22.599   7.9823   22.599   7.9823 0.000000 0.000000 
1 1 1   11    0  -78 o  100.943   2.5904  416.527   21.283  416.527   21.283  416.527   21.283  100.943   2.5904  100.943   2.5904 -0.000000 0.000000 
1 1 1   11    0  -77 o   94.806   2.6304  367.533   20.292  367.533   20.292  367.533   20.292   94.806   2.6304   94.806   2.6304 -0.000000 0.000000 
1 1 1   11    0  -76 o   70.435   2.9534  203.496   16.889  203.496   16.889  203.496   16.889   70.435   2.9534   70.435   2.9534 0.000000 0.000000 
1 1 1   11    0  -75 o   35.759   5.1882   55.462   14.196   55.462   14.196   55.462   14.196   35.759   5.1882   35.759   5.1882 -0.000000 0.000000 
1 1 1   11    0  -74 o   63.044   3.1963  163.430   16.329  163.430   16.329  163.430   16.329   63.044   3.1963   63.044   3.1963 0.000000 0.000000 
1 1 1   11    0  -73 f   17.487   8.3202   18.408   13.527   18.408   13.527   18.408   13.527   17.487   8.3202   17.487   8.3202 0.000000 0.000000 
1 1 1   11    0  -72 o   45.766   4.3627   87.829   15.914   87.829   15.914   87.829   15.914   45.766   4.3627   45.766   4.3627 0.000000 0.000000 
1 1 1   11    0  -71 o  145.531   1.7564  863.848   20.829  863.848   20.829  863.848   20.829  145.531   1.7564  145.531   1.7564 0.000000 0.000000 
1 1 1   11    0  -70 o  201.628   2.0065  1658.04   32.970  1658.04   32.970  1658.04   32.970  201.628   2.0065  201.628   2.0065 0.000000 0.000000 
1 1 1   11    0  -69 o  147.564   1.8095  888.168   21.758  888.168   21.758  888.168   21.758  147.564   1.8095  147.564   1.8095 0.000000 0.000000 
1 1 1   11    0  -68 o  138.384   1.7598  781.103   19.844  781.103   19.844  781.103   19.844  138.384   1.7598  138.384   1.7598 0.000000 0.000000 
1 1 1   11    0  -67 o   34.847   2.7270   50.426   7.6341   50.426   7.6341   50.426   7.6341   34.847   2.7270   34.847   2.7270 0.000000 0.000000 
1 1 1   11    0  -66 o   29.181   3.4999   36.209   8.0085   36.209   8.0085   36.209   8.0085   29.181   3.4999   29.181   3.4999 0.000000 0.000000 
1 1 1   11    0  -65 o   72.521   2.0478  214.935   12.084  214.935   12.084  214.935   12.084   72.521   2.0478   72.521   2.0478 0.000000 0.000000 
1 1 1   11    0  -64 o  203.937   2.2438  1696.35   37.290  1696.35   37.290  1696.35   37.290  203.937   2.2438  203.937   2.2438 0.000000 0.000000 
1 1 1   11    0  -63 o   15.253   6.4914   13.489   8.2004   13.489   8.2004   13.489   8.2004   15.253   6.4914   15.253   6.4914 0.000000 0.000000 
1 1 1   11    0  -62 o   48.286   2.6587   95.937   10.392   95.937   10.392   95.937   10.392   48.286   2.6587   48.286   2.6587 -0.000000 0.000000 
1 1 1   11    0  -61 o   59.133   6.4057  147.839   29.960  147.839   29.960  147.839   29.960   59.133   6.4057   59.133   6.4057 0.000000 0.000000 
1 1 1   11    0  -60 o   41.442   3.3254   71.389   11.062   71.389   11.062   71.389   11.062   41.442   3.3254   41.442   3.3254 0.000000 0.000000 
1 1 1   11    0  -59 o   98.819   2.2055  398.724   17.746  398.724   17.746  398.724   17.746   98.819   2.2055   98.819   2.2055 0.000000 0.000000 
1 1 1   11    0  -58 o  217.491   2.6683  1929.65   47.290  1929.65   47.290  1929.65   47.290  217.491   2.6683  217.491   2.6683 0.000000 0.000000 
1 1 1   11    0  -57 o  140.383   4.4101  806.547   50.353  806.547   50.353  806.547   50.353  140.383   4.4101  140.383   4.4101 -0.000000 0.000000 
1 1 1   11    0  -56 o  172.370   3.1387  1212.86   44.068  1212.86   44.068  1212.86   44.068  172.370   3.1387  172.370   3.1387 -0.000000 0.000000 
1 1 1   11    0  -55 o   65.379   2.8997  175.324   15.384  175.324   15.384  175.324   15.384   65.379   2.8997   65.379   2.8997 0.000000 0.000000 
1 1 1   11    0  -54 o  165.461   2.4808  1116.96   33.443  1116.96   33.443  1116.96   33.443  165.461   2.4808  165.461   2.4808 -0.000000 0.000000 
1 1 1   11    0  -53 o  261.343   2.5798  2785.55   54.947  2785.55   54.947  2785.55   54.947  261.343   2.5798  261.343   2.5798 0.000000 0.000000 
1 1 1   11    0  -52 o  215.890   2.3014  1900.81   40.490  1900.81   40.490  1900.81   40.490  215.890   2.3014  215.890   2.3014 0.000000 0.000000 
1 1 1   11    0  -51 o  327.044   3.0262  4362.48   80.660  4362.48   80.660  4362.48   80.660  327.044   3.0262  327.044   3.0262 0.000000 0.000000 
1 1 1   11    0  -50 o  421.746   3.7140  7256.07  127.659  7256.07  127.659  7256.07  127.659  421.746   3.7140  421.746   3.7140 0.000000 0.000000 
1 1 1   11    0  -49 o  164.514   2.0510  1103.82   27.495  1103.82   27.495  1103.82   27.495  164.514   2.0510  164.514   2.0510 0.000000 0.000000 
1 1 1   11    0  -48 o   24.715   4.4583   27.213   8.1146   27.213   8.1146   27.213   8.1146   24.715   4.4583   24.715   4.4583 0.000000 0.000000 
1 1 1   11    0  -47 o  240.927   2.4496  2367.13   48.097  2367.13   48.097  2367.13   48.097  240.927   2.4496  240.927   2.4496 0.000000 0.000000 
1 1 1   11    0  -46 o  101.612   1.9386  421.339   16.044  421.339   16.044  421.339   16.044  101.612   1.9386  101.612   1.9386 0.000000 0.000000 
1 1 1   11    0  -45 o  261.726   2.5785  2793.41   54.999  2793.41   54.999  2793.41   54.999  261.726   2.5785  261.726   2.5785 -0.000000 0.000000 
1 1 1   11    0  -44 o  369.098   3.3206  5556.03   99.887  5556.03   99.887  5556.03   99.887  369.098   3.3206  369.098   3.3206 0.000000 0.000000 
1 1 1   11    0  -43 o  324.678   3.0052  4298.87   79.520  4298.87   79.520  4298.87   79.520  324.678   3.0052  324.678   3.0052 0.000000 0.000000 
1 1 1   11    0  -42 o  318.614   3.3942  4140.38   88.131  4140.38   88.131  4140.38   88.131  318.614   3.3942  318.614   3.3942 0.000000 0.000000 
1 1 1   11    0  -41 o   72.927   2.7634  217.742   16.374  217.742   16.374  217.742   16.374   72.927   2.7634   72.927   2.7634 0.000000 0.000000 
1 1 1   11    0  -40 o  247.658   2.8363  2501.38   57.242  2501.38   57.242  2501.38   57.242  247.658   2.8363  247.658   2.8363 0.000000 0.000000 
1 1 1   11    0  -39 o  294.103   3.1963  3527.55   76.608  3527.55   76.608  3527.55   76.608  294.103   3.1963  294.103   3.1963 0.000000 0.000000 
1 1 1   11    0  -38 o  530.593   5.2296 11485.34  226.137 11485.34  226.137 11485.34  226.137  530.593   5.2296  530.593   5.2296 0.000000 0.000000 
1 1 1   11    0  -37 o  454.053   3.5251  8406.65  130.454  8406.65  130.454  8406.65  130.454  454.053   3.5251  454.053   3.5251 0.000000 0.000000 
1 1 1   11    0  -36 o  114.710   1.9302  536.804   18.037  536.804   18.037  536.804   18.037  114.710   1.9302  114.710   1.9302 0.000000 0.000000 
1 1 1   11    0  -35 o  127.420   1.9583  662.247   20.330  662.247   20.330  662.247   20.330  127.420   1.9583  127.420   1.9583 0.000000 0.000000 
1 1 1   11    0  -34 o  324.508   2.9993  4293.82   79.323  4293.82   79.323  4293.82   79.323  324.508   2.9993  324.508   2.9993 0.000000 0.000000 
1 1 1   11    0  -33 o  244.152   3.5806  2431.68   71.227  2431.68   71.227  2431.68   71.227  244.152   3.5806  244.152   3.5806 0.000000 0.000000 
1 1 1   11    0  -32 o  753.500   6.2917 23161.27  386.385 23161.27  386.385 23161.27  386.385  753.500   6.2917  753.500   6.2917 0.000000 0.000000 
1 1 1   11    0  -31 o  931.861   7.7171 35434.37  586.100 35434.37  586.100 35434.37  586.100  931.861   7.7171  931.861   7.7171 0.000000 0.000000 
1 1 1   11    0  -30 o  530.566   4.0502 11478.16  175.144 11478.16  175.144 11478.16  175.144  530.566   4.0502  530.566   4.0502 0.000000 0.000000 
1 1 1   11    0  -29 o  115.338   2.0963  542.760   19.694  542.760   19.694  542.760   19.694  115.338   2.0963  115.338   2.0963 0.000000 0.000000 
1 1 1   11    0  -28 o   26.829   4.2052   31.423   8.5226   31.423   8.5226   31.423   8.5226   26.829   4.2052   26.829   4.2052 -0.000000 0.000000 
1 1 1   11    0  -27 o  716.046   5.3537 20908.69  312.446 20908.69  312.446 20908.69  312.446  716.046   5.3537  716.046   5.3537 -0.000000 0.000000 
1 1 1   11    0  -26 o  104.106   2.2614  442.389   19.171  442.389   19.171  442.389   19.171  104.106   2.2614  104.106   2.2614 0.000000 0.000000 
1 1 1   11    0  -25 f  491.411   3.7799  9845.73  151.391  9845.73  151.391  9845.73  151.391  491.411   3.7799  491.411   3.7799 0.000000 0.000000 
1 1 1   11    0  -24 o  208.146   2.0059  1766.39   34.027  1766.39   34.027  1766.39   34.027  208.146   2.0059  208.146   2.0059 0.000000 0.000000 
1 1 1   11    0  -23 o   59.173   2.1483  143.283   10.331  143.283   10.331  143.283   10.331   59.173   2.1483   59.173   2.1483 0.000000 0.000000 
1 1 1   11    0  -22 o  113.151   1.7467  522.216   16.102  522.216   16.102  522.216   16.102  113.151   1.7467  113.151   1.7467 -0.000000 0.000000 
1 1 1   11    0  -21 o  434.595   3.3932  7700.29  120.191  7700.29  120.191  7700.29  120.191  434.595   3.3932  434.595   3.3932 0.000000 0.000000 
1 1 1   11    0  -20 o  420.860   3.3007  7221.23  113.219  7221.23  113.219  7221.23  113.219  420.860   3.3007  420.860   3.3007 0.000000 0.000000 
1 1 1   11    0  -19 o  181.067   2.1178  1336.85   31.249  1336.85   31.249  1336.85   31.249  181.067   2.1178  181.067   2.1178 -0.000000 0.000000 
1 1 1   11    0  -18 o  448.598   3.9035  8205.09  142.715  8205.09  142.715  8205.09  142.715  448.598   3.9035  448.598   3.9035 0.000000 0.000000 
1 1 1   11    0  -17 o  310.276   3.3341  3925.54   84.305  3925.54   84.305  3925.54   84.305  310.276   3.3341  310.276   3.3341 -0.000000 0.000000 
1 1 1   11    0  -16 o  283.072   3.1285  3267.38   72.169  3267.38   72.169  3267.38   72.169  283.072   3.1285  283.072   3.1285 0.000000 0.000000 
1 1 1   11    0  -15 o  546.038   5.3712 12158.87  239.022 12158.87  239.022 12158.87  239.022  546.038   5.3712  546.038   5.3712 0.000000 0.000000 
1 1 1   11    0  -14 o   27.113   6.3146   34.412   12.135   34.412   12.135   34.412   12.135   27.113   6.3146   27.113   6.3146 0.000000 0.000000 
1 1 1   11    0  -13 o  476.340   4.7555  9252.48  184.610  9252.48  184.610  9252.48  184.610  476.340   4.7555  476.340   4.7555 -0.000000 0.000000 
1 1 1   11    0  -12 o   91.039   2.1856  338.397   16.198  338.397   16.198  338.397   16.198   91.039   2.1856   91.039   2.1856 0.000000 0.000000 
1 1 1   11    0  -11 o  148.417   2.0781  898.354   25.130  898.354   25.130  898.354   25.130  148.417   2.0781  148.417   2.0781 0.000000 0.000000 
1 1 1   11    0  -10 o  150.404   2.0900  922.551   25.613  922.551   25.613  922.551   25.613  150.404   2.0900  150.404   2.0900 0.000000 0.000000 
1 1 1   11    0   -9 o   51.606   3.1047  109.729   12.951  109.729   12.951  109.729   12.951   51.606   3.1047   51.606   3.1047 0.000000 0.000000 
1 1 1   11    0   -8 o   12.779   7.7761   5.8719   15.174   5.8719   15.174   5.8719   15.174   12.779   7.7761   12.779   7.7761 -0.000000 0.000000 
1 1 1   11    0   -7 f  548.169   6.6126 12257.00  295.377 12257.00  295.377 12257.00  295.377  548.169   6.6126  548.169   6.6126 0.000000 0.000000 
1 1 1   11    0   -6 o  107.474   2.9816  471.899   26.075  471.899   26.075  471.899   26.075  107.474   2.9816  107.474   2.9816 -0.000000 0.000000 
1 1 1   11    0   -5 o  806.615   9.5106 26549.02  625.134 26549.02  625.134 26549.02  625.134  806.615   9.5106  806.615   9.5106 -0.000000 0.000000 
1 1 1   11    0   -4 o  270.204   3.7729  2977.80   83.063  2977.80   83.063  2977.80   83.063  270.204   3.7729  270.204   3.7729 -0.000000 0.000000 
1 1 1   11    0   -3 o  120.849   2.4198  595.987   23.816  595.987   23.816  595.987   23.816  120.849   2.4198  120.849   2.4198 0.000000 0.000000 
1 1 1   11    0   -2 o  218.178   2.7297  1941.15   48.529  1941.15   48.529  1941.15   48.529  218.178   2.7297  218.178   2.7297 -0.000000 0.000000 
1 1 1   11    0   -1 o  1046.49   9.9764 44683.87  850.858 44683.87  850.858 44683.87  850.858  1046.49   9.9764  1046.49   9.9764 -0.000000 0.000000 
1 1 1   11    0    0 o  331.004   3.5396  4467.51   95.480  4467.51   95.480  4467.51   95.480  331.004   3.5396  331.004   3.5396 -0.000000 0.000000 
1 1 1   11    0    1 o  706.253   8.3766 20349.86  482.087 20349.86  482.087 20349.86  482.087  706.253   8.3766  706.253   8.3766 -0.000000 0.000000 
1 1 1   11    0    3 o  493.397   4.9140  9926.92  197.594  9926.92  197.594  9926.92  197.594  493.397   4.9140  493.397   4.9140 -0.000000 0.000000 
1 1 1   11    0    4 o  377.310   3.9191  5804.95  120.507  5804.95  120.507  5804.95  120.507  377.310   3.9191  377.310   3.9191 -0.000000 0.000000 
1 1 1   11    0    5 o  986.332   9.4188 39691.09  757.121 39691.09  757.121 39691.09  757.121  986.332   9.4188  986.332   9.4188 -0.000000 0.000000 
1 1 1   11    0    6 o  780.391   7.5141 24840.33  477.897 24840.33  477.897 24840.33  477.897  780.391   7.5141  780.391   7.5141 0.000000 0.000000 
1 1 1   11    0    7 f  184.675   2.5579  1390.90   38.489  1390.90   38.489  1390.90   38.489  184.675   2.5579  184.675   2.5579 -0.000000 0.000000 
1 1 1   11    0    8 o  518.552   5.1402 10965.19  217.228 10965.19  217.228 10965.19  217.228  518.552   5.1402  518.552   5.1402 0.000000 0.000000 
1 1 1   11    0    9 o   81.495   3.1178  271.896   20.643  271.896   20.643  271.896   20.643   81.495   3.1178   81.495   3.1178 -0.000000 0.000000 
1 1 1   11    0   10 o  216.644   2.6997  1913.94   47.659  1913.94   47.659  1913.94   47.659  216.644   2.6997  216.644   2.6997 0.000000 0.000000 
1 1 1   11    0   11 o  285.379   3.1769  3320.87   73.882  3320.87   73.882  3320.87   73.882  285.379   3.1769  285.379   3.1769 -0.000000 0.000000 
1 1 1   11    0   12 o  354.006   3.7216  5110.04  107.368  5110.04  107.368  5110.04  107.368  354.006   3.7216  354.006   3.7216 -0.000000 0.000000 
1 1 1   11    0   13 o  959.042   9.1695 37525.66  716.691 37525.66  716.691 37525.66  716.691  959.042   9.1695  959.042   9.1695 -0.000000 0.000000 
1 1 1   11    0   14 o  235.445   2.8417  2260.52   54.520  2260.52   54.520  2260.52   54.520  235.445   2.8417  235.445   2.8417 0.000000 0.000000 
1 1 1   11    0   15 o  944.188   11.063 36391.03  851.200 36391.03  851.200 36391.03  851.200  944.188   11.063  944.188   11.063 -0.000000 0.000000 
1 1 1   11    0   16 o   30.903   8.2252   46.318   17.901   46.318   17.901   46.318   17.901   30.903   8.2252   30.903   8.2252 -0.000000 0.000000 
1 1 1   11    0   17 o  719.850   8.5255 21143.38  500.102 21143.38  500.102 21143.38  500.102  719.850   8.5255  719.850   8.5255 -0.000000 0.000000 
1 1 1   11    0   18 o  375.773   4.7701  5759.21  146.059  5759.21  146.059  5759.21  146.059  375.773   4.7701  375.773   4.7701 0.000000 0.000000 
1 1 1   11    0   19 o  659.877   6.4039 17759.59  344.388 17759.59  344.388 17759.59  344.388  659.877   6.4039  659.877   6.4039 -0.000000 0.000000 
1 1 1   11    0   20 o  875.631   8.3852 31281.09  598.383 31281.09  598.383 31281.09  598.383  875.631   8.3852  875.631   8.3852 -0.000000 0.000000 
1 1 1   11    0   21 o  279.799   3.8015  3193.04   86.668  3193.04   86.668  3193.04   86.668  279.799   3.8015  279.799   3.8015 -0.000000 0.000000 
1 1 1   11    0   22 o  531.643   5.2430 11526.67  227.165 11526.67  227.165 11526.67  227.165  531.643   5.2430  531.643   5.2430 0.000000 0.000000 
1 1 1   11    0   23 o  805.890   7.7417 26495.47  508.462 26495.47  508.462 26495.47  508.462  805.890   7.7417  805.890   7.7417 -0.000000 0.000000 
1 1 1   11    0   24 o  330.048   3.5043  4441.90   94.254  4441.90   94.254  4441.90   94.254  330.048   3.5043  330.048   3.5043 0.000000 0.000000 
1 1 1   11    0   25 f  417.809   4.2414  7118.53  144.417  7118.53  144.417  7118.53  144.417  417.809   4.2414  417.809   4.2414 -0.000000 0.000000 
1 1 1   11    0   26 o  242.832   3.4624  2405.19   68.505  2405.19   68.505  2405.19   68.505  242.832   3.4624  242.832   3.4624 0.000000 0.000000 
1 1 1   11    0   27 o   13.528   7.3761   10.448   11.541   10.448   11.541   10.448   11.541   13.528   7.3761   13.528   7.3761 -0.000000 0.000000 
1 1 1   11    0   28 o   99.819   2.3340  406.800   18.968  406.800   18.968  406.800   18.968   99.819   2.3340   99.819   2.3340 -0.000000 0.000000 
1 1 1   11    0   29 o  267.035   3.0071  2907.80   65.439  2907.80   65.439  2907.80   65.439  267.035   3.0071  267.035   3.0071 -0.000000 0.000000 
1 1 1   11    0   30 o  155.180   2.8463  982.580   35.976  982.580   35.976  982.580   35.976  155.180   2.8463  155.180   2.8463 0.000000 0.000000 
1 1 1   11    0   31 o  657.350   6.3820 17628.47  341.899 17628.47  341.899 17628.47  341.899  657.350   6.3820  657.350   6.3820 -0.000000 0.000000 
1 1 1   11    0   32 o   65.346   2.8311  175.039   15.015  175.039   15.015  175.039   15.015   65.346   2.8311   65.346   2.8311 -0.000000 0.000000 
1 1 1   11    0   33 o  709.158   6.8584 20520.45  396.379 20520.45  396.379 20520.45  396.379  709.158   6.8584  709.158   6.8584 -0.000000 0.000000 
1 1 1   11    0   34 o   68.189   2.7064  190.430   14.989  190.430   14.989  190.430   14.989   68.189   2.7064   68.189   2.7064 0.000000 0.000000 
1 1 1   11    0   35 o  564.161   5.5373 12984.06  254.589 12984.06  254.589 12984.06  254.589  564.161   5.5373  564.161   5.5373 -0.000000 0.000000 
1 1 1   11    0   36 o  382.859   4.8327  5980.13  150.766  5980.13  150.766  5980.13  150.766  382.859   4.8327  382.859   4.8327 -0.000000 0.000000 
1 1 1   11    0   37 o  133.062   2.7381  722.674   29.670  722.674   29.670  722.674   29.670  133.062   2.7381  133.062   2.7381 -0.000000 0.000000 
1 1 1   11    0   38 o  284.241   5.4186  3298.83  125.444  3298.83  125.444  3298.83  125.444  284.241   5.4186  284.241   5.4186 0.000000 0.000000 
1 1 1   11    0   39 o  173.305   4.0958  1226.71   57.788  1226.71   57.788  1226.71   57.788  173.305   4.0958  173.305   4.0958 -0.000000 0.000000 
1 1 1   11    0   40 o  392.447   6.9664  6291.56  222.699  6291.56  222.699  6291.56  222.699  392.447   6.9664  392.447   6.9664 0.000000 0.000000 
1 1 1   11    0   41 o  347.652   6.3214  4936.65  179.007  4936.65  179.007  4936.65  179.007  347.652   6.3214  347.652   6.3214 -0.000000 0.000000 
1 1 1   11    0   42 o  599.084   7.1934 14657.92  351.170 14657.92  351.170 14657.92  351.170  599.084   7.1934  599.084   7.1934 0.000000 0.000000 
1 1 1   11    0   43 o  176.197   2.9895  1266.80   42.909  1266.80   42.909  1266.80   42.909  176.197   2.9895  176.197   2.9895 -0.000000 0.000000 
1 1 1   11    0   44 o  176.611   2.9874  1272.77   42.979  1272.77   42.979  1272.77   42.979  176.611   2.9874  176.611   2.9874 -0.000000 0.000000 
1 1 1   11    0   45 o  213.757   3.2540  1864.32   56.669  1864.32   56.669  1864.32   56.669  213.757   3.2540  213.757   3.2540 -0.000000 0.000000 
1 1 1   11    0   46 o  190.015   3.0795  1473.29   47.670  1473.29   47.670  1473.29   47.670  190.015   3.0795  190.015   3.0795 0.000000 0.000000 
1 1 1   11    0   47 o  257.546   3.6289  2706.55   76.150  2706.55   76.150  2706.55   76.150  257.546   3.6289  257.546   3.6289 -0.000000 0.000000 
1 1 1   11    0   48 o  111.942   2.8145  511.877   25.645  511.877   25.645  511.877   25.645  111.942   2.8145  111.942   2.8145 0.000000 0.000000 
1 1 1   11    0   49 o   53.979   3.6783  120.475   16.010  120.475   16.010  120.475   16.010   53.979   3.6783   53.979   3.6783 -0.000000 0.000000 
1 1 1   11    0   50 o   54.574   3.6867  123.120   16.226  123.120   16.226  123.120   16.226   54.574   3.6867   54.574   3.6867 0.000000 0.000000 
1 1 1   11    0   51 o  336.658   4.3894  4626.25  120.410  4626.25  120.410  4626.25  120.410  336.658   4.3894  336.658   4.3894 -0.000000 0.000000 
1 1 1   11    0   52 o  107.876   2.8001  475.453   24.585  475.453   24.585  475.453   24.585  107.876   2.8001  107.876   2.8001 0.000000 0.000000 
1 1 1   11    0   53 o  121.045   2.7866  598.373   27.462  598.373   27.462  598.373   27.462  121.045   2.7866  121.045   2.7866 -0.000000 0.000000 
1 1 1   11    0   54 o  103.258   2.8052  435.715   23.572  435.715   23.572  435.715   23.572  103.258   2.8052  103.258   2.8052 0.000000 0.000000 
1 1 1   11    0   55 o  165.551   2.9407  1118.66   39.656  1118.66   39.656  1118.66   39.656  165.551   2.9407  165.551   2.9407 -0.000000 0.000000 
1 1 1   11    0   56 o   86.470   2.9335  305.950   20.623  305.950   20.623  305.950   20.623   86.470   2.9335   86.470   2.9335 0.000000 0.000000 
1 1 1   11    0   57 o  132.835   2.8199  720.495   30.503  720.495   30.503  720.495   30.503  132.835   2.8199  132.835   2.8199 -0.000000 0.000000 
1 1 1   11    0   58 o   22.494   10.625   30.405   22.022   30.405   22.022   30.405   22.022   22.494   10.625   22.494   10.625 0.000000 0.000000 
1 1 1   11    0   59 o   50.163   6.3434  107.618   24.811  107.618   24.811  107.618   24.811   50.163   6.3434   50.163   6.3434 -0.000000 0.000000 
1 1 1   11    0   60 o  146.601   4.2289  879.168   50.441  879.168   50.441  879.168   50.441  146.601   4.2289  146.601   4.2289 0.000000 0.000000 
1 1 1   11    0   61 o  137.979   3.1046  777.638   34.878  777.638   34.878  777.638   34.878  137.979   3.1046  137.979   3.1046 -0.000000 0.000000 
1 1 1   11    0   62 o   74.457   3.7189  227.857   22.442  227.857   22.442  227.857   22.442   74.457   3.7189   74.457   3.7189 0.000000 0.000000 
1 1 1   11    0   63 o   51.892   2.6295  110.647   11.057  110.647   11.057  110.647   11.057   51.892   2.6295   51.892   2.6295 -0.000000 0.000000 
1 1 1   11    0   64 o  204.884   2.2731  1712.18   37.952  1712.18   37.952  1712.18   37.952  204.884   2.2731  204.884   2.2731 0.000000 0.000000 
1 1 1   11    0   65 o  133.103   2.0121  722.795   21.819  722.795   21.819  722.795   21.819  133.103   2.0121  133.103   2.0121 -0.000000 0.000000 
1 1 1   11    0   66 o   32.436   4.0231   44.873   10.197   44.873   10.197   44.873   10.197   32.436   4.0231   32.436   4.0231 0.000000 0.000000 
1 1 1   11    0   67 o  108.077   2.3770  476.987   20.919  476.987   20.919  476.987   20.919  108.077   2.3770  108.077   2.3770 -0.000000 0.000000 
1 1 1   11    0   68 o   55.005   2.8183  124.366   12.560  124.366   12.560  124.366   12.560   55.005   2.8183   55.005   2.8183 0.000000 0.000000 
1 1 1   11    0   69 o  184.287   2.2622  1385.46   33.972  1385.46   33.972  1385.46   33.972  184.287   2.2622  184.287   2.2622 -0.000000 0.000000 
1 1 1   11    0   70 o   9.7892   6.5672  -5.7803   14.718  -5.7803   14.718  -5.7803   14.718   9.7892   6.5672   9.7892   6.5672 -0.000000 0.000000 
1 1 1   11    0   71 o   71.925   2.4473  211.699   14.311  211.699   14.311  211.699   14.311   71.925   2.4473   71.925   2.4473 0.000000 0.000000 
1 1 1   11    0   72 o  235.011   2.4714  2253.19   47.332  2253.19   47.332  2253.19   47.332  235.011   2.4714  235.011   2.4714 -0.000000 0.000000 
1 1 1   11    0   73 f  317.025   2.9870  4101.40   77.175  4101.40   77.175  4101.40   77.175  317.025   2.9870  317.025   2.9870 -0.000000 0.000000 
1 1 1   11    0   74 o   6.9057   4.7815  -7.6863   9.2386  -7.6863   9.2386  -7.6863   9.2386   6.9057   4.7815   6.9057   4.7815 0.000000 0.000000 
1 1 1   11    0   75 o   57.320   2.5262  134.796   11.751  134.796   11.751  134.796   11.751   57.320   2.5262   57.320   2.5262 0.000000 0.000000 
1 1 1   11    0   76 o  145.642   2.0281  865.505   24.067  865.505   24.067  865.505   24.067  145.642   2.0281  145.642   2.0281 -0.000000 0.000000 
1 1 1   11    0   77 o   7.6051   5.0751  -2.8679   8.5853  -2.8679   8.5853  -2.8679   8.5853   7.6051   5.0751   7.6051   5.0751 0.000000 0.000000 
1 1 1   11    0   78 o   89.021   2.2897  323.884   16.591  323.884   16.591  323.884   16.591   89.021   2.2897   89.021   2.2897 0.000000 0.000000 
1 1 1   11    0   79 o   45.397   3.1445   85.331   11.506   85.331   11.506   85.331   11.506   45.397   3.1445   45.397   3.1445 0.000000 0.000000 
1 1 1   11    0   80 o   13.489   6.9253   10.939   9.6846   10.939   9.6846   10.939   9.6846   13.489   6.9253   13.489   6.9253 -0.000000 0.000000 
1 1 1   11    0   81 o   47.025   2.7694   91.186   10.531   91.186   10.531   91.186   10.531   47.025   2.7694   47.025   2.7694 -0.000000 0.000000 
1 1 1   11    0   82 o  227.973   2.4035  2121.27   44.654  2121.27   44.654  2121.27   44.654  227.973   2.4035  227.973   2.4035 0.000000 0.000000 
1 1 1   11    0   83 o  145.183   2.0248  860.306   23.952  860.306   23.952  860.306   23.952  145.183   2.0248  145.183   2.0248 0.000000 0.000000 
1 1 1   11    0   84 o  159.826   2.0646  1042.61   26.887  1042.61   26.887  1042.61   26.887  159.826   2.0646  159.826   2.0646 0.000000 0.000000 
1 1 1   11    0   85 o   49.320   2.7709  100.253   11.059  100.253   11.059  100.253   11.059   49.320   2.7709   49.320   2.7709 -0.000000 0.000000 
1 1 1   11    0   86 o   44.794   2.8516   82.934   10.314   82.934   10.314   82.934   10.314   44.794   2.8516   44.794   2.8516 0.000000 0.000000 
1 1 1   11    0   87 o   32.661   3.7754   45.351   9.7025   45.351   9.7025   45.351   9.7025   32.661   3.7754   32.661   3.7754 0.000000 0.000000 
1 1 1   11    0   88 o  134.865   2.0498  742.765   22.522  742.765   22.522  742.765   22.522  134.865   2.0498  134.865   2.0498 0.000000 0.000000 
1 1 1   11    0   89 o  246.681   2.5341  2486.17   50.945  2486.17   50.945  2486.17   50.945  246.681   2.5341  246.681   2.5341 -0.000000 0.000000 
1 1 1   11    0   90 o   21.902   5.6929   23.268   8.7822   23.268   8.7822   23.268   8.7822   21.902   5.6929   21.902   5.6929 -0.000000 0.000000 
1 1 1   11    0   91 o   50.190   2.5452  103.715   10.352  103.715   10.352  103.715   10.352   50.190   2.5452   50.190   2.5452 -0.000000 0.000000 
1 1 1   11    0   92 o  119.605   1.9504  584.463   19.004  584.463   19.004  584.463   19.004  119.605   1.9504  119.605   1.9504 0.000000 0.000000 
1 1 1   11    0   93 o   25.550   4.2728   28.931   8.1518   28.931   8.1518   28.931   8.1518   25.550   4.2728   25.550   4.2728 -0.000000 0.000000 
1 1 1   11    0   94 o   11.934   6.5140   8.3680   9.0110   8.3680   9.0110   8.3680   9.0110   11.934   6.5140   11.934   6.5140 -0.000000 0.000000 
1 1 1   11    0   95 o   80.806   2.3476  267.636   15.434  267.636   15.434  267.636   15.434   80.806   2.3476   80.806   2.3476 -0.000000 0.000000 
1 1 1   11    0   96 o   85.163   2.3030  297.220   15.961  297.220   15.961  297.220   15.961   85.163   2.3030   85.163   2.3030 0.000000 0.000000 
1 1 1   11    0   97 o   75.493   2.0482  233.457   12.583  233.457   12.583  233.457   12.583   75.493   2.0482   75.493   2.0482 -0.000000 0.000000 
1 1 1   11    0   98 o   88.427   1.9758  320.099   14.226  320.099   14.226  320.099   14.226   88.427   1.9758   88.427   1.9758 -0.000000 0.000000 
1 1 1   11    0   99 o  131.607   1.9665  708.610   21.086  708.610   21.086  708.610   21.086  131.607   1.9665  131.607   1.9665 -0.000000 0.000000 
1 1 1   11    0  100 o  136.709   1.9757  764.786   22.006  764.786   22.006  764.786   22.006  136.709   1.9757  136.709   1.9757 0.000000 0.000000 
1 1 1   11    0  101 o   5.8581   4.0961  -7.0552   7.2403  -7.0552   7.2403  -7.0552   7.2403   5.8581   4.0961   5.8581   4.0961 0.000000 0.000000 
1 1 1   11    0  102 o   7.1320   4.7427  -1.9066   7.3859  -1.9066   7.3859  -1.9066   7.3859   7.1320   4.7427   7.1320   4.7427 0.000000 0.000000 
1 1 1   11    0  103 f   9.1709   5.5429   3.6117   7.6002   3.6117   7.6002   3.6117   7.6002   9.1709   5.5429   9.1709   5.5429 0.000000 0.000000 
1 1 1   11    0  104 o   6.6813   4.5465  -3.9728   7.5606  -3.9728   7.5606  -3.9728   7.5606   6.6813   4.5465   6.6813   4.5465 -0.000000 0.000000 
1 1 1   11    0  105 o   93.757   1.9889  360.455   15.185  360.455   15.185  360.455   15.185   93.757   1.9889   93.757   1.9889 0.000000 0.000000 
1 1 1   11    0  106 o   48.506   2.5539   97.462   10.034   97.462   10.034   97.462   10.034   48.506   2.5539   48.506   2.5539 -0.000000 0.000000 
1 1 1   11    0  107 o   43.870   2.7451   80.124   9.7276   80.124   9.7276   80.124   9.7276   43.870   2.7451   43.870   2.7451 -0.000000 0.000000 
1 1 1   11    0  108 o   20.375   5.8668   21.234   8.4490   21.234   8.4490   21.234   8.4490   20.375   5.8668   20.375   5.8668 0.000000 0.000000 
1 1 1   11    0  109 o   34.959   3.5795   52.260   9.9346   52.260   9.9346   52.260   9.9346   34.959   3.5795   34.959   3.5795 0.000000 0.000000 
1 1 1   11    0  110 f   94.672   2.2367  368.858   17.240  368.858   17.240  368.858   17.240   94.672   2.2367   94.672   2.2367 0.000000 0.000000 
1 1 1   11    0  111 o   38.930   3.5022   64.529   10.897   64.529   10.897   64.529   10.897   38.930   3.5022   38.930   3.5022 0.000000 0.000000 
1 1 1   11    0  112 o   33.342   4.1020   48.652   10.697   48.652   10.697   48.652   10.697   33.342   4.1020   33.342   4.1020 0.000000 0.000000 
1 1 1   11    0  113 o   63.141   3.5881  168.290   18.330  168.290   18.330  168.290   18.330   63.141   3.5881   63.141   3.5881 -0.000000 0.000000 
1 1 1   11    0  114 o   41.159   8.8478   87.041   26.055   87.041   26.055   87.041   26.055   41.159   8.8478   41.159   8.8478 0.000000 0.000000 
1 1 1   11    0  115 o   12.646   7.3077   10.148   12.191   10.148   12.191   10.148   12.191   12.646   7.3077   12.646   7.3077 -0.000000 0.000000 
1 1 1   11    0  116 o   30.894   5.9134   45.667   13.312   45.667   13.312   45.667   13.312   30.894   5.9134   30.894   5.9134 -0.000000 0.000000 
1 1 1   11    0  117 o   43.266   4.2149   81.964   14.519   81.964   14.519   81.964   14.519   43.266   4.2149   43.266   4.2149 -0.000000 0.000000 
1 1 1   11    0  119 o   13.039   7.5949   11.492   13.335   11.492   13.335   11.492   13.335   13.039   7.5949   13.039   7.5949 0.000000 0.000000 
1 1 1   11    0  120 o   45.820   4.2293   92.200   15.470   92.200   15.470   92.200   15.470   45.820   4.2293   45.820   4.2293 -0.000000 0.000000 
1 1 1   11    0  121 o   26.293   7.8565   38.925   14.660   38.925   14.660   38.925   14.660   26.293   7.8565   26.293   7.8565 -0.000000 0.000000 
1 1 1   11    0  122 o   7.6900   5.4129 -11.7794   13.285 -11.7794   13.285 -11.7794   13.285   7.6900   5.4129   7.6900   5.4129 -0.000000 0.000000 
1 1 1   11    0  123 o   16.512   8.3754   20.329   14.063   20.329   14.063   20.329   14.063   16.512   8.3754   16.512   8.3754 0.000000 0.000000 
1 1 1   11    0  124 o   20.916   8.5992   29.352   14.494   29.352   14.494   29.352   14.494   20.916   8.5992   20.916   8.5992 -0.000000 0.000000 
1 1 1   11    0  125 o   12.039   7.7690   6.3464   17.726   6.3464   17.726   6.3464   17.726   12.039   7.7690   12.039   7.7690 -0.000000 0.000000 
1 1 1   11    0  126 o   15.431   8.8188   19.030   17.467   19.030   17.467   19.030   17.467   15.431   8.8188   15.431   8.8188 -0.000000 0.000000 
1 1 1   11    0  127 o   14.273   8.4783   15.566   17.190   15.566   17.190   15.566   17.190   14.273   8.4783   14.273   8.4783 0.000000 0.000000 
1 1 1   11    0  128 f   25.063   9.2218   41.174   17.420   41.174   17.420   41.174   17.420   25.063   9.2218   25.063   9.2218 -0.000000 0.000000 
1 1 1   11    0  129 o   17.892   9.1752   25.682   16.987   25.682   16.987   25.682   16.987   17.892   9.1752   17.892   9.1752 0.000000 0.000000 
1 1 1   11    0  130 o   12.877   8.6201   4.8389   25.109   4.8389   25.109   4.8389   25.109   12.877   8.6201   12.877   8.6201 0.000000 0.000000 
1 1 1   11    1 -128 o   12.844   5.5163   4.0656   10.381   6.5633   15.653   2.1047   13.870   14.980   6.5974   13.511   6.0638 1.468349 8.960739 
1 1 1   11    1 -127 o   12.467   5.4091   3.0560   10.183  -2.1886   15.479   7.0571   13.520   13.177   6.0985   14.604   6.2840 -1.426652 8.756731 
1 1 1   11    1 -126 o   10.975   4.9642  -1.3495   9.5072   5.8363   13.566  -8.2841   13.327   14.339   6.2322   11.357   5.3823 2.982128 8.234712 
1 1 1   11    1 -125 o   16.343   6.0261   13.431   10.586   5.1535   13.595   26.180   16.873   14.228   6.2105   20.662   7.6096 -6.433616 9.822227 
1 1 1   11    1 -124 o   22.069   5.8681   25.544   10.738   29.453   13.886   19.730   16.935   22.713   6.8959   18.719   7.4342 3.994061 10.14002 
1 1 1   11    1 -123 o   11.689   5.1537   0.8871   9.5764   11.736   13.225 -11.0742   13.886   16.103   6.5095   11.253   5.3779 4.850327 8.443647 
1 1 1   11    1 -122 o   13.213   5.4534   5.6319   9.5221   17.582   13.040  -8.0208   13.938   18.184   6.6909   11.784   5.5604 6.400767 8.699741 
1 1 1   11    1 -121 o   38.533   3.3164   65.273   10.316   64.997   14.309   65.572   14.885   36.983   4.8643   36.920   5.0807 0.6340790E-01 7.033850 
1 1 1   11    1 -120 o   30.764   3.9857   42.958   9.7603   36.387   13.745   49.642   13.862   26.148   6.4814   31.675   5.5721 -5.526733 8.547320 
1 1 1   11    1 -119 o   13.783   5.4721   7.1532   9.1730   2.6406   12.920   11.741   13.026   13.665   6.0070   16.320   6.5073 -2.654507 8.855997 
1 1 1   11    1 -118 o   34.285   3.5650   51.980   9.8180   46.298   13.533   58.293   14.265   30.668   5.6206   34.925   5.1664 -4.256702 7.634300 
1 1 1   11    1 -117 o   21.725   5.7491   23.736   10.338   5.1229   16.450   35.884   13.290   15.451   6.7857   26.411   6.2678 -10.95986 9.237437 
1 1 1   11    1 -116 o   10.145   4.6532  -3.8355   8.7294  -3.8031   12.277  -3.8685   12.415   12.053   5.5245   12.103   5.5505 -0.5042934E-01 7.831200 
1 1 1   11    1 -115 o   15.633   5.5198   11.084   8.7653   5.2291   12.275   17.176   12.521   14.391   6.0829   18.621   6.5951 -4.229934 8.972023 
1 1 1   11    1 -114 o   10.901   5.0532  -6.0183   10.692 -11.0077   14.623  -0.2854   15.675   11.992   5.6696   14.386   6.4520 -2.394141 8.589127 
1 1 1   11    1 -113 o   11.798   5.2118  -0.5697   9.8387 -20.0163   12.379   32.790   16.213   9.6223   4.7097   24.894   7.4278 -15.27176 8.795025 
1 1 1   11    1 -112 o   11.098   5.0302  -3.3472   9.8207  -7.6252   12.654   3.1331   15.574   11.731   5.4582   15.298   6.6627 -3.566380 8.612965 
1 1 1   11    1 -111 o   10.727   4.8913  -4.1522   9.4606  -4.7241   14.977  -3.7724   12.203   13.472   6.1472   12.355   5.6029 1.116456 8.317454 
1 1 1   11    1 -110 o   28.036   4.7905   35.397   10.555   38.568   14.430   31.748   15.479   28.310   6.4035   25.186   7.1866 3.123878 9.625608 
1 1 1   11    1 -109 o   30.950   3.7450   41.366   9.2564   44.298   12.933   38.286   13.254   31.243   5.2652   28.653   5.8722 2.589722 7.887040 
1 1 1   11    1 -108 o   17.630   5.2358   14.051   8.0707   24.023   10.470  -0.5490   12.669   22.760   5.6657   13.536   5.9494 9.223794 8.215553 
1 1 1   11    1 -107 o   54.887   2.2089  124.708   9.8627  120.030   12.822  131.485   15.434   53.524   2.9503   55.776   3.4109 -2.251438 4.509847 
1 1 1   11    1 -106 o   39.386   2.7873   64.854   8.8909   58.419   11.573   74.121   13.888   36.926   3.9039   41.506   4.1610 -4.579384 5.705652 
1 1 1   11    1 -105 o   22.960   4.5488   23.305   8.2124   26.007   10.880   19.727   12.521   23.862   5.6763   20.781   6.5881 3.080833 8.696124 
1 1 1   11    1 -104 o   32.614   3.2827   44.910   8.6086   42.564   11.249   48.226   13.373   31.257   4.5484   33.033   5.1333 -1.775826 6.858472 
1 1 1   11    1 -103 o   33.142   3.5372   46.551   9.4085   44.486   11.135   51.703   17.589   32.073   4.3731   33.456   6.6835 -1.383709 7.987067 
1 1 1   11    1 -102 o   37.025   3.1863   57.514   9.5230   60.625   11.209   49.442   18.053   37.844   3.6800   32.616   6.9999 5.228615 7.908281 
1 1 1   11    1 -101 o   18.559   5.3836   15.254   8.6188   16.093   10.037   12.899   16.816   19.091   5.8759   19.268   7.4806 -0.1772556 9.512373 
1 1 1   11    1 -100 o   19.142   5.3884   16.240   8.7618   21.628   10.284   1.9737   16.733   21.953   5.6980   16.333   7.0088 5.620445 9.032781 
1 1 1   11    1  -99 o   27.535   4.0503   32.422   8.8194   29.614   10.280   40.250   17.164   25.977   5.0368   29.542   7.1954 -3.564846 8.783074 
1 1 1   11    1  -98 o   28.971   3.8381   35.618   8.8413   19.294   11.714   57.229   13.478   20.896   6.3314   36.560   4.6260 -15.66338 7.841341 
1 1 1   11    1  -97 o   92.852   1.8312  353.229   13.860  347.493   19.076  359.643   20.172   91.836   2.5508   93.388   2.6525 -1.552086 3.679983 
1 1 1   11    1  -96 o   26.641   4.1700   30.298   8.7590   24.135   12.032   37.246   12.775   23.286   6.2209   29.156   5.5785 -5.870037 8.355778 
1 1 1   11    1  -95 o   21.068   5.5341   19.491   9.6248   15.212   12.811   25.037   14.585   19.419   6.6848   23.768   7.0333 -4.349453 9.703243 
1 1 1   11    1  -94 o  120.652   1.7812  595.566   17.518  590.120   21.417  606.575   30.450  119.982   2.1898  121.264   3.0829 -1.282173 3.781487 
1 1 1   11    1  -93 o   46.224   2.6294   88.023   9.8666  104.048   12.329   59.478   16.454   50.185   3.0279   37.196   5.6004 12.98940 6.366522 
1 1 1   11    1  -92 o   27.872   3.7470   32.656   8.2979   19.640   10.867   50.859   12.851   21.270   6.0056   34.660   4.6670 -13.38972 7.605846 
1 1 1   11    1  -91 o   47.130   2.3762   91.225   9.0993   93.364   11.971   88.298   14.004   47.554   3.1051   46.101   3.7591 1.452545 4.875714 
1 1 1   11    1  -90 o   31.021   3.4429   40.078   8.5597   30.485   11.151   53.836   13.355   26.591   5.3304   35.729   4.6993 -9.138369 7.106105 
1 1 1   11    1  -89 o   19.848   5.0832   16.986   8.2594   23.259   10.938   8.6631   12.598   23.152   5.8067   17.021   6.5096 6.131315 8.723067 
1 1 1   11    1  -88 o   30.648   3.6132   39.152   8.8536   43.103   11.668   33.788   13.594   31.971   4.6100   27.909   6.1421 4.062090 7.679710 
1 1 1   11    1  -87 o  101.658   1.7452  422.024   14.462  420.220   18.907  424.568   22.450  101.369   2.2882  101.789   2.7082 -0.4193573 3.545397 
1 1 1   11    1  -86 o   85.565   2.0477  299.140   14.282  277.992   19.727  322.434   20.704   82.325   2.9444   88.684   2.8678 -6.358414 4.110195 
1 1 1   11    1  -85 o   52.610   2.4093  113.395   10.305  109.984   13.628  117.949   15.747   51.699   3.2503   53.484   3.6334 -1.784901 4.875055 
1 1 1   11    1  -84 o   42.014   2.8017   72.541   9.5405   71.298   12.464   74.300   14.825   41.519   3.7223   42.279   4.3644 -0.7596779 5.736135 
1 1 1   11    1  -83 o   82.434   1.7931  277.375   12.049  287.632   16.030  264.052   18.269   83.867   2.3471   80.297   2.7953 3.570808 3.650042 
1 1 1   11    1  -82 o   27.814   4.3043   32.511   9.4441   21.552   13.098   44.381   13.630   22.590   6.6601   32.388   5.3495 -9.797831 8.542463 
1 1 1   11    1  -81 o  114.103   1.3673  531.041   12.717  533.326   23.368  530.080   15.158  114.246   2.5092  113.982   1.6315 0.2649689 2.992988 
1 1 1   11    1  -80 o  172.857   1.5696  1218.94   22.116  1231.12   36.296  1211.75   27.892  173.584   2.5652  172.298   1.9859 1.285645 3.244069 
1 1 1   11    1  -79 o  106.969   1.4267  466.697   12.441  473.251   22.121  463.665   15.045  107.634   2.5212  106.602   1.7314 1.031685 3.058484 
1 1 1   11    1  -78 o   52.249   1.7269  111.501   7.3449  109.724   17.596  111.876   8.0828   51.560   4.2235   52.326   1.8981 -0.7656517 4.630442 
1 1 1   11    1  -77 o   44.639   1.9452   81.468   7.0610   78.042   17.224   82.160   7.7414   43.311   4.9685   44.816   2.1252 -1.504276 5.403921 
1 1 1   11    1  -76 o   90.255   1.6645  332.280   12.246  327.418   22.928  334.220   14.484   89.442   3.1497   90.503   1.9634 -1.061188 3.711546 
1 1 1   11    1  -75 o   92.863   1.4877  351.686   11.261  341.902   23.380  354.642   12.850   91.411   3.1424   93.244   1.6906 -1.832985 3.568314 
1 1 1   11    1  -74 o   81.628   1.4710  271.729   9.7877  255.330   18.431  278.170   11.551   79.012   2.8665   82.581   1.7159 -3.569527 3.340824 
1 1 1   11    1  -73 o  153.856   1.4611  965.316   18.325  966.335   31.762  964.807   22.435  153.854   2.5325  153.795   1.7896 0.5949402E-01 3.101034 
1 1 1   11    1  -72 o   57.522   1.7247  135.073   8.0776  163.645   16.334  125.823   9.2936   63.210   3.1802   55.496   2.0580 7.714142 3.787997 
1 1 1   11    1  -71 o   90.046   1.4860  330.636   10.907  338.178   19.971  327.430   13.021   90.977   2.6960   89.599   1.7827 1.378105 3.232079 
1 1 1   11    1  -70 o  106.768   1.5874  464.852   13.816  464.593   22.657  465.006   17.432  106.691   2.6052  106.769   2.0029 -0.7799530E-01 3.286078 
1 1 1   11    1  -69 o   52.241   2.1259  111.513   9.0339  101.021   16.673  115.873   10.748   49.529   4.1683   53.230   2.4840 -3.701405 4.852329 
1 1 1   11    1  -68 o   83.381   2.1600  283.796   14.668  289.637   20.710  277.915   20.778   84.175   3.0233   82.445   3.0973 1.729309 4.328213 
1 1 1   11    1  -67 o  263.284   2.2344  2827.82   47.954  2876.37   68.443  2781.00   67.209  265.412   3.1635  260.976   3.1593 4.436432 4.470924 
1 1 1   11    1  -66 o   88.874   1.7369  322.097   12.583  303.193   15.518  358.384   21.500   86.184   2.2108   93.663   2.8192 -7.479340 3.582636 
1 1 1   11    1  -65 o   72.676   1.7648  215.388   10.455  224.743   12.850  197.064   17.984   74.199   2.1268   69.402   3.1874 4.796783 3.831770 
1 1 1   11    1  -64 o  105.229   1.3896  451.459   11.919  466.820   16.784  435.828   16.930  106.989   1.9245  103.374   2.0092 3.615257 2.782177 
1 1 1   11    1  -63 o   66.695   1.5684  181.368   8.5266  185.260   11.581  176.760   12.600   67.363   2.1116   65.785   2.3536 1.578743 3.161995 
1 1 1   11    1  -62 o  125.842   1.4525  645.653   14.900  652.059   20.215  638.032   22.048  126.449   1.9612  125.073   2.1626 1.375343 2.919412 
1 1 1   11    1  -61 o   54.527   1.6587  121.340   7.3638  121.333   10.324  121.346   10.506   54.490   2.3298   54.491   2.3709 -0.4081726E-03 3.324031 
1 1 1   11    1  -60 o  223.258   2.1320  2032.84   38.800  1991.44   48.991  2102.51   63.551  220.928   2.7203  226.935   3.4355 -6.006516 4.382102 
1 1 1   11    1  -59 o   53.724   2.2356  117.922   9.7689  115.170   27.837  118.309   10.432   52.588   6.6416   53.803   2.3846 -1.215221 7.056708 
1 1 1   11    1  -58 o  112.198   1.6873  513.266   15.432  520.703   24.187  508.160   20.041  112.977   2.6263  111.623   2.2025 1.353668 3.427669 
1 1 1   11    1  -57 o  104.199   1.6694  442.682   14.180  438.273   21.908  445.860   18.602  103.620   2.5957  104.559   2.1825 -0.9392319 3.391345 
1 1 1   11    1  -56 o   90.534   1.5903  334.169   11.736  315.912   16.616  352.344   16.579   87.979   2.3189   92.950   2.1881 -4.970238 3.188332 
1 1 1   11    1  -55 o  274.598   2.4054  3075.48   53.842  3112.46   87.347  3052.81   68.379  276.085   3.8812  273.522   3.0668 2.562164 4.946664 
1 1 1   11    1  -54 o  236.248   2.0058  2275.90   38.627  2367.57   70.124  2235.97   46.281  240.831   3.5721  234.140   2.4249 6.690918 4.317381 
1 1 1   11    1  -53 o  176.081   1.6154  1264.05   23.186  1269.74   36.274  1260.13   30.150  176.438   2.5221  175.789   2.1040 0.6489410 3.284528 
1 1 1   11    1  -52 f  214.908   1.6262  1882.96   28.488  1882.23   40.263  1883.69   40.313  214.834   2.2991  214.917   2.3011 -0.8280945E-01 3.252871 
1 1 1   11    1  -51 o   78.247   1.5433  249.605   9.8433  243.773   13.129  257.092   14.875   77.291   2.0857   79.366   2.3018 -2.074867 3.106171 
1 1 1   11    1  -50 o  131.364   1.4826  703.495   15.876  694.678   20.807  715.780   24.562  130.527   1.9556  132.485   2.2744 -1.958008 2.999542 
1 1 1   11    1  -49 o   72.260   1.5688  212.870   9.2404  209.010   12.166  218.132   14.205   71.564   2.0878   73.096   2.3873 -1.531914 3.171423 
1 1 1   11    1  -48 o  170.778   1.5712  1188.99   21.873  1178.56   28.735  1203.35   33.726  170.012   2.0735  171.777   2.4086 -1.765488 3.178133 
1 1 1   11    1  -47 o   14.936   4.5977   9.0893   6.1453   13.996   8.3256   3.2163   9.1086   18.315   5.2848   13.430   5.4118 4.884307 7.564179 
1 1 1   11    1  -46 o  120.685   1.4724  593.745   14.484  589.696   19.051  599.291   22.299  120.263   1.9433  121.230   2.2565 -0.9668961 2.977947 
1 1 1   11    1  -45 o  114.128   1.4771  530.974   13.741  527.335   18.116  535.903   21.086  113.728   1.9542  114.641   2.2564 -0.9135437 2.985000 
1 1 1   11    1  -44 o  328.141   2.2928  4390.62   61.330  4336.81   80.355  4465.70   94.920  326.070   3.0232  330.833   3.5198 -4.763184 4.639876 
1 1 1   11    1  -43 o  167.795   1.3671  1147.70   18.699  1176.84   28.660  1126.10   24.675  169.895   2.0695  166.198   1.8214 3.696945 2.756805 
1 1 1   11    1  -42 o  181.374   1.5079  1341.02   22.294  1256.77   36.215  1392.43   28.290  175.556   2.5307  184.810   1.8779 -9.253387 3.151350 
1 1 1   11    1  -41 o  238.423   1.6171  2317.31   31.428  2316.97   47.342  2317.58   42.023  238.376   2.4364  238.419   2.1623 -0.4243469E-01 3.257514 
1 1 1   11    1  -40 o  117.264   1.2752  560.510   12.190  578.620   18.793  547.359   16.016  119.134   1.9352  115.875   1.6956 3.259407 2.572955 
1 1 1   11    1  -39 o  156.241   1.4227  995.070   18.120  987.991   29.750  999.245   22.847  155.667   2.3445  156.562   1.7902 -0.8958282 2.949848 
1 1 1   11    1  -38 o  281.685   2.0322  3234.77   46.662  3315.00   73.254  3179.99   60.531  285.106   3.1520  279.264   2.6591 5.841583 4.123815 
1 1 1   11    1  -37 o  376.818   2.5394  5789.37   78.001  6020.83  123.150  5634.30  100.797  384.176   3.9325  371.687   3.3269 12.48898 5.150969 
1 1 1   11    1  -36 o  564.917   3.9173 13017.89  180.387 13148.91  257.324 12891.30  252.945  567.510   5.5625  561.930   5.5221 5.579895 7.838083 
1 1 1   11    1  -35 f  199.480   1.7840  1622.09   29.009  1627.08   41.192  1617.19   40.859  199.770   2.5296  199.162   2.5168 0.6074371 3.568341 
1 1 1   11    1  -34 o  164.132   1.5124  1098.09   20.235  1092.92   26.605  1105.19   31.166  163.738   1.9933  164.648   2.3221 -0.9107819 3.060318 
1 1 1   11    1  -33 o  451.539   2.7753  8312.90  102.152  8456.68  146.051  8175.20  142.928  455.344   3.9348  447.704   3.9164 7.640594 5.551716 
1 1 1   11    1  -32 o  345.672   1.9854  4870.92   55.943  4910.03   79.552  4832.66   78.686  347.027   2.8122  344.282   2.8038 2.744629 3.971147 
1 1 1   11    1  -31 o  383.628   2.1598  5999.46   67.539  5981.43   95.282  6017.67   95.748  383.014   3.0518  384.172   3.0575 -1.158112 4.319972 
1 1 1   11    1  -30 o  341.471   1.9671  4753.13   54.754  4656.57   76.249  4855.95   78.677  337.959   2.7678  345.117   2.7967 -7.158386 3.934730 
1 1 1   11    1  -29 o  367.003   2.0828  5490.57   62.310  5448.15   87.631  5533.94   88.617  365.553   2.9408  368.419   2.9508 -2.866516 4.166008 
1 1 1   11    1  -28 o  103.204   1.2308  434.133   10.355  406.917   14.465  462.734   14.829   99.914   1.7761  106.547   1.7074 -6.632858 2.463645 
1 1 1   11    1  -27 o  119.668   1.2268  583.693   11.967  583.880   17.022  583.510   16.828  119.684   1.7448  119.646   1.7254 0.3777313E-01 2.453819 
1 1 1   11    1  -26 o   35.100   2.1617   50.411   6.1548   51.065   8.8788   49.806   8.5396   35.253   3.1220   34.820   3.0391 0.4330025 4.356952 
1 1 1   11    1  -25 o  301.433   1.8859  3703.71   46.340  3670.72   69.096  3730.67   62.472  300.066   2.8249  302.514   2.5334 -2.447906 3.794466 
1 1 1   11    1  -24 o  248.824   1.6569  2523.64   33.606  2543.59   50.706  2508.01   44.879  249.793   2.4902  248.044   2.2196 1.748505 3.335864 
1 1 1   11    1  -23 o  225.714   1.6503  2076.62   30.363  2013.80   42.384  2142.85   43.518  222.265   2.3393  229.276   2.3285 -7.011124 3.300671 
1 1 1   11    1  -22 o  180.452   1.4083  1327.25   20.716  1328.74   31.145  1326.07   27.743  180.547   2.1162  180.367   1.8869 0.1793213 2.835283 
1 1 1   11    1  -21 o  361.701   2.2965  5332.94   67.711  5313.48   95.746  5352.42   95.770  361.014   3.2536  362.335   3.2425 -1.320831 4.593431 
1 1 1   11    1  -20 o  309.549   2.0356  3905.82   51.364  3803.71   71.513  4014.62   73.820  305.460   2.8721  313.814   2.8858 -8.354431 4.071439 
1 1 1   11    1  -19 o  255.297   1.7784  2656.64   37.010  2650.23   52.545  2662.95   52.138  254.979   2.5281  255.590   2.5025 -0.6112061 3.557204 
1 1 1   11    1  -18 o  126.044   1.3568  647.546   13.940  629.394   19.861  665.172   19.570  124.262   1.9607  127.745   1.8794 -3.483528 2.715995 
1 1 1   11    1  -17 o  128.630   1.3595  674.392   14.254  661.010   20.442  687.056   19.886  127.345   1.9693  129.830   1.8791 -2.485146 2.721957 
1 1 1   11    1  -16 o  132.411   1.3708  714.617   14.795  703.301   21.215  725.332   20.644  131.355   1.9814  133.397   1.8985 -2.041962 2.744092 
1 1 1   11    1  -15 o  411.592   2.7377  6905.80   91.852  6924.79  121.879  6880.83  139.743  412.132   3.6279  410.802   4.1731 1.329926 5.529622 
1 1 1   11    1  -14 o  185.793   1.6156  1406.98   24.468  1385.91   32.306  1435.33   37.473  184.392   2.1493  187.648   2.4498 -3.255905 3.259039 
1 1 1   11    1  -13 o  474.479   3.3463  9177.93  129.423  9212.39  159.140  9110.62  222.419  475.340   4.1071  472.623   5.7733 2.716705 7.085130 
1 1 1   11    1  -12 o  886.537   7.3513 32069.85  531.249 32211.20  616.283 31661.02  1048.10  888.315   8.5109  879.381   14.621 8.934265 16.91805 
1 1 1   11    1  -11 o  599.095   5.0664 14636.27  247.417 14724.96  287.633 14383.97  485.140  600.852   5.8727  593.445   10.029 7.406982 11.62178 
1 1 1   11    1  -10 o  269.004   2.5952  2949.74   56.908  3040.91   82.992  2868.83   78.183  273.109   3.7279  265.272   3.6156 7.837860 5.193273 
1 1 1   11    1   -9 o  509.785   4.3617 10596.16  181.252 10445.20  254.077 10752.60  258.643  506.043   6.1595  513.435   6.1799 -7.391235 8.725226 
1 1 1   11    1   -8 o  463.914   4.0114  8774.48  151.693  8559.83  210.947  9004.34  218.294  458.131   5.6487  469.873   5.6993 -11.74200 8.024329 
1 1 1   11    1   -7 o  244.772   2.0083  2442.11   40.070  2454.79   57.121  2429.82   56.225  245.397   2.8555  244.146   2.8252 1.250580 4.016929 
1 1 1   11    1   -6 o  324.244   2.4421  4285.50   64.547  4285.49   91.388  4285.50   91.179  324.225   3.4578  324.225   3.4500 -0.3967285E-03 4.884564 
1 1 1   11    1   -5 o  623.053   3.9738 15826.71  201.820 15721.24  265.720 15970.51  310.263  620.902   5.2501  625.747   6.0827 -4.845032 8.035066 
1 1 1   11    1   -4 o  370.246   2.7236  5587.90   82.199  5710.80  118.859  5475.25  113.801  374.266   3.8960  366.469   3.8095 7.797607 5.448951 
1 1 1   11    1   -3 o  312.403   2.6296  3978.28   66.963  4274.95  113.164  3818.43   83.067  323.806   4.2873  306.050   3.3297 17.75571 5.428443 
1 1 1   11    1   -2 o  569.593   3.9554 13227.15  183.649 13079.74  222.901 13538.69  324.050  566.368   4.8281  576.083   6.9007 -9.715393 8.421975 
1 1 1   11    1   -1 o  505.023   3.8852 10398.12  159.942 10343.96  205.649 10481.03  254.449  503.657   5.0091  506.921   6.1578 -3.263245 7.937817 
1 1 1   11    1    0 o  305.281   2.3453  3798.84   58.363  3738.87   81.920  3860.66   83.171  302.845   3.3184  307.739   3.3155 -4.893158 4.690928 
1 1 1   11    1    1 o  470.503   3.3277  9024.50  127.628  9026.34  180.718  9022.67  180.270  470.500   4.7120  470.405   4.7013 0.9503174E-01 6.656199 
1 1 1   11    1    2 o  909.071   6.7369 33711.94  499.220 33397.08  639.352 34203.75  799.067  904.555   8.6710  915.065   10.713 -10.50897 13.78209 
1 1 1   11    1    3 o  252.954   2.2725  2608.16   46.857  2606.97   60.661  2609.91   73.782  252.888   2.9427  253.020   3.5773 -0.1320343 4.632123 
1 1 1   11    1    4 o  509.594   3.9118 10587.28  162.494 10650.83  258.524 10545.77  208.923  511.005   6.2064  508.544   5.0399 2.461182 7.994987 
1 1 1   11    1    5 o   80.727   1.8306  265.627   12.046  272.513   17.407  259.298   16.688   81.722   2.6164   79.716   2.5715 2.006477 3.668540 
1 1 1   11    1    6 o  298.113   2.5184  3622.61   61.199  3688.88   80.318  3530.87   94.499  300.814   3.2755  294.287   3.9393 6.527039 5.123178 
1 1 1   11    1    7 o  134.581   1.6383  738.242   17.973  751.815   25.866  725.570   24.992  135.809   2.3365  133.418   2.2980 2.391281 3.277188 
1 1 1   11    1    8 o  202.324   1.8243  1668.51   30.087  1663.88   42.811  1673.04   42.294  202.036   2.5995  202.591   2.5611 -0.5553741 3.649179 
1 1 1   11    1    9 o  261.043   2.2905  2777.65   48.740  2655.58   74.853  2867.50   64.220  255.223   3.5979  265.222   2.9705 -9.999695 4.665688 
1 1 1   11    1   10 o  207.389   2.2713  1753.17   38.397  1759.12   54.999  1747.52   53.630  207.729   3.2480  207.044   3.1777 0.6848755 4.543924 
1 1 1   11    1   11 o  191.663   2.1948  1497.36   34.290  1494.93   48.921  1499.71   48.078  191.497   3.1340  191.804   3.0750 -0.3068848 4.390622 
1 1 1   11    1   12 o  192.674   2.1997  1513.21   34.548  1565.80   50.343  1466.39   47.499  195.983   3.1512  189.661   3.0723 6.322250 4.401079 
1 1 1   11    1   13 o  490.452   4.2281  9807.70  169.034  9572.94  234.480 10061.68  243.897  484.456   5.9377  496.663   6.0243 -12.20728 8.458626 
1 1 1   11    1   14 o  555.572   4.2277 12585.12  191.459 12330.88  243.047 13000.89  310.808  549.862   5.4225  564.502   6.7545 -14.64044 8.661780 
1 1 1   11    1   15 o  348.965   2.5861  4964.05   73.562  5032.80  105.205  4898.27  102.900  351.347   3.6734  346.620   3.6419 4.726654 5.172694 
1 1 1   11    1   16 o  423.257   3.0293  7303.08  104.514  7355.31  148.774  7252.20  146.856  424.723   4.2972  421.736   4.2718 2.986298 6.059251 
1 1 1   11    1   17 o  292.697   2.2656  3492.16   54.054  3418.58   75.553  3569.32   77.367  289.579   3.2007  295.894   3.2076 -6.315338 4.531393 
1 1 1   11    1   18 o  416.805   2.9911  7082.15  101.623  7068.42  143.579  7095.94  143.855  416.355   4.2305  417.165   4.2304 -0.8100281 5.982767 
1 1 1   11    1   19 o  303.633   2.3275  3758.06   57.606  3787.04   81.988  3729.81   80.956  304.781   3.3001  302.470   3.2835 2.311096 4.655297 
1 1 1   11    1   20 o  612.925   4.2245 15318.75  211.068 15332.64  298.821 15304.91  298.169  613.060   5.9796  612.506   5.9719 0.5539551 8.451022 
1 1 1   11    1   21 o  165.130   1.6922  1111.45   22.778  1109.43   32.631  1113.37   31.812  164.973   2.4265  165.266   2.3614 -0.2934570 3.385850 
1 1 1   11    1   22 o  526.593   3.6750 11306.32  157.750 11338.15  223.721 11274.85  222.470  527.233   5.2056  525.760   5.1910 1.472473 7.351459 
1 1 1   11    1   23 o  232.255   1.9569  2198.80   37.049  2150.25   51.899  2249.27   52.905  229.664   2.7722  234.892   2.7631 -5.228745 3.914082 
1 1 1   11    1   24 o  424.616   3.3283  7351.00  115.200  7335.58  181.819  7361.33  148.902  424.064   5.2598  424.867   4.2994 -0.8031616 6.793455 
1 1 1   11    1   25 o  260.037   2.2846  2756.45   48.427  2770.24   76.916  2747.39   62.333  260.654   3.6201  259.595   2.9457 1.058655 4.667119 
1 1 1   11    1   26 o   85.521   1.8286  298.127   12.747  300.926   20.302  296.306   16.378   85.865   2.9047   85.224   2.3599 0.6415558 3.742553 
1 1 1   11    1   27 o   85.626   1.8381  298.861   12.830  311.845   20.242  290.143   16.587   87.413   2.8446   84.330   2.4155 3.083153 3.731808 
1 1 1   11    1   28 o  272.927   2.3625  3036.60   52.559  3043.75   83.254  3031.87   67.771  273.207   3.7383  272.696   3.0488 0.5104675 4.823951 
1 1 1   11    1   29 o  427.923   3.3531  7466.59  116.964  7509.57  185.799  7438.38  150.536  429.014   5.3130  427.053   4.3244 1.960876 6.850378 
1 1 1   11    1   30 o  275.389   2.3781  3091.70   53.385  3055.81   83.731  3116.27   69.296  273.740   3.7524  276.461   3.0750 -2.720367 4.851392 
1 1 1   11    1   31 o  314.734   2.6163  4038.50   67.122  4014.26  105.733  4054.86   86.872  313.721   4.1346  315.341   3.3796 -1.620178 5.340074 
1 1 1   11    1   32 o  355.851   2.8776  5163.00   83.472  5203.00  132.820  5136.89  107.311  357.128   4.5625  354.907   3.7093 2.220734 5.880114 
1 1 1   11    1   33 o  202.542   1.9884  1672.31   32.829  1622.07   51.130  1707.55   42.823  199.449   3.1449  204.652   2.5670 -5.203629 4.059511 
1 1 1   11    1   34 o  273.643   3.0400  3053.32   67.810  3017.46  116.251  3071.82   83.484  271.910   5.2449  274.440   3.7318 -2.529755 6.437011 
1 1 1   11    1   35 f  148.636   2.2617  900.681   27.403  926.814   47.693  887.802   33.481  150.688   3.8860  147.560   2.7835 3.128479 4.780020 
1 1 1   11    1   36 o  299.463   3.2396  3657.14   79.080  3615.76  135.553  3678.49   97.366  297.595   5.5879  300.292   3.9777 -2.696808 6.859027 
1 1 1   11    1   37 o  301.408   3.2547  3704.94   79.964  3717.99  138.753  3698.46   97.848  301.752   5.6410  301.098   3.9866 0.6544495 6.907557 
1 1 1   11    1   38 o  134.785   1.7488  740.582   19.214  738.254   30.442  742.124   24.772  134.554   2.7755  134.917   2.2525 -0.3630829 3.574528 
1 1 1   11    1   39 o   94.055   1.7630  360.627   13.516  400.485   21.983  336.399   17.139   99.065   2.7248   90.804   2.3174 8.260765 3.576996 
1 1 1   11    1   40 o  331.595   2.7258  4483.79   73.677  4607.04  118.961  4407.09   93.842  335.988   4.3435  328.691   3.5025 7.296967 5.579742 
1 1 1   11    1   41 o  171.933   1.8577  1205.13   26.036  1187.56   41.132  1216.88   33.631  170.642   2.9570  172.755   2.3882 -2.112946 3.801028 
1 1 1   11    1   42 o  203.654   1.9960  1690.94   33.136  1680.40   52.449  1697.93   42.747  202.971   3.1701  204.054   2.5700 -1.083176 4.080949 
1 1 1   11    1   43 o   17.565   5.3002   12.684   8.2208   18.112   13.279   9.3108   10.468   21.279   6.7893   16.623   6.0134 4.656387 9.069492 
1 1 1   11    1   44 o  343.117   2.8039  4801.60   78.422  4985.87  127.774  4690.23   99.332  349.454   4.4855  339.040   3.5942 10.41318 5.747900 
1 1 1   11    1   45 o  147.652   1.7900  888.808   21.544  881.688   34.074  893.549   27.808  147.027   2.8431  148.031   2.3045 -1.004196 3.659777 
1 1 1   11    1   46 o  147.332   1.7845  884.972   21.431  875.596   33.948  891.186   27.634  146.515   2.8425  147.833   2.2932 -1.318390 3.652162 
1 1 1   11    1   47 o   80.337   1.8909  263.141   12.383  280.927   20.058  252.189   15.740   82.933   2.9719   78.599   2.4597 4.333755 3.857758 
1 1 1   11    1   48 o  221.761   2.0950  2005.27   37.871  1984.46   59.699  2019.28   48.991  220.533   3.3209  222.502   2.7011 -1.968460 4.280698 
1 1 1   11    1   49 o  320.243   2.6646  4183.01   69.558  4156.28  109.801  4200.93   89.898  319.038   4.2221  320.848   3.4373 -1.810699 5.444346 
1 1 1   11    1   50 o  280.609   2.7198  3211.87   62.213  3244.50   88.633  3180.18   87.347  281.918   3.8569  279.111   3.8391 2.806671 5.441919 
1 1 1   11    1   51 o  326.311   3.0321  4344.21   80.650  4360.95  114.339  4327.62  113.776  326.773   4.2925  325.523   4.2878 1.250397 6.067207 
1 1 1   11    1   52 f  102.056   2.0114  424.698   16.733  429.480   23.627  419.886   23.701  102.567   2.8287  101.411   2.8700 1.155449 4.029652 
1 1 1   11    1   53 o  129.891   1.9894  687.971   21.063  704.644   29.889  671.521   29.688  131.426   2.7900  128.298   2.8387 3.128159 3.980237 
1 1 1   11    1   54 o  138.272   2.9312  780.065   33.038  781.159   46.699  778.969   46.746  138.235   4.1490  138.040   4.1591 0.1949921 5.874750 
1 1 1   11    1   55 o  187.473   3.1429  1434.23   48.029  1412.60   67.363  1456.60   68.498  185.941   4.4444  188.813   4.4505 -2.872589 6.289645 
1 1 1   11    1   56 o  124.325   2.9689  630.684   30.088  690.665   43.622  576.254   41.555  129.970   4.1227  118.688   4.3023 11.28157 5.958720 
1 1 1   11    1   57 o  179.422   2.1527  1312.87   31.484  1381.55   66.070  1292.69   35.811  183.878   4.4080  178.021   2.4678 5.857361 5.051757 
1 1 1   11    1   58 o  145.760   1.8134  866.309   21.546  878.396   34.671  858.703   27.501  146.722   2.8989  145.098   2.3252 1.624741 3.716188 
1 1 1   11    1   59 o  284.421   2.4542  3299.82   56.899  3262.07   89.534  3325.40   73.694  282.611   3.8865  285.441   3.1672 -2.830627 5.013604 
1 1 1   11    1   60 o  224.622   1.9610  2057.55   35.906  2089.94   51.855  2027.71   49.767  226.318   2.8108  222.930   2.7387 3.388596 3.924418 
1 1 1   11    1   61 o   21.791   4.9398   20.195   8.5714   23.122   12.712   17.755   11.607   23.393   6.4557   20.765   6.3047 2.628149 9.023567 
1 1 1   11    1   62 o  153.890   1.8967  965.746   23.793  970.247   39.670  963.217   29.736  154.174   3.1566  153.665   2.3739 0.5091705 3.949600 
1 1 1   11    1   63 o  188.858   1.8258  1454.46   28.108  1468.13   40.672  1441.97   38.889  189.689   2.6304  187.999   2.5377 1.690170 3.654932 
1 1 1   11    1   64 o  119.083   1.6982  578.242   16.484  575.946   20.184  582.841   28.564  118.832   2.0837  119.500   2.9323 -0.6677094 3.597287 
1 1 1   11    1   65 o   58.538   1.8394  139.880   8.7661  139.636   13.168  140.074   11.748   58.429   2.7726   58.542   2.4673 -0.1132393 3.711486 
1 1 1   11    1   66 o  212.721   1.5817  1845.10   27.427  1865.87   41.773  1829.37   36.363  213.853   2.3963  211.775   2.1064 2.077347 3.190521 
1 1 1   11    1   67 o  174.842   1.7049  1246.61   24.299  1315.81   33.203  1166.82   35.654  179.592   2.2681  169.096   2.5867 10.49683 3.440215 
1 1 1   11    1   68 o   64.542   1.9468  170.054   10.231  197.598   15.056  146.426   13.944   69.533   2.6612   59.825   2.8678 9.707737 3.912348 
1 1 1   11    1   69 o  206.351   1.6528  1736.40   27.801  1769.39   45.832  1717.20   34.968  208.210   2.7004  205.175   2.0908 3.035156 3.415212 
1 1 1   11    1   70 o  158.399   1.6415  1023.19   21.194  987.494   32.636  1049.22   27.871  155.549   2.5739  160.371   2.1321 -4.822021 3.342231 
1 1 1   11    1   71 o  191.262   1.5924  1491.79   24.827  1479.97   35.005  1503.75   35.216  190.450   2.2548  191.974   2.2504 -1.524399 3.185692 
1 1 1   11    1   72 o  155.843   1.4914  990.395   18.946  993.625   26.815  987.176   26.772  156.056   2.1080  155.549   2.1114 0.5075378 2.983574 
1 1 1   11    1   73 o  134.869   1.5361  741.805   16.888  768.048   26.048  722.776   22.181  137.181   2.3294  133.098   2.0445 4.083511 3.099358 
1 1 1   11    1   74 o  157.864   1.6823  1016.48   21.649  1039.06   31.200  995.520   30.064  159.546   2.3990  156.171   2.3616 3.374741 3.366369 
1 1 1   11    1   75 o  124.945   1.7337  636.807   17.657  630.233   23.624  645.130   26.580  124.256   2.3324  125.694   2.5942 -1.437378 3.488498 
1 1 1   11    1   76 o  111.411   1.5259  506.249   13.858  523.616   18.978  486.410   20.284  113.274   2.0553  109.160   2.2795 4.114319 3.069309 
1 1 1   11    1   77 o   91.725   1.6391  343.208   12.255  327.934   17.242  358.806   17.423   89.589   2.3630   93.749   2.2800 -4.160332 3.283631 
1 1 1   11    1   78 o  117.167   1.4345  559.916   13.701  560.419   19.489  559.424   19.264  117.178   2.0404  117.076   2.0186 0.1022949 2.870172 
1 1 1   11    1   79 o  170.222   1.5077  1181.93   20.920  1184.69   29.687  1179.21   29.486  170.351   2.1379  169.958   2.1283 0.3930359 3.016669 
1 1 1   11    1   80 o  111.154   1.4316  503.951   12.971  484.385   18.424  523.178   18.264  108.928   2.0750  113.214   1.9791 -4.286148 2.867438 
1 1 1   11    1   81 o   79.839   1.4959  260.030   9.7352  267.226   14.194  253.637   13.378   80.868   2.1551   78.790   2.0848 2.077888 2.998469 
1 1 1   11    1   82 o   10.628   4.3983   1.2282   6.2165   6.6965   9.3915  -3.0362   8.2935   14.930   5.6414   10.687   4.7497 4.243134 7.374622 
1 1 1   11    1   83 o  121.408   1.4139  601.316   13.993  603.281   19.990  599.428   19.593  121.548   2.0176  121.163   1.9838 0.3850327 2.829498 
1 1 1   11    1   84 o   66.518   1.6138  180.568   8.7502  189.774   12.925  172.778   11.889   68.105   2.3316   64.989   2.2477 3.115860 3.238591 
1 1 1   11    1   85 o   67.939   1.6168  188.392   8.9540  198.116   13.186  180.072   12.197   69.580   2.3282   66.340   2.2589 3.239952 3.243891 
1 1 1   11    1   86 o  100.063   1.4748  408.611   12.030  406.524   17.276  410.575   16.761   99.739   2.1249  100.243   2.0512 -0.5047150 2.953391 
1 1 1   11    1   87 o  123.962   1.5071  627.211   15.229  632.022   23.248  623.595   20.154  124.317   2.2942  123.535   2.0014 0.7818069 3.044503 
1 1 1   11    1   88 o   87.208   1.4466  310.423   10.284  317.735   14.885  303.746   14.224   88.162   2.0713   86.205   2.0241 1.956779 2.896118 
1 1 1   11    1   89 o   37.826   2.1157   58.694   6.4976   53.865   9.4362   63.049   8.9602   36.069   3.2441   39.113   2.8295 -3.043888 4.304654 
1 1 1   11    1   90 o  113.100   1.4767  522.297   13.614  525.003   18.106  518.778   20.650  113.315   1.9602  112.584   2.2501 0.7306519 2.984181 
1 1 1   11    1   91 o   14.706   4.6388   8.8881   6.2145   3.7187   9.1627   13.292   8.4570   13.495   5.4313   17.749   5.3801 -4.253912 7.644949 
1 1 1   11    1   92 o   29.991   3.5964   37.642   8.6170   28.567   10.039   63.035   16.793   25.752   4.9625   38.391   5.5252 -12.63885 7.426587 
1 1 1   11    1   93 o   53.759   2.0495  118.502   8.9647  119.747   12.027  116.946   13.448   53.913   2.7457   53.195   3.1150 0.7177658 4.152322 
1 1 1   11    1   94 o   56.202   1.6723  129.288   7.6528  128.936   10.629  129.666   11.028   56.014   2.3329   56.156   2.4147 -0.1423683 3.357572 
1 1 1   11    1   95 o   56.674   1.6679  131.499   7.6970  129.348   10.736  133.774   11.040   56.083   2.3537   57.031   2.3801 -0.9472885 3.347348 
1 1 1   11    1   96 o   14.130   4.5628   8.1923   5.9851   5.6359   8.4879   10.720   8.4408   13.822   5.3286   16.246   5.4279 -2.423566 7.606265 
1 1 1   11    1   97 o   77.400   1.3773  244.888   8.6896  245.344   14.436  244.630   10.882   77.236   2.2954   77.293   1.7272 -0.5759430E-01 2.872655 
1 1 1   11    1   98 o  139.990   1.3771  801.291   15.715  788.291   25.708  809.047   19.857  138.467   2.2776  140.535   1.7333 -2.068039 2.862163 
1 1 1   11    1   99 o   57.659   1.5132  136.152   7.1062  137.605   12.205  135.406   8.7405   57.698   2.6017   57.429   1.8696 0.2694817 3.203792 
1 1 1   11    1  100 o   19.926   3.3286   16.944   5.2161   13.373   9.2591   18.604   6.3132   17.662   5.6727   20.758   3.8735 -3.095966 6.869018 
1 1 1   11    1  101 o   27.590   2.3583   31.603   5.2529   34.547   8.8081   29.978   6.5440   28.430   3.9038   26.698   3.0623 1.731415 4.961592 
1 1 1   11    1  102 o   7.8676   3.5247  -1.8926   4.6639  -1.8308   8.0564  -1.9238   5.7198   10.661   4.7125   8.8231   3.9314 1.837406 6.137057 
1 1 1   11    1  103 o   30.437   2.1128   38.331   5.2094   43.447   8.9699   35.727   6.3992   32.021   3.4930   29.236   2.7163 2.785540 4.424862 
1 1 1   11    1  104 o   63.347   1.3629  164.298   7.0376  163.363   11.768  164.818   8.7807   62.862   2.3005   63.344   1.7021 -0.4817543 2.861679 
1 1 1   11    1  105 o   71.115   1.7077  207.665   9.8992  197.645   12.656  223.458   15.889   69.155   2.2480   73.336   2.6623 -4.180565 3.484468 
1 1 1   11    1  106 o   70.482   1.8278  204.435   10.493  197.031   14.168  213.429   15.615   68.892   2.5272   71.625   2.6792 -2.732872 3.683023 
1 1 1   11    1  107 o   25.296   3.7012   27.606   7.4062   22.405   9.7370   34.745   11.408   22.113   5.4398   27.758   5.2338 -5.644487 7.548761 
1 1 1   11    1  108 o   23.154   4.3754   23.771   7.9554   19.138   9.9258   32.093   13.303   20.326   5.7399   26.038   6.3301 -5.711992 8.544995 
1 1 1   11    1  109 o   39.186   2.5899   64.240   8.2264   60.609   10.118   71.324   14.131   37.745   3.3223   40.383   4.3619 -2.637962 5.483033 
1 1 1   11    1  110 o   51.143   2.2021  108.653   9.1587  115.912   11.265   94.504   15.729   52.615   2.6351   46.553   4.1897 6.061176 4.949428 
1 1 1   11    1  111 o   58.864   2.0590  143.727   9.8643  160.966   12.100  109.575   17.031   62.110   2.3945   50.002   4.2178 12.10736 4.850131 
1 1 1   11    1  112 o   20.784   4.5435   19.747   7.4823   21.221   9.5977   17.463   11.947   21.112   5.5169   19.099   6.4581 2.012373 8.493728 
1 1 1   11    1  113 o   13.146   5.0170   6.3275   7.4728   10.337   9.5931   0.1394   11.917   15.605   5.7394   13.021   5.7448 2.583573 8.120537 
1 1 1   11    1  114 o   31.956   3.7079   44.832   9.4796   33.297   11.918   64.698   15.641   26.215   5.7369   37.180   5.3115 -10.96492 7.818152 
1 1 1   11    1  115 o   22.152   5.5543   23.982   10.010   38.821   13.304   4.6255   15.195   27.994   6.0099   15.191   6.5991 12.80304 8.925661 
1 1 1   11    1  116 o   30.821   5.1251   45.033   12.424   48.445   14.078   33.013   26.423   31.492   5.6934   22.868   9.2164 8.624353 10.83312 
1 1 1   11    1  117 o   35.776   3.7953   56.993   10.899   52.924   14.384   62.479   16.703   32.977   5.5477   35.409   6.0009 -2.431950 8.172403 
1 1 1   11    1  118 o   31.890   4.6945   47.506   11.839   45.138   14.293   52.680   21.129   29.835   6.0834   29.462   8.3932 0.3730679 10.36597 
1 1 1   11    1  119 o   13.041   5.5553   3.8268   10.374  -9.1983   13.772   20.908   15.772   11.627   5.4986   19.563   7.3280 -7.936495 9.161564 
1 1 1   11    1  120 o   40.175   4.7340   75.766   15.206   65.293   18.082  101.056   28.098   35.318   6.5211   40.689   8.7328 -5.370857 10.89888 
1 1 1   11    1  121 o   38.141   3.8695   65.600   11.864   79.974   15.248   43.543   18.888   41.353   4.6011   26.639   8.0330 14.71491 9.257417 
1 1 1   11    1  122 o   9.9512   4.8127 -13.7092   11.909 -33.6013   16.903   5.8945   16.780   10.096   5.0391   15.369   6.7970 -5.273054 8.461188 
1 1 1   11    1  123 o   28.089   5.0982   38.501   11.243   19.962   18.145   50.056   14.325   18.886   7.6282   31.364   5.8173 -12.47846 9.593245 
1 1 1   11    1  124 o   24.908   5.2145   30.791   10.247   26.173   14.512   35.382   14.471   21.179   7.1177   25.024   6.8810 -3.844992 9.899981 
1 1 1   11    1  125 o   13.229   5.6177   4.9223   10.550   3.9700   13.554   6.3860   16.804   13.926   6.1360   15.303   6.7832 -1.377224 9.146709 
1 1 1   11    1  126 o   14.585   5.8574   9.0267   10.632   18.980   14.043  -4.3399   16.274   18.391   6.9094   13.107   6.1287 5.284090 9.235822 
1 1 1   11    1  127 o   17.828   6.2173   17.160   11.097   23.193   14.650   9.0374   16.998   19.788   7.1199   15.792   6.9176 3.996032 9.927058 
1 1 1   11    1  128 o   12.528   5.6210   0.7599   11.911  -4.4104   16.876   5.8921   16.813   13.255   6.2116   15.091   6.7314 -1.836618 9.159452 
1 1 1   11    1  129 o   34.028   7.3939   67.161   19.922   69.075   28.050   65.213   28.299   29.499   9.8954   28.298   9.9241 1.201225 14.01447 
1 1 1   11    2 -127 o   27.085   4.8384   35.691   10.290   48.016   12.464   9.3095   18.235   31.260   5.0646   16.059   7.0949 15.20028 8.717079 
1 1 1   11    2 -126 o   12.007   5.2210   2.4207   9.5307   4.0805   11.436  -1.3542   17.246   13.197   5.7290   13.840   6.4163 -0.6426640 8.601813 
1 1 1   11    2 -125 o   12.063   5.2618   2.2751   9.7448  -9.5122   11.819   27.302   17.222   10.448   4.9847   20.791   7.6824 -10.34298 9.157879 
1 1 1   11    2 -124 o   15.560   5.6356   11.892   9.1975   15.663   10.899   2.5643   17.143   17.252   6.1488   14.577   6.6225 2.674083 9.036858 
1 1 1   11    2 -123 o   17.128   5.7221   15.091   9.3807   17.318   11.002   9.1642   17.952   18.024   6.1954   16.129   7.0859 1.894814 9.412358 
1 1 1   11    2 -122 o   12.019   5.1805   2.5975   9.2186   7.3281   10.904  -9.2583   17.262   14.152   5.8378   12.792   6.0805 1.359653 8.429236 
1 1 1   11    2 -121 o   13.193   5.2538   6.5457   8.4802  -0.5317   10.753   18.191   13.793   11.860   5.3296   18.349   6.8570 -6.488227 8.684659 
1 1 1   11    2 -120 o   14.541   5.4890   9.3936   8.8863   4.5569   10.791   19.586   15.664   13.311   5.6679   18.870   7.2480 -5.559354 9.201057 
1 1 1   11    2 -119 o   9.4513   4.4987  -8.7889   9.5133 -10.5506   12.150  -5.9974   15.294   10.581   5.0497   12.702   5.9400 -2.120923 7.796344 
1 1 1   11    2 -118 f   14.423   5.3217   9.2319   8.2585   20.317   10.575  -8.0975   13.222   19.781   6.0204   11.535   5.4347 8.245777 8.110577 
1 1 1   11    2 -117 o   11.098   4.8253   0.9577   8.1390   10.537   10.447 -13.8384   12.983   15.446   5.9226   10.554   5.0845 4.892120 7.805722 
1 1 1   11    2 -116 o   12.391   5.0618   4.5420   8.0957   15.677   10.475 -11.9717   12.757   17.695   6.0464   10.743   5.1398 6.952324 7.935757 
1 1 1   11    2 -115 o   32.688   4.2525   48.597   11.063   40.701   17.592   53.761   14.228   26.743   7.6713   33.398   5.4112 -6.654808 9.387777 
1 1 1   11    2 -114 o   14.748   6.2276   6.0204   12.845   31.648   16.556 -32.7370   20.360   23.785   7.5798   11.733   5.8000 12.05168 9.544251 
1 1 1   11    2 -113 o   46.009   3.1091   90.816   11.592   79.849   18.352   98.095   14.952   40.893   5.6568   47.139   3.9268 -6.246220 6.886156 
1 1 1   11    2 -112 o   22.743   5.6057   24.990   10.325   19.107   16.365   28.881   13.308   19.755   7.4507   23.815   6.6180 -4.060875 9.965503 
1 1 1   11    2 -111 o   12.710   5.2067   4.1183   8.5957   5.4478   10.414   1.2766   15.225   13.972   5.7281   14.686   6.4857 -0.7139921 8.653111 
1 1 1   11    2 -110 o   35.187   3.3509   53.185   9.4953   54.526   11.648   50.528   16.393   35.172   4.1422   32.199   6.4703 2.972496 7.682658 
1 1 1   11    2 -109 o   10.222   4.6716  -4.2705   8.6934  -3.8758   11.913  -4.7201   12.714   12.207   5.5358   12.434   5.6699 -0.2268953 7.924153 
1 1 1   11    2 -108 o   61.579   2.2947  157.609   11.498  177.044   14.053  118.248   20.000   65.058   2.6556   51.643   4.8061 13.41499 5.490999 
1 1 1   11    2 -107 o   55.398   2.2176  127.274   9.9941  127.144   13.040  127.460   15.559   55.026   2.9176   54.741   3.5052 0.2848701 4.560618 
1 1 1   11    2 -106 o   12.508   5.1790   2.9053   8.6252   11.502   11.765  -7.0846   12.682   17.042   6.3399   12.087   5.5675 4.955242 8.437501 
1 1 1   11    2 -105 o   18.853   5.4116   16.138   8.7516   20.041   12.064   11.802   12.715   20.797   6.4490   17.462   6.5715 3.334578 9.207253 
1 1 1   11    2 -104 o   55.557   2.3460  127.862   10.601  115.548   14.502  141.990   15.534   52.335   3.4181   58.104   3.2932 -5.769306 4.746432 
1 1 1   11    2 -103 o   16.793   5.2088   12.381   7.8696   14.855   10.102   8.5623   12.551   18.342   5.9283   16.354   6.4296 1.988243 8.745548 
1 1 1   11    2 -102 o   30.811   3.3435   40.169   8.2629   42.267   10.612   36.939   13.169   31.264   4.2758   28.505   5.8634 2.759001 7.256860 
1 1 1   11    2 -101 o   22.680   4.8298   22.832   8.6552   21.220   10.128   27.198   16.667   21.630   5.6745   24.082   7.5968 -2.451458 9.482166 
1 1 1   11    2 -100 o   40.391   2.7248   67.862   8.9190   63.556   11.567   74.175   14.007   38.752   3.7069   41.690   4.1781 -2.937897 5.585460 
1 1 1   11    2  -99 o   35.382   3.0278   52.337   8.6486   75.927   11.466   21.196   13.173   42.559   3.3315   21.685   6.7413 20.87353 7.519576 
1 1 1   11    2  -98 o   11.991   4.9583   2.2010   7.8909   8.0994   10.277  -6.2729   12.317   15.534   5.8940   12.273   5.5904 3.261034 8.123488 
1 1 1   11    2  -97 o   31.114   3.4213   40.731   8.5344   38.863   11.107   43.425   13.336   29.978   4.6995   31.458   5.3947 -1.480356 7.154582 
1 1 1   11    2  -96 o   49.813   2.3180  102.252   9.3864  116.955   12.429   82.733   14.320   53.127   2.8807   44.298   4.0091 8.828537 4.936758 
1 1 1   11    2  -95 o   13.926   5.3356   5.9366   8.4742   9.9272   11.920   1.8582   12.050   16.967   6.3674   14.280   6.0310 2.686891 8.770219 
1 1 1   11    2  -94 o   57.207   2.5946  134.924   12.068  141.282   14.816  122.390   20.802   58.394   3.1240   53.737   4.7994 4.657177 5.726571 
1 1 1   11    2  -93 o   78.388   2.1785  252.169   13.907  263.525   17.308  231.484   23.359   80.002   2.6578   74.555   3.8567 5.446999 4.683825 
1 1 1   11    2  -92 o   37.106   3.7022   57.571   11.049   63.593   13.703   46.383   18.678   38.822   4.4083   32.155   7.2941 6.666798 8.522740 
1 1 1   11    2  -91 f   57.393   1.5171  134.682   7.0911  131.885   12.623  135.971   8.5714   56.588   2.7447   57.626   1.8271 -1.037701 3.297234 
1 1 1   11    2  -90 o   91.842   1.3630  344.418   10.204  344.967   16.284  344.063   13.093   91.784   2.1765   91.739   1.7508 0.4439545E-01 2.793309 
1 1 1   11    2  -89 o   9.8267   3.7723   2.6903   4.2416   5.9404   10.010   1.9790   4.6828   14.804   5.7647   9.7540   3.8975 5.049990 6.958599 
1 1 1   11    2  -88 o   49.579   1.6507  100.522   6.6620  111.620   12.359   95.977   7.9094   52.068   2.9237   48.405   2.0089 3.663292 3.547336 
1 1 1   11    2  -87 f   50.372   1.6202  103.725   6.6438  109.543   12.599  101.484   7.8194   51.581   3.0096   49.793   1.9302 1.788548 3.575351 
1 1 1   11    2  -86 o   91.116   1.3564  338.808   10.074  348.642   17.069  333.550   12.480   92.322   2.2681   90.374   1.6941 1.948570 2.830911 
1 1 1   11    2  -85 o   68.472   1.5162  191.371   8.4629  217.085   15.273  179.978   10.166   72.780   2.5785   66.350   1.8816 6.430817 3.192005 
1 1 1   11    2  -84 o  190.754   1.6409  1485.41   25.514  1458.10   36.525  1511.44   35.656  188.828   2.3730  192.276   2.2750 -3.448303 3.287310 
1 1 1   11    2  -83 o   42.947   1.9668   75.488   6.8671   88.098   13.190   70.799   8.0432   46.204   3.5288   41.546   2.3850 4.657658 4.259158 
1 1 1   11    2  -82 o  138.059   1.3791  777.584   15.520  765.577   24.583  785.542   20.013  136.887   2.2031  138.720   1.7699 -1.833206 2.825958 
1 1 1   11    2  -81 f   80.156   1.4962  262.142   9.7759  285.603   18.343  252.835   11.553   83.525   2.6977   78.702   1.8009 4.822746 3.243605 
1 1 1   11    2  -80 o  109.364   1.5121  487.968   13.480  506.297   19.614  471.561   18.558  111.341   2.1611  107.458   2.1186 3.883049 3.026343 
1 1 1   11    2  -79 o  111.321   1.5160  505.559   13.757  514.010   19.868  497.776   19.066  112.192   2.1725  110.412   2.1184 1.780632 3.034356 
1 1 1   11    2  -78 o  129.738   1.5078  686.625   15.946  689.473   22.652  683.827   22.451  129.949   2.1385  129.418   2.1282 0.5319824 3.016965 
1 1 1   11    2  -77 o   39.734   2.6576   64.799   8.5581   69.810   12.270   60.052   11.943   41.120   3.7001   38.084   3.9022 3.036636 5.377532 
1 1 1   11    2  -76 o  130.476   1.4293  694.345   15.201  726.372   23.184  670.192   20.133  133.393   2.1321  128.150   1.9273 5.243881 2.874133 
1 1 1   11    2  -75 o   64.416   1.6805  169.392   8.8164  186.501   14.407  159.151   11.147   67.519   2.6227   62.401   2.1949 5.117680 3.419975 
1 1 1   11    2  -74 o  103.073   1.5619  433.328   13.123  436.254   18.775  430.532   18.349  103.381   2.2279  102.703   2.1918 0.6777267 3.125304 
1 1 1   11    2  -73 o  120.811   1.4756  595.237   14.531  598.958   21.398  592.053   19.796  121.144   2.1669  120.455   2.0161 0.6894226 2.959761 
1 1 1   11    2  -72 o   78.486   1.6661  251.257   10.660  244.371   17.183  255.565   13.591   77.306   2.7310   79.110   2.1094 -1.803871 3.450832 
1 1 1   11    2  -71 f  119.884   1.5510  586.138   15.156  598.077   23.783  577.974   19.668  121.046   2.4103  119.020   2.0272 2.025581 3.149496 
1 1 1   11    2  -70 o   58.045   1.9345  137.599   9.1401  147.103   15.292  132.316   11.401   59.923   3.1415   56.882   2.4647 3.041054 3.992965 
1 1 1   11    2  -69 o   99.741   1.6164  405.707   13.142  407.101   21.468  404.872   16.620   99.828   2.6405   99.620   2.0467 0.2074127 3.340854 
1 1 1   11    2  -68 o   64.259   2.0171  168.610   10.552  157.659   20.022  172.822   12.417   61.963   3.9852   65.037   2.3460 -3.073761 4.624443 
1 1 1   11    2  -67 o  123.589   1.6233  622.868   16.354  644.648   26.390  609.290   20.837  125.681   2.5760  122.213   2.0916 3.467445 3.318170 
1 1 1   11    2  -66 o  117.941   1.6568  567.233   15.929  577.502   25.510  560.671   20.393  118.956   2.6308  117.237   2.1339 1.719841 3.387389 
1 1 1   11    2  -65 o   78.407   1.9154  250.732   12.242  262.331   20.932  244.702   15.092   80.087   3.2129   77.407   2.3948 2.680023 4.007205 
1 1 1   11    2  -64 o  161.122   1.5165  1058.53   19.917  1036.98   27.464  1082.43   28.927  159.442   2.1131  162.895   2.1785 -3.452271 3.035024 
1 1 1   11    2  -63 o  159.152   1.5936  1032.82   20.675  1044.38   27.205  1017.04   31.808  160.014   2.0857  157.882   2.4716 2.132568 3.234033 
1 1 1   11    2  -62 o  208.526   1.8592  1773.29   31.602  1805.60   39.622  1716.81   52.392  210.384   2.3104  205.068   3.1342 5.315536 3.893736 
1 1 1   11    2  -61 o  208.086   1.7705  1765.69   30.031  1883.18   48.179  1691.03   38.405  214.820   2.7513  203.603   2.3140 11.21771 3.595054 
1 1 1   11    2  -60 o  111.653   1.5454  508.286   14.065  504.904   17.600  514.264   23.400  111.269   1.9404  112.271   2.5569 -1.002289 3.209839 
1 1 1   11    2  -59 o  223.602   1.8157  2038.81   33.094  2023.73   42.898  2060.96   52.011  222.736   2.3627  224.733   2.8392 -1.997208 3.693709 
1 1 1   11    2  -58 o  176.319   1.5090  1267.50   21.688  1275.11   30.443  1259.66   30.906  176.819   2.1121  175.742   2.1574 1.077042 3.019168 
1 1 1   11    2  -57 o   32.679   2.4509   43.808   6.4812   44.309   8.9253   43.248   9.4268   32.771   3.3901   32.341   3.6389 0.4299278 4.973321 
1 1 1   11    2  -56 o  156.600   2.0664  1000.11   26.378   0.0000   0.0000  1000.11   26.378  ?   ?   156.600   2.0664 0.000000 2.066392 
1 1 1   11    2  -55 o   73.824   1.9897  222.406   11.962  240.661   30.725  219.144   12.987   76.557   4.9500   73.271   2.1769 3.285942 5.407469 
1 1 1   11    2  -54 o  342.235   2.8241  4778.71   78.785  4986.56  184.015  4732.06   87.180  348.821   6.4716  340.518   3.1408 8.303375 7.193515 
1 1 1   11    2  -53 o  213.760   2.3316  1863.64   40.628  1896.05   84.777  1853.98   46.290  215.362   4.8292  213.182   2.6638 2.180038 5.515143 
1 1 1   11    2  -52 f  152.554   1.7835  948.921   22.178  923.461   34.019  967.740   29.248  150.451   2.7739  154.038   2.3293 -3.586777 3.622166 
1 1 1   11    2  -51 o  157.510   1.6675  1011.52   21.409  1038.91   30.464  984.787   30.094  159.602   2.3416  155.388   2.3759 4.214279 3.335885 
1 1 1   11    2  -50 o  100.653   1.6222  413.047   13.310  432.534   18.988  394.221   18.663  102.985   2.2618   98.316   2.3287 4.668640 3.246318 
1 1 1   11    2  -49 o  255.790   2.0854  2668.05   43.481  2604.94   60.494  2735.50   62.540  252.684   2.9370  258.937   2.9630 -6.252655 4.171933 
1 1 1   11    2  -48 o  161.578   1.4648  1064.33   19.293  1040.85   26.834  1089.46   27.760  159.767   2.0604  163.454   2.0834 -3.687241 2.930196 
1 1 1   11    2  -47 o  323.205   2.1162  4259.68   55.753  4286.61   79.473  4233.58   78.235  324.144   3.0078  322.136   2.9794 2.008118 4.233624 
1 1 1   11    2  -46 o  183.338   1.6233  1370.36   24.260  1442.44   39.172  1325.51   30.898  188.059   2.5553  180.296   2.1024 7.762878 3.309040 
1 1 1   11    2  -45 o  132.093   1.2995  711.281   13.992  705.562   21.215  715.684   18.614  131.545   1.9785  132.492   1.7235 -0.9467468 2.623899 
1 1 1   11    2  -44 o  133.961   1.3024  731.539   14.222  751.952   21.805  716.425   18.763  135.802   1.9697  132.561   1.7364 3.241089 2.625815 
1 1 1   11    2  -43 o   74.495   1.3870  226.226   8.4223  233.214   12.991  221.159   11.062   75.598   2.1101   73.628   1.8446 1.970528 2.802747 
1 1 1   11    2  -42 o  160.108   1.3538  1044.98   17.668  1067.61   26.961  1027.95   23.390  161.814   2.0440  158.787   1.8071 3.027420 2.728320 
1 1 1   11    2  -41 o  116.545   1.2937  553.684   12.291  556.804   18.673  551.299   16.326  116.862   1.9602  116.287   1.7223 0.5745468 2.609345 
1 1 1   11    2  -40 o  347.883   2.3882  4935.02   67.723  4937.56   90.251  4931.74  102.457  347.905   3.1824  347.656   3.6154 0.2496948 4.816504 
1 1 1   11    2  -39 o  213.662   1.8693  1861.18   32.556  1834.13   39.864  1915.35   56.413  212.088   2.3059  216.689   3.1938 -4.601563 3.939188 
1 1 1   11    2  -38 o  343.857   2.5614  4821.56   71.796  4837.20   88.428  4791.31  122.984  344.368   3.1501  342.602   4.4037 1.765869 5.414460 
1 1 1   11    2  -37 o  413.996   2.9830  6990.20  100.667  6943.66  122.907  7085.04  175.461  412.546   3.6548  416.515   5.1679 -3.969116 6.329698 
1 1 1   11    2  -36 o  330.490   2.7226  4454.04   73.345  4483.52   95.600  4411.87  114.352  331.522   3.5376  328.795   4.2666 2.726501 5.542441 
1 1 1   11    2  -35 o  230.909   1.9475  2173.71   36.657  2156.27   44.967  2208.24   63.293  229.966   2.3988  232.678   3.3370 -2.712112 4.109766 
1 1 1   11    2  -34 o  215.484   1.7206  1892.85   30.222  1856.75   40.126  1940.18   45.941  213.402   2.3067  218.135   2.5837 -4.731979 3.463587 
1 1 1   11    2  -33 o  316.000   2.2128  4071.09   56.999  4102.15   76.453  4032.23   85.526  317.166   2.9571  314.428   3.3369 2.737701 4.458626 
1 1 1   11    2  -32 o  204.520   1.6658  1705.10   27.771  1658.27   42.254  1740.71   36.847  201.670   2.5703  206.633   2.1876 -4.963013 3.375199 
1 1 1   11    2  -31 o  226.198   1.8964  2085.78   34.966  2074.58   60.988  2091.27   42.676  225.543   3.3173  226.484   2.3116 -0.9408417 4.043233 
1 1 1   11    2  -30 o  260.150   1.9125  2758.91   40.557  2746.88   61.888  2767.97   53.693  259.548   2.9252  260.558   2.5280 -1.009796 3.866196 
1 1 1   11    2  -29 o  205.069   1.6597  1714.22   27.744  1686.69   42.134  1735.30   36.864  203.397   2.5413  206.315   2.1920 -2.918442 3.356003 
1 1 1   11    2  -28 o  101.570   1.3584  420.510   11.246  400.401   16.229  439.091   15.600   99.106   2.0088  103.786   1.8439 -4.679474 2.726797 
1 1 1   11    2  -27 o  399.048   2.4939  6492.05   81.123  6411.83  113.910  6574.62  115.559  396.518   3.5242  401.520   3.5307 -5.001648 4.988590 
1 1 1   11    2  -26 o  264.549   1.8219  2852.88   39.289  2850.00   55.850  2855.69   55.282  264.396   2.5914  264.661   2.5625 -0.2649536 3.644371 
1 1 1   11    2  -25 o  439.368   2.7075  7870.41   96.968  7962.81  138.730  7782.14  135.592  441.869   3.8516  436.830   3.8079 5.038513 5.416162 
1 1 1   11    2  -24 o  464.587   2.8450  8800.02  107.742  8737.58  151.683  8863.60  153.067  462.861   4.0202  466.186   4.0280 -3.325226 5.690944 
1 1 1   11    2  -23 o  194.951   1.7901  1549.21   28.448  1597.95   41.529  1506.12   39.048  197.980   2.5733  192.209   2.4922 5.771011 3.582324 
1 1 1   11    2  -22 o  152.671   1.5163  950.070   18.870  933.786   25.040  971.474   28.707  151.352   2.0296  154.372   2.2813 -3.020981 3.053495 
1 1 1   11    2  -21 o  112.500   1.4789  515.879   13.562  544.345   18.514  482.919   19.922  115.559   1.9655  108.841   2.2455 6.717484 2.984154 
1 1 1   11    2  -20 o  524.995   3.3946 11238.11  145.273 11220.95  192.128 11261.01  221.985  524.514   4.4936  525.387   5.1833 -0.8735352 6.860011 
1 1 1   11    2  -19 o  235.252   1.8184  2255.91   34.870  2224.17   45.922  2299.14   53.588  233.581   2.4118  237.478   2.7683 -3.896957 3.671547 
1 1 1   11    2  -18 o  159.433   1.4256  1036.07   18.528  1055.72   26.908  1018.36   25.549  160.932   2.0512  158.059   1.9830 2.872650 2.852989 
1 1 1   11    2  -17 o  255.143   1.7826  2653.49   37.073  2615.62   52.318  2691.68   52.542  253.302   2.5338  256.959   2.5084 -3.657104 3.565465 
1 1 1   11    2  -16 o  282.370   1.9093  3250.08   43.948  3204.34   62.022  3296.21   62.282  280.360   2.7139  284.351   2.6870 -3.991394 3.819088 
1 1 1   11    2  -15 o  170.158   1.5643  1180.17   21.697  1182.09   34.212  1178.88   28.063  170.287   2.4647  170.061   2.0244 0.2259064 3.189480 
1 1 1   11    2  -14 o  419.658   2.7855  7179.55   95.286  7228.17  146.988  7144.31  125.142  421.011   4.2831  418.592   3.6676 2.418732 5.638749 
1 1 1   11    2  -13 o  385.850   2.5955  6069.16   81.634  6005.32  124.308  6117.58  108.247  383.765   3.9737  387.358   3.4282 -3.592896 5.248147 
1 1 1   11    2  -12 o  215.046   1.7316  1884.98   30.354  1829.56   46.380  1926.51   40.146  211.849   2.6857  217.396   2.2655 -5.546875 3.513624 
1 1 1   11    2  -11 o  538.725   3.2476 11832.23  142.614 11759.79  200.982 11905.70  202.399  536.995   4.5915  540.315   4.5954 -3.320801 6.496110 
1 1 1   11    2  -10 o  477.355   2.9144  9289.44  113.403  9168.37  158.921  9415.06  161.871  474.180   4.1115  480.516   4.1326 -6.335907 5.829495 
1 1 1   11    2   -9 o  489.276   2.9793  9759.25  118.822  9879.14  170.090  9644.96  166.063  492.212   4.2393  486.346   4.1888 5.865936 5.959651 
1 1 1   11    2   -8 o  523.800   3.1684 11185.39  135.282 11238.21  192.403 11133.75  190.251  524.965   4.4962  522.521   4.4667 2.443665 6.337768 
1 1 1   11    2   -7 o  403.807   2.9110  6647.36   95.820  6706.19  118.556  6536.54  162.716  405.567   3.5861  400.342   4.9861 5.224854 6.141812 
1 1 1   11    2   -6 o   51.127   2.2047  106.749   9.1668  102.207   12.212  112.612   13.874   49.981   3.0114   52.456   3.2609 -2.475224 4.438654 
1 1 1   11    2   -5 o  316.954   2.4005  4095.08   62.021  4126.38   76.792  4036.36  105.177  318.151   2.9611  314.629   4.1010 3.521515 5.058254 
1 1 1   11    2   -4 o  350.383   2.8354  5004.73   80.984  4998.39  104.845  5014.10  127.511  350.138   3.6734  350.659   4.4609 -0.5216675 5.778779 
1 1 1   11    2   -3 o   64.410   2.1469  169.294   11.256  187.754   19.685  160.326   13.721   67.767   3.5763   62.656   2.6928 5.111507 4.476696 
1 1 1   11    2   -2 o  398.488   2.8795  6473.31   93.532  6444.45  132.019  6502.40  132.531  397.558   4.0738  399.342   4.0713 -1.783600 5.759495 
1 1 1   11    2   -1 o  422.543   3.0264  7278.56  104.240  7155.41  145.577  7408.15  149.329  418.906   4.2632  426.238   4.2979 -7.332489 6.053689 
1 1 1   11    2    0 o  242.666   2.0039  2400.32   39.639  2420.68   56.746  2380.91   55.393  243.681   2.8568  241.672   2.8119 2.009583 4.008462 
1 1 1   11    2    1 o  190.562   1.9474  1480.20   30.250  1451.48   38.864  1524.33   48.182  188.699   2.5266  193.369   3.0567 -4.670059 3.965804 
1 1 1   11    2    2 o  305.407   2.3380  3802.09   58.205  3986.06   85.434  3642.74   79.514  312.686   3.3519  298.919   3.2633 13.76672 4.678034 
1 1 1   11    2    3 o  204.405   2.6069  1703.19   43.437  1715.61   54.226  1680.94   72.563  205.139   3.2428  203.034   4.3844 2.104996 5.453316 
1 1 1   11    2    4 o  499.986   3.8444 10192.56  156.682 10367.36  251.755 10082.05  200.173  504.111   6.1265  497.208   4.9389 6.902924 7.869386 
1 1 1   11    2    5 o  516.498   3.6181 10876.48  152.329 11061.20  219.013 10703.39  212.008  520.777   5.1592  512.290   5.0769 8.486938 7.238279 
1 1 1   11    2    6 o  389.220   3.1087  6175.94   98.630  6108.88  126.756  6278.86  157.021  387.069   4.0174  392.377   4.9093 -5.308105 6.343543 
1 1 1   11    2    7 o  294.924   2.8159  3545.80   67.697  3610.78   98.300  3487.18   93.366  297.581   4.0524  292.447   3.9166 5.133667 5.635738 
1 1 1   11    2    8 o  214.309   1.8851  1872.10   32.932  1893.74   40.995  1832.72   55.298  215.539   2.3333  212.025   3.1995 3.513977 3.959955 
1 1 1   11    2    9 o  253.075   2.5070  2610.82   51.718  2524.66   71.564  2705.02   74.824  248.843   3.5280  257.578   3.5637 -8.734451 5.014651 
1 1 1   11    2   10 o  225.721   2.1140  2076.83   38.897  2087.61   50.769  2061.52   60.524  226.296   2.7522  224.867   3.3019 1.428650 4.298531 
1 1 1   11    2   11 o  319.912   2.4185  4171.93   63.067  4162.99   89.491  4180.76   88.894  319.543   3.4357  320.225   3.4055 -0.6820068 4.837492 
1 1 1   11    2   12 o  301.807   2.3147  3713.06   56.946  3747.54   81.437  3680.07   79.661  303.182   3.2952  300.441   3.2527 2.740417 4.630191 
1 1 1   11    2   13 o  317.563   2.4049  4110.91   62.254  4141.04   88.861  4081.87   87.242  318.697   3.4206  316.413   3.3825 2.283630 4.810544 
1 1 1   11    2   14 o  404.969   2.9212  6685.88   96.430  6660.43  136.259  6711.40  136.488  404.146   4.1361  405.690   4.1273 -1.543945 5.843087 
1 1 1   11    2   15 o  209.999   2.0122  1797.60   34.445  1824.70   55.116  1780.23   44.122  211.556   3.1961  208.973   2.5902 2.582916 4.113876 
1 1 1   11    2   16 o  245.875   2.1994  2464.33   44.080  2454.29   69.601  2471.06   56.960  245.345   3.4802  246.197   2.8383 -0.8524017 4.490799 
1 1 1   11    2   17 o  207.001   1.9991  1746.65   33.733  1726.66   53.308  1760.00   43.564  205.792   3.1778  207.781   2.5721 -1.988922 4.088288 
1 1 1   11    2   18 o  508.718   3.9007 10553.10  161.756 10456.02  254.006 10619.34  209.796  506.182   6.1560  510.226   5.0443 -4.043213 7.958742 
1 1 1   11    2   19 o  183.691   1.8957  1375.43   28.386  1384.94   45.410  1369.32   36.366  184.308   3.0225  183.276   2.4342 1.032471 3.880873 
1 1 1   11    2   20 o  194.430   1.9396  1540.95   30.740  1541.53   48.890  1540.57   39.533  194.447   3.0845  194.397   2.4948 0.4937744E-01 3.967108 
1 1 1   11    2   21 o  183.223   1.8888  1368.43   28.211  1372.95   44.847  1365.47   36.290  183.507   2.9981  183.017   2.4325 0.4900970 3.860793 
1 1 1   11    2   22 o  120.570   1.9381  592.581   19.048  596.605   27.018  588.604   26.859  120.970   2.7400  120.156   2.7422 0.8139496 3.876494 
1 1 1   11    2   23 o   34.608   3.1893   49.250   8.8960   48.149   14.536   49.909   11.248   33.928   5.4398   34.748   4.0469 -0.8198318 6.780044 
1 1 1   11    2   24 o  118.109   1.7239  568.623   16.597  535.628   25.955  591.448   21.588  114.620   2.7780  120.452   2.1986 -5.831535 3.542770 
1 1 1   11    2   25 o  231.923   2.1272  2192.70   40.215  2160.74   63.142  2214.51   52.162  230.194   3.3651  233.059   2.7457 -2.865463 4.343080 
1 1 1   11    2   26 o  185.404   1.9050  1401.24   28.791  1390.34   45.613  1408.46   37.121  184.658   3.0303  185.871   2.4500 -1.213074 3.896801 
1 1 1   11    2   27 o  213.172   2.0368  1852.46   35.393  1857.14   56.333  1849.40   45.493  213.410   3.2383  212.982   2.6204 0.4272919 4.165702 
1 1 1   11    2   28 o  532.696   4.5495 11577.03  197.550 11516.55  278.494 11638.29  280.269  531.038   6.4336  533.836   6.4407 -2.798279 9.103497 
1 1 1   11    2   29 o  210.841   2.5886  1812.43   44.490  1831.33   77.776  1803.24   54.240  211.865   4.5035  210.288   3.1642 1.576813 5.504003 
1 1 1   11    2   30 o  336.693   3.5432  4623.40   97.244  4600.63  167.735  4634.92  119.348  335.641   6.1307  337.056   4.3439 -1.414673 7.513648 
1 1 1   11    2   31 o  142.194   2.2342  824.310   25.897  865.091   45.921  805.291   31.359  145.577   3.8731  140.535   2.7374 5.042908 4.742861 
1 1 1   11    2   32 o  231.346   2.7259  2182.31   51.406  2102.08   86.999  2225.35   63.719  226.956   4.7026  233.590   3.3464 -6.633713 5.771719 
1 1 1   11    2   33 o  255.865   2.2688  2669.09   47.319  2573.93   73.343  2736.95   61.933  251.203   3.5818  259.069   2.9327 -7.866379 4.629268 
1 1 1   11    2   34 o  228.599   2.1170  2130.50   39.449  2183.61   63.723  2097.50   50.232  231.380   3.3786  226.801   2.7171 4.578827 4.335596 
1 1 1   11    2   35 o  240.441   2.1827  2357.03   42.779  2392.61   68.725  2334.52   54.660  242.189   3.4812  239.266   2.8026 2.923294 4.469105 
1 1 1   11    2   36 o  312.607   2.6074  3984.87   66.443  4074.29  107.177  3929.05   84.678  315.976   4.1611  310.361   3.3471 5.615234 5.340237 
1 1 1   11    2   37 o  316.567   2.6345  4086.61   67.983  4139.33  108.897  4052.95   87.024  318.474   4.1948  315.206   3.3870 3.267578 5.391429 
1 1 1   11    2   38 o  241.648   2.1905  2380.88   43.147  2372.59   68.425  2386.36   55.593  241.157   3.4808  241.895   2.8194 -0.7384186 4.479403 
1 1 1   11    2   39 o  287.114   2.4552  3361.49   57.463  3379.74   91.530  3349.62   73.824  287.782   3.9018  286.559   3.1604 1.222992 5.021169 
1 1 1   11    2   40 o  187.964   1.9286  1440.45   29.550  1462.12   47.616  1426.88   37.685  189.325   3.0854  187.057   2.4715 2.267410 3.953198 
1 1 1   11    2   41 o   90.864   1.7851  336.603   13.222  333.466   21.365  338.550   16.832   90.372   2.9040   91.119   2.2661 -0.7467728 3.683558 
1 1 1   11    2   42 o  219.984   2.0795  1973.19   37.290  1958.59   59.161  1982.81   48.032  219.100   3.3125  220.490   2.6724 -1.390076 4.256106 
1 1 1   11    2   43 o  238.268   2.1746  2314.94   42.235  2291.85   66.783  2330.32   54.524  236.993   3.4569  239.022   2.7984 -2.029160 4.447651 
1 1 1   11    2   44 o  156.123   1.8110  993.763   23.047  956.155   36.241  1019.30   29.863  153.100   2.9040  158.099   2.3172 -4.998978 3.715184 
1 1 1   11    2   45 o  139.624   1.7637  794.821   20.073  818.554   32.460  780.126   25.543  141.658   2.8111  138.313   2.2655 3.345062 3.610343 
1 1 1   11    2   46 o  183.663   1.9156  1375.38   28.679  1346.39   45.312  1394.75   37.044  181.661   3.0599  184.929   2.4574 -3.267151 3.924532 
1 1 1   11    2   47 o  163.451   1.8352  1089.28   24.452  1098.40   39.149  1083.45   31.311  164.086   2.9269  162.993   2.3566 1.093353 3.757706 
1 1 1   11    2   48 o  236.075   2.1677  2272.67   41.714  2374.35   68.116  2211.66   52.765  241.199   3.4645  232.845   2.7800 8.353836 4.441939 
1 1 1   11    2   49 o   91.139   2.0180  338.702   14.992  347.849   21.808  330.505   20.644   92.292   2.9024   89.965   2.8185 2.327446 4.045702 
1 1 1   11    2   50 o   52.731   3.9468  114.172   16.842  108.591   23.927  119.652   23.710   51.185   5.8391   53.810   5.4819 -2.624928 8.009109 
1 1 1   11    2   51 o  174.059   3.0666  1236.24   43.510  1213.42   61.013  1259.85   62.067  172.290   4.3478  175.612   4.3358 -3.321762 6.140224 
1 1 1   11    2   52 f   52.827   3.2485  114.319   13.921  131.712   25.612  107.027   16.584   56.457   5.6409   51.035   4.0189 5.421421 6.926097 
1 1 1   11    2   53 o  164.025   2.4316  1097.39   32.512  1087.13   57.247  1102.27   39.501  163.067   4.3105  164.361   2.9483 -1.293259 5.222379 
1 1 1   11    2   54 o  112.353   2.0025  514.758   18.340  503.608   25.584  526.545   26.304  111.064   2.8282  113.566   2.8437 -2.501572 4.010680 
1 1 1   11    2   55 o  119.701   1.7623  584.227   17.195  584.839   27.837  583.850   21.865  119.722   2.8524  119.646   2.2419 0.7606506E-01 3.627995 
1 1 1   11    2   56 o  330.390   2.7338  4453.61   73.624  4528.12  118.327  4406.55   94.047  332.874   4.3608  328.528   3.5119 4.346039 5.599085 
1 1 1   11    2   57 o  167.190   2.1295  1140.01   29.022  1154.68   41.293  1125.68   40.798  168.208   3.0116  166.082   3.0136 2.126373 4.260454 
1 1 1   11    2   58 o  179.433   1.7756  1312.84   25.971  1319.81   37.853  1306.63   35.699  179.862   2.5818  178.971   2.4470 0.8912201 3.557212 
1 1 1   11    2   59 o   94.539   1.7309  364.439   13.339  356.519   20.165  370.600   17.786   93.440   2.6502   95.318   2.2891 -1.878387 3.501908 
1 1 1   11    2   60 o  124.734   1.6869  634.410   17.152  634.162   25.537  634.614   23.151  124.676   2.5127  124.731   2.2770 -0.5539703E-01 3.390942 
1 1 1   11    2   61 o  204.834   1.8877  1711.05   31.519  1692.62   45.404  1728.19   43.789  203.663   2.7349  205.803   2.6102 -2.140274 3.780641 
1 1 1   11    2   62 o   45.618   2.9548   85.297   10.929  109.981   22.429   77.611   12.515   51.539   5.4197   43.446   3.5651 8.093468 6.487132 
1 1 1   11    2   63 o  139.927   1.7596  798.446   20.070  761.848   29.426  830.283   27.445  136.636   2.6420  142.658   2.3601 -6.022644 3.542602 
1 1 1   11    2   64 o   16.043   6.2051   6.7588   11.538   14.541   15.394  -3.2148   17.427   20.395   7.3033   16.176   7.0465 4.219692 10.14848 
1 1 1   11    2   65 o  167.640   1.7840  1146.09   24.379  1131.04   34.529  1161.06   34.425  166.485   2.5444  168.683   2.5036 -2.198013 3.569585 
1 1 1   11    2   66 o  101.807   1.8197  422.703   15.101  418.430   19.082  429.863   24.702  101.272   2.3115  102.570   2.9575 -1.298599 3.753694 
1 1 1   11    2   67 o  265.007   2.0150  2864.68   43.529  2901.08   58.375  2819.09   65.328  266.601   2.6861  262.752   3.0501 3.849396 4.064320 
1 1 1   11    2   68 o   80.468   1.6132  264.057   10.582  268.704   15.444  259.945   14.527   81.115   2.3382   79.788   2.2359 1.327309 3.235178 
1 1 1   11    2   69 o  143.046   1.5157  834.426   17.674  861.456   28.430  817.400   22.564  145.287   2.4006  141.555   1.9555 3.732590 3.096241 
1 1 1   11    2   70 o   32.997   2.8934   44.807   7.7038   24.835   15.940   50.895   8.7998   24.430   7.3822   35.161   3.1021 -10.73089 8.007499 
1 1 1   11    2   71 f   28.499   3.1291   33.582   7.1497   23.138   12.298   38.915   8.7873   23.321   6.3150   30.642   3.5858 -7.320452 7.262029 
1 1 1   11    2   72 o  137.209   1.5156  767.784   16.952  813.701   27.412  739.349   21.571  141.187   2.3818  134.615   1.9658 6.572021 3.088260 
1 1 1   11    2   73 o   56.831   1.7737  131.882   8.2069  136.704   12.856  128.565   10.662   57.788   2.7369   56.072   2.3378 1.716484 3.599470 
1 1 1   11    2   74 o   59.773   1.6464  145.848   8.0143  166.017   13.060  133.665   10.150   63.711   2.5197   57.184   2.1815 6.527077 3.332843 
1 1 1   11    2   75 o  182.424   1.4523  1357.27   21.596  1412.39   33.577  1318.39   28.203  186.006   2.2145  179.745   1.9249 6.261230 2.934146 
1 1 1   11    2   76 o   92.189   1.3727  346.618   10.316  354.282   16.422  341.622   13.258   93.158   2.1626   91.502   1.7775 1.655495 2.799299 
1 1 1   11    2   77 o   17.518   4.2132   13.091   5.9424   8.7594   10.260   15.277   7.2894   16.220   5.9405   18.917   4.7380 -2.696585 7.598593 
1 1 1   11    2   78 o   59.542   1.5837  144.734   7.6796  143.047   12.762  145.692   9.6155   59.104   2.6556   59.711   1.9783 -0.6067810 3.311484 
1 1 1   11    2   79 o  114.898   1.3305  538.448   12.462  548.072   19.668  531.993   16.107  115.859   2.0826  114.178   1.7306 1.680824 2.707781 
1 1 1   11    2   80 o   12.602   4.7428   4.8008   6.6233   13.118   9.9177  -1.8951   8.8984   18.091   5.8761   11.469   5.0149 6.622319 7.725194 
1 1 1   11    2   81 f   65.336   1.8426  174.399   9.8038  164.521   13.236  186.406   14.592   63.385   2.5671   67.465   2.6587 -4.079578 3.695722 
1 1 1   11    2   82 o   85.203   1.5435  296.231   10.720  283.982   15.679  306.983   14.690   83.329   2.3105   86.693   2.0787 -3.364067 3.107929 
1 1 1   11    2   83 o   44.397   2.2386   80.757   8.0752   75.222   13.058   84.185   10.276   42.629   3.7975   45.266   2.7986 -2.637482 4.717279 
1 1 1   11    2   84 o   52.043   2.0802  110.847   8.8070  125.196   14.569  102.584   11.056   55.156   3.2549   49.986   2.7236 5.169910 4.244076 
1 1 1   11    2   85 o  144.045   1.5945  847.059   18.722  868.091   28.408  830.907   24.894  145.673   2.3923  142.571   2.1420 3.102036 3.211166 
1 1 1   11    2   86 o   83.913   1.4844  287.428   10.154  284.217   17.031  289.199   12.647   83.286   2.5114   84.136   1.8441 -0.8496857 3.115780 
1 1 1   11    2   87 f   56.825   1.6457  131.988   7.6150  124.469   13.460  135.528   9.2350   54.993   3.0142   57.547   1.9716 -2.553944 3.601729 
1 1 1   11    2   88 o   86.099   1.4185  302.642   9.9559  294.594   19.810  305.362   11.516   84.681   2.8740   86.462   1.6339 -1.780861 3.306012 
1 1 1   11    2   89 o   12.116   3.9870   5.8166   4.5590   6.1677   10.553   5.7361   5.0550   15.152   5.9136   12.271   4.2000 2.880204 7.253312 
1 1 1   11    2   90 o   75.046   1.3566  229.961   8.2990  210.956   15.003  238.341   9.9619   71.663   2.5724   76.374   1.6002 -4.710724 3.029488 
1 1 1   11    2   91 f   69.540   1.3100  197.463   7.4255  195.015   12.398  198.832   9.2724   68.954   2.2087   69.745   1.6310 -0.7905273 2.745581 
1 1 1   11    2   92 o   17.763   3.4973   13.485   4.8834   8.3078   8.4893   16.045   5.9701   15.102   5.4215   19.330   3.9231 -4.228657 6.692045 
1 1 1   11    2   93 o   14.442   4.8007   8.3671   6.6045   15.622   8.2968  -4.1818   10.912   18.944   5.2106   12.032   5.3908 6.912012 7.497415 
1 1 1   11    2   94 o   40.552   2.2914   67.733   7.5436   62.651   9.4557   76.630   12.511   38.847   3.0095   42.822   3.6181 -3.975208 4.706137 
1 1 1   11    2   95 o   40.328   2.2665   67.015   7.4209   66.629   9.2896   67.694   12.336   40.082   2.8620   40.138   3.8163 -0.5586624E-01 4.770282 
1 1 1   11    2   96 o   51.724   1.9625  109.895   8.2593  112.267   10.420  105.884   13.548   52.165   2.4573   50.407   3.3156 1.758781 4.126941 
1 1 1   11    2   97 o   82.030   1.6096  275.522   10.763  276.972   13.733  273.215   17.328   82.128   2.0513   81.338   2.6169 0.7892838 3.325076 
1 1 1   11    2   98 o   41.903   2.2767   72.476   7.7473   70.493   9.7234   75.922   12.820   41.158   2.9171   42.446   3.7436 -1.288166 4.745973 
1 1 1   11    2   99 o   57.280   1.8792  134.831   8.7622  128.930   11.118  144.508   14.236   55.850   2.4480   58.943   2.9725 -3.092392 3.850743 
1 1 1   11    2  100 o   45.743   2.1410   86.316   7.9609   87.914   10.167   83.784   12.799   45.996   2.7239   44.601   3.5495 1.394756 4.474245 
1 1 1   11    2  101 o   69.182   1.7237  196.410   9.7207  205.891   12.602  182.478   15.275   70.651   2.1908   66.241   2.8355 4.409927 3.583269 
1 1 1   11    2  102 o   56.758   2.0273  132.782   9.3648  133.728   12.631  131.627   13.955   56.700   2.7411   56.112   3.0625 0.5878983 4.110036 
1 1 1   11    2  103 o   96.007   1.6846  378.379   13.184  377.345   18.028  379.568   19.330   95.573   2.3140   95.729   2.4793 -0.1557617 3.391368 
1 1 1   11    2  104 o   42.867   2.3869   76.256   8.3076   73.997   11.099   79.134   12.527   41.897   3.2760   43.194   3.5904 -1.296757 4.860308 
1 1 1   11    2  105 o   41.454   2.4457   71.459   8.2275   76.438   10.094   61.601   14.202   42.702   2.9173   37.454   4.7592 5.248695 5.582159 
1 1 1   11    2  106 o   45.850   2.3418   87.306   8.7234   79.332   10.614  103.901   15.313   43.433   3.0168   49.279   3.8423 -5.846767 4.885124 
1 1 1   11    2  107 o   22.556   4.2600   22.559   7.5459   9.4502   9.1447   50.530   13.358   15.397   5.6132   33.576   5.0357 -18.17908 7.540981 
1 1 1   11    2  108 o   54.787   2.0065  124.223   8.9458  126.760   11.512  120.356   14.213   55.078   2.5713   53.250   3.2905 1.827991 4.175968 
1 1 1   11    2  109 o   33.383   2.8540   47.126   7.6919   55.358   9.7195   33.330   12.583   35.961   3.3544   26.452   5.9769 9.509899 6.853836 
1 1 1   11    2  110 o   27.011   3.5061   31.664   7.5379   33.570   9.6874   28.740   12.001   27.313   4.5082   24.350   6.0680 2.962852 7.559416 
1 1 1   11    2  111 o   68.784   1.8518  195.879   10.374  190.015   13.357  204.792   16.468   67.364   2.4364   69.545   2.9114 -2.180626 3.796350 
1 1 1   11    2  112 o   25.242   3.9379   28.358   7.8382   25.735   10.053   32.426   12.517   23.201   5.4149   25.658   6.0785 -2.457075 8.140597 
1 1 1   11    2  113 o   39.628   2.6714   66.567   8.5789   62.588   10.994   72.763   13.719   37.830   3.6088   40.309   4.2386 -2.479172 5.566785 
1 1 1   11    2  114 o   43.588   2.7017   80.768   9.5521   78.183   12.748   84.077   14.423   42.090   3.7551   43.313   4.1353 -1.223442 5.585831 
1 1 1   11    2  115 o   30.684   3.9926   42.370   9.7495   29.423   13.594   56.083   13.990   23.459   6.7480   34.359   5.1539 -10.90042 8.491104 
1 1 1   11    2  116 o   27.589   4.9836   36.251   10.795   36.316   13.730   36.146   17.471   26.340   6.4477   24.877   7.7681 1.462587 10.09540 
1 1 1   11    2  117 o   23.450   5.7751   27.820   10.965   38.967   13.955   9.8329   17.727   27.323   6.3818   16.687   7.1880 10.63629 9.612167 
1 1 1   11    2  118 f   29.401   4.3352   39.924   10.078   33.220   14.419   46.329   14.093   24.530   6.9149   30.267   5.9243 -5.736710 9.105663 
1 1 1   11    2  119 o   20.652   6.9308   23.831   13.761   0.0000   0.0000   23.831   13.761  ?   ?    20.652   6.9308 0.000000 6.930826 
1 1 1   11    2  120 o   11.921   5.4649  -2.8619   12.019  -0.3742   17.815  -4.9405   16.284   14.449   6.6348   13.198   6.1579 1.251109 9.052086 
1 1 1   11    2  121 o   17.426   6.2330   15.720   11.209   17.043   14.850   13.968   17.091   17.968   7.0143   17.262   7.2299 0.7052898 10.07333 
1 1 1   11    2  122 o   19.192   6.2244   19.822   11.131   21.821   14.724   17.155   17.003   19.519   7.1216   18.012   7.3441 1.506966 10.22997 
1 1 1   11    2  123 o   32.301   4.4518   49.054   11.410   66.497   15.276   27.040   17.161   36.776   5.2442   20.922   7.6796 15.85357 9.299369 
1 1 1   11    2  124 o   13.944   5.7941   6.9704   10.849  -0.2673   14.272   16.877   16.698   13.188   6.0112   17.771   7.2657 -4.583220 9.430002 
1 1 1   11    2  125 o   12.291   5.4492   1.4733   10.850   13.027   14.297 -14.2158   16.660   16.414   6.7185   11.814   5.7083 4.600529 8.816074 
1 1 1   11    2  126 o   14.871   5.9549   9.7846   10.955   3.3865   14.228   19.101   17.169   13.887   6.1933   18.283   7.4074 -4.396434 9.655419 
1 1 1   11    2  127 o   18.987   6.2050   19.719   11.050   10.532   14.395   32.898   17.241   15.714   6.6119   22.701   7.7570 -6.986803 10.19253 
1 1 1   11    3 -126 o   18.443   6.6712   19.096   12.883   18.405   15.088   20.954   24.749   18.090   7.0679   18.838   8.2961 -0.7480106 10.89865 
1 1 1   11    3 -125 o   13.012   5.3683   5.8460   9.2219   7.6162   10.993   1.6403   16.944   14.119   5.8464   14.255   6.5175 -0.1364288 8.755494 
1 1 1   11    3 -124 o   13.122   5.6220   4.6897   10.733   5.9787   11.992  -0.5035   24.070   13.879   5.9441   15.481   7.3057 -1.602490 9.418398 
1 1 1   11    3 -123 o   16.591   6.1438   14.210   11.025   12.046   12.189   23.937   25.844   15.865   6.3051   19.425   8.5188 -3.559744 10.59829 
1 1 1   11    3 -122 o   10.557   4.9348  -5.5475   10.537  -6.5360   11.724  -1.3918   24.039   10.950   5.1461   15.518   7.3165 -4.568194 8.944998 
1 1 1   11    3 -121 o   31.114   4.3712   45.351   10.781   59.053   13.607   22.240   17.672   34.998   4.9039   19.371   7.6250 15.62729 9.065799 
1 1 1   11    3 -120 o   14.119   5.5070   8.4332   9.1471   21.020   10.943 -20.7519   16.663   19.803   6.1423   11.161   5.4631 8.641590 8.220292 
1 1 1   11    3 -119 o   34.975   3.5604   54.580   10.009   60.083   12.050   42.331   17.977   36.156   4.1646   26.392   7.8083 9.764019 8.849426 
1 1 1   11    3 -118 o   12.828   5.2945   5.1019   8.9755   5.6393   10.761   3.8735   16.270   13.631   5.7249   14.817   6.6146 -1.186095 8.748007 
1 1 1   11    3 -117 o   15.556   5.5892   11.498   9.0243   20.246   10.722  -9.7492   16.710   19.647   6.0777   12.654   6.0056 6.993026 8.544282 
1 1 1   11    3 -116 o   14.666   5.8432   8.5854   10.495   14.118   11.859 -11.4042   22.541   16.981   6.3557   14.359   6.8597 2.622010 9.351462 
1 1 1   11    3 -115 o   26.683   5.3529   34.806   11.238   31.027   12.733   48.123   23.900   24.294   6.3574   26.748   9.1331 -2.454788 11.12792 
1 1 1   11    3 -114 o   13.117   5.5993   3.6736   10.577  -4.3361   11.989   31.788   22.462   11.734   5.4079   22.516   8.6714 -10.78257 10.21948 
1 1 1   11    3 -113 o   24.729   5.6909   30.363   11.233   29.486   12.832   33.236   23.238   23.735   6.4607   23.019   8.8315 0.7153053 10.94243 
1 1 1   11    3 -112 o   12.808   5.4492   3.1223   9.9596   4.9111   12.664   0.2221   16.125   14.390   6.1343   14.473   6.5132 -0.8283615E-01 8.947180 
1 1 1   11    3 -111 o   20.235   5.3356   19.712   8.9247   31.126   10.672  -6.8333   16.275   25.579   5.2931   13.347   6.2032 12.23197 8.154573 
1 1 1   11    3 -110 f   18.409   5.4919   16.197   8.8638   12.478   10.749   24.100   15.669   16.707   6.0864   21.514   7.3936 -4.806152 9.576519 
1 1 1   11    3 -109 f   54.435   2.4018  124.034   10.631  120.647   12.897  131.212   18.777   53.309   2.9798   54.492   4.2611 -1.182709 5.199642 
1 1 1   11    3 -108 o   12.961   5.2213   4.7506   8.4760   3.0572   10.333   8.2335   14.819   13.217   5.5836   16.430   6.7944 -3.213829 8.794293 
1 1 1   11    3 -107 o   18.730   5.3312   16.316   8.5284   5.0522   10.347   40.179   15.060   13.956   5.7144   28.715   6.5761 -14.75809 8.712008 
1 1 1   11    3 -106 o   42.875   3.0903   77.772   10.728   77.048   13.867   78.851   16.932   42.106   4.0916   41.939   5.0547 0.1668930 6.503169 
1 1 1   11    3 -105 o   20.055   5.5778   18.640   9.4488   23.432   12.515   12.286   14.411   22.155   6.5044   17.898   6.9314 4.256735 9.505315 
1 1 1   11    3 -104 o   9.9555   4.6270  -6.7737   9.0544 -12.8988   11.837   1.8627   14.056   10.538   5.0167   14.802   6.3886 -4.263728 8.122917 
1 1 1   11    3 -103 o   11.743   5.2505  -2.7723   10.294 -10.5188   11.661   24.586   21.914   10.874   5.1173   23.131   8.6433 -12.25673 10.04451 
1 1 1   11    3 -102 o   41.221   1.7056   69.909   5.7186   73.724   11.478   68.649   6.5954   41.765   3.4009   40.779   1.9901 0.9868279 3.940403 
1 1 1   11    3 -101 o   25.004   2.5128   26.138   5.0522   32.632   12.025   24.745   5.5674   26.790   5.6826   24.228   2.8750 2.562794 6.368495 
1 1 1   11    3 -100 o   56.665   1.6363  131.833   7.5499  140.180   15.023  129.013   8.7329   57.844   3.1986   55.978   1.9166 1.865452 3.728885 
1 1 1   11    3  -99 o   53.519   1.6822  117.622   7.3296  114.046   14.376  118.879   8.5202   52.099   3.4036   53.736   1.9484 -1.637108 3.921845 
1 1 1   11    3  -98 o   61.279   1.5555  153.961   7.7638  139.753   13.334  161.248   9.5495   57.984   2.8296   62.631   1.8726 -4.646946 3.393100 
1 1 1   11    3  -97 o   40.583   1.8776   67.757   6.1944   68.170   11.370   67.582   7.3869   40.251   3.5001   40.449   2.2492 -0.1981430 4.160498 
1 1 1   11    3  -96 f   14.536   4.0883   9.1416   5.0460   22.340   10.240   4.9089   5.7990   22.324   5.6292   12.021   4.4551 10.30247 7.178854 
1 1 1   11    3  -95 o   30.326   2.2822   38.043   5.6004   22.968   10.745   43.667   6.5623   22.641   5.7974   32.457   2.4996 -9.816065 6.313261 
1 1 1   11    3  -94 o   60.235   1.8075  148.827   8.8650  147.779   12.974  149.744   12.141   59.799   2.6683   60.254   2.4773 -0.4540253 3.640999 
1 1 1   11    3  -93 o   26.094   3.3465   28.671   6.9547   33.080   10.859   25.605   9.0554   27.571   5.0165   24.259   4.7493 3.312201 6.908076 
1 1 1   11    3  -92 o   50.597   1.9756  105.081   8.1324   99.270   12.084  109.892   10.995   48.937   3.0444   51.607   2.6222 -2.669945 4.018010 
1 1 1   11    3  -91 o   12.049   4.7532   3.6047   6.8801   13.048   11.673  -1.4223   8.5166   18.232   6.3753   11.223   4.9068 7.008707 8.044952 
1 1 1   11    3  -90 f   88.028   1.5777  316.780   11.321  347.431   23.559  307.578   12.909   91.721   3.1557   86.695   1.8267 5.025749 3.646307 
1 1 1   11    3  -89 o   13.694   4.4158   7.6217   5.6068   10.885   11.636   6.6351   6.3986   17.392   6.3332   13.387   4.7170 4.004108 7.896803 
1 1 1   11    3  -88 o   37.650   2.1072   58.214   6.4413   56.304   11.150   59.171   7.8914   36.717   3.7792   37.890   2.5702 -1.173115 4.570412 
1 1 1   11    3  -87 o   55.538   1.6837  126.163   7.6137  123.820   12.592  127.513   9.5590   54.843   2.8263   55.779   2.1061 -0.9364738 3.524693 
1 1 1   11    3  -86 o   16.130   4.3525   11.137   5.8542   11.966   10.411   10.753   7.0793   17.556   6.0270   16.059   4.9332 1.496214 7.788540 
1 1 1   11    3  -85 o   12.022   4.5831   4.2062   6.2320   19.630   10.744  -3.6145   7.6506   21.337   5.9528   9.9859   4.4907 11.35065 7.456699 
1 1 1   11    3  -84 o   66.664   1.8240  181.697   9.9023  182.246   14.195  181.177   13.820   66.654   2.6177   66.468   2.5555 0.1860580 3.658270 
1 1 1   11    3  -83 o   64.026   1.9321  167.646   10.072  169.760   14.595  165.724   13.917   64.311   2.7906   63.556   2.6925 0.7550468 3.877752 
1 1 1   11    3  -82 o   94.006   1.7688  360.869   13.554  374.844   18.922  346.143   19.424   95.697   2.4277   91.930   2.5947 3.767151 3.553304 
1 1 1   11    3  -81 o   47.919   2.1347   94.015   8.3174  107.288   13.928   86.658   10.369   51.034   3.3668   45.927   2.7829 5.107468 4.368029 
1 1 1   11    3  -80 o  115.664   1.4714  545.877   13.873  530.649   20.648  558.409   18.731  113.957   2.2228  116.933   1.9651 -2.975655 2.966870 
1 1 1   11    3  -79 f  133.110   1.4597  722.898   15.839  725.894   23.559  720.427   21.395  133.302   2.1681  132.825   1.9761 0.4772644 2.933520 
1 1 1   11    3  -78 o  105.568   1.5619  454.729   13.441  458.946   18.857  450.373   19.164  106.001   2.1823  105.000   2.2391 1.000702 3.126632 
1 1 1   11    3  -77 o  135.855   1.5599  753.023   17.274  753.177   23.826  752.852   25.081  135.806   2.1523  135.762   2.2664 0.4380798E-01 3.125499 
1 1 1   11    3  -76 o  117.553   1.5541  563.755   14.892  571.856   20.877  555.364   21.248  118.341   2.1642  116.615   2.2353 1.726196 3.111288 
1 1 1   11    3  -75 o   94.178   1.6002  361.847   12.284  372.246   17.577  351.919   17.175   95.476   2.2585   92.832   2.2697 2.644211 3.201901 
1 1 1   11    3  -74 o   46.219   2.2465   87.430   8.4383   88.099   12.810   86.918   11.216   46.271   3.4204   46.008   3.0071 0.2629700 4.554320 
1 1 1   11    3  -73 f   90.114   1.6245  331.271   11.933  325.811   16.990  336.587   16.764   89.295   2.3362   90.796   2.2650 -1.500542 3.253929 
1 1 1   11    3  -72 o   84.284   1.6361  289.784   11.240  305.230   16.243  275.587   15.572   86.434   2.3074   82.125   2.3284 4.309273 3.278039 
1 1 1   11    3  -71 o   74.853   1.8069  228.585   11.025  253.923   17.310  211.288   14.301   78.799   2.6989   71.895   2.4439 6.904472 3.640919 
1 1 1   11    3  -70 o   75.365   1.7184  231.694   10.557  238.877   15.320  225.199   14.567   76.452   2.4614   74.233   2.4106 2.219124 3.445234 
1 1 1   11    3  -69 o  114.851   1.5521  537.968   14.530  545.201   20.323  530.404   20.783  115.585   2.1570  114.001   2.2365 1.584671 3.107165 
1 1 1   11    3  -68 o  180.088   1.6557  1322.77   24.305  1331.32   33.083  1312.74   35.825  180.616   2.2471  179.328   2.4508 1.287247 3.325007 
1 1 1   11    3  -67 o   87.336   1.7178  311.103   12.230  312.614   18.710  309.976   16.160   87.467   2.6271   87.124   2.2774 0.3422318 3.476784 
1 1 1   11    3  -66 o   79.685   1.7850  258.985   11.594  265.494   17.889  254.269   15.226   80.595   2.7268   78.899   2.3701 1.696304 3.612857 
1 1 1   11    3  -65 o  150.893   1.8527  928.681   22.788  939.193   30.874  916.100   33.775  151.699   2.4967  149.800   2.7660 1.899384 3.726146 
1 1 1   11    3  -64 o  157.316   1.4817  1009.12   19.001  1013.63   24.313  1002.05   30.455  157.645   1.8920  156.708   2.3841 0.9370422 3.043632 
1 1 1   11    3  -63 o  140.653   1.4620  806.640   16.763  783.527   21.201  845.180   27.377  138.604   1.8765  143.928   2.3335 -5.323273 2.994419 
1 1 1   11    3  -62 o  106.780   1.5181  464.918   13.214  486.742   17.186  433.359   20.666  109.243   1.9299  103.057   2.4601 6.186859 3.126751 
1 1 1   11    3  -61 o  118.191   1.4896  569.579   14.352  548.018   18.100  606.092   23.553  115.917   1.9155  121.882   2.3707 -5.965042 3.047856 
1 1 1   11    3  -60 o  198.715   1.7084  1610.25   27.674  1584.77   36.408  1645.12   42.587  197.097   2.2661  200.786   2.6020 -3.688507 3.450459 
1 1 1   11    3  -59 o  219.061   1.9512  1957.14   34.842  2000.01   42.996  1875.14   59.462  221.412   2.3823  214.280   3.4043 7.132141 4.155033 
1 1 1   11    3  -58 o  146.931   1.5335  880.247   18.366  865.458   24.317  899.887   28.023  145.670   2.0479  148.525   2.3146 -2.854965 3.090518 
1 1 1   11    3  -57 o  206.890   1.7142  1745.38   28.909  1764.88   38.695  1720.74   43.491  208.005   2.2822  205.362   2.5980 2.642853 3.458033 
1 1 1   11    3  -56 o   53.484   2.3591  116.916   10.260  106.724   17.916  121.890   12.515   50.912   4.3589   54.580   2.8225 -3.668156 5.192916 
1 1 1   11    3  -55 o  128.484   1.6552  673.106   17.336  646.933   25.284  696.327   23.815  125.930   2.4631  130.659   2.2360 -4.729546 3.326622 
1 1 1   11    3  -54 o   89.329   1.7175  325.371   12.506  318.812   18.672  330.708   16.843   88.362   2.5952   90.014   2.2973 -1.652512 3.465907 
1 1 1   11    3  -53 o   49.698   1.9642  100.877   7.9417   96.444   10.519  106.753   12.110   48.547   2.6685   51.064   2.9216 -2.517078 3.956847 
1 1 1   11    3  -52 o  147.594   1.3848  888.100   16.660  900.199   24.301  877.369   22.886  148.574   2.0065  146.682   1.9140 1.892380 2.773001 
1 1 1   11    3  -51 o  128.927   1.3549  677.640   14.239  717.104   21.207  645.245   19.214  132.610   1.9619  125.793   1.8738 6.816727 2.712928 
1 1 1   11    3  -50 o  146.859   1.5694  879.325   18.788  883.882   32.835  877.106   22.908  147.190   2.7367  146.662   1.9162 0.5282898 3.340856 
1 1 1   11    3  -49 o   92.042   1.6218  345.402   12.168  346.017   19.921  345.036   15.369   92.059   2.6574   91.984   2.0497 0.7537079E-01 3.356053 
1 1 1   11    3  -48 o  276.004   2.1611  3106.67   48.622  3079.65   83.881  3120.34   59.669  274.639   3.7468  276.570   2.6467 -1.931427 4.587365 
1 1 1   11    3  -47 o  236.530   2.1242  2281.50   40.957  2334.36   66.443  2249.11   52.014  239.149   3.4084  234.803   2.7176 4.345566 4.359149 
1 1 1   11    3  -46 o   54.059   1.8524  119.297   8.1506  106.080   12.388  129.386   10.823   50.901   2.9990   56.274   2.3647 -5.373180 3.819086 
1 1 1   11    3  -45 o  138.120   1.5678  777.765   17.651  768.524   25.736  785.972   24.255  137.275   2.3000  138.830   2.1433 -1.555176 3.143824 
1 1 1   11    3  -44 o  282.059   2.1998  3244.33   50.577  3295.64   73.251  3197.59   69.918  284.197   3.1620  279.947   3.0639 4.249939 4.402922 
1 1 1   11    3  -43 o   27.830   2.9897   31.962   6.6761   24.569   11.232   36.001   8.3017   24.030   5.8007   29.491   3.5229 -5.461857 6.786730 
1 1 1   11    3  -42 o  371.804   2.5203  5638.15   76.384  5634.66  117.209  5640.72  100.705  371.514   3.8704  371.793   3.3229 -0.2796021 5.101103 
1 1 1   11    3  -41 o  205.396   1.8383  1720.08   30.778  1712.29   43.684  1727.76   43.372  204.893   2.6155  205.818   2.5852 -0.9255066 3.677501 
1 1 1   11    3  -40 o  214.878   1.8787  1882.56   32.906  1889.72   46.952  1875.65   46.131  215.245   2.6760  214.445   2.6390 0.8008118 3.758376 
1 1 1   11    3  -39 o  177.035   1.7075  1277.77   24.641  1221.57   34.132  1338.93   35.609  173.072   2.4194  181.195   2.4109 -8.123535 3.415498 
1 1 1   11    3  -38 o  230.750   1.8103  2170.84   34.051  2178.20   45.321  2161.31   51.596  231.112   2.4057  230.194   2.7497 0.9180908 3.653544 
1 1 1   11    3  -37 o  178.646   1.4817  1301.02   21.578  1303.79   31.090  1298.44   29.971  178.816   2.1329  178.452   2.0604 0.3641357 2.965575 
1 1 1   11    3  -36 o  270.311   1.9827  2979.14   43.688  2998.60   67.750  2965.29   57.159  271.125   3.0655  269.647   2.6005 1.477783 4.019930 
1 1 1   11    3  -35 o  172.985   1.7039  1219.93   24.027  1203.12   34.333  1236.06   33.636  171.766   2.4521  174.104   2.3701 -2.338318 3.410278 
1 1 1   11    3  -34 o  215.952   1.8760  1901.29   33.024  1920.31   47.497  1883.49   45.948  216.995   2.6852  214.908   2.6229 2.087051 3.753661 
1 1 1   11    3  -33 o  218.837   1.8940  1952.43   33.786  1996.77   49.027  1912.33   46.624  221.274   2.7181  216.548   2.6413 4.725601 3.790100 
1 1 1   11    3  -32 o  247.814   2.0347  2503.79   41.103  2587.68   60.012  2429.67   56.411  251.888   2.9228  244.081   2.8352 7.806885 4.072015 
1 1 1   11    3  -31 o   88.165   1.6343  316.874   11.745  317.797   17.509  316.118   15.838   88.249   2.4363   88.025   2.2090 0.2240524 3.288646 
1 1 1   11    3  -30 o  149.993   1.6321  917.128   19.955  916.863   28.842  917.371   27.638  149.956   2.3595  150.000   2.2603 -0.4402161E-01 3.267504 
1 1 1   11    3  -29 o  208.236   1.7032  1767.68   28.911  1847.33   46.125  1716.13   37.105  212.845   2.6585  205.163   2.2187 7.682495 3.462678 
1 1 1   11    3  -28 o  297.782   2.1288  3615.21   51.674  3767.49   81.936  3514.63   66.585  303.926   3.3073  293.580   2.7824 10.34564 4.321996 
1 1 1   11    3  -27 o  101.231   1.5972  417.738   13.180  391.604   19.842  438.377   17.632   97.971   2.4865  103.696   2.0860 -5.725090 3.245661 
1 1 1   11    3  -26 o  133.502   1.5436  726.516   16.798  719.479   24.203  733.056   23.333  132.844   2.2351  134.093   2.1346 -1.249344 3.090678 
1 1 1   11    3  -25 o  195.840   1.7623  1563.46   28.133  1605.80   40.796  1525.08   38.847  198.455   2.5219  193.405   2.4641 5.050537 3.525815 
1 1 1   11    3  -24 o  350.023   2.5808  4995.30   73.635  5034.14  105.112  4957.87  103.186  351.315   3.6705  348.646   3.6308 2.668579 5.162832 
1 1 1   11    3  -23 o  213.344   1.8400  1855.45   31.998  1857.10   45.755  1853.86   44.766  213.419   2.6301  213.235   2.5755 0.1845856 3.681071 
1 1 1   11    3  -22 o  343.362   2.3614  4806.57   66.095  4744.21   86.982  4891.78  101.672  341.090   3.1284  346.325   3.6015 -5.235596 4.770502 
1 1 1   11    3  -21 o  419.989   2.7864  7192.04   95.393  7233.48  127.104  7138.59  144.349  421.135   3.7026  418.319   4.2332 2.815674 5.623969 
1 1 1   11    3  -20 o   40.753   2.1667   67.898   7.1719   66.426   11.208   68.919   9.3327   40.211   3.4528   41.017   2.8082 -0.8059273 4.450573 
1 1 1   11    3  -19 o   73.883   1.6248  222.510   9.7857  205.487   16.204  232.283   12.277   70.936   2.8078   75.459   1.9977 -4.523087 3.445972 
1 1 1   11    3  -18 o  256.714   1.9206  2686.45   40.191  2694.63   62.369  2680.64   52.559  257.074   2.9763  256.421   2.5145 0.6532288 3.896309 
1 1 1   11    3  -17 o  152.557   1.5174  948.665   18.870  976.097   30.162  931.021   24.189  154.735   2.3913  151.126   1.9636 3.608795 3.094162 
1 1 1   11    3  -16 o  309.695   2.0454  3909.80   51.637  3828.48   72.389  3994.05   73.679  306.430   2.8981  312.986   2.8879 -6.556244 4.091297 
1 1 1   11    3  -15 o   38.637   2.2773   61.068   7.1404   64.686   11.037   58.464   9.3643   39.679   3.4464   37.742   3.0703 1.937313 4.615680 
1 1 1   11    3  -14 o  108.448   1.3832  479.382   12.228  469.219   17.874  488.323   16.765  107.287   2.0438  109.451   1.8791 -2.163712 2.776323 
1 1 1   11    3  -13 o  294.818   1.9735  3543.09   47.428  3589.32   68.098  3499.55   66.094  296.711   2.8155  292.979   2.7675 3.732513 3.947951 
1 1 1   11    3  -12 o  309.365   2.0447  3901.39   51.563  3871.88   72.926  3930.89   72.916  308.167   2.9031  310.507   2.8808 -2.339966 4.089876 
1 1 1   11    3  -11 o  183.056   1.5087  1365.88   22.512  1326.65   31.917  1404.71   31.757  180.399   2.1704  185.632   2.0987 -5.232819 3.019168 
1 1 1   11    3  -10 o  321.968   2.1078  4225.75   55.319  4207.25   78.398  4244.10   78.068  321.234   2.9940  322.639   2.9684 -1.404572 4.216053 
1 1 1   11    3   -9 o  281.397   1.9115  3227.78   43.846  3255.28   62.813  3201.64   61.232  282.573   2.7270  280.237   2.6805 2.336395 3.823828 
1 1 1   11    3   -8 o  104.661   1.4042  446.488   11.980  445.866   17.832  447.000   16.174  104.584   2.0917  104.718   1.8947 -0.1344452 2.822299 
1 1 1   11    3   -7 o  197.300   1.5625  1586.72   25.130  1514.75   35.308  1660.60   35.774  192.764   2.2471  201.833   2.1744 -9.068375 3.126888 
1 1 1   11    3   -6 o  164.947   1.5508  1109.01   20.851  1107.04   32.556  1110.38   27.150  164.790   2.4236  165.044   2.0181 -0.2542114 3.153820 
1 1 1   11    3   -5 o  107.828   1.5301  473.919   13.449  464.651   22.074  479.391   16.960  106.760   2.5365  108.446   1.9186 -1.685501 3.180384 
1 1 1   11    3   -4 o  565.662   3.6380 13047.43  167.747 13209.42  259.753 12931.54  219.704  568.978   5.6005  563.047   4.7869 5.931641 7.367544 
1 1 1   11    3   -3 o  602.724   3.8577 14814.04  189.535 14708.58  288.366 14894.25  251.488  600.364   5.8924  604.234   5.1059 -3.870056 7.796870 
1 1 1   11    3   -2 o  265.321   2.1328  2869.58   46.127  2917.66   66.923  2826.06   63.667  267.511   3.0690  263.281   2.9666 4.229797 4.268417 
1 1 1   11    3   -1 o   84.025   1.7709  287.788   12.129  312.405   19.048  270.998   15.731   87.498   2.6738   81.499   2.3704 5.998909 3.573218 
1 1 1   11    3    0 o  232.421   2.4177  2202.14   45.806  2356.41   69.336  2082.67   61.017  240.396   3.5383  226.008   3.3120 14.38785 4.846550 
1 1 1   11    3    1 o  147.131   1.6595  882.377   19.903  898.461   25.150  855.424   32.557  148.461   2.0782  144.854   2.7573 3.607697 3.452795 
1 1 1   11    3    2 o  466.372   3.6223  8868.94  137.707  8898.58  154.573  8754.96  303.164  467.122   4.0594  462.944   8.0336 4.177948 9.001031 
1 1 1   11    3    3 o  643.630   4.8532 16898.24  254.624 16900.80  284.791 16888.01  568.458  643.611   5.4283  642.360   10.856 1.250427 12.13783 
1 1 1   11    3    4 o  284.082   2.4532  3289.93   56.808  3262.91   63.273  3402.26  129.008  282.905   2.7437  288.767   5.4807 -5.862122 6.129081 
1 1 1   11    3    5 o  129.861   1.6583  687.392   17.554  664.692   21.720  730.150   29.809  127.695   2.0867  133.827   2.7325 -6.132576 3.438157 
1 1 1   11    3    6 o  134.060   1.5209  732.560   16.620  740.046   22.777  724.036   24.305  134.739   2.0738  133.272   2.2373 1.467117 3.050636 
1 1 1   11    3    7 o  302.068   2.3201  3719.64   57.127  3699.08   80.805  3740.18   80.773  301.202   3.2911  302.871   3.2717 -1.669556 4.640640 
1 1 1   11    3    8 o  369.065   2.7065  5553.03   81.424  5563.72  115.604  5542.51  114.702  369.369   3.8395  368.666   3.8168 0.7035828 5.413878 
1 1 1   11    3    9 o  219.920   2.0738  1971.54   37.176  1950.75   59.038  1985.20   47.854  218.730   3.3112  220.669   2.6604 -1.939163 4.247561 
1 1 1   11    3   10 o  250.118   2.2345  2550.24   45.557  2575.14   73.129  2534.44   58.239  251.300   3.5699  249.327   2.8655 1.972153 4.577760 
1 1 1   11    3   11 o  171.765   1.7049  1202.61   23.871  1186.06   34.037  1218.63   33.486  170.568   2.4480  172.896   2.3760 -2.327942 3.411474 
1 1 1   11    3   12 o  306.982   2.3482  3841.73   58.760  3869.39   83.841  3815.04   82.378  308.051   3.3389  305.881   3.3039 2.169708 4.697182 
1 1 1   11    3   13 o  131.138   1.6140  700.981   17.253  691.562   24.793  709.823   24.023  130.246   2.3352  131.956   2.2334 -1.709641 3.231294 
1 1 1   11    3   14 o  227.758   1.9358  2114.56   35.940  2094.65   51.002  2134.20   50.652  226.665   2.7604  228.796   2.7159 -2.131256 3.872444 
1 1 1   11    3   15 o  385.209   3.0670  6050.23   96.306  6028.33  151.990  6064.92  124.485  384.396   4.8506  385.625   3.9602 -1.228821 6.261936 
1 1 1   11    3   16 o  396.720   3.1453  6417.42  101.715  6457.06  161.707  6391.47  130.839  397.814   4.9867  395.861   4.0547 1.953217 6.427113 
1 1 1   11    3   17 o  655.164   4.9295 17513.66  263.261 17456.19  415.243 17552.29  340.422  653.558   7.7944  655.649   6.3696 -2.090820 10.06598 
1 1 1   11    3   18 o  128.918   1.7550  677.475   18.443  629.520   28.972  710.148   23.914  124.257   2.8604  131.984   2.2228 -7.727432 3.622530 
1 1 1   11    3   19 o  275.708   2.3765  3099.00   53.411  3149.77   85.614  3066.65   68.341  277.901   3.7794  274.241   3.0571 3.659180 4.861029 
1 1 1   11    3   20 o  121.478   1.7339  601.543   17.170  623.166   27.765  588.154   21.848  123.629   2.7551  120.113   2.2314 3.515564 3.545445 
1 1 1   11    3   21 o  353.425   2.8600  5093.07   82.395  5233.56  133.241  5006.08  104.845  358.153   4.5639  350.347   3.6712 7.805664 5.857203 
1 1 1   11    3   22 o  414.390   3.6463  7003.66  123.168  6919.58  172.838  7090.41  175.566  411.754   5.1495  416.803   5.1674 -5.049530 7.295181 
1 1 1   11    3   23 o  162.720   2.8298  1079.63   37.535   0.0000   0.0000  1079.63   37.535  ?   ?   162.720   2.8298 0.000000 2.829795 
1 1 1   11    3   24 o  109.411   2.1981  488.029   19.604  451.207   33.653  506.943   24.119  105.098   3.9352  111.504   2.6536 -6.406303 4.746301 
1 1 1   11    3   25 o  301.552   3.2590  3708.49   80.109  3670.29  137.643  3728.06   98.512  299.811   5.6321  302.299   3.9977 -2.488312 6.906716 
1 1 1   11    3   26 o  412.169   4.1840  6931.31  140.574  6971.09  244.624  6911.70  171.768  412.911   7.2679  411.477   5.1211 1.433411 8.890849 
1 1 1   11    3   27 o   78.589   2.0572  251.967   13.167  272.660   27.001  245.512   15.082   81.648   4.0698   77.562   2.3883 4.085693 4.718825 
1 1 1   11    3   28 o  244.957   2.2061  2446.39   44.050  2395.79   69.051  2481.11   57.201  242.352   3.4953  246.664   2.8449 -4.311356 4.506704 
1 1 1   11    3   29 o  158.733   1.8065  1027.15   23.374  1010.44   37.073  1038.18   30.115  157.408   2.8893  159.571   2.3152 -2.163040 3.702432 
1 1 1   11    3   30 o   12.373   5.0328   2.3435   7.9623 -15.7436   13.595   11.787   9.8234   11.607   5.4814   17.524   5.8556 -5.916932 8.020839 
1 1 1   11    3   31 o  210.264   2.0252  1802.48   34.712  1804.82   55.440  1800.97   44.518  210.350   3.2333  210.155   2.5987 0.1951294 4.148201 
1 1 1   11    3   32 o  171.383   1.8542  1197.46   25.904  1221.22   41.904  1182.76   32.955  173.039   2.9708  170.314   2.3738 2.725479 3.802712 
1 1 1   11    3   33 o   59.792   2.1197  145.948   10.315  136.892   16.730  151.503   13.102   57.815   3.5673   60.894   2.6458 -3.079224 4.441400 
1 1 1   11    3   34 o  178.542   1.8864  1299.63   27.454  1242.11   42.935  1339.42   35.709  174.505   3.0183  181.237   2.4171 -6.731567 3.866858 
1 1 1   11    3   35 o  110.936   1.7218  501.720   15.570  510.123   25.431  496.681   19.693  111.837   2.7896  110.368   2.1889 1.468742 3.545848 
1 1 1   11    3   36 o   65.084   2.0021  172.874   10.609  171.568   17.590  173.620   13.300   64.761   3.3433   65.201   2.5072 -0.4391251 4.178965 
1 1 1   11    3   37 o   56.769   2.1539  131.598   9.9491  133.659   16.691  130.463   12.391   57.117   3.6032   56.493   2.6986 0.6243172 4.501710 
1 1 1   11    3   38 o  236.924   2.1678  2288.89   41.867  2334.86   67.632  2260.33   53.310  239.205   3.4685  235.406   2.7781 3.799210 4.443964 
1 1 1   11    3   39 o  252.540   2.2556  2600.70   46.432  2630.20   74.600  2582.05   59.324  253.866   3.6049  251.591   2.8927 2.275375 4.622038 
1 1 1   11    3   40 o  121.359   1.7381  600.469   17.194  584.439   27.749  610.459   21.907  119.697   2.8439  122.353   2.1965 -2.656387 3.593407 
1 1 1   11    3   41 o  177.656   1.8883  1286.87   27.346  1312.23   44.400  1271.36   34.711  179.344   3.0371  176.562   2.4117 2.782562 3.878235 
1 1 1   11    3   42 o   70.480   1.9509  202.699   11.197  197.515   18.767  205.564   13.953   69.493   3.3226   70.955   2.4159 -1.461807 4.108097 
1 1 1   11    3   43 o  126.172   1.7450  649.054   17.947  630.564   28.826  660.758   22.934  124.327   2.8444  127.292   2.2102 -2.964523 3.602172 
1 1 1   11    3   44 o  239.080   2.4354  2331.24   47.462  2310.34   67.465  2351.72   66.784  237.922   3.4786  240.049   3.4130 -2.127686 4.873335 
1 1 1   11    3   45 o   47.403   3.0256   92.054   11.630   72.210   23.553   98.451   13.374   41.371   7.2483   49.000   3.3688 -7.629318 7.992901 
1 1 1   11    3   46 o  135.440   2.2576  748.116   24.925  696.366   44.469  771.820   30.097  130.507   4.1855  137.552   2.6842 -7.044312 4.972283 
1 1 1   11    3   47 o  125.185   2.2393  639.119   22.851  678.601   43.411  623.986   26.876  128.831   4.1391  123.678   2.6659 5.152893 4.923331 
1 1 1   11    3   48 o   70.120   2.1370  200.697   12.200  212.374   27.985  197.957   13.556   71.922   4.8010   69.626   2.3921 2.295792 5.363908 
1 1 1   11    3   49 o   45.274   2.4534   83.852   9.0205   81.421   15.633   85.066   11.045   44.428   4.3734   45.561   2.9904 -1.133320 5.298021 
1 1 1   11    3   50 o  194.447   1.9579  1541.81   31.034  1580.67   50.397  1518.07   39.388  196.804   3.1415  192.913   2.5047 3.890823 4.017799 
1 1 1   11    3   51 o  236.036   2.4583  2272.58   47.299  2278.62   67.011  2266.59   66.771  236.253   3.4796  235.628   3.4764 0.6241760 4.918612 
1 1 1   11    3   52 o  217.877   2.3613  1936.28   41.937  1986.63   60.047  1888.33   58.595  220.606   3.3392  215.079   3.3422 5.527344 4.724414 
1 1 1   11    3   53 o  325.756   3.0435  4330.76   80.816  4351.02  114.597  4310.71  113.987  326.301   4.3084  324.786   4.3055 1.514404 6.090956 
1 1 1   11    3   54 o  224.458   2.4026  2055.15   43.960  2056.49   62.114  2053.81   62.223  224.436   3.3952  224.290   3.4034 0.1468658 4.807278 
1 1 1   11    3   55 o   74.635   1.9203  227.310   11.673  247.157   19.897  216.894   14.414   77.751   3.1458   72.876   2.4298 4.874748 3.974962 
1 1 1   11    3   56 o  164.818   1.7275  1107.69   23.209  1122.42   34.118  1095.00   31.665  165.867   2.5234  163.838   2.3710 2.029022 3.462530 
1 1 1   11    3   57 o  162.053   1.7275  1070.85   22.820  1073.28   33.470  1068.74   31.194  162.193   2.5316  161.860   2.3643 0.3324738 3.463923 
1 1 1   11    3   58 o  112.773   1.6892  518.587   15.528  530.213   23.624  509.742   20.605  113.996   2.5423  111.786   2.2612 2.209862 3.402425 
1 1 1   11    3   59 o  123.643   1.7219  623.396   17.355  661.451   26.843  596.065   22.749  127.320   2.5864  120.877   2.3087 6.442627 3.466940 
1 1 1   11    3   60 o   67.202   2.0687  184.381   11.319  169.028   18.467  193.619   14.325   64.230   3.5409   68.836   2.5574 -4.606766 4.367816 
1 1 1   11    3   61 o  155.929   2.0517  991.747   26.079  1009.29   34.606  968.689   39.673  157.257   2.6996  154.023   3.1599 3.234268 4.156068 
1 1 1   11    3   62 o   92.029   2.1321  345.479   15.994  331.089   31.296  350.566   18.608   89.875   4.2842   92.658   2.4659 -2.782837 4.943151 
1 1 1   11    3   63 o  139.263   1.9463  791.034   22.094  720.444   37.995  827.100   27.158  132.749   3.5143  142.380   2.3400 -9.630508 4.222107 
1 1 1   11    3   64 o  114.761   1.8919  537.169   17.698  513.050   30.317  549.638   21.798  112.022   3.3238  116.065   2.3040 -4.043610 4.044271 
1 1 1   11    3   65 o  184.408   1.9933  1387.19   29.964  1357.52   48.808  1405.14   37.959  182.292   3.2846  185.551   2.5097 -3.259598 4.133672 
1 1 1   11    3   66 o   92.033   1.8410  345.487   13.811  303.145   18.794  395.200   20.364   86.130   2.6801   98.365   2.5418 -12.23457 3.693749 
1 1 1   11    3   67 o  134.697   1.6539  739.969   18.159  753.506   23.529  720.029   28.557  135.895   2.1241  132.802   2.6380 3.092560 3.386860 
1 1 1   11    3   68 o   70.574   2.0280  203.384   11.655  205.639   14.664  199.517   19.204   70.927   2.5404   69.781   3.3862 1.145622 4.233220 
1 1 1   11    3   69 o  101.627   1.9174  421.360   15.884  445.209   20.205  382.771   25.701  104.436   2.3734   96.716   3.2647 7.719818 4.036240 
1 1 1   11    3   70 o  142.733   1.6129  830.950   18.766  825.185   34.657  833.341   22.322  142.109   2.9918  142.917   1.9161 -0.8073273 3.552780 
1 1 1   11    3   71 o   24.039   3.3549   24.084   6.3952   33.220   12.125   20.562   7.5274   27.945   5.5185   22.020   4.3480 5.925482 7.025642 
1 1 1   11    3   72 o  125.100   1.4684  638.296   14.974  608.184   23.876  657.818   19.225  122.043   2.4000  126.972   1.8574 -4.929344 3.034800 
1 1 1   11    3   73 f  152.738   1.5089  951.563   18.786  1002.95   30.610  920.516   23.794  156.715   2.3962  150.187   1.9436 6.527771 3.085288 
1 1 1   11    3   74 o   79.957   1.8049  260.875   11.764  259.414   19.373  261.729   14.806   79.596   2.9912   80.029   2.2719 -0.4324036 3.756191 
1 1 1   11    3   75 o   52.410   1.9175  112.256   8.1782  113.069   12.568  111.659   10.770   52.503   2.9485   52.217   2.5380 0.2863464 3.890353 
1 1 1   11    3   76 o   84.152   1.5366  288.899   10.541  312.426   15.795  270.006   14.154   87.439   2.2178   81.290   2.1378 6.148888 3.080407 
1 1 1   11    3   77 o   34.230   2.1635   48.039   6.0058   42.897   11.212   50.108   7.1122   32.016   4.4133   34.927   2.5150 -2.910233 5.079617 
1 1 1   11    3   78 o  187.693   1.4712  1437.24   22.509  1417.77   34.346  1451.90   29.800  186.293   2.2617  188.579   1.9386 -2.286530 2.978859 
1 1 1   11    3   79 f   79.316   1.4043  256.649   9.0796  243.604   15.124  263.999   11.353   77.165   2.4074   80.423   1.7318 -3.258583 2.965590 
1 1 1   11    3   80 o   30.159   2.3690   37.408   5.7772   43.700   11.960   35.493   6.5981   32.236   4.6887   29.319   2.7946 2.916758 5.458341 
1 1 1   11    3   81 o   81.129   1.4700  268.592   9.7215  274.555   16.083  265.158   12.203   81.905   2.4115   80.580   1.8579 1.325623 3.044153 
1 1 1   11    3   82 o   67.521   1.5494  186.088   8.5278  171.279   14.667  193.651   10.481   64.612   2.7914   68.830   1.8699 -4.218681 3.359835 
1 1 1   11    3   83 o   68.405   1.4244  190.974   7.9427  183.531   14.323  194.279   9.5449   66.899   2.6316   68.975   1.6976 -2.076103 3.131619 
1 1 1   11    3   84 o   66.895   1.7025  182.886   9.2762  170.781   16.176  188.817   11.323   64.438   3.0886   67.931   2.0472 -3.492683 3.705421 
1 1 1   11    3   85 o   64.342   1.6854  169.217   8.8319  156.477   15.426  175.430   10.772   61.659   3.0789   65.472   2.0208 -3.812439 3.682838 
1 1 1   11    3   86 o   37.802   3.0259   59.062   9.2463   59.276   12.837   58.832   13.330   37.618   4.2612   37.428   4.4565 0.1897125 6.165885 
1 1 1   11    3   87 o   47.721   2.2625   93.467   8.7760   93.210   11.338   93.851   13.861   47.542   2.9400   47.568   3.6016 -0.2603149E-01 4.649209 
1 1 1   11    3   88 o   26.671   3.6391   29.901   7.7056   27.700   10.110   32.953   11.903   25.318   5.0756   27.564   5.4906 -2.246750 7.477184 
1 1 1   11    3   89 o   55.909   2.0185  128.145   9.1843  130.753   11.963  124.400   14.332   56.367   2.6108   54.840   3.2204 1.527508 4.145716 
1 1 1   11    3   90 f   56.720   2.1113  132.014   9.7445  123.965   13.127  141.895   14.544   54.784   2.9503   58.595   3.0555 -3.811134 4.247430 
1 1 1   11    3   91 o   20.365   4.5610   18.016   7.3828   16.666   9.6542   19.919   11.458   19.582   5.7028   21.320   6.2137 -1.737795 8.434031 
1 1 1   11    3   92 o   37.573   2.6144   58.374   7.9572   50.751   10.319   69.556   12.497   34.763   3.6982   40.722   3.8090 -5.958981 5.309025 
1 1 1   11    3   93 o   29.841   3.1290   37.231   7.4983   33.913   9.7223   42.102   11.780   28.124   4.3838   31.272   4.7720 -3.147924 6.479901 
1 1 1   11    3   94 o   43.681   2.2691   78.646   8.0519   81.299   10.487   74.835   12.568   44.252   2.9236   42.219   3.6889 2.033413 4.706901 
1 1 1   11    3   95 o   22.398   4.0366   21.633   7.0989   9.7611   9.1017   40.073   11.343   15.874   5.6229   30.435   4.7253 -14.56132 7.344726 
1 1 1   11    3   96 f   35.961   2.7121   53.740   7.8916   56.937   9.6893   47.441   13.601   36.868   3.2576   32.917   5.2448 3.950684 6.174078 
1 1 1   11    3   97 o   60.052   1.9750  148.318   9.6548  134.649   12.954  165.398   14.481   56.954   2.7989   63.127   2.8213 -6.173477 3.974065 
1 1 1   11    3   98 o   34.315   2.8616   49.174   7.9318   52.087   10.767   45.717   11.729   34.999   3.8367   32.490   4.5537 2.509384 5.954515 
1 1 1   11    3   99 o   38.332   2.6161   61.107   8.1254   60.711   10.912   61.600   12.173   37.883   3.5761   37.995   3.9898 -0.1120987 5.357893 
1 1 1   11    3  100 o   49.622   2.0821  101.598   8.4031   95.815   10.842  110.295   13.297   47.956   2.7856   51.290   3.1963 -3.334625 4.239862 
1 1 1   11    3  101 o   71.669   1.8107  211.231   10.570  213.388   12.948  206.921   18.300   71.877   2.2126   70.272   3.2032 1.605629 3.893086 
1 1 1   11    3  102 o   12.222   4.8285   4.0995   7.1093   3.3799   8.7393   5.5074   12.224   12.805   5.2483   15.171   6.2112 -2.365514 8.131642 
1 1 1   11    3  103 o   23.884   4.2491   25.056   7.9692   21.771   10.023   30.701   13.139   21.757   5.6142   25.565   6.3370 -3.807434 8.466179 
1 1 1   11    3  104 o   45.483   2.2210   85.758   8.2097   85.812   10.538   85.674   13.095   45.244   2.8722   44.850   3.6123 0.3940163 4.615004 
1 1 1   11    3  105 o   21.873   4.2164   21.208   7.2452   19.659   9.2941   23.607   11.568   20.616   5.4490   22.334   6.1562 -1.718473 8.221371 
1 1 1   11    3  106 o   15.687   4.9625   10.930   7.1076   8.8549   9.1624   14.064   11.263   15.080   5.5978   17.834   6.2603 -2.753746 8.398038 
1 1 1   11    3  107 o   17.214   5.0056   13.577   7.4429   20.245   9.7766   4.3849   11.479   20.710   5.6401   14.211   5.9367 6.499492 8.188659 
1 1 1   11    3  108 o   21.139   4.5136   20.330   7.5409   15.566   9.6198   27.924   12.145   18.214   5.7747   23.943   6.1808 -5.729664 8.458692 
1 1 1   11    3  109 f   42.292   2.5011   75.127   8.5836   90.205   11.156   53.246   13.439   46.070   2.9867   34.104   4.9811 11.96632 5.807868 
1 1 1   11    3  110 f   32.515   3.1316   45.406   8.1976   46.176   10.729   44.326   12.706   32.169   4.1913   30.788   5.2511 1.380932 6.718653 
1 1 1   11    3  111 o   43.220   2.7479   79.265   9.6310   75.006   11.518   89.165   17.561   41.587   3.4281   43.961   4.9886 -2.373718 6.052866 
1 1 1   11    3  112 o   12.388   5.1568   3.6643   8.6162   7.5249   10.300  -5.3358   15.726   14.448   5.7779   13.280   6.1464 1.168368 8.435746 
1 1 1   11    3  113 o   23.860   4.7543   26.826   8.9220   18.860   10.640   45.692   16.374   19.259   6.0691   29.246   6.9681 -9.987173 9.240582 
1 1 1   11    3  114 o   12.076   5.1175   2.9164   8.7249  -8.5072   12.015   15.660   12.690   10.948   5.1650   17.746   6.5878 -6.797632 8.371198 
1 1 1   11    3  115 o   30.605   4.1314   42.660   10.044   33.359   14.527   51.177   13.902   24.654   6.9377   32.382   5.4606 -7.728245 8.828955 
1 1 1   11    3  116 o   21.754   5.8995   24.358   10.723   44.495   17.923   13.131   13.383   27.663   7.6778   16.789   6.6272 10.87403 10.14240 
1 1 1   11    3  117 o   23.954   5.6790   29.101   10.919   11.186   17.994   39.543   13.738   16.864   7.2529   27.472   6.2730 -10.60769 9.589301 
1 1 1   11    3  118 o   32.268   4.2670   48.118   10.949   47.691   14.582   48.670   16.576   30.363   6.1036   29.677   6.9716 0.6867676 9.265918 
1 1 1   11    3  119 o   20.005   6.1420   21.341   10.975   13.209   14.326   32.896   17.077   16.725   6.7700   23.192   7.7198 -6.467106 10.26782 
1 1 1   11    3  120 o   33.153   4.3409   51.195   11.450   37.561   14.466   74.062   18.734   25.998   6.7628   37.526   6.3507 -11.52782 9.277204 
1 1 1   11    3  121 o   31.876   4.6613   48.375   11.754   38.514   15.184   63.115   18.565   25.950   7.0129   33.670   6.9929 -7.720036 9.903624 
1 1 1   11    3  122 o   27.479   5.7807   38.994   12.538   48.728   17.542   28.827   17.926   28.738   7.4329   21.284   7.8427 7.453775 10.80538 
1 1 1   11    3  123 o   23.160   6.8937   31.096   13.978   53.856   24.441   20.032   17.041   26.782   9.2328   18.582   7.4316 8.199415 11.85210 
1 1 1   11    3  124 o   16.106   6.6006   12.350   13.822   25.438   23.906   5.7779   16.940   19.624   8.3983   15.042   6.7298 4.581241 10.76207 
1 1 1   11    3  125 o   13.165   5.9469   1.0845   13.589  -2.2480   23.335   2.7948   16.717   15.129   7.1555   14.411   6.5441 0.7171831 9.696748 
1 1 1   11    3  126 o   16.505   7.7027   5.3130   25.504   0.0000   0.0000   5.3130   25.504  ?   ?    16.505   7.7027 0.000000 7.702693 
1 1 1   11    4 -124 o   10.592   4.9156  -4.2531   10.162 -15.9985   12.431   19.405   17.643   9.7862   4.7747   18.338   7.4796 -8.552268 8.873670 
1 1 1   11    4 -123 o   12.548   5.4426   3.3049   10.304  -2.4583   12.590   14.995   17.930   12.044   5.5475   17.188   7.3120 -5.143529 9.178284 
1 1 1   11    4 -122 o   17.884   5.9988   17.218   10.309   20.640   12.864   11.077   17.233   18.989   6.6885   16.202   7.0330 2.787580 9.705634 
1 1 1   11    4 -121 o   16.889   6.1059   14.959   10.790   14.623   13.948   15.460   17.028   16.862   6.7302   17.317   7.2323 -0.4556808 9.879333 
1 1 1   11    4 -120 o   22.165   5.6318   25.487   10.194   28.995   12.591   18.811   17.369   22.861   6.4679   18.315   7.4394 4.546373 9.857958 
1 1 1   11    4 -119 o   11.743   5.1781   1.1210   9.6697   5.0963   11.954  -6.4053   16.448   13.725   5.9073   12.880   6.0661 0.8454542 8.467223 
1 1 1   11    4 -118 o   14.547   5.7053   9.1324   9.8623   5.2898   10.845   27.490   23.705   13.475   5.7078   20.511   8.5471 -7.036166 10.27778 
1 1 1   11    4 -117 o   11.932   5.1602   2.2626   9.2074   14.554   11.026 -26.0577   16.737   16.922   6.1644   10.672   5.2723 6.250434 8.111497 
1 1 1   11    4 -116 o   11.948   5.3872  -0.8496   11.092   6.9956   12.415 -31.8730   24.689   14.522   6.1270   12.860   6.3627 1.661877 8.833100 
1 1 1   11    4 -115 f   12.342   5.4933   0.5003   11.136   1.7974   12.574  -4.2202   23.987   13.236   5.8673   15.488   7.3039 -2.251562 9.368698 
1 1 1   11    4 -114 o   16.451   6.1954   12.923   11.306   15.804   12.698   1.9074   24.830   17.660   6.5833   16.579   7.6907 1.080854 10.12358 
1 1 1   11    4 -113 o   23.563   5.8536   28.275   11.193   37.434   12.648  -4.7901   24.033   27.220   5.8731   15.595   7.3411 11.62460 9.401359 
1 1 1   11    4 -112 o   8.9063   4.3145 -12.8358   9.6726 -12.3750   11.903 -13.7315   16.596   10.243   4.9177   12.182   5.8375 -1.938894 7.632872 
1 1 1   11    4 -111 o   20.038   5.8228   20.262   10.075   13.894   12.276   33.396   17.630   17.114   6.4535   23.957   7.8383 -6.843430 10.15313 
1 1 1   11    4 -110 f   17.039   5.7168   13.956   9.3622   7.9430   10.240   44.593   23.113   14.577   5.7835   26.653   8.9826 -12.07569 10.68343 
1 1 1   11    4 -109 o   32.548   3.8578   46.874   10.036   43.657   11.207   59.907   22.559   30.916   4.5857   32.376   8.4569 -1.459991 9.620131 
1 1 1   11    4 -108 o   21.688   5.7446   22.918   10.316   9.4033   11.645   72.187   22.234   15.691   6.1856   37.026   7.6211 -21.33464 9.815446 
1 1 1   11    4 -107 o   60.596   2.2637  153.239   11.162  140.469   13.395  182.247   20.189   57.611   2.8613   64.698   3.8455 -7.086826 4.793226 
1 1 1   11    4 -106 o   39.575   3.0097   66.544   9.6361   62.622   11.796   74.413   16.707   37.885   3.8741   40.323   5.2041 -2.437450 6.487777 
1 1 1   11    4 -105 f   13.220   5.4329   4.1887   9.3972   3.4790   10.233   8.0067   23.736   13.362   5.5954   18.823   8.2113 -5.460769 9.936445 
1 1 1   11    4 -104 o   24.373   3.8360   25.979   7.3696   21.637   10.301   30.530   10.547   21.424   5.7705   25.804   5.1943 -4.380966 7.763994 
1 1 1   11    4 -103 o   26.590   2.8336   29.882   6.0471   28.893   10.433   30.382   7.4207   25.122   5.2636   26.568   3.5125 -1.445469 6.327960 
1 1 1   11    4 -102 o   26.768   2.8316   30.223   6.0848   23.801   10.800   33.210   7.3650   22.606   5.8247   27.910   3.3011 -5.304457 6.695065 
1 1 1   11    4 -101 o   48.136   1.8204   95.471   7.1301   89.584   11.852   98.810   8.9261   46.119   3.1719   48.833   2.2484 -2.714706 3.887955 
1 1 1   11    4 -100 o   20.912   3.6600   18.950   6.0118   1.5580   11.592   25.349   7.0314   13.665   5.8481   24.257   3.6707 -10.59212 6.904644 
1 1 1   11    4  -99 o   27.828   2.7374   32.465   6.1291   33.146   10.821   32.144   7.4371   27.269   5.0543   27.488   3.3910 -0.2183990 6.086402 
1 1 1   11    4  -98 o   34.867   2.2646   50.388   6.4016   61.221   11.060   44.931   7.8500   37.986   3.6155   32.716   2.9761 5.270279 4.682873 
1 1 1   11    4  -97 o   27.765   2.8715   32.355   6.4053   30.239   12.395   33.126   7.4816   25.694   6.0235   27.955   3.3498 -2.261427 6.892303 
1 1 1   11    4  -96 o   29.234   2.7641   35.727   6.5087   40.329   12.202   33.896   7.6947   30.227   5.1360   28.285   3.4057 1.941526 6.162580 
1 1 1   11    4  -95 o   38.912   2.3042   62.618   7.2759   64.205   15.543   62.172   8.2338   38.372   5.0950   38.690   2.6263 -0.3179550 5.732094 
1 1 1   11    4  -94 o   47.447   2.0463   92.682   7.8956   67.561   16.250  100.445   9.0336   39.398   5.1856   49.347   2.2517 -9.948963 5.653407 
1 1 1   11    4  -93 o   59.739   1.6594  146.307   8.0726  133.163   12.792  155.007   10.407   56.691   2.7765   61.389   2.0827 -4.697983 3.470777 
1 1 1   11    4  -92 o   52.473   1.9519  113.120   8.3341  109.369   12.221  116.381   11.395   51.338   2.9326   53.050   2.6433 -1.712624 3.948062 
1 1 1   11    4  -91 o   19.079   4.3585   15.870   6.6293   21.998   10.395   11.669   8.6069   22.236   5.7067   16.735   5.4767 5.500845 7.909481 
1 1 1   11    4  -90 o   28.389   3.0968   33.696   7.0502   33.434   10.774   33.891   9.3236   27.764   4.9417   28.188   4.1846 -0.4237404 6.475428 
1 1 1   11    4  -89 o   49.859   2.0204  102.053   8.1944  102.499   12.073  101.673   11.158   49.757   2.9904   49.610   2.7703 0.1469269 4.076394 
1 1 1   11    4  -88 o   31.030   2.8653   39.980   7.1658   30.141   10.834   47.631   9.5540   26.314   5.2351   33.745   3.5252 -7.430990 6.311389 
1 1 1   11    4  -87 o   44.814   2.4918   82.698   9.0666   87.739   16.736   80.603   10.787   45.634   4.5601   44.136   3.0163 1.497787 5.467382 
1 1 1   11    4  -86 o   51.992   1.9601  110.782   8.2924  104.044   14.246  114.235   10.198   50.077   3.5121   52.729   2.3788 -2.652142 4.241906 
1 1 1   11    4  -85 o   44.639   2.1772   81.788   7.8986   80.619   13.591   82.384   9.7058   43.999   3.8275   44.723   2.6746 -0.7241707 4.669385 
1 1 1   11    4  -84 o   43.623   2.1433   78.068   7.5982   67.377   11.759   85.731   9.9557   40.264   3.6213   45.637   2.6881 -5.372974 4.509972 
1 1 1   11    4  -83 o   58.520   1.8122  140.090   8.6340  150.082   13.239  132.697   11.389   60.442   2.6939   56.865   2.4629 3.577808 3.650069 
1 1 1   11    4  -82 o   93.599   1.5245  357.700   11.632  341.730   17.042  371.626   15.915   91.357   2.2903   95.336   2.0479 -3.979874 3.072355 
1 1 1   11    4  -81 o   70.490   1.8200  203.127   10.449  199.993   14.872  206.183   14.684   69.832   2.6173   70.918   2.5443 -1.085983 3.650183 
1 1 1   11    4  -80 o  122.851   1.6054  616.163   16.077  616.354   22.237  615.955   23.269  122.775   2.2219  122.716   2.3262 0.5874634E-01 3.216853 
1 1 1   11    4  -79 o   32.952   3.6154   45.126   9.5518   41.275   13.437   49.060   13.581   31.102   5.5011   34.084   5.0399 -2.981983 7.460753 
1 1 1   11    4  -78 o   16.164   5.4362   10.167   8.4654   7.7682   12.051   12.504   11.894   16.531   6.3553   18.338   6.4337 -1.807400 9.043385 
1 1 1   11    4  -77 o   40.806   2.7297   68.429   9.0276   83.735   12.614   52.355   12.926   45.056   3.4608   35.362   4.5927 9.694462 5.750644 
1 1 1   11    4  -76 o   67.974   1.8458  188.770   10.218  195.414   14.484  182.186   14.417   69.084   2.5765   66.692   2.6572 2.392441 3.701242 
1 1 1   11    4  -75 o   19.258   5.1671   15.822   8.2790   23.299   11.517   7.8279   11.909   23.286   6.0229   16.526   6.3268 6.760168 8.735195 
1 1 1   11    4  -74 o  126.230   1.6893  650.216   17.382  658.529   22.176  636.971   27.991  126.987   2.1423  124.812   2.7512 2.174942 3.486910 
1 1 1   11    4  -73 o  107.610   1.8362  472.606   16.107  465.662   21.667  481.184   24.081  106.756   2.4898  108.460   2.7259 -1.704124 3.691814 
1 1 1   11    4  -72 o  160.995   1.7517  1057.64   22.988  1058.58   28.974  1056.04   37.765  161.012   2.2076  160.714   2.8827 0.2976685 3.630876 
1 1 1   11    4  -71 o   48.231   2.2833   95.202   8.9515   84.486   13.027  104.788   12.321   45.287   3.5574   50.534   3.0047 -5.246647 4.656488 
1 1 1   11    4  -70 o  106.315   1.6017  461.083   13.880  453.896   19.061  469.198   20.253  105.440   2.2177  107.194   2.3178 -1.754166 3.207869 
1 1 1   11    4  -69 o   41.975   2.5474   72.226   8.6752   73.453   12.628   71.129   11.938   42.197   3.7090   41.539   3.5599 0.6580811 5.140980 
1 1 1   11    4  -68 o   78.863   1.8358  253.746   11.801  259.644   15.598  245.851   18.048   79.709   2.4033   77.517   2.8611 2.191864 3.736593 
1 1 1   11    4  -67 o  183.769   1.8115  1377.73   27.136  1371.05   34.036  1389.38   44.956  183.273   2.2783  184.393   2.9909 -1.120789 3.759804 
1 1 1   11    4  -66 o   98.024   1.6230  391.911   12.969  400.564   18.047  382.670   18.649   99.068   2.2347   96.822   2.3629 2.245964 3.252309 
1 1 1   11    4  -65 o   21.999   4.6090   20.573   8.0002   26.752   11.843   15.387   10.850   25.010   5.9045   19.458   6.1282 5.551863 8.509889 
1 1 1   11    4  -64 o  157.417   1.6129  1010.64   20.697  1016.67   28.212  1003.60   30.456  157.843   2.1927  156.808   2.3827 1.034683 3.238079 
1 1 1   11    4  -63 o  112.121   1.4329  512.611   13.096  521.473   16.723  498.557   21.059  113.069   1.8144  110.529   2.3373 2.540527 2.958869 
1 1 1   11    4  -62 f  205.469   1.6338  1721.70   27.364  1743.59   35.186  1688.19   43.529  206.733   2.0880  203.365   2.6258 3.368042 3.354803 
1 1 1   11    4  -61 o  166.007   1.6012  1123.80   21.668  1097.62   28.354  1160.56   33.594  164.029   2.1206  168.639   2.4438 -4.610733 3.235584 
1 1 1   11    4  -60 o   25.887   3.8113   27.975   7.8021   31.777   10.188   22.581   12.133   27.479   4.7182   23.076   6.2826 4.403513 7.856945 
1 1 1   11    4  -59 o  172.320   1.6473  1210.89   23.138  1242.85   31.032  1170.86   34.724  174.546   2.1810  169.391   2.5148 5.155136 3.328832 
1 1 1   11    4  -58 o  179.783   1.8527  1318.21   27.152  1341.40   33.198  1271.36   47.188  181.330   2.2460  176.438   3.2810 4.892075 3.976092 
1 1 1   11    4  -57 o   46.594   2.6415   88.884   9.9917   97.053   14.592   81.671   13.710   48.595   3.7117   44.543   3.8126 4.052750 5.321000 
1 1 1   11    4  -56 o  140.019   1.6248  799.438   18.545  800.212   25.225  798.527   27.357  140.059   2.2094  139.900   2.3989 0.1584625 3.261354 
1 1 1   11    4  -55 o  230.773   1.7000  2171.66   31.979  2230.83   46.416  2118.20   44.122  233.835   2.4351  227.861   2.3754 5.973419 3.401837 
1 1 1   11    4  -54 o  178.866   1.4245  1304.39   20.769  1294.73   28.384  1315.53   30.472  178.176   1.9543  179.594   2.0815 -1.418137 2.855148 
1 1 1   11    4  -53 o  109.357   1.3635  487.565   12.154  522.281   18.070  458.885   16.425  113.166   1.9589  106.077   1.8995 7.088318 2.728652 
1 1 1   11    4  -52 o  340.056   2.2050  4716.70   61.120  4731.33   78.037  4693.47   98.306  340.503   2.8115  339.012   3.5574 1.491119 4.534278 
1 1 1   11    4  -51 o   48.093   1.9395   94.476   7.5877   96.422   12.286   93.276   9.6474   48.503   3.1241   47.752   2.4870 0.7511139 3.993185 
1 1 1   11    4  -50 o  123.718   1.4096  624.019   14.215  647.116   18.394  589.763   22.401  125.975   1.7912  120.245   2.2854 5.730026 2.903700 
1 1 1   11    4  -49 o  303.474   2.1669  3756.17   53.604  3763.06   71.347  3747.25   81.225  303.673   2.8823  302.979   3.2888 0.6935425 4.373087 
1 1 1   11    4  -48 o   58.936   1.8014  141.766   8.6441  160.945   12.148  122.093   12.303   62.770   2.3784   54.632   2.7717 8.137592 3.652326 
1 1 1   11    4  -47 o   26.246   3.2051   28.532   6.7150   21.365   9.3041   36.324   9.7011   22.408   5.1951   29.533   4.1437 -7.124636 6.645205 
1 1 1   11    4  -46 o  216.977   1.7528  1919.61   31.001  1932.71   41.538  1903.13   46.578  217.681   2.3409  215.986   2.6456 1.694260 3.532575 
1 1 1   11    4  -45 o  266.808   1.9789  2902.88   43.039  2877.56   56.901  2936.72   65.796  265.590   2.6283  268.268   3.0088 -2.678070 3.995104 
1 1 1   11    4  -44 o  208.655   2.0369  1775.41   34.644  1805.23   44.709  1730.60   54.806  210.364   2.6073  205.918   3.2651 4.446045 4.178390 
1 1 1   11    4  -43 o   70.324   1.9660  201.821   11.259  199.725   13.969  205.706   19.020   69.933   2.4543   70.917   3.2992 -0.9847260 4.111979 
1 1 1   11    4  -42 o  157.601   1.6495  1012.68   21.190  1054.04   30.464  973.912   29.495  160.760   2.3247  154.528   2.3415 6.231674 3.299567 
1 1 1   11    4  -41 o  116.433   1.6486  552.714   15.647  532.970   25.297  564.947   19.913  114.302   2.7151  117.703   2.0754 -3.400955 3.417491 
1 1 1   11    4  -40 o   91.572   1.6760  341.880   12.510  333.857   20.614  346.558   15.740   90.420   2.8002   92.187   2.0946 -1.766884 3.496927 
1 1 1   11    4  -39 o   50.473   1.9598  104.035   8.0481  104.152   12.697  103.956   10.405   50.428   3.1040   50.421   2.5398 0.6889343E-02 4.010682 
1 1 1   11    4  -38 o  138.070   1.5803  777.188   17.785  760.236   26.029  792.034   24.358  136.533   2.3388  139.366   2.1442 -2.833008 3.172912 
1 1 1   11    4  -37 o   23.033   3.5470   22.158   6.4462   21.767   11.119   22.356   7.9114   22.656   5.9467   23.016   4.3767 -0.3601875 7.383714 
1 1 1   11    4  -36 o  218.009   1.7456  1937.76   31.021  1931.38   48.090  1942.30   40.596  217.599   2.7112  218.238   2.2820 -0.6394958 3.543739 
1 1 1   11    4  -35 o  179.300   1.5941  1310.64   23.299  1313.44   36.459  1308.71   30.291  179.456   2.4924  179.150   2.0742 0.3052063 3.242565 
1 1 1   11    4  -34 o  211.665   1.7208  1826.59   29.691  1830.18   46.237  1824.07   38.731  211.826   2.6778  211.496   2.2466 0.3303070 3.495351 
1 1 1   11    4  -33 o  214.726   1.7353  1879.79   30.374  1807.95   46.128  1934.78   40.358  210.537   2.6878  217.820   2.2730 -7.283005 3.520080 
1 1 1   11    4  -32 o  173.468   1.5784  1226.74   22.320  1214.40   34.792  1235.37   29.096  172.562   2.4734  174.062   2.0506 -1.500137 3.212911 
1 1 1   11    4  -31 o  190.354   1.6372  1477.22   25.405  1458.28   39.398  1490.70   33.238  189.095   2.5560  191.203   2.1325 -2.108841 3.328799 
1 1 1   11    4  -30 o  325.441   2.2757  4318.79   60.370  4359.80   93.694  4289.68   78.940  326.871   3.5164  324.285   2.9863 2.586395 4.613382 
1 1 1   11    4  -29 o  246.157   1.8756  2470.42   37.635  2555.38   59.580  2414.01   48.547  250.297   2.9202  243.303   2.4478 6.993713 3.810410 
1 1 1   11    4  -28 o  191.271   1.6429  1491.45   25.616  1465.06   39.553  1510.51   33.619  189.539   2.5600  192.473   2.1428 -2.933914 3.338441 
1 1 1   11    4  -27 f   75.829   1.5914  234.410   9.8369  247.532   16.463  227.124   12.268   77.866   2.5974   74.609   2.0190 3.256271 3.289784 
1 1 1   11    4  -26 o  146.108   1.5165  870.234   18.062  839.438   28.284  891.440   23.470  143.478   2.4183  147.868   1.9472 -4.389984 3.104808 
1 1 1   11    4  -25 o  571.309   3.6738 13317.47  171.091 13601.73  266.760 13118.83  222.997  576.939   5.6722  566.808   4.8264 10.13086 7.447743 
1 1 1   11    4  -24 o   57.495   2.0478  134.945   9.5821  150.706   20.809  130.703   10.795   60.618   4.2380   56.568   2.3461 4.049786 4.844051 
1 1 1   11    4  -23 o  199.153   1.8172  1616.92   29.500  1570.48   52.708  1638.11   35.598  196.216   3.2954  200.443   2.1787 -4.226746 3.950510 
1 1 1   11    4  -22 o  342.047   2.3669  4770.42   65.994  4738.55  101.278  4793.93   87.000  340.806   3.6456  342.838   3.1131 -2.031128 4.793947 
1 1 1   11    4  -21 o  271.957   2.1557  3015.43   47.788  2981.02   83.168  3032.39   58.390  270.308   3.7745  272.699   2.6268 -2.390381 4.598549 
1 1 1   11    4  -20 o   43.379   2.1238   76.902   7.4869   73.585   12.160   78.927   9.5014   42.323   3.5576   43.914   2.6669 -1.591103 4.446179 
1 1 1   11    4  -19 o   87.414   1.4940  311.480   10.646  327.290   17.057  301.392   13.625   89.565   2.3384   85.982   1.9440 3.582466 3.040892 
1 1 1   11    4  -18 o   63.462   1.6877  164.292   8.7226  162.017   13.985  165.740   11.159   62.975   2.7308   63.723   2.1514 -0.7487717 3.476475 
1 1 1   11    4  -17 o  259.973   1.9328  2755.28   40.960  2834.04   64.156  2701.09   53.218  263.620   2.9855  257.382   2.5365 6.237366 3.917581 
1 1 1   11    4  -16 f  246.304   1.7546  2473.05   35.227  2483.47   50.369  2463.07   49.286  246.799   2.5037  245.784   2.4600 1.014297 3.510015 
1 1 1   11    4  -15 o  247.268   2.0312  2492.59   40.942  2528.63   59.315  2459.80   56.583  249.017   2.9221  245.608   2.8262 3.408813 4.065259 
1 1 1   11    4  -14 o  258.026   2.0900  2714.22   43.958  2817.28   64.669  2625.70   59.934  262.842   3.0183  253.753   2.8975 9.089066 4.183992 
1 1 1   11    4  -13 o  493.355   3.4731  9927.22  139.673  9873.79  197.380  9980.81  197.676  491.853   4.9230  494.514   4.9039 -2.661163 6.948677 
1 1 1   11    4  -12 o   10.042   4.5052  -3.6779   7.6487  -3.6205   12.677  -3.7108   9.5913   13.518   5.9460   11.487   5.1064 2.030707 7.837749 
1 1 1   11    4  -11 o  193.984   1.7949  1533.97   28.382  1559.28   41.583  1511.89   38.834  195.559   2.6086  192.568   2.4740 2.991150 3.595153 
1 1 1   11    4  -10 o  314.837   2.4081  4041.24   61.802  3910.16   86.423  4178.42   88.413  309.639   3.4240  320.086   3.3886 -10.44711 4.817300 
1 1 1   11    4   -9 o  439.832   3.1374  7888.79  112.484  7793.00  157.970  7987.31  160.207  437.039   4.4342  442.452   4.4420 -5.413940 6.276449 
1 1 1   11    4   -8 o  241.115   2.0126  2370.00   39.557  2443.24   57.980  2306.22   54.106  244.784   2.9058  237.825   2.7909 6.958939 4.028999 
1 1 1   11    4   -7 o  289.733   2.0943  3422.18   49.461  3504.77   67.029  3323.45   73.287  293.182   2.8047  285.482   3.1493 7.700104 4.217168 
1 1 1   11    4   -6 o  284.243   2.0659  3293.68   47.866  3274.32   63.547  3319.05   72.773  283.382   2.7510  285.295   3.1292 -1.912628 4.166528 
1 1 1   11    4   -5 o  213.338   1.6274  1855.25   28.300  1831.64   40.273  1878.29   39.777  211.961   2.3309  214.645   2.2734 -2.684006 3.255971 
1 1 1   11    4   -4 o  341.204   2.3608  4746.32   65.662  4835.73   88.529  4636.99   97.896  344.364   3.1538  337.190   3.5617 7.174316 4.757291 
1 1 1   11    4   -3 o  175.096   1.7377  1249.75   24.802  1253.74   30.835  1242.43   41.743  175.368   2.1571  174.557   2.9337 0.8103333 3.641332 
1 1 1   11    4   -2 o  167.426   1.7202  1142.66   23.476  1164.40   34.386  1123.67   32.129  168.997   2.4961  166.018   2.3742 2.979568 3.444882 
1 1 1   11    4   -1 o  153.900   1.5527  965.466   19.479  944.862   25.985  991.896   29.430  152.242   2.0939  155.981   2.3147 -3.739380 3.121250 
1 1 1   11    4    0 o   53.839   2.1699  118.361   9.5034  121.549   13.871  115.541   13.046   54.507   3.1352   53.145   3.0240 1.361305 4.355931 
1 1 1   11    4    1 o  556.210   3.5790 12617.24  162.269 12696.77  249.430 12558.88  213.664  557.717   5.4865  554.789   4.7246 2.928101 7.240459 
1 1 1   11    4    2 o  233.944   1.8175  2231.01   34.660  2221.34   53.140  2238.16   45.724  233.410   2.7930  234.304   2.3940 -0.8940887 3.678608 
1 1 1   11    4    3 o   14.479   5.0231   7.6504   7.2389   29.781   11.902  -5.3430   9.1196   26.505   5.6795   10.711   4.8516 15.79462 7.469626 
1 1 1   11    4    4 o  172.231   2.4432  1209.38   34.301  1209.38   34.301   0.0000   0.0000  172.231   2.4432  ?   ?  0.000000 2.443237 
1 1 1   11    4    5 o  305.459   2.3423  3803.94   58.322  3871.58   83.750  3740.24   81.265  308.118   3.3345  302.849   3.2919 5.269287 4.685648 
1 1 1   11    4    6 o  174.984   1.8920  1248.20   26.987  1233.42   34.793  1270.53   42.757  173.934   2.4540  176.519   2.9716 -2.584686 3.853848 
1 1 1   11    4    7 o  301.591   2.5469  3708.43   62.614  3683.57   80.558  3746.37   99.515  300.544   3.2883  303.052   4.0284 -2.508270 5.200072 
1 1 1   11    4    8 o  406.227   2.9339  6728.87   97.151  6829.14  139.331  6633.99  135.531  409.147   4.1777  403.263   4.1230 5.883484 5.869601 
1 1 1   11    4    9 o  110.283   1.6275  495.771   14.630  500.767   21.272  491.285   20.154  110.828   2.3546  109.775   2.2523 1.052872 3.258374 
1 1 1   11    4   10 o  320.219   2.4264  4180.62   63.334  4182.45   89.872  4178.82   89.267  320.237   3.4428  320.099   3.4211 0.1380310 4.853591 
1 1 1   11    4   11 o  269.913   2.1500  2970.06   47.304  2940.43   66.726  2999.99   67.070  268.529   3.0484  271.235   3.0335 -2.706635 4.300560 
1 1 1   11    4   12 o  250.896   2.2421  2566.36   45.856  2572.29   73.050  2562.50   58.908  251.131   3.5685  250.684   2.8828 0.4469452 4.587420 
1 1 1   11    4   13 o  151.739   1.6513  938.577   20.425  940.389   29.419  936.891   28.379  151.873   2.3764  151.592   2.2966 0.2810822 3.304799 
1 1 1   11    4   14 o  338.075   2.5290  4660.11   69.694  4763.96  100.470  4563.79   96.760  341.755   3.6065  334.502   3.5486 7.252838 5.059615 
1 1 1   11    4   15 o  245.205   2.4822  2451.47   49.614  2575.75   73.134  2345.50   67.531  251.294   3.5703  239.805   3.4547 11.48863 4.968064 
1 1 1   11    4   16 f  269.769   2.3526  2967.13   51.735  3032.21   68.117  2878.43   79.530  272.678   3.0645  265.641   3.6728 7.037964 4.783410 
1 1 1   11    4   17 o  146.303   1.7954  872.573   21.411  874.414   28.111  870.030   33.045  146.447   2.3548  146.069   2.7753 0.3775482 3.639699 
1 1 1   11    4   18 o  264.428   2.3204  2850.84   50.016  2883.06   65.366  2805.32   77.685  265.886   3.0159  262.242   3.6341 3.644012 4.722561 
1 1 1   11    4   19 o  213.942   2.2909  1866.17   39.952  1865.31   57.035  1866.99   55.980  213.854   3.2718  213.953   3.2098 -0.9953308E-01 4.583411 
1 1 1   11    4   20 o  266.270   2.3319  2890.77   50.613  2929.90   81.121  2865.83   64.764  267.989   3.7135  265.087   2.9972 2.902222 4.772116 
1 1 1   11    4   21 o  183.039   1.9168  1365.86   28.599  1388.91   46.536  1351.87   36.252  184.538   3.0936  182.085   2.4425 2.453720 3.941592 
1 1 1   11    4   22 o  177.484   2.0943  1284.29   30.300  1372.20   62.343  1257.11   34.670  183.370   4.1708  175.586   2.4223 7.784393 4.823221 
1 1 1   11    4   23 o  184.857   1.9154  1393.16   28.862  1321.09   44.707  1444.66   37.793  179.975   3.0474  188.226   2.4632 -8.251358 3.918387 
1 1 1   11    4   24 o  107.674   1.7553  472.647   15.406  480.887   24.980  467.588   19.572  108.552   2.8255  107.089   2.2421 1.462967 3.606992 
1 1 1   11    4   25 o  129.766   1.7534  686.496   18.547  677.724   29.679  692.117   23.758  128.909   2.8244  130.286   2.2370 -1.377304 3.603029 
1 1 1   11    4   26 o  196.596   1.9682  1575.77   31.540  1587.96   50.498  1567.98   40.387  197.305   3.1398  196.088   2.5267 1.217148 4.030188 
1 1 1   11    4   27 f  267.182   2.3408  2910.89   50.982  2872.98   80.165  2936.63   66.062  265.342   3.7063  268.319   3.0204 -2.976349 4.781169 
1 1 1   11    4   28 o   64.639   2.0575  170.530   10.827  158.723   17.578  177.748   13.743   62.274   3.4766   65.970   2.5606 -3.695507 4.317799 
1 1 1   11    4   29 o  101.596   1.7580  420.803   14.559  424.743   23.611  418.386   18.493  102.007   2.8423  101.295   2.2396 0.7127914 3.618620 
1 1 1   11    4   30 o   56.294   2.1990  129.415   10.071  133.969   16.761  126.841   12.599   57.183   3.6143   55.696   2.7840 1.486877 4.562237 
1 1 1   11    4   31 o  130.698   1.7507  696.421   18.651  683.318   29.815  704.845   23.907  129.431   2.8259  131.473   2.2307 -2.042313 3.600251 
1 1 1   11    4   32 o   59.705   2.1100  145.531   10.253  156.131   17.048  139.525   12.833   61.764   3.3992   58.425   2.7019 3.338757 4.342248 
1 1 1   11    4   33 o  108.596   1.7503  480.803   15.494  499.490   25.301  469.590   19.599  110.623   2.8081  107.311   2.2406 3.311859 3.592437 
1 1 1   11    4   34 o  293.817   2.4996  3520.83   59.866  3533.83   95.281  3512.35   76.951  294.211   3.9730  293.399   3.2175 0.8117065 5.112408 
1 1 1   11    4   35 o  134.819   1.7624  741.056   19.368  743.183   31.048  739.701   24.780  134.977   2.8219  134.681   2.2571 0.2958221 3.613564 
1 1 1   11    4   36 o   79.019   1.8732  254.584   12.066  261.519   19.743  250.450   15.244   80.005   3.0328   78.328   2.3903 1.676872 3.861519 
1 1 1   11    4   37 o  165.936   1.8427  1122.68   24.925  1135.78   40.089  1114.42   31.823  166.852   2.9475  165.305   2.3617 1.547424 3.776963 
1 1 1   11    4   38 o  107.699   1.7525  472.909   15.385  442.653   24.563  492.441   19.736  104.125   2.8968  109.889   2.2032 -5.764252 3.639440 
1 1 1   11    4   39 o  188.405   2.4856  1447.78   38.173  1519.28   69.633  1417.05   45.642  192.851   4.4295  186.364   3.0045 6.486740 5.352357 
1 1 1   11    4   40 o  137.484   2.2744  770.866   25.489  791.660   47.018  762.212   30.333  139.165   4.1494  136.692   2.7223 2.472824 4.962679 
1 1 1   11    4   41 o   77.474   2.4276  245.047   15.312  244.427   29.096  245.285   18.007   77.201   4.6449   77.486   2.8558 -0.2848129 5.452640 
1 1 1   11    4   42 o  183.596   2.4640  1374.87   36.876  1407.92   66.556  1360.23   44.296  185.636   4.3984  182.584   2.9763 3.051620 5.310719 
1 1 1   11    4   43 o   48.776   2.3641   97.263   9.3717   81.109   15.235  107.098   11.887   44.355   4.2661   51.155   2.8621 -6.799274 5.137242 
1 1 1   11    4   44 o  142.302   1.7711  825.668   20.544  812.127   33.148  834.114   26.178  141.083   2.8823  143.010   2.2456 -1.927429 3.653850 
1 1 1   11    4   45 o  251.449   2.2535  2578.68   46.189  2588.19   73.791  2572.55   59.226  251.782   3.5954  251.095   2.8936 0.6864471 4.615134 
1 1 1   11    4   46 o  155.244   1.8122  982.714   22.932  1040.24   37.954  949.636   28.779  159.667   2.9161  152.587   2.3138 7.079651 3.722581 
1 1 1   11    4   47 o  191.511   1.9532  1495.63   30.491  1518.79   49.293  1481.28   38.806  192.908   3.1347  190.558   2.4982 2.349716 4.008436 
1 1 1   11    4   48 o  126.674   1.7598  654.294   18.171  634.817   29.250  666.536   23.188  124.729   2.8769  127.837   2.2252 -3.108238 3.637069 
1 1 1   11    4   49 o  160.554   1.8412  1051.14   24.096  1057.49   39.061  1047.24   30.616  160.974   2.9768  160.231   2.3441 0.7433014 3.788935 
1 1 1   11    4   50 o  179.690   1.9072  1316.70   27.936  1312.73   44.873  1319.22   35.698  179.341   3.0695  179.831   2.4352 -0.4896240 3.918215 
1 1 1   11    4   51 o  160.666   1.8527  1052.64   24.264  1060.14   39.548  1048.11   30.726  161.168   3.0103  160.294   2.3516 0.8743286 3.819910 
1 1 1   11    4   52 o  210.783   2.3393  1812.38   40.194  1812.06   56.693  1812.70   56.995  210.675   3.3012  210.711   3.3183 -0.3562927E-01 4.680728 
1 1 1   11    4   53 o   70.294   2.4301  201.823   13.903  194.421   19.650  209.244   19.675   68.909   3.5097   71.506   3.3851 -2.596161 4.876172 
1 1 1   11    4   54 o  173.554   2.0067  1228.48   28.389  1203.02   36.590  1266.98   44.998  171.706   2.6142  176.168   3.1335 -4.461975 4.080824 
1 1 1   11    4   55 o   37.974   3.8049   59.505   11.619   48.069   15.416   74.546   17.680   33.775   5.8089   42.351   5.2326 -8.576042 7.818119 
1 1 1   11    4   56 o   65.708   2.2001  176.320   11.767  173.535   20.402  177.708   14.405   65.051   3.8650   65.934   2.6858 -0.8836212 4.706584 
1 1 1   11    4   57 o  246.056   2.2728  2469.98   45.585  2483.09   72.986  2461.58   58.371  246.525   3.6320  245.562   2.9161 0.9629669 4.657769 
1 1 1   11    4   58 o  143.116   3.2046  836.409   37.385   0.0000   0.0000  836.409   37.385  ?   ?   143.116   3.2046 0.000000 3.204568 
1 1 1   11    4   59 o   57.327   2.7072  134.430   12.615  136.584   27.878  133.875   14.146   57.379   6.0514   57.181   3.0460 0.1978188 6.774757 
1 1 1   11    4   60 o  205.257   2.3088  1718.95   38.629  1690.59   77.570  1728.30   44.545  203.223   4.6826  205.780   2.6556 -2.557007 5.383189 
1 1 1   11    4   61 o  150.818   2.3139  928.105   28.446  873.979   50.203  953.701   34.523  146.104   4.2198  152.846   2.7709 -6.742523 5.048209 
1 1 1   11    4   62 f   75.180   2.0865  230.760   12.775  215.779   18.714  243.831   17.480   72.612   3.1694   77.230   2.7812 -4.618736 4.216698 
1 1 1   11    4   63 o   20.256   5.6075   17.350   9.5741   33.346   19.519   12.283   10.986   28.072   8.0894   18.069   6.1916 10.00317 10.18693 
1 1 1   11    4   64 o  117.968   1.8338  567.675   17.634  547.438   24.506  589.406   25.395  115.797   2.5962  120.154   2.5928 -4.356934 3.669179 
1 1 1   11    4   65 o   95.050   1.7473  368.517   13.538  339.301   20.691  390.387   17.901   91.105   2.7894   97.804   2.2454 -6.698860 3.580844 
1 1 1   11    4   66 o  107.015   1.5679  467.076   13.677  481.214   19.194  452.492   19.494  108.589   2.1684  105.292   2.2712 3.297195 3.140135 
1 1 1   11    4   67 o  182.900   1.6737  1364.54   24.953  1352.65   33.653  1379.07   37.189  182.040   2.2679  183.782   2.4824 -1.742538 3.362366 
1 1 1   11    4   68 o   82.522   1.7658  277.818   11.878  264.520   15.844  294.884   17.949   80.453   2.4187   84.932   2.5956 -4.479362 3.547870 
1 1 1   11    4   69 o   69.527   1.7918  197.355   10.146  188.367   14.664  205.612   14.054   67.853   2.6563   70.916   2.4348 -3.063248 3.603348 
1 1 1   11    4   70 o   63.841   1.9782  166.496   10.282  197.038   17.411  150.141   12.741   69.348   3.0878   60.569   2.5865 8.778412 4.028015 
1 1 1   11    4   71 o   93.652   1.5346  357.775   11.715  327.969   17.303  383.005   15.919   89.582   2.3716   96.868   2.0161 -7.286011 3.112761 
1 1 1   11    4   72 o  139.621   1.5575  795.261   17.726  786.672   24.411  804.842   25.782  138.807   2.1574  140.389   2.2529 -1.582687 3.119307 
1 1 1   11    4   73 o  138.457   1.5567  782.088   17.569  797.394   24.487  765.851   25.222  139.743   2.1497  136.938   2.2595 2.805038 3.118717 
1 1 1   11    4   74 o   28.805   2.5853   34.185   6.0060   28.764   11.362   36.287   7.0753   25.915   5.5462   29.636   2.9687 -3.721098 6.290791 
1 1 1   11    4   75 o  135.630   1.4152  750.432   15.646  780.629   23.991  728.081   20.640  138.253   2.1288  133.547   1.8960 4.705963 2.850723 
1 1 1   11    4   76 o  306.243   2.3609  3832.76   58.935  4034.63   88.160  3669.66   79.245  313.725   3.4473  299.295   3.2481 14.42963 4.736513 
1 1 1   11    4   77 o   75.194   1.5461  230.736   9.4770  245.953   15.404  221.469   12.021   77.525   2.4406   73.611   2.0053 3.914139 3.158772 
1 1 1   11    4   78 o   48.937   1.7467   97.899   6.9568  115.509   13.384   91.380   8.1432   53.003   3.1115   47.244   2.1199 5.759167 3.765067 
1 1 1   11    4   79 o   40.329   1.9290   66.590   6.3229  101.257   16.249   60.404   6.8640   49.434   4.0683   38.378   2.2033 11.05608 4.626626 
1 1 1   11    4   80 o  113.797   1.5958  528.677   14.802  571.049   24.636  504.738   18.518  118.115   2.5588  111.131   2.0442 6.983360 3.275065 
1 1 1   11    4   81 o   86.365   1.9972  304.868   14.060  302.567   19.300  307.470   20.525   85.885   2.7604   86.548   2.9135 -0.6623306 4.013525 
1 1 1   11    4   82 o   61.181   2.1054  153.254   10.484  146.870   13.330  163.606   16.976   59.797   2.7421   63.009   3.3168 -3.212357 4.303539 
1 1 1   11    4   83 o   14.183   5.2824   6.5125   8.1719   4.2266   10.382   10.236   13.250   14.364   5.7813   17.817   6.7075 -3.452430 8.855187 
1 1 1   11    4   84 o   38.941   2.7412   62.524   8.6456   55.981   11.018   73.010   13.947   36.647   3.7406   41.805   4.1475 -5.158157 5.585121 
1 1 1   11    4   85 o   23.441   4.2601   23.467   7.8405   20.545   10.087   27.927   12.462   21.712   5.6470   25.229   6.1225 -3.516668 8.329061 
1 1 1   11    4   86 o   66.112   1.8778  178.954   10.109  170.322   13.010  192.111   16.062   64.385   2.4835   68.291   2.8919 -3.905136 3.811889 
1 1 1   11    4   87 o   45.003   2.3690   83.313   8.6600   88.326   11.368   76.382   13.368   46.207   3.0349   42.749   3.8784 3.458073 4.924717 
1 1 1   11    4   88 o   93.341   1.6487  356.332   12.545  357.771   16.394  354.297   19.486   93.416   2.1529   92.809   2.5782 0.6074829 3.358900 
1 1 1   11    4   89 o   31.824   3.1349   42.221   8.0268   36.116   10.537   50.663   12.391   29.023   4.6075   34.510   4.5127 -5.487427 6.449258 
1 1 1   11    4   90 o   14.413   5.0381   7.9611   7.2894   5.7336   9.5825   11.020   11.230   14.379   5.6284   17.188   6.2270 -2.809163 8.393656 
1 1 1   11    4   91 o   23.883   3.9812   24.433   7.4779   23.086   9.6960   26.411   11.747   22.854   5.3067   24.303   5.9731 -1.448530 7.989930 
1 1 1   11    4   92 o   32.390   3.4314   44.092   8.9220   48.317   13.330   40.663   12.009   33.369   5.0590   30.585   4.9886 2.783396 7.104842 
1 1 1   11    4   93 o   12.817   5.0194   4.5319   7.6237  -8.4100   10.558   18.631   11.020   10.747   4.9954   20.479   6.1269 -9.731874 7.905231 
1 1 1   11    4   94 o   17.372   5.0996   13.212   7.6931  -3.4007   10.534   32.197   11.261   11.873   5.3099   26.957   5.3139 -15.08374 7.512142 
1 1 1   11    4   95 o   44.831   2.2632   83.008   8.2440   77.006   10.768   91.508   12.814   42.928   3.0982   46.705   3.3889 -3.776997 4.591644 
1 1 1   11    4   96 o   15.742   4.8995   10.681   6.9563  -6.1295   8.9668   36.089   11.024   10.132   4.6721   28.657   4.8949 -18.52563 6.766730 
1 1 1   11    4   97 o   15.733   5.0393   10.606   7.3105   14.623   9.0828   3.2176   12.319   18.168   5.5891   14.587   6.1257 3.580845 8.292285 
1 1 1   11    4   98 o   40.831   2.5330   69.289   8.3890   66.464   10.165   75.321   14.855   39.772   3.1614   41.777   4.4294 -2.005028 5.441923 
1 1 1   11    4   99 o   66.689   1.9225  183.148   10.440  180.814   12.758  187.878   18.162   66.085   2.3723   66.856   3.3432 -0.7711563 4.099370 
1 1 1   11    4  100 o   36.537   2.6301   55.702   7.7807   51.604   9.9805   62.051   12.423   34.823   3.5664   37.982   4.0764 -3.159271 5.416241 
1 1 1   11    4  101 o   30.241   3.1075   38.677   7.5514   39.666   9.6536   37.118   12.121   30.277   4.0100   28.634   5.3909 1.643200 6.718740 
1 1 1   11    4  102 o   36.858   2.6609   56.840   7.9409   64.429   10.407   46.263   12.286   38.988   3.3057   32.292   4.8143 6.696430 5.839993 
1 1 1   11    4  103 o   42.945   2.3629   76.765   8.2398   85.204   10.933   65.671   12.536   44.970   2.9998   38.953   4.0050 6.016472 5.003911 
1 1 1   11    4  104 o   19.411   4.7599   17.182   7.4727   6.8294   9.7264   32.096   11.674   14.414   5.6620   26.238   5.6273 -11.82410 7.982739 
1 1 1   11    4  105 f   43.872   2.3990   80.386   8.5465   74.107   11.145   89.348   13.316   41.668   3.3084   45.581   3.6135 -3.913246 4.899229 
1 1 1   11    4  106 o   15.754   5.3433   11.016   8.1788  -5.2449   9.6128   53.648   15.565   10.532   4.8499   33.661   5.8869 -23.12872 7.627362 
1 1 1   11    4  107 o   10.195   4.5671  -2.0037   7.8285   5.3993   9.2235 -21.0772   14.805   13.472   5.4398   10.758   5.2403 2.714611 7.553258 
1 1 1   11    4  108 o   12.892   5.1327   5.2639   8.0916  -0.6817   9.4856   21.151   15.506   11.544   5.1076   20.414   7.3274 -8.870644 8.931848 
1 1 1   11    4  109 o   24.632   4.0136   27.228   7.7816   14.652   9.8227   48.422   12.751   17.498   5.8555   32.263   5.0111 -14.76482 7.706993 
1 1 1   11    4  110 f   13.026   5.0315   6.2928   7.5789  -1.4260   9.6468   18.739   12.250   11.320   5.0704   19.195   6.5389 -7.874942 8.274396 
1 1 1   11    4  111 o   11.594   4.9120   2.4220   8.0349   3.5477   10.969   1.1186   11.803   13.275   5.6852   12.945   5.7138 0.3305082 8.060356 
1 1 1   11    4  112 o   16.467   5.6511   13.115   9.1531   9.3719   13.468   16.328   12.478   15.721   6.4869   17.979   6.5565 -2.258140 9.223177 
1 1 1   11    4  113 o   16.681   5.7313   13.642   9.4154   9.6826   13.906   16.994   12.794   15.847   6.5701   18.174   6.6372 -2.326686 9.339134 
1 1 1   11    4  114 o   38.275   3.9740   66.152   12.219   60.214   25.586   67.906   13.907   29.557   9.4233   38.224   4.5527 -8.667620 10.46547 
1 1 1   11    4  115 f   11.137   4.9770  -0.6622   9.2373   3.0113   13.426  -3.9640   12.729   13.828   6.0993   12.030   5.5543 1.798002 8.249384 
1 1 1   11    4  116 o   39.088   3.3510   67.371   10.574   60.062   15.110   74.385   14.803   34.803   5.5094   39.752   4.6564 -4.948696 7.213593 
1 1 1   11    4  117 o   15.472   5.9449   11.080   10.541   7.2903   13.424   17.174   17.024   14.833   6.3192   18.087   7.3583 -3.253610 9.699302 
1 1 1   11    4  118 o   24.792   6.1327   32.614   12.325   32.865   14.470   31.952   23.523   23.959   6.9830   21.548   8.6919 2.410122 11.14952 
1 1 1   11    4  119 o   15.560   6.2573   10.917   12.150   9.9833   17.065   11.878   17.304   16.131   7.0005   16.606   7.1266 -0.4744740 9.989779 
1 1 1   11    4  120 o   21.897   6.5215   26.813   12.507   42.542   17.783   11.418   17.593   26.181   7.7711   16.487   7.1316 9.694069 10.54751 
1 1 1   11    4  121 o   27.159   5.9056   38.703   12.701   40.445   17.895   36.934   18.029   25.197   7.8609   23.860   7.9317 1.337069 11.16716 
1 1 1   11    4  122 o   24.930   6.2966   34.081   12.797   30.511   18.237   37.544   17.961   21.494   7.9121   23.974   7.9150 -2.479761 11.19142 
1 1 1   11    4  123 o   15.829   6.2877   12.167   12.117   26.891   17.246  -2.1893   17.029   20.529   7.6683   13.595   6.3277 6.933500 9.942012 
1 1 1   11    4  124 o   11.289   5.2773  -5.2620   12.056  -7.6324   17.027  -2.8790   17.072   12.789   6.0677   13.524   6.3082 -0.7345514 8.752742 
1 1 1   11    5 -122 o   18.691   6.5925   19.769   12.501   41.241   17.913  -0.6156   17.454   25.354   7.8575   13.973   6.4698 11.38088 10.17836 
1 1 1   11    5 -121 o   12.888   5.4839   4.7276   10.090   9.4062   12.631  -3.5207   16.771   14.988   6.2418   13.279   6.2132 1.708827 8.807089 
1 1 1   11    5 -120 o   15.090   6.0418   10.436   11.276   25.707   12.879 -39.7190   23.341   21.075   6.6818   11.648   5.8300 9.427200 8.867646 
1 1 1   11    5 -119 o   12.883   5.4644   4.7377   9.9628   9.8666   12.371  -4.7258   16.805   15.136   6.2284   13.150   6.1739 1.986101 8.769815 
1 1 1   11    5 -118 o   11.739   5.1979   0.9580   9.8410  -4.0056   12.152   10.415   16.774   11.606   5.3825   16.097   6.9634 -4.491429 8.801121 
1 1 1   11    5 -117 o   11.270   5.1668  -2.6820   10.747 -13.1789   13.956   12.610   16.845   10.908   5.2592   16.682   7.0918 -5.774176 8.829070 
1 1 1   11    5 -116 o   12.725   5.5643   2.6569   10.956  -6.7240   14.266   16.141   17.104   12.050   5.6672   17.691   7.3060 -5.641221 9.246320 
1 1 1   11    5 -115 f   13.368   5.7193   4.6271   11.081   6.7288   14.468   1.6449   17.234   14.917   6.4598   14.551   6.6221 0.3651409 9.251040 
1 1 1   11    5 -114 o   21.854   5.7064   24.625   10.274   18.830   12.708   35.558   17.454   18.630   6.6397   24.042   7.7944 -5.411875 10.23900 
1 1 1   11    5 -113 o   12.821   5.4378   4.0653   9.8658  -2.4400   12.079   17.101   17.099   12.043   5.5048   18.182   7.3829 -6.139466 9.209242 
1 1 1   11    5 -112 o   10.635   4.8781  -3.4507   9.5953  -1.6551   11.870  -6.8368   16.300   12.168   5.5210   12.965   6.0850 -0.7970285 8.216346 
1 1 1   11    5 -111 o   14.743   5.7300   9.1554   9.8750   21.725   12.175 -15.0116   16.882   20.154   6.5078   12.067   5.8095 8.086963 8.723660 
1 1 1   11    5 -110 o   10.784   4.9328  -3.3058   9.7225  -6.1637   12.042   2.0464   16.479   11.369   5.3012   14.708   6.6044 -3.339111 8.468836 
1 1 1   11    5 -109 o   32.776   3.6410   47.623   9.5638   49.447   11.410   43.313   17.538   32.848   4.3694   27.682   7.5603 5.166452 8.732134 
1 1 1   11    5 -108 o   11.011   4.8724  -0.4592   8.6346  -1.7902   10.219   2.8627   16.144   11.507   5.1812   14.970   6.6415 -3.463349 8.423453 
1 1 1   11    5 -107 o   25.310   5.1967   30.468   10.362   36.599   11.427   2.1003   24.582   27.770   5.2401   17.194   7.8569 10.57687 9.444019 
1 1 1   11    5 -106 o   25.299   4.9645   29.883   9.8721   27.681   10.690   42.652   25.738   23.937   5.5817   26.141   9.4331 -2.204519 10.96075 
1 1 1   11    5 -105 o   32.172   3.8629   45.543   9.9282   46.108   10.784   42.400   25.431   32.155   4.2156   26.435   9.3956 5.720905 10.29796 
1 1 1   11    5 -104 f   30.060   3.9976   39.858   9.5530   38.423   10.631   45.871   21.769   29.145   4.6297   28.590   8.6244 0.5546722 9.788502 
1 1 1   11    5 -103 o   15.165   5.0888   10.084   7.4183   19.113   10.163  -0.2115   10.853   20.023   5.8569   12.532   5.5073 7.490962 8.039553 
1 1 1   11    5 -102 o   15.275   4.7134   10.409   6.4537   14.715   11.470   8.4148   7.8066   18.077   6.3198   14.425   5.1964 3.652204 8.181818 
1 1 1   11    5 -101 o   20.808   3.8556   19.047   6.2990   24.307   10.158   15.760   8.0291   22.853   5.5163   18.532   5.1370 4.320936 7.537804 
1 1 1   11    5 -100 f   32.104   2.5973   43.167   6.7388   27.013   10.670   53.886   8.6916   24.182   5.5331   35.733   3.0120 -11.55152 6.299801 
1 1 1   11    5  -99 f   22.224   3.7615   21.482   6.5716   16.609   10.442   24.677   8.4561   19.080   6.0123   23.542   4.5714 -4.461195 7.552863 
1 1 1   11    5  -98 o   17.198   4.4776   13.197   6.3376   16.467   10.375   11.250   8.0047   19.064   5.9909   16.126   5.2819 2.937452 7.986828 
1 1 1   11    5  -97 o   33.379   2.5811   46.480   6.9683   41.628   10.941   49.790   9.0383   30.874   4.4781   34.322   3.2700 -3.447941 5.544972 
1 1 1   11    5  -96 o   33.928   2.5283   47.939   6.9421   55.392   11.065   43.100   8.9152   36.013   3.8277   31.851   3.4909 4.162302 5.180491 
1 1 1   11    5  -95 o   27.868   3.0272   32.719   6.7664   28.702   10.834   35.288   8.6642   25.219   5.4307   28.697   3.7969 -3.478693 6.626389 
1 1 1   11    5  -94 o   23.682   3.4796   23.958   6.5171   23.681   10.671   24.122   8.2302   22.816   5.7428   23.443   4.4700 -0.6271267 7.277358 
1 1 1   11    5  -93 o   34.608   2.4959   49.735   6.9937   49.978   11.207   49.580   8.9502   34.169   4.1060   34.341   3.2355 -0.1720810 5.227584 
1 1 1   11    5  -92 f   22.928   3.6832   22.534   6.6509   35.104   10.836   14.937   8.4243   28.312   4.8710   18.373   5.3204 9.939386 7.213420 
1 1 1   11    5  -91 o   65.281   1.6771  174.757   8.9170  170.075   13.603  178.285   11.808   64.123   2.6079   65.792   2.2048 -1.668610 3.415008 
1 1 1   11    5  -90 o   41.519   2.2957   71.148   7.7394   69.131   13.259   72.191   9.5317   40.384   4.0838   41.691   2.8213 -1.306965 4.963630 
1 1 1   11    5  -89 o   35.203   2.6432   51.394   7.5294   47.121   12.923   53.590   9.2642   32.992   4.9585   35.809   3.2077 -2.816692 5.905641 
1 1 1   11    5  -88 o   92.115   1.6979  347.433   12.749  371.404   24.201  338.225   15.000   94.665   3.1406   90.798   2.0266 3.867195 3.737670 
1 1 1   11    5  -87 o   24.254   3.7422   25.003   7.1606   28.677   12.393   23.162   8.7734   25.365   6.0740   23.046   4.8252 2.319489 7.757365 
1 1 1   11    5  -86 o   24.419   3.7652   25.315   7.2542   35.831   12.659   20.173   8.8519   28.592   5.6319   21.453   5.1311 7.138802 7.618822 
1 1 1   11    5  -85 o   10.505   4.5888  -1.2617   7.4332  -6.6999   14.519   0.6701   8.6534   13.557   6.1332   12.010   5.0933 1.546766 7.972336 
1 1 1   11    5  -84 o   38.566   2.5348   61.332   7.9245   61.767   11.474   60.935   10.958   38.452   3.7064   38.226   3.5575 0.2256775 5.137444 
1 1 1   11    5  -83 o   38.906   2.5446   62.381   8.0259   53.001   11.533   71.192   11.176   35.532   4.0541   41.418   3.3386 -5.885727 5.251890 
1 1 1   11    5  -82 o   66.708   1.9311  182.188   10.490  184.610   15.850  180.301   13.992   66.961   2.9107   66.242   2.5964 0.7189331 3.900447 
1 1 1   11    5  -81 o   78.767   1.8282  253.633   11.738  253.499   17.671  253.739   15.703   78.546   2.7643   78.650   2.4523 -0.1048431 3.695287 
1 1 1   11    5  -80 o  107.080   1.7075  468.468   14.904  446.870   21.691  487.787   20.514  104.428   2.5482  109.157   2.3055 -4.729408 3.436347 
1 1 1   11    5  -79 o   86.270   1.6975  304.006   11.937  295.928   16.553  312.758   17.230   84.990   2.3917   87.370   2.4216 -2.379601 3.403593 
1 1 1   11    5  -78 f   30.749   3.3506   39.294   8.2626   35.228   11.929   43.044   11.456   28.682   5.2973   31.962   4.5231 -3.280289 6.965642 
1 1 1   11    5  -77 o   28.734   3.7562   34.527   8.5876   33.646   12.642   35.282   11.702   27.940   5.7429   28.748   5.1841 -0.8086147 7.736703 
1 1 1   11    5  -76 o  133.865   2.1289  732.411   23.230  776.246   35.820  700.592   30.518  137.572   3.1942  130.777   2.8628 6.795151 4.289356 
1 1 1   11    5  -75 o   55.698   2.2090  126.989   10.009  134.186   14.486  120.415   13.847   57.136   3.1222   54.111   3.1529 3.024845 4.437201 
1 1 1   11    5  -74 o   81.047   1.7517  268.158   11.573  268.761   16.200  267.529   16.538   81.038   2.4552   80.844   2.5126 0.1940079 3.513033 
1 1 1   11    5  -73 o   50.469   2.4287  104.358   9.9623   96.389   13.390  114.238   14.910   48.372   3.4179   52.669   3.4926 -4.297115 4.886738 
1 1 1   11    5  -72 o   26.801   4.0673   30.155   8.6072   26.914   11.751   33.906   12.643   25.007   5.8664   28.140   5.7073 -3.132463 8.184598 
1 1 1   11    5  -71 o  111.189   1.7102  504.534   15.501  512.009   19.983  493.242   24.562  111.964   2.1895  109.827   2.7436 2.136986 3.510174 
1 1 1   11    5  -70 o  146.153   1.7124  871.661   20.401  865.377   25.720  882.322   33.501  145.572   2.1675  146.895   2.7978 -1.323090 3.539191 
1 1 1   11    5  -69 o  116.952   1.5913  558.022   15.170  594.047   21.162  519.939   21.758  120.618   2.1523  112.823   2.3658 7.795410 3.198362 
1 1 1   11    5  -68 f  155.277   1.7871  983.873   22.620  997.424   27.878  957.758   38.701  156.296   2.1882  153.018   3.1028 3.277679 3.796723 
1 1 1   11    5  -67 o   57.861   2.3606  136.952   11.110  150.538   13.794  111.860   18.746   60.625   2.7989   52.015   4.4642 8.609722 5.269083 
1 1 1   11    5  -66 o   46.257   3.1225   87.893   11.705  101.138   13.091   35.110   26.133   49.619   3.2546   29.309   9.5400 20.31011 10.07985 
1 1 1   11    5  -65 o   55.831   2.6765  127.626   12.145  143.276   13.534   62.892   27.525   59.149   2.8151   38.051   9.0137 21.09737 9.443063 
1 1 1   11    5  -64 o   95.190   2.0590  369.783   15.976  369.489   17.808  370.997   36.171   95.137   2.2963   94.978   4.6864 0.1588593 5.218712 
1 1 1   11    5  -63 o   67.614   2.3811  186.866   13.103  187.606   14.511  183.598   30.495   67.727   2.6335   66.574   5.6734 1.152847 6.254789 
1 1 1   11    5  -62 o  127.757   1.5775  665.687   16.429  689.365   19.354  604.643   31.076  129.994   1.8265  121.595   3.1379 8.399010 3.630771 
1 1 1   11    5  -61 o  127.434   1.5864  662.317   16.479  653.489   19.204  686.973   32.095  126.566   1.8614  129.669   3.0364 -3.103218 3.561548 
1 1 1   11    5  -60 o   44.268   1.9487   80.102   7.0146   72.091   10.422   86.737   9.4848   41.895   3.0730   46.025   2.5380 -4.129589 3.985535 
1 1 1   11    5  -59 o  140.458   1.4545  804.490   16.653  833.011   25.200  782.377   22.189  142.883   2.1636  138.486   1.9656 4.397232 2.923137 
1 1 1   11    5  -58 o  219.302   1.6836  1961.41   30.096  1993.65   44.118  1933.36   41.160  221.018   2.4488  217.666   2.3198 3.352554 3.373121 
1 1 1   11    5  -57 o  125.354   1.4632  640.735   14.952  641.833   19.394  639.128   23.476  125.442   1.8967  125.154   2.3011 0.2872391 2.982010 
1 1 1   11    5  -56 o   82.277   1.5415  276.038   10.339  272.363   15.358  279.083   13.981   81.670   2.3093   82.687   2.0758 -1.016838 3.105145 
1 1 1   11    5  -55 o   11.547   4.7704   1.4671   7.2955   7.1186   11.525  -2.3112   9.4238   16.169   6.2155   11.748   5.1483 4.421421 8.070793 
1 1 1   11    5  -54 o  186.430   1.9421  1417.58   29.514  1402.61   46.752  1427.50   38.055  185.340   3.0945  187.037   2.4960 -1.696625 3.975694 
1 1 1   11    5  -53 o   32.220   3.5375   42.919   9.1384   45.366   11.948   39.471   14.185   32.988   4.5656   30.507   5.9178 2.481287 7.474269 
1 1 1   11    5  -52 o  182.149   1.4738  1352.80   21.883  1381.68   30.276  1321.22   31.666  184.051   2.0180  179.969   2.1585 4.081558 2.954912 
1 1 1   11    5  -51 o   92.286   1.4222  347.240   10.699  341.280   15.020  353.378   15.243   91.474   2.0144   93.081   2.0090 -1.607269 2.844974 
1 1 1   11    5  -50 o  194.658   1.4906  1544.96   23.652  1549.39   32.350  1539.88   34.668  194.905   2.0362  194.295   2.1890 0.6100922 2.989576 
1 1 1   11    5  -49 o  188.515   1.5445  1449.01   23.734  1437.74   34.043  1459.66   33.105  187.740   2.2245  189.172   2.1469 -1.431427 3.091509 
1 1 1   11    5  -48 o   96.941   1.4686  383.154   11.605  394.860   18.113  375.002   15.115   98.387   2.2585   95.892   1.9337 2.495316 2.973187 
1 1 1   11    5  -47 o  115.019   1.4451  539.375   13.549  559.444   17.503  509.373   21.401  117.128   1.8333  111.744   2.3495 5.383453 2.980067 
1 1 1   11    5  -46 o  224.846   1.6952  2061.43   31.070  2060.23   39.465  2063.40   50.392  224.750   2.1541  224.872   2.7491 -0.1221924 3.492529 
1 1 1   11    5  -45 o  204.871   1.7257  1711.44   28.819  1730.25   38.646  1687.88   43.255  205.958   2.3019  203.397   2.6089 2.560394 3.479240 
1 1 1   11    5  -44 o  180.686   1.6095  1331.14   23.706  1368.47   37.642  1306.59   30.518  183.152   2.5213  178.989   2.0917 4.163040 3.275962 
1 1 1   11    5  -43 o   72.601   1.5986  214.905   9.4605  207.129   15.410  219.609   11.985   71.202   2.6597   73.356   2.0062 -2.153389 3.331500 
1 1 1   11    5  -42 o  133.535   1.4813  726.999   16.124  740.912   25.720  717.990   20.696  134.775   2.3411  132.691   1.9134 2.084076 3.023570 
1 1 1   11    5  -41 o  118.966   1.4679  577.008   14.235  528.456   22.179  611.015   18.562  113.823   2.3905  122.411   1.8603 -8.587692 3.029015 
1 1 1   11    5  -40 o  193.500   1.6588  1526.62   26.164  1520.72   40.874  1530.71   34.055  193.074   2.5971  193.734   2.1565 -0.6602325 3.375695 
1 1 1   11    5  -39 o  263.915   1.9631  2840.25   42.231  2905.63   66.412  2795.86   54.719  266.838   3.0533  261.797   2.5641 5.041077 3.987126 
1 1 1   11    5  -38 o  177.769   1.5974  1288.44   23.148  1272.68   35.996  1299.56   30.227  176.635   2.5000  178.514   2.0772 -1.878296 3.250374 
1 1 1   11    5  -37 o  315.358   2.2243  4055.93   57.180  4043.51   87.992  4065.01   75.228  314.737   3.4297  315.637   2.9239 -0.9008179 4.506901 
1 1 1   11    5  -36 o   80.890   1.6283  266.771   10.737  267.121   19.112  266.609   12.978   80.861   2.9043   80.859   1.9690 0.2296448E-02 3.508815 
1 1 1   11    5  -35 o  117.799   1.6852  565.776   16.182  640.598   27.357  525.509   20.069  125.313   2.6782  113.517   2.1689 11.79619 3.446239 
1 1 1   11    5  -34 o  286.754   2.4403  3353.83   57.041  3224.95   88.329  3446.03   74.707  281.038   3.8557  290.599   3.1538 -9.560394 4.981216 
1 1 1   11    5  -33 o  269.229   2.3333  2956.18   51.208  2959.67   81.683  2953.93   65.727  269.253   3.7217  269.069   2.9967 0.1834412 4.778175 
1 1 1   11    5  -32 o  259.623   2.2755  2748.88   48.157  2715.94   76.158  2770.82   62.161  257.943   3.6221  260.606   2.9262 -2.662689 4.656380 
1 1 1   11    5  -31 o   96.829   1.5056  382.232   11.884  344.527   18.644  408.031   15.422   91.874   2.4918  100.035   1.8913 -8.161118 3.128282 
1 1 1   11    5  -30 o   66.148   1.6917  178.511   9.1143  197.039   15.397  168.516   11.309   69.448   2.7251   64.248   2.1624 5.199997 3.478775 
1 1 1   11    5  -29 o  439.240   3.1490  7872.10  112.749  8121.26  202.344  7759.90  135.782  445.611   5.5705  435.984   3.8206 9.627136 6.754862 
1 1 1   11    5  -28 f  219.521   1.9184  1964.86   34.329  2058.91   63.623  1926.24   40.773  224.609   3.4750  217.333   2.3015 7.275909 4.168045 
1 1 1   11    5  -27 o  250.687   2.0706  2562.54   42.311  2487.32   74.042  2599.02   51.559  246.856   3.6796  252.437   2.5056 -5.580994 4.451679 
1 1 1   11    5  -26 o  128.946   1.6348  677.872   17.184  674.229   32.724  679.258   20.191  128.551   3.1229  129.071   1.9191 -0.5202179 3.665435 
1 1 1   11    5  -25 o  503.450   3.2794 10342.05  134.582 10379.67  206.923 10314.47  177.176  503.981   5.0368  502.570   4.3249 1.410919 6.638829 
1 1 1   11    5  -24 o   52.333   1.9992  111.833   8.5129  101.288   14.250  117.684   10.615   49.694   3.5411   53.664   2.4330 -3.969833 4.296377 
1 1 1   11    5  -23 o  250.345   1.9085  2555.30   38.947  2469.78   58.975  2621.45   51.865  246.058   2.9403  253.531   2.5096 -7.472824 3.865707 
1 1 1   11    5  -22 o  419.505   2.7982  7178.23   95.687  7136.71  146.178  7209.37  126.574  418.072   4.2894  420.293   3.6945 -2.221558 5.661111 
1 1 1   11    5  -21 o  105.928   1.5029  457.426   12.977  459.442   20.941  456.169   16.535  106.142   2.4204  105.775   1.9177 0.3675537 3.087977 
1 1 1   11    5  -20 o  251.983   1.9129  2588.80   39.292  2586.99   60.804  2590.11   51.486  251.833   2.9620  252.015   2.5063 -0.1815948 3.880058 
1 1 1   11    5  -19 f  123.528   1.4981  622.053   15.085  619.216   24.137  623.871   19.323  123.226   2.4029  123.700   1.9163 -0.4743500 3.073488 
1 1 1   11    5  -18 o  119.672   1.4902  583.821   14.537  572.386   23.190  591.225   18.658  118.475   2.4012  120.421   1.9008 -1.945717 3.062492 
1 1 1   11    5  -17 o  121.796   1.3888  604.711   13.788  595.582   19.988  612.998   19.045  120.861   2.0288  122.619   1.9054 -1.757141 2.783298 
1 1 1   11    5  -16 o  127.832   1.3952  666.129   14.538  671.637   21.264  661.295   19.922  128.347   2.0325  127.357   1.9190 0.9895172 2.795255 
1 1 1   11    5  -15 o  187.589   1.6320  1434.57   24.955  1469.83   39.203  1410.55   32.357  189.850   2.5332  185.997   2.1342 3.852692 3.312356 
1 1 1   11    5  -14 o   68.228   1.6801  189.772   9.3442  197.383   15.081  185.030   11.905   69.519   2.6662   67.330   2.1720 2.189400 3.438890 
1 1 1   11    5  -13 o  132.920   1.4979  720.222   16.230  718.178   25.495  721.616   21.045  132.713   2.3567  133.040   1.9406 -0.3271484 3.052857 
1 1 1   11    5  -12 o  393.873   2.6498  6326.56   85.075  6372.90  131.132  6292.88  111.796  395.158   4.0710  392.740   3.4921 2.418304 5.363559 
1 1 1   11    5  -11 o  127.344   1.4188  661.051   14.728  682.196   21.653  642.846   20.091  129.353   2.0535  125.569   1.9628 3.784256 2.840699 
1 1 1   11    5  -10 o  351.801   2.2658  5046.35   64.978  5015.25   91.819  5077.55   91.966  350.643   3.2124  352.815   3.1977 -2.172302 4.532671 
1 1 1   11    5   -9 o  290.778   2.1080  3447.30   49.964  3434.86   66.214  3463.75   76.143  290.214   2.7989  291.404   3.2055 -1.190094 4.255509 
1 1 1   11    5   -8 o  338.175   2.3527  4663.10   64.854  4632.79   85.604  4703.94   99.362  337.019   3.1160  339.556   3.5898 -2.536316 4.753588 
1 1 1   11    5   -7 o   43.542   2.5961   77.587   9.1724   81.792   11.451   70.060   15.321   44.668   3.1655   41.166   4.6470 3.502140 5.622684 
1 1 1   11    5   -6 o  131.048   1.7708  700.120   18.916  708.856   24.494  687.209   29.775  131.853   2.2789  129.811   2.8139 2.042343 3.621000 
1 1 1   11    5   -5 o   82.022   1.5848  274.250   10.596  297.537   16.734  258.665   13.690   85.389   2.4066   79.623   2.1111 5.765450 3.201276 
1 1 1   11    5   -4 o  249.344   1.8915  2534.66   38.446  2540.83   58.995  2530.11   50.687  249.602   2.8996  249.095   2.4963 0.5069580 3.826104 
1 1 1   11    5   -3 o  276.908   2.0267  3126.16   45.746  3180.43   70.882  3087.42   59.889  279.243   3.1140  275.156   2.6701 4.086884 4.101984 
1 1 1   11    5   -2 o  276.799   2.0271  3123.69   45.738  3045.51   68.816  3185.55   61.216  273.258   3.0895  279.494   2.6869 -6.235962 4.094420 
1 1 1   11    5   -1 o  230.475   1.9544  2165.60   36.718  2185.61   64.507  2156.01   44.658  231.470   3.4188  229.949   2.3825 1.521561 4.167087 
1 1 1   11    5    0 o  204.104   1.7036  1698.26   28.344  1748.79   44.163  1662.87   36.961  207.088   2.6162  201.950   2.2452 5.137650 3.447535 
1 1 1   11    5    1 o   93.052   1.6576  352.979   12.573  359.229   18.434  347.541   17.193   93.831   2.4121   92.324   2.2846 1.506599 3.322275 
1 1 1   11    5    2 o  146.707   1.6319  877.387   19.516  907.521   28.441  850.574   26.828  149.189   2.3387  144.434   2.2787 4.755188 3.265281 
1 1 1   11    5    3 o  106.581   1.6104  463.078   13.991  460.996   20.278  464.969   19.328  106.330   2.3396  106.790   2.2204 -0.4593658 3.225461 
1 1 1   11    5    4 o   69.300   1.8225  195.923   10.287  201.587   15.071  190.984   14.075   70.260   2.6362   68.390   2.5291 1.870018 3.653170 
1 1 1   11    5    5 o  355.462   2.8837  5153.06   83.557  5145.49  107.925  5164.37  132.017  355.126   3.7282  355.685   4.5533 -0.5592041 5.884946 
1 1 1   11    5    6 o  358.175   2.9009  5232.09   84.698  5208.79  109.108  5267.42  134.357  357.301   3.7462  359.210   4.5885 -1.909058 5.923552 
1 1 1   11    5    7 o  162.977   1.8448  1082.86   24.508  1078.59   31.829  1089.08   38.410  162.641   2.4008  163.414   2.8835 -0.7732849 3.752106 
1 1 1   11    5    8 o  246.186   2.2198  2471.14   44.546  2499.29   58.166  2431.22   69.275  247.551   2.8825  244.121   3.4812 3.430344 4.519716 
1 1 1   11    5    9 o   45.278   3.4844   84.129   12.761   84.129   12.761   0.0000   0.0000   45.278   3.4844  ?   ?  0.000000 3.484359 
1 1 1   11    5   10 o  171.334   2.0980  1196.86   29.300  1211.12   34.156  1157.14   57.012  172.341   2.4314  168.381   4.1538 3.960052 4.813023 
1 1 1   11    5   11 o  217.868   2.0907  1935.30   37.129  1986.19   48.570  1863.73   57.594  220.689   2.6999  213.746   3.3055 6.943176 4.268032 
1 1 1   11    5   12 o  195.072   1.9748  1551.44   31.402  1525.21   40.318  1591.91   50.068  193.395   2.5575  197.553   3.1091 -4.158478 4.025858 
1 1 1   11    5   13 o  101.511   1.6296  420.075   13.484  430.655   24.092  415.250   16.271  102.717   2.8803  100.921   1.9779 1.795982 3.494001 
1 1 1   11    5   14 o   92.067   1.6528  345.552   12.404  355.701   22.269  340.987   14.936   93.340   2.9305   91.452   2.0035 1.888405 3.549934 
1 1 1   11    5   15 o  150.165   1.6465  919.279   20.154  943.272   35.845  908.188   24.371  152.076   2.8916  149.249   2.0032 2.827118 3.517705 
1 1 1   11    5   16 o  168.939   1.6950  1163.52   23.342  1178.32   41.235  1156.54   28.315  169.965   2.9762  168.421   2.0625 1.544052 3.621025 
1 1 1   11    5   17 o  147.073   1.6438  881.812   19.707  866.936   28.160  896.090   27.589  145.808   2.3693  148.242   2.2831 -2.434097 3.290269 
1 1 1   11    5   18 o  128.696   1.6131  675.210   16.923  714.455   24.866  641.354   23.096  132.367   2.3046  125.414   2.2592 6.953194 3.227240 
1 1 1   11    5   19 f  204.815   1.8420  1710.28   30.753  1702.46   43.807  1717.88   43.182  204.313   2.6303  205.239   2.5811 -0.9261017 3.685202 
1 1 1   11    5   20 o  232.068   1.9701  2195.83   37.268  2165.58   52.658  2226.18   52.753  230.421   2.8035  233.625   2.7701 -3.203842 3.941220 
1 1 1   11    5   21 o  185.855   1.7714  1408.26   26.836  1437.92   38.755  1380.95   37.196  187.771   2.5320  184.016   2.4797 3.754562 3.544022 
1 1 1   11    5   22 o   82.707   1.7555  278.886   11.835  291.643   17.548  268.239   16.030   84.525   2.5497   81.066   2.4286 3.459412 3.521278 
1 1 1   11    5   23 o  191.295   1.7893  1491.95   27.902  1528.77   40.357  1458.24   38.618  193.609   2.5572  189.093   2.5054 4.515839 3.579983 
1 1 1   11    5   24 o   64.722   1.9446  170.953   10.248  153.188   15.022  186.416   14.015   61.204   3.0204   67.559   2.5495 -6.355377 3.952523 
1 1 1   11    5   25 o  255.896   2.0883  2670.12   43.560  2673.01   61.974  2667.30   61.240  255.975   2.9701  255.704   2.9380 0.2709808 4.177777 
1 1 1   11    5   26 o  189.685   1.7836  1466.96   27.578  1481.35   39.545  1453.34   38.479  190.579   2.5455  188.772   2.5006 1.807587 3.568308 
1 1 1   11    5   27 o  127.961   1.7698  667.593   18.460  661.263   29.560  671.640   23.636  127.319   2.8482  128.335   2.2594 -1.016006 3.635553 
1 1 1   11    5   28 f  228.549   2.1376  2130.01   39.824  2123.91   63.340  2134.00   51.212  228.133   3.4061  228.725   2.7467 -0.5923920 4.375609 
1 1 1   11    5   29 o  149.638   1.8124  912.952   22.107  914.205   35.498  912.158   28.255  149.697   2.9091  149.555   2.3177 0.1418304 3.719460 
1 1 1   11    5   30 o  214.957   2.0687  1884.16   36.248  1869.28   57.521  1893.97   46.683  214.026   3.2970  215.481   2.6578 -1.454941 4.234859 
1 1 1   11    5   31 o  250.443   2.9006  2558.84   59.215   0.0000   0.0000  2558.84   59.215  ?   ?   250.443   2.9006 0.000000 2.900615 
1 1 1   11    5   32 o  121.873   1.9691  605.646   19.562  571.678   40.173  616.204   22.397  118.239   4.1746  122.923   2.2352 -4.683464 4.735378 
1 1 1   11    5   33 o  318.253   3.4204  4133.87   88.733  4204.01  156.955  4100.93  107.574  320.476   6.0082  316.876   4.1647 3.600525 7.310468 
1 1 1   11    5   34 o   58.935   2.8012  142.019   13.419  156.930   25.859  136.524   15.698   61.735   5.1865   57.740   3.3496 3.994450 6.174100 
1 1 1   11    5   35 o  128.026   2.2572  668.461   23.556  691.675   42.829  658.392   28.206  130.076   4.0442  127.039   2.7237 3.036842 4.875914 
1 1 1   11    5   36 o  160.204   2.0437  1046.61   26.689  1050.31   38.437  1043.17   37.086  160.442   2.9390  159.901   2.8452 0.5406799 4.090608 
1 1 1   11    5   37 o  136.106   1.7754  755.329   19.697  754.361   31.626  755.942   25.176  135.975   2.8533  136.144   2.2685 -0.1687469 3.645255 
1 1 1   11    5   38 o  220.462   2.0935  1982.10   37.623  1966.91   59.660  1992.13   48.477  219.519   3.3341  220.978   2.6912 -1.459396 4.284723 
1 1 1   11    5   39 o  221.241   2.1006  1996.16   37.883  2040.54   61.191  1968.57   48.240  223.585   3.3574  219.666   2.6941 3.919830 4.304675 
1 1 1   11    5   40 o  239.987   2.1984  2348.91   43.005  2304.32   67.726  2379.04   55.669  237.580   3.4971  241.470   2.8282 -3.890091 4.497623 
1 1 1   11    5   41 o   52.167   2.3488  111.226   9.9624  101.127   16.530  116.988   12.485   49.583   4.1271   53.468   2.8751 -3.884903 5.029811 
1 1 1   11    5   42 o   68.022   2.0085  188.855   11.125  199.283   18.635  183.081   13.867   69.794   3.2847   66.943   2.5458 2.851341 4.155722 
1 1 1   11    5   43 o   42.576   2.7025   74.255   9.3307   92.006   15.921   64.969   11.515   47.270   4.1749   39.727   3.5948 7.542980 5.509281 
1 1 1   11    5   44 o  109.990   1.7773  493.301   15.935  466.006   25.443  510.918   20.440  106.821   2.9247  111.921   2.2405 -5.099991 3.684278 
1 1 1   11    5   45 o  116.525   1.7838  553.677   16.943  521.676   27.228  573.900   21.645  113.022   2.9580  118.618   2.2385 -5.596092 3.709519 
1 1 1   11    5   46 o  147.379   1.8214  885.723   21.881  851.271   34.756  908.344   28.163  144.424   2.9523  149.225   2.3153 -4.801453 3.751833 
1 1 1   11    5   47 o   71.499   1.9932  208.651   11.606  225.509   19.740  199.744   14.348   74.250   3.2694   69.925   2.5213 4.324371 4.128684 
1 1 1   11    5   48 o  116.266   1.7855  551.237   16.922  514.953   27.096  574.437   21.667  112.285   2.9630  118.670   2.2399 -6.385155 3.714379 
1 1 1   11    5   49 o   96.331   1.8294  378.423   14.365  392.106   24.072  370.855   17.903   97.964   3.0181   95.347   2.3034 2.616585 3.796639 
1 1 1   11    5   50 o  112.176   1.8323  513.165   16.754  501.559   27.342  520.143   21.201  110.804   3.0301  112.917   2.3033 -2.113693 3.806129 
1 1 1   11    5   51 o   54.576   2.4565  121.775   10.900  141.549   18.951  111.998   13.325   58.715   3.9830   52.281   3.1413 6.434425 5.072677 
1 1 1   11    5   52 o  108.431   1.7922  479.479   15.841  475.257   24.099  482.692   21.019  107.875   2.7428  108.770   2.3707 -0.8945389 3.625385 
1 1 1   11    5   53 o   38.717   3.6287   61.782   11.319   90.736   22.025   51.391   13.194   46.661   5.9239   35.123   4.7286 11.53826 7.579752 
1 1 1   11    5   54 o  103.984   3.3403  442.084   28.276   0.0000   0.0000  442.084   28.276  ?   ?   103.984   3.3403 0.000000 3.340256 
1 1 1   11    5   55 o  108.050   2.7578  476.847   24.270  492.743   31.269  452.758   38.493  109.768   3.4991  105.096   4.5037 4.671623 5.703276 
1 1 1   11    5   56 o   63.041   3.0249  162.650   15.499  157.646   18.530  174.302   28.278   61.999   3.6831   64.985   5.3865 -2.986515 6.525336 
1 1 1   11    5   57 o   89.793   2.4602  329.287   17.990  324.434   21.435  340.850   33.088   89.088   2.9558   91.147   4.4670 -2.059418 5.356372 
1 1 1   11    5   58 o  121.595   1.8803  603.095   18.638  575.733   25.846  632.734   26.900  118.757   2.6700  124.499   2.6507 -5.741585 3.762296 
1 1 1   11    5   59 o  117.272   1.7280  560.924   16.518  559.435   25.236  562.041   21.850  117.061   2.6447  117.358   2.2840 -0.2969894 3.494416 
1 1 1   11    5   60 o   12.295   5.0557   1.9150   8.1441  -1.0097   14.599   3.2364   9.8129   15.213   6.5378   13.821   5.5999 1.392351 8.608232 
1 1 1   11    5   61 o  107.958   1.7325  475.402   15.246  469.843   23.375  479.518   20.112  107.266   2.6734  108.393   2.2763 -1.126968 3.511189 
1 1 1   11    5   62 o   88.851   1.8113  322.047   13.118  327.297   20.580  318.454   17.026   89.470   2.8254   88.294   2.3677 1.175873 3.686352 
1 1 1   11    5   63 o   31.854   3.6476   42.050   9.3005   30.298   19.571   45.479   10.570   26.923   8.1894   33.091   3.9998 -6.167608 9.113935 
1 1 1   11    5   64 o  118.333   1.7000  571.217   16.398  570.277   24.940  571.932   21.764  118.168   2.5891  118.368   2.2556 -0.2002869 3.433865 
1 1 1   11    5   65 o   61.479   2.0822  154.441   10.420  137.779   16.998  164.471   13.189   57.909   3.6190   63.407   2.5569 -5.498184 4.431118 
1 1 1   11    5   66 o   44.374   2.5395   80.691   9.1474   81.507   15.868   80.285   11.195   44.352   4.4492   44.200   3.1273 0.1520271 5.438339 
1 1 1   11    5   67 o   55.525   2.0259  126.008   9.1542  131.182   14.021  122.164   12.085   56.557   3.0527   54.608   2.7236 1.948635 4.091055 
1 1 1   11    5   68 f   50.224   2.1522  103.173   8.7908   88.440   13.268  114.702   11.737   46.341   3.5391   52.906   2.7307 -6.565201 4.470147 
1 1 1   11    5   69 o   78.358   1.8020  250.567   11.510  249.755   15.744  251.501   16.869   78.148   2.4746   78.402   2.6433 -0.2543030 3.620903 
1 1 1   11    5   70 o   59.755   2.2038  146.021   10.716  141.104   16.709  149.457   13.967   58.585   3.5149   60.388   2.8454 -1.802551 4.522263 
1 1 1   11    5   71 o  115.126   1.6772  540.864   15.739  548.664   20.651  530.054   24.312  115.903   2.1858  113.868   2.6193 2.034584 3.411516 
1 1 1   11    5   72 o   64.251   1.9698  168.717   10.305  152.095   14.466  185.839   14.682   60.897   2.9227   67.360   2.6793 -6.462456 3.964952 
1 1 1   11    5   73 o   76.880   1.5978  241.202   10.013  240.015   15.920  241.980   12.880   76.573   2.5541   76.944   2.0553 -0.3717422 3.278389 
1 1 1   11    5   74 o  198.477   1.7072  1608.05   27.620  1625.11   44.893  1597.66   35.035  199.277   2.7636  197.740   2.1736 1.537552 3.515989 
1 1 1   11    5   75 o  187.855   1.6700  1440.60   25.572  1519.11   42.826  1397.09   31.880  192.650   2.7271  184.907   2.1151 7.742981 3.451163 
1 1 1   11    5   76 o   37.465   2.2204   57.583   6.7507   92.762   16.754   50.764   7.3759   47.228   4.4026   35.124   2.5945 12.10319 5.110238 
1 1 1   11    5   77 o  112.198   1.4062  513.742   12.861  496.664   20.602  524.647   16.463  110.197   2.2935  113.337   1.7820 -3.140366 2.904423 
1 1 1   11    5   78 f  117.110   1.6389  560.060   15.646  559.620   23.960  560.387   20.658  116.912   2.5141  117.061   2.1649 -0.1484070 3.317804 
1 1 1   11    5   79 o   33.968   3.4796   47.947   9.4986   38.655   11.702   65.896   16.264   30.147   4.9321   39.490   5.1771 -9.342773 7.150367 
1 1 1   11    5   80 o   55.606   2.8673  127.213   12.953  127.213   12.953   0.0000   0.0000   55.606   2.8673  ?   ?  0.000000 2.867266 
1 1 1   11    5   81 o   56.627   2.2291  131.482   10.269  134.796   12.715  125.265   17.415   57.251   2.7325   54.924   3.9154 2.327175 4.774637 
1 1 1   11    5   82 o   11.353   4.8413   0.1312   7.8927   11.970   10.118 -18.2703   12.614   17.433   5.9426   10.456   5.0307 6.977315 7.786069 
1 1 1   11    5   83 o   26.514   3.9252   29.717   8.2273   26.276   10.447   35.337   13.350   24.566   5.3674   28.423   5.9532 -3.856962 8.015610 
1 1 1   11    5   84 o   40.152   2.6737   66.544   8.7012   63.868   11.214   70.594   13.794   39.144   3.5530   41.000   4.1860 -1.856396 5.490547 
1 1 1   11    5   85 o   22.912   4.4530   22.633   8.0171   16.740   10.310   31.649   12.751   19.695   5.9339   26.776   5.9920 -7.081100 8.433021 
1 1 1   11    5   86 o   9.6635   4.4087  -4.6771   7.6996 -10.9118   9.9101   4.8177   12.230   9.8716   4.6673   15.336   6.2377 -5.464438 7.790536 
1 1 1   11    5   87 o   76.410   1.9366  239.431   12.053  239.865   16.454  238.929   17.705   76.275   2.6504   76.054   2.8609 0.2209396 3.899922 
1 1 1   11    5   88 o   15.231   5.3463   8.9465   8.2140   2.7748   11.090   16.448   12.226   14.051   5.8499   19.707   6.5311 -5.655503 8.767924 
1 1 1   11    5   89 o   49.906   2.4179  102.765   9.8070   95.507   13.559  110.726   14.201   47.784   3.5056   51.506   3.4015 -3.721500 4.884577 
1 1 1   11    5   90 o   21.383   4.5550   20.018   7.6964   6.2033   10.108   39.079   11.873   14.727   5.7759   29.920   5.0475 -15.19250 7.670622 
1 1 1   11    5   91 o   31.524   3.1709   41.686   8.0375   27.731   10.488   61.542   12.511   24.984   5.3135   38.042   4.0991 -13.05816 6.710896 
1 1 1   11    5   92 f   38.176   2.7072   60.595   8.3699   60.030   10.951   61.388   12.979   37.713   3.6062   37.882   4.2780 -0.1693726 5.595182 
1 1 1   11    5   93 o   46.380   2.6872   89.359   10.116   96.989   12.986   77.583   16.132   48.087   3.3336   42.357   4.7542 5.729099 5.806468 
1 1 1   11    5   94 o   20.826   4.8271   19.317   8.0344   6.7323   9.8844   43.824   13.793   14.717   5.7291   31.278   5.6163 -16.56079 8.022863 
1 1 1   11    5   95 o   21.084   4.5164   19.675   7.5285   8.6306   9.8141   35.469   11.736   15.439   5.7811   28.159   5.3074 -12.71944 7.847911 
1 1 1   11    5   96 o   61.406   1.9077  155.270   9.5374  153.989   12.383  157.137   14.953   60.930   2.4986   61.317   3.0008 -0.3866501 3.904819 
1 1 1   11    5   97 o   40.301   2.5483   67.603   8.3287   61.426   10.784   76.734   13.112   38.051   3.5165   42.411   3.8340 -4.360149 5.202418 
1 1 1   11    5   98 o   47.325   2.2546   92.791   8.6727   79.800   11.130  112.867   13.837   43.536   3.1578   51.741   3.2978 -8.204922 4.565870 
1 1 1   11    5   99 f   16.166   5.0448   11.541   7.3696   14.168   9.7390   8.0227   11.273   17.831   5.8252   15.573   6.1021 2.257924 8.436090 
1 1 1   11    5  100 f   24.967   4.1577   27.390   8.1641   11.115   11.312   45.087   11.795   16.716   6.2170   31.906   4.6738 -15.19008 7.777863 
1 1 1   11    5  101 o   22.384   5.1734   23.038   9.2502   22.890   11.321   23.337   16.045   21.950   6.1056   21.931   7.4832 0.1941872E-01 9.658027 
1 1 1   11    5  102 o   66.233   2.2453  182.302   12.104  183.428   15.219  180.362   19.970   66.063   2.8327   64.732   3.8014 1.331261 4.740700 
1 1 1   11    5  103 o   32.984   3.6693   47.164   9.6989   50.891   12.070   40.370   16.295   33.795   4.4925   28.309   7.0802 5.485823 8.385206 
1 1 1   11    5  104 f   11.565   4.8118   2.5529   7.4970  -3.1117   9.8630   10.304   11.537   11.178   5.0563   16.127   6.2137 -4.949085 8.010984 
1 1 1   11    5  105 o   14.583   5.1455   9.1396   7.6158   10.065   9.9186   7.8096   11.887   15.552   5.8142   15.254   6.1697 0.2980471 8.477640 
1 1 1   11    5  106 o   27.390   3.7198   33.076   8.0906   25.934   10.462   43.701   12.761   23.135   5.6070   30.440   5.3372 -7.305555 7.741045 
1 1 1   11    5  107 o   15.116   5.1855   10.338   7.7068   3.5396   9.9624   20.470   12.162   12.984   5.4838   20.047   6.5068 -7.063362 8.509377 
1 1 1   11    5  108 o   12.843   5.1839   5.2052   8.3735   0.3792   11.309   11.061   12.458   12.589   5.5732   16.199   6.3942 -3.610149 8.482182 
1 1 1   11    5  109 o   13.437   5.2499   6.8290   8.3238   5.0812   11.250   8.9433   12.373   13.817   5.8311   15.367   6.2652 -1.549808 8.558887 
1 1 1   11    5  110 o   14.916   5.2409   10.265   7.8946   10.542   10.187   9.8490   12.492   15.404   5.8626   15.617   6.3216 -0.2130785 8.621663 
1 1 1   11    5  111 o   12.867   5.1272   5.8423   8.0817   4.7855   10.451   7.4146   12.747   13.351   5.6265   14.877   6.2384 -1.526180 8.400856 
1 1 1   11    5  112 o   20.726   4.9439   20.892   8.2351   17.035   10.767   26.329   12.783   18.157   6.1309   21.997   6.6031 -3.840353 9.010450 
1 1 1   11    5  113 o   28.221   3.7415   35.907   8.3950   40.210   10.948   29.765   13.079   29.054   4.7894   23.340   6.5882 5.713881 8.145076 
1 1 1   11    5  114 o   23.210   5.4646   27.195   10.167   18.150   16.196   33.077   13.060   18.344   7.2749   24.750   6.4197 -6.405800 9.702438 
1 1 1   11    5  115 f   25.729   6.0559   34.748   12.488   36.763   17.520   32.666   17.806   24.384   7.8004   22.818   7.8798 1.565691 11.08775 
1 1 1   11    5  116 o   22.644   6.4003   28.096   12.335   21.710   17.067   35.079   17.849   19.265   7.5200   23.547   7.8934 -4.282551 10.90215 
1 1 1   11    5  117 o   10.445   5.0002 -10.5957   12.115 -11.2708   16.958  -9.8921   17.312   12.340   5.9100   12.647   6.0335 -0.3067636 8.445776 
1 1 1   11    5  118 o   23.063   6.8828   30.746   13.920   33.471   17.422   25.935   23.148   22.900   7.7981   19.907   8.3806 2.993530 11.44745 
1 1 1   11    5  119 o   24.768   6.3015   33.582   12.751   27.507   17.685   40.160   18.402   20.705   7.7590   24.805   7.9999 -4.100101 11.14450 
1 1 1   11    5  120 o   8.9314   4.4114 -19.8079   11.692 -26.1264   16.301 -13.1141   16.778   10.345   5.1275   11.928   5.7550 -1.583196 7.707867 
1 1 1   11    5  121 o   22.327   7.0626   29.890   14.396   36.093   17.583   17.276   25.074   23.535   7.8333   18.061   8.1254 5.473785 11.28643 
1 1 1   11    5  122 o   18.874   7.5273   21.506   17.434   21.506   17.434   0.0000   0.0000   18.874   7.5273  ?   ?  0.000000 7.527312 
1 1 1   11    6 -120 o   15.516   6.1205   11.588   11.407   12.202   14.797   10.688   17.910   16.123   6.7382   16.173   7.0920 -0.5000114E-01 9.782632 
1 1 1   11    6 -119 o   15.369   5.8840   11.583   10.301   14.397   12.762   6.3233   17.447   16.585   6.4945   15.162   6.8029 1.423749 9.405194 
1 1 1   11    6 -118 f   19.837   6.0234   21.553   10.594   8.5507   13.165   45.438   17.844   14.809   6.2815   26.826   7.7357 -12.01719 9.964808 
1 1 1   11    6 -117 o   16.046   5.9165   13.137   10.205   4.8103   12.786   27.750   16.938   13.760   6.0141   20.842   7.6328 -7.081729 9.717523 
1 1 1   11    6 -116 o   12.914   5.7482   2.0016   12.195  -2.6941   17.323   6.6143   17.170   13.639   6.3596   15.286   6.8115 -1.647028 9.318801 
1 1 1   11    6 -115 o   16.874   6.4518   14.802   12.374   32.683   17.843  -1.7637   17.174   22.494   7.8809   13.788   6.3957 8.706416 10.14959 
1 1 1   11    6 -114 o   17.707   6.5592   16.868   12.568   16.469   18.062   17.243   17.500   17.765   7.4359   17.931   7.3961 -0.1657391 10.48783 
1 1 1   11    6 -113 o   15.139   6.3437   8.8500   13.167  -4.7368   20.429   18.504   17.221   14.338   6.7552   18.343   7.4233 -4.005070 10.03683 
1 1 1   11    6 -112 o   10.608   5.0777 -10.9992   12.483  -1.3190   18.902 -18.4863   16.623   14.491   6.7178   11.401   5.5534 3.089796 8.716010 
1 1 1   11    6 -111 o   29.101   5.8737   43.344   13.452   17.952   19.635   65.805   18.468   18.466   7.7428   34.966   6.7235 -16.49997 10.25461 
1 1 1   11    6 -110 o   11.566   5.3188  -3.5109   11.509  -3.2443   16.003  -3.7966   16.564   13.411   6.2047   13.506   6.2707 -0.9459496E-01 8.821559 
1 1 1   11    6 -109 o   13.589   5.5892   6.1025   9.9559  -1.6634   12.347   20.536   16.833   12.376   5.6216   19.302   7.4869 -6.925740 9.362445 
1 1 1   11    6 -108 o   14.601   5.7838   8.5772   10.226   8.6599   12.647   8.4213   17.376   15.226   6.2847   16.232   7.0541 -1.006021 9.447678 
1 1 1   11    6 -107 o   13.684   5.4230   6.9863   8.9938   9.1958   10.769   1.8935   16.350   15.018   5.9398   14.657   6.5803 0.3612480 8.864656 
1 1 1   11    6 -106 o   11.360   5.0405  -0.3920   9.3014  -6.2291   11.405   11.203   16.074   11.092   5.1679   16.857   7.0323 -5.764646 8.727041 
1 1 1   11    6 -105 o   32.938   3.5695   47.693   9.4307   38.588   11.142   70.696   17.709   28.669   4.9464   38.004   5.9084 -9.335026 7.705554 
1 1 1   11    6 -104 o   24.195   5.3097   28.002   10.184   23.016   12.903   36.239   16.585   21.132   6.6865   25.826   7.4609 -4.694279 10.01870 
1 1 1   11    6 -103 o   21.609   5.1509   22.138   8.9443   19.947   10.808   26.898   15.933   20.094   6.0802   22.484   7.4559 -2.389130 9.620832 
1 1 1   11    6 -102 o   18.303   4.5529   15.454   6.7649   17.270   10.690   14.241   8.7369   18.910   6.0972   17.410   5.5013 1.500565 8.212216 
1 1 1   11    6 -101 o   14.389   4.8094   9.0438   6.6267   9.5974   10.390   8.6641   8.6039   15.572   5.9222   14.674   5.4287 0.8982172 8.033845 
1 1 1   11    6 -100 f   17.977   4.4999   14.719   6.5779   1.6467   10.152   24.179   8.6358   12.725   5.4599   23.021   4.7593 -10.29647 7.242989 
1 1 1   11    6  -99 o   26.367   3.6406   30.160   7.6163   39.900   10.519   19.428   11.042   29.987   4.4371   20.229   6.1508 9.758303 7.584266 
1 1 1   11    6  -98 o   17.053   5.0383   13.178   7.4890   12.560   10.169   13.911   11.071   17.020   5.9503   17.771   6.2091 -0.7519360 8.599977 
1 1 1   11    6  -97 o   27.557   3.6404   32.716   7.9775   38.211   10.676   25.769   12.004   29.372   4.6107   23.343   6.2034 6.028793 7.729182 
1 1 1   11    6  -96 o   18.747   4.4702   15.731   6.7346   8.8566   10.231   20.986   8.9458   15.544   5.8849   21.459   5.1747 -5.914415 7.836437 
1 1 1   11    6  -95 o   10.343   4.4422   0.1961   6.7329  -6.8542   10.382   5.3129   8.8449   10.828   5.0053   13.588   5.3801 -2.759613 7.348415 
1 1 1   11    6  -94 o   36.008   2.5020   53.978   7.2981   58.002   11.278   51.078   9.5728   36.839   3.8105   34.705   3.4286 2.134651 5.125954 
1 1 1   11    6  -93 o   35.323   2.5975   52.003   7.4266   58.314   11.238   47.110   9.8956   36.976   3.7815   33.225   3.7174 3.751442 5.302756 
1 1 1   11    6  -92 o   27.241   3.1896   31.395   6.9487   19.982   10.434   40.493   9.3151   20.923   5.8767   30.768   3.7943 -9.844963 6.995191 
1 1 1   11    6  -91 o   36.352   2.5322   54.924   7.4566   59.712   11.255   51.179   9.9547   37.500   3.7314   34.755   3.5643 2.745609 5.160182 
1 1 1   11    6  -90 o   55.489   1.8879  126.633   8.5269  130.464   12.749  123.532   11.470   56.023   2.8006   54.590   2.5850 1.433102 3.811192 
1 1 1   11    6  -89 o   15.687   5.2584   10.186   7.9211   1.3365   10.485   21.952   12.090   13.163   5.5953   21.980   6.3761 -8.817883 8.483063 
1 1 1   11    6  -88 o   51.629   2.2430  109.916   9.4170  109.698   12.501  110.202   14.318   51.344   3.0001   51.295   3.4443 0.4812241E-01 4.567642 
1 1 1   11    6  -87 o   15.455   5.4309   9.3305   8.4776  -0.3290   10.591   26.555   14.143   12.770   5.5286   24.116   6.8657 -11.34635 8.814901 
1 1 1   11    6  -86 o   48.474   2.5367   97.100   9.9884   97.493   12.608   96.436   16.369   48.372   3.2157   47.723   4.2522 0.6488113 5.331221 
1 1 1   11    6  -85 o   45.640   2.6147   86.114   9.6868   84.078   12.178   89.623   15.985   44.891   3.3520   46.018   4.3116 -1.126350 5.461285 
1 1 1   11    6  -84 o   78.997   2.1127  256.240   13.592  247.674   17.753  268.373   21.129   77.441   2.8171   80.453   3.2284 -3.011620 4.284644 
1 1 1   11    6  -83 o   29.315   4.0948   36.482   9.5182   49.101   12.781   20.767   14.262   33.879   4.7589   21.915   7.0406 11.96422 8.498099 
1 1 1   11    6  -82 o   14.488   5.6058   6.0822   9.4194   6.9862   12.641   4.9538   14.124   16.262   6.4342   16.256   6.6684 0.5889893E-02 9.266447 
1 1 1   11    6  -81 o   28.299   3.3742   33.534   7.6305   37.183   11.255   30.430   10.381   29.434   4.8604   26.533   4.9824 2.900749 6.960461 
1 1 1   11    6  -80 o   45.309   2.3564   84.409   8.6733   78.293   12.500   90.087   12.045   43.385   3.5660   46.648   3.1867 -3.263130 4.782402 
1 1 1   11    6  -79 o   96.541   1.7645  381.079   13.886  374.767   20.693  386.249   18.728   95.510   2.6605   97.071   2.3669 -1.561546 3.560928 
1 1 1   11    6  -78 o   75.518   2.0517  233.530   12.618  225.230   21.156  238.112   15.721   73.824   3.5258   76.162   2.5358 -2.337402 4.342981 
1 1 1   11    6  -77 o   68.223   2.0195  190.539   11.218  193.619   17.163  188.242   14.823   68.574   3.0783   67.695   2.6916 0.8797989 4.089063 
1 1 1   11    6  -76 o   15.439   5.5892   8.3738   9.0451   12.209   16.217   6.6421   10.898   19.539   7.4062   15.521   6.0231 4.017405 9.546127 
1 1 1   11    6  -75 o   55.051   2.3400  124.247   10.477  121.820   15.959  126.086   13.888   54.286   3.6273   55.338   3.0911 -1.051266 4.765767 
1 1 1   11    6  -74 o  107.779   1.7670  474.487   15.525  489.277   23.153  462.406   20.926  109.308   2.5985  106.298   2.4150 3.009903 3.547453 
1 1 1   11    6  -73 o   68.957   2.1891  194.605   12.289  183.427   16.115  210.139   18.997   66.829   2.9656   71.482   3.2689 -4.652893 4.413708 
1 1 1   11    6  -72 o   32.271   3.6664   43.328   9.4741   36.758   13.682   49.379   13.132   29.217   5.9474   34.242   4.8393 -5.025555 7.667486 
1 1 1   11    6  -71 o   83.506   1.7997  284.731   12.251  289.721   17.109  279.480   17.550   84.127   2.4976   82.609   2.6096 1.518097 3.612190 
1 1 1   11    6  -70 o  114.574   1.6318  535.783   15.240  513.453   20.531  563.189   22.744  112.091   2.2470  117.376   2.3772 -5.284882 3.271054 
1 1 1   11    6  -69 o   61.828   2.0413  156.293   10.274  155.572   14.376  157.045   14.688   61.590   2.8713   61.875   2.9205 -0.2848854 4.095520 
1 1 1   11    6  -68 o   67.935   1.9045  188.569   10.536  191.716   14.555  185.104   15.271   68.426   2.6143   67.212   2.7935 1.214310 3.826002 
1 1 1   11    6  -67 o   44.207   2.7617   80.227   9.9020   96.379   13.299   60.129   14.834   48.388   3.3931   37.902   4.9171 10.48677 5.974165 
1 1 1   11    6  -66 o  160.809   1.7704  1055.34   23.206  1061.44   29.219  1044.93   38.193  161.211   2.2235  159.832   2.9314 1.379700 3.679288 
1 1 1   11    6  -65 o  150.999   1.7392  930.404   21.407  946.569   27.115  903.658   34.879  152.252   2.1848  148.658   2.8783 3.594162 3.613593 
1 1 1   11    6  -64 o   25.910   3.1957   27.878   6.6065   26.493   12.037   28.476   7.9034   24.837   6.0108   26.087   3.8306 -1.250158 7.127625 
1 1 1   11    6  -63 o  131.760   1.4422  708.109   15.490  705.549   23.211  710.164   20.799  131.458   2.1660  131.911   1.9343 -0.4521637 2.904012 
1 1 1   11    6  -62 o  117.175   1.4430  560.007   13.783  551.156   20.893  566.827   18.340  116.189   2.2060  117.855   1.9090 -1.665222 2.917323 
1 1 1   11    6  -61 o  126.241   1.5382  650.046   15.829  647.748   22.601  652.258   22.175  125.966   2.2011  126.408   2.1521 -0.4422455 3.078371 
1 1 1   11    6  -60 o   17.241   4.4854   12.642   6.3627   26.916   10.040   3.0598   8.2255   25.156   5.0714   12.792   5.1469 12.36404 7.225603 
1 1 1   11    6  -59 o   80.624   1.4557  265.102   9.5669  269.577   13.783  260.942   13.289   81.249   2.0829   79.939   2.0411 1.309570 2.916230 
1 1 1   11    6  -58 o  133.045   1.3580  721.819   14.728  717.888   20.372  726.123   21.316  132.650   1.8841  133.403   1.9602 -0.7532043 2.718837 
1 1 1   11    6  -57 o   74.656   1.7191  227.346   10.462  236.950   15.708  219.691   14.025   76.139   2.5344   73.325   2.3494 2.813324 3.455881 
1 1 1   11    6  -56 o  165.732   1.6081  1120.25   21.724  1125.71   26.336  1108.62   38.428  166.109   1.9450  164.748   2.8615 1.361099 3.459945 
1 1 1   11    6  -55 o  206.754   1.6233  1743.41   27.358  1741.21   35.289  1746.72   43.312  206.579   2.0956  206.849   2.5687 -0.2702637 3.315110 
1 1 1   11    6  -54 o   50.472   2.0251  104.094   8.3149  102.435   12.065  105.594   11.475   49.993   2.9741   50.778   2.7830 -0.7850037 4.073138 
1 1 1   11    6  -53 o   76.709   1.5941  239.965   9.9680  232.804   13.475  248.619   14.814   75.505   2.1916   78.020   2.3320 -2.514999 3.200204 
1 1 1   11    6  -52 f   52.583   1.8855  112.925   8.0686  112.490   11.693  113.321   11.148   52.422   2.7460   52.627   2.6068 -0.2051201 3.786266 
1 1 1   11    6  -51 o  100.934   1.6841  415.467   13.856  401.351   18.122  435.334   21.499   99.183   2.2415  103.280   2.5536 -4.097847 3.397878 
1 1 1   11    6  -50 o  118.738   1.6616  574.936   16.082  583.541   21.343  563.634   24.461  119.599   2.1893  117.522   2.5534 2.077621 3.363426 
1 1 1   11    6  -49 o  108.546   2.1706  480.654   19.206  452.189   32.140  496.464   23.953  105.121   3.7568  110.292   2.6643 -5.170441 4.605637 
1 1 1   11    6  -48 o   95.860   1.7231  374.744   13.465  365.271   21.773  380.610   17.134   94.553   2.8281   96.591   2.1761 -2.038193 3.568392 
1 1 1   11    6  -47 o  170.807   1.5649  1189.65   21.788  1121.22   30.903  1257.29   30.724  165.779   2.2869  175.560   2.1469 -9.781509 3.136732 
1 1 1   11    6  -46 o  138.243   1.4903  779.242   16.794  744.190   24.122  812.213   23.395  135.067   2.1909  141.113   2.0339 -6.046494 2.989459 
1 1 1   11    6  -45 o  318.105   2.2808  4128.06   59.143  4131.92   91.963  4125.34   77.232  318.046   3.5472  317.896   2.9804 0.1491699 4.633116 
1 1 1   11    6  -44 o   50.714   1.9855  105.054   8.1921  127.487   12.920   89.974   10.594   55.817   2.8492   46.871   2.7853 8.945824 3.984438 
1 1 1   11    6  -43 o  184.356   1.5468  1385.78   23.246  1393.11   33.796  1379.19   32.024  184.802   2.2435  183.884   2.1364 0.9184570 3.098019 
1 1 1   11    6  -42 o  120.977   1.4155  596.698   13.958  576.695   20.402  614.301   19.139  118.909   2.1048  122.732   1.9130 -3.823486 2.844311 
1 1 1   11    6  -41 o  125.962   1.4190  646.879   14.570  610.421   21.046  680.435   20.192  122.337   2.1105  129.170   1.9177 -6.833435 2.851591 
1 1 1   11    6  -40 o  160.734   1.4722  1053.33   19.289  1044.95   27.931  1060.98   26.670  160.062   2.1407  161.291   2.0285 -1.229401 2.949156 
1 1 1   11    6  -39 o  206.503   1.7238  1738.82   29.016  1677.45   44.318  1784.87   38.388  202.760   2.6814  209.185   2.2513 -6.425400 3.501166 
1 1 1   11    6  -38 o  148.648   1.5446  900.904   18.716  927.505   29.940  883.841   23.978  150.786   2.4358  147.216   1.9982 3.570557 3.150546 
1 1 1   11    6  -37 o  419.223   2.8031  7171.34   95.788  7082.59  145.758  7238.81  127.084  416.295   4.2953  421.008   3.7031 -4.713226 5.671208 
1 1 1   11    6  -36 o  187.285   1.6520  1430.15   25.220  1371.48   38.634  1473.72   33.292  183.350   2.5850  190.090   2.1486 -6.739929 3.361322 
1 1 1   11    6  -35 o  105.831   1.5108  456.645   13.033  500.670   21.633  431.560   16.329  110.788   2.3954  102.873   1.9473 7.915741 3.087082 
1 1 1   11    6  -34 o  339.503   2.5581  4702.09   70.794  4738.88  125.674  4684.99   85.683  340.495   4.5279  338.812   3.1024 1.683441 5.488812 
1 1 1   11    6  -33 o   66.567   1.8895  180.837   10.242  195.027   21.701  176.770   11.618   68.995   3.8741   65.800   2.1689 3.194946 4.439904 
1 1 1   11    6  -32 o   82.342   1.7278  276.455   11.597  251.729   23.403  284.502   13.351   78.432   3.6707   83.527   1.9609 -5.094749 4.161670 
1 1 1   11    6  -31 o  124.010   1.9336  627.106   19.546   0.0000   0.0000  627.106   19.546  ?   ?   124.010   1.9336 0.000000 1.933631 
1 1 1   11    6  -30 o  325.627   2.4706  4325.11   65.578  4296.02   93.169  4353.68   92.319  324.394   3.5234  326.572   3.4680 -2.177856 4.943805 
1 1 1   11    6  -29 o  404.645   3.2135  6682.51  105.995  6673.50  137.663  6695.62  166.113  404.184   4.1783  404.644   5.0361 -0.4606934 6.543756 
1 1 1   11    6  -28 o  143.710   1.6436  842.034   19.254  777.464   27.390  905.114   27.072  138.061   2.4338  148.974   2.2294 -10.91255 3.300524 
1 1 1   11    6  -27 o   70.152   1.9616  200.833   11.206  201.007   15.912  200.661   15.785   70.137   2.7888   70.078   2.7688 0.5912781E-01 3.929816 
1 1 1   11    6  -26 o  176.560   2.1446  1271.29   30.866  1356.32   44.351  1191.42   42.982  182.321   2.9842  170.872   3.0859 11.44887 4.292844 
1 1 1   11    6  -25 o  138.540   1.6086  782.516   18.166  775.984   31.595  785.741   22.203  137.915   2.8104  138.814   1.9622 -0.8990479 3.427663 
1 1 1   11    6  -24 o  120.640   1.5895  593.361   15.631  593.061   27.387  593.506   19.036  120.571   2.7865  120.645   1.9357 -0.7472992E-01 3.392873 
1 1 1   11    6  -23 o  306.587   2.3543  3833.56   58.837  3700.28   99.621  3904.95   72.912  301.014   4.0600  309.377   2.8912 -8.362823 4.984266 
1 1 1   11    6  -22 o  269.850   2.1541  2969.53   47.383  2952.60   81.984  2978.02   58.063  268.931   3.7398  270.198   2.6362 -1.266968 4.575599 
1 1 1   11    6  -21 o   89.325   1.5987  325.300   11.641  316.493   19.127  330.482   14.671   88.044   2.6682   90.026   1.9992 -1.982376 3.334043 
1 1 1   11    6  -20 o  315.361   2.2382  4055.78   57.536  4018.67   88.174  4083.29   75.929  313.791   3.4472  316.362   2.9443 -2.571625 4.533434 
1 1 1   11    6  -19 o  135.008   1.5311  743.087   16.850  707.048   26.401  767.856   21.887  131.665   2.4599  137.228   1.9567 -5.562469 3.143191 
1 1 1   11    6  -18 o  159.727   1.5696  1040.12   20.436  1067.19   32.685  1022.74   26.185  161.758   2.4788  158.372   2.0283 3.386307 3.202912 
1 1 1   11    6  -17 o   71.301   1.7149  207.270   9.9671  211.856   16.432  204.600   12.537   72.011   2.8048   70.799   2.1748 1.211235 3.549172 
1 1 1   11    6  -16 o  143.585   1.6537  840.541   19.355  835.270   34.766  842.908   23.300  143.085   2.9807  143.778   1.9880 -0.6923065 3.582854 
1 1 1   11    6  -15 o  287.527   2.2740  3371.42   53.297  3234.97   73.803  3520.12   77.048  281.568   3.2156  293.716   3.2181 -12.14731 4.549282 
1 1 1   11    6  -14 o  216.129   1.9214  1904.61   33.851  1889.56   48.179  1919.28   47.572  215.228   2.7462  216.917   2.6904 -1.689545 3.844440 
1 1 1   11    6  -13 o  113.585   1.6752  525.990   15.510  548.558   23.060  507.346   20.960  115.976   2.4392  111.538   2.3053 4.437706 3.356246 
1 1 1   11    6  -12 o  118.257   1.5436  570.123   14.880  580.103   20.185  558.245   22.021  119.275   2.0761  117.000   2.3089 2.275108 3.105006 
1 1 1   11    6  -11 o   86.610   1.5566  305.815   10.989  329.247   17.174  289.569   14.300   89.822   2.3476   84.270   2.0818 5.551941 3.137675 
1 1 1   11    6  -10 o  171.605   1.7103  1200.61   23.924  1211.47   34.069  1190.04   33.604  172.353   2.4249  170.822   2.4133 1.530319 3.421146 
1 1 1   11    6   -9 o  264.999   2.3225  2863.78   50.169  2772.50   77.268  2930.31   65.965  260.634   3.6369  268.007   3.0195 -7.373138 4.726983 
1 1 1   11    6   -8 o  112.927   1.5900  519.897   14.636  514.098   24.806  522.994   18.128  112.267   2.7106  113.255   1.9636 -0.9877777 3.347054 
1 1 1   11    6   -7 o   71.254   1.7725  207.000   10.295  201.399   17.324  210.058   12.801   70.196   3.0347   71.739   2.1917 -1.542885 3.743376 
1 1 1   11    6   -6 o   77.331   1.7197  243.810   10.840  251.791   18.590  239.698   13.344   78.511   2.9098   76.640   2.1380 1.870483 3.610825 
1 1 1   11    6   -5 o  185.583   1.6283  1404.11   24.633  1373.47   37.315  1427.77   32.794  183.514   2.4945  187.121   2.1500 -3.607361 3.293130 
1 1 1   11    6   -4 o  171.899   1.7095  1204.72   23.954  1200.79   33.938  1208.61   33.814  171.593   2.4263  172.152   2.4096 -0.5586090 3.419537 
1 1 1   11    6   -3 f   84.023   1.8731  287.842   12.829  297.080   20.838  282.203   16.280   85.284   3.0021   83.151   2.4044 2.132393 3.846278 
1 1 1   11    6   -2 o  131.795   1.6222  708.140   17.427  696.202   24.618  720.131   24.673  130.661   2.3114  132.889   2.2778 -2.227615 3.245121 
1 1 1   11    6   -1 o  212.756   2.0623  1845.68   35.765  1954.78   58.715  1781.32   45.097  218.880   3.2909  208.984   2.6473 9.895905 4.223478 
1 1 1   11    6    0 o  228.889   2.1433  2136.29   39.989  2119.83   63.151  2147.31   51.668  227.925   3.3990  229.443   2.7625 -1.518311 4.380037 
1 1 1   11    6    1 o   79.675   1.6349  258.802   10.618  263.303   16.256  255.452   14.023   80.312   2.4861   79.119   2.1763 1.192642 3.304079 
1 1 1   11    6    2 o  252.044   1.9127  2590.13   39.297  2590.70   60.147  2589.70   51.907  252.009   2.9279  251.988   2.5270 0.2069092E-01 3.867656 
1 1 1   11    6    3 f   57.517   1.9062  135.033   8.9249  136.719   13.874  133.843   11.657   57.817   2.9537   57.232   2.5047 0.5842590 3.872683 
1 1 1   11    6    4 o  182.258   1.6241  1354.24   24.129  1327.02   36.664  1375.03   32.047  180.384   2.4935  183.633   2.1409 -3.249512 3.286502 
1 1 1   11    6    5 o   77.526   1.7826  245.042   11.265  244.046   16.226  245.968   15.651   77.311   2.5784   77.621   2.4768 -0.3095322 3.575254 
1 1 1   11    6    6 o  195.836   1.8093  1563.65   28.883  1578.34   41.170  1549.41   40.531  196.720   2.5674  194.910   2.5511 1.810486 3.619348 
1 1 1   11    6    7 o  214.210   1.8924  1870.88   33.043  1834.61   46.518  1907.82   46.946  212.083   2.6908  216.275   2.6629 -4.191940 3.785655 
1 1 1   11    6    8 o  125.870   1.6299  645.914   16.724  626.773   29.052  655.400   20.452  123.955   2.8753  126.783   1.9790 -2.828003 3.490476 
1 1 1   11    6    9 o  204.146   1.8456  1699.19   30.712  1664.05   52.911  1717.05   37.717  201.950   3.2141  205.197   2.2549 -3.247314 3.926218 
1 1 1   11    6   10 o   29.729   3.4534   36.552   8.2133   43.206   14.743   33.557   9.8902   32.004   5.8675   28.328   4.4278 3.675215 7.350739 
1 1 1   11    6   11 o  203.111   1.7029  1681.92   28.194  1670.93   43.136  1690.12   37.252  202.403   2.6145  203.582   2.2448 -1.178680 3.445931 
1 1 1   11    6   12 o   33.847   3.0698   47.124   8.3776   50.188   12.329   44.495   11.419   34.773   4.4516   32.716   4.3927 2.056614 6.253968 
1 1 1   11    6   13 o  192.035   1.6601  1503.47   25.986  1533.59   40.352  1482.13   33.968  193.909   2.5529  190.646   2.1858 3.263351 3.360759 
1 1 1   11    6   14 o  105.324   1.5086  452.236   12.952  466.544   20.350  442.494   16.792  106.958   2.3341  104.174   1.9775 2.784531 3.059163 
1 1 1   11    6   15 o  175.823   1.7375  1260.39   24.902  1242.84   35.130  1278.11   35.305  174.565   2.4688  177.026   2.4466 -2.460922 3.475703 
1 1 1   11    6   16 o  132.252   1.6385  713.086   17.663  696.260   24.835  730.310   25.127  130.663   2.3317  133.820   2.3035 -3.157806 3.277649 
1 1 1   11    6   17 o  184.799   1.9443  1392.48   29.288  1407.51   46.677  1382.72   37.615  185.734   3.0830  184.124   2.5062 1.609390 3.973129 
1 1 1   11    6   18 o  174.322   1.9090  1239.05   27.126  1285.64   43.574  1209.57   34.662  177.514   3.0114  172.211   2.4692 5.302704 3.894240 
1 1 1   11    6   19 o   39.673   2.7155   64.504   8.7287   76.291   13.071   55.016   11.727   43.067   3.7610   36.488   4.0086 6.578476 5.496683 
1 1 1   11    6   20 o   70.412   1.8503  202.286   10.611  197.929   15.481  206.148   14.572   69.603   2.7338   71.048   2.5201 -1.445045 3.718168 
1 1 1   11    6   21 o  252.123   2.0732  2592.09   42.609  2544.21   59.928  2641.03   60.593  249.721   2.9440  254.430   2.9216 -4.709122 4.147632 
1 1 1   11    6   22 o  186.029   1.7760  1411.00   26.931  1396.95   38.268  1424.79   37.907  185.064   2.5367  186.902   2.4881 -1.837784 3.553276 
1 1 1   11    6   23 o  236.684   2.1835  2284.50   42.127  2267.76   66.812  2295.55   54.277  235.712   3.4773  237.212   2.8070 -1.499924 4.468842 
1 1 1   11    6   24 o  129.722   1.7923  686.128   18.952  651.342   30.287  708.514   24.297  126.349   2.9407  131.806   2.2614 -5.456932 3.709631 
1 1 1   11    6   25 o  149.714   1.8260  913.928   22.285  909.591   36.032  916.615   28.359  149.309   2.9605  149.915   2.3206 -0.6066284 3.761617 
1 1 1   11    6   26 o  169.548   1.8852  1172.15   26.054  1203.95   42.426  1152.90   33.013  171.771   3.0300  168.126   2.4089 3.645737 3.870890 
1 1 1   11    6   27 o  210.113   2.2926  1800.54   39.267  1838.18   56.893  1766.31   54.264  212.223   3.2887  208.040   3.1998 4.182632 4.588539 
1 1 1   11    6   28 o  156.229   2.4167  995.536   30.777  995.536   30.777   0.0000   0.0000  156.229   2.4167  ?   ?  0.000000 2.416720 
1 1 1   11    6   29 o   70.192   2.0256  201.085   11.577  198.787   15.691  203.831   17.152   69.748   2.7653   70.614   2.9866 -0.8658066 4.070239 
1 1 1   11    6   30 o  229.924   2.1478  2155.95   40.255  2158.20   52.493  2152.74   62.721  229.994   2.7999  229.652   3.3505 0.3426971 4.366365 
1 1 1   11    6   31 o  115.513   1.6358  544.036   15.402  542.575   22.342  545.358   21.263  115.335   2.3764  115.635   2.2558 -0.2997055 3.276558 
1 1 1   11    6   32 o   70.647   2.0003  203.694   11.508  186.774   18.320  214.721   14.789   67.562   3.3369   72.509   2.5060 -4.946968 4.173098 
1 1 1   11    6   33 o  139.330   1.7964  791.565   20.403  811.648   33.049  779.197   25.935  141.037   2.8747  138.217   2.3019 2.819977 3.682770 
1 1 1   11    6   34 o  253.689   2.2819  2624.98   47.188  2579.90   73.987  2655.90   61.266  251.363   3.6109  255.117   2.9461 -3.753616 4.660253 
1 1 1   11    6   35 o  286.439   2.4748  3346.97   57.785  3273.34   90.326  3397.98   75.183  283.084   3.9143  288.529   3.1967 -5.444458 5.053785 
1 1 1   11    6   36 o  217.226   2.0951  1924.46   37.099  1886.25   58.535  1950.11   47.962  214.953   3.3407  218.624   2.6913 -3.670517 4.289899 
1 1 1   11    6   37 o  118.667   1.7949  574.216   17.362  601.471   28.419  557.986   21.931  121.406   2.8717  116.960   2.3003 4.445465 3.679358 
1 1 1   11    6   38 o  100.978   1.8228  415.792   15.004  417.725   24.769  414.672   18.857  101.124   3.0082  100.827   2.2943 0.2971115 3.783238 
1 1 1   11    6   39 o  148.675   1.8347  901.379   22.235  902.367   35.907  900.764   28.317  148.695   2.9624  148.600   2.3377 0.9443665E-01 3.773685 
1 1 1   11    6   40 o   90.964   1.8626  337.430   13.811  339.424   22.907  336.292   17.311   91.137   3.0878   90.766   2.3417 0.3710022 3.875334 
1 1 1   11    6   41 o   27.341   4.1726   31.247   9.0051   39.277   15.339   27.023   11.124   30.381   6.3963   25.199   5.5644 5.182404 8.477913 
1 1 1   11    6   42 o  181.737   1.9428  1346.98   28.782  1355.08   46.303  1341.87   36.743  182.195   3.1177  181.357   2.4854 0.8379517 3.987149 
1 1 1   11    6   43 o  116.689   1.8144  555.273   17.259  595.480   28.856  532.879   21.535  120.787   2.9307  114.292   2.3115 6.494171 3.732580 
1 1 1   11    6   44 o   38.935   3.1293   62.288   9.8480   50.145   16.552   68.942   12.253   34.461   6.1164   40.912   3.7144 -6.451607 7.155912 
1 1 1   11    6   45 o  185.683   1.9825  1406.21   30.007  1442.17   48.832  1384.40   38.034  187.938   3.1876  184.197   2.5331 3.741226 4.071527 
1 1 1   11    6   46 o   65.111   2.2887  173.170   12.128  195.698   21.030  161.942   14.846   69.104   3.7474   62.919   2.9025 6.184326 4.739983 
1 1 1   11    6   47 o  231.412   2.8221  2185.91   53.235   0.0000   0.0000  2185.91   53.235  ?   ?   231.412   2.8221 0.000000 2.822107 
1 1 1   11    6   48 o  113.109   2.1499  521.904   19.822  535.420   42.439  518.132   22.417  114.296   4.5643  112.685   2.4405 1.610458 5.175803 
1 1 1   11    6   49 o   95.033   2.3746  368.495   18.395  348.988   30.554  379.585   23.038   92.298   4.0710   96.381   2.9358 -4.082932 5.019175 
1 1 1   11    6   50 o  230.771   2.5265  2173.26   47.526  2188.37   70.804  2160.86   64.117  231.397   3.7537  229.992   3.4200 1.404984 5.078066 
1 1 1   11    6   51 o   85.708   2.1328  299.678   14.901  296.844   21.531  302.282   20.642   85.201   3.1054   85.993   2.9492 -0.7916870 4.282657 
1 1 1   11    6   52 f   45.327   3.5024   84.452   12.840   92.760   17.256   74.146   19.220   47.391   4.5217   42.124   5.7471 5.267193 7.312635 
1 1 1   11    6   53 o  137.392   1.7372  769.887   19.456  774.417   29.333  766.329   25.997  137.737   2.6126  137.038   2.3273 0.6993408 3.498857 
1 1 1   11    6   54 o   74.097   1.9532  224.128   11.787  219.980   19.012  226.718   15.022   73.309   3.1891   74.488   2.4775 -1.178627 4.038382 
1 1 1   11    6   55 o   64.470   2.0979  169.765   11.010  171.940   18.125  168.492   13.861   64.765   3.4457   64.186   2.6550 0.5791245 4.349874 
1 1 1   11    6   56 o   70.990   1.9934  205.777   11.524  208.554   18.631  204.056   14.666   71.365   3.2109   70.651   2.5507 0.7134323 4.100714 
1 1 1   11    6   57 o   72.973   2.3879  217.607   14.185  215.968   18.966  219.687   21.370   72.621   3.2118   73.201   3.5924 -0.5806427 4.818803 
1 1 1   11    6   58 o  145.742   1.9843  866.679   23.574  843.270   30.661  900.527   36.869  143.701   2.6175  148.448   3.0468 -4.747330 4.016772 
1 1 1   11    6   59 o   66.672   2.5020  181.761   13.573  183.075   18.323  180.163   20.206   66.824   3.3747   66.242   3.7575 0.5818176 5.050494 
1 1 1   11    6   60 o   52.178   2.3797  111.388   10.095  113.729   16.798  110.065   12.630   52.550   3.9504   51.807   3.0036 0.7430763 4.962630 
1 1 1   11    6   61 o   56.590   2.2363  130.942   10.295  126.721   17.053  133.362   12.915   55.501   3.7921   57.062   2.7849 -1.560963 4.704901 
1 1 1   11    6   62 o   89.818   1.7999  329.174   13.178  349.153   21.022  316.241   16.913   92.389   2.7946   87.969   2.3608 4.419563 3.658270 
1 1 1   11    6   63 o   42.151   2.9047   72.979   9.9194   78.746   20.458   71.207   11.342   43.286   5.9557   41.577   3.3756 1.709728 6.845797 
1 1 1   11    6   64 o   77.615   1.8809  245.857   11.900  273.803   19.396  228.986   15.070   81.780   2.9142   74.828   2.4741 6.951897 3.822839 
1 1 1   11    6   65 o  170.245   1.9585  1183.08   27.180  1188.04   36.515  1176.92   40.700  170.498   2.6273  169.639   2.9433 0.8588562 3.945364 
1 1 1   11    6   66 o   38.010   3.0945   59.507   9.5050   65.947   15.644   55.739   11.967   39.728   4.9370   36.633   4.0765 3.095062 6.402539 
1 1 1   11    6   67 o   70.963   1.9232  205.727   11.115  198.308   15.113  214.466   16.403   69.594   2.6690   72.363   2.7860 -2.769104 3.858139 
1 1 1   11    6   68 o  114.244   1.6063  532.599   14.959  523.852   21.135  541.378   21.175  113.232   2.2898  115.115   2.2566 -1.882660 3.214908 
1 1 1   11    6   69 o  272.977   2.4331  3046.01   54.141  3026.21   71.133  3073.28   83.474  271.793   3.2107  273.648   3.7422 -1.855804 4.930751 
1 1 1   11    6   70 o   46.767   2.6335   89.747   9.9986   79.914   21.317   92.520   11.321   43.435   6.1963   47.447   2.9416 -4.011887 6.859064 
1 1 1   11    6   71 o   67.441   1.9858  185.950   10.905  187.099   18.477  185.336   13.509   67.456   3.3710   67.274   2.4676 0.1819763 4.177648 
1 1 1   11    6   72 o   47.093   2.3199   90.904   8.8784   80.567   14.886   96.610   11.061   44.033   4.1981   48.490   2.8104 -4.457005 5.051967 
1 1 1   11    6   73 o   73.435   1.8173  220.269   10.879  202.927   16.863  232.632   14.238   70.301   2.9491   75.382   2.3198 -5.080681 3.752191 
1 1 1   11    6   74 o   17.301   4.5224   12.827   6.4481   6.5467   12.233   15.243   7.5878   16.128   6.3454   18.834   4.8972 -2.706701 8.015456 
1 1 1   11    6   75 o   70.874   1.5743  205.110   9.0951  198.532   15.271  208.726   11.322   69.552   2.6986   71.435   1.9462 -1.882736 3.327229 
1 1 1   11    6   76 o   29.753   2.1332   36.396   5.1393   50.935   12.008   33.136   5.6864   34.837   4.3213   28.336   2.4871 6.501379 4.985877 
1 1 1   11    6   77 o   88.742   1.5729  321.660   11.378  325.634   16.831  318.316   15.440   89.146   2.3182   88.197   2.1476 0.9489822 3.160060 
1 1 1   11    6   78 o   65.737   2.1499  177.083   11.505  180.310   14.159  170.813   19.737   66.246   2.6273   64.197   3.7885 2.049408 4.610376 
1 1 1   11    6   79 o  116.267   1.7784  552.743   16.855  572.591   20.931  516.135   28.427  118.243   2.1716  111.935   3.1185 6.307457 3.800139 
1 1 1   11    6   80 o   37.340   3.4262   58.025   10.312   74.517   13.585   35.604   15.841   42.209   3.9960   28.280   6.9273 13.92921 7.997231 
1 1 1   11    6   81 o   65.648   2.1079  176.769   11.265  168.395   13.938  192.548   19.132   63.947   2.6798   68.161   3.4547 -4.214146 4.372217 
1 1 1   11    6   82 o   39.743   3.1732   65.613   10.195   51.023   13.356   85.978   15.779   34.545   4.8788   45.189   4.3369 -10.64415 6.527759 
1 1 1   11    6   83 o   37.988   3.2181   60.074   9.8713   61.537   12.990   58.075   15.186   38.161   4.2479   36.733   5.2183 1.428616 6.728685 
1 1 1   11    6   84 o   70.508   2.1538  204.228   12.365  204.042   16.028  204.503   19.433   70.285   2.8031   70.143   3.4089 0.1419296 4.413412 
1 1 1   11    6   85 o   66.219   1.9962  180.043   10.763  189.098   13.879  166.382   17.047   67.720   2.5186   63.245   3.3183 4.474979 4.165911 
1 1 1   11    6   86 o   43.873   2.5780   79.628   9.1793   78.779   11.799   80.929   14.610   43.416   3.3600   43.729   4.1484 -0.3133507 5.338396 
1 1 1   11    6   87 o   21.326   5.1291   20.169   8.8068   24.838   10.516   9.2003   16.116   23.579   5.5618   18.050   7.2244 5.528999 9.117317 
1 1 1   11    6   88 o   54.433   2.3773  122.332   10.523  105.802   12.560  161.254   19.273   50.395   3.0721   61.900   3.8386 -11.50438 4.916540 
1 1 1   11    6   89 o   31.245   3.9142   41.638   9.7510   33.372   12.063   57.220   16.563   27.300   5.6085   35.827   5.8748 -8.527008 8.122061 
1 1 1   11    6   90 o   11.886   4.9587   1.8887   7.9925  -2.9120   10.733   7.8652   11.975   12.074   5.3823   16.001   6.2834 -3.926753 8.273496 
1 1 1   11    6   91 o   56.473   2.2078  131.666   10.144  129.371   14.073  134.147   14.634   55.626   3.1160   56.616   3.1838 -0.9893608 4.454900 
1 1 1   11    6   92 o   30.965   3.4887   40.715   8.6526   51.181   12.110   29.799   12.368   34.371   4.4247   25.451   6.0506 8.920183 7.495843 
1 1 1   11    6   93 o   45.384   2.4172   85.446   8.9102   76.567   11.732   97.546   13.696   42.583   3.4084   48.040   3.5220 -5.456585 4.901175 
1 1 1   11    6   94 o   35.335   2.9261   52.387   8.3526   52.995   11.122   51.601   12.650   35.137   3.9515   34.350   4.6360 0.7870712 6.091535 
1 1 1   11    6   95 o   71.747   1.8441  211.950   10.776  209.450   14.140  215.413   16.642   71.050   2.4452   71.831   2.8480 -0.7802963 3.753621 
1 1 1   11    6   96 o   27.479   4.1194   32.920   8.9431   34.131   10.409   29.507   17.478   27.692   4.7842   24.490   7.7861 3.202257 9.138466 
1 1 1   11    6   97 o   28.278   3.9989   34.787   8.9608   23.521   10.497   65.053   17.205   22.482   5.7160   37.725   5.7787 -15.24249 8.128108 
1 1 1   11    6   98 o   13.099   5.2061   4.9816   8.3112   7.2265   9.8222  -0.6778   15.595   14.642   5.7080   14.727   6.5310 -0.8456326E-01 8.673761 
1 1 1   11    6   99 o   67.885   1.8890  190.387   10.443  167.548   13.510  224.286   16.460   63.282   2.6247   73.129   2.7662 -9.846767 3.813258 
1 1 1   11    6  100 f   51.689   2.2003  111.128   9.2497   99.703   12.012  127.772   14.498   48.504   3.0536   54.787   3.2612 -6.282143 4.467598 
1 1 1   11    6  101 o   13.253   5.0662   6.3122   7.6284   2.2229   10.118   11.698   11.612   12.827   5.4759   16.697   6.2807 -3.870108 8.332618 
1 1 1   11    6  102 o   18.637   5.0105   16.299   7.7755   17.667   10.245   14.442   11.941   19.119   5.9453   17.738   6.4217 1.381407 8.751297 
1 1 1   11    6  103 o   10.970   4.8090  -0.1594   8.2291 -12.2758   11.438   12.841   11.848   10.170   4.8660   16.997   6.3545 -6.826541 8.003634 
1 1 1   11    6  104 o   19.297   5.2472   17.885   8.4696   13.432   11.578   23.013   12.423   17.097   6.3023   21.199   6.5391 -4.101072 9.081738 
1 1 1   11    6  105 o   10.852   4.7868  -0.3412   8.2704   4.2825   11.340  -5.5956   12.088   13.716   5.8243   11.623   5.3826 2.093319 7.930603 
1 1 1   11    6  106 o   40.104   2.7056   68.589   8.7928   61.543   11.487   78.561   13.664   37.154   3.8485   41.817   4.0597 -4.663078 5.593983 
1 1 1   11    6  107 o   27.004   3.8302   32.809   8.1950   30.044   10.643   36.835   12.844   24.697   5.4343   26.920   6.0058 -2.223307 8.099452 
1 1 1   11    6  108 o   12.726   5.0557   5.7238   7.8346   15.360   10.389  -6.9826   11.930   17.461   6.0195   11.133   5.2189 6.328167 7.966896 
1 1 1   11    6  109 o   15.171   5.2633   10.865   7.9477   8.0486   10.402   14.815   12.319   14.416   5.7924   17.238   6.4724 -2.822016 8.685783 
1 1 1   11    6  110 o   13.052   5.3015   5.7957   8.8200   15.758   12.437  -4.2840   12.510   17.533   6.5193   11.862   5.4872 5.671309 8.521203 
1 1 1   11    6  111 o   15.074   5.5294   10.643   8.8944   4.0381   12.496   17.424   12.663   13.711   5.9699   18.092   6.6037 -4.381738 8.902229 
1 1 1   11    6  112 o   10.790   5.0989  -7.8992   11.797   8.3141   16.518 -24.7799   16.855   15.749   6.8606   10.827   5.3379 4.922824 8.692542 
1 1 1   11    6  113 o   15.782   6.2593   11.543   11.990   35.859   17.345 -10.7077   16.593   24.009   7.7689   12.332   5.8896 11.67755 9.748995 
1 1 1   11    6  114 o   13.056   5.9849  -1.2391   14.413 -29.2020   26.669   10.298   17.130   13.423   6.6359   16.190   7.0200 -2.766542 9.659998 
1 1 1   11    6  115 o   21.391   6.5742   25.834   12.571   18.502   17.447   33.748   18.128   18.182   7.4296   22.778   7.9461 -4.595423 10.87836 
1 1 1   11    6  116 o   17.221   6.4623   15.861   12.277   1.1978   16.789   32.715   17.999   14.153   6.4771   22.372   7.9089 -8.219407 10.22270 
1 1 1   11    6  117 o   11.419   5.4257  -8.4821   13.714 -15.5755   16.753   5.9281   23.878   11.631   5.6445   16.251   7.5394 -4.620126 9.418273 
1 1 1   11    6  118 f   17.159   6.7565   16.014   13.879   26.937   17.118  -4.9415   23.710   20.444   7.6392   14.764   7.0482 5.680483 10.39395 
1 1 1   11    6  119 o   11.686   5.4971  -5.9937   13.432  -4.6699   16.743  -8.3844   22.500   13.064   6.1427   14.114   6.7720 -1.049844 9.142848 
1 1 1   11    6  120 o   12.490   5.9333  -7.9109   16.386  -8.2950   22.816  -7.5017   23.548   14.231   6.8259   14.483   6.9437 -0.2524357 9.736963 
1 1 1   11    7 -117 o   20.577   6.5399   24.354   12.332   10.418   14.206   66.951   24.837   15.490   6.5456   30.044   9.2423 -14.55388 11.32543 
1 1 1   11    7 -116 o   17.311   6.0662   16.238   10.572   21.555   13.207   6.7501   17.641   19.173   6.7749   15.241   6.8395 3.931351 9.626971 
1 1 1   11    7 -115 f   14.783   5.8677   10.015   10.545   12.325   13.160   5.8714   17.625   15.916   6.4717   15.090   6.7985 0.8258839 9.386304 
1 1 1   11    7 -114 o   10.193   4.8107  -6.8238   10.441 -20.8349   12.993   18.708   17.540   9.4575   4.6674   18.064   7.4229 -8.606199 8.768324 
1 1 1   11    7 -113 o   8.8774   4.3355 -14.5839   10.320 -16.4041   12.981 -11.4569   17.014   9.9971   4.8780   12.265   5.8860 -2.267911 7.644575 
1 1 1   11    7 -112 o   22.625   5.9121   27.217   11.022   22.741   13.851   34.945   18.200   19.759   6.9420   23.137   7.9676 -3.377504 10.56760 
1 1 1   11    7 -111 o   17.445   6.0628   16.042   10.548   3.8968   13.136   38.090   17.698   13.752   6.0507   24.573   7.8376 -10.82051 9.901504 
1 1 1   11    7 -110 o   22.382   6.9338   28.833   13.950   6.2095   16.232   92.768   27.286   15.155   6.6945   37.646   9.0118 -22.49083 11.22627 
1 1 1   11    7 -109 o   11.923   5.4074  -1.2623   11.369   14.577   15.918 -17.7590   16.245   17.213   7.0720   11.325   5.5102 5.888038 8.965289 
1 1 1   11    7 -108 o   9.6124   4.8164 -35.4742   16.130   0.0000   0.0000 -35.4742   16.130  ?   ?    9.6124   4.8164 0.000000 4.816360 
1 1 1   11    7 -107 o   19.106   7.5704   20.251   17.524   0.0000   0.0000   20.251   17.524  ?   ?    19.106   7.5704 0.000000 7.570423 
1 1 1   11    7 -106 o   14.220   6.4908  -0.2788   16.715   0.0000   0.0000  -0.2788   16.715  ?   ?    14.220   6.4908 0.000000 6.490761 
1 1 1   11    7 -105 o   14.648   6.1993   6.6309   12.776   15.537   20.003   0.4953   16.603   18.229   7.7380   14.377   6.5260 3.851944 10.12251 
1 1 1   11    7 -104 o   19.939   5.8948   20.341   10.249   26.995   13.255   10.450   16.162   22.322   6.7288   16.550   6.9869 5.772167 9.700232 
1 1 1   11    7 -103 o   9.6801   4.5242  -6.0477   8.8516  -5.9147   10.592  -6.3558   16.118   10.725   4.9914   13.145   6.1308 -2.419636 7.905759 
1 1 1   11    7 -102 o   10.006   4.6200  -4.6813   8.8085   5.6800   10.700 -26.4632   15.515   13.923   5.7669   10.341   5.1027 3.581923 7.700314 
1 1 1   11    7 -101 o   24.675   3.6916   26.971   7.1973   19.934   10.896   32.419   9.5866   19.974   6.1173   26.555   4.5950 -6.581245 7.650855 
1 1 1   11    7 -100 o   13.168   4.9063   6.7732   7.0510   0.5399   10.676   11.596   9.3906   12.486   5.4754   16.069   5.7095 -3.583450 7.910632 
1 1 1   11    7  -99 o   22.704   4.0334   23.073   7.1911   20.264   10.914   25.228   9.5599   20.322   6.1013   23.141   5.1956 -2.819321 8.013710 
1 1 1   11    7  -98 o   21.491   4.2005   20.778   7.0946   28.372   10.710   14.841   9.4706   24.484   5.5008   17.803   5.7388 6.680632 7.949421 
1 1 1   11    7  -97 o   16.662   4.8439   12.693   6.9704   17.865   10.673   8.8467   9.2043   19.386   6.0743   14.990   5.6015 4.395883 8.262858 
1 1 1   11    7  -96 o   46.479   2.1696   89.748   8.1972   87.773   12.214   91.367   11.058   45.391   3.3240   46.539   2.9297 -1.147190 4.430788 
1 1 1   11    7  -95 o   51.843   2.0165  111.230   8.5055   98.686   12.498  122.053   11.609   48.276   3.1938   54.020   2.6443 -5.743969 4.146467 
1 1 1   11    7  -94 o   30.312   3.0460   38.905   7.4243   31.708   10.721   45.537   10.291   26.430   5.1616   32.413   3.9784 -5.983160 6.516933 
1 1 1   11    7  -93 o   40.860   2.5324   69.617   8.3931   76.232   11.450   61.935   12.339   42.421   3.3382   37.865   4.0610 4.555840 5.256951 
1 1 1   11    7  -92 o   47.442   2.2854   93.313   8.8122   86.446   11.939  101.534   13.062   45.263   3.2575   49.058   3.2853 -3.794228 4.626484 
1 1 1   11    7  -91 o   35.199   3.1382   52.231   8.9099   55.151   11.217   47.239   14.666   35.862   3.8999   32.227   5.7959 3.635906 6.985824 
1 1 1   11    7  -90 o   62.831   1.9701  162.701   10.078  163.254   13.409  161.983   15.278   62.667   2.6307   62.229   3.0209 0.4379272 4.005801 
1 1 1   11    7  -89 o   16.014   5.2817   10.934   7.9988  -0.7980   9.9810   31.995   13.373   12.151   5.3123   26.247   6.3255 -14.09593 8.260258 
1 1 1   11    7  -88 o   31.563   3.3387   42.118   8.4601   52.453   10.892   26.398   13.432   35.055   3.8763   23.801   6.6618 11.25352 7.707486 
1 1 1   11    7  -87 o   37.794   2.6659   59.444   8.1602   67.781   11.438   50.802   11.645   40.067   3.5385   34.374   4.2462 5.692207 5.527275 
1 1 1   11    7  -86 o   46.841   2.3008   90.662   8.7582   98.931   12.346   82.285   12.427   48.659   3.1291   44.231   3.4745 4.428532 4.675862 
1 1 1   11    7  -85 o   25.924   3.7673   28.712   7.7281   28.436   11.087   28.972   10.778   25.199   5.5481   25.507   5.3544 -0.3087959 7.710472 
1 1 1   11    7  -84 o   12.956   4.9770   5.1278   7.3868   15.424   10.595  -4.6091   10.304   18.874   6.0688   11.435   5.1707 7.439219 7.972866 
1 1 1   11    7  -83 o   38.695   2.6299   62.068   8.2461   77.580   11.880   47.648   11.455   43.047   3.4136   33.384   4.3097 9.662712 5.497874 
1 1 1   11    7  -82 o   41.926   2.4905   72.650   8.4732   61.336   11.807   84.665   12.167   38.133   3.8510   45.033   3.3382 -6.899860 5.096487 
1 1 1   11    7  -81 o   42.120   2.6261   73.376   8.9715   83.058   13.637   65.987   11.912   44.484   3.7971   39.636   3.7308 4.847450 5.323247 
1 1 1   11    7  -80 o   68.662   2.0023  193.449   11.195  212.631   17.242  179.469   14.720   71.709   2.9560   65.937   2.7446 5.772278 4.033697 
1 1 1   11    7  -79 o   35.118   3.1113   51.312   8.8144   41.780   13.367   58.647   11.725   30.975   5.4951   37.354   3.9085 -6.378914 6.743318 
1 1 1   11    7  -78 o   31.353   3.3570   41.086   8.4462   33.448   12.951   46.738   11.142   27.548   5.9423   33.244   4.2055 -5.695999 7.279900 
1 1 1   11    7  -77 o   38.433   2.8296   61.094   8.8024   62.237   13.371   60.219   11.694   38.421   4.3454   37.925   3.8354 0.4954529 5.795937 
1 1 1   11    7  -76 o   50.197   2.1832  103.425   8.9117  111.712   12.457   94.737   12.755   52.025   2.9494   47.820   3.2921 4.205280 4.420106 
1 1 1   11    7  -75 o   72.680   1.9051  216.236   11.277  215.276   14.434  217.741   18.068   72.415   2.4487   72.684   3.0564 -0.2688980 3.916364 
1 1 1   11    7  -74 o   48.952   2.2591   98.343   8.9904  106.479   12.533   89.720   12.903   50.803   3.0404   46.540   3.4252 4.263226 4.579989 
1 1 1   11    7  -73 o   41.204   2.5826   69.867   8.6306   74.665   12.012   64.748   12.408   42.435   3.5039   39.410   3.9141 3.025459 5.253377 
1 1 1   11    7  -72 o   61.665   2.0023  155.648   10.051  158.167   13.882  152.872   14.572   62.046   2.7516   60.961   2.9411 1.084564 4.027627 
1 1 1   11    7  -71 o   65.451   1.9913  175.283   10.612  164.424   14.431  188.070   15.659   63.266   2.8052   67.663   2.8453 -4.397198 3.995605 
1 1 1   11    7  -70 o   56.634   2.5464  131.589   11.725  122.892   19.236  136.731   14.791   54.373   4.3771   57.631   3.1606 -3.257843 5.398895 
1 1 1   11    7  -69 o   90.325   2.1024  333.502   15.480  349.498   25.320  323.956   19.561   92.193   3.3750   88.898   2.7025 3.295135 4.323649 
1 1 1   11    7  -68 o   94.455   2.0934  364.617   16.118  333.062   25.775  384.881   20.655   89.986   3.5206   96.936   2.6163 -6.950233 4.386353 
1 1 1   11    7  -67 o   30.597   3.2053   38.795   7.8759   35.679   17.186   39.623   8.8612   28.608   7.3354   30.862   3.5893 -2.253607 8.166430 
1 1 1   11    7  -66 o   44.948   2.1608   82.741   7.8937   62.845   12.944   94.522   9.9601   38.872   4.1491   48.005   2.5545 -9.133545 4.872444 
1 1 1   11    7  -65 o  128.894   1.4610  677.867   15.350  691.223   23.346  667.697   20.373  130.067   2.2019  127.868   1.9546 2.199051 2.944299 
1 1 1   11    7  -64 o  109.329   1.4707  487.676   13.106  482.591   19.940  491.545   17.391  108.681   2.2508  109.719   1.9445 -1.037704 2.974389 
1 1 1   11    7  -63 o   56.077   1.8668  128.515   8.5213  141.824   14.326  121.228   10.600   58.792   2.9992   54.414   2.3958 4.378376 3.838614 
1 1 1   11    7  -62 o  131.734   1.4673  707.960   15.756  742.004   24.047  682.351   20.856  134.787   2.1886  129.280   1.9791 5.507034 2.950763 
1 1 1   11    7  -61 o  152.586   1.5793  949.913   19.643  966.929   27.625  932.512   27.935  153.872   2.2025  151.099   2.2681 2.772430 3.161505 
1 1 1   11    7  -60 o   38.854   2.6667   61.988   8.3947   51.105   12.794   70.216   11.124   34.972   4.5993   41.283   3.3340 -6.311096 5.680571 
1 1 1   11    7  -59 o   95.664   1.4861  373.310   11.588  375.564   15.659  370.580   17.230   95.920   2.0028   95.265   2.2188 0.6551437 2.988962 
1 1 1   11    7  -58 o   44.844   2.0724   82.267   7.5552   69.975   11.408   91.870   10.084   41.206   3.4274   47.345   2.6230 -6.139301 4.315889 
1 1 1   11    7  -57 o   87.578   1.4551  312.839   10.388  308.432   14.893  317.013   14.496   86.924   2.1019   88.130   2.0178 -1.206238 2.913676 
1 1 1   11    7  -56 o   96.441   1.4104  379.331   11.088  396.743   15.969  363.127   15.406   98.598   1.9869   94.327   2.0036 4.270554 2.821794 
1 1 1   11    7  -55 o  142.679   1.6307  830.402   18.966  833.494   22.400  822.575   35.642  142.921   1.9227  141.851   3.0825 1.069107 3.632971 
1 1 1   11    7  -54 o   55.366   2.1798  125.311   9.8184  118.374   13.345  133.497   14.497   53.730   3.0596   57.062   3.1287 -3.331882 4.376052 
1 1 1   11    7  -53 f   56.479   2.2779  130.417   10.466  120.515   14.594  140.900   15.016   54.190   3.3198   58.628   3.1537 -4.438042 4.578966 
1 1 1   11    7  -52 o   21.413   4.1379   19.409   6.9611   35.073   11.592   10.576   8.7054   28.807   5.1245   16.516   5.5122 12.29096 7.526278 
1 1 1   11    7  -51 o  154.956   1.4877  979.231   18.791  943.937   27.161  1011.63   26.025  152.085   2.1909  157.459   2.0276 -5.373810 2.985164 
1 1 1   11    7  -50 o   75.165   1.6090  230.426   9.8582  226.679   15.139  233.184   12.990   74.475   2.4973   75.566   2.1108 -1.091370 3.269925 
1 1 1   11    7  -49 o   48.070   2.1009   94.462   8.2125   91.109   13.146   96.608   10.518   47.086   3.4488   48.571   2.6667 -1.484600 4.359572 
1 1 1   11    7  -48 o   76.242   1.6463  237.067   10.231  242.266   15.741  233.263   13.463   77.000   2.5112   75.578   2.1876 1.422279 3.330446 
1 1 1   11    7  -47 o   75.541   2.0301  232.964   12.489  212.716   15.415  271.650   21.308   72.139   2.6258   81.482   3.2143 -9.342339 4.150546 
1 1 1   11    7  -46 o   34.220   3.0289   48.193   8.3616   48.760   12.869   47.779   11.000   34.184   4.7463   33.940   4.0562 0.2443542 6.243421 
1 1 1   11    7  -45 o  192.034   1.7206  1503.94   26.933  1490.25   36.281  1520.75   40.197  191.109   2.3290  193.033   2.5546 -1.923920 3.456889 
1 1 1   11    7  -44 o   94.713   1.8312  365.862   14.138  362.046   21.751  368.654   18.604   94.131   2.8380   95.020   2.4038 -0.8894501 3.719237 
1 1 1   11    7  -43 o   17.138   5.9839   10.712   10.281  -5.5314   23.844   14.422   11.395   18.668   8.1849   19.163   6.3033 -0.4945126 10.33073 
1 1 1   11    7  -42 o  180.501   1.8836  1328.82   27.715  1469.44   54.580  1279.97   32.171  189.646   3.5307  177.127   2.2281 12.51842 4.174933 
1 1 1   11    7  -41 o   40.593   2.8276   67.590   9.2979   57.882   15.706   72.828   11.536   37.211   5.3300   42.089   3.3913 -4.877460 6.317438 
1 1 1   11    7  -40 o  157.980   1.5278  1017.66   19.674  1022.22   28.701  1013.61   27.022  158.294   2.2243  157.635   2.1029 0.6596985 3.061054 
1 1 1   11    7  -39 o   12.866   4.9789   4.2969   7.4314   9.0129   11.592   1.0063   9.6829   16.933   6.2944   12.971   5.4379 3.962214 8.318021 
1 1 1   11    7  -38 o   16.419   5.2769   10.746   8.0113   11.680   15.087   10.379   9.4544   19.282   7.1782   16.695   5.7429 2.587093 9.192801 
1 1 1   11    7  -37 o   87.629   1.6857  313.126   12.041  336.332   20.887  301.574   14.737   90.733   2.8274   85.986   2.1025 4.747696 3.523490 
1 1 1   11    7  -36 o   69.584   1.8285  197.592   10.363  191.375   17.644  200.865   12.803   68.392   3.1735   70.136   2.2424 -1.744614 3.885775 
1 1 1   11    7  -35 o   38.374   2.5509   60.346   7.9340   71.342   13.241   54.187   9.9100   41.598   3.9524   36.270   3.3912 5.327534 5.207853 
1 1 1   11    7  -34 o   94.285   1.5819  362.468   12.158  342.288   19.304  375.736   15.653   91.555   2.5893   95.983   2.0006 -4.428551 3.272119 
1 1 1   11    7  -33 o   76.021   1.6898  235.655   10.472  251.007   17.038  226.336   13.275   78.386   2.6704   74.459   2.1895 3.926903 3.453260 
1 1 1   11    7  -32 o  208.246   1.7443  1768.35   29.609  1723.62   45.415  1801.41   39.050  205.525   2.7108  210.148   2.2796 -4.622513 3.541892 
1 1 1   11    7  -31 o   75.222   1.7035  230.724   10.446  211.902   16.774  242.647   13.350   72.002   2.8637   77.102   2.1261 -5.100082 3.566662 
1 1 1   11    7  -30 f  161.260   1.5940  1060.31   20.953  1051.50   32.911  1066.31   27.172  160.542   2.5148  161.695   2.0615 -1.153015 3.251799 
1 1 1   11    7  -29 f  116.681   1.5447  555.094   14.693  565.398   23.464  548.448   18.844  117.727   2.4451  115.967   1.9935 1.760468 3.154707 
1 1 1   11    7  -28 o  201.130   1.7208  1649.50   28.213  1620.49   43.745  1670.15   36.917  199.290   2.6928  202.354   2.2381 -3.064667 3.501478 
1 1 1   11    7  -27 o  116.400   1.5280  552.415   14.498  566.179   23.447  543.896   18.447  117.810   2.4416  115.487   1.9595 2.323555 3.130676 
1 1 1   11    7  -26 o   18.450   4.8467   14.426   7.3819   11.797   12.061   16.001   9.3347   18.251   6.4719   19.540   5.5827 -1.289305 8.547056 
1 1 1   11    7  -25 o  182.137   1.6488  1352.61   24.480  1321.90   37.813  1374.77   32.120  180.006   2.5770  183.598   2.1462 -3.591446 3.353666 
1 1 1   11    7  -24 o  139.785   1.5410  796.665   17.559  828.447   28.171  776.472   22.455  142.511   2.4250  137.987   1.9964 4.524216 3.141076 
1 1 1   11    7  -23 o  145.488   1.6737  863.034   19.850  807.852   28.303  916.448   27.846  140.727   2.4673  149.897   2.2789 -9.169922 3.358715 
1 1 1   11    7  -22 o  108.764   1.6655  482.329   14.766  445.638   21.470  515.267   20.342  104.519   2.5200  112.399   2.2202 -7.880211 3.358477 
1 1 1   11    7  -21 o  158.014   1.7080  1018.05   21.999  970.301   31.264  1064.89   30.962  154.229   2.4868  161.579   2.3508 -7.349777 3.422032 
1 1 1   11    7  -20 o   68.163   2.1862  189.682   12.132  177.910   15.856  206.304   18.841   65.964   2.9563   71.020   3.2633 -5.056183 4.403277 
1 1 1   11    7  -19 f  263.541   2.3538  2832.89   50.566  2887.98   81.857  2798.90   64.302  265.934   3.7761  261.893   3.0121 4.041473 4.830295 
1 1 1   11    7  -18 o   58.360   2.2058  139.103   10.474  145.622   15.417  133.514   14.275   59.649   3.1822   57.116   3.0775 2.532631 4.426884 
1 1 1   11    7  -17 o   33.416   3.2625   46.008   8.7736   42.878   13.051   48.590   11.851   31.974   5.1848   34.212   4.3476 -2.238527 6.766387 
1 1 1   11    7  -16 o  187.747   1.9469  1437.37   29.795  1406.71   46.515  1458.71   38.800  185.664   3.0735  189.103   2.5171 -3.438950 3.972650 
1 1 1   11    7  -15 o   53.194   2.3258  115.631   10.061  111.223   16.029  118.496   12.923   52.051   3.8040   53.808   2.9578 -1.756588 4.818615 
1 1 1   11    7  -14 o  100.997   1.8020  415.918   14.836  429.516   23.556  406.978   19.100  102.565   2.8202   99.891   2.3457 2.673676 3.668196 
1 1 1   11    7  -13 o  169.026   2.0934  1165.09   28.842  1172.39   41.045  1157.96   40.538  169.506   2.9706  168.461   2.9521 1.045166 4.187984 
1 1 1   11    7  -12 o  152.486   1.8273  948.091   22.713  976.942   36.541  929.926   28.994  154.738   2.8970  150.996   2.3557 3.741745 3.733890 
1 1 1   11    7  -11 o  329.445   2.7308  4427.78   73.334  4540.35  118.198  4357.33   93.507  333.363   4.3497  326.712   3.5111 6.650726 5.589962 
1 1 1   11    7  -10 o  203.670   1.8470  1691.41   30.664  1825.85   55.673  1632.87   36.739  211.515   3.2290  200.094   2.2524 11.42184 3.937008 
1 1 1   11    7   -9 o  179.601   1.7505  1315.20   25.628  1307.99   44.470  1318.78   31.360  179.038   3.0471  179.828   2.1393 -0.7903595 3.723096 
1 1 1   11    7   -8 o  150.362   1.6674  921.789   20.436  900.287   35.384  932.552   25.034  148.544   2.9222  151.224   2.0308 -2.680344 3.558590 
1 1 1   11    7   -7 o  251.574   2.0698  2580.90   42.446  2471.98   71.677  2639.72   52.675  246.078   3.5733  254.390   2.5402 -8.312653 4.384197 
1 1 1   11    7   -6 o  319.678   2.2552  4167.80   58.768  4178.92   90.081  4159.57   77.542  319.967   3.4538  319.287   2.9793 0.6808472 4.561243 
1 1 1   11    7   -5 o  136.735   1.5110  762.231   16.842  779.755   26.139  749.793   22.022  138.271   2.3191  135.600   1.9923 2.670654 3.057411 
1 1 1   11    7   -4 o  111.634   1.5004  508.070   13.653  516.625   21.188  501.996   17.854  112.549   2.3095  110.954   1.9741 1.594971 3.038224 
1 1 1   11    7   -3 o  185.996   1.7657  1410.53   26.770  1438.86   46.794  1396.74   32.639  187.782   3.0570  185.067   2.1635 2.715088 3.745157 
1 1 1   11    7   -2 o  152.459   1.8037  947.729   22.416  985.976   36.259  924.068   28.519  155.457   2.8613  150.523   2.3244 4.933731 3.686435 
1 1 1   11    7   -1 o  133.937   1.6267  731.385   17.760  709.289   30.400  742.833   21.882  131.854   2.8285  134.970   1.9889 -3.115555 3.457718 
1 1 1   11    7    0 o  113.598   1.7616  526.152   16.313  528.609   36.362  525.532   18.252  113.709   3.9289  113.525   1.9724 0.1834717 4.396230 
1 1 1   11    7    1 o   72.942   1.8166  216.941   10.801  200.552   19.165  224.570   13.076   70.018   3.3677   74.176   2.1649 -4.158348 4.003546 
1 1 1   11    7    2 o  158.033   1.6827  1018.25   21.676  1056.79   38.661  1000.58   26.177  160.938   2.9470  156.643   2.0501 4.294617 3.589980 
1 1 1   11    7    3 o   57.801   2.0467  136.410   9.6279  109.563   16.862  149.397   11.728   51.639   4.0379   60.475   2.3837 -8.836590 4.688993 
1 1 1   11    7    4 o   52.384   2.3597  112.146   10.050   93.575   16.466  123.172   12.688   47.671   4.2831   54.872   2.8463 -7.201656 5.142616 
1 1 1   11    7    5 o   44.254   2.2969   80.087   8.2573   72.196   12.879   85.594   10.759   41.877   3.8148   45.711   2.9026 -3.833824 4.793513 
1 1 1   11    7    6 o  127.927   1.6226  667.222   16.920  670.381   24.210  664.206   23.657  128.207   2.3166  127.617   2.2741 0.5902634 3.246222 
1 1 1   11    7    7 o  130.135   1.5139  690.429   16.059  704.783   24.973  680.308   20.970  131.455   2.3305  129.164   1.9916 2.290848 3.065600 
1 1 1   11    7    8 o  228.333   1.8133  2125.81   33.750  2107.35   51.430  2139.77   44.728  227.277   2.7760  229.046   2.3956 -1.769669 3.666794 
1 1 1   11    7    9 o  102.467   1.5317  428.062   12.794  417.247   19.614  436.071   16.879  101.144   2.3790  103.411   2.0024 -2.267181 3.109560 
1 1 1   11    7   10 o  141.621   1.5311  817.698   17.675  830.903   27.359  808.238   23.156  142.731   2.3515  140.784   2.0178 1.947067 3.098561 
1 1 1   11    7   11 o  189.352   1.6579  1461.83   25.589  1449.33   39.153  1471.16   33.810  188.495   2.5481  189.930   2.1838 -1.434814 3.355900 
1 1 1   11    7   12 o  117.282   1.5192  560.783   14.524  569.043   22.605  554.976   18.954  118.118   2.3478  116.660   1.9932 1.457466 3.079734 
1 1 1   11    7   13 o  260.981   1.9644  2777.41   41.789  2707.11   63.088  2832.38   55.782  257.570   3.0048  263.501   2.5970 -5.931152 3.971574 
1 1 1   11    7   14 o  150.889   1.6672  928.275   20.506  964.328   36.462  911.596   24.799  153.734   2.9096  149.514   2.0348 4.220230 3.550516 
1 1 1   11    7   15 o   21.811   5.0483   20.233   8.7976   17.253   15.041   21.784   10.847   21.331   7.2459   22.644   5.8387 -1.313425 9.305561 
1 1 1   11    7   16 o  103.145   1.6519  433.773   13.889  406.526   24.125  447.281   16.986   99.769   2.9697  104.731   1.9897 -4.961456 3.574640 
1 1 1   11    7   17 o  135.167   1.6402  744.914   18.072  747.268   31.946  743.805   21.917  135.330   2.8959  135.055   1.9908 0.2741699 3.514194 
1 1 1   11    7   18 o  131.531   1.6329  705.371   17.508  700.898   30.799  707.507   21.280  131.063   2.8829  131.719   1.9819 -0.6552734 3.498415 
1 1 1   11    7   19 f  126.285   1.5104  650.197   15.548  638.145   23.846  659.111   20.507  125.082   2.3387  127.134   1.9788 -2.051521 3.063577 
1 1 1   11    7   20 o   88.862   1.7087  321.970   12.377  316.703   21.910  324.439   15.000   88.041   3.0577   89.194   2.0630 -1.153366 3.688546 
1 1 1   11    7   21 o  177.208   2.1499  1280.71   31.055  1288.94   44.328  1272.77   43.520  177.719   3.0599  176.603   3.0231 1.115448 4.301422 
1 1 1   11    7   22 o  127.865   1.8075  666.665   18.839  667.844   24.517  664.964   29.438  127.958   2.3505  127.660   2.8289 0.2980957 3.678014 
1 1 1   11    7   23 o  150.410   1.8457  922.497   22.629  922.809   29.405  922.043   35.439  150.410   2.3983  150.320   2.8922 0.8996582E-01 3.757202 
1 1 1   11    7   24 o   63.492   1.9824  164.555   10.247  160.468   15.191  167.968   13.881   62.636   2.9838   64.109   2.6621 -1.472683 3.998694 
1 1 1   11    7   25 o   40.946   2.4622   68.639   8.1801   68.582   13.387   68.673   10.334   40.769   4.0830   40.900   3.1232 -0.1310692 5.140537 
1 1 1   11    7   26 o  220.362   1.9231  1980.22   34.544  2012.76   49.789  1950.01   47.968  222.102   2.7501  218.618   2.6917 3.484619 3.848150 
1 1 1   11    7   27 o  201.672   1.7110  1658.39   28.128  1639.60   43.037  1672.40   37.164  200.467   2.6337  202.490   2.2515 -2.022995 3.464921 
1 1 1   11    7   28 o  219.702   1.7816  1968.24   31.906  1956.02   48.904  1977.30   42.100  218.947   2.7401  220.168   2.3458 -1.221069 3.607055 
1 1 1   11    7   29 f  135.363   1.5343  747.064   16.930  748.547   26.510  746.042   22.000  135.462   2.4008  135.253   1.9955 0.2086334 3.121821 
1 1 1   11    7   30 f   82.351   1.6422  276.517   11.024  286.104   17.715  270.458   14.082   83.700   2.5996   81.405   2.1240 2.295258 3.356993 
1 1 1   11    7   31 o  152.231   1.5695  944.890   19.476  959.623   30.497  934.744   25.308  153.372   2.4394  151.391   2.0508 1.980591 3.186906 
1 1 1   11    7   32 o  134.962   1.5501  742.667   17.054  754.019   26.972  735.108   22.011  135.951   2.4339  134.256   2.0113 1.695633 3.157391 
1 1 1   11    7   33 o  105.677   1.5600  455.342   13.438  463.275   21.565  450.306   17.182  106.562   2.4826  105.077   2.0060 1.483971 3.191778 
1 1 1   11    7   34 o  102.306   1.5650  426.762   13.051  427.512   20.679  426.265   16.826  102.365   2.4782  102.233   2.0191 0.1320114 3.196620 
1 1 1   11    7   35 o  197.003   1.7102  1582.57   27.463  1582.21   42.445  1582.83   36.018  196.913   2.6443  196.984   2.2431 -0.7102966E-01 3.467573 
1 1 1   11    7   36 o  118.053   1.5680  568.256   15.089  542.562   23.416  586.500   19.731  115.316   2.4910  119.917   2.0185 -4.600151 3.206207 
1 1 1   11    7   37 o  124.465   1.6898  631.709   17.144  635.183   30.793  630.149   20.638  124.738   3.0285  124.297   2.0369 0.4406815 3.649738 
1 1 1   11    7   38 o  159.843   1.7525  1041.92   22.834  1037.76   40.480  1043.86   27.653  159.429   3.1149  159.971   2.1206 -0.5426025 3.768224 
1 1 1   11    7   39 o  202.428   1.8958  1671.23   31.283  1729.70   56.252  1645.06   37.640  205.794   3.3533  200.805   2.2995 4.988464 4.065993 
1 1 1   11    7   40 o  215.049   1.9528  1886.24   34.233  1948.91   61.373  1857.94   41.245  218.426   3.4470  213.393   2.3711 5.032745 4.183769 
1 1 1   11    7   41 o  106.246   2.2168  460.520   19.199  451.241   28.948  467.806   25.652  105.049   3.3850  107.004   2.9437 -1.954773 4.485964 
1 1 1   11    7   42 o  103.692   2.5752  438.794   21.766  479.871   41.898  423.610   25.474  108.164   4.7637  101.808   3.0730 6.355789 5.668890 
1 1 1   11    7   43 o  102.393   2.5640  428.131   21.384  371.066   39.283  452.163   25.492   95.041   5.0891  105.195   2.9758 -10.15388 5.895278 
1 1 1   11    7   44 o  129.393   2.4445  683.197   25.784  614.158   45.842  715.143   31.183  122.409   4.6024  132.352   2.8904 -9.942497 5.434787 
1 1 1   11    7   45 o  108.232   1.9524  477.821   17.225  474.354   28.539  479.808   21.604  107.714   3.2540  108.433   2.4442 -0.7184601 4.069744 
1 1 1   11    7   46 o  170.822   1.8432  1190.19   25.665  1194.59   37.966  1186.47   34.829  171.064   2.7227  170.503   2.5059 0.5614471 3.700363 
1 1 1   11    7   47 o  118.938   1.7926  576.982   17.380  563.477   26.323  587.420   23.141  117.480   2.7487  119.977   2.3662 -2.496529 3.626914 
1 1 1   11    7   48 o   90.307   1.8797  332.667   13.837  319.185   21.355  342.422   18.166   88.354   2.9694   91.563   2.4360 -3.209740 3.840763 
1 1 1   11    7   49 o  145.244   1.9912  860.647   23.575  845.566   30.947  881.498   36.389  143.912   2.6381  146.897   3.0389 -2.984680 4.024260 
1 1 1   11    7   50 o   53.206   2.4508  115.802   10.601  126.493   17.126  109.162   13.497   55.476   3.8104   51.583   3.2260 3.892906 4.992589 
1 1 1   11    7   51 o   77.329   1.9940  244.144   12.559  230.762   19.650  253.385   16.329   75.072   3.2185   78.737   2.5475 -3.665573 4.104712 
1 1 1   11    7   52 o   51.219   2.4817  107.355   10.331   99.543   16.859  112.052   13.072   49.115   4.2528   52.274   3.0815 -3.158821 5.251851 
1 1 1   11    7   53 f  176.425   1.8293  1269.84   26.308  1305.73   39.510  1241.25   35.262  178.797   2.7109  174.357   2.4811 4.440628 3.674848 
1 1 1   11    7   54 o  235.483   2.0574  2262.97   39.493  2309.92   58.241  2223.02   53.734  237.740   3.0053  233.262   2.8260 4.478073 4.125326 
1 1 1   11    7   55 o  123.187   1.7590  619.098   17.663  608.490   26.830  627.210   23.464  122.047   2.6969  123.946   2.3224 -1.899849 3.559060 
1 1 1   11    7   56 o  114.987   1.7539  539.443   16.439  536.325   25.192  541.756   21.695  114.574   2.6974  115.190   2.3105 -0.6157150 3.551655 
1 1 1   11    7   57 o  102.261   1.7681  426.683   14.739  446.254   22.952  412.949   19.227  104.470   2.6975  100.560   2.3455 3.909492 3.574660 
1 1 1   11    7   58 o   87.891   1.8323  315.234   13.128  309.426   20.387  319.349   17.159   86.952   2.8802   88.394   2.3835 -1.441635 3.738591 
1 1 1   11    7   59 o   59.716   3.0343  146.223   14.722  155.104   17.190  121.786   28.514   61.455   3.4453   53.828   6.6392 7.627438 7.479904 
1 1 1   11    7   60 o  115.756   2.5258  547.498   23.833  573.903   29.550  498.354   40.313  118.405   3.0642  110.048   4.5034 8.357048 5.447017 
1 1 1   11    7   61 o   57.077   3.1526  133.727   14.611  130.775   17.112  141.670   28.069   56.359   3.7460   58.232   5.9991 -1.872364 7.072604 
1 1 1   11    7   62 o  134.345   1.8892  736.759   20.689  801.096   37.122  707.771   24.918  139.875   3.2558  131.624   2.3224 8.251160 3.999270 
1 1 1   11    7   63 o  211.817   2.1300  1832.44   36.777  1822.01   60.719  1838.48   46.219  210.830   3.5331  212.039   2.6741 -1.208664 4.430977 
1 1 1   11    7   64 o  110.723   1.8979  500.543   17.130  505.475   30.995  498.375   20.554  110.997   3.4298  110.440   2.2831 0.5565872 4.120201 
1 1 1   11    7   65 o  112.868   1.9074  520.186   17.549  508.012   31.549  525.640   21.117  111.245   3.4834  113.413   2.2842 -2.167786 4.165564 
1 1 1   11    7   66 o   95.368   1.8219  371.361   14.164  378.810   22.640  366.570   18.155   96.146   2.8921   94.694   2.3520 1.451515 3.727712 
1 1 1   11    7   67 o  140.526   1.6524  806.133   18.928  804.826   26.644  807.464   26.895  140.303   2.3297  140.529   2.3478 -0.2263184 3.307499 
1 1 1   11    7   68 o   24.771   4.3382   26.015   8.4406   32.245   14.581   22.875   10.351   27.231   6.6316   23.020   5.5760 4.210724 8.664304 
1 1 1   11    7   69 o   79.662   1.9074  259.274   12.386  261.202   17.665  257.408   17.372   79.813   2.7192   79.235   2.6936 0.5780182 3.827481 
1 1 1   11    7   70 o   27.362   3.6396   31.327   7.9168   36.003   15.391   29.645   9.2316   28.717   6.6984   26.441   4.4405 2.276758 8.036582 
1 1 1   11    7   71 o   66.200   1.8499  179.221   9.9730  188.901   15.670  172.630   12.930   67.814   2.8410   64.888   2.4489 2.925507 3.750774 
1 1 1   11    7   72 o   83.252   1.6486  283.105   11.188  307.900   17.007  264.188   14.855   86.680   2.4093   80.312   2.2714 6.368500 3.311198 
1 1 1   11    7   73 o   40.728   2.2151   68.092   7.3263   74.011   12.681   65.127   8.9756   42.201   3.7246   39.744   2.7882 2.457001 4.652625 
1 1 1   11    7   74 o   56.064   1.8357  128.649   8.3777  131.936   13.514  126.598   10.677   56.591   2.9396   55.537   2.3638 1.054081 3.772138 
1 1 1   11    7   75 o   47.716   1.9383   93.302   7.5233  100.356   12.771   89.553   9.3100   49.265   3.1976   46.668   2.4560 2.597092 4.031904 
1 1 1   11    7   76 o   21.573   2.6404   19.391   4.5464   3.0763   12.826   21.735   4.8621   15.160   6.2996   22.854   2.6595 -7.694693 6.837984 
1 1 1   11    7   77 o   65.731   2.9411  178.247   15.718  184.153   19.231  166.359   27.283   66.630   3.5536   62.605   5.3989 4.024593 6.463407 
1 1 1   11    7   78 o   21.504   5.7348   20.327   10.237   36.113   14.642   5.2325   14.318   28.499   6.4533   16.429   6.7238 12.06947 9.319615 
1 1 1   11    7   79 o   42.632   3.0135   75.356   10.405   81.567   13.827   67.248   15.799   44.122   3.8840   39.668   4.9965 4.454075 6.328549 
1 1 1   11    7   80 o   40.022   3.1973   66.667   10.344   62.013   13.612   73.029   15.914   38.217   4.4528   41.382   4.8071 -3.164665 6.552481 
1 1 1   11    7   81 o   47.718   2.7862   94.258   10.790  100.123   14.383   86.708   16.319   48.926   3.6324   45.203   4.4881 3.722309 5.773858 
1 1 1   11    7   82 o  108.254   2.1599  481.445   19.059  485.839   22.406  469.942   36.251  108.586   2.5314  105.706   4.2156 2.880043 4.917207 
1 1 1   11    7   83 o   63.701   2.3451  167.265   12.156  162.446   13.855  183.379   25.336   62.654   2.7194   65.576   4.7724 -2.921852 5.492818 
1 1 1   11    7   84 o   55.063   2.5917  125.434   11.600  118.920   13.176  147.883   24.459   53.463   3.0359   58.554   5.1778 -5.090664 6.002224 
1 1 1   11    7   85 o   44.948   2.6967   83.850   9.8353   76.338   12.047   98.862   17.031   42.617   3.4987   48.140   4.3882 -5.522503 5.612240 
1 1 1   11    7   86 o   21.288   5.1324   20.246   8.8013   7.9394   10.863   43.768   15.017   15.623   6.0266   31.082   6.1449 -15.45904 8.606951 
1 1 1   11    7   87 o   31.808   3.5413   42.894   9.0265   37.403   11.120   53.504   15.456   29.192   4.8426   34.624   5.6726 -5.431883 7.458445 
1 1 1   11    7   88 o   13.719   5.2823   5.9933   8.3338   15.719   10.245 -13.0341   14.329   18.817   5.9585   12.015   5.6599 6.802161 8.218148 
1 1 1   11    7   89 o   14.468   5.2748   7.8856   8.0755   10.448   10.356   3.9101   12.899   16.371   5.9726   15.006   6.2827 1.364620 8.668596 
1 1 1   11    7   90 o   19.504   5.0543   17.147   8.1003   19.456   10.420   13.620   12.877   20.606   5.9020   18.262   6.6603 2.344507 8.899031 
1 1 1   11    7   91 o   19.245   5.4199   16.812   8.8621   12.507   10.513   27.379   16.472   17.253   6.0491   23.880   7.5547 -6.626072 9.678082 
1 1 1   11    7   92 o   15.675   5.4793   10.147   8.6222   11.945   10.128   5.4154   16.433   16.878   5.9357   16.674   7.0427 0.2039356 9.210417 
1 1 1   11    7   93 o   12.649   5.0606   4.2392   7.9044   3.2996   10.195   5.6556   12.516   13.449   5.6047   15.229   6.2656 -1.780167 8.406546 
1 1 1   11    7   94 o   17.829   5.2223   14.445   8.0751   4.7327   10.430   28.975   12.758   14.011   5.7370   24.686   6.3152 -10.67534 8.532010 
1 1 1   11    7   95 o   13.942   5.2164   7.2073   7.9872   16.652   10.565  -5.3906   12.202   18.964   6.0563   12.096   5.5306 6.867869 8.201629 
1 1 1   11    7   96 o   24.091   4.6849   26.234   8.8685   16.456   12.430   36.371   12.657   18.924   6.5813   27.844   5.7662 -8.920321 8.750050 
1 1 1   11    7   97 o   42.799   2.6056   76.900   9.0472   59.687   11.813  101.325   14.071   36.964   3.9832   48.545   3.5811 -11.58025 5.356295 
1 1 1   11    7   98 o   20.980   5.1818   20.659   8.8088   7.2505   12.094   35.809   12.855   15.233   6.2004   27.289   5.9475 -12.05545 8.591748 
1 1 1   11    7   99 o   24.124   4.6229   26.645   8.7598   21.311   12.157   32.405   12.633   20.683   6.4831   25.689   6.1203 -5.006628 8.915657 
1 1 1   11    7  100 o   14.706   5.4349   8.9959   8.6198   26.185   12.120  -8.5961   12.261   22.827   6.3053   11.249   5.2789 11.57811 8.223371 
1 1 1   11    7  101 o   20.528   4.9824   19.979   8.2520   30.342   11.032   6.8139   12.434   25.040   5.5504   14.959   6.2082 10.08134 8.327600 
1 1 1   11    7  102 o   24.026   4.3563   26.503   8.2177   27.763   10.686   24.680   12.856   23.774   5.6059   21.701   6.6445 2.072775 8.693440 
1 1 1   11    7  103 o   8.4452   4.0352  -8.6123   7.8085 -16.1918   10.121   2.5322   12.273   8.7021   4.2591   13.495   5.8954 -4.792587 7.272909 
1 1 1   11    7  104 o   22.969   4.9219   25.313   8.9380   21.608   12.463   29.236   12.825   20.132   6.5904   23.459   6.4886 -3.327370 9.248525 
1 1 1   11    7  105 o   24.699   4.5882   28.728   8.8976   34.965   12.401   22.110   12.774   26.163   5.9495   20.208   6.6750 5.955482 8.941600 
1 1 1   11    7  106 o   17.896   5.4187   16.025   8.5820   11.720   11.851   20.771   12.444   16.033   6.2642   19.624   6.5909 -3.591255 9.092854 
1 1 1   11    7  107 o   11.404   4.9353   1.6351   8.4336   0.8132   11.569   2.5671   12.320   12.589   5.6015   13.321   5.8604 -0.7313910 8.106829 
1 1 1   11    7  108 o   13.531   5.3164   7.2893   8.5772   9.5249   11.861   4.8385   12.418   15.158   6.1510   13.896   6.0012 1.261870 8.593555 
1 1 1   11    7  109 o   10.516   4.8548  -3.9093   9.7209 -15.5968   11.897   19.564   16.861   9.6433   4.6974   18.682   7.4183 -9.038359 8.780463 
1 1 1   11    7  110 o   23.015   5.7214   27.457   10.688   25.257   13.386   31.325   17.750   21.036   6.8264   22.253   7.8551 -1.216492 10.40687 
1 1 1   11    7  111 o   13.278   5.5887   5.4204   10.290   12.151   12.878  -6.4668   17.115   16.046   6.4457   13.070   6.1656 2.975694 8.919762 
1 1 1   11    7  112 o   12.498   5.5563   1.4897   11.358  -0.3114   13.046   7.1315   23.090   12.712   5.7758   16.446   7.5522 -3.733805 9.507642 
1 1 1   11    7  113 o   26.539   6.6215   39.372   14.277   33.323   17.590   51.052   24.442   22.676   7.8319   25.829   9.2077 -3.152845 12.08799 
1 1 1   11    7  114 o   18.284   6.8794   19.159   13.933   10.582   16.885   37.458   24.663   16.009   6.9555   22.047   8.8975 -6.037340 11.29355 
1 1 1   11    7  115 f   16.372   6.6372   13.599   13.793   26.496   17.111 -10.3350   23.309   20.283   7.6253   14.067   6.7860 6.215366 10.20759 
1 1 1   11    7  116 o   17.037   7.1413   15.303   16.694   15.303   16.694   0.0000   0.0000   17.037   7.1413  ?   ?  0.000000 7.141298 
1 1 1   11    7  117 o   12.182   5.8194  -9.4124   16.223  -9.4124   16.223   0.0000   0.0000   12.182   5.8194  ?   ?  0.000000 5.819437 
1 1 1   11    8 -115 o   11.749   5.6924 -14.3803   16.855 -14.3803   16.855   0.0000   0.0000   11.749   5.6924  ?   ?  0.000000 5.692399 
1 1 1   11    8 -114 o   13.728   6.0604   4.5191   13.283   4.5191   13.283   0.0000   0.0000   13.728   6.0604  ?   ?  0.000000 6.060399 
1 1 1   11    8 -113 o   9.3768   4.6273 -20.2272   12.766 -20.2272   12.766   0.0000   0.0000   9.3768   4.6273  ?   ?  0.000000 4.627340 
1 1 1   11    8 -112 o   10.551   5.0801 -11.6602   12.915 -11.6602   12.915   0.0000   0.0000   10.551   5.0801  ?   ?  0.000000 5.080133 
1 1 1   11    8 -111 o   10.654   4.9481  -4.1861   10.325  -3.7831   12.689  -4.9755   17.760   11.795   5.4804   13.334   6.2872 -1.538998 8.340430 
1 1 1   11    8 -110 o   16.851   6.1213   14.994   10.862   11.453   13.669   21.058   17.891   15.800   6.5287   18.738   7.5725 -2.938659 9.998298 
1 1 1   11    8 -109 o   22.587   6.0295   27.464   11.309   29.787   14.259   23.527   18.566   22.455   7.0188   19.457   7.7653 2.997515 10.46722 
1 1 1   11    8 -108 o   48.406   3.1885  103.023   12.511   96.308   15.720  114.626   20.664   45.489   4.2900   48.040   5.3686 -2.550877 6.872084 
1 1 1   11    8 -107 o   34.352   4.2880   54.975   11.746   52.703   14.941   58.652   19.007   31.883   5.9683   31.695   7.4784 0.1882305 9.568011 
1 1 1   11    8 -106 o   24.601   5.6201   30.975   11.023   28.349   13.797   35.610   18.327   22.236   6.8968   23.585   7.9985 -1.348291 10.56135 
1 1 1   11    8 -105 o   17.800   6.3575   16.713   11.657   3.3699   16.200   31.040   16.787   14.624   6.5589   22.537   7.6550 -7.913379 10.08059 
1 1 1   11    8 -104 o   17.347   6.6605   15.267   13.224  -1.3698   20.110   27.940   17.552   14.894   6.9130   21.436   7.7823 -6.542246 10.40931 
1 1 1   11    8 -103 o   10.468   4.9390  -7.7732   10.991  -3.6008   14.550 -13.3177   16.773   12.840   5.9319   12.181   5.8453 0.6586113 8.327963 
1 1 1   11    8 -102 o   31.099   5.6130   48.015   13.706   25.481   21.739   62.881   17.657   20.590   8.3377   34.686   6.4833 -14.09633 10.56175 
1 1 1   11    8 -101 o   16.877   6.5633   13.439   12.962   19.766   20.224   9.0287   16.886   19.308   7.9561   16.302   7.0188 3.005898 10.60958 
1 1 1   11    8 -100 o   22.882   6.8949   28.492   13.919   1.5788   22.602   44.936   17.667   16.287   7.4767   28.242   7.5348 -11.95479 10.61481 
1 1 1   11    8  -99 o   17.388   6.0261   14.717   10.417   15.483   23.139   14.522   11.666   19.033   8.2056   17.378   6.3393 1.654934 10.36910 
1 1 1   11    8  -98 o   19.339   5.6459   18.343   9.4520   23.276   16.456   15.914   11.547   20.888   7.5421   18.076   6.3392 2.812847 9.852319 
1 1 1   11    8  -97 o   25.125   4.4582   28.830   8.7963   25.946   13.112   31.189   11.862   22.448   6.6753   25.213   5.8800 -2.764639 8.895720 
1 1 1   11    8  -96 o   19.500   4.9822   17.890   7.9476   22.150   11.027   13.285   11.465   21.180   6.0731   17.154   6.2801 4.025471 8.736242 
1 1 1   11    8  -95 o   17.986   5.5477   15.264   8.9416  -9.3537   10.777   69.664   16.020   10.352   4.8862   38.920   5.1777 -28.56776 7.119287 
1 1 1   11    8  -94 o   30.233   3.4033   39.412   8.2418   37.858   11.420   41.102   11.906   28.721   5.0628   29.956   5.0558 -1.234398 7.154908 
1 1 1   11    8  -93 o   28.979   3.5760   36.339   8.2681   48.790   11.522   23.121   11.872   33.200   4.3629   21.842   6.3131 11.35758 7.674016 
1 1 1   11    8  -92 o   39.314   2.7180   64.930   8.6567   47.848   11.681   85.742   12.893   32.878   4.4745   44.743   3.5646 -11.86583 5.720812 
1 1 1   11    8  -91 o   35.052   2.9595   51.867   8.3770   43.059   11.564   61.594   12.152   31.105   4.7077   37.697   4.0164 -6.591942 6.188215 
1 1 1   11    8  -90 o   15.179   5.0805   9.8509   7.3946   8.8745   10.131   10.964   10.818   15.475   5.8565   16.537   6.0926 -1.062612 8.450970 
1 1 1   11    8  -89 o   32.045   3.0817   43.395   7.9505   42.145   10.861   44.838   11.671   31.011   4.4214   31.903   4.6222 -0.8915749 6.396369 
1 1 1   11    8  -88 o   17.029   5.0744   12.943   7.5706   19.761   10.253   4.7674   11.227   20.704   5.8291   14.460   5.9399 6.243664 8.322377 
1 1 1   11    8  -87 o   21.592   4.7663   20.867   8.1644   24.264   10.706   16.147   12.621   22.967   5.7362   19.190   6.6338 3.776932 8.769885 
1 1 1   11    8  -86 o   17.817   5.1418   14.212   7.8807   11.139   10.198   18.765   12.416   16.599   5.9443   20.318   6.5728 -3.718813 8.862062 
1 1 1   11    8  -85 o   32.321   3.0414   43.927   7.9187   43.458   10.932   44.446   11.487   31.652   4.3519   31.933   4.5406 -0.2810841 6.289391 
1 1 1   11    8  -84 o   33.502   2.9500   47.037   7.9738   49.169   10.919   44.600   11.672   33.867   4.0344   31.998   4.6076 1.868809 6.124216 
1 1 1   11    8  -83 o   30.905   3.3871   40.386   8.3934   36.487   12.423   43.659   11.385   28.531   5.5415   31.719   4.5318 -3.188354 7.158548 
1 1 1   11    8  -82 f   11.762   4.9106   1.7741   7.8468  -5.1651   9.8131   14.078   13.067   10.946   4.9874   18.671   6.7234 -7.725498 8.371264 
1 1 1   11    8  -81 o   20.365   4.9186   18.400   8.0722   10.103   10.128   32.848   13.365   16.291   5.9120   26.868   6.2246 -10.57720 8.584741 
1 1 1   11    8  -80 o   70.146   1.9817  202.223   11.320  204.169   14.221  198.858   18.700   70.316   2.4850   69.038   3.3328 1.278366 4.157211 
1 1 1   11    8  -79 o   48.480   2.2738   96.908   8.9607  121.164   12.498   71.254   12.854   54.051   2.8467   41.079   3.8848 12.97230 4.816146 
1 1 1   11    8  -78 o   22.288   4.7074   21.744   8.2837   15.450   10.602   31.611   13.274   18.951   6.0684   26.484   6.2500 -7.532919 8.711335 
1 1 1   11    8  -77 o   80.252   1.8738  263.978   12.258  237.198   17.649  288.935   17.037   75.735   2.8639   83.740   2.4987 -8.004463 3.800730 
1 1 1   11    8  -76 o   22.428   4.5178   21.827   7.9737   24.586   10.959   18.723   11.623   23.536   5.7600   20.697   6.3141 2.839191 8.546673 
1 1 1   11    8  -75 o   39.958   2.6298   65.979   8.5183   71.502   11.642   59.615   12.497   41.397   3.4823   37.585   4.1477 3.811886 5.415725 
1 1 1   11    8  -74 o   13.038   5.2661   3.4849   8.6474   0.9066   10.468   9.0237   15.343   13.184   5.5972   17.976   7.0961 -4.791883 9.037831 
1 1 1   11    8  -73 o   41.579   2.7984   71.448   9.4294   74.703   13.782   68.585   12.929   42.207   4.0557   40.450   3.9723 1.757286 5.676982 
1 1 1   11    8  -72 o   48.045   2.4669   94.971   9.6287   89.891   14.002   99.528   13.262   46.457   3.7288   48.999   3.3403 -2.541790 5.006199 
1 1 1   11    8  -71 o   89.649   1.5535  328.397   11.353  306.334   19.100  340.450   14.117   86.318   2.7179   91.222   1.8985 -4.904327 3.315341 
1 1 1   11    8  -70 o   19.787   3.8602   16.728   6.0026   14.004   11.209   17.823   7.1077   18.649   6.2553   20.339   4.4140 -1.689915 7.655852 
1 1 1   11    8  -69 f   93.874   1.4792  359.887   11.319  345.101   17.514  370.494   14.834   91.758   2.3434   95.184   1.9118 -3.425850 3.024350 
1 1 1   11    8  -68 o   88.635   1.5206  320.822   10.986  331.868   17.384  313.478   14.175   89.990   2.3719   87.554   1.9862 2.436752 3.093719 
1 1 1   11    8  -67 o   71.465   1.6581  208.614   9.6595  211.119   15.436  207.002   12.384   71.724   2.6447   71.105   2.1390 0.6191483 3.401431 
1 1 1   11    8  -66 o   76.319   1.6386  237.875   10.194  240.063   16.125  236.419   13.157   76.511   2.5891   76.004   2.1258 0.5076523 3.349999 
1 1 1   11    8  -65 f   31.247   3.0080   40.412   7.5672   41.807   12.925   39.685   9.3342   31.326   5.2472   30.823   3.7951 0.5028877 6.475771 
1 1 1   11    8  -64 f   90.663   1.6314  335.610   12.057  326.622   18.825  341.860   15.699   89.285   2.5893   91.450   2.1060 -2.165108 3.337633 
1 1 1   11    8  -63 o   14.291   5.1752   7.0517   7.7554   26.341   13.838  -1.7815   9.3643   24.671   6.7064   11.796   5.1516 12.87522 8.456647 
1 1 1   11    8  -62 o   84.857   1.8177  294.045   12.573  295.149   20.136  293.339   16.098   84.839   2.9159   84.670   2.3346 0.1684418 3.735359 
1 1 1   11    8  -61 o   55.667   2.1626  126.812   9.7946  119.657   19.920  129.093   11.248   53.684   4.5962   56.132   2.4643 -2.448338 5.215127 
1 1 1   11    8  -60 o   53.916   2.1692  118.959   9.5142  120.352   19.614  118.531   10.880   53.874   4.5076   53.784   2.4884 0.9021759E-01 5.148812 
1 1 1   11    8  -59 o  122.189   1.9177  609.620   19.100  630.246   31.375  597.474   24.076  124.018   3.1060  120.897   2.4430 3.120728 3.951647 
1 1 1   11    8  -58 o  138.686   1.7809  785.089   20.133  774.885   29.530  793.952   27.520  137.661   2.6316  139.379   2.4222 -1.717926 3.576668 
1 1 1   11    8  -57 o   75.842   1.8634  234.799   11.520  253.659   15.925  214.096   16.685   78.743   2.4841   72.292   2.8368 6.450508 3.770751 
1 1 1   11    8  -56 o   65.255   1.8455  173.943   9.8067  171.716   17.341  174.990   11.891   64.675   3.3002   65.417   2.2331 -0.7415085 3.984756 
1 1 1   11    8  -55 o  134.633   1.5670  739.507   17.197  714.718   23.843  766.391   24.829  132.291   2.2110  136.988   2.2235 -4.697220 3.135676 
1 1 1   11    8  -54 o   48.490   2.3812   96.275   9.3831   89.671   13.618  102.243   12.946   46.649   3.6094   49.884   3.2008 -3.235130 4.824188 
1 1 1   11    8  -53 o   56.279   2.0648  129.473   9.4563  119.788   15.244  135.532   12.056   53.978   3.4831   57.536   2.5772 -3.557888 4.332862 
1 1 1   11    8  -52 o   93.896   1.5267  359.647   11.685  380.623   17.961  344.250   15.388   96.545   2.2822   91.833   2.0556 4.712219 3.071492 
1 1 1   11    8  -51 o   41.423   2.3586   70.297   7.9312   55.421   13.058   78.994   9.9840   36.478   4.4857   43.875   2.8063 -7.396931 5.291226 
1 1 1   11    8  -50 o   74.961   1.6807  229.237   10.269  215.688   16.025  238.680   13.378   72.606   2.7123   76.436   2.1492 -3.829697 3.460596 
1 1 1   11    8  -49 o  197.009   1.7418  1583.44   27.972  1571.51   44.477  1591.24   35.977  196.117   2.7822  197.432   2.2355 -1.314117 3.569007 
1 1 1   11    8  -48 o   29.260   3.2336   35.429   7.5839   46.594   12.742   29.305   9.4373   33.355   4.8268   26.361   4.5567 6.993948 6.637887 
1 1 1   11    8  -47 o   64.591   1.8018  170.334   9.4775  159.044   14.818  178.151   12.329   62.320   2.9250   66.022   2.2944 -3.702133 3.717544 
1 1 1   11    8  -46 o  158.084   1.5229  1019.23   19.624  991.653   28.509  1044.07   27.053  155.870   2.2438  159.953   2.0748 -4.083054 3.056058 
1 1 1   11    8  -45 o  103.622   1.5205  437.915   12.843  438.614   19.450  437.375   17.101  103.661   2.3018  103.532   2.0264 0.1292267 3.066662 
1 1 1   11    8  -44 o  136.120   1.7931  755.836   19.895  791.970   29.864  727.002   26.677  139.266   2.6307  133.448   2.4524 5.818085 3.596525 
1 1 1   11    8  -43 f  127.741   1.6196  665.522   16.865  649.992   27.697  674.672   21.260  126.166   2.6931  128.591   2.0282 -2.425201 3.371448 
1 1 1   11    8  -42 f  295.033   2.1702  3551.87   52.192  3499.74   80.597  3589.52   68.492  292.616   3.3790  296.470   2.8341 -3.854401 4.410200 
1 1 1   11    8  -41 o  150.301   1.6350  921.319   20.031  915.604   32.544  924.804   25.416  149.755   2.6660  150.556   2.0710 -0.8012543 3.375850 
1 1 1   11    8  -40 o  149.913   1.6351  916.544   19.981  976.353   33.121  882.320   25.054  154.651   2.6273  147.059   2.0900 7.592743 3.357211 
1 1 1   11    8  -39 o   37.079   2.8962   56.481   8.6845   51.939   13.882   59.402   11.132   35.261   4.9670   37.948   3.6435 -2.686581 6.160049 
1 1 1   11    8  -38 o   63.820   1.9443  166.292   10.103  163.568   15.595  168.262   13.262   63.215   3.0353   64.158   2.5408 -0.9429550 3.958401 
1 1 1   11    8  -37 o   83.780   1.8392  286.283   12.560  310.123   21.159  273.312   15.608   87.098   2.9847   81.809   2.3429 5.289047 3.794388 
1 1 1   11    8  -36 o   28.407   5.1176   34.064   11.415   29.561   24.065   35.371   12.966   27.450   9.1648   28.867   5.7124 -1.416910 10.79936 
1 1 1   11    8  -35 o  228.595   2.2588  2131.96   42.090  2055.55   54.577  2244.10   66.117  224.376   2.9840  234.369   3.4608 -9.993469 4.569595 
1 1 1   11    8  -34 o  254.029   2.1814  2632.60   45.170  2699.53   57.236  2522.09   73.547  257.170   2.7303  248.433   3.6318 8.736862 4.543634 
1 1 1   11    8  -33 o   58.592   2.6065  140.385   12.418  103.174   16.452  189.656   18.930   50.068   4.0660   68.050   3.4237 -17.98260 5.315407 
1 1 1   11    8  -32 o   35.507   3.6414   52.054   10.390   54.558   13.929   48.912   15.601   36.187   4.8435   34.061   5.8284 2.126171 7.578254 
1 1 1   11    8  -31 o  159.014   1.8158  1031.21   23.536  1048.60   34.989  1016.84   31.808  160.290   2.6779  157.859   2.4719 2.430557 3.644401 
1 1 1   11    8  -30 o   38.947   3.2295   62.367   10.161   58.813   15.501   65.044   13.454   37.540   5.2055   39.660   4.2267 -2.120190 6.705354 
1 1 1   11    8  -29 o   99.875   1.8440  406.811   15.013  412.259   22.643  402.539   20.054  100.465   2.7676   99.325   2.4769 1.140121 3.714103 
1 1 1   11    8  -28 o  109.126   1.7851  485.636   15.879  471.556   23.605  497.274   21.461  107.459   2.6969  110.401   2.3847 -2.941833 3.600065 
1 1 1   11    8  -27 o  188.090   1.7103  1442.66   26.222  1486.98   41.866  1414.05   33.637  190.885   2.6906  186.183   2.2164 4.701477 3.485953 
1 1 1   11    8  -26 o  168.912   1.8157  1163.52   24.999  1193.50   36.473  1136.96   34.333  171.021   2.6163  166.928   2.5232 4.093430 3.634729 
1 1 1   11    8  -25 o  227.030   2.0120  2102.20   37.234  2041.80   52.477  2163.44   52.839  223.664   2.8783  230.237   2.8154 -6.572754 4.026306 
1 1 1   11    8  -24 o  159.564   1.7720  1038.26   23.049  1004.90   32.800  1070.80   32.395  156.934   2.5640  162.006   2.4531 -5.071838 3.548491 
1 1 1   11    8  -23 o  172.496   1.6441  1213.27   23.118  1169.74   35.656  1244.84   30.365  169.317   2.5834  174.698   2.1323 -5.381470 3.349733 
1 1 1   11    8  -22 o   51.744   2.3528  109.451   9.8981  125.942   18.803  103.130   11.642   55.350   4.1989   50.188   2.8574 5.162395 5.078935 
1 1 1   11    8  -21 f   15.438   5.2276   9.0374   7.8282   13.244   12.710   6.4665   9.9364   19.054   6.6532   15.163   5.7855 3.891477 8.816869 
1 1 1   11    8  -20 o   74.338   1.8265  225.353   11.068  228.701   18.829  223.586   13.681   74.787   3.0953   74.001   2.2707 0.7864838 3.838885 
1 1 1   11    8  -19 o  203.081   1.8513  1681.82   30.646  1648.29   52.216  1699.45   37.851  200.938   3.1879  204.113   2.2749 -3.175705 3.916379 
1 1 1   11    8  -18 o  151.816   1.6749  939.799   20.727  971.807   36.177  924.159   25.289  154.313   2.8760  150.531   2.0609 3.782562 3.538231 
1 1 1   11    8  -17 o   47.993   2.3457   94.183   9.1491   88.702   15.261   97.258   11.431   46.414   4.0750   48.732   2.8906 -2.318428 4.996112 
1 1 1   11    8  -16 o  111.206   1.7922  504.287   16.246  508.286   25.548  501.572   21.052  111.570   2.8114  110.887   2.3290 0.6828537 3.650734 
1 1 1   11    8  -15 o   84.712   1.8969  292.645   13.099  309.025   20.947  282.128   16.786   86.966   2.9591   83.123   2.4801 3.843193 3.860987 
1 1 1   11    8  -14 o  108.157   1.7984  477.012   15.856  468.432   24.968  482.811   20.526  107.101   2.8624  108.795   2.3145 -1.693581 3.681116 
1 1 1   11    8  -13 o   92.594   1.6976  349.595   12.813  349.882   22.136  349.450   15.713   92.545   2.9380   92.565   2.0825 -0.1944733E-01 3.601175 
1 1 1   11    8  -12 o  168.449   1.7264  1157.01   23.706  1083.84   39.733  1197.45   29.539  162.962   2.9911  171.348   2.1148 -8.386612 3.663241 
1 1 1   11    8  -11 o   81.955   2.1810  274.139   14.557   0.0000   0.0000  274.139   14.557  ?   ?    81.955   2.1810 0.000000 2.180988 
1 1 1   11    8  -10 o   60.920   2.0427  151.527   10.129  144.395   17.440  155.157   12.443   59.353   3.6220   61.621   2.4823 -2.268185 4.391011 
1 1 1   11    8   -9 o  213.671   1.8976  1861.80   33.051  1862.60   57.335  1861.40   40.448  213.602   3.2929  213.620   2.3229 -0.1820374E-01 4.029774 
1 1 1   11    8   -8 o  123.631   1.6472  623.209   16.600  612.703   28.667  628.509   20.361  122.534   2.8701  124.143   2.0121 -1.609177 3.505118 
1 1 1   11    8   -7 o  255.671   2.0974  2665.96   43.711  2592.74   74.441  2704.49   54.001  251.972   3.6243  257.470   2.5730 -5.497375 4.444745 
1 1 1   11    8   -6 o  119.897   1.6474  586.133   16.101  571.454   27.662  593.654   19.800  118.338   2.8676  120.652   2.0133 -2.313950 3.503767 
1 1 1   11    8   -5 o  122.849   1.8138  615.400   18.164  629.836   42.086  612.096   20.135  124.083   4.1668  122.511   2.0163 1.571373 4.628994 
1 1 1   11    8   -4 o  221.438   2.1273  1999.86   38.398  1990.12   86.577  2002.24   42.843  220.595   4.8147  221.552   2.3723 -0.9568024 5.367435 
1 1 1   11    8   -3 o  434.250   3.4247  7699.00  121.227  7911.80  277.521  7648.82  134.764  438.652   7.7614  432.742   3.8204 5.910431 8.650708 
1 1 1   11    8   -2 o  229.306   2.1650  2144.55   40.467  2327.72   96.208  2105.18   44.605  238.553   4.9476  227.173   2.4088 11.37975 5.502782 
1 1 1   11    8   -1 o  162.376   1.7141  1075.07   22.688  1129.56   40.537  1050.22   27.377  166.367   2.9892  160.471   2.0929 5.896255 3.649045 
1 1 1   11    8    0 o   64.171   1.9816  168.091   10.353  182.098   18.712  161.911   12.429   66.695   3.4535   62.955   2.4265 3.740341 4.220790 
1 1 1   11    8    1 o  191.487   1.9706  1495.31   30.759  1557.25   50.323  1458.36   38.863  195.326   3.1606  189.072   2.5216 6.253738 4.043246 
1 1 1   11    8    2 o   77.097   1.8247  242.378   11.468  251.298   20.486  238.307   13.839   78.397   3.2125   76.405   2.2244 1.991707 3.907447 
1 1 1   11    8    3 o  127.080   2.0094  658.592   20.815   0.0000   0.0000  658.592   20.815  ?   ?   127.080   2.0094 0.000000 2.009354 
1 1 1   11    8    4 o  245.611   2.2405  2460.51   44.857  2388.89   98.229  2479.38   50.422  241.658   4.9866  246.528   2.5091 -4.870834 5.582249 
1 1 1   11    8    5 o  119.593   1.8006  583.210   17.553  577.085   39.034  584.763   19.652  118.781   4.0373  119.745   2.0134 -0.9641953 4.511479 
1 1 1   11    8    6 o   97.028   1.8396  383.901   14.549  373.503   32.422  386.523   16.281   95.515   4.1742   97.353   2.0516 -1.837746 4.651145 
1 1 1   11    8    7 o  157.568   1.8667  1012.43   23.976  929.768   37.108  1071.66   31.413  150.935   3.0161  162.085   2.3776 -11.15012 3.840521 
1 1 1   11    8    8 o  200.751   1.7103  1643.27   27.988  1651.95   43.034  1636.91   36.846  201.221   2.6236  200.329   2.2563 0.8916931 3.460427 
1 1 1   11    8    9 o  178.026   1.6315  1292.25   23.676  1298.02   36.418  1288.02   31.160  178.375   2.5046  177.709   2.1511 0.6660309 3.301582 
1 1 1   11    8   10 o   96.114   1.5705  376.655   12.305  378.308   19.025  375.467   16.133   96.270   2.4263   95.950   2.0627 0.3200684 3.184608 
1 1 1   11    8   11 o  105.223   1.5460  451.423   13.261  445.227   20.397  455.959   17.452  104.472   2.3951  105.737   2.0248 -1.264641 3.136322 
1 1 1   11    8   12 o   85.997   1.6229  301.541   11.376  322.204   17.819  287.325   14.781   88.838   2.4631   83.905   2.1629 4.932945 3.277949 
1 1 1   11    8   13 o  115.155   1.5387  540.660   14.444  543.084   22.365  538.926   18.918  115.383   2.3779  114.955   2.0189 0.4287643 3.119321 
1 1 1   11    8   14 o   65.999   1.8436  177.765   9.9085  171.424   15.298  182.348   13.005   64.747   2.9059   66.816   2.3917 -2.069252 3.763573 
1 1 1   11    8   15 o  162.577   1.7198  1077.76   22.791  1081.26   32.437  1074.36   32.030  162.803   2.4443  162.284   2.4213 0.5190277 3.440488 
1 1 1   11    8   16 o   65.021   2.0052  172.584   10.615  172.638   15.442  172.536   14.616   64.974   2.9232   64.966   2.7662 0.8003235E-02 4.024529 
1 1 1   11    8   17 o   61.003   2.0558  151.946   10.208  152.228   14.879  151.695   14.032   60.998   3.0016   60.903   2.8342 0.9446335E-01 4.128240 
1 1 1   11    8   18 o  128.002   1.6578  668.077   17.297  661.508   24.607  674.495   24.320  127.342   2.3705  128.588   2.3202 -1.246376 3.317062 
1 1 1   11    8   19 o  100.797   1.5739  414.263   12.932  426.331   20.271  405.982   16.793  102.227   2.4326   99.771   2.0648 2.456360 3.190766 
1 1 1   11    8   20 o  119.624   1.5478  583.461   15.093  565.331   23.109  596.947   19.931  117.719   2.4083  120.982   2.0210 -3.263618 3.143930 
1 1 1   11    8   21 f   76.041   1.7367  235.785   10.765  240.817   16.918  232.361   13.954   76.774   2.7076   75.440   2.2718 1.334023 3.534377 
1 1 1   11    8   22 o   76.525   1.7326  238.794   10.808  240.028   17.067  237.968   13.964   76.645   2.7361   76.346   2.2463 0.2987823 3.540078 
1 1 1   11    8   23 o   82.033   1.8065  274.423   12.080  270.132   21.875  276.306   14.490   81.270   3.3090   82.276   2.1624 -1.005730 3.952848 
1 1 1   11    8   24 o  216.504   1.9221  1911.65   33.922  1944.66   59.778  1895.98   41.197  218.225   3.3605  215.582   2.3443 2.643402 4.097384 
1 1 1   11    8   25 o  120.771   1.5692  594.720   15.448  573.610   23.740  610.221   20.344  118.572   2.4562  122.317   2.0404 -3.744995 3.193130 
1 1 1   11    8   26 o  178.706   1.8049  1302.36   26.292  1314.00   37.495  1291.10   36.877  179.451   2.5633  177.882   2.5433 1.569153 3.610882 
1 1 1   11    8   27 o  111.199   1.7630  504.249   15.980  513.992   22.978  495.122   22.240  112.236   2.5115  110.158   2.4767 2.077782 3.527309 
1 1 1   11    8   28 o   48.447   2.6796   96.077   10.541   95.850   15.549   96.271   14.338   48.262   3.9880   48.405   3.6609 -0.1429443 5.413547 
1 1 1   11    8   29 o  133.302   1.7768  724.656   19.307  726.817   27.773  722.635   26.858  133.460   2.5529  133.080   2.4759 0.3797607 3.556276 
1 1 1   11    8   30 o  304.603   2.2145  3785.07   54.986  3832.49   85.495  3751.63   71.808  306.309   3.4241  303.154   2.9058 3.155304 4.490891 
1 1 1   11    8   31 o  118.506   1.6531  572.677   15.969  588.054   25.784  563.109   20.339  120.038   2.6351  117.491   2.1237 2.546318 3.384366 
1 1 1   11    8   32 o  194.279   1.8979  1539.44   30.056  1547.18   43.503  1532.38   41.575  194.692   2.7412  193.770   2.6321 0.9224548 3.800277 
1 1 1   11    8   33 o  139.876   1.8352  797.965   20.925  764.394   30.115  829.304   29.096  136.849   2.6996  142.555   2.5039 -5.706436 3.682029 
1 1 1   11    8   34 o  218.330   2.1918  1944.67   39.007  2016.56   52.490  1856.01   58.293  222.250   2.8973  213.158   3.3549 9.091751 4.432818 
1 1 1   11    8   35 o  183.461   2.0615  1372.98   30.830  1368.39   50.264  1375.74   39.034  183.025   3.3691  183.600   2.6082 -0.5742950 4.260651 
1 1 1   11    8   36 o  159.270   1.9876  1034.72   25.805  1000.89   42.029  1055.19   32.693  156.536   3.2938  160.801   2.4942 -4.264954 4.131588 
1 1 1   11    8   37 o  109.491   1.8210  488.947   16.252  502.361   30.440  483.598   19.221  110.839   3.3730  108.875   2.1658 1.963943 4.008490 
1 1 1   11    8   38 o  163.622   1.7943  1091.92   23.932  1113.33   43.191  1082.43   28.749  165.093   3.2095  162.884   2.1652 2.209030 3.871535 
1 1 1   11    8   39 o  130.387   1.6202  693.308   17.220  714.229   27.546  679.888   22.062  132.282   2.5546  129.093   2.0966 3.188766 3.304777 
1 1 1   11    8   40 o   78.144   1.8547  249.085   11.815  238.454   19.486  255.266   14.857   76.338   3.1381   79.057   2.3079 -2.719223 3.895388 
1 1 1   11    8   41 o  165.388   1.7600  1115.67   23.727  1114.67   42.091  1116.13   28.726  165.182   3.1260  165.393   2.1307 -0.2119141 3.783110 
1 1 1   11    8   42 f   94.184   1.7920  361.832   13.758  357.376   25.411  363.679   16.364   93.450   3.3411   94.409   2.1263 -0.9580994 3.960375 
1 1 1   11    8   43 f  186.335   1.8246  1416.36   27.715  1415.44   49.022  1416.79   33.600  186.104   3.2315  186.326   2.2122 -0.2226105 3.916172 
1 1 1   11    8   44 o  140.380   1.7153  803.825   19.628  779.783   34.696  815.141   23.803  138.142   3.0812  141.339   2.0660 -3.196991 3.709732 
1 1 1   11    8   45 o  113.891   1.7357  529.115   16.114  546.188   28.998  521.487   19.382  115.569   3.0809  113.045   2.1034 2.523926 3.730414 
1 1 1   11    8   46 o  115.454   1.6474  543.703   15.504  589.112   26.188  519.200   19.237  120.102   2.6750  112.795   2.0923 7.306442 3.396052 
1 1 1   11    8   47 o   65.898   1.9723  177.352   10.582  172.070   18.588  179.886   12.872   64.760   3.5347   66.336   2.3844 -1.576355 4.263696 
1 1 1   11    8   48 o   38.902   2.8463   62.164   8.9635   64.740   16.198   61.027   10.762   39.364   5.1730   38.469   3.4690 0.8944321 6.228499 
1 1 1   11    8   49 o   99.048   1.6740  400.213   13.515  401.636   23.153  399.478   16.646   99.097   2.8692   98.934   2.0641 0.1626816 3.534495 
1 1 1   11    8   50 o   75.901   1.9875  235.273   12.286  201.779   19.412  257.655   15.869   70.143   3.4053   79.391   2.4551 -9.247551 4.198031 
1 1 1   11    8   51 o  108.349   1.6555  478.933   14.622  463.802   24.866  486.931   18.078  106.483   2.8673  109.223   2.0304 -2.740715 3.513452 
1 1 1   11    8   52 o  162.875   1.6572  1082.31   22.002  1118.13   36.287  1061.48   27.669  165.411   2.6912  161.250   2.1050 4.161606 3.416691 
1 1 1   11    8   53 o   55.458   2.3568  125.841   10.630  110.217   18.029  134.167   13.161   51.642   4.3225   57.218   2.8305 -5.576046 5.166767 
1 1 1   11    8   54 o   62.759   2.1456  161.008   10.960  153.877   18.110  165.129   13.768   61.178   3.6481   63.507   2.6656 -2.329746 4.518157 
1 1 1   11    8   55 o  139.532   1.9024  794.686   21.637  753.677   37.202  815.650   26.599  135.671   3.3639  141.311   2.3092 -5.639694 4.080224 
1 1 1   11    8   56 o   22.938   4.6663   22.414   8.4277   26.589   19.478   21.452   9.3480   25.476   8.2317   22.372   5.2216 3.104206 9.748177 
1 1 1   11    8   57 o   11.574   4.8800   0.5844   7.8678   13.156   19.512  -1.8565   8.5978   21.134   8.0965   11.267   4.9279 9.867107 9.478246 
1 1 1   11    8   58 o   75.350   2.0740  232.045   12.727  257.507   24.908  223.048   14.805   79.115   3.8740   73.831   2.4635 5.283768 4.590972 
1 1 1   11    8   59 o  117.741   1.7415  565.867   16.714  573.972   25.998  560.157   21.822  118.458   2.6924  117.082   2.2865 1.376015 3.532281 
1 1 1   11    8   60 o   86.511   1.8645  305.584   13.149  313.771   21.416  300.630   16.658   87.485   3.0076   85.724   2.3861 1.760269 3.839158 
1 1 1   11    8   61 o   84.402   2.2880  291.389   15.727  300.858   21.374  280.211   23.224   85.642   3.0666   82.575   3.4578 3.067108 4.621774 
1 1 1   11    8   62 o   88.162   2.2616  317.939   16.240  323.051   22.063  311.893   23.991   88.737   3.0547   87.124   3.3845 1.612999 4.559178 
1 1 1   11    8   63 o   10.596   5.0281 -14.0901   11.703 -32.7431   16.114   6.7317   17.025   10.748   5.2835   18.280   7.3871 -7.532198 9.082131 
1 1 1   11    8   64 f   24.234   4.9544   25.178   9.4563   38.693   21.995   22.113   10.474   29.721   8.5938   22.618   5.6874 7.103178 10.30536 
1 1 1   11    8   65 f   58.652   2.2360  140.906   10.671  146.333   18.734  138.300   12.983   59.481   3.8851   58.033   2.7523 1.448307 4.761255 
1 1 1   11    8   66 o   91.346   1.9263  341.031   14.343  339.355   25.572  341.801   17.325   90.777   3.4622   91.362   2.3282 -0.5847702 4.172260 
1 1 1   11    8   67 o   88.449   1.9134  319.785   13.795  295.872   24.604  330.749   16.661   84.701   3.5716   89.870   2.2761 -5.169800 4.235204 
1 1 1   11    8   68 o   26.878   3.5420   30.252   7.5716   19.657   13.604   35.007   9.1136   21.635   6.8683   28.853   3.9808 -7.218622 7.938555 
1 1 1   11    8   69 f   41.371   2.7538   70.545   9.2341   58.203   17.116   75.613   10.967   36.791   5.9069   42.763   3.1688 -5.971096 6.703162 
1 1 1   11    8   70 o   37.137   2.4536   56.785   7.3860   65.656   12.847   52.405   9.0272   39.626   4.0333   35.550   3.1476 4.075779 5.116150 
1 1 1   11    8   71 o   60.634   1.9227  150.579   9.4912  168.356   16.735  142.149   11.524   63.842   3.2261   58.829   2.4082 5.013649 4.025846 
1 1 1   11    8   72 o   69.908   1.7951  200.042   10.221  220.536   17.514  189.456   12.586   73.145   2.9434   67.943   2.2758 5.201347 3.720624 
1 1 1   11    8   73 o   19.231   3.8587   15.871   5.8384   5.4197   11.184   19.786   6.8453   15.090   6.0254   21.484   4.0574 -6.393709 7.264150 
1 1 1   11    8   74 o   57.036   1.8304  133.304   8.4988  139.326   13.853  129.669   10.762   58.068   2.9362   56.152   2.3564 1.915943 3.764868 
1 1 1   11    8   75 o   49.584   1.9469  100.888   7.8538   96.988   13.109  103.072   9.8089   48.294   3.3508   50.029   2.4124 -1.734985 4.128897 
1 1 1   11    8   76 o   58.857   1.8741  142.076   8.9800  145.576   13.885  139.560   11.774   59.329   2.8797   58.195   2.4877 1.134117 3.805400 
1 1 1   11    8   77 o   14.836   5.6455   7.0605   9.4455   4.0258   10.802   16.917   19.468   14.318   5.8477   21.427   8.1162 -7.108898 10.00343 
1 1 1   11    8   78 o   42.685   3.1096   75.877   10.746   70.380   12.294   93.668   22.118   40.910   3.7275   46.204   6.0151 -5.294807 7.076448 
1 1 1   11    8   79 o   86.337   2.1425  306.368   15.078  321.082   17.036  253.161   32.396   88.273   2.3697   76.774   5.2074 11.49866 5.721232 
1 1 1   11    8   80 o  140.931   1.9551  815.482   22.460  848.273   29.638  771.254   34.422  143.378   2.5359  136.302   3.0981 7.075409 4.003621 
1 1 1   11    8   81 o   14.631   5.4874   7.3795   8.8499   10.323   11.128   2.3136   14.598   16.699   6.1746   15.466   6.5893 1.232280 9.030158 
1 1 1   11    8   82 f   18.274   5.4315   14.771   8.6824   23.802   10.849  -1.3161   14.480   22.917   5.8027   14.470   6.3602 8.447123 8.609485 
1 1 1   11    8   83 o   14.486   5.3994   7.4478   8.5410   3.9612   10.651   13.729   14.296   14.059   5.7815   18.780   6.9882 -4.720786 9.069763 
1 1 1   11    8   84 o   23.951   5.0687   25.628   9.5869   18.795   12.575   35.112   14.815   20.443   6.6149   27.420   6.6886 -6.977510 9.407140 
1 1 1   11    8   85 o   12.331   5.2250   1.4316   9.0941  -0.6599   10.135   10.069   20.597   12.282   5.3617   19.285   7.9958 -7.003123 9.627055 
1 1 1   11    8   86 o   27.242   4.5432   32.601   9.7338   34.174   10.822   25.938   22.271   27.720   4.9720   23.721   8.7415 3.999027 10.05661 
1 1 1   11    8   87 o   16.371   5.7197   11.123   9.3947   10.891   10.465   12.087   21.324   16.537   6.0083   19.831   8.1705 -3.294012 10.14190 
1 1 1   11    8   88 o   29.525   3.8252   37.530   8.9900   32.957   11.083   46.328   15.373   27.042   5.2167   31.640   6.1823 -4.597923 8.089171 
1 1 1   11    8   89 o   29.611   3.8697   37.865   9.1170   27.525   11.128   58.975   15.900   24.407   5.6975   36.095   5.5843 -11.68787 7.977818 
1 1 1   11    8   90 o   18.239   5.4668   15.158   8.7671   12.451   10.625   20.935   15.519   17.127   6.0744   21.170   7.3542 -4.042536 9.538484 
1 1 1   11    8   91 o   17.362   5.5061   13.610   8.7452   10.535   10.742   19.654   15.060   16.286   6.0582   20.561   7.2373 -4.275110 9.438197 
1 1 1   11    8   92 o   38.856   3.1929   64.144   10.024   48.162   13.733   82.366   14.664   32.442   5.3816   43.453   4.1920 -11.01078 6.821597 
1 1 1   11    8   93 o   29.808   3.8763   38.793   9.1957   42.056   12.893   35.415   13.119   30.146   5.4471   27.224   6.0671 2.922413 8.153540 
1 1 1   11    8   94 o   40.288   2.9844   68.869   9.7312   57.379   13.489   81.338   14.052   35.700   4.7533   43.116   4.0455 -7.416626 6.241855 
1 1 1   11    8   95 o   14.271   5.3158   8.0715   8.2763   4.0823   10.963   13.358   12.620   13.758   5.7781   17.468   6.5526 -3.710184 8.736341 
1 1 1   11    8   96 o   53.623   2.3054  120.285   10.054  109.986   13.142  134.816   15.611   50.673   3.1979   55.909   3.4420 -5.235954 4.698289 
1 1 1   11    8   97 o   25.916   4.2165   30.307   8.6015   41.983   11.586   15.968   12.839   30.127   4.8848   18.276   6.6529 11.85108 8.253633 
1 1 1   11    8   98 o   13.100   5.1708   5.8937   8.1467   4.8471   10.886   7.2256   12.282   13.777   5.7703   15.006   6.1934 -1.228532 8.464929 
1 1 1   11    8   99 o   29.635   3.9009   39.288   9.1948   31.293   13.013   47.261   12.994   24.583   6.4239   31.496   5.2456 -6.912991 8.293526 
1 1 1   11    8  100 o   38.344   3.1092   63.678   9.6348   56.403   13.629   70.945   13.622   34.558   4.9821   39.463   4.3042 -4.905457 6.583868 
1 1 1   11    8  101 o   15.148   5.4946   10.540   8.7473   8.0532   12.320   13.069   12.422   14.979   6.1947   16.680   6.4420 -1.701047 8.937211 
1 1 1   11    8  102 o   44.916   2.7984   86.628   10.195   81.865   14.358   91.471   14.478   42.334   4.2169   45.015   3.9869 -2.681564 5.803261 
1 1 1   11    8  103 o   9.9089   4.5848  -4.3846   8.7416  -0.7094   12.185  -8.2820   12.548   12.494   5.6388   11.152   5.2663 1.342649 7.715529 
1 1 1   11    8  104 o   28.488   4.0990   37.276   9.2448   46.758   12.944   27.404   13.208   30.830   5.3444   22.219   6.7213 8.610920 8.587050 
1 1 1   11    8  105 o   19.682   5.4896   19.785   9.1382   19.664   12.928   19.906   12.918   18.916   6.7014   19.014   6.7022 -0.9753418E-01 9.477754 
1 1 1   11    8  106 o   20.222   5.8787   21.590   10.267   22.214   12.675   20.400   17.508   19.918   6.6512   18.872   7.5379 1.045572 10.05278 
1 1 1   11    8  107 o   12.274   5.4761   0.7614   11.134  -3.6254   12.749   14.856   22.852   11.971   5.5382   17.834   7.9074 -5.862969 9.653975 
1 1 1   11    8  108 o   11.795   5.3688  -1.4706   11.334  -2.0102   13.026   0.2112   22.996   12.371   5.6779   15.484   7.2547 -3.113047 9.212452 
1 1 1   11    8  109 o   13.302   5.7581   4.4089   11.485  -1.0156   13.310   20.222   22.725   12.641   5.7783   18.635   8.0829 -5.994431 9.935925 
1 1 1   11    8  110 o   12.279   5.6481  -2.0732   12.989   9.1359   15.642 -26.9673   23.310   15.503   6.7151   12.601   6.2250 2.901317 9.156602 
1 1 1   11    8  111 o   18.368   7.2383   19.831   15.940   19.831   15.940   0.0000   0.0000   18.368   7.2383  ?   ?  0.000000 7.238344 
1 1 1   11    8  112 o   11.600   5.7729 -32.0831   21.509 -32.0831   21.509   0.0000   0.0000   11.600   5.7729  ?   ?  0.000000 5.772876 
1 1 1   11    8  113 o   25.751   9.5546   56.279   26.687   56.279   26.687   0.0000   0.0000   25.751   9.5546  ?   ?  0.000000 9.554560 
1 1 1   11    8  114 o   14.362   6.5287   3.4301   16.693   3.4301   16.693   0.0000   0.0000   14.362   6.5287  ?   ?  0.000000 6.528675 
1 1 1   11    8  115 o   17.415   7.9277   14.256   24.726   14.256   24.726   0.0000   0.0000   17.415   7.9277  ?   ?  0.000000 7.927747 
1 1 1   11    9 -112 o   13.272   6.2135  -2.9986   16.815  -2.9986   16.815   0.0000   0.0000   13.272   6.2135  ?   ?  0.000000 6.213478 
1 1 1   11    9 -111 o   14.896   6.3462   8.9920   13.540   8.9920   13.540   0.0000   0.0000   14.896   6.3462  ?   ?  0.000000 6.346241 
1 1 1   11    9 -110 o   14.723   6.2913   8.4765   13.378   8.4765   13.378   0.0000   0.0000   14.723   6.2913  ?   ?  0.000000 6.291334 
1 1 1   11    9 -109 o   14.346   6.6252   1.5063   18.127   1.5063   18.127   0.0000   0.0000   14.346   6.6252  ?   ?  0.000000 6.625151 
1 1 1   11    9 -108 o   15.791   6.5123   11.819   13.564   11.819   13.564   0.0000   0.0000   15.791   6.5123  ?   ?  0.000000 6.512337 
1 1 1   11    9 -107 o   23.619   6.8839   32.672   14.062   32.672   14.062   0.0000   0.0000   23.619   6.8839  ?   ?  0.000000 6.883892 
1 1 1   11    9 -106 o   10.306   4.9975 -14.1936   13.057 -14.1936   13.057   0.0000   0.0000   10.306   4.9975  ?   ?  0.000000 4.997526 
1 1 1   11    9 -105 o   13.327   5.8598   3.4823   12.301   5.6927   13.774  -5.2254   27.338   14.311   6.2489   15.581   7.4729 -1.269563 9.741315 
1 1 1   11    9 -104 o   23.516   5.8029   28.980   11.055   14.801   13.549   57.209   19.118   16.952   6.6755   30.961   7.6260 -14.00985 10.13496 
1 1 1   11    9 -103 o   21.404   6.4905   25.512   12.306   27.720   16.178   22.480   18.958   21.272   7.5001   19.332   7.8012 1.940701 10.82175 
1 1 1   11    9 -102 o   11.432   5.1536  -0.9454   10.146  -4.1683   12.440   5.4585   17.535   11.760   5.4511   15.311   6.8487 -3.550778 8.753282 
1 1 1   11    9 -101 o   12.282   5.3644   2.0515   10.158   4.4127   12.639  -2.2553   17.070   13.839   6.0151   13.844   6.4061 -0.4983902E-02 8.787453 
1 1 1   11    9 -100 o   17.945   6.0971   16.744   10.650   1.6701   13.127   45.766   18.215   13.369   5.9567   27.695   7.7597 -14.32522 9.782349 
1 1 1   11    9  -99 o   17.938   5.5900   16.296   9.0519   9.0021   12.529   24.261   13.092   15.213   6.2649   20.950   6.7471 -5.736094 9.207167 
1 1 1   11    9  -98 o   14.298   5.3668   8.8937   8.4687   8.7866   15.481   8.9394   10.117   15.877   6.7755   14.689   5.7732 1.187795 8.901565 
1 1 1   11    9  -97 o   12.348   5.0948   4.2666   8.3067   12.340   15.237   0.8520   9.9087   16.878   6.9251   11.961   5.2590 4.917180 8.695643 
1 1 1   11    9  -96 o   15.469   5.5739   10.961   8.9826   7.8668   19.880   11.755   10.069   16.847   7.4268   15.976   5.8793 0.8706894 9.472268 
1 1 1   11    9  -95 o   11.302   4.9807  -0.0929   8.9346   1.9613   21.013  -0.5463   9.8714   16.197   7.3479   11.671   5.1848 4.525859 8.992983 
1 1 1   11    9  -94 o   10.709   4.9482  -5.2169   10.130  -5.1214   21.000  -5.2459   11.564   15.195   7.0568   11.481   5.2986 3.713710 8.824592 
1 1 1   11    9  -93 o   35.111   3.2747   53.241   9.2642   51.337   13.510   54.930   12.728   33.163   5.1661   34.757   4.6055 -1.594566 6.920910 
1 1 1   11    9  -92 o   23.781   4.7988   26.162   8.9814   34.108   13.750   20.248   11.862   26.059   6.4960   20.191   6.4138 5.867571 9.128762 
1 1 1   11    9  -91 o   58.734   2.5016  144.630   11.949  140.691   19.566  146.972   15.090   56.439   4.2850   58.723   3.1642 -2.283859 5.326617 
1 1 1   11    9  -90 o   11.345   5.0513  -1.6332   9.4236 -12.0328   15.584   4.3613   11.832   12.444   5.8744   14.278   6.0002 -1.833829 8.397030 
1 1 1   11    9  -89 o   40.524   3.2632   70.014   10.688   81.700   17.969   63.617   13.296   42.339   5.3241   37.963   4.3767 4.376293 6.892088 
1 1 1   11    9  -88 o   50.190   2.5133  105.218   10.250  111.885   14.854   99.160   14.161   51.129   3.5868   48.087   3.6397 3.042145 5.110078 
1 1 1   11    9  -87 o   44.881   2.4814   84.021   9.0428   92.389   12.162   73.675   13.523   46.715   3.2134   41.222   4.0778 5.492561 5.191753 
1 1 1   11    9  -86 o   36.757   3.0806   57.080   9.1453   68.444   13.243   46.719   12.645   39.729   4.1504   32.338   4.9546 7.390957 6.463234 
1 1 1   11    9  -85 o   22.923   4.3508   23.263   7.8325   20.193   10.563   27.013   11.674   20.843   5.9332   24.044   5.9809 -3.200979 8.424569 
1 1 1   11    9  -84 o   39.338   2.6911   64.661   8.5774   67.833   11.554   60.766   12.802   39.922   3.5888   37.441   4.2710 2.480427 5.578598 
1 1 1   11    9  -83 o   52.415   2.2188  113.696   9.4586  124.291   12.901  101.382   13.908   54.513   2.9139   48.934   3.5101 5.579201 4.561975 
1 1 1   11    9  -82 f   23.796   4.2647   24.830   7.9685   33.108   10.715   14.585   11.920   27.245   5.0090   18.441   6.4427 8.803934 8.160783 
1 1 1   11    9  -81 o   23.923   4.4515   25.187   8.3613   24.261   10.386   26.894   14.096   23.063   5.5844   23.883   6.8720 -0.8199844 8.854924 
1 1 1   11    9  -80 o   26.107   4.0473   29.485   8.3344   30.922   10.489   27.025   13.727   26.351   5.0672   24.032   6.7373 2.319176 8.430199 
1 1 1   11    9  -79 o   12.312   5.0427   2.9341   8.0611  -3.9761   10.205   14.400   13.145   11.462   5.1678   18.740   6.7441 -7.277496 8.496408 
1 1 1   11    9  -78 o   18.274   4.9935   14.843   7.6485   10.457   10.273   20.299   11.457   16.436   5.9556   21.150   6.2273 -4.714138 8.616709 
1 1 1   11    9  -77 o   39.276   2.6832   64.106   8.5389   64.121   11.609   64.087   12.603   38.947   3.7013   38.804   4.0438 0.1429329 5.481910 
1 1 1   11    9  -76 o   16.580   5.1767   11.827   7.7590   10.615   10.453   13.315   11.579   16.626   6.0099   18.082   6.3475 -1.456373 8.741288 
1 1 1   11    9  -75 o   27.112   3.8033   31.327   8.1745   32.565   11.212   29.923   11.944   27.160   5.2541   25.819   5.8154 1.341261 7.837358 
1 1 1   11    9  -74 o   25.778   2.9215   27.832   6.0306   39.022   13.053   24.795   6.7999   29.702   5.5965   24.151   3.5608 5.550629 6.633276 
1 1 1   11    9  -73 o   58.389   1.8028  139.848   8.5705  138.137   13.426  141.026   11.135   57.751   2.8608   58.507   2.3394 -0.7561760 3.695525 
1 1 1   11    9  -72 o   9.5040   4.1060  -0.4539   5.8179 -10.0550   10.695   3.5813   6.9335   10.540   4.9413   12.034   4.7640 -1.493895 6.863842 
1 1 1   11    9  -71 o   36.854   2.3949   56.055   7.1557   53.173   11.696   57.779   9.0464   35.457   4.1235   37.288   3.0016 -1.831409 5.100238 
1 1 1   11    9  -70 o   77.472   1.5578  245.445   9.8376  234.323   15.350  253.198   12.816   75.457   2.4990   78.575   2.0025 -3.117905 3.202338 
1 1 1   11    9  -69 o   41.394   2.1502   70.444   7.2304   71.149   12.070   70.050   9.0299   41.278   3.6239   41.175   2.7054 0.1037407 4.522372 
1 1 1   11    9  -68 o   42.652   2.0891   74.717   7.2412   71.062   12.105   76.753   9.0362   41.272   3.6353   43.145   2.5811 -1.873169 4.458455 
1 1 1   11    9  -67 o   21.644   3.7878   19.943   6.4397   20.818   11.419   19.535   7.7979   21.819   6.1549   21.242   4.6340 0.5768948 7.704344 
1 1 1   11    9  -66 o   49.098   2.0766   98.874   8.2920  110.937   15.382   93.933   9.8450   51.676   3.6756   47.778   2.5370 3.898327 4.466157 
1 1 1   11    9  -65 o   35.625   2.7817   52.437   8.0141   42.098   14.304   57.167   9.6751   31.150   5.8481   37.123   3.2294 -5.972795 6.680505 
1 1 1   11    9  -64 o   83.112   1.5823  282.194   10.720  258.970   16.715  298.419   13.972   79.423   2.5853   85.408   2.0068 -5.984390 3.272756 
1 1 1   11    9  -63 o   66.397   1.7169  180.261   9.2848  177.331   15.047  182.063   11.799   65.675   2.8173   66.663   2.1742 -0.9880295 3.558671 
1 1 1   11    9  -62 o   82.242   1.9972  276.570   13.389  261.564   19.693  289.469   18.258   79.754   3.0348   83.989   2.6703 -4.234894 4.042313 
1 1 1   11    9  -61 o   84.036   1.9085  288.646   13.074  295.270   17.730  280.751   19.355   84.861   2.5661   82.682   2.8761 2.178230 3.854414 
1 1 1   11    9  -60 o   69.586   2.0447  198.128   11.586  183.501   19.021  206.755   14.608   66.709   3.5103   71.013   2.5276 -4.304611 4.325626 
1 1 1   11    9  -59 o  127.131   1.9461  660.463   20.168  669.570   36.145  656.346   24.303  127.593   3.4785  126.658   2.3539 0.9350052 4.200099 
1 1 1   11    9  -58 o  111.435   1.8334  507.228   16.654  546.956   27.015  482.873   21.151  115.534   2.8685  108.644   2.3884 6.889709 3.732653 
1 1 1   11    9  -57 o   45.996   2.7091   86.915   10.113   49.259   17.754  105.000   12.304   33.751   6.6896   50.529   3.0007 -16.77861 7.331779 
1 1 1   11    9  -56 o  126.223   1.7783  650.546   18.297  683.568   28.685  627.896   23.757  129.227   2.7231  123.921   2.3518 5.306442 3.598135 
1 1 1   11    9  -55 o   96.495   1.6930  380.101   13.317  378.963   19.081  381.182   18.593   96.239   2.4343   96.560   2.3622 -0.3210220 3.392008 
1 1 1   11    9  -54 o   32.685   3.1416   44.165   8.2672   45.407   13.404   43.402   10.503   32.763   5.1921   32.241   4.0881 0.5218468 6.608347 
1 1 1   11    9  -53 o   23.993   4.3099   24.384   8.1194   24.297   14.119   24.427   9.9246   23.858   6.8814   23.863   5.2453 -0.5073547E-02 8.652611 
1 1 1   11    9  -52 o  134.887   1.6923  742.576   18.608  734.254   27.227  749.870   25.489  134.021   2.4922  135.467   2.3082 -1.446304 3.396950 
1 1 1   11    9  -51 o  121.084   1.8226  598.472   17.990  594.388   29.591  600.866   22.657  120.512   3.0123  121.273   2.2920 -0.7608795 3.785100 
1 1 1   11    9  -50 o   35.772   3.1592   52.787   9.1176   50.945   17.070   53.522   10.785   34.543   6.2942   35.938   3.7360 -1.394691 7.319469 
1 1 1   11    9  -49 o   25.011   4.0735   26.324   8.0194   28.262   15.095   25.562   9.4656   25.654   7.0172   24.493   4.9120 1.161070 8.565568 
1 1 1   11    9  -48 o  110.155   1.9053  495.285   17.109  466.050   31.115  507.955   20.483  106.595   3.5860  111.522   2.2532 -4.927139 4.235132 
1 1 1   11    9  -47 o  114.339   1.7683  533.500   16.481  494.127   25.811  560.607   21.416  109.889   2.8839  117.164   2.2424 -7.274902 3.653129 
1 1 1   11    9  -46 o  127.637   1.7421  664.767   18.125  667.339   28.041  662.921   23.755  127.781   2.6921  127.406   2.2874 0.3743210 3.532646 
1 1 1   11    9  -45 o   80.065   1.6536  261.535   10.792  275.307   16.845  251.947   14.056   82.052   2.5215   78.522   2.1981 3.529724 3.345107 
1 1 1   11    9  -44 o   51.450   2.1962  108.271   9.1894   79.847   14.753  126.290   11.747   43.931   4.1697   55.537   2.6020 -11.60622 4.914936 
1 1 1   11    9  -43 o   38.084   2.7199   59.565   8.3882   68.329   13.322   53.807   10.797   40.628   4.0776   36.059   3.7271 4.569263 5.524302 
1 1 1   11    9  -42 o  124.437   1.5143  631.592   15.360  636.924   22.805  627.165   20.782  124.905   2.2398  123.961   2.0567 0.9444504 3.040817 
1 1 1   11    9  -41 o  157.462   1.6794  1011.46   21.556  993.584   28.788  1034.26   32.520  156.007   2.2638  159.139   2.5069 -3.131882 3.377777 
1 1 1   11    9  -40 o  109.598   1.5445  489.925   13.798  486.991   20.651  492.292   18.545  109.218   2.3196  109.830   2.0715 -0.6113129 3.109883 
1 1 1   11    9  -39 o  148.336   1.5311  897.444   18.513  923.309   27.501  876.009   25.036  150.398   2.2433  146.509   2.0963 3.888901 3.070319 
1 1 1   11    9  -38 o   49.730   2.2998  101.166   9.2976  120.974   14.767   88.156   11.968   54.289   3.3533   46.330   3.1883 7.958843 4.627105 
1 1 1   11    9  -37 o  135.366   1.5292  747.333   16.873  721.641   24.698  769.821   23.107  132.964   2.2787  137.350   2.0638 -4.385239 3.074408 
1 1 1   11    9  -36 o  178.728   1.7145  1303.01   24.979  1238.03   39.268  1347.17   32.373  174.100   2.7669  181.685   2.1859 -7.584671 3.526210 
1 1 1   11    9  -35 f  122.743   1.5343  614.433   15.351  613.254   22.805  615.410   20.759  122.578   2.2824  122.808   2.0737 -0.2303543 3.083731 
1 1 1   11    9  -34 o   50.892   2.2670  105.912   9.3808  138.273   14.776   84.064   12.141   58.088   3.1322   45.230   3.3162 12.85779 4.561558 
1 1 1   11    9  -33 f   59.592   2.0329  145.057   9.8604  161.766   15.275  133.120   12.911   62.858   2.9897   57.027   2.7858 5.831482 4.086460 
1 1 1   11    9  -32 o   96.194   1.7808  377.431   13.964  362.233   18.856  395.887   20.779   94.172   2.4585   98.441   2.5918 -4.268799 3.572338 
1 1 1   11    9  -31 o   96.985   1.9234  383.705   15.206  391.061   22.452  377.470   20.668   97.820   2.8186   96.120   2.6403 1.700043 3.862120 
1 1 1   11    9  -30 o  161.167   1.8393  1059.49   24.164  1036.03   34.776  1081.39   33.600  159.302   2.6781  162.767   2.5325 -3.464462 3.685860 
1 1 1   11    9  -29 o  109.809   1.6962  491.774   15.183  507.492   24.816  482.370   19.195  111.493   2.7306  108.732   2.1657 2.760818 3.485131 
1 1 1   11    9  -28 o  157.598   1.8201  1013.03   23.383  960.561   42.469  1035.86   28.010  153.323   3.3981  159.340   2.1565 -6.016724 4.024615 
1 1 1   11    9  -27 o  105.641   1.7211  455.140   14.821  452.137   24.316  456.915   18.695  105.196   2.8383  105.827   2.1671 -0.6308823 3.571014 
1 1 1   11    9  -26 o   9.6333   4.5485 -10.7490   9.3539 -12.0454   15.723 -10.0389   11.637   13.475   6.2042   11.373   5.2720 2.101880 8.141607 
1 1 1   11    9  -25 o  196.902   2.1281  1581.64   34.157  1458.95   54.319  1661.89   43.929  188.957   3.5266  201.781   2.6708 -12.82414 4.423743 
1 1 1   11    9  -24 o  204.573   2.1197  1707.25   35.348  1701.50   56.059  1711.05   45.542  204.086   3.3697  204.739   2.7288 -0.6529083 4.336062 
1 1 1   11    9  -23 o  156.000   1.9835  992.661   25.223  1049.93   41.149  958.189   31.924  160.340   3.1483  153.227   2.5559 7.113235 4.055206 
1 1 1   11    9  -22 o  227.825   2.2266  2117.59   41.350  2156.71   66.474  2092.90   52.812  229.742   3.5496  226.419   2.8614 3.323792 4.559294 
1 1 1   11    9  -21 o   76.585   2.3223  239.532   14.481  236.760   23.422  241.247   18.425   76.013   3.7920   76.812   2.9481 -0.7992325 4.803170 
1 1 1   11    9  -20 o   68.438   2.4684  191.382   13.748  189.336   21.855  192.721   17.686   67.935   3.9637   68.622   3.1703 -0.6865387 5.075642 
1 1 1   11    9  -19 o  108.625   1.9844  481.293   17.571  472.190   27.861  487.304   22.640  107.480   3.1836  109.274   2.5418 -1.794121 4.073797 
1 1 1   11    9  -18 o  102.294   1.8255  426.767   15.222  439.061   26.507  420.717   18.593  103.643   3.1412  101.549   2.2462 2.093674 3.861648 
1 1 1   11    9  -17 o   35.835   3.4249   52.934   9.8830   62.669   16.817   47.797   12.215   38.723   5.4807   33.880   4.5369 4.843269 7.114892 
1 1 1   11    9  -16 o   83.959   1.9269  287.507   13.187  309.878   23.062  276.639   16.074   87.046   3.2560   82.306   2.3985 4.740158 4.044038 
1 1 1   11    9  -15 o  144.910   1.7468  856.357   20.634  842.559   35.458  863.423   25.373  143.654   3.0280  145.485   2.1395 -1.831299 3.707628 
1 1 1   11    9  -14 o  140.440   1.7272  804.322   19.773  746.921   33.145  836.038   24.637  135.258   3.0062  143.162   2.1112 -7.903458 3.673440 
1 1 1   11    9  -13 o  112.449   1.7377  515.656   15.928  546.330   27.677  500.464   19.477  115.647   2.9383  110.763   2.1572 4.884377 3.645186 
1 1 1   11    9  -12 o  135.784   1.8972  751.955   20.999  688.688   46.067  768.549   23.593  129.689   4.3639  137.263   2.1086 -7.574463 4.846575 
1 1 1   11    9  -11 o  141.670   1.8928  818.559   21.859  817.777   49.248  818.751   24.393  141.348   4.2792  141.676   2.1122 -0.3278351 4.772118 
1 1 1   11    9  -10 o  189.192   2.2552  1460.20   34.779  1432.26   69.165  1469.66   40.237  187.109   4.5348  189.774   2.6010 -2.665756 5.227790 
1 1 1   11    9   -9 o   73.836   2.4627  222.692   14.802  202.036   29.981  229.349   17.020   70.032   5.2909   74.910   2.7923 -4.877655 5.982546 
1 1 1   11    9   -8 o  237.869   2.2304  2308.19   43.248  2232.20   67.088  2362.22   56.571  233.764   3.5207  240.564   2.8849 -6.799820 4.551714 
1 1 1   11    9   -7 o  249.590   2.2918  2541.39   46.627  2505.45   72.913  2566.25   60.648  247.646   3.6119  250.728   2.9674 -3.082077 4.674559 
1 1 1   11    9   -6 o  120.132   1.7121  588.507   16.766  588.945   29.061  588.288   20.527  120.114   2.9682  120.094   2.0968 0.1970673E-01 3.634096 
1 1 1   11    9   -5 o  293.753   2.3169  3520.37   55.479  3447.01   94.830  3558.54   68.408  290.400   4.0060  295.271   2.8422 -4.870331 4.911832 
1 1 1   11    9   -4 o   85.133   1.8366  295.573   12.745  273.157   21.697  307.384   15.749   81.724   3.2635   86.777   2.2283 -5.052979 3.951716 
1 1 1   11    9   -3 o   18.402   5.6834   13.835   9.3807   22.544   15.397   8.6945   11.830   23.469   7.2868   16.911   6.3441 6.557621 9.661469 
1 1 1   11    9   -2 o   39.670   2.9528   64.595   9.4801   99.209   16.770   48.337   11.493   49.079   4.2331   34.127   4.2212 14.95179 5.978114 
1 1 1   11    9   -1 o   72.081   1.9625  212.062   11.520  230.327   20.593  203.742   13.899   75.023   3.3760   70.625   2.4178 4.398109 4.152503 
1 1 1   11    9    0 o   31.643   3.6561   41.446   9.2571   51.591   16.280   36.598   11.254   34.998   5.9171   29.525   4.8438 5.473375 7.646839 
1 1 1   11    9    1 o   34.250   3.3676   48.366   9.2803   55.670   16.631   45.064   11.184   36.408   5.7980   32.927   4.2670 3.481426 7.198861 
1 1 1   11    9    2 o  114.016   1.7202  530.104   15.988  526.595   27.976  531.806   19.483  113.535   3.0255  114.184   2.0932 -0.6488037 3.679028 
1 1 1   11    9    3 o  251.843   2.1019  2587.05   43.149  2542.91   74.172  2609.63   53.049  249.489   3.6471  252.890   2.5734 -3.401123 4.463642 
1 1 1   11    9    4 o  297.361   2.3380  3607.43   56.672  3699.79   99.978  3563.70   68.791  300.846   4.0768  295.483   2.8560 5.363312 4.977701 
1 1 1   11    9    5 o   79.936   1.8962  260.595   12.356  288.214   22.002  247.873   14.933   83.953   3.2211   77.911   2.3540 6.041656 3.989564 
1 1 1   11    9    6 o   98.038   1.7688  391.960   14.136  434.170   25.382  372.983   17.020  103.083   3.0240   95.622   2.1835 7.461143 3.729882 
1 1 1   11    9    7 o   51.912   2.4704  110.204   10.424   98.154   18.046  116.237   12.769   48.768   4.5935   53.280   2.9516 -4.512180 5.460066 
1 1 1   11    9    8 o  180.165   1.9710  1323.89   28.946  1329.68   37.753  1315.62   45.091  180.514   2.5657  179.511   3.0815 1.003632 4.009753 
1 1 1   11    9    9 o   86.310   1.8587  303.810   13.077  318.692   18.821  289.920   18.183   88.333   2.6168   84.245   2.6511 4.087791 3.725010 
1 1 1   11    9   10 o   98.667   1.9495  397.055   15.680  378.586   24.647  409.610   20.322   96.240   3.1460  100.193   2.4883 -3.952599 4.011075 
1 1 1   11    9   11 o  158.895   1.9338  1029.74   25.047  984.643   39.028  1061.31   32.659  155.295   3.0831  161.277   2.4843 -5.981873 3.959422 
1 1 1   11    9   12 o  206.567   1.9179  1740.30   32.294  1796.91   56.772  1713.21   39.266  209.758   3.3203  204.918   2.3507 4.839645 4.068202 
1 1 1   11    9   13 o  121.430   1.7619  601.328   17.440  599.663   30.349  602.148   21.310  121.151   3.0756  121.496   2.1517 -0.3442917 3.753583 
1 1 1   11    9   14 o  146.366   1.6319  873.588   19.471  865.885   29.636  879.438   25.827  145.671   2.4958  146.828   2.1579 -1.157379 3.299328 
1 1 1   11    9   15 o  149.902   1.6426  916.310   20.071  881.613   30.352  943.274   26.757  146.984   2.5332  152.063   2.1586 -5.078705 3.328175 
1 1 1   11    9   16 o  129.169   1.6442  680.375   17.312  670.592   26.433  687.723   22.909  128.191   2.5296  129.840   2.1645 -1.648499 3.329259 
1 1 1   11    9   17 o   94.642   1.7735  365.291   13.682  354.055   20.956  373.639   18.063   93.094   2.7646   95.697   2.3155 -2.603073 3.606176 
1 1 1   11    9   18 o  114.717   1.6870  536.665   15.775  529.967   24.239  541.586   20.778  113.954   2.6095  115.218   2.2123 -1.264137 3.421064 
1 1 1   11    9   19 o  160.260   1.6917  1047.38   22.100  1041.56   33.813  1051.72   29.200  159.752   2.5966  160.558   2.2311 -0.8056793 3.423427 
1 1 1   11    9   20 o  234.447   2.0701  2242.19   39.562  2240.07   56.240  2244.26   55.664  234.232   2.9455  234.456   2.9126 -0.2238159 4.142357 
1 1 1   11    9   21 o   65.966   2.2799  177.754   12.241  165.011   19.386  186.204   15.786   63.427   3.7664   67.474   2.8768 -4.046844 4.739382 
1 1 1   11    9   22 o  127.466   1.8554  662.667   19.278  699.419   28.500  631.668   26.175  130.904   2.6709  124.408   2.5810 6.495728 3.714199 
1 1 1   11    9   23 o  213.786   2.1816  1864.59   38.018  1903.37   61.613  1840.75   48.312  215.834   3.5020  212.350   2.7911 3.484451 4.478183 
1 1 1   11    9   24 o   45.482   3.2082   84.904   11.818   64.020   17.450  102.599   16.062   39.114   5.6353   49.936   3.9789 -10.82180 6.898430 
1 1 1   11    9   25 o  281.417   2.2888  3231.27   52.503  3211.13   74.347  3251.31   74.154  280.384   3.2529  282.138   3.2243 -1.754211 4.580152 
1 1 1   11    9   26 o  132.349   1.9686  714.499   21.238  704.925   34.630  720.271   26.889  131.368   3.2339  132.851   2.4830 -1.482040 4.077162 
1 1 1   11    9   27 o  132.417   1.6593  715.073   17.911  757.288   28.698  688.138   22.923  136.212   2.5847  129.872   2.1653 6.340042 3.371830 
1 1 1   11    9   28 o  146.736   1.6492  878.093   19.726  852.514   30.548  896.388   25.835  144.520   2.5931  148.227   2.1382 -3.707169 3.360911 
1 1 1   11    9   29 o   78.601   2.0309  252.202   13.001  292.212   24.555  236.618   15.325   84.477   3.5740   76.101   2.4738 8.375366 4.346635 
1 1 1   11    9   30 o  158.068   1.7686  1019.09   22.788  1029.59   40.790  1014.32   27.475  158.755   3.1520  157.672   2.1377 1.083588 3.808521 
1 1 1   11    9   31 o   64.604   2.1957  170.502   11.546  154.705   21.396  176.992   13.715   61.325   4.3076   65.797   2.5620 -4.472164 5.011888 
1 1 1   11    9   32 o   92.684   1.8835  350.422   14.230  362.744   20.648  339.275   19.640   94.218   2.6912   91.121   2.6469 3.097534 3.774755 
1 1 1   11    9   33 f   13.729   5.5523   3.2807   9.6265   15.987   14.257  -7.3661   13.051   20.567   7.0531   12.824   5.8070 7.743317 9.136001 
1 1 1   11    9   34 o  122.074   1.7584  607.861   17.498  595.724   24.720  620.046   24.771  120.799   2.5105  123.244   2.4657 -2.444847 3.518812 
1 1 1   11    9   35 f   73.498   1.8499  220.515   11.074  212.167   17.727  225.859   14.182   71.998   3.0272   74.350   2.3430 -2.351990 3.827996 
1 1 1   11    9   36 o  103.821   1.6299  439.644   13.794  454.633   21.940  429.848   17.737  105.520   2.5508  102.632   2.1202 2.887787 3.316846 
1 1 1   11    9   37 o   50.630   2.4667  104.906   10.150  109.984   18.883  102.843   12.036   51.600   4.5356   50.083   2.9614 1.517342 5.416750 
1 1 1   11    9   38 o   22.142   4.9092   20.906   8.6280   5.1933   14.548   29.432   10.716   16.899   6.8287   26.321   5.1791 -9.421892 8.570563 
1 1 1   11    9   39 o  131.860   1.6006  709.198   17.204  721.664   27.235  700.921   22.192  132.939   2.5133  131.054   2.0774 1.885056 3.260709 
1 1 1   11    9   40 o   84.503   1.7071  291.303   11.759  302.155   18.262  283.617   15.369   85.972   2.6089   83.322   2.2649 2.649910 3.454882 
1 1 1   11    9   41 o  140.505   1.5467  805.231   17.715  814.882   26.467  797.399   23.843  141.279   2.2982  139.775   2.0926 1.503632 3.108174 
1 1 1   11    9   42 o   93.109   1.8159  353.721   13.782  344.137   19.038  364.275   19.978   91.755   2.5479   94.398   2.5988 -2.642998 3.639442 
1 1 1   11    9   43 o   18.955   5.2616   15.220   8.4168   30.204   13.749   6.2395   10.644   26.513   6.4290   15.372   5.9561 11.14086 8.763963 
1 1 1   11    9   44 o  120.625   1.5417  593.542   15.159  592.718   22.825  594.193   20.277  120.476   2.3242  120.650   2.0617 -0.1747284 3.106853 
1 1 1   11    9   45 o   94.914   1.7243  367.576   13.341  372.827   22.773  364.833   16.461   95.445   2.9306   94.531   2.1362 0.9139633 3.626515 
1 1 1   11    9   46 o   64.224   2.1906  168.621   11.452  155.365   18.667  176.620   14.501   61.463   3.7437   65.680   2.7143 -4.216969 4.624133 
1 1 1   11    9   47 o   51.457   2.8037  108.573   11.716  131.605   27.664  103.539   12.933   56.085   6.1520   50.203   3.1766 5.882572 6.923697 
1 1 1   11    9   48 o   80.237   2.1034  263.050   13.745  245.523   25.766  270.022   16.251   77.242   4.1070   81.258   2.4562 -4.015648 4.785421 
1 1 1   11    9   49 o   54.680   2.5498  122.458   11.334  121.133   23.357  122.866   12.962   53.929   5.3851   54.730   2.9159 -0.8012352 6.123871 
1 1 1   11    9   50 o   36.818   2.9234   55.801   8.7016   52.451   16.562   57.079   10.227   35.128   5.9992   37.173   3.4131 -2.045673 6.902150 
1 1 1   11    9   51 o   72.509   1.8494  214.759   10.922  244.497   19.568  201.302   13.163   77.218   3.1152   70.155   2.3049 7.063202 3.875223 
1 1 1   11    9   52 o   79.255   1.7654  256.397   11.405  247.039   19.727  261.096   13.978   77.610   3.1246   79.921   2.1476 -2.310989 3.791457 
1 1 1   11    9   53 o   26.172   4.1016   28.812   8.4630   7.1107   16.993   35.970   9.7595   18.433   7.4042   29.287   4.2087 -10.85461 8.516795 
1 1 1   11    9   54 o   60.509   2.1270  149.764   10.475  184.102   20.704  137.949   12.144   66.847   3.8153   58.020   2.5741 8.826794 4.602506 
1 1 1   11    9   55 o   74.340   1.9437  225.863   11.768  227.484   22.354  225.241   13.841   74.339   3.7006   74.197   2.2912 0.1417313 4.352515 
1 1 1   11    9   56 o  143.971   1.7549  846.314   20.595  866.998   37.828  837.600   24.553  145.420   3.1912  143.172   2.1038 2.248215 3.822270 
1 1 1   11    9   57 o   92.192   2.0145  347.277   15.139  348.190   26.361  346.828   18.493   92.012   3.5211   92.042   2.4670 -0.3042603E-01 4.299362 
1 1 1   11    9   58 o   36.165   3.4656   54.203   10.092   86.210   18.330   40.282   12.089   45.351   5.0435   30.817   4.9822 14.53450 7.089387 
1 1 1   11    9   59 o  122.722   1.6769  615.030   16.775  612.295   27.959  616.568   20.969  122.235   2.8061  122.809   2.0947 -0.5733719 3.501661 
1 1 1   11    9   60 o  105.533   1.6684  454.845   14.352  441.782   23.897  462.216   17.950  103.771   2.8277  106.326   2.0711 -2.555115 3.505021 
1 1 1   11    9   61 o   19.993   4.8748   17.241   7.8719   25.606   15.552   14.359   9.1276   24.373   7.2753   18.465   5.5877 5.907738 9.173457 
1 1 1   11    9   62 o  115.102   1.6025  541.106   15.035  565.827   25.344  527.681   18.677  117.490   2.6463  113.596   2.0170 3.894020 3.327312 
1 1 1   11    9   63 o   83.476   1.6815  284.708   11.442  313.695   20.370  271.345   13.830   87.373   2.8639   81.413   2.0857 5.959419 3.542869 
1 1 1   11    9   64 o   12.825   5.4394   0.6526   9.8701   15.234   18.301  -5.3283   11.721   21.066   7.8932   12.325   5.5492 8.741104 9.648605 
1 1 1   11    9   65 o  108.787   2.4516  485.247   21.741   0.0000   0.0000  485.247   21.741  ?   ?   108.787   2.4516 0.000000 2.451640 
1 1 1   11    9   66 o   16.810   4.8293   12.085   6.9666  -2.5482   17.008   15.035   7.6366   15.766   6.9124   18.635   4.9457 -2.869750 8.499545 
1 1 1   11    9   67 o   58.306   1.7891  139.192   8.4932  144.007   14.037  136.411   10.667   59.085   2.9237   57.639   2.2748 1.445801 3.704415 
1 1 1   11    9   68 o   26.014   3.1690   28.315   6.5814   12.569   11.805   35.417   7.9278   18.100   6.4045   29.082   3.4088 -10.98239 7.255132 
1 1 1   11    9   69 o   52.332   2.0447  112.397   8.7056  119.167   15.607  109.339   10.489   53.507   3.5992   51.525   2.5049 1.982124 4.385054 
1 1 1   11    9   70 o   18.927   4.0953   15.488   6.1343   16.652   11.413   15.016   7.2745   19.751   6.2932   18.556   4.7801 1.195309 7.902762 
1 1 1   11    9   71 o   16.507   4.4260   11.820   6.0771   2.5260   11.134   15.763   7.2526   14.025   5.8520   18.993   4.7083 -4.967771 7.510921 
1 1 1   11    9   72 o   30.136   2.5846   37.673   6.2880   48.329   11.666   33.309   7.4652   33.681   4.3509   28.160   3.3157 5.521063 5.470249 
1 1 1   11    9   73 o   75.830   1.5575  235.324   9.6275  225.268   15.421  241.747   12.324   73.892   2.5641   76.739   1.9718 -2.847214 3.234657 
1 1 1   11    9   74 o   29.997   2.5633   37.368   6.2078   41.609   11.556   35.648   7.3598   31.028   4.7175   29.156   3.1465 1.871889 5.670556 
1 1 1   11    9   75 o   56.005   1.7442  128.700   7.9531  130.580   13.433  127.686   9.8688   56.066   2.9495   55.679   2.1786 0.3868141 3.666897 
1 1 1   11    9   76 o   26.556   2.8880   29.546   6.1511   19.126   11.424   33.800   7.2996   20.682   6.2496   28.336   3.2171 -7.654228 7.029071 
1 1 1   11    9   77 o  101.204   1.5224  419.486   12.560  440.451   21.579  408.745   15.445  103.243   2.5640   99.766   1.8993 3.477669 3.190839 
1 1 1   11    9   78 o   47.962   2.3923   95.181   9.3236   90.925   12.724  100.115   13.701   46.531   3.3778   48.798   3.4669 -2.267910 4.840338 
1 1 1   11    9   79 o   50.651   2.4865  106.323   10.235  113.103   12.950   95.041   16.705   52.023   3.0674   47.052   4.4069 4.971146 5.369281 
1 1 1   11    9   80 o   14.488   5.3785   7.5959   8.4588   16.277   10.533  -8.1720   14.196   19.099   6.0410   12.794   5.8923 6.304823 8.438779 
1 1 1   11    9   81 o   33.626   3.4429   47.939   9.3039   36.506   11.530   69.279   15.752   28.618   5.1310   39.732   4.9722 -11.11407 7.144921 
1 1 1   11    9   82 f   47.376   2.3555   93.061   9.0682  101.433   12.120   82.413   13.668   49.194   3.0371   43.950   3.8541 5.244049 4.907003 
1 1 1   11    9   83 o   22.646   4.5479   22.768   8.1035   24.295   10.661   20.679   12.470   22.975   5.7160   21.116   6.5580 1.858646 8.699473 
1 1 1   11    9   84 o   12.723   5.0421   4.5087   7.7746   7.7000   10.290   0.2628   11.869   15.128   5.8575   13.404   5.8275 1.723402 8.262559 
1 1 1   11    9   85 o   37.050   2.8415   57.616   8.5162   52.051   11.184   65.296   13.139   34.702   4.0284   38.808   4.2213 -4.106083 5.835007 
1 1 1   11    9   86 o   32.807   3.8742   46.487   10.161   27.918   16.170   58.604   13.062   23.826   7.4781   36.557   4.4767 -12.73075 8.715638 
1 1 1   11    9   87 o   40.700   2.9254   69.763   9.6408   67.868   13.830   71.555   13.446   39.370   4.3838   40.595   4.1204 -1.224869 6.016290 
1 1 1   11    9   88 o   42.151   2.9101   74.915   9.9378   66.151   14.222   83.278   13.892   38.647   4.6048   43.870   3.9263 -5.222351 6.051503 
1 1 1   11    9   89 o   16.543   5.3563   12.352   8.2444   9.8160   10.943   15.680   12.537   15.923   6.0725   18.571   6.5973 -2.647945 8.966568 
1 1 1   11    9   90 o   28.855   3.7779   36.373   8.6728   26.995   11.505   48.717   13.199   23.669   5.9661   32.616   5.1339 -8.947212 7.870891 
1 1 1   11    9   91 o   36.227   3.0447   55.965   8.9080   48.763   11.725   65.799   13.700   32.974   4.4777   38.377   4.4626 -5.402973 6.321703 
1 1 1   11    9   92 o   32.550   3.3773   45.850   8.8310   45.523   11.777   46.271   13.347   31.604   4.7157   31.363   5.4166 0.2410336 7.181741 
1 1 1   11    9   93 o   11.949   5.0898   2.0633   8.7063   4.5219   12.200  -0.4883   12.428   14.249   6.0454   13.017   5.7981 1.231449 8.376482 
1 1 1   11    9   94 o   22.408   4.7202   23.433   8.3491   20.903   12.528   25.455   11.199   20.216   6.6069   22.578   5.9877 -2.361658 8.916453 
1 1 1   11    9   95 o   14.372   5.2278   8.9107   7.9257   14.087   12.130   5.0545   10.470   17.290   6.4365   13.630   5.6800 3.660705 8.584332 
1 1 1   11    9   96 o   19.975   5.0062   19.252   8.1342   29.639   12.825   12.262   10.521   23.777   6.4534   16.251   6.0048 7.525829 8.814941 
1 1 1   11    9   97 o   20.915   4.8198   20.985   8.0484   12.875   12.552   26.646   10.488   16.648   6.4630   23.043   5.6321 -6.394676 8.572710 
1 1 1   11    9   98 o   9.9789   4.5014  -1.8558   7.7545  -1.4701   12.064  -2.1274   10.123   12.307   5.5769   11.242   5.1000 1.064620 7.557259 
1 1 1   11    9   99 o   19.848   5.2516   19.629   8.6271   40.417   15.767   10.746   10.307   26.834   7.0995   15.386   5.8870 11.44837 9.222766 
1 1 1   11    9  100 o   35.729   3.2418   56.046   9.3390   60.588   16.773   54.006   11.243   34.143   6.2573   34.362   4.0944 -0.2188873 7.477806 
1 1 1   11    9  101 o   28.620   3.9551   37.428   8.9807   31.645   15.870   40.153   10.893   23.053   7.4286   28.981   4.7772 -5.928282 8.832115 
1 1 1   11    9  102 o   12.588   5.2495   4.6551   8.9518   6.8759   14.846   3.3864   11.221   15.003   6.5201   13.033   5.6661 1.970134 8.638063 
1 1 1   11    9  103 o   33.888   4.6915   54.806   12.612   54.673   14.268   55.281   26.974   32.998   5.4978   26.397   9.6378 6.601807 11.09561 
1 1 1   11    9  104 o   26.367   5.8951   36.383   12.352   33.168   13.920   48.286   26.787   24.138   6.7908   24.542   9.4648 -0.4041386 11.64889 
1 1 1   11    9  105 o   23.068   6.3500   29.376   12.316   12.493   13.692  100.984   28.197   16.172   6.5917   38.900   9.0616 -22.72742 11.20550 
1 1 1   11    9  106 o   29.669   6.1069   46.872   14.277   46.872   14.277   0.0000   0.0000   29.669   6.1069  ?   ?  0.000000 6.106928 
1 1 1   11    9  107 o   19.940   6.8678   23.449   13.522   23.449   13.522   0.0000   0.0000   19.940   6.8678  ?   ?  0.000000 6.867774 
1 1 1   11    9  108 o   17.348   6.7562   16.687   13.750   16.687   13.750   0.0000   0.0000   17.348   6.7562  ?   ?  0.000000 6.756165 
1 1 1   11    9  109 o   15.131   6.4124   9.6314   13.700   9.6314   13.700   0.0000   0.0000   15.131   6.4124  ?   ?  0.000000 6.412412 
1 1 1   11    9  110 o   12.921   5.8316   1.5049   13.034   1.5049   13.034   0.0000   0.0000   12.921   5.8316  ?   ?  0.000000 5.831570 
1 1 1   11    9  111 o   16.852   6.6668   15.505   13.570   15.505   13.570   0.0000   0.0000   16.852   6.6668  ?   ?  0.000000 6.666812 
1 1 1   11    9  112 o   14.296   6.7666  -3.1741   20.942  -3.1741   20.942   0.0000   0.0000   14.296   6.7666  ?   ?  0.000000 6.766575 
1 1 1   11   10 -108 o   11.079   5.2839  -8.7588   13.260  -8.7588   13.260   0.0000   0.0000   11.079   5.2839  ?   ?  0.000000 5.283863 
1 1 1   11   10 -107 o   20.712   6.7956   25.780   13.248   25.780   13.248   0.0000   0.0000   20.712   6.7956  ?   ?  0.000000 6.795558 
1 1 1   11   10 -106 o   10.824   5.1811  -9.7078   13.000  -9.7078   13.000   0.0000   0.0000   10.824   5.1811  ?   ?  0.000000 5.181145 
1 1 1   11   10 -105 o   28.578   6.2749   44.799   14.216   44.799   14.216   0.0000   0.0000   28.578   6.2749  ?   ?  0.000000 6.274908 
1 1 1   11   10 -104 o   14.584   6.2413   7.8211   13.201   7.8211   13.201   0.0000   0.0000   14.584   6.2413  ?   ?  0.000000 6.241265 
1 1 1   11   10 -103 o   10.735   5.1536 -10.9876   13.068 -10.9876   13.068   0.0000   0.0000   10.735   5.1536  ?   ?  0.000000 5.153558 
1 1 1   11   10 -102 o   10.178   5.0229 -22.6709   15.044 -22.6709   15.044   0.0000   0.0000   10.178   5.0229  ?   ?  0.000000 5.022930 
1 1 1   11   10 -101 o   16.963   6.7257   15.032   13.840   15.032   13.840   0.0000   0.0000   16.963   6.7257  ?   ?  0.000000 6.725724 
1 1 1   11   10 -100 o   10.976   5.2278  -9.3983   12.892  -9.3983   12.892   0.0000   0.0000   10.976   5.2278  ?   ?  0.000000 5.227846 
1 1 1   11   10  -99 o   11.255   5.2328  -4.6182   11.598  -4.3561   12.899  -5.7238   26.496   11.874   5.5200   15.474   7.4042 -3.599523 9.235440 
1 1 1   11   10  -98 o   11.678   5.1954   0.3753   9.9492   4.7858   12.661  -6.7447   16.087   13.878   6.0264   12.725   5.9949 1.153743 8.500324 
1 1 1   11   10  -97 o   15.973   5.7810   12.518   9.6758   21.093   13.130   2.3279   14.313   19.466   6.7644   13.855   6.1931 5.611076 9.171276 
1 1 1   11   10  -96 o   29.845   3.8608   40.406   9.1727   28.839   12.799   52.622   13.153   22.972   6.5283   33.009   5.0485 -10.03689 8.252646 
1 1 1   11   10  -95 f   27.830   4.2277   35.804   9.2897   40.861   13.419   31.149   12.874   28.142   6.0308   24.055   6.4384 4.086752 8.821740 
1 1 1   11   10  -94 o   37.762   3.2187   62.341   9.8134   66.348   13.694   58.110   14.071   37.759   4.5399   34.758   5.1194 3.001026 6.842463 
1 1 1   11   10  -93 o   32.823   4.2069   49.210   10.997   38.352   13.281   72.899   19.616   27.338   6.1131   37.263   6.7046 -9.924210 9.073145 
1 1 1   11   10  -92 o   32.264   4.1751   47.255   10.723   49.520   13.214   42.885   18.351   32.170   5.2175   27.215   7.8441 4.955444 9.420789 
1 1 1   11   10  -91 o   17.761   5.9469   15.485   10.132   16.906   12.358   12.570   17.694   18.403   6.5487   17.637   7.3696 0.7655602 9.858857 
1 1 1   11   10  -90 o   16.490   5.9304   12.531   10.163   17.223   12.462   3.2150   17.559   18.641   6.5817   15.592   6.9214 3.048482 9.551190 
1 1 1   11   10  -89 o   35.161   4.3316   55.624   12.153   66.335   16.239   41.989   18.323   37.441   5.4834   27.593   7.8009 9.848532 9.535241 
1 1 1   11   10  -88 o   13.951   5.7714   5.2551   10.698 -11.8870   14.063   28.803   16.483   11.613   5.5110   23.182   7.5784 -11.56903 9.370380 
1 1 1   11   10  -87 o   36.528   3.4971   57.735   10.286   58.149   13.086   57.065   16.637   35.951   4.5686   34.362   6.1661 1.589199 7.674129 
1 1 1   11   10  -86 o   35.371   3.3547   53.761   9.5570   54.191   11.679   52.889   16.626   35.037   4.1712   32.995   6.4127 2.042328 7.649970 
1 1 1   11   10  -85 o   36.408   3.5408   57.106   10.376   57.960   13.367   55.812   16.458   35.997   4.6649   34.282   6.1140 1.715393 7.690390 
1 1 1   11   10  -84 o   20.556   5.6361   19.884   9.7248   13.405   12.439   30.071   15.597   17.702   6.5312   24.440   7.2836 -6.737743 9.782975 
1 1 1   11   10  -83 o   37.400   4.6678   61.996   13.921   65.871   17.430   55.171   23.134   37.745   5.8548   32.249   8.6307 5.495781 10.42911 
1 1 1   11   10  -82 o   14.990   5.7341   8.0573   9.7771 -12.3813   15.860   20.584   12.417   12.699   5.9733   20.862   6.5538 -8.162981 8.867545 
1 1 1   11   10  -81 o   17.501   5.7612   13.625   9.5187   3.4363   15.359   19.978   12.129   15.686   6.7228   20.651   6.4759 -4.965403 9.334477 
1 1 1   11   10  -80 o   51.565   2.4719  110.581   10.360  108.938   15.056  112.058   14.277   50.574   3.6773   51.442   3.4242 -0.8682594 5.024693 
1 1 1   11   10  -79 o   44.392   2.7253   82.311   9.8141   83.486   14.489   81.315   13.341   44.060   4.0805   43.635   3.7882 0.4244003 5.567787 
1 1 1   11   10  -78 o   54.615   2.3874  123.717   10.603  114.966   15.537  131.345   14.506   52.022   3.6878   55.897   3.1969 -3.875053 4.880593 
1 1 1   11   10  -77 f   31.118   3.6745   41.393   9.1412   43.343   13.608   39.789   12.340   30.967   5.5969   29.802   5.2725 1.164566 7.689182 
1 1 1   11   10  -76 o   59.474   1.7750  145.461   8.5957  160.811   15.856  139.073   10.229   61.952   3.1502   58.025   2.1665 3.927105 3.823238 
1 1 1   11   10  -75 o   14.635   4.7082   9.0899   6.3766   28.845   12.823   2.5998   7.3498   24.950   6.3037   11.740   4.8125 13.20992 7.930769 
1 1 1   11   10  -74 o   24.444   3.5877   25.568   6.9360   19.850   12.689   28.004   8.2830   20.934   6.6316   25.418   4.1401 -4.483625 7.817884 
1 1 1   11   10  -73 o   19.313   4.5060   16.483   6.9635   29.964   13.026   11.089   8.2396   25.534   6.2983   16.211   5.3612 9.323133 8.271077 
1 1 1   11   10  -72 o   28.313   3.0532   33.677   6.9351   31.168   13.578   34.563   8.0667   26.054   6.4324   28.543   3.5431 -2.489149 7.343626 
1 1 1   11   10  -71 o   69.227   1.7534  196.664   9.8866  212.183   17.610  189.520   11.947   71.432   3.0312   67.837   2.1633 3.594772 3.723963 
1 1 1   11   10  -70 o   33.622   2.5631   46.919   6.9717   52.451   11.821   43.968   8.6328   35.048   4.2227   32.342   3.3217 2.705593 5.372643 
1 1 1   11   10  -69 o   30.989   2.6876   39.945   6.7220   40.183   11.520   39.822   8.2772   30.439   4.8018   30.771   3.3542 -0.3316917 5.857268 
1 1 1   11   10  -68 o   29.105   2.8893   35.352   6.7643   44.762   11.580   30.477   8.3340   32.294   4.5228   26.725   3.9439 5.569040 6.000883 
1 1 1   11   10  -67 o   37.228   2.5188   57.323   7.5985   52.989   12.161   60.099   9.7322   35.285   4.3178   37.963   3.1740 -2.677082 5.358916 
1 1 1   11   10  -66 o   39.979   2.7552   66.203   8.9241   58.871   12.277   74.420   12.995   37.320   4.1031   42.099   3.8287 -4.778267 5.612002 
1 1 1   11   10  -65 o   10.763   4.7441  -1.9241   8.1086  -4.8841   11.228   1.3023   11.722   12.029   5.4223   13.969   5.9263 -1.940134 8.032608 
1 1 1   11   10  -64 o   42.334   2.2559   73.756   7.7566   60.473   12.493   82.087   9.8947   37.878   4.1122   44.569   2.7367 -6.691547 4.939620 
1 1 1   11   10  -63 o   57.785   1.9949  136.950   9.3826  144.790   16.217  133.005   11.503   59.077   3.3818   56.847   2.4885 2.230907 4.198681 
1 1 1   11   10  -62 o   21.466   4.5739   19.947   7.7585  -2.6419   18.038   25.074   8.5941   16.164   7.1018   24.139   4.5341 -7.975121 8.425782 
1 1 1   11   10  -61 o   19.713   4.3873   16.794   6.8683   14.663   14.327   17.430   7.8264   19.659   7.0448   20.027   4.8469 -0.3674393 8.551121 
1 1 1   11   10  -60 o   66.393   1.9084  180.503   10.317  185.064   22.099  179.231   11.667   66.675   4.0856   66.113   2.1678 0.5618515 4.625096 
1 1 1   11   10  -59 o   37.275   2.6971   57.335   8.1396   71.416   19.190   54.245   8.9882   40.761   5.9510   36.184   3.0765 4.577381 6.699214 
1 1 1   11   10  -58 o   14.144   5.0349   7.2615   7.3058   19.341   17.413   4.6809   8.0485   22.185   7.7844   13.265   5.1681 8.920213 9.343816 
1 1 1   11   10  -57 o   42.682   2.3977   74.859   8.3083   96.893   16.221   67.023   9.6735   48.216   4.1682   40.288   2.9664 7.927620 5.115960 
1 1 1   11   10  -56 o   21.919   4.4003   20.581   7.5886   5.7014   14.885   25.807   8.8211   16.986   6.8916   24.573   4.5720 -7.587151 8.270218 
1 1 1   11   10  -55 o   45.188   2.4370   83.857   8.9433   71.671   16.852   88.635   10.552   41.208   5.1274   46.406   2.8025 -5.197479 5.843343 
1 1 1   11   10  -54 o   29.675   3.5021   36.712   8.3084   46.316   16.088   33.219   9.7024   32.722   6.2594   28.023   4.3916 4.698349 7.646281 
1 1 1   11   10  -53 o   89.920   1.7592  330.285   12.895  339.157   22.506  325.950   15.733   90.869   3.0427   89.277   2.1619 1.591286 3.732519 
1 1 1   11   10  -52 o   66.009   2.3313  178.467   12.524  202.116   23.236  168.783   14.869   69.904   4.0958   64.111   2.8524 5.792816 4.991117 
1 1 1   11   10  -51 f   48.275   2.5706   95.659   10.079  111.217   19.189   89.732   11.844   51.687   4.6027   46.670   3.1316 5.016987 5.566971 
1 1 1   11   10  -50 o   48.657   2.3473   97.044   9.2825   73.276   15.172  111.263   11.735   41.906   4.5125   52.052   2.7758 -10.14585 5.297905 
1 1 1   11   10  -49 o   66.507   1.8936  180.805   10.256  191.163   16.405  174.159   13.140   68.248   2.9558   65.205   2.4766 3.042763 3.856227 
1 1 1   11   10  -48 o   72.822   1.7998  216.533   10.684  237.661   16.925  202.537   13.775   76.154   2.7308   70.339   2.4061 5.815598 3.639571 
1 1 1   11   10  -47 f   55.848   2.0525  127.582   9.3279  147.130   14.912  115.018   11.956   59.854   3.0667   52.940   2.7802 6.913273 4.139339 
1 1 1   11   10  -46 o   95.962   1.5864  375.808   12.410  385.210   18.969  368.773   16.408   97.074   2.3972   95.011   2.1186 2.062805 3.199210 
1 1 1   11   10  -45 o   55.284   2.0643  125.004   9.2863  146.536   14.867  111.230   11.891   59.744   3.0630   52.063   2.8124 7.681137 4.158313 
1 1 1   11   10  -44 o   97.545   1.5785  388.273   12.551  395.660   19.117  382.677   16.640   98.394   2.3835   96.795   2.1089 1.599243 3.182585 
1 1 1   11   10  -43 o   69.053   1.8689  194.798   10.510  196.503   17.102  193.762   13.323   69.223   3.0382   68.819   2.3785 0.4035110 3.858518 
1 1 1   11   10  -42 o   50.109   2.4461  102.855   9.9614  130.011   15.636   84.302   12.924   56.229   3.4276   45.218   3.5343 11.01091 4.923356 
1 1 1   11   10  -41 o   57.324   2.4298  134.512   11.328  130.862   19.342  136.418   13.976   56.289   4.2468   57.667   2.9833 -1.378239 5.189975 
1 1 1   11   10  -40 o  100.867   1.8911  415.289   15.549  412.746   25.519  416.789   19.609  100.380   3.1226  101.005   2.3816 -0.6243820 3.927171 
1 1 1   11   10  -39 o   14.229   5.4092   5.8964   8.6659   18.108   15.994   0.8215   10.311   21.743   7.4699   13.254   5.5872 8.489439 9.328242 
1 1 1   11   10  -38 o   31.621   4.2604   41.770   10.702   58.531   17.079   30.932   13.733   37.220   5.8197   26.806   6.3779 10.41307 8.634027 
1 1 1   11   10  -37 o  105.081   1.8761  450.663   16.070  451.284   23.903  450.151   21.708  105.030   2.7944  104.962   2.5372 0.6721497E-01 3.774354 
1 1 1   11   10  -36 o   81.753   1.8920  272.774   12.609  299.969   17.702  244.771   17.963   85.648   2.5384   77.324   2.8548 8.323746 3.820118 
1 1 1   11   10  -35 o   95.803   1.6267  374.442   12.704  373.134   19.209  375.458   16.936   95.543   2.4685   95.897   2.1666 -0.3533936 3.284496 
1 1 1   11   10  -34 o   85.971   1.6823  301.546   11.789  288.264   17.600  312.355   15.878   83.961   2.5747   87.437   2.2295 -3.476440 3.405854 
1 1 1   11   10  -33 o   99.536   1.7511  404.230   14.208  398.186   24.039  407.474   17.613   98.644   2.9930   99.907   2.1628 -1.262871 3.692645 
1 1 1   11   10  -32 o   84.573   1.7052  291.806   11.756  308.610   18.011  279.335   15.516   86.885   2.5459   82.681   2.3044 4.204056 3.433918 
1 1 1   11   10  -31 o   28.552   3.7702   33.951   8.5605   29.939   13.292   36.795   11.191   26.413   6.2681   29.564   4.8087 -3.150572 7.900121 
1 1 1   11   10  -30 o   23.251   4.7359   22.987   8.6708   37.220   13.518   13.038   11.302   29.561   5.8173   18.474   6.2810 11.08698 8.561078 
1 1 1   11   10  -29 o  153.664   1.7511  963.302   21.934  964.559   38.447  962.695   26.706  153.612   3.0704  153.580   2.1332 0.3218079E-01 3.738742 
1 1 1   11   10  -28 o   45.411   2.6107   84.498   9.6231   93.353   15.385   78.808   12.334   47.577   4.0041   43.754   3.4869 3.822636 5.309512 
1 1 1   11   10  -27 o   58.557   2.1463  140.133   10.228  148.027   16.216  134.919   13.180   60.075   3.3244   57.398   2.8256 2.677578 4.362953 
1 1 1   11   10  -26 o  224.248   1.9867  2051.94   36.315  2016.53   62.612  2069.90   44.580  222.043   3.4592  225.162   2.4289 -3.119064 4.226802 
1 1 1   11   10  -25 o  167.066   1.7833  1138.62   24.285  1161.01   42.833  1128.02   29.482  168.541   3.1177  166.249   2.1755 2.292435 3.801700 
1 1 1   11   10  -24 o  189.731   2.2382  1469.26   34.616  1442.77   68.835  1478.23   40.049  187.607   4.5012  190.264   2.5822 -2.657745 5.189277 
1 1 1   11   10  -23 o   39.363   3.7536   63.967   11.898   56.530   24.321   66.307   13.643   36.184   8.4066   40.013   4.2475 -3.828594 9.418751 
1 1 1   11   10  -22 o  176.548   2.1896  1272.03   31.511  1247.01   62.482  1280.56   36.491  174.402   4.3986  177.100   2.5278 -2.697922 5.073185 
1 1 1   11   10  -21 o   26.237   4.5929   29.028   9.4654   33.233   16.314   26.894   11.622   27.843   7.1510   25.081   5.8001 2.762039 9.207517 
1 1 1   11   10  -20 o  165.265   1.7675  1114.10   23.811  1124.10   41.497  1109.19   29.074  165.870   3.0691  164.867   2.1634 1.002548 3.754985 
1 1 1   11   10  -19 o   74.350   1.9937  225.698   12.072  197.369   20.474  240.796   14.947   69.377   3.6330   76.770   2.3914 -7.393707 4.349452 
1 1 1   11   10  -18 o  115.271   1.9082  542.055   17.930  573.028   41.420  534.913   19.890  118.219   4.3054  114.496   2.1312 3.722900 4.804021 
1 1 1   11   10  -17 o  100.612   1.9742  412.977   16.191  383.523   36.391  420.246   18.080   96.638   4.6332  101.483   2.1856 -4.844307 5.122789 
1 1 1   11   10  -16 o   42.308   3.3059   73.593   11.311   66.913   26.030   75.147   12.559   39.464   8.3522   42.717   3.6414 -3.252243 9.111500 
1 1 1   11   10  -15 o  188.405   2.2669  1448.54   34.814   0.0000   0.0000  1448.54   34.814  ?   ?   188.405   2.2669 0.000000 2.266858 
1 1 1   11   10  -14 o   34.959   3.7767   50.557   10.592   60.531   17.020   44.253   13.531   37.986   5.6702   32.431   5.3014 5.555046 7.762431 
1 1 1   11   10  -13 o   61.129   2.4844  152.774   12.354  179.558   19.943  136.098   15.737   66.164   3.7127   57.612   3.3656 8.552059 5.011120 
1 1 1   11   10  -12 o   93.416   2.0376  356.016   15.516  368.813   24.676  347.649   19.953   94.960   3.1924   92.243   2.6564 2.717674 4.153110 
1 1 1   11   10  -11 o  151.412   1.9454  935.202   24.010  993.411   39.039  899.788   30.451  155.952   3.0710  148.475   2.5160 7.477875 3.970014 
1 1 1   11   10  -10 o  162.684   1.9681  1079.64   26.099  1071.82   41.464  1084.77   33.588  161.984   3.1402  163.024   2.5275 -1.039688 4.031082 
1 1 1   11   10   -9 o  140.608   1.9232  806.470   22.043  818.408   35.567  799.025   28.088  141.552   3.0825  139.920   2.4627 1.632187 3.945427 
1 1 1   11   10   -8 o  123.234   1.9484  619.493   19.573  671.676   32.145  588.748   24.674  128.238   3.0751  120.103   2.5203 8.135368 3.975930 
1 1 1   11   10   -7 o  164.119   1.8112  1098.60   24.231  1056.68   41.421  1120.41   29.876  160.838   3.1593  165.710   2.2118 -4.872299 3.856590 
1 1 1   11   10   -6 o  113.789   1.9504  528.166   18.091  517.916   28.894  534.774   23.201  112.559   3.1523  114.468   2.4864 -1.909164 4.014870 
1 1 1   11   10   -5 o   70.791   2.1821  204.656   12.577  203.030   21.674  205.481   15.442   70.367   3.7926   70.898   2.6768 -0.5311432 4.642127 
1 1 1   11   10   -4 o  154.892   1.8026  978.532   22.760  1006.32   39.700  964.929   27.778  156.966   3.1028  153.784   2.2159 3.182129 3.812824 
1 1 1   11   10   -3 o  154.117   1.9796  968.904   24.869  941.369   38.670  988.326   32.477  151.814   3.1248  155.609   2.5604 -3.794922 4.039767 
1 1 1   11   10   -2 o   78.546   2.2897  251.952   14.644  209.898   22.488  282.915   19.296   71.542   3.8706   83.193   2.8497 -11.65058 4.806474 
1 1 1   11   10   -1 o  175.254   2.0324  1252.95   29.034  1237.12   45.222  1264.06   37.870  174.029   3.1878  175.975   2.6400 -1.945953 4.139047 
1 1 1   11   10    0 o  152.482   1.9906  948.451   24.743  988.882   39.550  922.451   31.716  155.600   3.1181  150.332   2.5881 5.267883 4.052323 
1 1 1   11   10    1 o  230.361   2.2456  2165.22   42.167  2138.16   66.050  2183.83   54.785  228.730   3.5425  231.263   2.9061 -2.532822 4.582030 
1 1 1   11   10    2 o  183.764   2.0705  1377.63   31.015  1394.23   49.095  1366.61   40.011  184.740   3.2602  182.969   2.6827 1.770462 4.222001 
1 1 1   11   10    3 o  188.172   2.0710  1444.52   31.766  1369.85   48.672  1499.93   41.927  183.117   3.2607  191.686   2.6833 -8.568985 4.222844 
1 1 1   11   10    4 o   84.746   2.0332  292.980   14.045  290.601   23.976  294.224   17.330   84.254   3.4985   84.869   2.5078 -0.6143875 4.304519 
1 1 1   11   10    5 o  158.034   1.8094  1018.64   23.310  957.520   39.421  1051.50   28.904  153.107   3.1586  160.535   2.2088 -7.428085 3.854304 
1 1 1   11   10    6 o  123.184   1.7957  618.906   18.031  626.375   31.447  615.247   22.008  123.797   3.1188  122.798   2.1987 0.9996109 3.815867 
1 1 1   11   10    7 o  165.237   1.8187  1113.63   24.497  1131.65   42.877  1104.90   29.847  166.445   3.1602  164.558   2.2251 1.886978 3.864983 
1 1 1   11   10    8 o  170.209   1.9911  1181.83   27.625  1130.60   43.242  1217.16   35.909  166.363   3.1887  172.685   2.5510 -6.321762 4.083531 
1 1 1   11   10    9 o   56.413   2.5572  130.163   11.729  116.042   20.429  137.106   14.325   53.011   4.7788   57.859   3.0480 -4.848431 5.668095 
1 1 1   11   10   10 o  117.473   1.9584  562.935   18.753  526.884   29.591  587.135   24.244  113.522   3.2009  119.940   2.4797 -6.418114 4.049055 
1 1 1   11   10   11 o  108.661   1.9789  481.663   17.528  473.764   27.865  486.835   22.548  107.643   3.1792  109.212   2.5329 -1.568199 4.064782 
1 1 1   11   10   12 o   45.550   3.5075   85.305   12.923   62.687   18.644  106.225   17.930   38.587   6.1322   50.753   4.3766 -12.16586 7.533797 
1 1 1   11   10   13 o   88.358   2.0813  318.523   14.990  298.281   23.738  331.950   19.333   85.363   3.4183   90.135   2.6341 -4.772362 4.315464 
1 1 1   11   10   14 o  107.784   1.9589  473.924   17.211  469.958   27.293  476.543   22.176  107.211   3.1263  108.049   2.5178 -0.8382721 4.014128 
1 1 1   11   10   15 o  130.204   1.9141  691.570   20.315  692.022   32.505  691.280   26.023  130.156   3.0637  130.139   2.4531 0.1693726E-01 3.924825 
1 1 1   11   10   16 o   46.202   2.8242   87.494   10.586   92.731   18.529   84.957   12.898   47.316   4.8736   45.454   3.5082 1.862438 6.004909 
1 1 1   11   10   17 o  103.255   1.9591  434.955   16.490  422.556   26.780  442.527   20.928  101.638   3.2364  104.121   2.4657 -2.483047 4.068703 
1 1 1   11   10   18 o   76.543   1.9934  239.194   12.427  245.818   22.080  236.122   15.035   77.462   3.5059   76.019   2.4294 1.443512 4.265372 
1 1 1   11   10   19 o  146.419   1.7504  874.470   20.892  868.062   36.403  877.618   25.512  145.764   3.0637  146.654   2.1341 -0.8909760 3.733738 
1 1 1   11   10   20 o  120.427   1.6269  591.497   15.971  595.216   24.702  588.825   20.935  120.747   2.5096  120.124   2.1380 0.6228943 3.296865 
1 1 1   11   10   21 o   96.135   1.7036  376.971   13.350  397.868   20.917  362.608   17.341   98.679   2.6026   94.259   2.2570 4.420349 3.444942 
1 1 1   11   10   22 o  159.562   1.7744  1038.58   23.080  1027.88   40.295  1043.80   28.156  158.596   3.1169  159.930   2.1597 -1.334030 3.792005 
1 1 1   11   10   23 o  237.438   2.2436  2301.00   43.425  2282.27   68.968  2313.30   55.896  236.214   3.5818  237.964   2.8816 -1.750076 4.597073 
1 1 1   11   10   24 o  224.830   1.9973  2062.56   36.604  2131.03   64.961  2030.71   44.308  228.266   3.4912  223.026   2.4372 5.240067 4.257739 
1 1 1   11   10   25 o  157.225   1.7794  1008.44   22.806  1012.75   40.326  1006.41   27.653  157.409   3.1428  157.033   2.1603 0.3754120 3.813679 
1 1 1   11   10   26 o   89.109   1.7644  323.925   12.816  299.173   19.815  341.727   16.804   85.527   2.8461   91.498   2.2531 -5.971138 3.629956 
1 1 1   11   10   27 o  136.831   1.7496  763.791   19.514  778.468   34.788  757.052   23.572  138.006   3.0924  136.197   2.1232 1.808838 3.751127 
1 1 1   11   10   28 o  241.975   1.9209  2389.10   37.888  2362.40   57.837  2409.18   50.146  240.436   2.9510  242.889   2.5327 -2.453262 3.888870 
1 1 1   11   10   29 o   35.332   3.5477   51.588   10.080   31.837   18.687   59.692   11.970   27.382   7.9225   37.980   3.9228 -10.59761 8.840496 
1 1 1   11   10   30 o   65.279   2.0518  174.086   10.905  181.308   17.897  169.822   13.752   66.499   3.3121   64.426   2.6241 2.073219 4.225614 
1 1 1   11   10   31 o  160.417   1.6502  1049.77   21.578  1068.12   33.885  1037.24   27.987  161.711   2.5706  159.408   2.1538 2.303314 3.353636 
1 1 1   11   10   32 o  182.372   1.7022  1356.89   25.305  1382.95   39.597  1338.91   32.899  183.989   2.6402  181.097   2.2286 2.892578 3.455045 
1 1 1   11   10   33 o  135.567   1.7475  749.840   19.311  786.510   35.130  733.961   23.117  138.684   3.1075  134.091   2.1150 4.593582 3.758950 
1 1 1   11   10   34 o   57.736   2.3628  136.359   11.097  125.107   20.318  141.141   13.247   55.014   4.5721   58.701   2.7763 -3.687527 5.349000 
1 1 1   11   10   35 o   35.133   3.1837   50.905   9.0187   62.793   14.938   44.086   11.314   38.795   4.8278   32.487   4.3839 6.307240 6.521204 
1 1 1   11   10   36 o   14.315   5.3230   6.4845   8.2917   6.4005   13.236   6.5388   10.638   16.644   6.5842   15.476   5.9656 1.167609 8.884820 
1 1 1   11   10   37 o   96.161   1.9474  377.436   15.265  374.982   22.930  379.389   20.457   95.713   2.9425   96.318   2.6079 -0.6055527 3.931879 
1 1 1   11   10   38 o   64.841   2.3315  171.947   12.303  174.007   18.868  170.423   16.227   65.079   3.5703   64.467   3.0969 0.6116486 4.726334 
1 1 1   11   10   39 o   78.112   2.1870  249.359   13.911  287.665   22.775  226.563   17.569   83.756   3.3426   74.374   2.9036 9.381920 4.427661 
1 1 1   11   10   40 o   18.100   5.7631   13.292   9.5723   32.055   17.227   4.9115   11.513   27.294   7.5087   15.297   6.1116 11.99782 9.681501 
1 1 1   11   10   41 o  128.072   1.7217  669.373   17.974  654.112   26.339  682.674   24.589  126.507   2.5541  129.269   2.3335 -2.762474 3.459615 
1 1 1   11   10   42 o   72.672   1.9998  215.796   11.835  224.429   18.025  209.255   15.692   73.998   2.9945   71.487   2.6977 2.511154 4.030404 
1 1 1   11   10   43 o   98.420   1.6540  395.294   13.270  406.983   21.222  387.791   17.004   99.737   2.6126   97.440   2.1408 2.296722 3.377666 
1 1 1   11   10   44 o  115.539   1.6110  544.754   15.173  525.184   23.914  557.940   19.630  113.333   2.5886  116.883   2.0603 -3.549370 3.308415 
1 1 1   11   10   45 o   85.402   1.6734  297.677   11.649  303.341   18.267  293.794   15.123   86.086   2.6061   84.773   2.1904 1.313271 3.404372 
1 1 1   11   10   46 o   76.248   1.7574  237.334   10.923  224.005   17.203  246.338   14.139   73.925   2.8602   77.611   2.2373 -3.686325 3.631263 
1 1 1   11   10   47 f   64.608   1.8996  170.607   9.9934  166.557   15.953  173.223   12.820   63.690   3.0820   65.045   2.4222 -1.355507 3.919941 
1 1 1   11   10   48 o   11.377   4.8709  -0.2767   8.0471   1.7940   13.711  -1.3646   9.9388   15.399   6.4643   12.312   5.3428 3.086796 8.386499 
1 1 1   11   10   49 o   57.393   2.3112  134.889   10.790  146.747   20.989  130.630   12.580   59.519   4.3563   56.423   2.7434 3.096581 5.148205 
1 1 1   11   10   50 o   36.987   3.0979   56.474   9.2544   37.392   17.192   64.260   10.981   29.256   7.2468   39.415   3.4527 -10.15839 8.027267 
1 1 1   11   10   51 f   60.984   2.2163  152.259   10.999  177.719   20.403  141.829   13.059   65.612   3.8316   58.785   2.7328 6.827404 4.706251 
1 1 1   11   10   52 o   37.987   3.1093   59.591   9.5439   85.511   18.357   49.990   11.173   45.139   5.0770   34.603   4.0368 10.53597 6.486218 
1 1 1   11   10   53 o   50.055   2.4075  102.777   9.7942   85.156   17.591  110.693   11.791   45.078   4.8642   51.894   2.7977 -6.815510 5.611389 
1 1 1   11   10   54 o   31.398   3.7026   41.142   9.2945   44.241   16.064   39.583   11.395   31.928   6.3954   30.567   4.7258 1.361631 7.952002 
1 1 1   11   10   55 o   22.117   4.6155   21.004   8.0518   10.222   15.220   25.194   9.4883   18.547   7.1392   24.201   4.9760 -5.653839 8.702236 
1 1 1   11   10   56 o   56.451   2.0789  130.525   9.5497  119.055   17.119  135.707   11.507   53.559   3.9488   57.506   2.4604 -3.946598 4.652573 
1 1 1   11   10   57 o   26.991   3.6178   30.552   7.7594   28.215   15.064   31.396   9.0528   25.361   7.0387   27.237   4.2133 -1.875881 8.203371 
1 1 1   11   10   58 o   50.880   2.4755  106.367   10.236   90.698   20.145  111.820   11.885   46.239   5.4494   52.112   2.8082 -5.873024 6.130373 
1 1 1   11   10   59 o   33.734   3.0617   47.189   8.3275   32.364   18.414   51.001   9.3369   27.017   7.8784   35.032   3.3089 -8.015100 8.545010 
1 1 1   11   10   60 o   56.101   2.1373  129.087   9.7561  109.285   20.621  134.798   11.074   50.870   5.0391   57.289   2.3765 -6.418938 5.571380 
1 1 1   11   10   61 o   92.342   1.7464  348.736   13.146  357.189   21.325  343.555   16.695   93.158   2.8114   91.552   2.2371 1.606033 3.592890 
1 1 1   11   10   62 o   26.601   3.7151   29.854   7.8363   25.589   14.358   31.663   9.3518   24.051   6.9403   27.247   4.3573 -3.195772 8.194727 
1 1 1   11   10   63 o   51.050   2.1868  107.064   9.0789  128.477   16.070   97.025   11.003   55.584   3.5655   48.470   2.7968 7.114117 4.531532 
1 1 1   11   10   64 o   17.553   5.0787   13.302   7.6791   58.736   17.964   3.1438   8.4943   36.565   6.2515   12.806   5.2022 23.75880 8.132917 
1 1 1   11   10   65 o   29.033   3.0918   35.203   7.2046   18.198   13.616   41.815   8.4905   20.746   6.8929   31.609   3.3460 -10.86256 7.662113 
1 1 1   11   10   66 o   62.856   2.1975  162.415   11.242  175.308   16.754  151.857   15.162   65.011   3.1712   60.525   3.0832 4.485535 4.422966 
1 1 1   11   10   67 o   56.511   2.1912  131.372   10.075  139.784   13.823  121.840   14.714   58.086   2.9289   54.082   3.3542 4.004826 4.452988 
1 1 1   11   10   68 o   37.768   2.3034   58.884   7.0578   56.443   12.239   60.100   8.6390   36.444   4.1964   38.043   2.8056 -1.598557 5.047843 
1 1 1   11   10   69 o   42.497   2.3446   74.569   8.0904   66.869   14.347   78.159   9.7966   39.537   4.5335   43.398   2.7840 -3.860741 5.320103 
1 1 1   11   10   70 o   12.964   4.5316   6.4574   5.8976   0.3497   10.928   8.9675   7.0054   13.142   5.6521   14.804   4.9448 -1.661526 7.509831 
1 1 1   11   10   71 o   58.401   1.7661  140.012   8.3977  146.380   13.830  136.293   10.569   59.373   2.8662   57.488   2.2598 1.884125 3.649857 
1 1 1   11   10   72 o   30.443   2.6940   38.638   6.6163   27.754   11.208   44.460   8.1970   24.821   5.6647   32.552   3.1277 -7.730766 6.470812 
1 1 1   11   10   73 o   23.406   3.5812   23.445   6.6157   17.262   11.126   26.827   8.2285   19.694   6.2061   24.864   4.2099 -5.170773 7.499265 
1 1 1   11   10   74 o   32.020   2.7131   42.798   7.0148   40.206   11.465   44.349   8.8686   30.286   4.8042   32.383   3.4109 -2.096542 5.891905 
1 1 1   11   10   75 o   63.213   1.7810  164.259   9.1678  158.689   13.841  168.612   12.237   61.765   2.7561   63.843   2.3554 -2.078194 3.625479 
1 1 1   11   10   76 o   12.427   4.5089   5.6821   5.8909   20.250   10.824  -0.4481   7.0218   21.009   6.0147   10.340   4.4890 10.66835 7.505141 
1 1 1   11   10   77 f   59.282   1.7974  144.606   8.6754  166.254   15.756  135.189   10.392   63.002   3.0774   57.169   2.2344 5.833668 3.803002 
1 1 1   11   10   78 o   43.654   1.9757   78.666   7.0121   73.001   12.293   81.399   8.5371   41.406   3.6806   44.284   2.3736 -2.878323 4.379618 
1 1 1   11   10   79 o   48.329   2.6047   97.310   10.223   94.050   14.676  100.384   14.249   46.901   3.8733   48.604   3.6225 -1.702644 5.303332 
1 1 1   11   10   80 o   29.880   3.9208   38.600   9.3194   25.455   13.075   52.174   13.287   23.139   6.6059   34.311   4.8888 -11.17168 8.218147 
1 1 1   11   10   81 o   66.611   2.1578  183.651   11.701  184.130   16.844  183.205   16.266   66.141   3.1332   66.042   3.0296 0.9873199E-01 4.358332 
1 1 1   11   10   82 o   12.455   5.0667   3.6493   8.0705   0.1316   10.746   8.1999   12.223   12.705   5.5341   15.881   6.3128 -3.175394 8.395111 
1 1 1   11   10   83 o   25.065   4.5311   28.081   8.9172   38.092   11.052   9.4133   15.093   29.130   4.8233   17.094   6.9381 12.03536 8.449960 
1 1 1   11   10   84 o   26.940   3.8538   31.701   8.2222   33.656   10.905   29.124   12.517   27.127   5.1189   24.591   6.2364 2.536148 8.068229 
1 1 1   11   10   85 o   29.139   3.5781   36.779   8.3207   33.882   10.824   40.964   13.009   27.179   5.0722   29.614   5.5940 -2.434774 7.551220 
1 1 1   11   10   86 o   32.519   3.2842   45.404   8.5865   46.295   11.378   44.226   13.087   32.183   4.4565   30.836   5.4033 1.347275 7.003970 
1 1 1   11   10   87 o   60.684   2.0948  153.158   10.347  141.790   13.610  168.721   15.925   57.861   2.8949   62.945   3.1134 -5.084034 4.251323 
1 1 1   11   10   88 o   16.210   5.5557   11.991   8.8458   7.7720   12.305   16.505   12.726   15.329   6.2486   18.563   6.6410 -3.234216 9.118544 
1 1 1   11   10   89 o   34.536   3.7547   52.461   10.400   37.538   15.951   63.495   13.716   26.615   7.1857   37.376   4.5989 -10.76083 8.531331 
1 1 1   11   10   90 o   24.896   4.9886   29.211   9.7708   21.972   14.893   34.682   12.947   20.466   7.1976   26.304   6.1490 -5.838133 9.466582 
1 1 1   11   10   91 o   35.558   3.6361   55.696   10.391   75.608   16.353   42.213   13.457   40.107   5.1184   29.256   5.8474 10.85121 7.771109 
1 1 1   11   10   92 o   21.884   5.5222   23.756   9.8494   23.574   15.023   23.893   13.044   20.725   7.2334   21.130   6.7274 -0.4052162 9.878254 
1 1 1   11   10   93 o   28.483   4.1633   37.099   9.3808   19.480   13.042   55.985   13.503   19.147   6.7354   34.348   4.9669 -15.20020 8.368692 
1 1 1   11   10   94 o   31.014   3.8651   43.418   9.5600   30.307   13.437   56.855   13.604   23.560   6.6872   34.513   4.9792 -10.95341 8.337349 
1 1 1   11   10   95 f   24.381   5.1543   29.163   9.9228   40.627   15.976   21.962   12.661   26.778   7.1746   20.019   6.6467 6.758575 9.780274 
1 1 1   11   10   96 o   22.447   5.8764   26.202   10.876   12.813   16.180   37.240   14.690   16.880   7.0498   25.883   6.8551 -9.002287 9.833219 
1 1 1   11   10   97 o   20.643   5.5819   21.877   9.6165   23.027   16.120   21.242   11.982   19.852   7.4142   19.711   6.4626 0.1418190 9.835370 
1 1 1   11   10   98 o   13.086   5.3980   5.6947   9.3228   14.519   16.264   1.3764   11.378   17.185   7.1133   12.548   5.5707 4.637625 9.035030 
1 1 1   11   10   99 o   21.717   5.5974   24.426   9.9712   23.989   16.591   24.673   12.476   19.902   7.5029   20.950   6.5676 -1.048296 9.971306 
1 1 1   11   10  100 o   14.206   6.6863  -3.9234   19.923  -3.9234   19.923   0.0000   0.0000   14.206   6.6863  ?   ?  0.000000 6.686342 
1 1 1   11   10  101 o   12.432   5.8929  -7.7181   15.991  -7.7181   15.991   0.0000   0.0000   12.432   5.8929  ?   ?  0.000000 5.892945 
1 1 1   11   10  102 o   17.700   7.3114   17.307   17.134   17.307   17.134   0.0000   0.0000   17.700   7.3114  ?   ?  0.000000 7.311387 
1 1 1   11   10  103 o   12.199   5.8398 -10.1338   16.516 -10.1338   16.516   0.0000   0.0000   12.199   5.8398  ?   ?  0.000000 5.839761 
1 1 1   11   10  104 o   11.620   5.6269 -14.1818   16.412 -14.1818   16.412   0.0000   0.0000   11.620   5.6269  ?   ?  0.000000 5.626876 
1 1 1   11   10  105 o   16.019   6.8845   11.740   16.191   11.740   16.191   0.0000   0.0000   16.019   6.8845  ?   ?  0.000000 6.884515 
1 1 1   11   10  106 o   12.542   5.9268  -5.6356   15.940  -5.6356   15.940   0.0000   0.0000   12.542   5.9268  ?   ?  0.000000 5.926838 
1 1 1   11   10  107 o   15.628   6.8367   10.185   16.554   10.185   16.554   0.0000   0.0000   15.628   6.8367  ?   ?  0.000000 6.836673 
1 1 1   11   10  108 o   15.267   6.7358   8.6168   16.386   8.6168   16.386   0.0000   0.0000   15.267   6.7358  ?   ?  0.000000 6.735846 
1 1 1   11   11    0 o  187.747   3.1844  1438.90   48.735  1343.82   67.002  1545.71   71.016  181.236   4.5389  194.442   4.4805 -13.20630 6.377826 
1 1 1   11   11    1 o   18.932   6.2995   14.012   11.372  -9.2857   16.240   36.423   15.928   14.250   6.4625   29.114   6.8303 -14.86405 9.403029 
1 1 1   11   11    2 f   68.709   2.3203  192.951   12.977  191.926   20.358  193.653   16.842   68.383   3.6655   68.768   3.0118 -0.3850098 4.744119 
1 1 1   11   11    3 o   40.446   3.3688   67.366   11.006   89.422   17.560   53.096   14.125   46.449   4.7024   35.617   5.0028 10.83254 6.865915 
1 1 1   11   11    4 o   71.561   2.5588  209.408   14.902  213.781   20.767  204.766   21.397   72.198   3.5395   70.631   3.7297 1.566887 5.141823 
1 1 1   11   11    5 o   97.986   2.2491  391.936   17.964  397.302   25.116  386.316   25.704   98.532   3.1310   97.143   3.2506 1.388565 4.513291 
1 1 1   11   11    6 o  147.919   1.9412  892.827   23.407  886.830   36.390  897.060   30.570  147.296   3.0308  148.208   2.5304 -0.9115906 3.948227 
1 1 1   11   11    7 o   83.853   1.9485  286.921   13.319  308.918   22.980  275.794   16.343   86.855   3.2515   82.147   2.4434 4.708450 4.067258 
1 1 1   11   11    8 o  102.297   1.8113  426.958   15.104  385.968   25.340  449.544   18.810   97.103   3.2057  104.942   2.1989 -7.839180 3.887425 
1 1 1   11   11    9 o  175.808   1.9887  1261.33   28.499  1276.53   45.423  1251.47   36.599  176.696   3.1537  175.046   2.5650 1.649414 4.065065 
1 1 1   11   11   10 o  109.314   1.7902  487.533   15.952  452.659   27.043  506.144   19.755  105.171   3.1580  111.354   2.1764 -6.182587 3.835323 
1 1 1   11   11   11 o   61.240   2.3049  153.332   11.486  136.063   19.631  162.320   14.162   57.461   4.2205   62.970   2.7659 -5.508476 5.046088 
1 1 1   11   11   12 o   51.897   2.5655  110.274   10.819   71.950   18.385  130.579   13.382   41.445   5.5839   56.449   2.9182 -15.00452 6.300456 
1 1 1   11   11   13 o   39.909   3.1535   65.530   10.176   89.304   18.063   54.478   12.316   46.384   4.8489   36.208   4.2537 10.17529 6.450273 
1 1 1   11   11   14 o   70.809   2.1146  204.837   12.192  226.334   21.353  194.441   14.850   74.282   3.5367   68.939   2.6474 5.342857 4.417791 
1 1 1   11   11   15 o  168.874   1.9724  1163.86   27.151  1098.60   59.081  1181.33   30.571  163.579   4.4349  170.109   2.2046 -6.530045 4.952665 
1 1 1   11   11   16 o  128.370   1.9271  672.482   20.166  707.675   45.892  664.061   22.449  131.287   4.2940  127.543   2.1593 3.744423 4.806360 
1 1 1   11   11   17 o  133.940   1.9252  732.122   21.020  701.666   46.187  740.078   23.606  130.712   4.3408  134.644   2.1508 -3.932510 4.844456 
1 1 1   11   11   18 o  186.301   1.8581  1416.33   28.217  1362.81   48.013  1444.57   34.875  182.524   3.2270  188.092   2.2746 -5.568207 3.948106 
1 1 1   11   11   19 o   96.442   1.8571  379.556   14.600  376.977   25.298  380.845   17.877   95.939   3.2396   96.576   2.2709 -0.6372986 3.956215 
1 1 1   11   11   20 o   71.462   2.1061  208.659   12.255  240.442   21.408  193.165   14.947   76.566   3.4388   68.702   2.6740 7.863869 4.356109 
1 1 1   11   11   21 o  160.816   1.7804  1055.31   23.339  1032.05   39.944  1067.36   28.759  158.847   3.0849  161.684   2.1821 -2.837509 3.778616 
1 1 1   11   11   22 o   70.020   2.1220  200.348   12.097  174.833   20.737  213.512   14.895   65.190   3.9205   72.246   2.5331 -7.056816 4.667656 
1 1 1   11   11   23 o  160.127   1.9459  1046.57   25.399  994.947   55.947  1059.97   28.506  155.596   4.4155  161.120   2.1705 -5.524048 4.920144 
1 1 1   11   11   24 o   93.842   2.0289  359.501   15.520  375.609   35.066  355.577   17.307   95.513   4.5167   93.309   2.2754 2.203712 5.057495 
1 1 1   11   11   25 o  100.166   1.8119  409.469   14.794  373.750   25.640  427.295   18.113   95.497   3.2987  102.294   2.1723 -6.797241 3.949698 
1 1 1   11   11   26 o  117.195   1.9120  560.616   18.265  549.790   29.169  567.599   23.427  115.879   3.0908  117.868   2.4383 -1.989059 3.936821 
1 1 1   11   11   27 o   96.240   1.8360  378.024   14.403  361.630   25.219  385.959   17.546   93.928   3.2989   97.214   2.2142 -3.286346 3.973109 
1 1 1   11   11   28 o   17.925   5.6943   13.050   9.3497   27.521   17.393   7.1688   11.088   25.542   7.7099   15.920   6.1023 9.622137 9.832623 
1 1 1   11   11   29 f  177.524   1.8266  1286.29   26.432  1370.29   47.753  1249.19   31.737  182.959   3.2019  174.885   2.2263 8.074295 3.899842 
1 1 1   11   11   30 o   43.854   3.0972   79.099   11.001   52.988   25.363   85.149   12.209   34.805   8.9045   45.479   3.3160 -10.67432 9.501930 
1 1 1   11   11   31 o   91.112   1.7310  338.797   12.856  357.969   20.769  326.888   16.369   93.522   2.7273   89.427   2.2474 4.095085 3.533917 
1 1 1   11   11   32 o   23.430   4.9617   23.465   9.1806   31.568   16.304   19.702   11.109   27.040   7.2493   21.514   6.0715 5.525688 9.455956 
1 1 1   11   11   33 o   55.969   2.3103  128.210   10.517  134.082   15.251  122.885   14.523   57.118   3.2896   54.675   3.2737 2.442635 4.640922 
1 1 1   11   11   34 o  100.706   1.7299  413.951   14.200  414.390   20.052  413.510   20.113  100.687   2.4432  100.579   2.4532 0.1082458 3.462251 
1 1 1   11   11   35 o  145.478   1.8467  864.059   21.899  871.771   27.575  850.891   36.034  146.055   2.3162  144.150   3.0666 1.904800 3.843002 
1 1 1   11   11   36 o   12.856   5.1520   3.3293   8.2070 -12.1729   12.796   14.161   10.697   11.652   5.4436   18.758   6.1033 -7.106313 8.178217 
1 1 1   11   11   37 o   92.477   1.6496  349.065   12.435  359.284   18.905  341.272   16.510   93.704   2.4772   91.386   2.2163 2.317757 3.323932 
1 1 1   11   11   38 o   53.607   2.2192  117.640   9.6761  126.630   15.382  111.754   12.447   55.458   3.4193   52.158   2.9395 3.300236 4.509151 
1 1 1   11   11   39 o   20.150   5.2679   17.423   8.7484   28.514   14.235   10.692   11.090   25.657   6.7257   17.303   6.1984 8.354101 9.146320 
1 1 1   11   11   40 o   50.899   2.3722  106.168   9.8150   97.393   15.547  111.983   12.656   48.501   3.9670   52.196   2.9870 -3.694584 4.965847 
1 1 1   11   11   41 o   12.129   5.1199   0.6665   8.6768   0.4847   14.157   0.7759   10.981   15.251   6.4931   13.594   5.7501 1.657122 8.673183 
1 1 1   11   11   42 o   69.738   2.1809  199.016   12.382  210.197   17.531  187.883   17.492   71.544   3.0127   67.603   3.1831 3.941193 4.382780 
1 1 1   11   11   43 o   40.018   3.4808   66.282   11.242   54.552   15.874   78.085   15.923   35.805   5.6239   43.235   4.5879 -7.430367 7.257943 
1 1 1   11   11   44 o   64.306   2.4413  169.484   12.774  171.484   18.505  167.664   17.655   64.490   3.5336   63.791   3.4076 0.6986008 4.909010 
1 1 1   11   11   45 o   12.591   5.1578   2.4010   8.4350 -13.0582   14.091   11.033   10.530   12.232   5.7140   17.208   6.0522 -4.976718 8.323350 
1 1 1   11   11   46 o   40.687   2.7203   68.151   8.9705   69.251   14.499   67.468   11.418   40.684   4.4442   40.350   3.5063 0.3345947 5.660800 
1 1 1   11   11   47 o   11.186   4.8045  -0.3820   7.8754  -7.9560   13.032   3.9750   9.8843   12.566   5.7341   14.013   5.6408 -1.447161 8.043507 
1 1 1   11   11   48 o   20.810   4.7378   18.674   7.8561   13.566   12.716   21.827   9.9911   18.918   6.6510   22.427   5.5064 -3.508505 8.634608 
1 1 1   11   11   49 o   19.515   4.8357   16.450   7.6529   20.901   12.289   13.630   9.7809   22.020   6.4402   18.186   5.8293 3.834358 8.686615 
1 1 1   11   11   50 o   72.168   1.8719  213.095   11.003  210.775   15.873  215.240   15.265   71.620   2.7238   72.403   2.5907 -0.7834854 3.759076 
1 1 1   11   11   51 o   30.595   3.2101   38.940   7.8867   27.013   13.372   45.301   9.7660   24.792   6.5283   32.923   3.7031 -8.131439 7.505448 
1 1 1   11   11   52 o   47.981   2.6416   94.776   10.292  100.819   19.803   92.539   12.047   48.868   5.0438   47.312   3.1414 1.556690 5.942072 
1 1 1   11   11   53 o   11.090   4.8437  -1.4287   8.2810   12.349   17.516  -5.3944   9.3975   19.857   7.6548   10.760   4.8941 9.096557 9.085609 
1 1 1   11   11   54 o   71.020   2.1134  206.797   12.222  214.411   22.942  203.779   14.441   71.801   3.9348   70.412   2.5201 1.388626 4.672662 
1 1 1   11   11   55 o   22.451   4.4589   21.727   7.8725   30.089   14.105   17.943   9.4877   26.009   6.6333   20.282   5.5695 5.727350 8.661374 
1 1 1   11   11   56 o   63.161   1.8954  163.479   9.7474  155.337   17.006  167.462   11.896   61.190   3.4230   63.847   2.2893 -2.656883 4.118008 
1 1 1   11   11   57 o   89.641   1.7544  328.861   12.820  300.185   24.795  339.322   14.977   85.019   3.5859   90.996   2.0191 -5.976044 4.115268 
1 1 1   11   11   58 o   74.122   1.7651  224.906   10.664  236.400   18.960  219.588   12.898   75.593   3.0835   73.127   2.1662 2.465134 3.768328 
1 1 1   11   11   59 o   29.881   3.1452   37.313   7.5460   34.420   14.520   38.384   8.8324   27.682   6.5396   30.180   3.6652 -2.498363 7.496718 
1 1 1   11   11   60 o   24.071   3.8391   24.714   7.2798   31.501   14.351   22.363   8.4472   26.401   6.6679   22.639   4.7301 3.761667 8.175262 
1 1 1   11   11   61 o   32.498   2.8577   43.953   7.4933   47.175   14.134   42.693   8.8376   32.836   5.4730   31.874   3.4567 0.9621487 6.473253 
1 1 1   11   11   62 o   11.981   4.7059   3.7903   6.7184   14.346   13.241   0.1308   7.7965   18.985   6.7762   11.184   4.7915 7.800982 8.299128 
1 1 1   11   11   63 o   36.917   2.5806   56.494   7.7168   43.119   14.245   62.050   9.1806   31.139   5.8260   38.604   2.9396 -7.464476 6.525549 
1 1 1   11   11   64 o   51.420   2.1902  108.962   9.1593  112.546   20.179  108.032   10.279   51.165   4.8980   51.122   2.4741 0.4285431E-01 5.487355 
1 1 1   11   11   65 o   50.479   2.0604  104.922   8.4602  105.142   15.217  104.824   10.178   49.947   3.7652   50.339   2.4882 -0.3919373 4.513063 
1 1 1   11   11   66 o   16.923   4.6770   12.600   6.6666   8.2203   13.061   14.143   7.7526   16.562   6.5441   17.887   5.0802 -1.325369 8.284499 
1 1 1   11   11   67 o   28.714   3.0897   34.685   7.1181   37.323   11.542   33.066   9.0423   29.096   5.0496   27.695   4.1316 1.401590 6.524429 
1 1 1   11   11   68 o   24.211   3.8230   25.239   7.2949   20.976   13.622   26.954   8.6377   21.480   6.8788   24.828   4.4306 -3.347616 8.182225 
1 1 1   11   11   69 o   45.901   2.6802   87.659   9.9848   77.263   12.439  106.489   16.741   42.730   3.6050   49.925   4.1512 -7.195484 5.497986 
1 1 1   11   11   70 o   50.207   2.3355  104.380   9.5320  108.192   13.006   99.956   14.011   50.792   3.1569   48.628   3.5593 2.164299 4.757534 
1 1 1   11   11   71 o   14.680   4.6489   9.2537   6.2361   8.2700   10.813   9.7440   7.6335   15.598   6.0139   15.268   5.1622 0.3305569 7.925653 
1 1 1   11   11   72 f   19.576   4.2991   16.984   6.6720   7.7624   12.477   20.677   7.8957   15.985   6.3705   21.531   4.6360 -5.545342 7.878800 
1 1 1   11   11   73 o   66.023   1.8984  179.620   10.206  167.081   16.343  187.638   13.068   63.050   3.1902   67.270   2.3870 -4.220131 3.984360 
1 1 1   11   11   74 o   59.468   1.8730  145.751   9.0681  151.232   15.809  143.063   11.070   59.918   3.2490   58.744   2.3164 1.173630 3.990184 
1 1 1   11   11   75 o   33.335   2.5929   46.471   6.9904   37.080   11.577   51.859   8.7693   28.699   5.1376   35.039   3.1023 -6.340275 6.001624 
1 1 1   11   11   76 o   27.328   3.0233   31.663   6.6224   46.859   11.442   24.007   8.1210   32.681   4.4072   23.225   4.4515 9.455774 6.264148 
1 1 1   11   11   77 o   26.691   2.9794   30.223   6.3720   27.475   11.145   31.558   7.7666   24.257   5.7287   27.041   3.6139 -2.783707 6.773379 
1 1 1   11   11   78 o   10.621   4.2682   2.7322   5.6493   10.593   10.774  -0.2488   6.6347   16.279   6.0648   10.042   4.3615 6.236777 7.470279 
1 1 1   11   11   79 o   20.332   3.6293   18.116   5.7943   14.319   12.257   19.209   6.5754   18.026   6.5089   20.798   4.0239 -2.772606 7.652351 
1 1 1   11   11   80 f   32.947   3.4977   46.777   9.2503   48.539   13.109   45.030   13.055   32.635   5.0942   31.273   5.3108 1.361382 7.359022 
1 1 1   11   11   81 o   19.448   5.3580   17.817   8.7646   11.563   12.345   24.174   12.446   16.833   6.4423   22.124   6.4841 -5.290888 9.140398 
1 1 1   11   11   82 o   35.137   3.6713   53.731   10.360   52.342   16.128   54.706   13.518   32.831   6.2548   34.619   4.9293 -1.788433 7.963704 
1 1 1   11   11   83 o   31.124   3.9615   42.856   9.8230   54.695   13.947   31.201   13.837   34.359   5.1372   24.741   6.6982 9.617266 8.441414 
1 1 1   11   11   84 o   35.822   3.4257   55.708   9.8814   35.795   13.916   75.955   14.033   26.594   6.4799   41.239   4.2346 -14.64470 7.740911 
1 1 1   11   11   85 o   28.605   4.4220   37.276   9.9788   38.485   13.040   35.568   15.502   27.981   5.9030   25.821   7.1303 2.159828 9.256724 
1 1 1   11   11   86 o   16.922   5.6334   13.729   9.0935   18.464   12.805   8.9125   12.916   19.069   6.6766   15.644   6.3925 3.424399 9.243425 
1 1 1   11   11   87 o   11.674   5.0476   1.4683   8.8053  -0.7150   12.195   3.8461   12.727   12.677   5.6878   14.030   6.0672 -1.353184 8.316331 
1 1 1   11   11   88 o   39.658   3.1126   68.189   9.9814   72.917   13.935   63.208   14.304   39.918   4.3531   36.614   4.9166 3.303684 6.566779 
1 1 1   11   11   89 o   39.873   3.3396   69.769   10.755   67.916   13.870   72.565   17.033   38.229   4.5392   38.357   5.6138 -0.1275558 7.219373 
1 1 1   11   11   90 o   12.727   5.3345   4.3863   9.3152  -4.0497   12.011   17.120   14.756   11.688   5.3961   18.101   7.0130 -6.412859 8.848753 
1 1 1   11   11   91 o   14.274   5.5304   8.6845   9.1767   3.7028   11.846   16.159   14.511   13.411   5.8262   17.688   6.9254 -4.277674 9.050224 
1 1 1   11   11   92 o   15.139   5.6696   10.672   9.4399   16.694   12.619   3.0204   14.224   17.778   6.5750   13.986   6.2179 3.792094 9.049483 
1 1 1   11   11   93 o   18.445   5.7433   17.709   9.5576   8.4325   12.368   31.460   15.058   14.854   6.1805   23.138   7.2097 -8.284140 9.496237 
1 1 1   11   11   94 o   20.096   6.0205   21.655   10.635   26.439   12.822   11.112   19.037   21.654   6.6369   16.658   7.3081 4.996475 9.872054 
1 1 1   11   11   95 o   18.637   6.0234   18.680   10.429   15.496   12.549   25.789   18.750   17.126   6.5095   20.144   7.8766 -3.017780 10.21836 
1 1 1   11   11   96 o   14.043   6.0883   5.6158   12.881   5.6158   12.881   0.0000   0.0000   14.043   6.0883  ?   ?  0.000000 6.088250 
1 1 1   11   11   97 o   10.199   4.9429 -13.8629   12.730 -13.8629   12.730   0.0000   0.0000   10.199   4.9429  ?   ?  0.000000 4.942940 
1 1 1   11   11   98 o   19.320   6.8548   21.914   13.531   21.914   13.531   0.0000   0.0000   19.320   6.8548  ?   ?  0.000000 6.854780 
1 1 1   11   11   99 o   13.064   5.8909   1.5485   13.268   1.5485   13.268   0.0000   0.0000   13.064   5.8909  ?   ?  0.000000 5.890860 
1 1 1   11   11  100 o   17.704   6.7778   17.891   13.668   17.891   13.668   0.0000   0.0000   17.704   6.7778  ?   ?  0.000000 6.777831 
1 1 1   11   11  101 o   13.078   6.0496  -1.0710   15.203  -1.0710   15.203   0.0000   0.0000   13.078   6.0496  ?   ?  0.000000 6.049553 
1 1 1   11   11  102 o   13.127   5.8883   2.5976   13.061   2.5976   13.061   0.0000   0.0000   13.127   5.8883  ?   ?  0.000000 5.888320 
1 1 1   11   11  103 o   9.4662   4.6596 -18.6005   12.669 -18.6005   12.669   0.0000   0.0000   9.4662   4.6596  ?   ?  0.000000 4.659551 
1 1 1   11   11  104 o   13.200   6.1976  -2.9783   16.936  -2.9783   16.936   0.0000   0.0000   13.200   6.1976  ?   ?  0.000000 6.197644 
1 1 1   11   11  105 o   13.935   6.7064  -8.1310   22.452  -8.1310   22.452   0.0000   0.0000   13.935   6.7064  ?   ?  0.000000 6.706390 
1 1 1   12    0 -127 o   8.3400   5.7776  -7.2241   13.533  -7.2241   13.533  -7.2241   13.533   8.3400   5.7776   8.3400   5.7776 -0.000000 0.000000 
1 1 1   12    0 -126 o   9.1180   6.1889  -3.0910   13.828  -3.0910   13.828  -3.0910   13.828   9.1180   6.1889   9.1180   6.1889 0.000000 0.000000 
1 1 1   12    0 -125 o   11.891   7.3466   8.6000   14.023   8.6000   14.023   8.6000   14.023   11.891   7.3466   11.891   7.3466 -0.000000 0.000000 
1 1 1   12    0 -124 o   13.390   8.0196   12.873   15.621   12.873   15.621   12.873   15.621   13.390   8.0196   13.390   8.0196 0.000000 0.000000 
1 1 1   12    0 -123 o   38.090   6.2330   70.598   17.798   70.598   17.798   70.598   17.798   38.090   6.2330   38.090   6.2330 0.000000 0.000000 
1 1 1   12    0 -122 o   14.070   8.2344   14.733   15.797   14.733   15.797   14.733   15.797   14.070   8.2344   14.070   8.2344 -0.000000 0.000000 
1 1 1   12    0 -121 o   14.759   7.9846   16.283   13.419   16.283   13.419   16.283   13.419   14.759   7.9846   14.759   7.9846 0.000000 0.000000 
1 1 1   12    0 -120 o   10.478   6.7134   3.8839   12.933   3.8839   12.933   3.8839   12.933   10.478   6.7134   10.478   6.7134 0.000000 0.000000 
1 1 1   12    0 -119 o   10.914   6.9106   5.1413   13.230   5.1413   13.230   5.1413   13.230   10.914   6.9106   10.914   6.9106 0.000000 0.000000 
1 1 1   12    0 -118 o   10.347   6.6820   2.9357   13.142   2.9357   13.142   2.9357   13.142   10.347   6.6820   10.347   6.6820 0.000000 0.000000 
1 1 1   12    0 -117 o   27.647   7.0970   40.230   13.823   40.230   13.823   40.230   13.823   27.647   7.0970   27.647   7.0970 0.000000 0.000000 
1 1 1   12    0 -116 o   16.778   8.2731   20.190   13.534   20.190   13.534   20.190   13.534   16.778   8.2731   16.778   8.2731 0.000000 0.000000 
1 1 1   12    0 -115 o   13.188   7.5821   11.814   13.024   11.814   13.024   11.814   13.024   13.188   7.5821   13.188   7.5821 0.000000 0.000000 
1 1 1   12    0 -114 o   9.0984   6.0585  -1.4705   12.123  -1.4705   12.123  -1.4705   12.123   9.0984   6.0585   9.0984   6.0585 0.000000 0.000000 
1 1 1   12    0 -113 o   29.447   6.1964   42.259   13.094   42.259   13.094   42.259   13.094   29.447   6.1964   29.447   6.1964 -0.000000 0.000000 
1 1 1   12    0 -112 o   8.0070   5.6168 -12.3215   13.937 -12.3215   13.937 -12.3215   13.937   8.0070   5.6168   8.0070   5.6168 -0.000000 0.000000 
1 1 1   12    0 -111 o   21.117   7.8219   26.419   12.489   26.419   12.489   26.419   12.489   21.117   7.8219   21.117   7.8219 -0.000000 0.000000 
1 1 1   12    0 -110 o   12.264   7.2582   8.6679   12.514   8.6679   12.514   8.6679   12.514   12.264   7.2582   12.264   7.2582 0.000000 0.000000 
1 1 1   12    0 -109 o   56.597   4.1644  136.726   18.968  136.726   18.968  136.726   18.968   56.597   4.1644   56.597   4.1644 0.000000 0.000000 
1 1 1   12    0 -108 o   59.488   3.9358  149.851   18.891  149.851   18.891  149.851   18.891   59.488   3.9358   59.488   3.9358 -0.000000 0.000000 
1 1 1   12    0 -107 o   47.084   4.5520   95.696   17.071   95.696   17.071   95.696   17.071   47.084   4.5520   47.084   4.5520 -0.000000 0.000000 
1 1 1   12    0 -106 f   9.5635   6.2626  -0.5037   12.121  -0.5037   12.121  -0.5037   12.121   9.5635   6.2626   9.5635   6.2626 0.000000 0.000000 
1 1 1   12    0 -105 o   55.663   3.4605  129.794   15.561  129.794   15.561  129.794   15.561   55.663   3.4605   55.663   3.4605 0.000000 0.000000 
1 1 1   12    0 -104 o   93.584   3.4497  363.920   26.235  363.920   26.235  363.920   26.235   93.584   3.4497   93.584   3.4497 0.000000 0.000000 
1 1 1   12    0 -103 o   26.842   9.1457   40.507   17.944   40.507   17.944   40.507   17.944   26.842   9.1457   26.842   9.1457 -0.000000 0.000000 
1 1 1   12    0 -102 o   38.882   6.1088   68.366   17.935   68.366   17.935   68.366   17.935   38.882   6.1088   38.882   6.1088 0.000000 0.000000 
1 1 1   12    0 -101 o   11.255   7.3175   0.4137   16.129   0.4137   16.129   0.4137   16.129   11.255   7.3175   11.255   7.3175 0.000000 0.000000 
1 1 1   12    0 -100 o   14.190   7.5863   12.661   11.981   12.661   11.981   12.661   11.981   14.190   7.5863   14.190   7.5863 0.000000 0.000000 
1 1 1   12    0  -99 o   9.2164   6.1100  -2.3931   12.104  -2.3931   12.104  -2.3931   12.104   9.2164   6.1100   9.2164   6.1100 -0.000000 0.000000 
1 1 1   12    0  -98 o   25.542   6.9860   32.786   12.574   32.786   12.574   32.786   12.574   25.542   6.9860   25.542   6.9860 0.000000 0.000000 
1 1 1   12    0  -97 o   10.876   7.1445  -1.5185   15.963  -1.5185   15.963  -1.5185   15.963   10.876   7.1445   10.876   7.1445 0.000000 0.000000 
1 1 1   12    0  -96 o   8.5630   5.7894  -5.1677   11.866  -5.1677   11.866  -5.1677   11.866   8.5630   5.7894   8.5630   5.7894 -0.000000 0.000000 
1 1 1   12    0  -95 o   13.899   7.5409   11.742   12.003   11.742   12.003   11.742   12.003   13.899   7.5409   13.899   7.5409 -0.000000 0.000000 
1 1 1   12    0  -94 o   91.506   2.6325  343.730   19.599  343.730   19.599  343.730   19.599   91.506   2.6325   91.506   2.6325 0.000000 0.000000 
1 1 1   12    0  -93 o   55.084   4.0174  126.851   17.814  126.851   17.814  126.851   17.814   55.084   4.0174   55.084   4.0174 0.000000 0.000000 
1 1 1   12    0  -92 f   70.299   3.5135  204.342   20.018  204.342   20.018  204.342   20.018   70.299   3.5135   70.299   3.5135 0.000000 0.000000 
1 1 1   12    0  -91 o  117.199   3.0627  563.713   29.215  563.713   29.215  563.713   29.215  117.199   3.0627  117.199   3.0627 -0.000000 0.000000 
1 1 1   12    0  -90 o   18.592   7.9666   20.497   12.339   20.497   12.339   20.497   12.339   18.592   7.9666   18.592   7.9666 0.000000 0.000000 
1 1 1   12    0  -89 o   98.975   2.5667  401.210   20.676  401.210   20.676  401.210   20.676   98.975   2.5667   98.975   2.5667 0.000000 0.000000 
1 1 1   12    0  -88 o   96.195   2.5667  378.937   20.094  378.937   20.094  378.937   20.094   96.195   2.5667   96.195   2.5667 0.000000 0.000000 
1 1 1   12    0  -87 o   29.374   6.3970   40.177   13.421   40.177   13.421   40.177   13.421   29.374   6.3970   29.374   6.3970 -0.000000 0.000000 
1 1 1   12    0  -86 o   38.280   4.7080   62.794   14.096   62.794   14.096   62.794   14.096   38.280   4.7080   38.280   4.7080 0.000000 0.000000 
1 1 1   12    0  -85 o   39.150   5.0898   66.024   15.486   66.024   15.486   66.024   15.486   39.150   5.0898   39.150   5.0898 0.000000 0.000000 
1 1 1   12    0  -84 o   53.676   3.7820  119.633   16.355  119.633   16.355  119.633   16.355   53.676   3.7820   53.676   3.7820 -0.000000 0.000000 
1 1 1   12    0  -83 o   40.988   4.7703   71.589   15.375   71.589   15.375   71.589   15.375   40.988   4.7703   40.988   4.7703 -0.000000 0.000000 
1 1 1   12    0  -82 o   93.520   2.6643  357.945   20.273  357.945   20.273  357.945   20.273   93.520   2.6643   93.520   2.6643 0.000000 0.000000 
1 1 1   12    0  -81 o   8.6705   5.9254  -8.1323   13.139  -8.1323   13.139  -8.1323   13.139   8.6705   5.9254   8.6705   5.9254 0.000000 0.000000 
1 1 1   12    0  -80 o  183.929   2.6402  1381.70   39.565  1381.70   39.565  1381.70   39.565  183.929   2.6402  183.929   2.6402 0.000000 0.000000 
1 1 1   12    0  -79 o   6.7045   4.8237 -22.4707   12.932 -22.4707   12.932 -22.4707   12.932   6.7045   4.8237   6.7045   4.8237 0.000000 0.000000 
1 1 1   12    0  -78 o   42.641   4.2279   76.504   14.340   76.504   14.340   76.504   14.340   42.641   4.2279   42.641   4.2279 0.000000 0.000000 
1 1 1   12    0  -77 o   57.749   3.3949  137.603   15.854  137.603   15.854  137.603   15.854   57.749   3.3949   57.749   3.3949 0.000000 0.000000 
1 1 1   12    0  -76 o  100.699   2.6571  414.646   21.777  414.646   21.777  414.646   21.777  100.699   2.6571  100.699   2.6571 0.000000 0.000000 
1 1 1   12    0  -75 o   13.164   7.9196   7.1676   15.369   7.1676   15.369   7.1676   15.369   13.164   7.9196   13.164   7.9196 0.000000 0.000000 
1 1 1   12    0  -74 o  205.212   2.1969  1718.19   36.741  1718.19   36.741  1718.19   36.741  205.212   2.1969  205.212   2.1969 0.000000 0.000000 
1 1 1   12    0  -73 o  219.643   2.2670  1968.28   40.579  1968.28   40.579  1968.28   40.579  219.643   2.2670  219.643   2.2670 0.000000 0.000000 
1 1 1   12    0  -72 o  192.594   2.1141  1513.22   33.181  1513.22   33.181  1513.22   33.181  192.594   2.1141  192.594   2.1141 0.000000 0.000000 
1 1 1   12    0  -71 o   42.745   2.3360   75.185   8.0834   75.185   8.0834   75.185   8.0834   42.745   2.3360   42.745   2.3360 -0.000000 0.000000 
1 1 1   12    0  -70 o   7.4740   4.8897  -1.0075   7.3637  -1.0075   7.3637  -1.0075   7.3637   7.4740   4.8897   7.4740   4.8897 0.000000 0.000000 
1 1 1   12    0  -69 o   40.979   3.0484   69.641   10.051   69.641   10.051   69.641   10.051   40.979   3.0484   40.979   3.0484 0.000000 0.000000 
1 1 1   12    0  -68 o  190.648   2.2362  1482.77   34.742  1482.77   34.742  1482.77   34.742  190.648   2.2362  190.648   2.2362 0.000000 0.000000 
1 1 1   12    0  -67 o  178.812   2.2035  1304.38   32.107  1304.38   32.107  1304.38   32.107  178.812   2.2035  178.812   2.2035 -0.000000 0.000000 
1 1 1   12    0  -66 o   5.8483   4.1629 -12.2657   8.6407 -12.2657   8.6407 -12.2657   8.6407   5.8483   4.1629   5.8483   4.1629 0.000000 0.000000 
1 1 1   12    0  -65 o   30.181   4.6336   39.720   10.602   39.720   10.602   39.720   10.602   30.181   4.6336   30.181   4.6336 -0.000000 0.000000 
1 1 1   12    0  -64 o   9.0987   5.7176   1.6427   8.8686   1.6427   8.8686   1.6427   8.8686   9.0987   5.7176   9.0987   5.7176 -0.000000 0.000000 
1 1 1   12    0  -63 o   50.622   3.9875  106.515   16.213  106.515   16.213  106.515   16.213   50.622   3.9875   50.622   3.9875 -0.000000 0.000000 
1 1 1   12    0  -62 o  161.788   2.5657  1068.22   33.818  1068.22   33.818  1068.22   33.818  161.788   2.5657  161.788   2.5657 0.000000 0.000000 
1 1 1   12    0  -61 o  179.932   2.6179  1321.10   38.379  1321.10   38.379  1321.10   38.379  179.932   2.6179  179.932   2.6179 0.000000 0.000000 
1 1 1   12    0  -60 o  281.699   3.9410  3240.02   90.457  3240.02   90.457  3240.02   90.457  281.699   3.9410  281.699   3.9410 0.000000 0.000000 
1 1 1   12    0  -59 o  100.014   2.2202  408.438   18.080  408.438   18.080  408.438   18.080  100.014   2.2202  100.014   2.2202 0.000000 0.000000 
1 1 1   12    0  -58 o   11.496   7.0393   4.4697   12.608   4.4697   12.608   4.4697   12.608   11.496   7.0393   11.496   7.0393 0.000000 0.000000 
1 1 1   12    0  -57 o  182.960   2.1529  1365.34   32.099  1365.34   32.099  1365.34   32.099  182.960   2.1529  182.960   2.1529 0.000000 0.000000 
1 1 1   12    0  -56 o  180.521   2.1421  1329.17   31.511  1329.17   31.511  1329.17   31.511  180.521   2.1421  180.521   2.1421 -0.000000 0.000000 
1 1 1   12    0  -55 o  154.001   2.8153  968.086   35.315  968.086   35.315  968.086   35.315  154.001   2.8153  154.001   2.8153 -0.000000 0.000000 
1 1 1   12    0  -54 o  321.762   3.4561  4224.37   90.625  4224.37   90.625  4224.37   90.625  321.762   3.4561  321.762   3.4561 0.000000 0.000000 
1 1 1   12    0  -53 o   55.560   2.6348  126.716   11.872  126.716   11.872  126.716   11.872   55.560   2.6348   55.560   2.6348 0.000000 0.000000 
1 1 1   12    0  -52 o   50.536   2.7941  105.092   11.429  105.092   11.429  105.092   11.429   50.536   2.7941   50.536   2.7941 0.000000 0.000000 
1 1 1   12    0  -51 o  118.465   1.9494  572.583   18.813  572.583   18.813  572.583   18.813  118.465   1.9494  118.465   1.9494 -0.000000 0.000000 
1 1 1   12    0  -50 o  143.243   1.9924  836.964   23.254  836.964   23.254  836.964   23.254  143.243   1.9924  143.243   1.9924 0.000000 0.000000 
1 1 1   12    0  -49 o  107.525   2.1934  471.940   19.207  471.940   19.207  471.940   19.207  107.525   2.1934  107.525   2.1934 0.000000 0.000000 
1 1 1   12    0  -48 o  192.728   2.5419  1515.23   39.918  1515.23   39.918  1515.23   39.918  192.728   2.5419  192.728   2.5419 -0.000000 0.000000 
1 1 1   12    0  -47 o  285.958   3.1794  3335.88   74.091  3335.88   74.091  3335.88   74.091  285.958   3.1794  285.958   3.1794 -0.000000 0.000000 
1 1 1   12    0  -46 o   54.459   2.8066  121.888   12.383  121.888   12.383  121.888   12.383   54.459   2.8066   54.459   2.8066 0.000000 0.000000 
1 1 1   12    0  -45 o   41.407   3.3967   71.321   11.281   71.321   11.281   71.321   11.281   41.407   3.3967   41.407   3.3967 0.000000 0.000000 
1 1 1   12    0  -44 o   57.410   4.1655  136.553   19.253  136.553   19.253  136.553   19.253   57.410   4.1655   57.410   4.1655 0.000000 0.000000 
1 1 1   12    0  -43 o  510.480   5.0785 10637.19  211.278 10637.19  211.278 10637.19  211.278  510.480   5.0785  510.480   5.0785 -0.000000 0.000000 
1 1 1   12    0  -42 o  241.327   2.8580  2375.54   56.204  2375.54   56.204  2375.54   56.204  241.327   2.8580  241.327   2.8580 0.000000 0.000000 
1 1 1   12    0  -41 o  137.048   2.3063  766.343   25.748  766.343   25.748  766.343   25.748  137.048   2.3063  137.048   2.3063 0.000000 0.000000 
1 1 1   12    0  -40 o   45.979   2.8352   87.172   10.533   87.172   10.533   87.172   10.533   45.979   2.8352   45.979   2.8352 0.000000 0.000000 
1 1 1   12    0  -39 o   18.610   5.6541   17.532   7.4856   17.532   7.4856   17.532   7.4856   18.610   5.6541   18.610   5.6541 0.000000 0.000000 
1 1 1   12    0  -38 o  346.909   2.8229  4907.44   79.816  4907.44   79.816  4907.44   79.816  346.909   2.8229  346.909   2.8229 -0.000000 0.000000 
1 1 1   12    0  -37 o  186.224   2.0982  1414.21   31.842  1414.21   31.842  1414.21   31.842  186.224   2.0982  186.224   2.0982 0.000000 0.000000 
1 1 1   12    0  -36 o   31.544   3.2008   41.806   8.0202   41.806   8.0202   41.806   8.0202   31.544   3.2008   31.544   3.2008 0.000000 0.000000 
1 1 1   12    0  -35 o   63.714   1.9527  165.939   10.120  165.939   10.120  165.939   10.120   63.714   1.9527   63.714   1.9527 0.000000 0.000000 
1 1 1   12    0  -34 o  420.311   3.3033  7203.98  113.161  7203.98  113.161  7203.98  113.161  420.311   3.3033  420.311   3.3033 0.000000 0.000000 
1 1 1   12    0  -33 o   21.274   5.5902   21.873   8.3756   21.873   8.3756   21.873   8.3756   21.274   5.5902   21.274   5.5902 0.000000 0.000000 
1 1 1   12    0  -32 o  223.535   2.3049  2037.51   41.989  2037.51   41.989  2037.51   41.989  223.535   2.3049  223.535   2.3049 -0.000000 0.000000 
1 1 1   12    0  -31 o   8.4781   5.3746   0.9526   8.0306   0.9526   8.0306   0.9526   8.0306   8.4781   5.3746   8.4781   5.3746 0.000000 0.000000 
1 1 1   12    0  -30 o  194.484   2.1447  1542.35   33.992  1542.35   33.992  1542.35   33.992  194.484   2.1447  194.484   2.1447 0.000000 0.000000 
1 1 1   12    0  -29 o   94.887   1.7775  367.372   13.737  367.372   13.737  367.372   13.737   94.887   1.7775   94.887   1.7775 0.000000 0.000000 
1 1 1   12    0  -28 o   76.659   1.8860  239.972   11.769  239.972   11.769  239.972   11.769   76.659   1.8860   76.659   1.8860 0.000000 0.000000 
1 1 1   12    0  -27 o   43.212   2.6391   76.964   9.2158   76.964   9.2158   76.964   9.2158   43.212   2.6391   43.212   2.6391 0.000000 0.000000 
1 1 1   12    0  -26 o  133.957   1.7639  731.793   19.253  731.793   19.253  731.793   19.253  133.957   1.7639  133.957   1.7639 0.000000 0.000000 
1 1 1   12    0  -25 o  619.789   4.6779 15665.94  236.305 15665.94  236.305 15665.94  236.305  619.789   4.6779  619.789   4.6779 0.000000 0.000000 
1 1 1   12    0  -24 o  232.773   2.1474  2209.12   40.739  2209.12   40.739  2209.12   40.739  232.773   2.1474  232.773   2.1474 -0.000000 0.000000 
1 1 1   12    0  -23 o  386.544   3.0790  6092.05   97.002  6092.05   97.002  6092.05   97.002  386.544   3.0790  386.544   3.0790 0.000000 0.000000 
1 1 1   12    0  -22 o  163.809   1.8304  1094.13   24.435  1094.13   24.435  1094.13   24.435  163.809   1.8304  163.809   1.8304 0.000000 0.000000 
1 1 1   12    0  -21 o   34.203   3.3243   49.027   9.0539   49.027   9.0539   49.027   9.0539   34.203   3.3243   34.203   3.3243 0.000000 0.000000 
1 1 1   12    0  -20 o  278.454   2.6791  3161.44   60.797  3161.44   60.797  3161.44   60.797  278.454   2.6791  278.454   2.6791 -0.000000 0.000000 
1 1 1   12    0  -19 f  246.355   2.4755  2474.59   49.701  2474.59   49.701  2474.59   49.701  246.355   2.4755  246.355   2.4755 0.000000 0.000000 
1 1 1   12    0  -18 o   74.691   2.2030  227.988   13.387  227.988   13.387  227.988   13.387   74.691   2.2030   74.691   2.2030 0.000000 0.000000 
1 1 1   12    0  -17 o  447.218   4.5050  8156.59  164.193  8156.59  164.193  8156.59  164.193  447.218   4.5050  447.218   4.5050 0.000000 0.000000 
1 1 1   12    0  -16 o   29.784   5.3492   39.479   11.742   39.479   11.742   39.479   11.742   29.784   5.3492   29.784   5.3492 -0.000000 0.000000 
1 1 1   12    0  -15 o  194.442   2.5462  1541.88   40.342  1541.88   40.342  1541.88   40.342  194.442   2.5462  194.442   2.5462 0.000000 0.000000 
1 1 1   12    0  -14 o   39.002   3.9430   63.890   12.218   63.890   12.218   63.890   12.218   39.002   3.9430   39.002   3.9430 0.000000 0.000000 
1 1 1   12    0  -13 o   98.050   2.2191  392.457   17.715  392.457   17.715  392.457   17.715   98.050   2.2191   98.050   2.2191 0.000000 0.000000 
1 1 1   12    0  -12 o  201.763   2.2263  1659.88   36.605  1659.88   36.605  1659.88   36.605  201.763   2.2263  201.763   2.2263 -0.000000 0.000000 
1 1 1   12    0  -11 o  174.861   2.3788  1246.99   33.892  1246.99   33.892  1246.99   33.892  174.861   2.3788  174.861   2.3788 0.000000 0.000000 
1 1 1   12    0  -10 o  172.455   2.3708  1212.93   33.314  1212.93   33.314  1212.93   33.314  172.455   2.3708  172.455   2.3708 -0.000000 0.000000 
1 1 1   12    0   -9 o   79.835   2.4116  260.498   15.661  260.498   15.661  260.498   15.661   79.835   2.4116   79.835   2.4116 0.000000 0.000000 
1 1 1   12    0   -8 o  523.202   5.1604 11163.84  220.036 11163.84  220.036 11163.84  220.036  523.202   5.1604  523.202   5.1604 -0.000000 0.000000 
1 1 1   12    0   -7 o  164.108   2.3473  1098.40   31.385  1098.40   31.385  1098.40   31.385  164.108   2.3473  164.108   2.3473 0.000000 0.000000 
1 1 1   12    0   -6 o  427.489   5.2705  7454.15  183.598  7454.15  183.598  7454.15  183.598  427.489   5.2705  427.489   5.2705 -0.000000 0.000000 
1 1 1   12    0   -5 o  159.741   2.7922  1041.06   36.333  1041.06   36.333  1041.06   36.333  159.741   2.7922  159.741   2.7922 0.000000 0.000000 
1 1 1   12    0   -4 o  364.099   4.6080  5407.07  136.713  5407.07  136.713  5407.07  136.713  364.099   4.6080  364.099   4.6080 0.000000 0.000000 
1 1 1   12    0   -3 o   50.611   3.8382  106.205   15.620  106.205   15.620  106.205   15.620   50.611   3.8382   50.611   3.8382 -0.000000 0.000000 
1 1 1   12    0   -2 o  977.117   11.426 38988.77  909.805 38988.77  909.805 38988.77  909.805  977.117   11.426  977.117   11.426 -0.000000 0.000000 
1 1 1   12    0   -1 o  606.200   7.2553 14993.08  358.398 14993.08  358.398 14993.08  358.398  606.200   7.2553  606.200   7.2553 -0.000000 0.000000 
1 1 1   12    0    0 o   18.693   8.7110   20.828   14.764   20.828   14.764   20.828   14.764   18.693   8.7110   18.693   8.7110 -0.000000 0.000000 
1 1 1   12    0    1 o  853.627   8.1852 29730.44  569.435 29730.44  569.435 29730.44  569.435  853.627   8.1852  853.627   8.1852 -0.000000 0.000000 
1 1 1   12    0    2 o  155.667   2.8623  988.730   36.293  988.730   36.293  988.730   36.293  155.667   2.8623  155.667   2.8623 -0.000000 0.000000 
1 1 1   12    0    3 o  821.361   7.8884 27524.01  528.044 27524.01  528.044 27524.01  528.044  821.361   7.8884  821.361   7.8884 -0.000000 0.000000 
1 1 1   12    0    4 o  396.091   4.9570  6399.19  159.991  6399.19  159.991  6399.19  159.991  396.091   4.9570  396.091   4.9570 0.000000 0.000000 
1 1 1   12    0    5 o  442.654   5.4688  7992.61  197.261  7992.61  197.261  7992.61  197.261  442.654   5.4688  442.654   5.4688 -0.000000 0.000000 
1 1 1   12    0    7 o  355.985   4.5756  5168.86  132.725  5168.86  132.725  5168.86  132.725  355.985   4.5756  355.985   4.5756 0.000000 0.000000 
1 1 1   12    0    8 o  494.857   6.0342  9989.72  243.326  9989.72  243.326  9989.72  243.326  494.857   6.0342  494.857   6.0342 -0.000000 0.000000 
1 1 1   12    0    9 o  447.712   5.5262  8176.48  201.610  8176.48  201.610  8176.48  201.610  447.712   5.5262  447.712   5.5262 -0.000000 0.000000 
1 1 1   12    0   10 o  285.878   3.8781  3333.42   90.335  3333.42   90.335  3333.42   90.335  285.878   3.8781  285.878   3.8781 -0.000000 0.000000 
1 1 1   12    0   11 o  477.328   4.7604  9291.74  185.182  9291.74  185.182  9291.74  185.182  477.328   4.7604  477.328   4.7604 -0.000000 0.000000 
1 1 1   12    0   12 o  225.172   2.7125  2067.59   49.772  2067.59   49.772  2067.59   49.772  225.172   2.7125  225.172   2.7125 -0.000000 0.000000 
1 1 1   12    0   13 o  414.556   4.2113  7008.26  142.277  7008.26  142.277  7008.26  142.277  414.556   4.2113  414.556   4.2113 0.000000 0.000000 
1 1 1   12    0   14 o  164.352   2.3859  1101.70   31.949  1101.70   31.949  1101.70   31.949  164.352   2.3859  164.352   2.3859 -0.000000 0.000000 
1 1 1   12    0   15 o  469.016   4.6884  8971.13  179.205  8971.13  179.205  8971.13  179.205  469.016   4.6884  469.016   4.6884 -0.000000 0.000000 
1 1 1   12    0   16 o  288.785   3.8740  3401.62   91.158  3401.62   91.158  3401.62   91.158  288.785   3.8740  288.785   3.8740 -0.000000 0.000000 
1 1 1   12    0   17 o  216.700   2.6637  1914.99   47.035  1914.99   47.035  1914.99   47.035  216.700   2.6637  216.700   2.6637 -0.000000 0.000000 
1 1 1   12    0   18 o  649.874   6.3151 17228.87  334.464 17228.87  334.464 17228.87  334.464  649.874   6.3151  649.874   6.3151 -0.000000 0.000000 
1 1 1   12    0   19 f   23.585   6.9362   27.836   11.587   27.836   11.587   27.836   11.587   23.585   6.9362   23.585   6.9362 0.000000 0.000000 
1 1 1   12    0   20 o  147.030   2.3160  881.817   27.742  881.817   27.742  881.817   27.742  147.030   2.3160  147.030   2.3160 -0.000000 0.000000 
1 1 1   12    0   21 o   88.375   2.3942  319.050   17.219  319.050   17.219  319.050   17.219   88.375   2.3942   88.375   2.3942 0.000000 0.000000 
1 1 1   12    0   22 o  425.048   4.3098  7368.18  149.290  7368.18  149.290  7368.18  149.290  425.048   4.3098  425.048   4.3098 -0.000000 0.000000 
1 1 1   12    0   23 o  240.309   3.4437  2355.64   67.426  2355.64   67.426  2355.64   67.426  240.309   3.4437  240.309   3.4437 -0.000000 0.000000 
1 1 1   12    0   24 o  239.926   2.8143  2347.50   55.023  2347.50   55.023  2347.50   55.023  239.926   2.8143  239.926   2.8143 -0.000000 0.000000 
1 1 1   12    0   25 o  143.204   2.2959  836.559   26.785  836.559   26.785  836.559   26.785  143.204   2.2959  143.204   2.2959 -0.000000 0.000000 
1 1 1   12    0   26 o  186.163   2.4838  1413.45   37.677  1413.45   37.677  1413.45   37.677  186.163   2.4838  186.163   2.4838 -0.000000 0.000000 
1 1 1   12    0   27 o   61.399   2.8164  154.644   14.028  154.644   14.028  154.644   14.028   61.399   2.8164   61.399   2.8164 0.000000 0.000000 
1 1 1   12    0   28 o   8.2452   5.5734  -5.3865   10.986  -5.3865   10.986  -5.3865   10.986   8.2452   5.5734   8.2452   5.5734 -0.000000 0.000000 
1 1 1   12    0   29 o  239.478   2.8130  2338.83   54.896  2338.83   54.896  2338.83   54.896  239.478   2.8130  239.478   2.8130 0.000000 0.000000 
1 1 1   12    0   30 o  202.516   3.1392  1673.19   51.794  1673.19   51.794  1673.19   51.794  202.516   3.1392  202.516   3.1392 -0.000000 0.000000 
1 1 1   12    0   31 o  225.545   3.3198  2075.29   61.006  2075.29   61.006  2075.29   61.006  225.545   3.3198  225.545   3.3198 -0.000000 0.000000 
1 1 1   12    0   32 o  347.290   4.4627  4920.88  126.289  4920.88  126.289  4920.88  126.289  347.290   4.4627  347.290   4.4627 -0.000000 0.000000 
1 1 1   12    0   33 o  250.286   3.5353  2555.63   72.095  2555.63   72.095  2555.63   72.095  250.286   3.5353  250.286   3.5353 0.000000 0.000000 
1 1 1   12    0   34 o  360.994   4.6225  5317.42  135.973  5317.42  135.973  5317.42  135.973  360.994   4.6225  360.994   4.6225 -0.000000 0.000000 
1 1 1   12    0   35 o   58.582   2.9168  140.949   13.850  140.949   13.850  140.949   13.850   58.582   2.9168   58.582   2.9168 -0.000000 0.000000 
1 1 1   12    0   36 o  170.204   2.4073  1181.65   33.383  1181.65   33.383  1181.65   33.383  170.204   2.4073  170.204   2.4073 -0.000000 0.000000 
1 1 1   12    0   37 o  190.111   2.5102  1474.17   38.884  1474.17   38.884  1474.17   38.884  190.111   2.5102  190.111   2.5102 0.000000 0.000000 
1 1 1   12    0   38 o  180.401   2.4617  1327.48   36.186  1327.48   36.186  1327.48   36.186  180.401   2.4617  180.401   2.4617 -0.000000 0.000000 
1 1 1   12    0   39 o   62.406   2.8126  159.743   14.241  159.743   14.241  159.743   14.241   62.406   2.8126   62.406   2.8126 -0.000000 0.000000 
1 1 1   12    0   40 o  235.654   2.8008  2265.08   53.785  2265.08   53.785  2265.08   53.785  235.654   2.8008  235.654   2.8008 -0.000000 0.000000 
1 1 1   12    0   41 o   88.930   2.4320  323.136   17.600  323.136   17.600  323.136   17.600   88.930   2.4320   88.930   2.4320 0.000000 0.000000 
1 1 1   12    0   42 o   11.665   6.8485   6.4072   10.985   6.4072   10.985   6.4072   10.985   11.665   6.8485   11.665   6.8485 -0.000000 0.000000 
1 1 1   12    0   43 o  310.921   3.3675  3943.61   85.326  3943.61   85.326  3943.61   85.326  310.921   3.3675  310.921   3.3675 -0.000000 0.000000 
1 1 1   12    0   44 o   8.2313   5.5660  -5.4115   10.976  -5.4115   10.976  -5.4115   10.976   8.2313   5.5660   8.2313   5.5660 -0.000000 0.000000 
1 1 1   12    0   45 o  138.240   2.8404  780.187   31.977  780.187   31.977  780.187   31.977  138.240   2.8404  138.240   2.8404 0.000000 0.000000 
1 1 1   12    0   46 o   66.512   3.2414  181.685   17.478  181.685   17.478  181.685   17.478   66.512   3.2414   66.512   3.2414 -0.000000 0.000000 
1 1 1   12    0   47 o  199.419   3.1689  1622.95   51.483  1622.95   51.483  1622.95   51.483  199.419   3.1689  199.419   3.1689 0.000000 0.000000 
1 1 1   12    0   48 o  108.904   2.8375  484.584   25.151  484.584   25.151  484.584   25.151  108.904   2.8375  108.904   2.8375 0.000000 0.000000 
1 1 1   12    0   49 o  255.132   3.6187  2656.57   75.224  2656.57   75.224  2656.57   75.224  255.132   3.6187  255.132   3.6187 0.000000 0.000000 
1 1 1   12    0   50 o  122.060   4.1879  609.986   41.557  609.986   41.557  609.986   41.557  122.060   4.1879  122.060   4.1879 -0.000000 0.000000 
1 1 1   12    0   51 o  139.766   4.1838  799.148   47.570  799.148   47.570  799.148   47.570  139.766   4.1838  139.766   4.1838 0.000000 0.000000 
1 1 1   12    0   52 o   47.999   6.4908   99.146   24.089   99.146   24.089   99.146   24.089   47.999   6.4908   47.999   6.4908 -0.000000 0.000000 
1 1 1   12    0   53 o  186.675   4.4552  1424.51   67.707  1424.51   67.707  1424.51   67.707  186.675   4.4552  186.675   4.4552 0.000000 0.000000 
1 1 1   12    0   54 o  153.803   2.9065  965.692   36.410  965.692   36.410  965.692   36.410  153.803   2.9065  153.803   2.9065 -0.000000 0.000000 
1 1 1   12    0   55 o  241.744   3.5156  2385.33   69.244  2385.33   69.244  2385.33   69.244  241.744   3.5156  241.744   3.5156 0.000000 0.000000 
1 1 1   12    0   56 o  284.025   3.8938  3293.18   90.113  3293.18   90.113  3293.18   90.113  284.025   3.8938  284.025   3.8938 0.000000 0.000000 
1 1 1   12    0   57 o  302.883   4.0738  3745.39  100.539  3745.39  100.539  3745.39  100.539  302.883   4.0738  302.883   4.0738 0.000000 0.000000 
1 1 1   12    0   58 o  135.051   2.8869  744.832   31.749  744.832   31.749  744.832   31.749  135.051   2.8869  135.051   2.8869 -0.000000 0.000000 
1 1 1   12    0   59 o  292.013   3.9848  3481.49   94.811  3481.49   94.811  3481.49   94.811  292.013   3.9848  292.013   3.9848 0.000000 0.000000 
1 1 1   12    0   60 o  289.150   3.9662  3413.66   93.443  3413.66   93.443  3413.66   93.443  289.150   3.9662  289.150   3.9662 0.000000 0.000000 
1 1 1   12    0   61 o  155.724   2.9899  990.160   37.921  990.160   37.921  990.160   37.921  155.724   2.9899  155.724   2.9899 0.000000 0.000000 
1 1 1   12    0   62 o   64.853   3.6054  173.185   18.924  173.185   18.924  173.185   18.924   64.853   3.6054   64.853   3.6054 -0.000000 0.000000 
1 1 1   12    0   63 o  141.435   3.0318  817.066   34.917  817.066   34.917  817.066   34.917  141.435   3.0318  141.435   3.0318 0.000000 0.000000 
1 1 1   12    0   64 o   91.204   5.1047  342.986   37.677  342.986   37.677  342.986   37.677   91.204   5.1047   91.204   5.1047 0.000000 0.000000 
1 1 1   12    0   65 o   83.168   3.2095  283.440   21.685  283.440   21.685  283.440   21.685   83.168   3.2095   83.168   3.2095 -0.000000 0.000000 
1 1 1   12    0   66 o  129.556   2.7051  685.458   28.540  685.458   28.540  685.458   28.540  129.556   2.7051  129.556   2.7051 -0.000000 0.000000 
1 1 1   12    0   67 o  111.188   2.2275  504.719   20.170  504.719   20.170  504.719   20.170  111.188   2.2275  111.188   2.2275 0.000000 0.000000 
1 1 1   12    0   68 o  128.608   2.6464  675.469   27.717  675.469   27.717  675.469   27.717  128.608   2.6464  128.608   2.6464 0.000000 0.000000 
1 1 1   12    0   69 o  173.436   2.5157  1227.62   35.549  1227.62   35.549  1227.62   35.549  173.436   2.5157  173.436   2.5157 0.000000 0.000000 
1 1 1   12    0   70 o   47.371   3.4548   93.035   13.174   93.035   13.174   93.035   13.174   47.371   3.4548   47.371   3.4548 -0.000000 0.000000 
1 1 1   12    0   71 o   11.048   6.6420   5.0058   10.795   5.0058   10.795   5.0058   10.795   11.048   6.6420   11.048   6.6420 0.000000 0.000000 
1 1 1   12    0   72 o   31.560   4.8665   43.495   11.635   43.495   11.635   43.495   11.635   31.560   4.8665   31.560   4.8665 0.000000 0.000000 
1 1 1   12    0   73 o  308.688   3.3682  3891.21   84.731  3891.21   84.731  3891.21   84.731  308.688   3.3682  308.688   3.3682 0.000000 0.000000 
1 1 1   12    0   74 o   54.709   2.7201  123.026   12.062  123.026   12.062  123.026   12.062   54.709   2.7201   54.709   2.7201 -0.000000 0.000000 
1 1 1   12    0   75 o   53.461   2.7106  117.516   11.743  117.516   11.743  117.516   11.743   53.461   2.7106   53.461   2.7106 -0.000000 0.000000 
1 1 1   12    0   76 o   16.935   7.1146   16.609   9.8727   16.609   9.8727   16.609   9.8727   16.935   7.1146   16.935   7.1146 -0.000000 0.000000 
1 1 1   12    0   77 o  141.060   2.0636  812.123   23.716  812.123   23.716  812.123   23.716  141.060   2.0636  141.060   2.0636 -0.000000 0.000000 
1 1 1   12    0   78 o   39.548   3.4253   65.305   10.844   65.305   10.844   65.305   10.844   39.548   3.4253   39.548   3.4253 -0.000000 0.000000 
1 1 1   12    0   79 o   14.815   6.9833   13.214   9.5085   13.214   9.5085   13.214   9.5085   14.815   6.9833   14.815   6.9833 -0.000000 0.000000 
1 1 1   12    0   80 o   81.497   2.1647  271.540   14.357  271.540   14.357  271.540   14.357   81.497   2.1647   81.497   2.1647 0.000000 0.000000 
1 1 1   12    0   81 o  110.956   2.0360  502.751   18.401  502.751   18.401  502.751   18.401  110.956   2.0360  110.956   2.0360 -0.000000 0.000000 
1 1 1   12    0   82 o   48.197   2.8711   95.867   11.187   95.867   11.187   95.867   11.187   48.197   2.8711   48.197   2.8711 -0.000000 0.000000 
1 1 1   12    0   83 o   57.076   2.6110  133.841   12.090  133.841   12.090  133.841   12.090   57.076   2.6110   57.076   2.6110 0.000000 0.000000 
1 1 1   12    0   84 o   29.934   5.0469   39.713   11.264   39.713   11.264   39.713   11.264   29.934   5.0469   29.934   5.0469 -0.000000 0.000000 
1 1 1   12    0   85 o   7.9287   5.3037  -3.3170   9.4760  -3.3170   9.4760  -3.3170   9.4760   7.9287   5.3037   7.9287   5.3037 -0.000000 0.000000 
1 1 1   12    0   86 o   39.290   3.1347   64.314   9.8882   64.314   9.8882   64.314   9.8882   39.290   3.1347   39.290   3.1347 -0.000000 0.000000 
1 1 1   12    0   87 o   12.262   6.6947   8.7635   9.5198   8.7635   9.5198   8.7635   9.5198   12.262   6.6947   12.262   6.6947 -0.000000 0.000000 
1 1 1   12    0   88 o   31.717   4.2066   43.374   10.343   43.374   10.343   43.374   10.343   31.717   4.2066   31.717   4.2066 0.000000 0.000000 
1 1 1   12    0   89 o  125.220   2.2638  641.138   23.090  641.138   23.090  641.138   23.090  125.220   2.2638  125.220   2.2638 -0.000000 0.000000 
1 1 1   12    0   90 o  103.323   1.9635  436.387   16.524  436.387   16.524  436.387   16.524  103.323   1.9635  103.323   1.9635 -0.000000 0.000000 
1 1 1   12    0   91 o   61.691   2.2117  156.106   11.090  156.106   11.090  156.106   11.090   61.691   2.2117   61.691   2.2117 -0.000000 0.000000 
1 1 1   12    0   92 f   9.6047   5.6418   4.5062   7.4618   4.5062   7.4618   4.5062   7.4618   9.6047   5.6418   9.6047   5.6418 0.000000 0.000000 
1 1 1   12    0   93 o   22.493   5.0410   23.719   8.0696   23.719   8.0696   23.719   8.0696   22.493   5.0410   22.493   5.0410 -0.000000 0.000000 
1 1 1   12    0   94 o   23.795   4.6301   25.799   8.0055   25.799   8.0055   25.799   8.0055   23.795   4.6301   23.795   4.6301 -0.000000 0.000000 
1 1 1   12    0   95 o   9.0980   5.5333   3.2573   7.6746   3.2573   7.6746   3.2573   7.6746   9.0980   5.5333   9.0980   5.5333 -0.000000 0.000000 
1 1 1   12    0   96 o  131.402   1.9838  706.458   21.238  706.458   21.238  706.458   21.238  131.402   1.9838  131.402   1.9838 0.000000 0.000000 
1 1 1   12    0   97 o   86.151   1.9934  304.034   13.982  304.034   13.982  304.034   13.982   86.151   1.9934   86.151   1.9934 0.000000 0.000000 
1 1 1   12    0   98 o   68.948   2.1311  195.122   11.952  195.122   11.952  195.122   11.952   68.948   2.1311   68.948   2.1311 -0.000000 0.000000 
1 1 1   12    0   99 o   15.266   6.6385   14.039   8.5540   14.039   8.5540   14.039   8.5540   15.266   6.6385   15.266   6.6385 -0.000000 0.000000 
1 1 1   12    0  100 o   21.934   5.7540   23.744   8.8886   23.744   8.8886   23.744   8.8886   21.934   5.7540   21.934   5.7540 -0.000000 0.000000 
1 1 1   12    0  101 o   19.110   6.1796   19.396   8.5048   19.396   8.5048   19.396   8.5048   19.110   6.1796   19.110   6.1796 -0.000000 0.000000 
1 1 1   12    0  102 o   66.636   2.3703  182.871   12.838  182.871   12.838  182.871   12.838   66.636   2.3703   66.636   2.3703 -0.000000 0.000000 
1 1 1   12    0  103 o   36.185   3.4177   55.527   9.8618   55.527   9.8618   55.527   9.8618   36.185   3.4177   36.185   3.4177 0.000000 0.000000 
1 1 1   12    0  104 o   55.667   2.5377  128.139   11.461  128.139   11.461  128.139   11.461   55.667   2.5377   55.667   2.5377 0.000000 0.000000 
1 1 1   12    0  105 o   47.212   2.8480   92.838   10.868   92.838   10.868   92.838   10.868   47.212   2.8480   47.212   2.8480 -0.000000 0.000000 
1 1 1   12    0  106 f   81.692   2.2689  274.681   15.083  274.681   15.083  274.681   15.083   81.692   2.2689   81.692   2.2689 -0.000000 0.000000 
1 1 1   12    0  107 o   17.532   6.2919   17.229   8.2216   17.229   8.2216   17.229   8.2216   17.532   6.2919   17.532   6.2919 0.000000 0.000000 
1 1 1   12    0  108 o   34.145   3.3272   49.714   9.0450   49.714   9.0450   49.714   9.0450   34.145   3.3272   34.145   3.3272 -0.000000 0.000000 
1 1 1   12    0  109 o   11.672   6.2352   8.6754   8.0881   8.6754   8.0881   8.6754   8.0881   11.672   6.2352   11.672   6.2352 -0.000000 0.000000 
1 1 1   12    0  110 o   65.299   2.2615  176.176   12.005  176.176   12.005  176.176   12.005   65.299   2.2615   65.299   2.2615 -0.000000 0.000000 
1 1 1   12    0  111 o   14.203   7.5602   13.642   11.854   13.642   11.854   13.642   11.854   14.203   7.5602   14.203   7.5602 -0.000000 0.000000 
1 1 1   12    0  112 o   16.307   7.9017   18.052   12.265   18.052   12.265   18.052   12.265   16.307   7.9017   16.307   7.9017 0.000000 0.000000 
1 1 1   12    0  113 o   21.497   7.9650   27.763   12.949   27.763   12.949   27.763   12.949   21.497   7.9650   21.497   7.9650 -0.000000 0.000000 
1 1 1   12    0  114 o   15.261   7.9731   16.514   12.991   16.514   12.991   16.514   12.991   15.261   7.9731   15.261   7.9731 -0.000000 0.000000 
1 1 1   12    0  115 o   16.898   8.1661   20.084   13.089   20.084   13.089   20.084   13.089   16.898   8.1661   16.898   8.1661 -0.000000 0.000000 
1 1 1   12    0  116 o   15.736   8.7942   18.719   16.864   18.719   16.864   18.719   16.864   15.736   8.7942   15.736   8.7942 0.000000 0.000000 
1 1 1   12    0  117 o   13.686   7.7443   13.274   13.287   13.274   13.287   13.274   13.287   13.686   7.7443   13.686   7.7443 -0.000000 0.000000 
1 1 1   12    0  118 o   39.825   6.3629   76.352   19.078   76.352   19.078   76.352   19.078   39.825   6.3629   39.825   6.3629 -0.000000 0.000000 
1 1 1   12    0  119 o   58.168   4.6431  149.843   21.683  149.843   21.683  149.843   21.683   58.168   4.6431   58.168   4.6431 0.000000 0.000000 
1 1 1   12    0  120 o   18.869   9.2946   27.295   17.075   27.295   17.075   27.295   17.075   18.869   9.2946   18.869   9.2946 0.000000 0.000000 
1 1 1   12    0  121 o   17.145   8.4609   21.796   14.160   21.796   14.160   21.796   14.160   17.145   8.4609   17.145   8.4609 0.000000 0.000000 
1 1 1   12    0  122 o   19.666   8.5735   26.912   14.264   26.912   14.264   26.912   14.264   19.666   8.5735   19.666   8.5735 0.000000 0.000000 
1 1 1   12    0  123 o   11.101   7.0529   5.6324   13.919   5.6324   13.919   5.6324   13.919   11.101   7.0529   11.101   7.0529 -0.000000 0.000000 
1 1 1   12    0  124 o   9.6396   6.4615  -1.0691   14.195  -1.0691   14.195  -1.0691   14.195   9.6396   6.4615   9.6396   6.4615 0.000000 0.000000 
1 1 1   12    0  125 o   15.423   8.2981   18.515   14.418   18.515   14.418   18.515   14.418   15.423   8.2981   15.423   8.2981 -0.000000 0.000000 
1 1 1   12    0  126 o   9.0601   6.3000  -8.7342   16.488  -8.7342   16.488  -8.7342   16.488   9.0601   6.3000   9.0601   6.3000 0.000000 0.000000 
1 1 1   12    0  127 o   7.7508   5.5598 -21.0696   16.628 -21.0696   16.628 -21.0696   16.628   7.7508   5.5598   7.7508   5.5598 0.000000 0.000000 
1 1 1   12    1 -126 o   14.259   5.6776   8.6787   9.9025   8.2395   13.356   9.2147   14.757   14.871   6.3180   15.411   6.5968 -0.5398684 9.134302 
1 1 1   12    1 -125 o   10.934   4.9353  -1.0492   9.3375   3.8860   13.056  -6.2172   13.360   13.647   6.0172   11.675   5.4889 1.971571 8.144567 
1 1 1   12    1 -124 o   10.754   4.8797  -1.6545   9.2726 -19.1385   13.105   15.875   13.122   9.7322   4.7803   17.244   6.6311 -7.511629 8.174541 
1 1 1   12    1 -123 o   9.9945   4.6651  -5.1880   9.3622  -9.7841   13.274  -0.6386   13.206   11.098   5.2911   12.728   5.7942 -1.630818 7.846593 
1 1 1   12    1 -122 o   10.162   4.7824  -6.6822   10.188   4.3304   15.489 -15.0789   13.525   14.548   6.4768   10.478   5.0819 4.070209 8.232523 
1 1 1   12    1 -121 o   12.638   5.4587   3.2159   10.277  -8.2445   15.510   12.184   13.721   12.304   5.8236   16.253   6.6084 -3.949307 8.808237 
1 1 1   12    1 -120 o   14.430   5.7898   8.4158   10.378   1.4727   15.708   13.794   13.824   14.117   6.3837   16.837   6.7069 -2.720097 9.259286 
1 1 1   12    1 -119 o   39.856   3.5395   70.598   11.380   76.008   14.904   63.034   17.623   40.232   4.6287   34.539   6.4980 5.693455 7.978036 
1 1 1   12    1 -118 o   15.803   5.9771   11.701   10.549  -6.4011   13.724   37.835   16.490   11.997   5.6156   25.464   7.4639 -13.46675 9.340473 
1 1 1   12    1 -117 o   14.992   5.7715   9.7930   9.9477   0.0494   12.741   25.006   15.920   12.933   5.8075   20.870   7.4321 -7.936057 9.432062 
1 1 1   12    1 -116 o   10.079   4.7399  -7.1582   9.9756  -5.1819   12.596 -10.4827   16.338   11.809   5.4778   12.495   5.9324 -0.6856823 8.074682 
1 1 1   12    1 -115 f   11.691   5.1028   1.0820   9.1759   6.8413   13.017  -4.6065   12.937   14.860   6.2717   12.103   5.5920 2.757211 8.402678 
1 1 1   12    1 -114 o   15.650   5.8515   10.997   10.047  -0.9254   13.066   28.245   15.715   12.974   5.8486   22.426   7.4035 -9.451744 9.434934 
1 1 1   12    1 -113 o   22.359   5.1978   24.101   9.2933   27.256   13.048   20.853   13.240   22.779   6.6286   19.988   6.7982 2.791037 9.494977 
1 1 1   12    1 -112 f   10.502   4.7554  -2.7197   8.7504   7.3953   12.307 -13.0626   12.444   15.090   6.2111   10.548   5.0546 4.542228 8.007911 
1 1 1   12    1 -111 o   35.038   3.6305   53.611   10.219   59.629   15.402   48.879   13.659   35.553   5.4912   32.216   5.3914 3.336395 7.695471 
1 1 1   12    1 -110 o   50.895   2.6121  109.037   10.801  117.280   15.416  101.091   15.137   52.009   3.6596   48.079   3.8956 3.929359 5.344886 
1 1 1   12    1 -109 o   61.286   2.3055  156.668   11.497  149.580   16.308  163.672   16.212   59.094   3.3998   61.976   3.2200 -2.881763 4.682621 
1 1 1   12    1 -108 o   42.614   2.9143   76.744   10.063   98.480   14.550   56.816   13.932   47.747   3.7688   35.462   4.9546 12.28582 6.225149 
1 1 1   12    1 -107 o   26.455   4.7798   31.560   9.9282   38.297   12.784   21.323   15.759   28.688   5.6679   21.099   7.4053 7.589773 9.325405 
1 1 1   12    1 -106 o   19.565   5.6593   17.758   9.5366   20.424   12.459   13.984   14.820   20.775   6.5699   18.530   7.0668 2.244762 9.649049 
1 1 1   12    1 -105 o   13.679   5.4360   5.4112   9.0607   11.501   11.784  -3.3969   14.172   17.030   6.3432   13.602   6.1149 3.427744 8.810668 
1 1 1   12    1 -104 o   42.746   3.6704   77.850   12.665   45.528   25.588   88.339   14.576   29.308   9.4318   45.383   3.9804 -16.07512 10.23732 
1 1 1   12    1 -103 o   48.592   3.2728   99.434   12.888   74.855   26.099  107.360   14.821   38.728   8.5010   50.312   3.6385 -11.58424 9.246912 
1 1 1   12    1 -102 o   20.721   6.1920   19.674   11.260   21.837   24.077   19.069   12.739   22.890   8.9329   20.500   6.6599 2.390017 11.14229 
1 1 1   12    1 -101 o   54.417   2.7043  123.163   11.958  123.518   19.503  122.949   15.137   53.557   4.5092   54.029   3.4550 -0.4728394 5.680686 
1 1 1   12    1 -100 o   71.830   2.0592  212.558   12.045  216.441   17.020  208.664   17.047   72.107   2.9017   70.766   2.9617 1.340233 4.146257 
1 1 1   12    1  -99 o   21.322   5.7367   20.570   10.188   19.696   12.572   22.240   17.388   20.917   6.5980   22.365   7.7834 -1.448305 10.20367 
1 1 1   12    1  -98 o   47.896   2.5966   95.080   10.100  100.184   14.197   89.849   14.371   48.803   3.5940   46.094   3.8601 2.709358 5.274173 
1 1 1   12    1  -97 o   69.161   2.0742  196.757   11.681  199.253   16.435  194.208   16.604   69.290   2.9164   68.376   2.9862 0.9139023 4.173995 
1 1 1   12    1  -96 o   18.694   5.3545   15.387   8.5767   18.160   11.987   12.477   12.277   20.347   6.4455   17.978   6.5112 2.369104 9.161916 
1 1 1   12    1  -95 o   26.203   4.3944   29.608   9.0543   30.451   12.858   28.779   12.752   26.022   6.1583   25.274   6.2299 0.7488155 8.759953 
1 1 1   12    1  -94 o   15.531   5.9088   7.8190   10.345   2.2096   12.626   19.280   18.047   14.660   6.1815   21.876   7.8982 -7.216312 10.02961 
1 1 1   12    1  -93 o   68.133   2.3867  191.003   13.235  193.623   16.418  186.141   22.366   68.430   2.9503   66.633   4.1382 1.796661 5.082159 
1 1 1   12    1  -92 o   55.205   2.6675  125.679   11.968  124.206   14.967  128.292   19.932   54.690   3.3738   55.206   4.4673 -0.5166512 5.598127 
1 1 1   12    1  -91 o  113.531   1.9953  527.922   18.466  525.346   23.220  532.354   30.457  113.090   2.5189  113.482   3.2960 -0.3922119 4.148294 
1 1 1   12    1  -90 o   48.975   2.8018   98.939   11.139   81.480   16.770  112.720   14.900   43.916   4.7607   52.109   3.5286 -8.193573 5.925844 
1 1 1   12    1  -89 o  101.141   1.9945  418.630   16.443  405.903   25.146  428.139   21.735   99.255   3.1118  102.101   2.6136 -2.846581 4.063797 
1 1 1   12    1  -88 f   32.328   4.4195   44.134   11.342   40.841   15.937   47.513   16.144   30.492   6.6032   33.057   6.2196 -2.564686 9.071141 
1 1 1   12    1  -87 o   34.372   3.7264   49.276   10.274   42.464   13.172   59.856   16.416   31.495   5.3200   37.459   5.5434 -5.963661 7.683208 
1 1 1   12    1  -86 o  112.925   1.9601  521.307   18.043  535.371   23.327  500.363   28.467  114.329   2.5030  110.321   3.1688 4.008461 4.038114 
1 1 1   12    1  -85 o   59.599   2.3810  145.596   11.544  162.937   16.052  127.019   16.614   62.926   3.1393   55.431   3.6981 7.494961 4.850869 
1 1 1   12    1  -84 o   23.270   5.2101   23.330   9.6362   21.835   13.342   24.961   13.933   22.628   6.7347   24.045   6.8042 -1.416435 9.573553 
1 1 1   12    1  -83 o  101.188   1.9682  418.312   16.234  420.478   22.879  416.117   23.038  101.292   2.7735  100.758   2.8077 0.5338364 3.946632 
1 1 1   12    1  -82 o   32.749   2.2273   44.037   5.9105   25.965   15.279   47.217   6.4095   24.621   7.1756   33.905   2.3334 -9.283688 7.545460 
1 1 1   12    1  -81 o  122.597   1.4165  613.233   14.156  593.955   25.355  621.963   17.062  120.508   2.5812  123.439   1.6957 -2.930962 3.088360 
1 1 1   12    1  -80 o   73.524   1.5032  220.569   9.0089  213.084   17.833  223.133   10.439   72.080   3.0420   73.937   1.7320 -1.857117 3.500533 
1 1 1   12    1  -79 o  122.735   1.4126  614.525   14.133  658.893   26.074  596.067   16.818  126.963   2.5194  120.853   1.7072 6.110481 3.043325 
1 1 1   12    1  -78 o   74.906   1.5109  228.911   9.2255  214.806   17.714  234.161   10.807   72.396   3.0082   75.748   1.7502 -3.351997 3.480281 
1 1 1   12    1  -77 o   70.407   1.5739  202.239   9.0331  212.051   17.659  198.762   10.512   71.937   3.0182   69.761   1.8503 2.175407 3.540232 
1 1 1   12    1  -76 o   89.946   1.5015  330.019   11.009  311.681   20.147  337.826   13.145   87.271   2.8358   90.989   1.7723 -3.717766 3.344101 
1 1 1   12    1  -75 o  139.592   1.5351  794.862   17.468  760.520   33.398  807.795   20.495  136.380   3.0042  140.702   1.7869 -4.321747 3.495482 
1 1 1   12    1  -74 o  119.427   1.5729  581.808   15.313  603.995   25.066  568.598   19.342  121.602   2.5287  118.032   2.0103 3.569695 3.230424 
1 1 1   12    1  -73 o   57.018   1.9465  132.820   9.0338  126.919   15.914  135.626   10.973   55.582   3.5307   57.588   2.3424 -2.005733 4.237107 
1 1 1   12    1  -72 o   59.494   2.5029  144.788   12.111  151.577   16.217  136.226   18.212   60.798   3.2844   57.552   3.9052 3.246387 5.102724 
1 1 1   12    1  -71 f   28.650   4.6610   34.511   10.512   25.726   14.051   45.678   15.841   24.589   6.7877   32.785   6.1534 -8.195427 9.161781 
1 1 1   12    1  -70 o  124.685   2.1082  634.384   21.427  650.971   30.507  618.235   30.101  126.231   2.9648  123.012   3.0019 3.218605 4.219198 
1 1 1   12    1  -69 o   62.424   1.6686  159.049   8.4831  160.677   11.746  157.273   12.264   62.703   2.3020   62.025   2.4304 0.6783104 3.347603 
1 1 1   12    1  -68 o  113.303   1.4623  523.494   13.505  500.312   19.438  545.130   18.778  110.732   2.1535  115.595   1.9929 -4.862617 2.934098 
1 1 1   12    1  -67 o  108.288   1.4870  478.176   13.126  485.304   19.327  472.073   17.883  109.062   2.1740  107.572   2.0394 1.490089 2.980844 
1 1 1   12    1  -66 o  144.476   1.4594  851.132   17.187  841.623   24.069  861.026   24.552  143.635   2.0557  145.280   2.0732 -1.645172 2.919595 
1 1 1   12    1  -65 o  149.352   1.5583  909.577   18.971  914.684   25.592  903.348   28.263  149.741   2.0967  148.795   2.3302 0.9462128 3.134663 
1 1 1   12    1  -64 o   37.413   2.5587   57.387   7.7565   62.065   11.493   53.475   10.511   38.801   3.6777   35.996   3.6319 2.804821 5.168816 
1 1 1   12    1  -63 o  178.919   1.5867  1305.34   23.142  1315.67   32.710  1294.99   32.744  179.584   2.2345  178.166   2.2546 1.418411 3.174310 
1 1 1   12    1  -62 o   51.010   2.5369  106.438   10.515   75.249   17.439  124.254   13.181   42.562   5.1300   55.092   2.9458 -12.53012 5.915596 
1 1 1   12    1  -61 o  239.953   1.7810  2348.01   34.836  2336.88   49.006  2359.39   49.530  239.317   2.5121  240.465   2.5269 -1.148254 3.563093 
1 1 1   12    1  -60 o  148.326   1.6224  897.086   19.616  885.073   30.831  905.256   25.426  147.280   2.5681  148.978   2.0938 -1.697708 3.313457 
1 1 1   12    1  -59 o  144.244   1.7133  848.422   20.145  849.100   36.253  848.120   24.231  144.224   3.0837  144.203   2.0614 0.2127075E-01 3.709231 
1 1 1   12    1  -58 o   32.687   2.5230   43.849   6.6704   35.761   9.5465   51.564   9.3240   29.299   4.1100   35.389   3.2691 -6.089907 5.251626 
1 1 1   12    1  -57 o   85.726   1.6422  299.646   11.475  309.961   14.540  282.613   18.685   87.179   2.0461   83.177   2.7597 4.002106 3.435474 
1 1 1   12    1  -56 o  199.077   1.7246  1615.99   27.986  1658.30   44.043  1587.34   36.244  201.602   2.6800  197.273   2.2539 4.329315 3.501807 
1 1 1   12    1  -55 o  155.978   1.5879  991.952   20.189  1006.58   31.785  982.058   26.139  157.083   2.4823  155.178   2.0664 1.904129 3.229886 
1 1 1   12    1  -54 o   46.139   1.9498   86.965   7.3165   89.655   10.531   84.456   10.173   46.794   2.7732   45.413   2.7611 1.380825 3.913352 
1 1 1   12    1  -53 o  149.078   1.4336  906.054   17.421  877.799   24.217  936.357   25.080  146.714   2.0250  151.529   2.0305 -4.814407 2.867639 
1 1 1   12    1  -52 o  110.962   1.3935  501.961   12.604  506.437   17.858  497.517   17.792  111.442   1.9659  110.456   1.9760 0.9860611 2.787374 
1 1 1   12    1  -51 o  103.119   1.6847  433.556   14.161  432.525   18.968  434.855   21.286  102.981   2.2595  103.249   2.5291 -0.2682190 3.391426 
1 1 1   12    1  -50 o  267.107   1.9974  2909.37   43.490  3026.04   67.748  2827.60   56.718  272.318   3.0520  263.276   2.6429 9.041534 4.037275 
1 1 1   12    1  -49 o  119.590   1.5985  583.091   15.583  588.538   22.012  577.618   22.063  120.129   2.2479  119.008   2.2744 1.120560 3.197808 
1 1 1   12    1  -48 o  126.529   1.7359  652.748   17.904  636.383   22.905  678.453   28.706  124.917   2.2494  128.961   2.7307 -4.044136 3.537898 
1 1 1   12    1  -47 o  287.759   2.2558  3376.95   52.913  3374.57   74.589  3379.36   75.073  287.571   3.1819  287.773   3.2003 -0.2022705 4.512978 
1 1 1   12    1  -46 o  115.572   1.4050  544.515   13.236  549.894   18.663  539.070   18.776  116.129   1.9715  114.979   2.0033 1.149467 2.810670 
1 1 1   12    1  -45 o  218.804   1.6611  1951.88   29.627  1925.67   41.457  1979.24   42.356  217.297   2.3405  220.298   2.3587 -3.000824 3.322820 
1 1 1   12    1  -44 o  226.648   1.8064  2094.42   33.374  2058.03   43.567  2146.10   51.920  224.641   2.3792  229.371   2.7769 -4.730423 3.656731 
1 1 1   12    1  -43 o   87.919   1.5570  315.129   11.158  306.809   16.887  321.576   14.866   86.703   2.3917   88.806   2.0536 -2.102814 3.152350 
1 1 1   12    1  -42 o  349.342   2.4159  4977.07   68.798  4953.25  104.609  4995.22   91.327  348.364   3.6838  349.897   3.2020 -1.533325 4.880930 
1 1 1   12    1  -41 o  122.680   1.5137  613.558   15.137  598.202   22.781  625.699   20.255  121.117   2.3074  123.877   2.0059 -2.760536 3.057437 
1 1 1   12    1  -40 o  278.715   1.9095  3167.26   43.383  3215.73   71.933  3139.55   54.387  280.754   3.1432  277.464   2.4047 3.289398 3.957513 
1 1 1   12    1  -39 o  446.386   2.7593  8127.24  100.402  8355.47  168.008  8000.46  125.221  452.327   4.5566  442.797   3.4693 9.529785 5.726993 
1 1 1   12    1  -38 o  248.066   1.7700  2508.80   35.791  2590.70   60.002  2463.57   44.593  252.021   2.9207  245.799   2.2256 6.221130 3.672074 
1 1 1   12    1  -37 o  247.565   1.7670  2498.64   35.659  2577.57   59.765  2455.01   44.434  251.385   2.9166  245.374   2.2215 6.010635 3.666288 
1 1 1   12    1  -36 o  253.827   1.7824  2626.63   36.880  2619.01   59.431  2631.40   47.031  253.404   2.8771  254.037   2.2712 -0.6324158 3.665550 
1 1 1   12    1  -35 f  175.135   1.4722  1250.35   21.017  1225.68   29.451  1275.94   30.002  173.384   2.0838  176.904   2.0805 -3.519516 2.944618 
1 1 1   12    1  -34 o  245.906   1.6526  2465.10   33.127  2434.50   44.114  2504.68   50.165  244.354   2.2147  247.839   2.4831 -3.485321 3.327282 
1 1 1   12    1  -33 o  276.906   1.7836  3125.88   40.260  3097.98   53.681  3161.74   60.867  275.642   2.3891  278.448   2.6816 -2.806580 3.591529 
1 1 1   12    1  -32 o  112.544   1.2880  516.298   11.816  522.990   15.998  508.267   17.526  113.266   1.7328  111.657   1.9256 1.608360 2.590445 
1 1 1   12    1  -31 f  316.778   1.9632  4090.98   50.693  4095.39   68.093  4085.50   75.928  316.915   2.6359  316.514   2.9429 0.4012451 3.950738 
1 1 1   12    1  -30 o  262.378   1.7226  2806.35   36.842  2816.94   49.576  2793.29   55.059  262.852   2.3138  261.735   2.5807 1.116608 3.466043 
1 1 1   12    1  -29 o  320.972   1.9833  4199.95   51.892  4195.96   69.597  4204.95   77.872  320.788   2.6615  321.115   2.9750 -0.3263245 3.991786 
1 1 1   12    1  -28 o  213.136   1.8420  1851.85   32.002  1814.69   38.740  1931.69   56.783  210.977   2.2526  217.639   3.2007 -6.662064 3.913941 
1 1 1   12    1  -27 o  230.359   1.6661  2163.14   31.285  2173.07   44.490  2153.44   44.001  230.869   2.3641  229.824   2.3487 1.044632 3.332454 
1 1 1   12    1  -26 f  294.133   2.0905  3526.93   50.122  3516.70   76.375  3534.67   66.427  293.660   3.1906  294.430   2.7677 -0.7693787 4.223768 
1 1 1   12    1  -25 o  173.388   1.5448  1225.46   21.833  1256.62   33.771  1203.09   28.618  175.564   2.3598  171.790   2.0436 3.773865 3.121727 
1 1 1   12    1  -24 o  122.782   1.4668  614.495   14.680  609.133   19.593  621.357   22.166  122.239   1.9664  123.457   2.2026 -1.217484 2.952617 
1 1 1   12    1  -23 o  140.568   1.4901  805.419   17.074  809.644   22.874  800.105   25.657  140.930   1.9912  140.093   2.2467 0.8363037 3.002075 
1 1 1   12    1  -22 o  490.257   3.1924  9800.72  127.579  9771.64  168.463  9839.82  195.358  489.442   4.2225  491.079   4.8803 -1.636475 6.453403 
1 1 1   12    1  -21 o  171.327   1.5701  1196.48   21.927  1162.91   28.845  1242.44   33.748  168.899   2.0951  174.574   2.3716 -5.674728 3.164430 
1 1 1   12    1  -20 o  377.720   2.7652  5816.87   85.139  5729.99  119.433  5906.63  121.402  374.827   3.9089  380.560   3.9135 -5.733124 5.531302 
1 1 1   12    1  -19 o  445.608   2.9363  8095.97  106.658  8003.33  161.953  8166.93  141.736  442.945   4.4854  447.496   3.8856 -4.551270 5.934358 
1 1 1   12    1  -18 o  612.050   3.9077 15277.34  194.961 15152.75  296.261 15372.50  258.927  609.299   5.9650  613.810   5.1750 -4.511597 7.896899 
1 1 1   12    1  -17 o  157.683   1.5364  1013.48   19.748  995.460   30.778  1026.09   25.747  156.264   2.4163  158.656   1.9909 -2.391708 3.130786 
1 1 1   12    1  -16 o  483.618   3.1543  9536.24  124.351  9554.94  190.770  9522.43  163.973  483.968   4.8357  483.200   4.1630 0.7680664 6.380808 
1 1 1   12    1  -15 o  269.691   1.8549  2964.80   40.777  3015.21   58.695  2917.76   56.691  271.956   2.6477  267.527   2.5996 4.429504 3.710574 
1 1 1   12    1  -14 o  193.852   1.6442  1531.76   25.982  1552.45   35.024  1506.44   38.744  195.150   2.2017  192.231   2.4726 2.918579 3.310785 
1 1 1   12    1  -13 o  296.536   2.1154  3584.51   51.133  3592.65   68.109  3573.99   77.405  296.854   2.8147  296.069   3.2073 0.7846375 4.267230 
1 1 1   12    1  -12 o  141.332   1.4957  814.182   17.231  811.824   23.236  817.063   25.685  141.123   2.0199  141.575   2.2256 -0.4524994 3.005578 
1 1 1   12    1  -11 o  188.426   1.6272  1447.20   24.993  1435.70   33.310  1462.03   37.807  187.669   2.1775  189.378   2.4491 -1.709000 3.277104 
1 1 1   12    1  -10 o  406.836   2.7140  6747.67   90.006  6833.44  120.562  6639.69  135.280  409.374   3.6129  403.503   4.1129 5.871613 5.474407 
1 1 1   12    1   -9 o  228.443   1.7894  2127.20   33.321  2123.32   44.372  2132.22   50.459  228.225   2.3851  228.697   2.7067 -0.4717865 3.607648 
1 1 1   12    1   -8 o  280.583   2.0347  3209.12   46.538  3228.48   62.159  3184.44   70.202  281.413   2.7097  279.477   3.0815 1.935760 4.103468 
1 1 1   12    1   -7 o  105.322   1.4882  452.145   12.776  474.456   17.590  427.232   18.588  107.886   2.0002  102.375   2.2274 5.511490 2.993657 
1 1 1   12    1   -6 o   12.139   4.7943   3.2459   7.0072   2.1431   10.032   4.2965   9.7915   13.607   5.6050   14.255   5.6555 -0.6479197 7.962504 
1 1 1   12    1   -5 f  173.217   1.5824  1222.99   22.342  1199.67   29.753  1253.15   33.833  171.553   2.1276  175.331   2.3673 -3.778839 3.182878 
1 1 1   12    1   -4 o  241.417   1.8514  2375.68   36.435  2365.32   48.448  2389.16   55.278  240.880   2.4674  242.084   2.8012 -1.204391 3.732954 
1 1 1   12    1   -3 o  125.078   1.5805  637.680   16.114  665.543   23.425  612.649   22.202  127.776   2.2490  122.594   2.2217 5.182358 3.161336 
1 1 1   12    1   -2 o  182.180   2.0774  1352.90   30.850  1418.71   44.946  1294.28   42.421  186.545   2.9558  178.178   2.9207 8.367599 4.155395 
1 1 1   12    1   -1 o  197.504   2.1888  1590.10   35.238  1587.62   50.745  1592.40   48.970  197.335   3.1547  197.634   3.0397 -0.2993011 4.380847 
1 1 1   12    1    0 o  205.303   2.2354  1718.17   37.410  1692.92   53.313  1742.66   52.508  203.773   3.2096  206.746   3.1157 -2.973373 4.473172 
1 1 1   12    1    1 o  388.084   3.4607  6140.71  109.479  6068.48  154.025  6214.46  155.639  385.723   4.8987  390.335   4.8915 -4.612366 6.922746 
1 1 1   12    1    2 o  343.202   4.4109  4803.63  123.399  4855.93  176.034  4753.10  173.031  344.960   6.2603  341.290   6.2196 3.669342 8.824657 
1 1 1   12    1    3 o  186.571   3.0280  1419.12   46.051  1455.54   66.214  1384.99   64.090  188.923   4.2996  184.288   4.2664 4.634811 6.057120 
1 1 1   12    1    4 o  173.187   2.4170  1222.69   34.122  1218.03   58.713  1225.06   41.930  172.825   4.1677  173.347   2.9674 -0.5213470 5.116137 
1 1 1   12    1    5 f   94.690   2.3304  365.505   17.988  346.512   21.236  413.734   33.840   92.150   2.8305  100.641   4.1338 -8.490707 5.009944 
1 1 1   12    1    6 o  230.787   2.7439  2171.36   51.620  2145.93   62.374  2226.63   91.957  229.418   3.3354  233.646   4.8282 -4.228333 5.868272 
1 1 1   12    1    7 o  180.337   2.9433  1325.86   43.267   0.0000   0.0000  1325.86   43.267  ?   ?   180.337   2.9433 0.000000 2.943326 
1 1 1   12    1    8 o  327.716   2.6984  4378.31   72.083  4390.35  114.543  4370.41   92.753  328.107   4.2827  327.395   3.4755 0.7121582 5.515511 
1 1 1   12    1    9 o  135.825   1.6131  751.975   17.859  754.336   25.688  749.767   24.847  136.032   2.3166  135.620   2.2476 0.4118500 3.227742 
1 1 1   12    1   10 o  144.316   1.6278  848.939   19.149  858.537   27.417  839.799   26.756  145.123   2.3177  143.531   2.2869 1.592148 3.255957 
1 1 1   12    1   11 o  309.570   2.3618  3906.69   59.599  3970.24   85.498  3846.62   83.123  312.048   3.3612  307.152   3.3199 4.895233 4.724401 
1 1 1   12    1   12 o  155.438   1.6555  984.828   20.976  1003.78   30.258  967.298   29.104  156.918   2.3656  154.041   2.3179 2.876953 3.311864 
1 1 1   12    1   13 o  225.967   1.9240  2081.39   35.440  2069.02   50.159  2093.71   50.080  225.279   2.7314  226.620   2.7110 -1.340805 3.848419 
1 1 1   12    1   14 o  370.165   2.7134  5586.17   81.873  5636.50  116.692  5537.37  114.900  371.778   3.8505  368.496   3.8252 3.282379 5.427585 
1 1 1   12    1   15 o  285.710   2.2325  3327.65   51.993  3362.25   74.170  3294.21   72.905  287.164   3.1686  284.245   3.1465 2.919891 4.465455 
1 1 1   12    1   16 o  416.843   3.2792  7084.84  111.425  7002.50  174.458  7141.58  144.808  414.287   5.1660  418.451   4.2453 -4.163422 6.686589 
1 1 1   12    1   17 o  336.847   2.5199  4625.72   69.191  4640.63   98.261  4611.06   97.445  337.347   3.5733  336.271   3.5550 1.075745 5.040454 
1 1 1   12    1   18 o   31.099   3.5054   39.938   8.7315   15.146   12.681   62.287   12.040   19.887   6.6531   38.891   3.8483 -19.00425 7.685943 
1 1 1   12    1   19 o  754.520   5.1442 23228.89  316.394 23259.58  448.198 23198.41  446.702  754.598   7.2865  753.609   7.2717 0.9895020 10.29420 
1 1 1   12    1   20 o  268.356   2.1438  2935.72   46.896  2935.72   66.585  2935.72   66.059  268.328   3.0442  268.330   3.0202 -0.1098633E-02 4.288191 
1 1 1   12    1   21 o  174.450   1.7251  1240.52   24.531  1220.98   34.711  1260.03   34.672  173.058   2.4606  175.805   2.4195 -2.746353 3.450829 
1 1 1   12    1   22 o  190.309   1.9487  1476.38   30.230  1523.17   39.904  1413.36   46.312  193.289   2.5327  186.179   3.0516 7.110260 3.965690 
1 1 1   12    1   23 o  221.698   1.9104  2003.57   34.524  2016.23   49.202  1991.29   48.454  222.377   2.7143  220.998   2.6897 1.379440 3.821255 
1 1 1   12    1   24 o   75.277   1.8128  230.996   11.123  227.855   16.184  233.809   15.314   74.709   2.6618   75.688   2.4855 -0.9787827 3.641798 
1 1 1   12    1   25 o  411.406   3.6286  6903.07  121.687  6956.21  173.324  6851.42  170.884  412.844   5.1504  409.726   5.1165 3.117615 7.259799 
1 1 1   12    1   26 f  305.618   2.8646  3808.52   71.365  3777.85  100.578  3839.61  101.275  304.318   4.0545  306.796   4.0497 -2.477814 5.730530 
1 1 1   12    1   27 o  417.278   3.6719  7102.07  124.897  7154.85  177.925  7050.81  175.364  418.664   5.2136  415.614   5.1762 3.050446 7.346756 
1 1 1   12    1   28 o  206.684   2.2484  1741.59   37.881  1753.18   54.157  1730.49   53.005  207.339   3.2043  205.994   3.1567 1.344620 4.498035 
1 1 1   12    1   29 o  165.340   2.0547  1114.48   27.692  1124.52   39.812  1105.07   38.543  166.060   2.9411  164.620   2.8723 1.439835 4.110991 
1 1 1   12    1   30 o  101.919   1.6372  423.438   13.601  422.553   19.521  424.273   18.962  101.803   2.3524  102.011   2.2803 -0.2080536 3.276189 
1 1 1   12    1   31 f  207.511   2.0199  1755.52   34.166  1790.00   54.704  1733.47   43.748  209.495   3.2034  206.185   2.6030 3.310440 4.127632 
1 1 1   12    1   32 o   44.346   2.6679   80.483   9.5996   76.037   15.145   83.469   12.411   42.941   4.3883   45.108   3.4005 -2.167355 5.551643 
1 1 1   12    1   33 o  290.557   2.4794  3442.43   58.723  3372.71   91.673  3490.96   76.472  287.502   3.9117  292.553   3.2067 -5.050690 5.058115 
1 1 1   12    1   34 o  248.088   2.2352  2509.48   45.202  2613.26   73.551  2446.50   57.301  253.090   3.5651  244.924   2.8701 8.166519 4.576838 
1 1 1   12    1   35 f   40.375   2.8222   66.809   9.2300   67.589   14.391   66.264   12.031   40.449   4.4373   40.127   3.7203 0.3215027 5.790581 
1 1 1   12    1   36 o  300.342   2.5418  3678.54   62.229  3690.10   98.764  3670.93   80.138  300.690   4.0294  299.977   3.2773 0.7128296 5.193917 
1 1 1   12    1   37 o  135.111   1.7763  744.234   19.563  761.994   31.348  732.905   25.037  136.685   2.8135  134.066   2.2910 2.618591 3.628314 
1 1 1   12    1   38 o   64.118   2.0738  167.801   10.825  171.469   17.176  165.385   13.942   64.748   3.2649   63.623   2.6944 1.125488 4.233147 
1 1 1   12    1   39 o   90.617   1.8234  334.786   13.469  346.465   21.386  327.108   17.340   92.119   2.8515   89.531   2.3780 2.588493 3.712953 
1 1 1   12    1   40 o  251.542   2.2582  2580.14   46.303  2615.92   74.052  2557.18   59.332  253.182   3.5881  250.378   2.9071 2.804291 4.617983 
1 1 1   12    1   41 o  216.236   2.0694  1906.57   36.476  1852.57   56.754  1944.57   47.611  213.083   3.2675  218.349   2.6750 -5.266327 4.222793 
1 1 1   12    1   42 o  176.755   1.8922  1273.83   27.263  1266.04   43.048  1279.05   35.229  176.163   2.9978  177.094   2.4404 -0.9309998 3.865536 
1 1 1   12    1   43 o   56.375   2.2247  129.804   10.203  150.021   16.305  116.792   13.081   60.544   3.3166   53.420   3.0163 7.123974 4.483025 
1 1 1   12    1   44 o  219.619   2.0850  1966.77   37.326  1980.09   59.437  1958.10   47.964  220.281   3.3101  219.100   2.6856 1.181625 4.262545 
1 1 1   12    1   45 o  172.961   1.8789  1219.76   26.491  1271.19   42.949  1188.18   33.655  176.517   2.9849  170.685   2.4189 5.831741 3.841975 
1 1 1   12    1   46 o  107.010   2.3479  467.012   20.481  506.022   37.684  450.660   24.399  111.236   4.1633  105.065   2.8515 6.171173 5.046234 
1 1 1   12    1   47 o  166.768   2.4351  1134.33   33.102  1138.64   58.794  1132.33   40.054  166.903   4.3252  166.594   2.9495 0.3088684 5.235145 
1 1 1   12    1   48 o  253.424   2.9482  2620.37   60.903  2525.31  104.161  2669.76   75.073  248.516   5.1418  255.734   3.6013 -7.218491 6.277535 
1 1 1   12    1   49 o  165.454   2.4360  1116.56   32.855  1045.45   56.769  1152.38   40.287  159.909   4.3592  168.058   2.9409 -8.148788 5.258423 
1 1 1   12    1   50 o  216.901   2.0781  1918.53   36.742  1915.18   58.370  1920.73   47.285  216.620   3.3056  216.986   2.6734 -0.3659668 4.251378 
1 1 1   12    1   51 o   47.314   2.4931   91.567   9.5813  102.614   15.432   84.637   12.222   49.984   3.8163   45.416   3.3245 4.568367 5.061290 
1 1 1   12    1   52 o  225.110   2.1237  2066.61   38.969  2114.85   62.857  2036.50   49.665  227.617   3.3877  223.421   2.7270 4.195770 4.348964 
1 1 1   12    1   53 o  245.399   2.5129  2456.57   50.267  2426.58   70.593  2487.42   71.592  243.790   3.5523  246.827   3.5583 -3.036560 5.027946 
1 1 1   12    1   54 o  261.590   2.3293  2791.14   49.670  2806.43   79.133  2781.20   63.804  262.153   3.7031  261.058   2.9983 1.094238 4.764728 
1 1 1   12    1   55 o  252.888   2.2832  2608.48   47.066  2604.74   74.688  2610.95   60.617  252.561   3.6278  252.945   2.9399 -0.3837128 4.669505 
1 1 1   12    1   56 o  178.930   2.1797  1305.81   31.791  1273.03   44.318  1340.56   45.630  176.608   3.0785  181.231   3.0887 -4.623260 4.360872 
1 1 1   12    1   57 o   99.819   2.1020  406.375   17.103  435.287   24.605  379.346   23.791  103.235   2.9269   96.360   3.0326 6.875267 4.214674 
1 1 1   12    1   58 o  250.136   2.2737  2552.19   46.360  2538.31   73.390  2561.40   59.802  249.301   3.6114  250.520   2.9285 -1.219498 4.649522 
1 1 1   12    1   59 o  232.900   2.1894  2212.51   41.566  2169.06   65.039  2242.50   54.042  230.466   3.4620  234.412   2.8283 -3.945801 4.470437 
1 1 1   12    1   60 o   83.559   2.0713  284.779   14.109  273.771   22.024  292.440   18.373   81.816   3.3092   84.613   2.6672 -2.797867 4.250281 
1 1 1   12    1   61 o  133.759   1.9120  729.683   20.847  709.297   32.861  743.414   26.969  131.811   3.0584  134.984   2.4510 -3.172653 3.919331 
1 1 1   12    1   62 o  136.564   1.9358  760.642   21.549  767.377   34.277  756.240   27.710  137.096   3.0672  136.137   2.4971 0.9586334 3.955137 
1 1 1   12    1   63 o  121.459   2.1007  601.753   20.799  589.016   27.335  619.266   32.052  120.129   2.7915  123.106   3.1968 -2.977158 4.244055 
1 1 1   12    1   64 o   45.576   3.3990   85.314   12.537   75.865   17.032   96.488   18.521   42.759   4.9797   48.321   4.7641 -5.561947 6.891580 
1 1 1   12    1   65 o   95.549   2.4849  372.812   19.338  369.040   30.026  375.486   25.278   94.933   3.8884   95.828   3.2408 -0.8948135 5.061814 
1 1 1   12    1   66 o  149.683   2.2419  914.148   27.354  995.742   40.026  842.645   37.469  156.140   3.1448  143.630   3.2003 12.50948 4.486796 
1 1 1   12    1   67 o  101.116   2.4831  417.301   20.467  417.301   20.467   0.0000   0.0000  101.116   2.4831  ?   ?  0.000000 2.483133 
1 1 1   12    1   68 o   24.865   6.1918   26.426   12.502   23.977   16.512   29.714   19.136   24.178   7.5523   26.700   8.0930 -2.522045 11.06946 
1 1 1   12    1   69 o   74.187   1.6671  224.477   10.081  221.932   14.770  226.697   13.794   73.693   2.4622   74.496   2.2743 -0.8021927 3.351806 
1 1 1   12    1   70 o   30.123   3.0887   37.465   7.4770   38.527   11.273   36.630   9.9907   30.302   4.7174   29.609   4.2621 0.6935234 6.357630 
1 1 1   12    1   71 f  150.390   1.4056  922.333   17.231  910.446   25.935  931.726   23.055  149.364   2.1301  151.122   1.8716 -1.757538 2.835508 
1 1 1   12    1   72 o  194.081   1.5928  1536.38   25.199  1513.74   40.845  1550.30   32.019  192.523   2.6027  194.913   2.0153 -2.389542 3.291709 
1 1 1   12    1   73 o  145.789   1.3935  866.813   16.560  863.998   24.964  869.026   22.131  145.494   2.1049  145.939   1.8603 -0.4452972 2.809151 
1 1 1   12    1   74 o   38.845   2.3436   61.837   7.3864   66.400   11.289   58.422   9.7671   40.130   3.4856   37.659   3.2124 2.471508 4.740105 
1 1 1   12    1   75 o  107.562   1.3920  471.875   12.205  490.625   18.654  457.840   16.140  109.631   2.0874  105.921   1.8693 3.709808 2.802011 
1 1 1   12    1   76 o   99.273   1.4061  401.965   11.379  409.330   17.451  396.517   15.008  100.129   2.1380   98.570   1.8679 1.559616 2.839029 
1 1 1   12    1   77 o  139.076   1.3759  788.928   15.599  808.626   23.911  774.334   20.581  140.732   2.0844  137.743   1.8330 2.989319 2.775676 
1 1 1   12    1   78 o   90.341   1.4216  332.929   10.469  326.267   15.867  338.065   13.931   89.381   2.1777   91.006   1.8780 -1.625267 2.875638 
1 1 1   12    1   79 o   38.355   2.2888   60.313   7.1233   45.535   10.829   71.584   9.4573   33.050   4.1080   41.742   2.7956 -8.691765 4.968960 
1 1 1   12    1   80 o   31.433   2.6745   40.700   6.7878   41.109   10.502   40.407   8.8959   31.350   4.2162   31.191   3.5626 0.1585388 5.519881 
1 1 1   12    1   81 o   40.222   2.3045   66.335   7.5239   84.423   11.442   52.556   9.9867   45.291   3.1182   35.630   3.4830 9.661392 4.674897 
1 1 1   12    1   82 o   48.380   2.0055   95.780   7.8918  104.087   12.477   90.240   10.189   50.310   3.0568   46.883   2.6772 3.427402 4.063447 
1 1 1   12    1   83 o  113.935   1.6119  529.926   14.970  546.157   20.162  509.984   22.348  115.595   2.1397  111.652   2.4554 3.943657 3.256912 
1 1 1   12    1   84 o   85.861   1.6485  301.014   11.538  286.550   18.433  310.332   14.794   83.600   2.7085   87.132   2.0829 -3.532211 3.416854 
1 1 1   12    1   85 o   73.552   1.7596  220.989   10.550  192.905   18.025  235.624   13.012   68.462   3.2390   75.883   2.1056 -7.421204 3.863290 
1 1 1   12    1   86 o   48.898   1.9125   97.881   7.6083   85.656   14.627  102.416   8.9083   45.391   3.9938   49.986   2.1916 -4.595276 4.555582 
1 1 1   12    1   87 o   44.471   1.8537   80.981   6.7051   77.234   11.134   83.113   8.3986   43.229   3.1821   44.998   2.2973 -1.768417 3.924711 
1 1 1   12    1   88 f  121.562   1.4897  603.549   14.762  581.580   21.742  622.338   20.107  119.173   2.2381  123.336   1.9999 -4.163757 3.001499 
1 1 1   12    1   89 o  117.011   1.3529  559.081   12.904  570.744   21.380  552.399   16.184  118.037   2.2221  116.245   1.7080 1.792274 2.802666 
1 1 1   12    1   90 o   57.467   1.5053  135.035   7.0453  116.022   10.930  148.549   9.2151   53.103   2.5324   60.222   1.8795 -7.119732 3.153651 
1 1 1   12    1   91 o   46.770   1.6614   89.571   6.3238   82.829   9.9398   94.155   8.1966   44.793   2.7353   47.887   2.1049 -3.094555 3.451472 
1 1 1   12    1   92 o   29.985   2.2554   37.098   5.4724   30.207   8.7178   41.579   7.0300   26.624   4.1523   31.665   2.7509 -5.040089 4.980853 
1 1 1   12    1   93 o   42.691   1.7496   74.736   6.0756   63.977   9.6395   81.826   7.8256   39.244   3.0370   44.604   2.1587 -5.360546 3.726045 
1 1 1   12    1   94 o   53.521   1.5043  117.259   6.5562  109.637   10.295  122.459   8.5036   51.562   2.4564   54.623   1.9128 -3.060844 3.113293 
1 1 1   12    1   95 o   43.207   1.7089   76.587   6.0070   69.213   9.6152   81.308   7.6930   40.815   2.9091   44.443   2.1297 -3.627224 3.605338 
1 1 1   12    1   96 o   57.453   1.6344  135.298   7.6465  116.653   10.788  154.122   10.840   53.141   2.4974   61.193   2.1766 -8.051151 3.312796 
1 1 1   12    1   97 o   28.396   2.6224   33.574   6.0013   35.038   8.5493   32.151   8.4263   28.710   3.7421   27.443   3.8745 1.267208 5.386523 
1 1 1   12    1   98 o   56.092   1.6551  129.081   7.5593  135.654   10.788  122.740   10.596   57.327   2.3132   54.502   2.3909 2.824947 3.326753 
1 1 1   12    1   99 o   35.631   1.9085   52.309   5.5230   39.106   9.0172   60.236   6.9868   30.306   3.7287   38.164   2.2560 -7.858633 4.358037 
1 1 1   12    1  100 o   8.0506   3.5699  -1.3916   4.6585  -1.4133   8.8048  -1.3832   5.4899   11.272   4.9569   8.8104   3.8926 2.461713 6.302576 
1 1 1   12    1  101 o   85.292   1.3944  297.927   9.6944  299.863   15.782  296.754   12.285   85.201   2.2744   84.998   1.7731 0.2026443 2.883923 
1 1 1   12    1  102 o   52.897   1.6147  114.914   6.9544  111.057   10.743  117.696   9.1242   51.706   2.5567   53.395   2.1004 -1.688583 3.308881 
1 1 1   12    1  103 o   33.889   2.0749   47.524   5.7042   43.878   9.2867   49.733   7.2286   32.068   3.6156   34.528   2.5871 -2.460697 4.445877 
1 1 1   12    1  104 o   44.359   1.6407   80.929   5.9224   84.536   10.158   79.071   7.2897   44.963   2.7851   43.736   2.0504 1.227329 3.458461 
1 1 1   12    1  105 o   11.774   4.1634   5.3495   4.9883   2.6647   8.5585   6.7308   6.1387   12.375   5.1444   13.071   4.6190 -0.6959209 6.913747 
1 1 1   12    1  106 o   61.302   1.9635  155.267   9.7992  149.051   11.707  169.814   17.908   59.859   2.4043   63.205   3.4894 -3.345791 4.237535 
1 1 1   12    1  107 o   38.518   2.6738   62.280   8.3430   57.734   9.9264   73.219   15.398   36.776   3.3479   40.582   4.7442 -3.805069 5.806521 
1 1 1   12    1  108 o   38.603   2.5385   62.483   7.9437   67.674   10.216   54.543   12.634   39.876   3.1688   35.008   4.5336 4.868465 5.531304 
1 1 1   12    1  109 o   29.865   3.1839   38.250   7.6316   32.571   9.7413   47.273   12.279   26.819   4.6229   32.290   4.8120 -5.471527 6.672814 
1 1 1   12    1  110 o   55.200   2.0436  126.662   9.1795  128.120   11.815  124.443   14.581   55.164   2.6350   53.849   3.3383 1.314938 4.252945 
1 1 1   12    1  111 o   40.736   2.5487   69.963   8.4209   69.119   10.885   71.220   13.289   39.999   3.3698   40.054   4.1292 -0.5466843E-01 5.329750 
1 1 1   12    1  112 f   44.363   2.3950   82.774   8.6289   82.919   10.963   82.537   13.989   43.965   3.0785   43.115   4.0270 0.8495026 5.068916 
1 1 1   12    1  113 o   34.271   3.4764   51.443   9.5774   49.691   13.945   53.006   13.177   32.085   5.5316   33.662   4.9498 -1.577034 7.422846 
1 1 1   12    1  114 o   23.081   5.6196   26.482   10.472   19.728   13.276   37.610   17.040   19.394   6.7976   25.705   7.6013 -6.311323 10.19735 
1 1 1   12    1  115 f   21.139   6.4710   23.695   12.194   34.501   17.344   13.131   17.148   24.267   7.7608   17.437   7.2680 6.830238 10.63273 
1 1 1   12    1  116 o   21.098   5.8805   22.815   10.490   43.544   17.751   11.692   13.003   27.470   7.6470   16.302   6.5011 11.16810 10.03702 
1 1 1   12    1  117 o   18.425   6.0443   17.503   10.481 -11.1247   17.204   34.399   13.217   12.681   6.0399   25.518   6.3732 -12.83673 8.780597 
1 1 1   12    1  118 o   56.367   2.5190  135.136   11.545  158.773   16.535  112.651   16.127   60.111   3.3882   49.903   3.9978 10.20726 5.240443 
1 1 1   12    1  119 o   21.726   5.5856   24.050   9.9463   30.711   14.427   18.017   13.731   23.237   7.0235   18.336   6.8437 4.901152 9.806468 
1 1 1   12    1  120 o   17.395   6.0836   15.644   10.629   7.1607   13.802   28.009   16.663   14.893   6.3778   21.511   7.6092 -6.617853 9.928579 
1 1 1   12    1  121 o   19.759   5.8034   20.461   9.9608   22.433   14.198   18.549   13.978   19.788   7.0216   18.379   6.8957 1.409616 9.841399 
1 1 1   12    1  122 o   23.496   5.3676   27.876   10.055   13.332   14.155   42.687   14.285   16.605   6.7266   28.182   6.3687 -11.57674 9.263244 
1 1 1   12    1  123 o   18.219   5.8696   17.562   9.9079   30.322   14.294   5.7613   13.746   22.776   7.0124   14.371   6.2593 8.404655 9.399574 
1 1 1   12    1  124 o   19.136   6.1889   20.045   11.008   13.541   14.258   29.644   17.321   16.550   6.7337   21.528   7.7423 -4.978254 10.26094 
1 1 1   12    1  125 o   18.540   6.1943   18.796   10.993   23.735   14.219   11.455   17.333   20.020   7.0335   16.347   7.0749 3.672606 9.976167 
1 1 1   12    1  126 o   19.920   6.1667   21.739   11.037   19.653   14.347   24.763   17.273   18.530   6.9790   19.940   7.6232 -1.410620 10.33532 
1 1 1   12    2 -125 o   13.025   6.0506  -2.9154   15.456   5.5714   18.212 -24.7620   29.219   15.293   6.8985   14.220   7.0141 1.073403 9.838045 
1 1 1   12    2 -124 o   16.836   6.3925   14.934   12.094   16.906   13.592   7.4426   26.494   17.555   6.7494   16.846   7.8580 0.7090816 10.35867 
1 1 1   12    2 -123 o   16.950   6.4432   15.247   12.295   9.4906   13.787   37.617   27.179   15.261   6.4485   21.768   9.1172 -6.506744 11.16720 
1 1 1   12    2 -122 o   19.230   6.0835   20.066   10.681   10.895   13.580   34.944   17.296   15.686   6.4970   23.421   7.7684 -7.734684 10.12715 
1 1 1   12    2 -121 o   31.893   4.5307   48.179   11.448   45.571   14.588   52.359   18.469   29.160   6.3200   29.585   7.6139 -0.4253025 9.895109 
1 1 1   12    2 -120 o   14.174   6.0363   6.3602   12.242   0.2036   17.195   12.689   17.434   14.207   6.5215   16.826   7.1857 -2.619144 9.703865 
1 1 1   12    2 -119 o   14.752   6.0735   8.4972   11.772   7.9063   15.787   9.2372   17.668   15.488   6.7273   16.156   7.0653 -0.6673946 9.755791 
1 1 1   12    2 -118 o   27.576   5.5243   38.152   11.985   30.307   16.084   47.946   17.971   22.494   7.4920   28.535   7.5932 -6.041183 10.66713 
1 1 1   12    2 -117 o   15.033   5.8986   9.8452   10.546   3.6975   13.371   19.963   17.154   13.927   6.1171   18.955   7.4966 -5.027191 9.675643 
1 1 1   12    2 -116 o   10.664   5.0135  -7.1640   11.146  -7.6303   12.799  -5.7001   22.677   11.383   5.3580   15.001   7.0826 -3.617702 8.880945 
1 1 1   12    2 -115 o   11.762   5.2493  -0.3430   10.240  -7.5571   12.954   11.674   16.718   11.507   5.4083   16.865   7.1124 -5.357892 8.935076 
1 1 1   12    2 -114 o   14.150   5.7096   7.3377   10.154   7.0670   13.253   7.7225   15.800   14.949   6.3198   15.766   6.7886 -0.8171024 9.274962 
1 1 1   12    2 -113 o   24.503   5.2710   29.242   10.216   28.326   13.172   30.625   16.181   22.988   6.6517   23.130   7.5052 -0.1423340 10.02863 
1 1 1   12    2 -112 o   41.491   3.3039   74.938   11.082   69.446   14.340   83.080   17.461   38.790   4.6263   41.801   5.2393 -3.011101 6.989461 
1 1 1   12    2 -111 o   28.815   4.2523   37.667   9.6881   29.727   13.382   46.410   14.044   23.838   6.6410   30.786   5.8091 -6.947952 8.823187 
1 1 1   12    2 -110 o   22.957   5.1998   25.099   9.5040   29.536   13.226   20.362   13.666   23.990   6.5710   19.991   6.9034 3.999134 9.530706 
1 1 1   12    2 -109 o   15.511   5.5632   10.515   8.9363   12.245   12.406   8.6496   12.883   16.900   6.4605   15.784   6.4088 1.115578 9.100049 
1 1 1   12    2 -108 o   17.586   5.5744   14.527   8.9644   15.719   12.492   13.262   12.871   18.346   6.5779   17.458   6.6025 0.8881245 9.320010 
1 1 1   12    2 -107 o   22.918   4.9623   24.271   9.0012   34.312   12.403   13.096   13.084   26.817   5.8396   17.550   6.6524 9.266352 8.851898 
1 1 1   12    2 -106 o   17.653   5.6291   14.340   9.1299   33.138   12.941  -4.2851   12.882   26.267   6.1528   12.612   5.7339 13.65513 8.410352 
1 1 1   12    2 -105 o   72.564   2.1042  218.117   12.433  231.797   17.499  204.170   17.668   74.278   2.8956   69.533   3.1252 4.744873 4.260485 
1 1 1   12    2 -104 o   49.499   3.2914  103.794   13.205   99.405   19.357  107.615   18.060   47.209   5.1116   49.595   4.5167 -2.386406 6.821216 
1 1 1   12    2 -103 o   21.166   6.1488   20.948   11.235   26.677   17.309   16.776   14.770   23.414   7.7714   19.624   7.1368 3.789774 10.55122 
1 1 1   12    2 -102 o   67.920   2.6372  192.029   14.573  179.998   21.491  202.269   19.828   64.813   4.0887   69.145   3.5296 -4.331940 5.401389 
1 1 1   12    2 -101 o   53.550   3.2068  120.502   13.934  101.687   19.007  142.359   20.486   48.212   4.9047   57.474   4.4064 -9.261894 6.593369 
1 1 1   12    2 -100 o   45.069   2.7533   84.693   10.067   89.841   14.336   79.686   14.139   45.933   3.8647   43.142   4.0685 2.790924 5.611435 
1 1 1   12    2  -99 o   23.056   5.1823   23.902   9.5019   28.419   14.594   20.578   12.519   24.556   6.9688   21.197   6.5688 3.359489 9.576689 
1 1 1   12    2  -98 o   52.659   2.5951  115.074   11.105  118.169   17.214  112.867   14.534   52.708   4.0373   51.792   3.4625 0.9153099 5.318697 
1 1 1   12    2  -97 o   29.620   3.9924   37.609   9.3944   25.209   13.911   48.005   12.738   23.352   6.8581   33.170   4.8548 -9.817404 8.402523 
1 1 1   12    2  -96 o   70.357   2.0346  203.664   11.656  206.308   16.252  200.862   16.728   70.504   2.8335   69.509   2.9591 0.9948959 4.097013 
1 1 1   12    2  -95 o   49.366   2.4904  100.771   9.9892   90.280   13.854  112.132   14.417   46.315   3.7003   51.754   3.4368 -5.438557 5.050094 
1 1 1   12    2  -94 o   49.226   2.5250  100.166   10.098  103.411   13.963   96.609   14.621   49.715   3.4673   47.931   3.7727 1.784519 5.124004 
1 1 1   12    2  -93 o   70.977   2.0451  206.965   11.820  185.852   16.221  230.872   17.260   66.957   2.9794   74.697   2.8399 -7.740211 4.116042 
1 1 1   12    2  -92 o   32.281   2.5661   43.179   6.6969   71.413   17.170   38.113   7.2729   40.662   5.3067   30.224   2.9912 10.43761 6.091647 
1 1 1   12    2  -91 o   11.036   3.8452   4.5665   4.2444   9.2557   12.001   3.8962   4.5376   16.765   6.3675   10.749   3.9483 6.016348 7.492253 
1 1 1   12    2  -90 o   52.051   1.6026  110.912   6.7917  102.783   14.312  113.274   7.7158   49.675   3.5581   52.573   1.8031 -2.898022 3.988929 
1 1 1   12    2  -89 o   35.037   1.9912   50.441   5.6636   34.502   12.779   54.337   6.3180   28.048   5.7814   36.347   2.1419 -8.298624 6.165397 
1 1 1   12    2  -88 o   81.785   1.4177  273.247   9.4511  269.592   17.689  274.708   11.181   80.953   2.6844   81.967   1.6734 -1.013435 3.163239 
1 1 1   12    2  -87 o   73.274   1.8277  219.592   10.916  252.688   20.960  207.273   12.788   78.231   3.2941   71.099   2.2092 7.132278 3.966316 
1 1 1   12    2  -86 o   39.314   2.0307   63.410   6.4858   61.670   16.346   63.735   7.0658   38.017   5.4288   39.392   2.2094 -1.374920 5.861125 
1 1 1   12    2  -85 o  106.677   1.5842  464.845   13.776  483.696   27.189  458.335   15.979  108.446   3.0789  105.885   1.8513 2.560349 3.592587 
1 1 1   12    2  -84 o   25.222   3.0311   26.485   6.1071   22.035   15.470   27.306   6.6469   22.913   7.3298   25.574   3.2627 -2.660849 8.023162 
1 1 1   12    2  -83 o  105.357   1.5390  453.202   13.217  491.802   22.888  433.890   16.189  109.582   2.5623  103.036   1.9275 6.545853 3.206328 
1 1 1   12    2  -82 o   86.149   2.0978  303.399   14.732  309.969   19.896  295.426   21.918   86.927   2.8115   84.786   3.1770 2.141701 4.242383 
1 1 1   12    2  -81 o   69.571   2.1864  198.062   12.384  178.295   17.708  216.983   17.325   65.830   3.3106   72.708   2.9292 -6.878143 4.420441 
1 1 1   12    2  -80 o  133.324   1.8115  725.870   19.687  735.539   28.323  716.830   27.385  134.075   2.5915  132.370   2.5380 1.705505 3.627260 
1 1 1   12    2  -79 o   67.923   1.7115  188.449   9.4686  181.254   17.671  191.347   11.214   66.416   3.2742   68.414   2.0131 -1.998489 3.843548 
1 1 1   12    2  -78 f   51.859   1.9332  109.968   8.1580  120.554   15.999  106.248   9.4837   54.085   3.6502   50.939   2.2898 3.145672 4.308994 
1 1 1   12    2  -77 o  106.114   1.5877  459.478   13.734  463.545   22.353  457.012   17.406  106.480   2.5754  105.790   2.0185 0.6896820 3.272099 
1 1 1   12    2  -76 o   44.801   2.2340   82.187   8.1327   64.277   14.609   90.231   9.7900   39.259   4.6554   46.914   2.5698 -7.654762 5.317612 
1 1 1   12    2  -75 o   46.739   2.1791   89.402   8.2794   80.092   14.818   93.628   9.9830   43.977   4.1841   47.795   2.5718 -3.818790 4.911300 
1 1 1   12    2  -74 o   46.215   2.2457   87.427   8.4349   75.176   15.234   92.843   10.129   42.556   4.4577   47.593   2.6210 -5.036617 5.171142 
1 1 1   12    2  -73 o   96.309   1.6331  378.412   12.821  358.041   20.599  391.294   16.380   93.562   2.7037   97.906   2.0525 -4.344643 3.394529 
1 1 1   12    2  -72 o  174.162   1.6744  1237.50   23.771  1267.46   37.501  1217.37   30.734  176.133   2.6119  172.680   2.1834 3.452713 3.404354 
1 1 1   12    2  -71 o   49.337   2.2108   99.568   8.8686   93.583   15.566  102.445   10.791   47.619   4.0485   50.006   2.6569 -2.387444 4.842498 
1 1 1   12    2  -70 o  171.758   1.7872  1203.57   25.022  1173.12   43.311  1218.82   30.655  169.396   3.1366  172.801   2.1763 -3.405090 3.817660 
1 1 1   12    2  -69 o  262.820   2.0163  2818.67   43.196  2876.56   67.432  2778.38   56.253  265.285   3.1183  260.823   2.6458 4.462463 4.089537 
1 1 1   12    2  -68 o  104.861   1.4755  448.430   12.612  438.785   16.713  461.188   19.222  103.702   1.9771  106.301   2.2183 -2.599358 2.971512 
1 1 1   12    2  -67 o  101.035   1.4630  416.292   12.049  404.910   15.872  431.775   18.511   99.622   1.9545  102.859   2.2078 -3.237312 2.948620 
1 1 1   12    2  -66 o   98.784   1.4811  397.946   11.926  383.868   15.740  416.927   18.276   96.999   1.9906  101.078   2.2182 -4.078369 2.980414 
1 1 1   12    2  -65 o  189.862   1.9113  1470.48   29.581  1459.90   38.389  1485.93   46.410  189.120   2.4902  190.738   2.9850 -1.617126 3.887298 
1 1 1   12    2  -64 o   68.707   1.7468  192.658   9.7752  209.435   13.833  175.926   13.815   71.600   2.3735   65.599   2.5886 6.000114 3.512036 
1 1 1   12    2  -63 o  246.796   2.0655  2484.71   41.553  2450.21   57.636  2522.05   59.963  244.971   2.8863  248.525   2.9599 -3.554108 4.134237 
1 1 1   12    2  -62 o  185.928   1.7573  1409.83   26.634  1373.57   41.412  1435.41   34.782  183.438   2.7695  187.568   2.2749 -4.130554 3.584028 
1 1 1   12    2  -61 o   99.845   1.5415  406.494   12.546  403.201   17.531  409.952   17.962   99.418   2.1632  100.245   2.1982 -0.8273773 3.084045 
1 1 1   12    2  -60 o   58.875   2.8430  141.820   13.604  156.538   19.254  127.149   19.223   61.770   3.8430   55.596   4.2745 6.173454 5.748070 
1 1 1   12    2  -59 o   14.655   5.4462   6.7289   8.6775 -16.7385   16.305   16.002   10.249   13.012   6.1004   19.668   5.9145 -6.655791 8.496850 
1 1 1   12    2  -58 o  117.301   1.7111  561.097   16.362  555.104   27.132  564.522   20.511  116.619   2.8541  117.641   2.1389 -1.022659 3.566631 
1 1 1   12    2  -57 o  157.698   1.5064  1013.97   19.364  1020.79   27.259  1007.02   27.512  158.197   2.1138  157.124   2.1481 1.073044 3.013729 
1 1 1   12    2  -56 f   99.059   1.7693  400.148   14.287  401.177   18.998  398.809   21.675   99.167   2.3502   98.823   2.6932 0.3437958 3.574478 
1 1 1   12    2  -55 o   53.426   1.8576  116.541   8.0774  126.308   11.428  106.792   11.418   55.583   2.5290   51.083   2.7522 4.500038 3.737729 
1 1 1   12    2  -54 o  110.024   1.4379  493.539   12.896  470.450   17.913  518.381   18.580  107.402   2.0460  112.742   2.0218 -5.339485 2.876411 
1 1 1   12    2  -53 o  198.945   1.7316  1613.88   28.081  1633.79   43.779  1599.96   36.602  200.105   2.6839  198.054   2.2672 2.051178 3.513360 
1 1 1   12    2  -52 o  271.647   1.8958  3009.16   41.979  3004.65   59.205  3013.73   59.530  271.372   2.6764  271.780   2.6871 -0.4087219 3.792579 
1 1 1   12    2  -51 o  179.359   1.5431  1311.60   22.561  1311.72   31.817  1311.49   31.998  179.337   2.1765  179.320   2.1890 0.1632690E-01 3.086879 
1 1 1   12    2  -50 o  323.481   2.1393  4267.59   56.410  4142.73   77.982  4404.63   81.700  318.614   3.0026  328.525   3.0508 -9.910156 4.280554 
1 1 1   12    2  -49 o  281.467   1.8160  3230.41   41.667  3315.87   63.925  3167.28   54.942  285.082   2.7508  278.655   2.4188 6.427612 3.663010 
1 1 1   12    2  -48 o  213.180   1.5375  1852.83   26.717  1869.73   40.587  1839.90   35.491  214.107   2.3255  212.409   2.0498 1.698029 3.099950 
1 1 1   12    2  -47 o  225.217   1.6765  2068.09   30.779  2074.80   43.820  2061.55   43.241  225.540   2.3835  224.820   2.3595 0.7197876 3.353866 
1 1 1   12    2  -46 o  186.896   1.6096  1424.14   24.522  1446.44   38.224  1408.54   31.967  188.311   2.4902  185.848   2.1101 2.462784 3.263996 
1 1 1   12    2  -45 o  142.167   1.6139  824.039   18.703  852.228   26.921  797.738   26.004  144.555   2.2846  139.857   2.2810 4.697403 3.228374 
1 1 1   12    2  -44 o  199.847   1.9686  1628.58   32.069  1617.73   41.587  1644.50   50.368  199.148   2.5618  200.753   3.0779 -1.605026 4.004555 
1 1 1   12    2  -43 o  164.420   1.8188  1102.27   24.377  1112.15   31.951  1088.52   37.709  165.132   2.3736  163.345   2.8321 1.786880 3.695215 
1 1 1   12    2  -42 o  191.394   1.6385  1493.47   25.563  1474.24   34.457  1517.02   38.123  190.132   2.2232  192.861   2.4250 -2.728394 3.289880 
1 1 1   12    2  -41 o  166.472   1.5417  1129.81   20.921  1154.38   28.770  1102.23   30.476  168.253   2.0977  164.401   2.2741 3.851685 3.093889 
1 1 1   12    2  -40 o  145.328   1.3985  860.992   16.568  861.981   24.081  860.102   22.829  145.394   2.0319  145.239   1.9283 0.1552582 2.801212 
1 1 1   12    2  -39 o  167.967   1.5551  1150.19   21.293  1091.62   32.588  1193.82   28.126  163.603   2.4436  171.108   2.0165 -7.504623 3.168240 
1 1 1   12    2  -38 o  328.341   2.1424  4396.14   57.341  4373.59   81.299  4418.46   80.888  327.416   3.0461  329.095   3.0153 -1.678650 4.286141 
1 1 1   12    2  -37 o  142.200   1.3999  824.314   16.227  797.585   23.340  849.322   22.577  139.859   2.0473  144.328   1.9190 -4.468674 2.806034 
1 1 1   12    2  -36 o  190.545   1.6430  1480.20   25.519  1457.02   39.530  1496.76   33.415  189.010   2.5657  191.590   2.1396 -2.579773 3.340769 
1 1 1   12    2  -35 o  472.653   3.0991  9113.87  119.404  9046.87  182.040  9164.46  158.186  470.612   4.7453  473.795   4.0958 -3.182739 6.268505 
1 1 1   12    2  -34 o  639.891   4.0829 16715.27  212.967 16648.81  324.778 16765.39  282.077  637.935   6.2456  640.465   5.4030 -2.530579 8.258338 
1 1 1   12    2  -33 o  168.458   1.7032  1156.92   23.388  1176.28   33.859  1139.26   32.344  169.837   2.4457  167.145   2.3739 2.691360 3.408398 
1 1 1   12    2  -32 o  100.706   1.4806  413.432   12.154  404.138   16.264  425.189   18.292   99.560   2.0040  102.116   2.1975 -2.556259 2.974050 
1 1 1   12    2  -31 o   85.759   1.5195  299.816   10.622  299.624   14.320  300.051   15.839   85.725   2.0493   85.752   2.2679 -0.2756500E-01 3.056599 
1 1 1   12    2  -30 f  157.490   1.5282  1011.11   19.619  1025.74   26.357  992.919   29.380  158.614   2.0385  156.048   2.3097 2.566086 3.080621 
1 1 1   12    2  -29 o  107.880   1.4840  474.420   13.050  486.008   17.696  460.608   19.320  109.182   1.9884  106.286   2.2300 2.895607 2.987705 
1 1 1   12    2  -28 o  308.970   2.0401  3892.06   51.381  3978.38   74.263  3812.79   71.163  312.325   2.9170  305.761   2.8552 6.564758 4.081760 
1 1 1   12    2  -27 o  286.772   1.9347  3352.75   45.227  3371.22   64.610  3335.01   63.331  287.520   2.7567  285.974   2.7168 1.546082 3.870453 
1 1 1   12    2  -26 o  372.347   2.3606  5652.94   71.648  5698.85  102.340  5608.80  100.341  373.779   3.3589  370.818   3.3196 2.961243 4.722470 
1 1 1   12    2  -25 o  191.627   1.5312  1496.89   23.918  1509.67   34.389  1484.91   33.287  192.427   2.1924  190.844   2.1398 1.583328 3.063516 
1 1 1   12    2  -24 o  356.711   2.2825  5187.88   66.368  5145.41   93.634  5230.75   94.086  355.186   3.2340  358.121   3.2230 -2.934479 4.565784 
1 1 1   12    2  -23 o  123.738   1.5686  624.134   15.822  636.593   28.084  618.341   19.150  124.946   2.7574  123.157   1.9075 1.788605 3.352924 
1 1 1   12    2  -22 o  219.973   2.0524  1972.69   36.802  1970.25   59.000  1974.24   47.084  219.792   3.2931  220.042   2.6250 -0.2492065 4.211339 
1 1 1   12    2  -21 o  185.546   1.8884  1403.46   28.562  1376.02   45.564  1421.23   36.659  183.691   3.0430  186.704   2.4087 -3.012650 3.880915 
1 1 1   12    2  -20 o  244.202   2.1855  2431.23   43.506  2494.70   70.717  2392.59   55.185  247.315   3.5078  242.233   2.7948 5.082596 4.485056 
1 1 1   12    2  -19 o  191.346   1.7417  1492.51   27.166  1518.16   39.245  1468.91   37.643  192.966   2.4950  189.811   2.4329 3.154724 3.484815 
1 1 1   12    2  -18 o   24.448   3.4943   24.870   6.7657   16.383   9.9735   32.105   9.2086   19.857   5.8002   27.741   4.2039 -7.883326 7.163433 
1 1 1   12    2  -17 o  239.301   1.8368  2334.39   35.830  2307.85   47.500  2369.42   54.576  237.921   2.4492  241.062   2.7774 -3.141373 3.703048 
1 1 1   12    2  -16 o  271.696   1.9919  3009.27   44.114  3010.26   58.836  3008.00   66.671  271.719   2.6563  271.603   3.0114 0.1162109 4.015548 
1 1 1   12    2  -15 o  422.714   2.8069  7285.73   96.718  7371.62  129.547  7177.57  145.376  425.133   3.7382  419.457   4.2518 5.676208 5.661443 
1 1 1   12    2  -14 f   84.547   1.5448  291.379   10.646  301.752   14.975  280.777   15.139   86.035   2.1353   82.959   2.2407 3.075180 3.095204 
1 1 1   12    2  -13 o  383.606   2.4242  5999.31   75.803  6055.42  108.224  5945.27  106.208  385.340   3.4454  381.821   3.4124 3.518982 4.849279 
1 1 1   12    2  -12 o  226.668   1.6711  2094.32   30.876  2091.13   44.082  2097.40   43.259  226.479   2.3878  226.820   2.3397 -0.3406830 3.343045 
1 1 1   12    2  -11 o  307.327   2.0359  3850.28   51.004  3896.71   73.169  3806.39   71.134  309.144   2.9036  305.542   2.8561 3.601837 4.072823 
1 1 1   12    2  -10 o  141.009   1.4064  810.472   16.166  804.853   23.340  815.654   22.412  140.512   2.0378  141.453   1.9437 -0.9408722 2.816114 
1 1 1   12    2   -9 o   52.704   1.8680  113.372   8.0126  131.713   12.320   99.926   10.548   56.776   2.6695   49.438   2.6269 7.338123 3.745254 
1 1 1   12    2   -8 f  266.113   1.8435  2886.72   39.989  2867.10   56.721  2906.11   56.386  265.187   2.6240  266.986   2.5909 -1.798920 3.687530 
1 1 1   12    2   -7 f  185.047   1.6368  1395.80   24.690  1372.20   33.047  1425.60   37.144  183.468   2.2097  186.999   2.4368 -3.530945 3.289511 
1 1 1   12    2   -6 o  479.828   3.7089  9389.40  145.066  9313.89  228.742  9440.19  187.624  477.679   5.8745  481.029   4.7850 -3.349365 7.576698 
1 1 1   12    2   -5 o  233.201   1.9737  2216.87   37.519  2209.43   53.919  2223.86   52.241  232.788   2.8415  233.550   2.7441 -0.7616730 3.950185 
1 1 1   12    2   -4 o  469.669   3.3280  8994.90  127.414  9204.85  184.294  8802.65  176.349  475.001   4.7597  464.517   4.6573 10.48367 6.659225 
1 1 1   12    2   -3 o  199.836   1.8293  1627.85   29.798  1700.17   44.360  1568.39   40.225  204.210   2.6649  196.140   2.5159 8.070145 3.664876 
1 1 1   12    2   -2 o  228.798   1.8060  2133.88   33.683  2115.23   44.750  2158.26   51.160  227.783   2.4101  230.081   2.7278 -2.297272 3.639994 
1 1 1   12    2   -1 o  240.418   2.0125  2356.20   39.439  2362.57   48.654  2343.99   67.352  240.732   2.4794  239.754   3.4463 0.9775085 4.245474 
1 1 1   12    2    0 o  427.975   3.7687  7469.70  131.477  7624.86  154.678  7065.69  249.592  432.351   4.3889  415.889   7.3623 16.46152 8.571260 
1 1 1   12    2    1 o  127.513   2.0819  662.815   21.640  740.306   33.560  607.669   28.311  134.746   3.0554  122.083   2.8449 12.66304 4.174811 
1 1 1   12    2    2 o  449.286   2.9640  8230.26  108.551  8528.67  147.966  7882.47  159.739  457.291   3.9695  439.587   4.4579 17.70358 5.969041 
1 1 1   12    2    3 o  149.118   1.6606  906.400   20.185  932.654   25.552  862.818   32.922  151.258   2.0724  145.474   2.7763 5.783752 3.464453 
1 1 1   12    2    4 o  194.512   1.9884  1542.32   31.528  1515.54   35.104  1654.05   71.698  192.812   2.2335  201.370   4.3680 -8.557755 4.905868 
1 1 1   12    2    5 o  147.622   1.6558  888.302   19.925  934.462   25.432  814.924   32.065  151.404   2.0606  141.378   2.7823 10.02591 3.462310 
1 1 1   12    2    6 o  283.713   3.1226  3282.07   72.216  3324.54   89.450  3202.59  122.380  285.511   3.8435  280.141   5.3592 5.370361 6.594909 
1 1 1   12    2    7 f   55.256   2.4644  124.722   11.072  125.100   16.202  124.390   15.165   55.268   3.6162   55.127   3.3913 0.1416702 4.957592 
1 1 1   12    2    8 f  115.775   1.6163  546.372   15.254  540.103   22.248  551.934   20.954  115.101   2.3713  116.357   2.2092 -1.255745 3.240886 
1 1 1   12    2    9 o   83.962   1.7142  287.364   11.732  283.592   17.404  290.506   15.884   83.363   2.5643   84.384   2.3113 -1.020653 3.452199 
1 1 1   12    2   10 o  126.601   2.2259  653.400   22.971   0.0000   0.0000  653.400   22.971  ?   ?   126.601   2.2259 0.000000 2.225867 
1 1 1   12    2   11 o  314.091   2.3982  4021.93   61.402  3954.62   86.352  4090.76   87.326  311.410   3.4018  316.725   3.3824 -5.315491 4.797145 
1 1 1   12    2   12 o  128.729   1.7548  675.492   18.413  651.733   28.925  691.679   23.876  126.430   2.8067  130.256   2.2487 -3.825668 3.596401 
1 1 1   12    2   13 o  309.312   2.5850  3900.68   65.177  3888.28  103.039  3908.95   84.151  308.745   4.0942  309.607   3.3344 -0.8618164 5.280197 
1 1 1   12    2   14 f  299.840   2.5282  3665.41   61.794  3660.37   97.836  3668.76   79.704  299.563   4.0066  299.946   3.2599 -0.3831177 5.165240 
1 1 1   12    2   15 o  504.946   3.8808 10399.84  159.735 10561.79  255.917 10296.48  204.450  508.566   6.1733  502.305   4.9932 6.261169 7.939883 
1 1 1   12    2   16 o  171.625   1.8567  1200.73   25.976  1186.32   40.970  1210.41   33.590  170.570   2.9467  172.305   2.3915 -1.735611 3.795015 
1 1 1   12    2   17 o  329.882   2.7141  4437.04   72.984  4379.56  114.355  4476.54   94.802  327.643   4.2817  331.303   3.5104 -3.660431 5.536785 
1 1 1   12    2   18 o  384.504   3.0657  6028.81   96.087  5895.79  149.336  6122.80  125.521  380.095   4.8199  387.422   3.9746 -7.327057 6.247313 
1 1 1   12    2   19 o  241.760   2.0100  2382.72   39.611  2377.36   56.423  2387.93   55.623  241.460   2.8667  241.997   2.8197 -0.5377808 4.021037 
1 1 1   12    2   20 o  126.581   1.7734  653.161   18.298  624.370   23.846  694.389   28.535  123.751   2.3639  130.499   2.6825 -6.748497 3.575442 
1 1 1   12    2   21 o  146.237   2.2667  871.875   27.020  806.034   45.434  907.905   33.610  140.507   3.9709  149.217   2.7632 -8.710464 4.837693 
1 1 1   12    2   22 o  346.578   3.6300  4899.61  102.552  4861.31  176.574  4919.10  125.977  344.941   6.2798  347.196   4.4512 -2.254303 7.697376 
1 1 1   12    2   23 o  390.617   4.0033  6225.23  127.471  6308.61  222.868  6184.69  155.398  392.817   6.9602  389.244   4.8977 3.572571 8.510658 
1 1 1   12    2   24 o  144.455   1.9686  850.711   23.180  925.471   47.235  826.995   26.604  150.565   3.8518  142.421   2.2916 8.144058 4.481944 
1 1 1   12    2   25 o  296.535   2.5113  3585.48   60.703  3475.08   94.011  3664.41   79.497  291.841   3.9518  299.737   3.2537 -7.896545 5.118930 
1 1 1   12    2   26 o  167.573   1.8456  1144.78   25.210  1132.17   39.930  1153.13   32.509  166.617   2.9400  168.170   2.3715 -1.553543 3.777236 
1 1 1   12    2   27 o  189.637   1.9365  1466.14   29.935  1424.14   46.836  1495.15   38.922  186.861   3.0749  191.487   2.4935 -4.625198 3.958849 
1 1 1   12    2   28 o  247.081   2.2289  2489.15   44.891  2449.74   70.482  2516.04   58.230  245.046   3.5285  248.380   2.8760 -3.333908 4.552133 
1 1 1   12    2   29 o  148.791   1.7935  902.550   21.753  884.930   34.477  914.203   28.038  147.302   2.8713  149.736   2.2972 -2.434357 3.677161 
1 1 1   12    2   30 f  136.281   1.7651  757.168   19.608  737.383   31.047  770.295   25.290  134.462   2.8326  137.446   2.2572 -2.984756 3.622012 
1 1 1   12    2   31 o  170.456   1.8680  1184.57   25.955  1172.13   41.240  1192.72   33.398  169.519   2.9844  171.025   2.3957 -1.505539 3.827043 
1 1 1   12    2   32 o  179.110   1.8993  1307.93   27.729  1328.42   44.715  1295.13   35.347  180.461   3.0397  178.212   2.4332 2.248901 3.893626 
1 1 1   12    2   33 o  171.022   1.8666  1192.48   26.022  1226.36   42.086  1171.51   33.109  173.392   2.9776  169.494   2.3964 3.897675 3.822147 
1 1 1   12    2   34 o   26.383   4.1042   29.090   8.5397   44.125   13.878   19.927   10.834   32.421   5.4440   21.733   5.9448 10.68754 8.060877 
1 1 1   12    2   35 o  239.041   2.1901  2330.00   42.674  2287.05   67.071  2359.21   55.315  236.742   3.4756  240.497   2.8216 -3.754425 4.476721 
1 1 1   12    2   36 o  157.940   1.8354  1017.04   23.629  993.342   37.407  1032.77   30.480  156.047   2.9407  159.139   2.3497 -3.092285 3.764156 
1 1 1   12    2   37 o  435.594   3.4191  7742.83  121.402  7701.33  191.449  7770.73  157.005  434.026   5.4113  436.200   4.4156 -2.173798 6.984256 
1 1 1   12    2   38 o  216.861   2.0749  1917.66   36.680  1926.33   58.534  1912.05   47.067  217.274   3.3050  216.511   2.6668 0.7629700 4.246735 
1 1 1   12    2   39 o  112.860   1.7536  519.317   16.132  511.253   25.831  524.473   20.656  111.914   2.8339  113.407   2.2344 -1.492691 3.608799 
1 1 1   12    2   40 o   81.390   1.8733  270.097   12.428  263.826   20.150  273.948   15.789   80.354   3.0821   81.925   2.3669 -1.570511 3.886006 
1 1 1   12    2   41 o  248.406   3.5293  2518.52   71.464   0.0000   0.0000  2518.52   71.464  ?   ?   248.406   3.5293 0.000000 3.529292 
1 1 1   12    2   42 o   97.359   2.3294  386.571   18.487  376.525   33.662  390.910   22.121   95.915   4.3164   97.851   2.7762 -1.936028 5.132155 
1 1 1   12    2   43 o  139.513   2.3333  793.808   26.535  736.182   46.438  821.746   32.333  134.185   4.2509  141.926   2.7948 -7.741180 5.087317 
1 1 1   12    2   44 o  132.108   2.3202  711.791   24.985  736.635   45.574  701.115   29.875  134.231   4.1702  131.094   2.7957 3.136475 5.020637 
1 1 1   12    2   45 o   71.150   1.9737  206.587   11.436  208.900   18.694  205.203   14.457   71.474   3.2168   70.884   2.5059 0.5898590 4.077698 
1 1 1   12    2   46 o  123.229   1.7633  619.162   17.713  619.782   28.548  618.773   22.585  123.251   2.8416  123.175   2.2494 0.7655334E-01 3.624124 
1 1 1   12    2   47 o  118.694   1.7612  574.436   17.040  575.034   27.419  574.060   21.750  118.718   2.8334  118.640   2.2490 0.7756042E-01 3.617446 
1 1 1   12    2   48 o  118.080   1.7575  568.505   16.917  597.188   27.637  551.320   21.392  120.983   2.8024  116.266   2.2572 4.717575 3.598390 
1 1 1   12    2   49 o  144.611   1.8032  852.706   21.256  829.091   33.784  868.179   27.347  142.543   2.9076  145.896   2.2995 -3.352997 3.706954 
1 1 1   12    2   50 o  156.807   1.8373  1002.63   23.484  1030.85   38.098  985.337   29.825  158.939   2.9406  155.425   2.3541 3.514618 3.766783 
1 1 1   12    2   51 o   80.937   1.8921  267.134   12.483  258.908   20.536  271.954   15.721   79.582   3.1721   81.618   2.3655 -2.036812 3.956948 
1 1 1   12    2   52 o   59.699   2.2094  145.562   10.733  165.872   18.179  134.694   13.298   63.640   3.5180   57.382   2.8519 6.257736 4.528810 
1 1 1   12    2   53 o  132.950   1.8095  720.771   19.610  724.102   31.916  718.751   24.855  133.203   2.9394  132.743   2.2970 0.4593201 3.730474 
1 1 1   12    2   54 o  284.224   2.4605  3295.61   57.007  3318.81   91.081  3280.67   73.095  285.017   3.9203  283.492   3.1631 1.524811 5.037244 
1 1 1   12    2   55 o  179.555   1.9352  1314.81   28.325  1365.85   46.430  1284.56   35.748  182.920   3.1139  177.444   2.4714 5.476532 3.975451 
1 1 1   12    2   56 f  362.325   2.9545  5358.35   87.260  5275.37  136.841  5415.21  113.279  359.118   4.6746  364.066   3.8171 -4.947998 6.035066 
1 1 1   12    2   57 o  159.007   1.9129  1031.12   24.793  984.894   38.922  1062.69   32.163  155.324   3.0741  161.390   2.4448 -6.065857 3.927771 
1 1 1   12    2   58 o  225.840   2.1787  2080.55   40.109  2135.47   65.045  2046.85   50.948  228.651   3.4898  223.943   2.7910 4.707336 4.468616 
1 1 1   12    2   59 o  122.129   1.9244  608.335   19.158  599.113   30.979  614.045   24.378  121.090   3.1412  122.675   2.4379 -1.585487 3.976209 
1 1 1   12    2   60 o   76.488   2.5217  238.990   15.701  172.681   22.797  298.836   21.657   64.833   4.3386   85.494   3.1129 -20.66054 5.339766 
1 1 1   12    2   61 o  155.955   2.2914  992.286   29.130  1014.30   42.612  972.976   39.913  157.589   3.3172  154.359   3.1721 3.229599 4.589725 
1 1 1   12    2   62 o   60.753   3.0406  151.086   15.010  184.881   22.973  125.909   19.828   67.100   4.2214   55.296   4.4361 11.80345 6.123676 
1 1 1   12    2   63 o  105.800   2.6122  456.884   22.528  451.798   29.050  464.556   35.681  105.103   3.3953  106.492   4.1182 -1.388771 5.337340 
1 1 1   12    2   64 o  100.374   2.6219  411.539   21.434  365.594   27.008  489.704   35.228   94.515   3.5117  109.351   3.9587 -14.83572 5.291809 
1 1 1   12    2   65 o  163.581   3.3626  1093.55   44.838  1093.55   44.838   0.0000   0.0000  163.581   3.3626  ?   ?  0.000000 3.362612 
1 1 1   12    2   66 o   57.634   2.3032  135.781   10.799  112.606   16.624  152.700   14.204   52.315   3.9268   61.079   2.8608 -8.764385 4.858410 
1 1 1   12    2   67 o  131.602   1.7276  706.437   18.532  662.125   27.082  745.461   25.415  127.342   2.6090  135.145   2.3070 -7.803017 3.482659 
1 1 1   12    2   68 o   88.334   1.8578  318.333   13.377  307.725   20.418  326.310   17.706   86.742   2.8918   89.370   2.4327 -2.627861 3.778930 
1 1 1   12    2   69 o  162.100   1.8767  1072.07   24.799  1084.31   32.406  1054.77   38.523  162.965   2.4395  160.666   2.9414 2.298935 3.821388 
1 1 1   12    2   70 o   65.339   2.0198  174.390   10.745  173.123   14.235  176.068   16.380   65.045   2.6906   65.558   3.0737 -0.5127563 4.084981 
1 1 1   12    2   71 o   74.957   1.6329  229.204   9.9773  201.184   16.067  246.790   12.729   70.109   2.8172   77.736   2.0104 -7.627571 3.461019 
1 1 1   12    2   72 o   24.122   3.7581   24.393   7.1489   29.503   12.118   21.664   8.8536   26.245   5.8172   22.525   4.9566 3.719683 7.642536 
1 1 1   12    2   73 o   95.701   1.4612  373.577   11.399  373.452   18.934  373.648   14.276   95.588   2.4319   95.689   1.8303 -0.1010056 3.043698 
1 1 1   12    2   74 o   97.370   1.6610  386.828   13.183  373.064   32.224  389.595   14.448   95.264   4.1597   97.707   1.8140 -2.442665 4.538008 
1 1 1   12    2   75 o   63.771   1.7784  166.095   9.2357  188.353   18.670  158.884   10.627   67.736   3.3922   62.345   2.0941 5.391037 3.986513 
1 1 1   12    2   76 o   56.572   1.8469  130.772   8.5054  131.948   15.913  130.301   10.063   56.645   3.4629   56.440   2.1915 0.2047920 4.098065 
1 1 1   12    2   77 o  131.391   1.4662  704.333   15.704  742.296   27.827  686.593   19.022  134.751   2.5333  129.693   1.7993 5.058029 3.107313 
1 1 1   12    2   78 f   68.199   1.8168  190.016   10.091  182.878   17.139  193.803   12.484   66.744   3.1592   68.835   2.2278 -2.091057 3.865687 
1 1 1   12    2   79 o   98.410   1.6738  395.309   13.427  419.632   21.587  379.963   17.147  101.248   2.6178   96.430   2.1815 4.818359 3.407620 
1 1 1   12    2   80 o   81.422   1.8550  270.746   12.312  295.783   25.972  263.490   13.982   84.756   3.7687   80.269   2.1389 4.487328 4.333313 
1 1 1   12    2   81 o  134.986   1.5804  743.823   17.390  820.711   37.688  723.025   19.602  141.424   3.2693  133.053   1.8073 8.371002 3.735554 
1 1 1   12    2   82 o   22.133   3.9894   20.784   6.9329   15.896   18.839   21.550   7.4561   21.586   8.0242   22.503   4.2197 -0.9170456 9.066083 
1 1 1   12    2   83 o   43.350   2.0506   77.000   7.2257   58.969   14.420   83.046   8.3496   37.421   4.8405   44.995   2.2839 -7.574734 5.352270 
1 1 1   12    2   84 o   47.951   1.8391   94.106   7.1754  103.893   14.357   90.848   8.2842   50.117   3.5370   47.075   2.1647 3.041908 4.146853 
1 1 1   12    2   85 o   34.663   2.2083   49.376   6.2072   46.211   13.435   50.235   6.9990   32.918   5.1779   34.928   2.4743 -2.009979 5.738698 
1 1 1   12    2   86 o   72.876   1.6780  217.041   9.9682  214.670   16.536  218.395   12.493   72.247   2.8132   73.017   2.1012 -0.7697678 3.511324 
1 1 1   12    2   87 o   79.351   1.6351  257.350   10.576  251.468   17.573  260.691   13.243   78.191   2.7614   79.778   2.0381 -1.586815 3.432092 
1 1 1   12    2   88 o   61.263   1.7621  153.637   8.7906  146.184   15.060  157.488   10.826   59.480   3.1170   61.962   2.1467 -2.481403 3.784708 
1 1 1   12    2   89 o   6.9963   3.2439  -3.7375   4.4100  -1.6936   11.394  -4.0977   4.7828   12.981   5.6755   7.2678   3.3727 5.713463 6.601974 
1 1 1   12    2   90 o   17.088   3.6145   12.552   4.8773   11.034   11.768   12.866   5.3593   17.416   6.3647   17.261   3.9011 0.1550598 7.465101 
1 1 1   12    2   91 o   15.542   3.7759   10.443   4.7360   7.7336   11.334   11.017   5.2129   15.934   6.1534   15.948   4.0136 -0.1456833E-01 7.346650 
1 1 1   12    2   92 o   45.704   1.6589   85.620   6.1699   86.232   12.971   85.441   7.0143   45.420   3.5312   45.618   1.8904 -0.1980057 4.005336 
1 1 1   12    2   93 o   30.699   2.0904   38.873   5.1997   24.896   11.847   42.208   5.7869   23.538   6.1186   31.968   2.2348 -8.429998 6.513972 
1 1 1   12    2   94 o   18.250   3.1497   14.193   4.5164   25.371   11.034   11.943   4.9501   23.795   5.7525   16.591   3.7488 7.203896 6.866187 
1 1 1   12    2   95 o   34.922   2.2225   50.380   6.2939   51.148   14.450   50.200   6.9920   34.138   5.3696   34.802   2.4810 -0.6640244 5.915075 
1 1 1   12    2   96 o   77.084   1.7772  243.775   11.167  235.637   15.242  253.205   16.407   75.513   2.4796   78.238   2.5762 -2.724983 3.575599 
1 1 1   12    2   97 o   15.351   4.9008   10.027   6.9184   1.6906   9.1876   20.945   10.514   12.527   5.2771   21.494   5.8471 -8.967479 7.876289 
1 1 1   12    2   98 o   64.956   1.8398  173.474   9.7318  178.746   11.817  162.361   17.156   65.813   2.2059   62.192   3.3969 3.620739 4.050303 
1 1 1   12    2   99 o   88.441   1.6864  321.042   12.158  311.485   14.564  343.007   22.080   86.968   2.0545   90.693   2.9908 -3.725212 3.628426 
1 1 1   12    2  100 o   41.787   2.3033   72.349   7.8154   74.983   9.8840   67.955   12.766   42.351   2.8802   39.854   3.9829 2.496918 4.915162 
1 1 1   12    2  101 o   22.193   3.8833   21.421   6.7695   22.362   8.4878   19.777   11.222   22.364   4.7997   20.727   6.1783 1.636805 7.823614 
1 1 1   12    2  102 o   47.126   2.1033   91.835   8.0592   85.000   10.124  103.661   13.316   45.097   2.7674   49.558   3.3153 -4.461514 4.318518 
1 1 1   12    2  103 o   24.906   3.5438   26.699   6.9919   31.993   8.7510   17.352   11.627   27.084   4.0912   19.485   6.3647 7.598637 7.566261 
1 1 1   12    2  104 o   23.961   3.7481   24.968   7.0810   16.142   8.7651   41.552   12.015   18.744   5.4267   30.397   5.0243 -11.65321 7.395431 
1 1 1   12    2  105 o   9.7497   4.3843  -2.5643   7.2914  -0.6420   8.6657  -7.2244   13.492   11.255   4.9344   12.380   5.7168 -1.125140 7.551819 
1 1 1   12    2  106 o   14.619   5.1949   8.8534   7.7743   7.2821   9.1438   12.952   14.769   14.328   5.5287   17.968   7.0007 -3.640907 8.920516 
1 1 1   12    2  107 o   74.442   1.9008  229.336   11.525  226.969   13.774  234.861   21.043   73.803   2.2923   74.012   3.4979 -0.2096329 4.182064 
1 1 1   12    2  108 o   9.5647   4.3719  -3.7316   7.6183   1.4018   9.0225 -16.4815   14.219   11.972   5.1421   11.067   5.3289 0.9047480 7.405354 
1 1 1   12    2  109 o   22.768   4.9633   24.250   8.9510   24.518   9.5719   22.390   25.263   22.721   5.2704   21.321   8.8488 1.400471 10.29948 
1 1 1   12    2  110 o   28.349   4.1727   36.132   9.3543   33.671   10.037   52.399   25.806   27.003   4.7322   28.762   9.4870 -1.758808 10.60172 
1 1 1   12    2  111 o   38.788   3.2380   65.140   10.144   65.806   10.951   61.114   26.938   38.798   3.5001   30.494   9.6628 8.303741 10.27717 
1 1 1   12    2  112 o   19.311   5.8991   18.834   10.141   5.8493   16.558   26.627   12.828   15.669   6.8465   22.430   6.5854 -6.760665 9.499625 
1 1 1   12    2  113 o   12.745   5.4193   3.4521   9.8413   2.2883   16.175   4.1361   12.401   14.711   6.5791   13.922   6.0045 0.7889585 8.907249 
1 1 1   12    2  114 o   15.495   5.8261   10.873   9.9891   7.2680   16.184   13.091   12.696   15.748   6.8260   16.736   6.4992 -0.9881630 9.425186 
1 1 1   12    2  115 o   18.251   5.6328   16.807   9.2164   19.948   13.406   13.993   12.691   19.251   6.8237   17.001   6.5256 2.250071 9.441701 
1 1 1   12    2  116 o   24.507   5.4401   29.941   10.584   46.831   18.140   21.223   13.032   28.270   7.6759   19.700   6.7437 8.570223 10.21746 
1 1 1   12    2  117 o   21.836   5.5281   24.199   9.8474   27.455   14.351   21.303   13.537   21.899   7.0649   19.581   6.8642 2.317993 9.850365 
1 1 1   12    2  118 o   17.783   5.8881   16.365   9.9377   10.936   14.274   21.471   13.844   16.039   6.6537   19.558   6.9341 -3.518688 9.610064 
1 1 1   12    2  119 o   34.330   4.3264   54.834   11.839   61.611   15.315   44.773   18.661   35.124   5.5320   26.857   7.9578 8.266390 9.691734 
1 1 1   12    2  120 o   16.278   6.0939   13.234   10.903   17.648   14.496   7.4824   16.546   18.002   6.9573   15.484   6.8024 2.518529 9.730230 
1 1 1   12    2  121 o   16.085   6.0927   12.830   10.970  -0.9461   14.289   32.603   17.120   13.061   5.9767   22.757   7.7305 -9.695824 9.771455 
1 1 1   12    2  122 o   15.145   6.2005   9.9013   12.181   25.364   17.659  -4.1327   16.823   20.109   7.7029   13.279   6.2162 6.830263 9.898216 
1 1 1   12    2  123 o   16.279   6.3488   13.420   12.156  -6.4576   17.469   32.083   16.927   13.079   6.1875   22.388   7.6848 -9.309451 9.866202 
1 1 1   12    2  124 o   15.039   6.1615   9.7948   12.039   7.9888   17.807   11.315   16.339   15.650   6.9573   16.149   6.9279 -0.4993153 9.818390 
1 1 1   12    2  125 o   28.313   7.6861   49.144   18.190   31.962   25.911   65.840   25.542   20.870   8.8305   29.758   9.4067 -8.887712 12.90207 
1 1 1   12    3 -123 o   12.154   5.5455  -1.1854   12.185  -0.0281   17.270  -2.3324   17.193   14.031   6.4750   13.627   6.3476 0.4039230 9.067412 
1 1 1   12    3 -122 o   12.259   5.5418  -0.0340   11.826   6.6767   16.548  -7.0398   16.908   15.110   6.7126   12.803   6.0660 2.306809 9.047389 
1 1 1   12    3 -121 o   10.844   5.1263  -7.3612   11.949 -11.0132   17.155  -3.9201   16.652   12.348   5.9216   13.205   6.1825 -0.8572502 8.560918 
1 1 1   12    3 -120 o   13.104   5.7985   2.6903   12.229 -24.9468   17.210   30.876   17.380   10.850   5.3576   21.935   7.7700 -11.08535 9.438015 
1 1 1   12    3 -119 o   17.652   6.1209   16.576   10.748   17.998   13.577   14.188   17.593   18.067   6.7924   17.130   7.2633 0.9377499 9.944453 
1 1 1   12    3 -118 o   26.938   5.3258   36.267   11.280   27.866   13.858   52.757   19.416   21.961   6.9272   29.254   7.9404 -7.293676 10.53739 
1 1 1   12    3 -117 o   32.012   4.3249   47.759   10.997   51.825   11.959   25.492   27.985   33.154   4.5447   20.040   8.8239 13.11391 9.925498 
1 1 1   12    3 -116 f   28.364   5.2200   39.542   11.625   43.370   12.821   21.860   27.555   29.413   5.5510   19.559   8.6771 9.854128 10.30076 
1 1 1   12    3 -115 o   15.492   5.9687   11.010   10.645   9.8052   11.627   17.255   26.468   15.226   6.1217   18.839   8.4214 -3.612388 10.41134 
1 1 1   12    3 -114 o   15.219   5.6942   10.632   9.5173   10.859   11.421   10.115   17.216   15.621   6.1357   16.469   7.0887 -0.8480244 9.375337 
1 1 1   12    3 -113 o   8.9969   4.2979  -9.1278   8.8474  -4.4390   10.386 -21.5259   16.889   10.850   5.0123   11.292   5.5216 -0.4421291 7.457313 
1 1 1   12    3 -112 o   25.272   4.7284   30.221   9.3825   29.859   10.999   31.187   17.978   24.411   5.6410   22.803   7.9156 1.607302 9.719993 
1 1 1   12    3 -111 o   16.697   6.0443   13.435   10.578   13.435   10.578   0.0000   0.0000   16.697   6.0443  ?   ?  0.000000 6.044296 
1 1 1   12    3 -110 o   16.196   5.7923   12.325   9.6803   21.521   11.883  -5.8179   16.691   20.320   6.4152   13.458   6.2639 6.862732 8.966088 
1 1 1   12    3 -109 o   20.460   5.4075   20.435   9.1532   22.344   10.911   15.899   16.817   21.030   6.0443   18.456   7.3821 2.573997 9.540932 
1 1 1   12    3 -108 o   32.234   3.8497   45.956   9.9153   38.978   10.992   76.414   22.967   29.038   4.8125   37.774   7.7197 -8.736624 9.096895 
1 1 1   12    3 -107 o   31.158   4.0079   43.069   9.9440   33.564   11.042   83.856   22.874   26.690   5.2625   40.478   7.1962 -13.78799 8.915064 
1 1 1   12    3 -106 o   16.029   5.5675   11.480   8.8944   3.8269   10.619   29.474   16.282   13.514   5.6820   23.638   7.5151 -10.12393 9.421341 
1 1 1   12    3 -105 o   24.132   4.8085   26.682   9.1268   22.723   11.179   34.597   15.806   21.628   6.0858   25.974   7.2105 -4.345699 9.435466 
1 1 1   12    3 -104 o   16.465   5.9080   11.628   10.080   1.3020   12.945   27.534   16.066   13.951   6.0753   23.293   7.4713 -9.342295 9.629653 
1 1 1   12    3 -103 o   15.573   6.0505   8.6744   11.007   8.4460   12.438   9.4998   23.642   15.951   6.3591   19.270   8.3010 -3.319716 10.45679 
1 1 1   12    3 -102 o   50.290   2.8167  106.074   11.500  113.341   15.039   95.840   17.847   51.534   3.6028   46.592   4.7663 4.941879 5.974756 
1 1 1   12    3 -101 o   18.851   5.8091   16.240   9.8069   17.010   12.982   15.216   14.967   19.453   6.7280   19.092   7.1412 0.3612118 9.811307 
1 1 1   12    3 -100 o   10.311   3.8254   3.6332   4.2778  -5.1013   12.609   4.7692   4.5475   12.485   5.6749   11.209   3.9741 1.275902 6.928082 
1 1 1   12    3  -99 o   24.703   2.5188   25.548   5.0010   32.182   10.770   23.725   5.6467   26.792   5.1178   23.665   2.9941 3.126879 5.929236 
1 1 1   12    3  -98 o   41.887   1.8929   72.320   6.4463   66.972   13.661   73.852   7.3115   39.387   4.3260   42.267   2.1290 -2.880268 4.821521 
1 1 1   12    3  -97 o   35.571   2.0689   52.294   5.9729   64.394   13.037   49.080   6.7197   38.705   4.1993   34.370   2.4138 4.334671 4.843570 
1 1 1   12    3  -96 o   19.786   3.2789   16.764   5.1032   11.143   11.448   18.158   5.7009   17.016   6.2679   20.537   3.5327 -3.521391 7.194930 
1 1 1   12    3  -95 o   42.015   1.8785   72.661   6.4173   63.094   12.825   75.856   7.4120   38.403   4.1632   42.872   2.1276 -4.468071 4.675361 
1 1 1   12    3  -94 o   9.5705   3.8918   1.6890   4.7596 -12.7342   11.015   5.0003   5.2777   10.180   4.8443   11.785   4.2690 -1.604495 6.456850 
1 1 1   12    3  -93 o   29.899   3.0473   37.469   7.3231   50.228   12.091   30.077   9.2030   34.188   4.4438   26.333   4.4455 7.855232 6.285673 
1 1 1   12    3  -92 o   36.621   2.5844   55.605   7.6653   57.680   12.295   54.286   9.8037   36.815   4.1704   35.965   3.3838 0.8500214 5.370528 
1 1 1   12    3  -91 o   20.859   3.3281   18.500   5.4689   18.988   10.631   18.324   6.3775   20.670   5.9739   20.603   3.9409 0.6696320E-01 7.156651 
1 1 1   12    3  -90 o   48.587   1.8657   96.907   7.3757   78.532   14.694  103.096   8.5279   43.075   4.2398   50.071   2.0940 -6.996166 4.728673 
1 1 1   12    3  -89 o   21.848   3.1884   20.148   5.5110   3.8275   10.615   26.170   6.4480   14.179   5.7947   24.941   3.2487 -10.76231 6.643207 
1 1 1   12    3  -88 o   29.363   2.5017   35.695   5.9309   44.462   10.949   32.055   7.0557   32.369   4.2523   27.675   3.1857 4.693970 5.313289 
1 1 1   12    3  -87 o   43.361   1.9190   77.142   6.7661   74.174   11.731   78.621   8.2826   42.206   3.4395   43.707   2.3332 -1.500057 4.156198 
1 1 1   12    3  -86 f   53.500   1.7322  117.197   7.5442  129.072   12.816  110.900   9.3323   55.941   2.8197   51.966   2.2081 3.975037 3.581380 
1 1 1   12    3  -85 o   44.396   1.9672   80.827   7.1015   79.702   11.943   81.442   8.8329   43.827   3.3687   44.491   2.4449 -0.6642647 4.162437 
1 1 1   12    3  -84 o   59.691   1.6792  145.745   8.1625  152.615   13.371  141.664   10.305   60.912   2.6997   58.780   2.1544 2.131203 3.453972 
1 1 1   12    3  -83 o   80.915   1.6083  267.482   10.608  269.802   17.973  266.242   13.141   81.041   2.7246   80.675   1.9983 0.3655624 3.378867 
1 1 1   12    3  -82 o   82.408   1.6112  277.390   10.823  289.475   18.246  270.829   13.444   83.983   2.6686   81.376   2.0267 2.607048 3.350996 
1 1 1   12    3  -81 o   55.935   2.0732  128.118   9.4367  142.918   15.507  119.413   11.892   58.890   3.2428   53.907   2.7151 4.982708 4.229342 
1 1 1   12    3  -80 o  129.322   1.6918  683.036   17.834  700.266   27.061  669.808   23.711  130.774   2.5386  127.957   2.2733 2.816971 3.407653 
1 1 1   12    3  -79 o   75.715   1.7509  234.133   10.806  262.056   16.348  212.465   14.401   79.977   2.5108   72.014   2.4569 7.963753 3.512848 
1 1 1   12    3  -78 o   46.098   2.5392   87.215   9.5044   83.445   15.986   89.277   11.821   44.764   4.4394   46.557   3.1329 -1.793610 5.433567 
1 1 1   12    3  -77 o   45.689   2.6775   85.719   9.9282   68.740   15.552   97.396   12.898   40.530   4.8005   48.627   3.2731 -8.097195 5.810175 
1 1 1   12    3  -76 o   92.928   2.0973  352.789   15.887  356.495   20.801  347.601   24.612   93.299   2.7380   92.029   3.2861 1.269943 4.277266 
1 1 1   12    3  -75 o   67.251   2.3091  185.035   12.640  169.575   17.130  203.511   18.727   64.249   3.2818   70.401   3.2722 -6.152412 4.634326 
1 1 1   12    3  -74 o   69.217   2.0861  195.839   11.757  166.531   16.995  222.736   16.281   63.678   3.2852   73.750   2.7129 -10.07146 4.260582 
1 1 1   12    3  -73 f   97.999   2.0206  392.121   16.141  379.079   24.691  401.853   21.330   96.181   3.1536   99.110   2.6425 -2.928474 4.114372 
1 1 1   12    3  -72 o   83.671   1.9441  285.782   13.259  309.180   19.223  264.546   18.313   86.923   2.7163   80.387   2.7990 6.535477 3.900369 
1 1 1   12    3  -71 o   96.914   1.7094  383.243   13.504  398.358   20.828  372.281   17.738   98.701   2.5910   95.476   2.2791 3.224571 3.450760 
1 1 1   12    3  -70 f  109.733   1.6870  491.287   15.090  477.543   22.655  502.248   20.231  108.112   2.5708  110.906   2.2379 -2.794044 3.408368 
1 1 1   12    3  -69 o   62.337   2.0399  158.783   10.352  152.056   16.548  163.108   13.268   60.868   3.3482   63.134   2.5836 -2.265457 4.229111 
1 1 1   12    3  -68 o   90.513   1.7689  334.262   13.051  333.488   20.190  334.819   17.106   90.300   2.7461   90.525   2.3201 -0.2247162 3.594968 
1 1 1   12    3  -67 o  109.545   1.5878  489.477   14.178  489.725   17.821  489.049   23.404  109.547   1.9957  109.421   2.6239 0.1256714 3.296626 
1 1 1   12    3  -66 o  120.645   1.4986  593.629   14.738  602.115   19.721  582.895   22.180  121.473   1.9917  119.497   2.2770 1.976112 3.025148 
1 1 1   12    3  -65 o   30.985   2.7460   39.518   6.8637   28.182   8.9090   56.072   10.766   25.875   4.3801   36.846   3.6317 -10.97114 5.689836 
1 1 1   12    3  -64 f   50.458   1.9934  104.043   8.1831  106.960   10.860  100.212   12.446   51.114   2.6153   49.425   3.1050 1.689735 4.059609 
1 1 1   12    3  -63 o   24.066   3.5385   24.183   6.7344   17.268   8.6046   35.114   10.819   20.138   5.2044   28.895   4.7589 -8.756731 7.052189 
1 1 1   12    3  -62 o  133.247   1.5218  724.049   16.529  710.982   21.850  741.531   25.274  132.010   2.0305  134.798   2.3002 -2.787094 3.068154 
1 1 1   12    3  -61 o  111.300   1.5189  505.158   13.780  491.721   18.158  523.407   21.161  109.787   2.0290  113.254   2.2921 -3.467247 3.061163 
1 1 1   12    3  -60 o   36.842   3.3291   55.903   9.8899   58.286   17.870   54.852   11.874   37.192   6.1061   36.395   4.0722 0.7966194 7.339424 
1 1 1   12    3  -59 o  135.527   1.8856  749.159   20.831  707.723   33.834  774.453   26.435  131.639   3.1531  137.767   2.3539 -6.128677 3.934829 
1 1 1   12    3  -58 o  110.445   1.8057  497.481   16.257  492.665   24.637  501.195   21.635  109.828   2.7541  110.830   2.3948 -1.001465 3.649673 
1 1 1   12    3  -57 o  211.431   2.0832  1823.49   35.904  1955.46   58.098  1741.94   45.668  218.819   3.2572  206.591   2.7118 12.22789 4.238294 
1 1 1   12    3  -56 o  116.874   1.8273  557.078   17.409  573.517   21.143  522.468   30.678  118.570   2.1876  113.053   3.3326 5.516327 3.986418 
1 1 1   12    3  -55 o  246.159   2.1039  2471.69   42.215  2485.97   51.605  2442.80   73.400  246.820   2.5649  244.510   3.6827 2.310425 4.487875 
1 1 1   12    3  -54 o  155.838   1.6085  990.273   20.433  998.633   27.335  979.687   30.761  156.467   2.1432  154.957   2.4353 1.509766 3.244079 
1 1 1   12    3  -53 o  171.559   1.4989  1200.06   20.961  1193.37   30.335  1206.17   28.997  171.044   2.1757  171.966   2.0686 -0.9215088 3.002139 
1 1 1   12    3  -52 o  203.117   1.5936  1682.21   26.385  1734.91   38.680  1636.36   36.083  206.226   2.3009  200.290   2.2101 5.935806 3.190406 
1 1 1   12    3  -51 o  179.725   1.6290  1317.07   23.865  1310.32   38.006  1321.46   30.664  179.205   2.6018  179.999   2.0899 -0.7945557 3.337188 
1 1 1   12    3  -50 o  206.757   1.7280  1743.12   29.124  1729.03   45.790  1752.69   37.742  205.847   2.7289  207.291   2.2336 -1.443466 3.526463 
1 1 1   12    3  -49 o  317.273   2.2343  4105.85   57.785  4129.36   77.433  4076.28   86.810  318.085   2.9864  315.975   3.3704 2.109802 4.503106 
1 1 1   12    3  -48 o  110.453   1.4553  497.393   13.103  529.836   18.602  465.440   18.461  113.982   2.0021  106.827   2.1200 7.154938 2.915895 
1 1 1   12    3  -47 o  122.361   1.5073  610.430   15.035  638.394   20.514  577.978   22.099  125.116   2.0114  119.039   2.2775 6.077316 3.038493 
1 1 1   12    3  -46 o  188.968   1.6574  1455.97   25.530  1445.61   34.027  1469.32   38.617  188.266   2.2173  189.785   2.4962 -1.519272 3.338785 
1 1 1   12    3  -45 o  149.333   1.6947  909.273   20.629  951.886   25.654  831.299   34.702  152.778   2.0599  142.727   2.9827 10.05115 3.624895 
1 1 1   12    3  -44 o  163.911   1.5625  1095.38   20.877  1103.44   28.090  1085.43   31.204  164.491   2.0949  163.130   2.3466 1.360443 3.145658 
1 1 1   12    3  -43 o  185.922   1.6338  1409.36   24.761  1408.13   33.053  1410.94   37.381  185.815   2.1822  185.984   2.4657 -0.1686249 3.292652 
1 1 1   12    3  -42 o  144.611   1.5206  852.597   17.925  843.640   24.004  863.886   26.949  143.832   2.0474  145.539   2.2716 -1.706467 3.058053 
1 1 1   12    3  -41 o  276.390   2.0334  3115.17   45.812  3124.10   61.058  3103.67   69.296  276.729   2.7068  275.784   3.0825 0.9449463 4.102262 
1 1 1   12    3  -40 o  174.270   1.7082  1238.27   24.267  1256.39   34.758  1221.04   33.895  175.508   2.4295  173.023   2.4032 2.485291 3.417318 
1 1 1   12    3  -39 o  215.487   1.8580  1893.37   32.637  1998.28   48.477  1806.39   44.139  221.325   2.6870  210.438   2.5731 10.88712 3.720344 
1 1 1   12    3  -38 o  213.045   1.8525  1850.67   32.170  1845.02   46.116  1856.02   44.900  212.673   2.6601  213.311   2.5822 -0.6381226 3.707322 
1 1 1   12    3  -37 o  293.885   2.2698  3522.29   54.375  3493.63   77.125  3550.62   76.671  292.595   3.2336  294.977   3.1887 -2.381744 4.541366 
1 1 1   12    3  -36 o   63.503   1.9060  164.579   9.8551  143.163   16.582  176.273   12.254   59.126   3.4557   65.704   2.2915 -6.578701 4.146379 
1 1 1   12    3  -35 o  209.056   1.7151  1781.86   29.228  1791.83   45.801  1775.02   37.962  209.589   2.6808  208.629   2.2322 0.9597168 3.488506 
1 1 1   12    3  -34 o   94.984   1.6416  367.822   12.710  308.970   24.429  389.667   14.883   86.941   3.4539   97.760   1.8677 -10.81842 3.926525 
1 1 1   12    3  -33 o  149.964   1.5116  916.829   18.478  992.947   30.306  871.786   23.313  156.036   2.3827  146.221   1.9559 9.814606 3.082703 
1 1 1   12    3  -32 o  227.874   1.7979  2117.12   33.397  2083.23   51.422  2141.84   43.920  225.987   2.7915  229.172   2.3511 -3.185211 3.649642 
1 1 1   12    3  -31 o  347.289   2.3947  4918.71   67.791  4911.59  104.215  4923.93   89.255  346.894   3.6855  347.396   3.1519 -0.5022583 4.849470 
1 1 1   12    3  -30 o  147.266   1.5179  884.125   18.221  840.017   28.268  915.478   23.833  143.519   2.4163  149.843   1.9512 -6.323456 3.105786 
1 1 1   12    3  -29 o  115.410   1.4765  542.987   13.891  518.780   21.997  559.042   17.914  112.788   2.3926  117.096   1.8768 -4.308014 3.040895 
1 1 1   12    3  -28 o   73.603   1.4963  220.848   8.9774  222.230   13.421  219.729   12.077   73.789   2.2338   73.382   2.0210 0.4072800 3.012328 
1 1 1   12    3  -27 o  192.629   1.6562  1512.74   26.006  1530.75   41.114  1500.72   33.576  193.735   2.6034  191.845   2.1470 1.889832 3.374550 
1 1 1   12    3  -26 o  193.764   1.6591  1530.61   26.205  1514.70   40.808  1541.78   34.184  192.719   2.5977  194.453   2.1566 -1.733887 3.376249 
1 1 1   12    3  -25 o  281.211   2.0520  3224.30   47.038  3235.29   72.972  3216.49   61.527  281.614   3.1788  280.831   2.6877 0.7828064 4.162778 
1 1 1   12    3  -24 o  313.218   2.2148  4000.27   56.549  4011.08   87.422  3992.49   74.151  313.547   3.4204  312.864   2.9075 0.6825867 4.489220 
1 1 1   12    3  -23 o   99.416   1.3861  402.894   11.233  387.893   16.295  416.476   15.505   97.538   2.0495  101.071   1.8820 -3.532639 2.782501 
1 1 1   12    3  -22 o  117.213   1.3760  560.045   13.148  556.809   19.158  562.927   18.076  116.863   2.0111  117.505   1.8871 -0.6425781 2.757892 
1 1 1   12    3  -21 o  313.527   2.0695  4007.81   52.890  3975.44   74.792  4040.19   74.805  312.203   2.9389  314.737   2.9157 -2.533936 4.139864 
1 1 1   12    3  -20 o  133.066   1.3851  721.788   15.024  709.474   21.732  733.060   20.793  131.915   2.0210  134.092   1.9023 -2.177200 2.775478 
1 1 1   12    3  -19 f  109.111   1.3784  485.297   12.260  482.803   17.981  487.464   16.760  108.821   2.0271  109.347   1.8803 -0.5264130 2.764878 
1 1 1   12    3  -18 o  251.931   1.8918  2587.54   38.851  2618.64   60.185  2565.33   50.870  253.393   2.9138  250.823   2.4880 2.570419 3.831486 
1 1 1   12    3  -17 o   18.049   4.4980   13.822   6.5937   4.5210   10.803   19.345   8.3243   14.882   5.9286   21.343   4.8898 -6.461705 7.684908 
1 1 1   12    3  -16 o  211.146   1.7124  1817.46   29.474  1706.28   43.880  1908.86   39.785  204.557   2.6316  216.374   2.2557 -11.81679 3.465999 
1 1 1   12    3  -15 o   34.533   2.7931   48.948   7.7954   45.845   15.719   49.959   8.9771   32.979   6.0709   34.853   3.1953 -1.873955 6.860462 
1 1 1   12    3  -14 o  195.190   1.7840  1553.16   28.384  1573.31   50.625  1543.92   34.279  196.406   3.1621  194.598   2.1610 1.807724 3.829972 
1 1 1   12    3  -13 o  167.564   1.5741  1144.57   21.500  1162.14   34.226  1133.12   27.633  168.824   2.4870  166.715   2.0334 2.109772 3.212468 
1 1 1   12    3  -12 o  199.819   1.6852  1627.65   27.449  1619.80   42.890  1633.10   35.724  199.309   2.6399  200.141   2.1897 -0.8310699 3.429866 
1 1 1   12    3  -11 o   67.227   1.7461  184.363   9.5605  197.822   16.507  177.569   11.728   69.588   2.9166   65.959   2.1842 3.628571 3.643793 
1 1 1   12    3  -10 o  422.993   2.6320  7295.65   90.752  7154.19  126.712  7444.64  130.038  418.781   3.7119  427.195   3.7343 -8.413879 5.265255 
1 1 1   12    3   -9 o  265.307   1.9658  2869.52   42.514  2890.67   65.665  2854.25   55.783  266.239   3.0257  264.577   2.5865 1.661896 3.980559 
1 1 1   12    3   -8 o  175.919   1.6040  1261.55   23.001  1243.32   30.789  1284.56   34.601  174.633   2.1629  177.500   2.3914 -2.867157 3.224452 
1 1 1   12    3   -7 o  258.515   1.9412  2724.44   40.906  2770.42   55.207  2668.47   60.914  260.663   2.5982  255.808   2.9212 4.855133 3.909519 
1 1 1   12    3   -6 o  466.981   3.3142  8893.91  126.157  8866.86  154.360  8948.33  218.940  466.192   4.0619  468.096   5.7379 -1.904236 7.030149 
1 1 1   12    3   -5 o  223.532   1.9361  2036.96   35.277  2035.90   43.522  2039.00   60.235  223.460   2.3893  223.595   3.3048 -0.1352539 4.078073 
1 1 1   12    3   -4 o  169.555   1.8945  1171.98   26.184  1190.83   34.706  1147.07   39.895  170.900   2.4913  167.718   2.9181 3.181290 3.836920 
1 1 1   12    3   -3 o  212.822   2.0641  1846.51   35.808  1868.61   40.557  1768.34   76.265  214.085   2.3240  208.171   4.4944 5.914841 5.059692 
1 1 1   12    3   -2 f  117.032   1.5015  558.307   14.324  574.226   19.879  541.119   20.657  118.682   2.0548  115.208   2.1996 3.474251 3.010072 
1 1 1   12    3   -1 o  309.712   2.1969  3910.63   55.463  3879.22   73.345  3952.58   84.763  308.433   2.9172  311.311   3.3402 -2.878082 4.434782 
1 1 1   12    3    0 f  227.563   1.9510  2111.09   36.190  2130.99   52.379  2092.90   50.060  228.605   2.8108  226.557   2.7107 2.048477 3.904942 
1 1 1   12    3    1 o  134.881   1.6513  741.611   18.156  748.687   27.168  735.901   24.406  135.510   2.4595  134.352   2.2285 1.157852 3.318955 
1 1 1   12    3    2 f  246.434   1.8911  2475.71   37.989  2468.56   50.663  2484.88   57.417  246.058   2.5259  246.857   2.8534 -0.7989044 3.810775 
1 1 1   12    3    3 o  120.775   1.5236  594.595   15.000  593.273   20.645  596.074   21.830  120.633   2.0995  120.916   2.2148 -0.2827225 3.051773 
1 1 1   12    3    4 o  173.262   1.6071  1223.71   22.698  1230.93   30.774  1215.09   33.611  173.761   2.1727  172.635   2.3885 1.125946 3.228842 
1 1 1   12    3    5 o  136.515   1.5312  759.674   17.039  769.125   23.352  748.913   24.917  137.353   2.0857  135.533   2.2553 1.819855 3.071922 
1 1 1   12    3    6 o  312.567   2.6249  3983.57   66.879  3986.34   86.913  3979.55  104.717  312.630   3.4105  312.314   4.1133 0.3161926 5.343285 
1 1 1   12    3    7 o  421.076   3.7165  7232.59  127.564  7519.30  151.887  6546.21  235.006  429.275   4.3406  400.132   7.2051 29.14291 8.411558 
1 1 1   12    3    8 o  469.596   3.3328  8994.01  127.575  9057.27  157.444  8873.05  217.695  471.162   4.0994  466.115   5.7295 5.046967 7.045037 
1 1 1   12    3    9 o  344.546   2.5794  4840.40   72.444  4794.35   88.381  4934.67  126.466  342.867   3.1623  347.740   4.4615 -4.873047 5.468545 
1 1 1   12    3   10 o  212.438   1.8930  1839.80   32.781  1827.23   40.401  1864.03   56.086  211.698   2.3412  213.786   3.2184 -2.088028 3.979834 
1 1 1   12    3   11 o  211.848   1.8857  1829.59   32.564  1828.17   40.235  1832.29   55.444  211.753   2.3310  211.958   3.2090 -0.2049561 3.966262 
1 1 1   12    3   12 o  103.160   1.5440  433.804   12.983  425.554   17.816  443.148   18.960  102.166   2.1392  104.256   2.2310 -2.089287 3.090893 
1 1 1   12    3   13 o  170.914   2.3634  1191.03   32.927  1112.05   55.147  1234.79   41.046  165.087   4.0980  174.009   2.8937 -8.921448 5.016735 
1 1 1   12    3   14 o  249.783   2.4939  2544.00   50.778  2530.66   71.890  2557.28   71.732  249.073   3.5408  250.381   3.5146 -1.308456 4.988964 
1 1 1   12    3   15 o  274.402   2.6544  3070.40   59.373  3024.60   83.428  3117.40   84.515  272.280   3.7589  276.426   3.7508 -4.146210 5.310118 
1 1 1   12    3   16 o  373.789   3.3599  5699.16  102.372  5645.37  144.460  5753.42  145.095  371.868   4.7656  375.413   4.7414 -3.544861 6.722528 
1 1 1   12    3   17 o  202.721   2.5416  1675.75   41.999  1637.42   71.594  1695.86   51.859  200.295   4.3850  203.909   3.1200 -3.614120 5.381682 
1 1 1   12    3   18 o  186.393   2.1297  1416.50   32.358  1434.19   64.488  1410.55   37.408  187.460   4.2202  185.990   2.4674 1.469696 4.888564 
1 1 1   12    3   19 f  175.096   2.0832  1249.98   29.733  1233.07   58.634  1255.84   34.497  173.822   4.1382  175.495   2.4115 -1.673874 4.789534 
1 1 1   12    3   20 o  304.410   2.5654  3778.78   63.657  3586.58   97.285  3922.69   84.179  296.454   4.0258  310.097   3.3302 -13.64249 5.224679 
1 1 1   12    3   21 o  426.783   3.3540  7430.51  116.683  7534.35  186.859  7364.13  149.389  429.453   5.3378  424.745   4.3147 4.707947 6.863605 
1 1 1   12    3   22 o  226.548   2.1199  2092.63   39.149  2043.31   61.471  2126.28   50.779  223.799   3.3696  228.335   2.7282 -4.536133 4.335579 
1 1 1   12    3   23 o  290.981   2.4827  3452.76   58.888  3549.42   95.257  3392.97   74.920  294.905   3.9626  288.401   3.1869 6.503876 5.085090 
1 1 1   12    3   24 o  308.798   2.5931  3888.78   65.272  3941.57  104.538  3855.04   83.563  310.745   4.1270  307.396   3.3349 3.349274 5.305989 
1 1 1   12    3   25 o  359.950   2.9186  5284.80   85.634  5336.39  136.658  5251.44  109.884  361.489   4.6377  358.721   3.7579 2.768036 5.969080 
1 1 1   12    3   26 o  469.693   3.6501  9002.72  139.751  9115.64  223.518  8930.26  179.067  472.180   5.8072  467.608   4.6978 4.572235 7.469507 
1 1 1   12    3   27 o  113.514   1.7700  525.337   16.378  515.277   26.304  531.706   20.929  112.358   2.8744  114.190   2.2485 -1.832001 3.649348 
1 1 1   12    3   28 o  197.453   1.9834  1589.65   31.923  1578.59   50.620  1596.95   41.134  196.706   3.1570  197.881   2.5501 -1.174088 4.058285 
1 1 1   12    3   29 o   27.161   4.0504   30.777   8.6941   33.196   14.747   29.488   10.764   27.922   6.5864   26.408   5.1854 1.513830 8.382702 
1 1 1   12    3   30 o   92.185   1.8049  346.477   13.563  341.505   22.167  349.453   17.148   91.447   2.9776   92.571   2.2724 -1.124458 3.745716 
1 1 1   12    3   31 o  195.802   1.9718  1563.21   31.471  1515.14   49.387  1596.08   40.837  192.707   3.1440  197.823   2.5324 -5.116455 4.037063 
1 1 1   12    3   32 o  173.667   1.8864  1229.73   26.704  1234.05   42.896  1226.99   34.123  173.919   3.0257  173.453   2.4134 0.4665680 3.870338 
1 1 1   12    3   33 o  279.513   2.4207  3186.32   55.154  3180.14   87.619  3190.38   70.982  279.104   3.8512  279.632   3.1141 -0.5277100 4.952683 
1 1 1   12    3   34 o   37.012   3.0060   56.256   8.9911   44.033   15.171   62.873   11.163   32.295   5.9832   39.089   3.5417 -6.794277 6.952837 
1 1 1   12    3   35 o  165.639   1.8496  1118.67   24.974  1070.16   39.070  1152.18   32.474  161.959   2.9594  168.081   2.3702 -6.121994 3.791545 
1 1 1   12    3   36 o  105.589   2.0068  454.620   17.273  518.922   37.995  437.868   19.393  112.649   4.1448  103.618   2.2959 9.030304 4.738227 
1 1 1   12    3   37 o  181.439   2.4728  1342.71   36.573  1387.97   66.663  1323.23   43.744  184.324   4.4368  180.089   2.9798 4.235596 5.344573 
1 1 1   12    3   38 o  101.473   2.3046  419.935   19.062  425.738   35.727  417.626   22.539  101.999   4.3067  101.143   2.7363 0.8563385 5.102396 
1 1 1   12    3   39 o  192.581   2.5331  1512.78   39.765  1493.76   70.378  1521.70   48.195  191.201   4.5155  193.112   3.0617 -1.910843 5.455620 
1 1 1   12    3   40 o  237.763   2.1860  2305.47   42.367  2359.32   68.449  2272.02   53.941  240.412   3.4928  235.986   2.8041 4.425446 4.479152 
1 1 1   12    3   41 o  285.169   2.4518  3317.01   56.993  3379.67   91.841  3277.77   72.680  287.678   3.9165  283.407   3.1461 4.271057 5.023590 
1 1 1   12    3   42 o  132.357   1.7740  714.296   19.140  675.018   30.495  739.826   24.586  128.622   2.9086  134.685   2.2394 -6.063293 3.670769 
1 1 1   12    3   43 o  259.174   2.3034  2739.65   48.662  2808.66   78.790  2697.09   61.874  262.273   3.6854  257.094   2.9524 5.178680 4.722140 
1 1 1   12    3   44 o  133.449   1.7819  726.150   19.384  736.709   31.519  719.727   24.582  134.369   2.8777  132.840   2.2701 1.529449 3.665295 
1 1 1   12    3   45 o  183.789   1.9332  1377.43   28.963  1347.33   46.043  1397.14   37.257  181.694   3.1088  185.069   2.4697 -3.374374 3.970348 
1 1 1   12    3   46 o  166.071   1.8653  1124.63   25.251  1078.42   39.893  1155.53   32.617  162.558   3.0106  168.311   2.3774 -5.752319 3.836098 
1 1 1   12    3   47 o   26.345   4.1395   29.040   8.5967   14.418   14.676   36.678   10.607   20.143   7.1396   29.616   4.5380 -9.472923 8.459756 
1 1 1   12    3   48 o   34.033   3.2199   47.700   8.8262   21.510   14.790   62.185   10.999   22.961   7.1438   38.868   3.5095 -15.90628 7.959339 
1 1 1   12    3   49 o  109.509   1.7737  489.010   15.833  514.368   26.426  474.809   19.775  112.231   2.8909  107.892   2.2485 4.339279 3.662429 
1 1 1   12    3   50 o  118.142   1.7744  569.156   17.088  564.229   27.793  572.151   21.668  117.581   2.8998  118.435   2.2444 -0.8538208 3.666867 
1 1 1   12    3   51 o   91.460   1.8458  341.117   13.761  318.366   22.332  355.043   17.472   88.258   3.1090   93.294   2.2975 -5.035728 3.865793 
1 1 1   12    3   52 o  125.572   1.7973  643.023   18.398  655.596   30.187  635.594   23.205  126.738   2.9220  124.824   2.2806 1.913712 3.706647 
1 1 1   12    3   53 o  107.240   1.8406  469.000   16.090  470.083   26.569  468.373   20.219  107.267   3.0417  107.150   2.3149 0.1166992 3.822418 
1 1 1   12    3   54 o  105.905   1.8622  457.413   16.076  460.095   26.412  455.834   20.262  106.116   3.0566  105.703   2.3516 0.4130554 3.856499 
1 1 1   12    3   55 o  118.026   1.8613  568.122   17.907  566.794   29.364  568.908   22.595  117.784   3.0609  118.085   2.3473 -0.3011551 3.857356 
1 1 1   12    3   56 o  115.643   1.9374  545.450   18.263  508.069   29.207  569.448   23.402  111.494   3.2170  118.136   2.4302 -6.641266 4.031775 
1 1 1   12    3   57 o  187.206   2.2505  1429.76   34.343  1491.99   70.188  1410.17   39.378  190.961   4.5090  185.889   2.5988 5.071243 5.204298 
1 1 1   12    3   58 o  141.607   4.2180  820.864   48.635  820.864   48.635   0.0000   0.0000  141.607   4.2180  ?   ?  0.000000 4.218042 
1 1 1   12    3   59 o   96.003   2.3834  376.086   18.651  398.873   35.307  367.266   21.967   98.633   4.4025   94.805   2.8457 3.827873 5.242171 
1 1 1   12    3   60 o  137.972   2.4471  776.886   27.522  769.877   33.926  790.377   47.070  137.301   3.0313  138.932   4.1610 -1.631546 5.148040 
1 1 1   12    3   61 o  149.235   2.1561  908.690   26.229  927.841   36.952  889.244   37.236  150.723   3.0076  147.546   3.0960 3.177368 4.316315 
1 1 1   12    3   62 o  111.081   2.1238  503.458   19.231  489.429   26.744  518.478   27.672  109.422   3.0013  112.623   3.0169 -3.201065 4.255505 
1 1 1   12    3   63 o   61.210   2.5524  153.226   12.707  174.672   17.237  127.698   18.807   65.295   3.2487   55.695   4.1728 9.600773 5.288347 
1 1 1   12    3   64 f   54.107   2.2824  119.699   10.044  124.627   16.466  116.780   12.675   55.074   3.6891   53.387   2.9238 1.686981 4.707266 
1 1 1   12    3   65 o  160.297   1.9445  1048.39   25.407  1034.85   43.656  1055.32   31.244  159.088   3.3664  160.783   2.3839 -1.694214 4.125025 
1 1 1   12    3   66 o  110.135   1.7376  494.822   15.599  477.553   23.976  507.497   20.541  108.092   2.7233  111.502   2.2600 -3.410622 3.538918 
1 1 1   12    3   67 o  158.328   1.7598  1022.69   22.712  1028.49   33.937  1017.99   30.567  158.682   2.6237  157.900   2.3748 0.7814331 3.538826 
1 1 1   12    3   68 o   40.895   2.7315   68.635   9.0535   70.419   15.364   67.686   11.206   41.159   4.6612   40.529   3.4238 0.6300507 5.783524 
1 1 1   12    3   69 o   74.993   1.7403  229.461   10.638  228.565   15.308  230.298   14.795   74.760   2.5155   75.053   2.4215 -0.2924500 3.491630 
1 1 1   12    3   70 f  119.509   1.5657  582.645   15.253  590.227   21.176  574.470   21.989  120.235   2.1606  118.608   2.2743 1.626785 3.136988 
1 1 1   12    3   71 o  175.266   1.9383  1253.82   27.692  1264.28   32.146  1223.75   54.525  175.952   2.2413  172.776   3.8715 3.176468 4.473467 
1 1 1   12    3   72 o   45.015   2.2908   82.981   8.3781   86.662   12.592   80.057   11.223   45.880   3.3908   44.120   3.1411 1.760124 4.622164 
1 1 1   12    3   73 f  153.695   1.5680  963.815   19.644  963.882   27.408  963.743   28.170  153.623   2.1887  153.602   2.2498 0.2018738E-01 3.138827 
1 1 1   12    3   74 o   54.431   1.9065  121.104   8.4459  121.443   13.333  120.876   10.915   54.389   3.0193   54.326   2.4713 0.6267929E-01 3.901686 
1 1 1   12    3   75 o  110.170   1.5187  495.254   13.638  534.227   20.149  462.303   18.528  114.355   2.1616  106.382   2.1365 7.973320 3.039276 
1 1 1   12    3   76 o  109.028   1.7585  485.280   15.628  517.649   29.221  472.313   18.495  112.349   3.1940  107.522   2.1102 4.826653 3.828138 
1 1 1   12    3   77 o   52.056   1.9559  110.843   8.2850  114.147   16.547  109.738   9.5710   52.554   3.8902   51.763   2.2739 0.7911263 4.506036 
1 1 1   12    3   78 o   50.912   2.0183  106.078   8.3596  129.854   17.127   98.642   9.5779   56.075   3.7688   49.050   2.4028 7.025425 4.469646 
1 1 1   12    3   79 o   61.186   1.6366  152.964   8.1551  147.771   13.966  155.651   10.045   59.981   2.8648   61.683   2.0005 -1.701862 3.494154 
1 1 1   12    3   80 o   68.573   1.6986  192.053   9.4945  185.657   14.218  197.201   12.755   67.279   2.5974   69.395   2.2579 -2.115646 3.441593 
1 1 1   12    3   81 o   57.080   1.8315  133.273   8.5109  150.428   13.265  121.271   11.096   60.523   2.6955   54.358   2.5109 6.165001 3.683818 
1 1 1   12    3   82 o  108.419   1.4703  479.960   12.994  480.843   18.921  479.171   17.877  108.408   2.1411  108.241   2.0261 0.1669083 2.947791 
1 1 1   12    3   83 o   53.303   1.5919  116.171   6.9089  121.615   12.412  113.727   8.3163   54.357   2.8109   52.697   1.9393 1.659374 3.414943 
1 1 1   12    3   84 o   40.385   1.7906   66.817   5.8800   74.850   11.098   63.682   6.9330   42.515   3.2266   39.377   2.1683 3.137966 3.887471 
1 1 1   12    3   85 o   66.942   1.3907  183.028   7.5889  188.724   13.285  180.269   9.2460   67.792   2.4079   66.378   1.7102 1.413696 2.953420 
1 1 1   12    3   86 f   74.781   1.3315  228.403   8.1167  222.112   13.947  231.626   9.9810   73.548   2.3293   75.267   1.6268 -1.719315 2.841136 
1 1 1   12    3   87 o   26.134   2.2097   28.208   4.6633   33.299   10.220   26.869   5.2406   27.850   4.6669   25.443   2.5616 2.406559 5.323695 
1 1 1   12    3   88 o   30.169   2.3107   37.586   5.6394   38.119   10.205   37.352   6.7664   29.917   4.3087   29.983   2.8009 -0.6677437E-01 5.139065 
1 1 1   12    3   89 o   31.289   3.3170   40.996   8.3313   42.886   11.483   38.895   12.106   31.643   4.5855   29.922   5.1489 1.720768 6.894795 
1 1 1   12    3   90 o   33.668   2.9396   47.194   7.9866   47.617   10.534   46.622   12.248   33.548   3.9263   32.938   4.6945 0.6102676 6.119989 
1 1 1   12    3   91 o   61.092   2.0546  153.414   10.217  150.708   13.888  156.607   15.084   60.320   2.8324   61.424   3.0219 -1.104343 4.141792 
1 1 1   12    3   92 o   16.509   5.1578   11.668   7.7012   20.792   10.427   0.7167   11.424   21.542   5.8069   13.536   5.7995 8.006182 8.206992 
1 1 1   12    3   93 o   42.032   2.3580   73.024   8.0468   78.599   10.400   64.710   12.701   43.443   2.9545   39.025   4.0517 4.418484 5.014466 
1 1 1   12    3   94 o   19.543   4.8082   16.944   7.6063   14.990   9.2985   20.897   13.224   18.447   5.6514   21.521   6.7638 -3.074066 8.814050 
1 1 1   12    3   95 o   25.505   3.8578   27.949   7.7703   24.567   9.4179   35.160   13.751   23.478   5.0696   27.708   6.2390 -4.230076 8.039057 
1 1 1   12    3   96 o   46.837   2.3039   90.755   8.7692   91.438   10.755   89.401   15.145   46.838   2.8302   45.761   4.1036 1.077118 4.984991 
1 1 1   12    3   97 o   29.679   3.1256   37.153   7.4483   38.874   9.6626   34.634   11.692   30.036   4.0497   27.781   5.3574 2.254906 6.715743 
1 1 1   12    3   98 o   54.646   1.9586  123.078   8.7103  117.674   11.130  131.617   13.991   53.217   2.5735   56.064   3.0732 -2.846935 4.008443 
1 1 1   12    3   99 o   12.600   4.8150   5.1560   6.8895   8.9302   8.8759  -0.5646   10.927   15.196   5.5316   12.716   5.5589 2.479894 7.842187 
1 1 1   12    3  100 o   9.8484   4.3489  -1.4033   6.8443 -11.3045   8.7446   14.254   10.996   8.8266   4.2316   18.072   6.1944 -9.245620 7.501772 
1 1 1   12    3  101 o   22.458   4.1029   22.186   7.2345   18.439   9.2298   28.155   11.650   20.018   5.4917   24.575   5.8920 -4.556595 8.054471 
1 1 1   12    3  102 o   32.645   2.9071   44.964   7.6552   51.460   9.9104   35.354   12.054   34.659   3.5583   27.713   5.5297 6.946173 6.575707 
1 1 1   12    3  103 o   30.198   3.1299   38.816   7.5929   39.021   9.8810   38.520   11.865   29.800   4.1826   29.061   5.1996 0.7397251 6.673112 
1 1 1   12    3  104 o   35.218   2.7586   52.302   7.8562   53.419   10.144   50.629   12.419   35.198   3.5855   33.652   4.6514 1.546902 5.872991 
1 1 1   12    3  105 o   8.3064   3.9692  -9.0005   7.5583 -15.6553   8.8007   9.7040   14.754   8.0600   3.9504   16.820   6.8476 -8.759933 7.905372 
1 1 1   12    3  106 o   27.513   3.9002   33.426   8.5023   37.019   10.016   24.159   16.085   28.676   4.4272   21.652   7.4889 7.023594 8.699672 
1 1 1   12    3  107 o   45.455   2.3708   86.647   8.7541   87.403   11.303   85.514   13.839   45.218   3.0849   44.133   3.8866 1.085354 4.962063 
1 1 1   12    3  108 o   22.110   4.8092   22.870   8.4204   26.343   11.658   19.083   12.175   22.938   6.1215   19.508   6.5188 3.429821 8.942439 
1 1 1   12    3  109 o   37.681   3.3242   61.689   10.106   62.636   12.592   59.975   16.939   37.292   4.2162   34.677   6.2213 2.614937 7.515348 
1 1 1   12    3  110 o   45.364   2.9362   88.334   10.799   86.615   13.606   91.261   17.754   44.166   3.8167   44.062   5.0332 0.1036606 6.316637 
1 1 1   12    3  111 o   16.236   5.5013   12.682   8.6695   12.088   10.393   14.039   15.718   16.107   5.9651   17.496   7.0879 -1.389570 9.263988 
1 1 1   12    3  112 o   33.152   4.1324   50.021   10.926   31.645   13.856   80.225   17.764   24.122   6.7713   40.547   5.5176 -16.42536 8.734673 
1 1 1   12    3  113 o   11.527   5.1921  -1.3070   10.273   10.710   13.376 -18.5924   16.042   15.996   6.5170   11.278   5.4850 4.717994 8.518005 
1 1 1   12    3  114 o   27.910   5.5717   38.896   12.232   38.611   17.356   39.177   17.241   25.443   7.7063   25.707   7.6572 -0.2633533 10.86368 
1 1 1   12    3  115 o   17.430   6.4281   15.660   12.047   8.1447   16.734   23.745   17.357   15.838   6.9021   20.078   7.6499 -4.240225 10.30338 
1 1 1   12    3  116 f   39.082   4.9991   73.499   15.562   80.911   27.598   70.043   18.843   34.113   9.5493   36.182   6.6332 -2.069141 11.62704 
1 1 1   12    3  117 o   31.735   4.4514   47.276   11.199   44.159   18.502   49.079   14.069   26.680   7.9284   31.031   5.7745 -4.351194 9.808417 
1 1 1   12    3  118 o   18.221   6.1236   17.740   10.742   0.8266   17.067   28.834   13.823   14.272   6.5312   22.383   6.8965 -8.110952 9.498334 
1 1 1   12    3  119 o   12.669   5.6509   1.3249   11.847 -22.1367   16.802   24.523   16.708   11.003   5.4063   20.046   7.5353 -9.042546 9.274087 
1 1 1   12    3  120 o   17.225   6.8197   15.721   14.210   46.093   17.903 -35.9930   23.361   27.334   7.7054   11.971   5.9673 15.36276 9.745833 
1 1 1   12    3  121 o   24.490   6.9593   35.064   14.545   43.150   17.361   16.024   26.639   26.359   7.6390   18.020   8.2133 8.339235 11.21664 
1 1 1   12    3  122 o   24.645   7.0086   35.705   14.746   27.618   18.297   50.693   24.909   20.563   7.8496   25.402   9.2635 -4.838324 12.14198 
1 1 1   12    3  123 o   22.834   7.1163   31.218   14.670   38.880   18.052   16.322   25.173   24.440   7.9270   17.986   8.1120 6.454510 11.34204 
1 1 1   12    4 -121 f   12.007   5.3207   1.3943   10.332   3.3482   13.125  -1.7896   16.755   13.490   5.9864   13.559   6.2990 -0.6845474E-01 8.689933 
1 1 1   12    4 -120 o   17.498   6.0888   16.546   10.640   14.281   13.033   21.072   18.426   16.584   6.5419   18.655   7.6306 -2.071657 10.05099 
1 1 1   12    4 -119 o   10.056   4.7542  -7.1158   10.280  -5.3422   12.635 -10.5895   17.683   11.497   5.3838   12.561   6.0208 -1.063848 8.076810 
1 1 1   12    4 -118 o   11.846   5.2608   0.9495   10.156   7.4905   12.621 -11.0675   17.106   14.481   6.1467   12.349   5.9198 2.132567 8.533782 
1 1 1   12    4 -117 o   8.3954   4.1330 -16.8138   9.9771 -16.8679   12.400 -16.7143   16.801   9.6825   4.7337   11.581   5.6280 -1.898657 7.354063 
1 1 1   12    4 -116 o   16.576   6.0649   14.052   10.690   22.155   13.533   0.6078   17.433   19.666   6.8654   14.308   6.5674 5.357918 9.500773 
1 1 1   12    4 -115 o   14.022   5.7292   7.4352   10.374   12.514   12.779  -2.3794   17.764   16.216   6.4520   13.957   6.4849 2.258618 9.147781 
1 1 1   12    4 -114 o   12.955   5.3532   5.3616   9.1899   7.7503   10.896  -0.5254   17.105   14.307   5.8616   14.131   6.4932 0.1763515 8.747567 
1 1 1   12    4 -113 o   18.570   5.9788   18.072   10.281   15.001   12.607   24.169   17.764   17.172   6.5251   20.134   7.7224 -2.962719 10.11005 
1 1 1   12    4 -112 o   34.407   3.8485   53.433   10.609   71.764   13.235   20.479   17.746   39.606   4.1616   19.167   7.6106 20.43888 8.674111 
1 1 1   12    4 -111 o   26.582   4.7669   33.570   9.9494   41.504   12.183   17.680   17.241   29.128   5.3273   18.478   7.4456 10.64969 9.155131 
1 1 1   12    4 -110 o   19.762   5.5994   19.734   9.4295   17.301   11.079   26.131   17.963   18.311   6.2187   21.078   7.8354 -2.766300 10.00327 
1 1 1   12    4 -109 o   11.587   5.1099   0.3480   9.4193   8.3455   11.296 -17.9065   17.066   14.841   6.0100   11.825   5.7291 3.015621 8.303144 
1 1 1   12    4 -108 o   8.6277   4.2006 -13.9498   9.4801  -7.5877   10.283 -49.9789   24.471   10.209   4.8046   11.773   5.9036 -1.563709 7.611566 
1 1 1   12    4 -107 f   9.8983   4.6521  -7.3060   9.5834 -13.3360   10.307   31.185   26.040   9.2612   4.4785   22.559   9.1288 -13.29756 10.16824 
1 1 1   12    4 -106 o   33.749   3.8603   50.425   10.429   48.016   11.298   64.290   27.110   32.578   4.3642   31.784   9.6324 0.7939224 10.57499 
1 1 1   12    4 -105 o   17.284   5.5426   14.142   8.8419   17.202   10.494   6.6559   16.416   18.785   6.0397   16.193   6.9453 2.592566 9.204079 
1 1 1   12    4 -104 o   33.747   3.4684   49.354   9.4053   46.125   11.207   57.047   17.297   32.048   4.4064   34.026   6.4728 -1.978172 7.830285 
1 1 1   12    4 -103 o   26.033   4.8324   31.032   9.8772   27.603   11.182   43.214   21.073   23.976   5.7877   27.885   8.5010 -3.909451 10.28415 
1 1 1   12    4 -102 o   49.149   3.2720  102.957   13.034  105.454   15.357   96.524   24.648   49.336   3.8491   44.300   7.0627 5.036102 8.043427 
1 1 1   12    4 -101 o   29.424   2.6923   36.491   6.3859   54.536   13.639   31.425   7.2269   34.812   4.9455   27.041   3.3502 7.770706 5.973453 
1 1 1   12    4 -100 o   34.125   2.5473   48.756   7.0346   37.499   17.628   50.888   7.6720   27.227   7.6355   34.801   2.7262 -7.574083 8.107622 
1 1 1   12    4  -99 o   25.632   3.0245   27.892   6.1978   28.203   13.434   27.808   6.9857   24.242   6.6153   25.440   3.4580 -1.198759 7.464609 
1 1 1   12    4  -98 o   21.701   3.6107   20.405   6.1629   32.488   13.591   17.278   6.9147   26.207   6.4148   19.673   4.4200 6.533407 7.790087 
1 1 1   12    4  -97 o   30.540   2.4971   38.924   6.1622   37.123   11.143   39.718   7.3959   28.896   4.9062   30.698   2.9936 -1.802246 5.747416 
1 1 1   12    4  -96 o   54.437   1.7318  121.866   7.6747  122.859   12.853  121.316   9.5677   54.216   2.9190   54.176   2.1709 0.4084015E-01 3.637797 
1 1 1   12    4  -95 o   23.806   3.2131   24.102   6.0763   15.483   10.511   28.427   7.4466   18.679   6.0480   25.744   3.6508 -7.064558 7.064469 
1 1 1   12    4  -94 o   22.576   3.3899   21.789   6.0458   14.127   10.472   25.620   7.4045   18.069   6.0458   24.365   3.8564 -6.295574 7.171067 
1 1 1   12    4  -93 o   17.693   4.4439   13.846   6.3995   24.216   10.265   7.2525   8.1850   23.139   5.5195   14.245   5.2903 8.894072 7.645379 
1 1 1   12    4  -92 o   23.851   3.4732   24.257   6.5545   34.059   10.530   18.056   8.3747   27.865   4.8096   20.100   5.1031 7.765131 7.012401 
1 1 1   12    4  -91 o   58.513   1.8369  140.656   8.7504  139.347   12.981  141.746   11.847   57.954   2.7557   58.546   2.4880 -0.5929756 3.712687 
1 1 1   12    4  -90 o   34.527   2.6033   49.498   7.2729   48.677   11.367   50.067   9.4635   33.742   4.2250   34.504   3.4092 -0.7612190 5.428965 
1 1 1   12    4  -89 o   29.842   3.0198   37.261   7.2450   28.655   15.305   39.746   8.2248   24.982   7.1520   30.747   3.3350 -5.764339 7.891365 
1 1 1   12    4  -88 o   15.009   4.8517   9.3661   6.7658   22.857   14.746   5.7687   7.6146   22.644   7.1460   13.403   5.0763 9.240693 8.765484 
1 1 1   12    4  -87 o   36.446   2.8228   55.144   8.3207   64.783   22.587   53.630   8.9502   37.615   7.6277   35.874   3.0908 1.740658 8.230081 
1 1 1   12    4  -86 o   15.269   4.8276   9.7464   6.7270   25.015   12.717   3.8144   7.9268   23.654   6.4289   12.733   5.0765 10.92113 8.191491 
1 1 1   12    4  -85 o   31.830   2.6777   41.985   6.8832   37.625   11.166   44.657   8.7418   29.579   4.7949   32.693   3.3265 -3.113831 5.835842 
1 1 1   12    4  -84 o   46.434   2.1251   88.564   8.0224   87.200   11.896   89.702   10.865   45.849   3.2031   46.583   2.8753 -0.7344322 4.304312 
1 1 1   12    4  -83 o   36.059   2.5514   53.661   7.4511   52.401   11.162   54.673   10.007   35.328   3.9433   36.221   3.4301 -0.8926697 5.226416 
1 1 1   12    4  -82 o   23.038   3.8591   22.543   6.9909   16.876   10.745   26.704   9.2061   19.877   6.0722   24.919   4.7047 -5.041500 7.681499 
1 1 1   12    4  -81 o   22.763   3.9260   22.023   7.0216   13.362   10.654   28.674   9.3359   18.219   6.0983   25.891   4.5916 -7.672890 7.633629 
1 1 1   12    4  -80 o  105.078   1.5701  451.036   13.449  451.943   18.818  450.089   19.228  105.071   2.1971  104.844   2.2499 0.2269821 3.144701 
1 1 1   12    4  -79 o  114.534   1.5711  535.765   14.668  535.691   20.407  535.845   21.098  114.415   2.1881  114.416   2.2621 -0.7095337E-03 3.147195 
1 1 1   12    4  -78 o   62.626   2.0280  160.527   10.339  164.027   16.285  158.164   13.382   63.115   3.1756   62.070   2.6510 1.044464 4.136688 
1 1 1   12    4  -77 o   39.991   2.7866   65.863   9.0272   65.586   14.744   66.029   11.418   39.544   4.6635   39.915   3.5460 -0.3715782 5.858545 
1 1 1   12    4  -76 o   26.209   4.1842   29.005   8.6388   30.807   14.294   27.968   10.843   26.592   6.6201   25.486   5.3881 1.105919 8.535705 
1 1 1   12    4  -75 o   38.734   3.1096   61.907   9.7356   83.108   15.848   49.056   12.338   44.676   4.4091   34.186   4.5396 10.48981 6.328422 
1 1 1   12    4  -74 o   46.038   2.4613   86.934   9.2032   91.446   13.744   83.267   12.391   47.054   3.6109   44.922   3.4094 2.132824 4.966139 
1 1 1   12    4  -73 o   34.468   3.0536   49.039   8.4907   54.300   12.679   44.761   11.433   36.053   4.4058   32.685   4.4029 3.368259 6.228693 
1 1 1   12    4  -72 o   25.351   4.2523   27.132   8.4765   22.993   11.957   31.314   12.018   23.131   6.2111   27.016   5.6398 -3.884842 8.389555 
1 1 1   12    4  -71 o   53.994   2.2728  119.324   9.9809  101.755   13.499  140.514   14.825   49.723   3.3499   58.499   3.1201 -8.776100 4.577925 
1 1 1   12    4  -70 o  186.902   1.8292  1425.88   27.868  1408.19   34.743  1457.81   46.667  185.659   2.2957  188.737   3.0333 -3.077408 3.804128 
1 1 1   12    4  -69 o   36.506   3.0356   54.899   8.9516   71.158   12.441   37.445   12.890   41.500   3.7169   29.658   5.5355 11.84232 6.667614 
1 1 1   12    4  -68 o  104.734   1.6075  447.533   13.724  452.977   18.943  441.520   19.909  105.321   2.2065  103.967   2.3492 1.353790 3.222985 
1 1 1   12    4  -67 o   54.578   2.0945  121.788   9.3009  125.206   13.095  118.309   13.212   55.260   2.9175   53.699   3.0307 1.560867 4.206791 
1 1 1   12    4  -66 o   92.593   1.6726  349.787   12.624  339.504   15.583  369.426   21.535   91.195   2.0962   95.030   2.7830 -3.835442 3.484143 
1 1 1   12    4  -65 o   44.578   2.4183   81.394   8.7544   79.893   11.018   83.964   14.417   44.095   3.0849   45.094   3.9624 -0.9996109 5.021701 
1 1 1   12    4  -64 o   92.550   1.6813  349.431   12.684  353.309   15.859  342.545   21.132   93.038   2.0911   91.512   2.8363 1.526970 3.523840 
1 1 1   12    4  -63 o   99.191   1.6665  401.351   13.475  397.651   16.735  408.170   22.721   98.709   2.0799   99.914   2.7925 -1.204597 3.481931 
1 1 1   12    4  -62 o   53.083   2.0383  115.155   8.8036  131.336   11.523   92.463   13.645   56.659   2.5010   47.410   3.5567 9.248817 4.348015 
1 1 1   12    4  -61 o  180.712   1.8220  1332.25   26.840  1363.32   39.533  1305.69   36.556  182.712   2.6543  178.827   2.5077 3.884598 3.651622 
1 1 1   12    4  -60 o  103.473   1.7627  436.745   14.868  462.565   22.670  417.255   19.696  106.435   2.6129  101.103   2.3898 5.331924 3.541014 
1 1 1   12    4  -59 o  106.504   1.7270  462.673   14.993  463.191   17.909  461.459   27.413  106.546   2.0621  106.221   3.1696 0.3257980 3.781305 
1 1 1   12    4  -58 f  149.425   1.5618  910.568   19.023  927.578   25.657  889.800   28.351  150.779   2.0875  147.656   2.3555 3.123718 3.147344 
1 1 1   12    4  -57 o  110.173   1.6174  495.011   14.526  485.324   20.491  504.796   20.595  109.055   2.3050  111.223   2.2715 -2.168167 3.236203 
1 1 1   12    4  -56 o  147.591   1.5712  888.305   18.903  892.892   25.330  882.540   28.399  147.940   2.1005  147.061   2.3690 0.8795013 3.166133 
1 1 1   12    4  -55 o  165.452   1.6260  1116.32   21.929  1098.00   29.074  1140.49   33.401  164.053   2.1741  167.175   2.4510 -3.121735 3.276306 
1 1 1   12    4  -54 f   28.074   3.7197   32.770   8.3030   40.209   11.824   25.533   11.662   30.972   4.8418   24.460   5.9146 6.512444 7.643654 
1 1 1   12    4  -53 o   68.500   1.8456  191.509   10.296  207.832   16.296  180.664   13.283   71.300   2.8094   66.495   2.4549 4.805275 3.730805 
1 1 1   12    4  -52 o  134.879   2.0590  742.076   22.638  694.815   31.188  794.709   32.912  130.459   2.9327  139.525   2.8938 -9.066238 4.120080 
1 1 1   12    4  -51 o  124.326   1.5571  630.276   15.781  628.930   24.871  631.183   20.417  124.151   2.4575  124.396   2.0135 -0.2456131 3.177033 
1 1 1   12    4  -50 f  233.649   1.8791  2226.46   35.789  2197.72   47.181  2265.41   54.924  232.080   2.4940  235.584   2.8601 -3.504562 3.794731 
1 1 1   12    4  -49 o   95.968   1.6491  375.551   12.901  392.452   17.380  354.814   19.251   98.086   2.1737   93.216   2.5359 4.870331 3.340091 
1 1 1   12    4  -48 o  126.031   1.7316  647.717   17.789  650.270   26.327  645.571   24.131  126.241   2.5584  125.795   2.3533 0.4460449 3.476119 
1 1 1   12    4  -47 o  137.244   1.5436  768.005   17.269  744.688   27.741  782.758   22.066  135.100   2.5190  138.539   1.9540 -3.439224 3.188047 
1 1 1   12    4  -46 o   40.155   2.1965   65.965   7.1621   67.263   11.057   65.027   9.4009   40.446   3.3847   39.809   2.9172 0.6366501 4.468373 
1 1 1   12    4  -45 o  104.096   1.4031  441.781   11.906  429.232   17.490  452.619   16.253  102.587   2.0915  105.352   1.8926 -2.764343 2.820710 
1 1 1   12    4  -44 o   92.200   1.4343  346.582   10.779  359.105   16.203  336.639   14.438   93.833   2.1184   90.856   1.9494 2.977715 2.878883 
1 1 1   12    4  -43 o  225.407   1.6823  2071.70   30.910  2066.37   44.301  2076.76   43.148  225.066   2.4147  225.637   2.3459 -0.5708313 3.366633 
1 1 1   12    4  -42 o  135.239   1.4095  745.650   15.539  733.684   22.459  756.638   21.521  134.127   2.0542  136.214   1.9383 -2.086700 2.824267 
1 1 1   12    4  -41 o  293.463   1.9870  3512.05   47.531  3460.84   67.283  3563.08   67.156  291.229   2.8342  295.505   2.7880 -4.275818 3.975605 
1 1 1   12    4  -40 o  265.976   1.9794  2884.92   42.915  2946.14   67.337  2843.04   55.691  268.677   3.0746  263.986   2.5880 4.691071 4.018813 
1 1 1   12    4  -39 o  143.452   1.5097  838.995   17.654  828.422   27.729  846.202   22.893  142.512   2.3870  144.052   1.9496 -1.540176 3.081963 
1 1 1   12    4  -38 o   71.151   1.6283  206.408   9.4437  191.921   15.456  215.039   11.930   68.529   2.7725   72.589   2.0181 -4.059181 3.429239 
1 1 1   12    4  -37 o  155.177   1.5308  981.747   19.364  946.830   30.077  1006.47   25.306  152.357   2.4218  157.102   1.9761 -4.745438 3.125672 
1 1 1   12    4  -36 o   85.871   1.5341  300.630   10.738  328.743   17.841  284.661   13.446   89.742   2.4412   83.550   1.9744 6.191063 3.139653 
1 1 1   12    4  -35 o  257.192   1.9344  2697.32   40.554  2738.28   63.315  2668.83   52.809  259.049   2.9984  255.786   2.5327 3.263245 3.924936 
1 1 1   12    4  -34 o  251.539   1.9087  2580.00   39.137  2601.12   60.866  2565.12   51.101  252.484   2.9574  250.771   2.4998 1.712997 3.872377 
1 1 1   12    4  -33 o  210.650   2.0684  1809.53   35.516  1698.60   57.378  1878.42   45.220  203.994   3.4506  214.590   2.5852 -10.59694 4.311561 
1 1 1   12    4  -32 o  126.680   1.7004  654.304   17.559  630.907   28.378  668.819   22.352  124.357   2.7995  128.064   2.1411 -3.707626 3.524443 
1 1 1   12    4  -31 o  168.241   2.0497  1154.22   28.109  1124.70   59.533  1162.69   31.888  165.864   4.4071  168.845   2.3169 -2.981094 4.979002 
1 1 1   12    4  -30 o  239.035   2.4318  2330.42   47.384  2388.27  100.174  2313.74   53.781  241.697   5.0845  238.153   2.7703 3.544189 5.790229 
1 1 1   12    4  -29 o  261.418   2.3087  2787.06   49.196  2841.43  114.818  2774.83   54.447  263.598   5.3436  260.825   2.5609 2.772919 5.925548 
1 1 1   12    4  -28 o  306.455   2.3570  3830.16   58.879  3507.51   97.013  4018.31   74.084  293.079   4.0608  313.841   2.8959 -20.76154 4.987570 
1 1 1   12    4  -27 o  235.928   1.8392  2269.51   35.371  2253.82   54.636  2280.83   46.410  235.048   2.8516  236.484   2.4075 -1.435562 3.732010 
1 1 1   12    4  -26 o  202.564   1.6932  1672.90   27.958  1691.54   43.872  1660.15   36.279  203.642   2.6429  201.768   2.2058 1.874664 3.442459 
1 1 1   12    4  -25 o  125.605   1.4928  643.170   15.285  640.278   24.449  645.026   19.583  125.298   2.3937  125.776   1.9101 -0.4782104 3.062425 
1 1 1   12    4  -24 o  302.553   2.1648  3732.76   53.389  3711.05   82.081  3748.69   70.291  301.565   3.3391  303.141   2.8446 -1.576050 4.386453 
1 1 1   12    4  -23 o  315.658   2.2325  4063.23   57.443  4132.10   89.706  4015.36   74.788  318.202   3.4585  313.732   2.9244 4.469727 4.529124 
1 1 1   12    4  -22 o   45.902   2.1778   86.111   8.1255   92.041   14.001   83.100   9.9779   47.347   3.6559   45.054   2.7297 2.293633 4.562525 
1 1 1   12    4  -21 o  201.183   1.8178  1650.21   29.811  1692.62   53.561  1631.17   35.883  203.677   3.2260  200.003   2.2010 3.673615 3.905326 
1 1 1   12    4  -20 o  132.109   1.3988  711.469   15.064  705.008   21.830  717.343   20.814  131.493   2.0366  132.641   1.9250 -1.148331 2.802403 
1 1 1   12    4  -19 o   67.662   1.5946  186.641   8.7949  174.883   13.197  196.035   11.796   65.437   2.4786   69.306   2.0904 -3.868736 3.242404 
1 1 1   12    4  -18 o  149.417   1.4363  910.107   17.493  897.437   25.204  921.885   24.299  148.356   2.0842  150.366   1.9825 -2.010300 2.876430 
1 1 1   12    4  -17 o  203.458   1.5956  1687.58   26.463  1702.96   38.228  1673.44   36.669  204.356   2.2949  202.580   2.2206 1.776077 3.193362 
1 1 1   12    4  -16 o  464.309   2.8564  8793.49  108.108  8844.65  154.111  8743.92  151.694  465.471   4.0617  462.820   4.0209 2.650757 5.715301 
1 1 1   12    4  -15 o  147.197   1.5080  883.275   18.095  871.282   28.018  891.856   23.700  146.171   2.3515  147.899   1.9658 -1.727417 3.064958 
1 1 1   12    4  -14 o   56.386   1.7850  129.751   8.1939  129.232   12.525  130.140   10.834   56.223   2.7411   56.443   2.3600 -0.2198601 3.617078 
1 1 1   12    4  -13 o  320.702   2.2531  4193.85   58.900  4166.89   90.011  4214.03   77.892  319.569   3.4554  321.417   2.9729 -1.848572 4.558300 
1 1 1   12    4  -12 o  165.969   1.5665  1122.94   21.193  1118.98   32.959  1125.74   27.673  165.650   2.4409  166.163   2.0431 -0.5132141 3.183114 
1 1 1   12    4  -11 o  121.881   1.6299  605.596   16.194  626.656   23.351  586.082   22.477  123.967   2.3108  119.887   2.3000 4.080132 3.260285 
1 1 1   12    4  -10 o  223.075   1.9292  2028.86   35.080  2035.92   49.951  2021.99   49.278  223.425   2.7427  222.661   2.7150 0.7638245 3.859234 
1 1 1   12    4   -9 o  292.181   2.2815  3481.04   54.339  3492.87   77.209  3469.43   76.491  292.610   3.2370  291.628   3.2177 0.9820862 4.564178 
1 1 1   12    4   -8 o   57.792   1.9612  136.329   9.2256  129.876   12.776  143.361   13.336   56.362   2.7895   59.224   2.7701 -2.861752 3.931264 
1 1 1   12    4   -7 o  210.616   1.7363  1808.42   29.809  1795.06   39.764  1825.56   45.040  209.815   2.3250  211.577   2.6115 -1.762283 3.496511 
1 1 1   12    4   -6 o  369.162   2.5194  5557.43   75.815  5477.85   99.541  5667.38  117.000  366.435   3.3325  372.660   3.8516 -6.226013 5.093154 
1 1 1   12    4   -5 o  147.372   1.4403  885.351   17.303  895.816   25.187  875.998   23.810  148.227   2.0846  146.580   1.9927 1.646423 2.883805 
1 1 1   12    4   -4 o  148.710   1.4375  901.499   17.426  892.085   25.125  910.224   24.189  147.918   2.0838  149.417   1.9861 -1.498810 2.878623 
1 1 1   12    4   -3 o   81.064   1.5237  267.884   10.068  263.272   15.016  271.651   13.571   80.321   2.2958   81.626   2.0397 -1.305222 3.070981 
1 1 1   12    4   -2 f  104.272   1.4323  443.220   12.174  441.136   17.948  444.996   16.567  104.016   2.1168  104.474   1.9454 -0.4570541 2.874966 
1 1 1   12    4   -1 o  272.212   1.8839  3021.00   41.802  3089.39   60.510  2958.56   57.817  275.234   2.6971  269.346   2.6333 5.887238 3.769439 
1 1 1   12    4    0 o  153.031   1.4540  954.640   18.137  962.804   26.393  947.336   24.966  153.669   2.1070  152.432   2.0093 1.236877 2.911505 
1 1 1   12    4    1 o  136.392   1.5308  758.350   17.019  758.513   27.428  758.248   21.702  136.385   2.4671  136.375   1.9523 0.1084900E-01 3.146077 
1 1 1   12    4    2 f  161.911   1.4857  1068.66   19.608  1051.52   28.394  1084.29   27.111  160.591   2.1691  163.077   2.0395 -2.486649 2.977296 
1 1 1   12    4    3 o  426.682   2.6579  7424.57   92.444  7480.27  131.960  7370.89  129.544  428.150   3.7810  425.013   3.7392 3.136353 5.317682 
1 1 1   12    4    4 o   77.937   1.5931  247.622   10.121  256.229   15.338  240.984   13.470   79.234   2.3774   76.849   2.1524 2.385590 3.206975 
1 1 1   12    4    5 o  393.136   2.8624  6303.65   91.728  6248.52  129.000  6360.05  130.459  391.277   4.0445  394.753   4.0543 -3.475189 5.726728 
1 1 1   12    4    6 o  219.758   1.9165  1968.93   34.331  1931.11   48.227  2007.80   48.884  217.602   2.7189  221.882   2.7028 -4.279587 3.833699 
1 1 1   12    4    7 o  470.915   3.3393  9047.07  128.182  8942.98  179.755  9154.75  182.839  467.977   4.7122  473.480   4.7373 -5.503723 6.681798 
1 1 1   12    4    8 o  100.419   2.3973  411.197   19.623  411.197   19.623   0.0000   0.0000  100.419   2.3973  ?   ?  0.000000 2.397296 
1 1 1   12    4    9 o  119.789   1.7672  585.008   17.256  598.053   23.002  568.218   26.097  121.105   2.3301  118.036   2.7123 3.069427 3.575716 
1 1 1   12    4   10 o   73.216   2.0207  218.727   12.048  222.314   15.956  213.971   18.376   73.784   2.6573   72.357   3.1230 1.426750 4.100518 
1 1 1   12    4   11 o   96.775   1.8103  381.825   14.281  362.253   23.217  393.736   18.112   94.189   3.0279   98.265   2.2611 -4.076050 3.778991 
1 1 1   12    4   12 o  162.049   1.8420  1070.61   24.332  1143.09   40.234  1028.83   30.551  167.404   2.9485  158.839   2.3596 8.564911 3.776377 
1 1 1   12    4   13 o  146.930   2.0320  880.216   24.337  896.825   35.106  864.847   33.770  148.280   2.9045  145.615   2.8450 2.665314 4.065706 
1 1 1   12    4   14 o  161.982   2.0772  1069.83   27.427  1063.90   39.185  1075.53   38.401  161.498   2.9766  162.382   2.9011 -0.8834686 4.156528 
1 1 1   12    4   15 o   56.942   2.5489  132.496   11.801  152.319   17.562  116.177   15.935   60.994   3.5476   53.227   3.6956 7.766232 5.122758 
1 1 1   12    4   16 o  131.719   2.0055  707.407   21.533  724.875   31.203  691.525   29.753  133.308   2.8715  130.208   2.8032 3.100342 4.012900 
1 1 1   12    4   17 o  105.970   1.6459  457.811   14.218  457.564   20.852  458.025   19.437  105.925   2.4150  105.982   2.2498 -0.5737305E-01 3.300570 
1 1 1   12    4   18 o   74.883   1.7984  228.619   10.978  233.006   16.445  225.092   14.744   75.536   2.6751   74.253   2.4392 1.282982 3.620170 
1 1 1   12    4   19 o  196.805   1.9787  1579.25   31.744  1549.86   50.213  1598.82   40.970  194.906   3.1605  197.995   2.5385 -3.089569 4.053722 
1 1 1   12    4   20 o   89.853   2.0759  329.206   15.204  328.194   21.745  330.173   21.267   89.645   2.9799   89.919   2.9053 -0.2745972 4.161830 
1 1 1   12    4   21 o  114.748   1.7544  536.825   16.410  505.556   26.234  556.924   21.032  111.287   2.8944  116.865   2.2078 -5.577660 3.640332 
1 1 1   12    4   22 o  141.018   1.7855  810.779   20.524  815.013   33.062  808.124   26.179  141.348   2.8695  140.772   2.2814 0.5761108 3.665866 
1 1 1   12    4   23 o  234.228   2.1683  2237.19   41.400  2271.84   66.691  2215.47   52.808  235.942   3.4676  233.050   2.7798 2.891388 4.444232 
1 1 1   12    4   24 o  236.199   2.1789  2275.03   41.951  2277.10   66.689  2273.68   53.967  236.213   3.4635  236.089   2.8042 0.1242828 4.456388 
1 1 1   12    4   25 o  230.585   2.1488  2168.16   40.390  2146.48   63.884  2182.60   52.131  229.340   3.4173  231.313   2.7648 -1.972931 4.395627 
1 1 1   12    4   26 o  176.705   1.8930  1273.14   27.267  1244.47   43.014  1292.40   35.256  174.649   3.0214  178.013   2.4296 -3.364136 3.877089 
1 1 1   12    4   27 o  153.717   1.8187  963.419   22.788  936.952   36.144  980.881   29.359  151.546   2.9259  155.086   2.3223 -3.539871 3.735498 
1 1 1   12    4   28 o  189.009   1.9454  1456.66   29.972  1454.00   47.789  1458.39   38.481  188.773   3.1057  189.094   2.4965 -0.3216705 3.984703 
1 1 1   12    4   29 o   80.419   1.9051  263.699   12.488  235.519   19.972  281.791   16.003   75.902   3.2354   83.089   2.3652 -7.187172 4.007738 
1 1 1   12    4   30 o  228.813   2.3910  2135.33   44.595  2199.04   92.129  2115.83   50.964  231.954   4.8726  227.742   2.7453 4.211990 5.592699 
1 1 1   12    4   31 o  105.351   2.2846  452.643   19.619  444.391   35.329  456.322   23.591  104.226   4.1667  105.728   2.7396 -1.501480 4.986681 
1 1 1   12    4   32 o  103.406   2.3003  436.093   19.390  421.987   35.417  442.130   23.170  101.548   4.2883  104.069   2.7337 -2.521698 5.085511 
1 1 1   12    4   33 o  222.227   2.7192  2014.67   49.257  1969.94   85.664  2036.76   60.205  219.531   4.7870  223.392   3.3062 -3.860748 5.817774 
1 1 1   12    4   34 o  201.915   2.2396  1662.73   36.861  1659.31   52.654  1666.03   51.621  201.639   3.2034  202.053   3.1342 -0.4137268 4.481668 
1 1 1   12    4   35 o  187.197   1.9364  1428.94   29.548  1462.21   47.745  1408.28   37.618  189.292   3.0943  185.809   2.4837 3.482697 3.967757 
1 1 1   12    4   36 o   47.355   2.4522   91.715   9.4334   85.035   15.552   95.603   11.865   45.426   4.2494   48.308   3.0284 -2.882511 5.218110 
1 1 1   12    4   37 o   11.709   4.9498   0.3295   8.1288 -14.7630   13.732   8.4717   10.086   11.844   5.5672   16.085   5.8901 -4.241446 8.104751 
1 1 1   12    4   38 o   44.976   2.5638   82.785   9.3604   87.536   15.527   80.073   11.732   46.102   4.1770   44.170   3.2819 1.931152 5.312049 
1 1 1   12    4   39 o  135.175   1.7809  745.058   19.623  746.820   31.695  743.962   24.988  135.287   2.8741  135.057   2.2698 0.2299347 3.662251 
1 1 1   12    4   40 o  226.462   2.1306  2091.61   39.331  2116.90   63.183  2075.60   50.255  227.713   3.4039  225.547   2.7334 2.166031 4.365581 
1 1 1   12    4   41 o  235.854   2.1809  2268.77   41.929  2327.98   67.976  2232.41   53.270  238.783   3.4923  233.904   2.7939 4.878281 4.472373 
1 1 1   12    4   42 o  143.751   1.8121  842.636   21.233  835.682   34.143  847.022   27.115  143.101   2.9270  144.103   2.3083 -1.002136 3.727708 
1 1 1   12    4   43 o  184.240   1.9404  1384.26   29.141  1383.72   46.680  1384.61   37.303  184.122   3.1102  184.229   2.4840 -0.1074219 3.980389 
1 1 1   12    4   44 o  138.951   1.8061  787.316   20.457  767.016   32.614  800.484   26.268  137.093   2.9184  140.087   2.3003 -2.993805 3.715994 
1 1 1   12    4   45 o   97.763   1.8218  389.749   14.518  399.781   23.828  383.827   18.309   98.927   2.9582   97.002   2.3155 1.925148 3.756627 
1 1 1   12    4   46 o   89.973   1.8795  330.124   13.784  327.349   23.018  331.675   17.211   89.492   3.1604   90.139   2.3444 -0.6476135 3.935007 
1 1 1   12    4   47 o  185.359   1.9558  1401.23   29.551  1376.61   46.967  1417.37   38.019  183.632   3.1377  186.386   2.5024 -2.754257 4.013353 
1 1 1   12    4   48 o   50.116   2.5158  102.735   10.245  109.644   17.422   99.083   12.666   51.623   4.1757   49.161   3.1777 2.461739 5.247355 
1 1 1   12    4   49 o   62.508   2.2470  159.598   11.430  155.660   19.183  161.765   14.233   61.601   3.8394   62.896   2.7830 -1.294601 4.741963 
1 1 1   12    4   50 f  144.760   1.8608  854.629   21.957  851.163   35.288  856.819   28.048  144.393   2.9981  144.917   2.3744 -0.5232239 3.824414 
1 1 1   12    4   51 o  111.996   2.0906  511.649   19.086  504.320   39.002  513.957   21.885  110.958   4.3204  112.234   2.3921 -1.276154 4.938396 
1 1 1   12    4   52 o  133.791   2.3814  730.353   25.972  753.039   46.971  720.363   31.170  135.626   4.2539  132.840   2.8785 2.786423 5.136308 
1 1 1   12    4   53 o  140.052   2.3899  800.318   27.283  752.335   47.725  823.612   33.253  135.552   4.3248  142.041   2.8720 -6.489349 5.191508 
1 1 1   12    4   54 f  177.419   2.5007  1284.53   36.166  1261.14   64.327  1295.35   43.732  175.494   4.5004  178.114   3.0121 -2.619675 5.415379 
1 1 1   12    4   55 o  245.429   2.9584  2459.53   59.185  2457.78   72.449  2463.02  102.619  245.230   3.6243  245.154   5.1351 0.7672119E-01 6.285310 
1 1 1   12    4   56 o  154.319   1.8817  971.362   23.671  1014.84   38.955  945.912   29.804  157.637   3.0316  152.246   2.4015 5.390244 3.867554 
1 1 1   12    4   57 o  115.580   1.7341  544.846   16.338  557.810   25.229  535.485   21.440  116.893   2.6478  114.553   2.2961 2.340042 3.504662 
1 1 1   12    4   58 f   66.411   2.0406  180.111   11.034  191.256   17.972  173.369   13.979   68.339   3.2353   65.112   2.6392 3.227272 4.175226 
1 1 1   12    4   59 o   58.859   2.1911  141.568   10.494  145.981   17.175  138.938   13.257   59.646   3.5484   58.260   2.7996 1.385952 4.519882 
1 1 1   12    4   60 o   55.093   2.8024  124.288   12.544  115.272   17.107  134.774   18.448   52.919   3.9952   57.246   3.9782 -4.326839 5.638063 
1 1 1   12    4   61 o   82.150   2.2294  275.639   14.915  288.997   20.138  259.408   22.199   84.053   2.9438   79.574   3.4304 4.478371 4.520307 
1 1 1   12    4   62 o  157.014   1.9963  1005.98   25.551  1024.11   33.769  981.715   39.080  158.355   2.6160  154.981   3.0934 3.374252 4.051278 
1 1 1   12    4   63 o   69.643   2.4102  198.269   13.662  209.039   18.606  185.670   20.124   71.431   3.2036   67.253   3.6848 4.177933 4.882742 
1 1 1   12    4   64 o   64.466   2.0556  169.790   10.788  185.902   17.929  160.646   13.507   67.339   3.2761   62.654   2.6506 4.685490 4.214130 
1 1 1   12    4   65 o   81.797   2.0300  273.089   13.535  308.887   26.449  260.388   15.755   86.764   3.7485   79.811   2.4244 6.952644 4.464216 
1 1 1   12    4   66 o   38.967   2.8972   62.417   9.1368   77.789   15.975   54.945   11.138   43.283   4.5982   36.425   3.8075 6.857979 5.969962 
1 1 1   12    4   67 o   32.545   3.2791   43.780   8.5806   47.677   14.959   41.868   10.475   33.554   5.6712   31.682   4.1563 1.871658 7.031162 
1 1 1   12    4   68 o   58.344   2.1523  139.181   10.219  148.179   16.887  133.983   12.836   60.054   3.4643   57.182   2.7619 2.871868 4.430489 
1 1 1   12    4   69 o   54.514   2.4365  121.667   10.800  107.410   16.165  133.162   14.515   51.024   3.9165   56.956   3.1385 -5.932156 5.018819 
1 1 1   12    4   70 o  163.012   1.7507  1084.52   23.263  1102.93   29.551  1054.52   37.724  164.323   2.2062  160.553   2.8825 3.770096 3.629864 
1 1 1   12    4   71 o   60.266   2.4913  148.716   12.212  136.691   16.644  162.740   17.974   57.631   3.5604   62.908   3.5192 -5.277355 5.006118 
1 1 1   12    4   72 o   29.522   3.6118   36.278   8.5108   44.133   14.744   32.353   10.423   32.157   5.8399   27.630   4.8019 4.527119 7.560602 
1 1 1   12    4   73 o   82.818   2.0072  280.153   13.551  283.892   19.651  276.764   18.710   83.220   2.9012   82.184   2.7970 1.036087 4.029915 
1 1 1   12    4   74 o   71.844   1.9821  211.008   11.597  181.185   18.754  229.470   14.756   66.352   3.4796   74.868   2.4211 -8.516075 4.239049 
1 1 1   12    4   75 o  111.909   1.5720  511.216   14.340  549.917   26.026  494.342   17.185  115.882   2.7552  110.005   1.9164 5.876900 3.356146 
1 1 1   12    4   76 o  109.149   1.4440  486.247   12.848  512.094   20.624  469.854   16.425  111.898   2.2611  107.241   1.8789 4.657188 2.939813 
1 1 1   12    4   77 o   82.572   1.6650  278.446   11.207  298.664   16.584  261.457   15.202   85.394   2.3849   79.902   2.3366 5.492455 3.338758 
1 1 1   12    4   78 o   25.090   3.6215   26.435   7.1928   9.0114   12.201   35.715   8.9047   16.983   6.4271   29.196   3.8343 -12.21257 7.483911 
1 1 1   12    4   79 o   48.454   1.7480   96.060   6.8927  123.111   12.413   84.002   8.2878   54.711   2.7927   45.247   2.2542 9.464607 3.588908 
1 1 1   12    4   80 o   43.866   1.8211   78.797   6.4976   85.138   11.914   76.112   7.7521   45.374   3.2424   43.061   2.2160 2.313248 3.927298 
1 1 1   12    4   81 o   14.871   4.0412   9.4604   5.0257   10.506   10.298   9.1335   5.7580   16.819   5.9787   14.748   4.4326 2.071176 7.442646 
1 1 1   12    4   82 o   63.241   1.4418  163.373   7.4326  173.652   13.277  158.682   8.9698   65.006   2.5104   62.267   1.7690 2.739086 3.071061 
1 1 1   12    4   83 o   54.176   1.5066  120.036   6.6468  110.602   12.285  123.941   7.9035   51.753   2.9240   55.016   1.7646 -3.262722 3.415231 
1 1 1   12    4   84 o   65.120   1.5717  173.377   8.3428  184.347   13.372  166.386   10.675   66.953   2.4542   63.689   2.0590 3.264431 3.203559 
1 1 1   12    4   85 o   72.097   1.8576  212.997   10.908  205.487   14.129  224.076   17.162   70.672   2.4564   73.681   2.8628 -3.008911 3.772219 
1 1 1   12    4   86 o   20.860   4.9904   19.088   8.3715   11.660   11.350   27.950   12.397   17.498   6.2705   25.027   6.1268 -7.529602 8.766804 
1 1 1   12    4   87 o   47.749   2.4880   94.095   9.6508   84.185   13.064  106.001   14.319   44.848   3.6038   50.388   3.5080 -5.540531 5.029263 
1 1 1   12    4   88 o   19.839   4.8897   17.335   7.8559   17.848   10.214   16.591   12.292   20.095   5.8698   19.730   6.5490 0.3650646 8.794499 
1 1 1   12    4   89 o   57.896   2.0524  137.843   9.6709  139.033   12.552  136.105   15.170   57.971   2.6634   57.141   3.2706 0.8299065 4.217886 
1 1 1   12    4   90 o   36.401   3.0181   55.318   8.8750   49.523   10.788   67.452   15.610   34.137   3.9497   39.483   4.9594 -5.346176 6.340025 
1 1 1   12    4   91 o   25.473   4.4614   28.239   8.9262   22.535   11.501   36.881   14.156   22.280   6.1373   28.464   6.2705 -6.184261 8.774196 
1 1 1   12    4   92 o   23.863   4.1343   24.694   7.7506   30.781   10.173   16.271   11.966   26.425   4.9035   19.350   6.4625 7.074486 8.112235 
1 1 1   12    4   93 o   25.601   3.7505   28.109   7.5948   40.537   10.059   11.631   11.583   30.693   4.1249   17.268   6.3139 13.42475 7.541868 
1 1 1   12    4   94 o   57.451   2.1425  136.230   10.016  140.239   13.866  131.855   14.484   57.972   2.9439   56.099   3.1804 1.873058 4.333767 
1 1 1   12    4   95 o   22.560   4.1883   22.282   7.4187   19.342   9.6635   26.502   11.577   20.607   5.6054   23.989   5.9497 -3.381840 8.174316 
1 1 1   12    4   96 o   37.548   2.6550   58.817   8.0737   61.363   10.718   55.479   12.275   38.041   3.4956   35.807   4.2909 2.233723 5.534490 
1 1 1   12    4   97 o   8.7007   4.0613  -6.0725   7.0965  -8.9764   9.2585  -1.9365   11.049   9.6438   4.5448   12.399   5.4980 -2.755278 7.133273 
1 1 1   12    4   98 o   40.474   2.5516   68.315   8.3756   54.462   10.747   89.741   13.366   35.642   3.7556   45.921   3.5994 -10.27943 5.201912 
1 1 1   12    4   99 o   16.694   5.0193   12.496   7.3820   18.408   9.7753   4.6491   11.261   19.937   5.7183   14.356   5.9284 5.581347 8.236745 
1 1 1   12    4  100 o   23.521   4.6350   24.869   8.5706   18.571   10.101   41.060   16.196   19.928   5.8416   28.976   6.9471 -9.048002 9.076682 
1 1 1   12    4  101 o   58.525   2.1945  142.235   10.450  149.721   12.542  125.236   18.900   59.839   2.5773   53.459   4.3754 6.379372 5.078100 
1 1 1   12    4  102 o   33.232   3.2573   47.261   8.7106   53.187   12.174   41.045   12.468   34.618   4.4145   29.812   5.3262 4.806391 6.917788 
1 1 1   12    4  103 o   21.122   4.8104   20.608   8.0965   23.441   11.083   17.365   11.857   21.959   6.0152   19.059   6.4337 2.899952 8.807689 
1 1 1   12    4  104 o   10.074   4.5282  -2.2424   7.7680  -7.7817   10.386   4.7906   11.703   10.403   4.8744   14.233   5.9733 -3.829994 7.709739 
1 1 1   12    4  105 o   31.669   3.6938   44.003   9.3567   34.979   13.784   51.714   12.742   26.338   6.4681   33.602   4.7873 -7.264561 8.047042 
1 1 1   12    4  106 o   14.902   5.5189   9.4218   8.8963   3.6302   12.962   14.580   12.232   14.221   6.1363   17.611   6.4803 -3.390226 8.924588 
1 1 1   12    4  107 f   12.633   4.9982   5.4057   7.6281   15.986   9.9055 -10.0121   11.957   18.007   5.8742   10.730   5.0888 7.277016 7.771873 
1 1 1   12    4  108 o   18.122   5.3689   16.142   8.4945   22.349   11.415   8.4372   12.717   20.752   6.2419   15.304   6.3080 5.447745 8.874205 
1 1 1   12    4  109 o   11.196   4.9084   0.5085   8.5739  -3.3952   10.151   10.225   16.015   10.999   5.0347   16.468   6.9539 -5.469296 8.585147 
1 1 1   12    4  110 o   15.755   5.3416   11.903   8.1735   9.6456   10.464   15.435   13.090   15.063   5.8858   17.569   6.6553 -2.505729 8.884593 
1 1 1   12    4  111 o   16.927   5.2966   14.134   8.1179   20.840   10.506   4.2004   12.788   20.022   5.9806   13.956   6.0584 6.066059 8.513028 
1 1 1   12    4  112 o   27.978   5.0380   37.866   11.067   26.173   14.380   54.853   17.333   21.430   7.0824   31.728   6.8987 -10.29853 9.887015 
1 1 1   12    4  113 o   15.664   6.2212   11.012   11.861   12.682   16.431   9.1952   17.139   16.851   7.0754   16.124   7.0064 0.7268314 9.957478 
1 1 1   12    4  114 o   35.341   4.5844   58.863   12.896   58.496   17.870   59.261   18.629   32.557   6.9456   32.384   7.2392 0.1729202 10.03231 
1 1 1   12    4  115 o   23.671   6.3775   30.522   12.580   43.296   17.546   17.009   18.047   26.755   7.6571   17.982   7.4725 8.772987 10.69901 
1 1 1   12    4  116 o   9.1154   4.5448 -27.5094   13.588 -51.7537   24.018 -16.0977   16.478   11.212   5.6521   11.559   5.6070 -0.3467283 7.961427 
1 1 1   12    4  117 o   35.652   4.6698   60.701   13.245   53.497   18.404   68.441   19.077   29.967   7.5413   35.048   6.9231 -5.080828 10.23722 
1 1 1   12    4  118 o   21.908   7.1309   28.780   14.601   23.177   18.114   39.174   24.672   19.370   7.6898   22.617   8.9759 -3.246965 11.81951 
1 1 1   12    4  119 o   18.759   7.0036   20.589   14.382   22.724   18.139   16.973   23.602   19.145   7.6636   17.944   7.9914 1.200634 11.07220 
1 1 1   12    4  120 o   35.515   5.2801   63.108   14.821   72.360   18.369   45.848   25.090   36.574   6.3941   23.957   9.1803 12.61731 11.18762 
1 1 1   12    4  121 f   12.757   5.8320  -0.6408   13.562   2.9104   16.914  -7.0357   22.698   14.430   6.5643   14.353   6.8641 0.7620525E-01 9.497681 
1 1 1   12    5 -119 o   12.786   5.5214   3.9683   10.510   2.0690   13.261   7.1771   17.237   13.217   5.9306   15.304   6.8215 -2.086660 9.039061 
1 1 1   12    5 -118 o   19.128   6.0429   20.072   10.542   14.197   13.293   30.031   17.306   16.537   6.5804   21.419   7.7343 -4.881859 10.15482 
1 1 1   12    5 -117 o   12.129   5.5278  -0.8966   12.065 -14.6115   17.117   12.647   17.010   11.844   5.7381   16.460   7.0649 -4.615357 9.101626 
1 1 1   12    5 -116 o   8.7627   4.3438 -21.4918   11.716 -22.4570   16.670 -20.5494   16.471   10.855   5.3437   10.976   5.3847 -0.1206760 7.586170 
1 1 1   12    5 -115 o   13.221   6.2202  -5.2321   17.214  -5.2321   17.214   0.0000   0.0000   13.221   6.2202  ?   ?  0.000000 6.220213 
1 1 1   12    5 -114 f   11.714   5.2368   0.1991   10.237  -3.4305   12.877   6.4339   16.876   12.024   5.5640   15.246   6.7755 -3.221215 8.767309 
1 1 1   12    5 -113 o   13.876   5.7093   7.0791   10.393   3.5562   13.033   13.233   17.225   13.654   6.0165   16.913   7.1799 -3.259037 9.367455 
1 1 1   12    5 -112 o   10.309   4.8279  -5.9610   10.166  -5.3738   12.779  -6.9730   16.776   11.681   5.4515   12.942   6.1047 -1.260979 8.184570 
1 1 1   12    5 -111 o   16.323   5.9398   13.269   10.233   15.548   12.938   9.4618   16.724   17.337   6.6049   16.055   6.9490 1.281742 9.587146 
1 1 1   12    5 -110 o   15.976   6.0146   12.232   10.654   14.392   13.494   8.6577   17.358   17.043   6.6768   16.073   7.0168 0.9699707 9.685769 
1 1 1   12    5 -109 o   29.653   4.4002   40.894   10.314   44.165   12.578   34.181   18.021   30.008   5.3375   23.589   7.9315 6.419634 9.560265 
1 1 1   12    5 -108 o   22.274   5.4522   24.802   9.8179   26.677   11.896   20.796   17.387   22.459   6.2631   19.398   7.5848 3.061356 9.836455 
1 1 1   12    5 -107 f   39.838   3.3268   69.513   10.705   77.324   13.083   53.691   18.620   41.490   3.9147   30.886   7.4768 10.60420 8.439678 
1 1 1   12    5 -106 o   20.334   5.7925   20.985   10.064   22.108   10.980   15.087   25.165   20.674   6.0988   18.881   8.3382 1.793291 10.33055 
1 1 1   12    5 -105 f   27.029   4.3330   33.496   9.2245   30.441   10.812   41.668   17.684   24.947   5.4680   27.124   7.6622 -2.176470 9.413194 
1 1 1   12    5 -104 o   18.352   5.5011   16.415   8.8773   13.421   10.453   24.163   16.816   16.879   6.0209   21.093   7.6229 -4.214285 9.713910 
1 1 1   12    5 -103 o   35.663   3.7073   55.840   10.620   52.197   13.413   61.963   17.387   33.474   5.0746   35.449   6.2453 -1.974892 8.047047 
1 1 1   12    5 -102 o   41.264   3.3263   73.395   11.094   80.816   14.149   61.556   17.872   42.713   4.1148   35.288   6.4506 7.424324 7.651264 
1 1 1   12    5 -101 o   13.026   5.2987   4.6784   8.8260   4.4602   10.489   5.2076   16.333   13.664   5.6890   15.965   6.8884 -2.300532 8.933964 
1 1 1   12    5 -100 o   13.744   4.9772   7.6070   7.1736   11.187   12.922   6.0125   8.6245   16.831   6.5511   13.532   5.3267 3.299410 8.443391 
1 1 1   12    5  -99 o   46.318   2.3276   89.457   8.7600  100.921   15.144   83.692   10.739   48.263   3.8821   44.478   2.9792 3.784847 4.893440 
1 1 1   12    5  -98 o   31.719   3.2584   42.949   8.3052   45.983   13.523   41.111   10.524   31.647   5.4382   30.502   4.3561 1.144972 6.967736 
1 1 1   12    5  -97 o   9.0762   4.1615  -4.1194   6.9740  -5.5022   12.562  -3.5033   8.3849   12.282   5.6140   10.269   4.6517 2.013347 7.290740 
1 1 1   12    5  -96 o   20.960   4.4570   19.630   7.3804   11.323   12.979   23.599   8.9721   17.256   6.6053   22.826   4.9638 -5.569956 8.262511 
1 1 1   12    5  -95 o   23.207   3.8507   23.434   7.0292   24.007   12.914   23.192   8.3794   22.514   6.6066   22.775   4.6704 -0.2613926 8.090720 
1 1 1   12    5  -94 o   30.836   2.8177   39.918   7.0043   33.470   11.218   44.037   8.9669   27.261   5.2386   32.166   3.4750 -4.904997 6.286409 
1 1 1   12    5  -93 o   28.852   2.9429   35.045   6.8246   40.378   10.948   31.656   8.7278   30.363   4.5645   27.010   4.0922 3.353271 6.130292 
1 1 1   12    5  -92 o   20.314   4.1281   18.123   6.6023   22.895   10.549   15.050   8.4652   22.351   5.7556   18.315   5.3419 4.035295 7.852566 
1 1 1   12    5  -91 o   16.836   4.6172   12.556   6.5254   31.990   10.388  -0.1123   8.3867   26.870   4.9239   11.395   4.9265 15.47514 6.965321 
1 1 1   12    5  -90 o   48.722   1.9847   97.800   7.8660   99.315   12.057   96.677   10.379   48.748   3.0494   48.240   2.6497 0.5074501 4.039778 
1 1 1   12    5  -89 o   20.032   4.2320   17.585   6.6935   13.005   10.295   20.938   8.8094   17.593   5.9946   21.655   5.0790 -4.061108 7.856956 
1 1 1   12    5  -88 o   19.473   4.4109   16.672   6.8386   13.095   10.568   19.248   8.9696   17.732   6.0728   20.748   5.2885 -3.016476 8.052757 
1 1 1   12    5  -87 o   15.294   4.9439   9.8135   7.0253 -10.6583   10.321   27.489   9.5900   10.128   4.7808   25.014   4.8785 -14.88605 6.830536 
1 1 1   12    5  -86 o   97.783   1.6017  391.549   12.767  386.155   17.708  397.387   18.423   96.888   2.2421   98.263   2.3000 -1.375305 3.212009 
1 1 1   12    5  -85 o   43.962   2.4416   79.823   8.7152   76.070   13.843   82.287   11.217   42.424   4.0522   44.456   3.1151 -2.031353 5.111221 
1 1 1   12    5  -84 o   11.712   4.7310   2.8069   6.9801   0.4555   10.651   4.5770   9.2411   13.086   5.6033   13.728   5.4785 -0.6414728 7.836531 
1 1 1   12    5  -83 o   9.7218   4.3485  -2.7390   7.0685   4.7772   11.475  -7.3351   8.9731   14.930   6.0533   9.9411   4.6154 4.989005 7.612123 
1 1 1   12    5  -82 o   25.881   3.6783   28.334   7.5417   30.494   11.973   26.912   9.7100   26.289   5.7479   24.870   4.9637 1.418892 7.594562 
1 1 1   12    5  -81 o   20.135   4.7016   17.647   7.5761   19.191   12.349   16.716   9.5936   21.066   6.5234   19.611   5.6773 1.455299 8.647901 
1 1 1   12    5  -80 o   60.611   1.8894  150.515   9.3235  152.165   13.463  148.995   12.924   60.773   2.7246   60.154   2.6422 0.6182556 3.795362 
1 1 1   12    5  -79 o   13.211   5.0092   5.3525   7.4200   25.411   12.320  -6.0647   9.2948   24.017   6.2379   10.519   4.8160 13.49829 7.880655 
1 1 1   12    5  -78 o   21.545   4.8098   20.095   8.2328   5.0917   14.624   27.056   9.9614   16.620   6.7978   25.018   5.0587 -8.398176 8.473547 
1 1 1   12    5  -77 o   70.038   1.9305  200.779   11.011  195.157   16.985  204.853   14.461   68.834   3.0346   70.641   2.5153 -1.806984 3.941473 
1 1 1   12    5  -76 o   84.079   1.7083  288.857   11.708  299.019   16.508  278.570   16.609   85.412   2.3733   82.417   2.4751 2.995094 3.429053 
1 1 1   12    5  -75 o   55.454   2.4062  126.150   10.851  133.368   13.547  113.234   18.123   56.934   2.9289   52.154   4.3011 4.779961 5.203665 
1 1 1   12    5  -74 o   49.235   2.6952   99.628   10.775   91.657   13.444  113.950   18.019   47.074   3.5292   52.354   4.2591 -5.280346 5.531303 
1 1 1   12    5  -73 o   40.781   3.4904   68.847   11.491   75.893   15.371   59.920   17.302   42.625   4.4913   37.481   5.8545 5.144608 7.378825 
1 1 1   12    5  -72 o   57.935   3.1455  138.086   14.799  143.896   17.387  122.804   28.195   59.056   3.6293   53.774   6.5686 5.282314 7.504544 
1 1 1   12    5  -71 o   39.241   3.9711   63.988   12.528   44.680   16.428   90.819   19.366   32.158   6.4910   46.551   5.1918 -14.39323 8.311881 
1 1 1   12    5  -70 o   15.316   5.9413   6.3013   10.601   0.6571   14.118   13.597   16.051   15.293   6.4964   20.072   7.4168 -4.779210 9.859612 
1 1 1   12    5  -69 o   41.967   2.6231   72.323   8.9287   84.440   13.056   61.675   12.238   45.227   3.5703   38.545   3.9509 6.681965 5.325089 
1 1 1   12    5  -68 o   55.004   2.1825  123.795   9.7663  140.262   14.180  108.933   13.471   58.458   2.9855   51.465   3.2273 6.993042 4.396464 
1 1 1   12    5  -67 o  108.930   1.6141  484.206   14.333  499.610   19.864  467.477   20.701  110.590   2.2035  106.955   2.3744 3.635147 3.239279 
1 1 1   12    5  -66 o   85.465   1.8370  298.150   12.798  319.675   16.908  269.273   19.584   88.423   2.3478   81.069   2.9685 7.354088 3.784731 
1 1 1   12    5  -65 o   17.562   5.0500   12.993   7.6148   15.621   9.5216   8.3291   12.684   19.286   5.6766   17.053   6.5293 2.232708 8.651889 
1 1 1   12    5  -64 o   53.619   2.0528  117.547   8.9556  123.752   11.027  105.527   15.349   54.981   2.4668   50.606   3.7474 4.375328 4.486426 
1 1 1   12    5  -63 o  132.039   1.7225  711.381   18.539  702.252   23.478  726.501   30.215  131.142   2.1963  133.313   2.7805 -2.170883 3.543242 
1 1 1   12    5  -62 o  101.603   1.6484  421.169   13.652  429.021   18.911  412.623   19.729  102.500   2.2633  100.510   2.4080 1.990433 3.304688 
1 1 1   12    5  -61 o   81.739   1.4398  272.510   9.5933  278.836   13.715  266.451   13.423   82.652   2.0357   80.770   2.0405 1.882431 2.882285 
1 1 1   12    5  -60 o  170.782   1.4203  1189.55   19.773  1174.96   26.998  1206.43   29.039  169.680   1.9519  171.924   2.0721 -2.243698 2.846679 
1 1 1   12    5  -59 o   93.535   1.3727  356.792   10.466  353.844   14.650  359.866   14.957   93.121   1.9300   93.908   1.9539 -0.7875824 2.746382 
1 1 1   12    5  -58 o   47.592   1.9871   92.586   7.6919   88.701   11.683   95.557   10.219   46.481   3.1013   48.301   2.6051 -1.820137 4.050280 
1 1 1   12    5  -57 o  158.145   1.5557  1020.04   20.055  1039.09   31.306  1006.78   26.117  159.537   2.4073  157.074   2.0397 2.462952 3.155284 
1 1 1   12    5  -56 o  131.066   1.5147  700.591   16.183  683.410   22.166  720.205   23.683  129.411   2.1012  132.843   2.1870 -3.431290 3.032871 
1 1 1   12    5  -55 o   34.363   2.7009   48.516   7.5048   36.950   10.845   59.142   10.396   29.677   4.6346   37.883   3.4026 -8.206314 5.749555 
1 1 1   12    5  -54 o  112.789   1.6550  518.852   15.216  515.522   19.240  524.412   24.861  112.403   2.0999  113.327   2.6912 -0.9244156 3.413509 
1 1 1   12    5  -53 o   37.990   2.8503   59.267   8.7624   50.867   10.820   75.273   14.935   35.057   3.8497   42.659   4.3561 -7.602200 5.813450 
1 1 1   12    5  -52 o  123.171   1.6813  618.735   16.880  601.654   20.700  652.641   29.165  121.437   2.0911  126.425   2.8300 -4.988113 3.518764 
1 1 1   12    5  -51 o   55.787   2.1444  127.158   9.7334  120.162   12.768  136.864   15.040   54.170   2.9021   57.795   3.2049 -3.624725 4.323575 
1 1 1   12    5  -50 o   14.684   5.2879   7.3875   8.0832   11.045   10.383   1.7595   12.879   17.321   6.0154   15.062   6.2899 2.259361 8.703347 
1 1 1   12    5  -49 o   85.137   1.6003  295.573   11.106  284.160   16.154  305.804   15.294   83.417   2.3781   86.552   2.1695 -3.134743 3.218969 
1 1 1   12    5  -48 o  133.413   1.6008  725.806   17.409  672.713   26.732  764.905   22.940  128.392   2.5542  136.938   2.0551 -8.545975 3.278327 
1 1 1   12    5  -47 o   76.296   2.1365  237.645   13.274  348.891   23.161  183.233   16.198   92.386   3.0799   66.927   2.9766 25.45869 4.283201 
1 1 1   12    5  -46 o  191.857   1.7108  1501.09   26.755  1482.09   41.362  1514.77   35.083  190.562   2.6627  192.691   2.2336 -2.128448 3.475496 
1 1 1   12    5  -45 o   88.963   1.8568  322.782   13.465  315.899   27.943  324.864   15.368   87.826   3.9129   89.241   2.1125 -1.415108 4.446761 
1 1 1   12    5  -44 o  137.558   1.5649  771.562   17.547  751.682   27.335  785.497   22.885  135.729   2.4707  138.774   2.0230 -3.044632 3.193257 
1 1 1   12    5  -43 o   88.640   1.6281  320.383   11.764  321.169   19.179  319.908   14.895   88.675   2.6563   88.562   2.0633 0.1129227 3.363507 
1 1 1   12    5  -42 o  201.824   1.7192  1661.00   28.283  1705.37   44.845  1631.69   36.445  204.426   2.6911  200.000   2.2355 4.426208 3.498519 
1 1 1   12    5  -41 o  218.936   1.7778  1954.66   31.727  1899.45   48.647  1995.52   41.853  215.741   2.7662  221.172   2.3215 -5.430695 3.611270 
1 1 1   12    5  -40 o   66.966   1.7440  182.986   9.5118  172.724   15.708  188.927   11.952   64.984   2.9733   68.024   2.1582 -3.039505 3.673995 
1 1 1   12    5  -39 o  206.635   1.7242  1741.08   29.042  1654.07   44.051  1807.98   38.626  201.337   2.6841  210.532   2.2507 -9.194595 3.502853 
1 1 1   12    5  -38 o  254.681   1.9328  2645.16   40.126  2666.13   62.569  2630.51   52.297  255.582   3.0032  253.922   2.5266 1.660782 3.924686 
1 1 1   12    5  -37 o  141.335   1.5211  814.437   17.525  855.786   28.505  789.312   22.220  144.839   2.4144  139.121   1.9594 5.717636 3.109394 
1 1 1   12    5  -36 o  225.742   1.8030  2078.00   33.177  2025.08   50.879  2117.14   43.760  222.772   2.8018  227.819   2.3564 -5.047089 3.660985 
1 1 1   12    5  -35 o  221.829   1.9383  2006.71   35.048  2131.75   65.633  1956.83   41.453  228.489   3.5239  219.028   2.3218 9.460419 4.220000 
1 1 1   12    5  -34 o  238.693   2.0180  2323.52   39.264  2396.26   71.970  2292.69   46.850  242.238   3.6448  237.074   2.4243 5.164276 4.377437 
1 1 1   12    5  -33 o  217.402   1.9171  1927.36   33.974  1918.97   61.137  1931.12   40.864  216.798   3.4595  217.588   2.3039 -0.7897491 4.156456 
1 1 1   12    5  -32 o  183.599   1.6388  1374.40   24.527  1338.14   37.958  1400.38   32.137  181.111   2.5711  185.303   2.1276 -4.191238 3.337260 
1 1 1   12    5  -31 o  225.798   1.8045  2078.94   33.214  2123.73   52.319  2048.71   42.987  228.143   2.8133  224.115   2.3531 4.028961 3.667635 
1 1 1   12    5  -30 o  411.625   2.7596  6912.92   92.593  6679.90  138.343  7102.00  124.621  404.352   4.1972  417.050   3.6658 -12.69879 5.572669 
1 1 1   12    5  -29 o   18.570   4.6577   14.649   7.0374   11.551   12.273   16.166   8.5898   18.230   6.5218   19.553   5.2706 -1.323235 8.385297 
1 1 1   12    5  -28 o  141.272   1.5239  813.674   17.549  846.464   28.298  793.182   22.371  144.056   2.4098  139.467   1.9678 4.589569 3.111179 
1 1 1   12    5  -27 f  241.845   2.0233  2385.14   39.886  2282.52   55.863  2491.86   56.968  236.518   2.8975  247.132   2.8279 -10.61447 4.048815 
1 1 1   12    5  -26 o  236.566   1.9945  2282.11   38.461  2279.40   55.360  2284.64   53.474  236.359   2.8733  236.640   2.7722 -0.2806244 3.992616 
1 1 1   12    5  -25 o  135.741   1.6351  751.234   18.092  717.026   26.329  781.838   24.903  132.586   2.4361  138.458   2.2064 -5.872192 3.286774 
1 1 1   12    5  -24 o  159.487   1.6726  1037.07   21.744  1024.75   37.644  1043.25   26.638  158.479   2.9140  159.947   2.0431 -1.467834 3.558869 
1 1 1   12    5  -23 o  208.101   1.8490  1765.80   31.366  1729.87   54.091  1784.00   38.499  205.883   3.2231  209.149   2.2582 -3.265747 3.935426 
1 1 1   12    5  -22 o  272.159   2.1635  3020.66   47.997  2997.51   83.064  3032.27   58.808  270.955   3.7608  272.642   2.6461 -1.687073 4.598430 
1 1 1   12    5  -21 o  126.481   1.5914  652.215   16.408  685.257   29.615  637.580   19.709  129.603   2.8032  125.045   1.9336 4.558350 3.405432 
1 1 1   12    5  -20 o   69.233   1.7681  195.559   9.9703  194.846   18.000  195.874   11.975   69.025   3.2079   69.273   2.1232 -0.2479095 3.846920 
1 1 1   12    5  -19 o  104.730   1.6008  447.182   13.666  456.947   24.626  442.836   16.428  105.794   2.8583  104.213   1.9339 1.580856 3.451025 
1 1 1   12    5  -18 o  187.146   1.5451  1427.88   23.570  1392.77   33.460  1462.46   33.208  184.804   2.2211  189.374   2.1513 -4.570450 3.092135 
1 1 1   12    5  -17 o  172.420   1.4944  1211.97   21.003  1210.13   30.194  1213.71   29.235  172.264   2.1503  172.522   2.0788 -0.2578735 2.990828 
1 1 1   12    5  -16 o  230.412   1.8355  2164.65   34.474  2090.16   44.972  2270.79   53.684  226.380   2.4371  235.933   2.7914 -9.553864 3.705556 
1 1 1   12    5  -15 o  103.823   1.6530  439.469   13.990  437.301   20.019  441.539   19.558  103.549   2.3717  104.052   2.3060 -0.5024643 3.307925 
1 1 1   12    5  -14 o   27.056   3.5612   30.392   7.6634   24.435   10.423   37.401   11.307   23.971   5.4570   29.881   4.8050 -5.910002 7.270901 
1 1 1   12    5  -13 o  102.276   1.5492  426.451   12.916  432.582   17.457  419.034   19.199  102.997   2.0792  101.365   2.3236 1.631973 3.118036 
1 1 1   12    5  -12 o  182.373   1.5332  1355.95   22.792  1383.09   33.120  1331.54   31.414  184.163   2.2062  180.702   2.1327 3.461456 3.068537 
1 1 1   12    5  -11 o  191.240   1.5655  1491.02   24.404  1484.75   35.112  1496.87   33.942  190.809   2.2574  191.590   2.1734 -0.7809601 3.133619 
1 1 1   12    5  -10 o  125.777   1.6117  644.962   16.524  632.834   23.670  656.491   23.078  124.569   2.3311  126.879   2.2314 -2.310135 3.226933 
1 1 1   12    5   -9 o  248.134   1.9053  2510.45   38.538  2499.98   51.346  2523.96   58.320  247.577   2.5443  248.736   2.8763 -1.159683 3.840122 
1 1 1   12    5   -8 o   81.234   1.5284  269.026   10.121  281.524   15.046  258.698   13.677   83.058   2.2244   79.622   2.1092 3.435478 3.065351 
1 1 1   12    5   -7 o   99.854   1.4524  406.482   11.822  374.104   17.216  435.373   16.262   95.781   2.2050  103.333   1.9307 -7.552391 2.930818 
1 1 1   12    5   -6 o  254.473   1.9301  2640.38   40.036  2621.82   61.518  2654.02   52.731  253.506   2.9770  255.092   2.5359 -1.585541 3.910692 
1 1 1   12    5   -5 o  256.751   2.1015  2688.07   43.982  2698.94   62.867  2677.65   61.554  257.206   2.9985  256.194   2.9475 1.012268 4.204588 
1 1 1   12    5   -4 o  127.454   1.6418  662.275   17.057  686.375   25.111  641.628   23.243  129.731   2.3746  125.434   2.2732 4.296806 3.287246 
1 1 1   12    5   -3 o  102.835   1.6645  431.141   13.953  418.937   20.336  441.995   19.179  101.351   2.4615  104.108   2.2600 -2.757133 3.341693 
1 1 1   12    5   -2 o  204.863   1.7251  1711.08   28.807  1699.22   38.398  1726.36   43.571  204.125   2.3077  205.733   2.5981 -1.607681 3.474956 
1 1 1   12    5   -1 o   79.016   1.7511  254.557   11.279  253.706   16.404  255.320   15.534   78.828   2.5562   79.086   2.4124 -0.2581940 3.514809 
1 1 1   12    5    0 o  128.783   1.6235  676.153   17.043  688.987   24.562  664.236   23.668  129.980   2.3182  127.625   2.2750 2.354652 3.248012 
1 1 1   12    5    1 o  133.530   1.5071  726.893   16.404  773.038   26.067  696.636   21.108  137.680   2.3227  130.710   1.9811 6.970245 3.052805 
1 1 1   12    5    2 o  139.775   1.6437  796.507   18.728  796.441   33.352  796.537   22.633  139.724   2.9283  139.768   1.9865 -0.4348755E-01 3.538498 
1 1 1   12    5    3 o   56.468   1.9108  130.160   8.7825  124.087   13.813  134.281   11.378   55.062   3.0900   57.329   2.4404 -2.266449 3.937463 
1 1 1   12    5    4 o  156.838   1.5558  1002.82   19.890  998.620   30.764  1005.84   26.072  156.480   2.4118  157.059   2.0364 -0.5791321 3.156579 
1 1 1   12    5    5 o  185.444   1.6413  1402.04   24.811  1390.24   38.180  1410.67   32.642  184.625   2.5370  185.994   2.1530 -1.369553 3.327384 
1 1 1   12    5    6 o  155.456   1.6753  985.272   21.229  1017.01   38.068  970.945   25.576  157.889   2.9578  154.311   2.0333 3.578491 3.589275 
1 1 1   12    5    7 o  157.976   1.6846  1017.48   21.693  1069.01   39.124  994.603   26.066  161.874   2.9650  156.179   2.0475 5.695679 3.603277 
1 1 1   12    5    8 o  188.396   1.9589  1447.21   30.083  1469.95   48.543  1433.04   38.330  189.807   3.1375  187.445   2.5086 2.362091 4.017055 
1 1 1   12    5    9 o  204.523   2.0242  1705.65   33.746  1722.24   54.372  1695.25   43.039  205.442   3.2468  203.869   2.5898 1.572647 4.153152 
1 1 1   12    5   10 o   88.763   1.5916  321.215   11.516  318.652   18.002  322.991   14.983   88.355   2.5021   89.000   2.0653 -0.6449661 3.244328 
1 1 1   12    5   11 o  125.647   1.5168  643.615   15.535  631.036   24.001  652.685   20.380  124.391   2.3670  126.518   1.9762 -2.127739 3.083505 
1 1 1   12    5   12 o  306.677   2.3656  3835.69   59.138  3827.63   83.686  3843.72   83.580  306.257   3.3522  306.901   3.3410 -0.6442261 4.732794 
1 1 1   12    5   13 o  133.002   1.6444  721.204   17.828  707.427   25.390  734.601   25.038  131.704   2.3650  134.213   2.2886 -2.508408 3.290988 
1 1 1   12    5   14 o  198.124   1.6887  1600.37   27.272  1618.36   42.243  1587.52   35.711  199.189   2.6017  197.303   2.2204 1.886307 3.420368 
1 1 1   12    5   15 o   61.787   1.8502  155.799   9.3083  158.766   14.845  153.878   11.949   62.314   2.9308   61.378   2.3928 0.9355316 3.783572 
1 1 1   12    5   16 o  119.928   1.5079  586.358   14.741  585.943   23.059  586.645   19.170  119.863   2.3601  119.947   1.9606 -0.8371735E-01 3.068219 
1 1 1   12    5   17 o  125.918   1.5222  646.401   15.625  641.201   24.336  650.048   20.380  125.386   2.3810  126.261   1.9801 -0.8748550 3.096790 
1 1 1   12    5   18 o  293.263   2.8104  3508.54   67.184  3493.34   94.903  3523.80   95.121  292.491   3.9804  293.764   3.9723 -1.273468 5.623440 
1 1 1   12    5   19 o   69.638   2.1007  197.935   11.911  208.540   15.770  183.848   18.175   71.448   2.7127   67.035   3.3366 4.412605 4.300150 
1 1 1   12    5   20 o   32.625   3.6564   43.994   9.5568   40.151   12.804   48.828   14.360   30.908   5.2711   34.151   5.3325 -3.243013 7.498023 
1 1 1   12    5   21 o  152.652   1.8594  950.155   23.137  947.217   30.092  954.404   36.185  152.393   2.4224  152.946   2.9024 -0.5531464 3.780495 
1 1 1   12    5   22 o  181.320   1.9391  1340.59   28.660  1458.86   48.294  1276.30   35.608  189.078   3.1334  176.892   2.4695 12.18526 3.989577 
1 1 1   12    5   23 o  107.271   1.8138  469.190   15.860  462.004   26.153  473.370   19.946  106.365   3.0195  107.735   2.2713 -1.370369 3.778345 
1 1 1   12    5   24 o  104.116   1.8290  442.000   15.523  428.942   25.641  449.555   19.502  102.480   3.0730  104.989   2.2788 -2.508812 3.825705 
1 1 1   12    5   25 o   80.077   2.5622  261.841   16.703  344.652   31.072  228.184   19.809   91.761   4.1649   74.702   3.2609 17.05925 5.289593 
1 1 1   12    5   26 o  212.827   3.2430  1848.65   56.260   0.0000   0.0000  1848.65   56.260  ?   ?   212.827   3.2430 0.000000 3.242954 
1 1 1   12    5   27 f  152.236   2.0489  945.112   25.426  915.274   35.911  975.106   36.005  149.770   2.9415  154.593   2.8572 -4.822739 4.100766 
1 1 1   12    5   28 o  306.345   2.8930  3829.25   72.242  3762.89  101.218  3898.16  103.141  303.509   4.0912  308.915   4.0960 -5.406403 5.789199 
1 1 1   12    5   29 o  211.260   2.2986  1820.33   39.583  1808.13   56.158  1832.38   55.801  210.473   3.2733  211.884   3.2308 -1.410568 4.599165 
1 1 1   12    5   30 o  114.007   1.7826  529.977   16.567  519.960   26.688  536.256   21.131  112.847   2.9037  114.665   2.2607 -1.818497 3.679956 
1 1 1   12    5   31 o  234.340   2.1755  2239.67   41.556  2227.61   66.005  2247.59   53.487  233.590   3.4665  234.704   2.7957 -1.113647 4.453361 
1 1 1   12    5   32 o   80.408   1.9402  263.654   12.717  266.115   20.765  262.176   16.087   80.685   3.1633   80.131   2.4658 0.5537109 4.010816 
1 1 1   12    5   33 o  122.462   1.8006  611.524   17.975  603.836   28.847  616.403   22.982  121.644   2.9092  122.932   2.2934 -1.287735 3.704469 
1 1 1   12    5   34 o  277.822   2.4244  3148.57   54.905  3177.44   87.774  3130.02   70.372  278.909   3.8607  276.925   3.1175 1.984344 4.962228 
1 1 1   12    5   35 o  100.727   1.8247  413.729   14.982  386.710   23.843  431.357   19.259   97.295   3.0099  102.836   2.2975 -5.540909 3.786537 
1 1 1   12    5   36 o  169.817   1.8942  1175.99   26.221  1194.17   42.375  1164.72   33.379  171.051   3.0391  168.972   2.4234 2.079285 3.887039 
1 1 1   12    5   37 o  245.327   2.2440  2454.90   44.874  2476.66   71.714  2440.90   57.529  246.266   3.5724  244.565   2.8857 1.701035 4.592361 
1 1 1   12    5   38 o  144.214   1.8385  848.114   21.613  800.063   33.971  880.787   28.013  140.010   2.9766  146.942   2.3387 -6.932465 3.785446 
1 1 1   12    5   39 o  241.692   2.2287  2382.72   43.908  2387.55   70.259  2379.62   56.245  241.787   3.5648  241.473   2.8575 0.3143921 4.568656 
1 1 1   12    5   40 o   42.486   2.8836   74.007   9.9274   69.734   16.881   76.266   12.274   40.954   5.1719   43.071   3.5269 -2.116531 6.259965 
1 1 1   12    5   41 o   28.183   4.1448   33.154   9.2378   40.862   15.916   29.238   11.344   30.982   6.5094   26.234   5.4817 4.747814 8.510090 
1 1 1   12    5   42 o  122.440   1.8272  611.368   18.236  580.319   29.300  631.003   23.300  119.194   3.0180  124.370   2.2982 -5.176468 3.793461 
1 1 1   12    5   43 o  126.418   1.8447  651.758   19.009  640.319   30.667  658.895   24.224  125.242   3.0039  127.086   2.3384 -1.843391 3.806786 
1 1 1   12    5   44 o  152.608   1.9021  949.835   23.662  918.151   37.567  970.673   30.465  149.962   3.0731  154.242   2.4231 -4.279495 3.913500 
1 1 1   12    5   45 o  118.554   1.8903  573.233   18.268  588.225   30.100  564.491   22.985  119.989   3.0799  117.623   2.3973 2.366150 3.902938 
1 1 1   12    5   46 o   89.505   2.5986  327.214   18.939  297.940   34.452  339.892   22.672   85.151   4.9854   91.187   3.0545 -6.036224 5.846688 
1 1 1   12    5   47 o  171.389   2.5444  1198.71   35.546  1102.99   60.638  1248.82   43.876  164.118   4.5370  174.884   3.0778 -10.76576 5.482446 
1 1 1   12    5   48 o  239.875   2.8974  2349.00   56.654  2324.65   98.900  2360.89   69.118  238.223   5.0930  240.387   3.5273 -2.163818 6.195256 
1 1 1   12    5   49 o  103.892   2.1594  440.331   18.288  413.311   26.820  463.810   25.001  100.540   3.2769  106.549   2.8812 -6.008667 4.363423 
1 1 1   12    5   50 o   89.956   2.0119  330.095   14.753  333.137   24.206  328.298   18.608   90.246   3.2961   89.652   2.5489 0.5936279 4.166629 
1 1 1   12    5   51 o  133.179   1.8634  723.448   20.229  701.192   32.365  737.717   25.915  131.032   3.0301  134.454   2.3645 -3.422409 3.843466 
1 1 1   12    5   52 o   90.014   2.2838  330.842   16.744  320.702   23.314  341.642   24.062   88.540   3.2358   91.388   3.2351 -2.848701 4.575558 
1 1 1   12    5   53 o  206.383   2.0613  1737.80   34.677  1740.18   55.589  1736.29   44.369  206.358   3.3047  206.225   2.6394 0.1328125 4.229308 
1 1 1   12    5   54 o   40.538   3.0787   67.522   10.097   58.699   17.480   71.940   12.370   37.335   5.9427   41.782   3.6691 -4.447605 6.984097 
1 1 1   12    5   55 o  203.347   1.9107  1686.95   31.671  1661.10   45.992  1710.27   43.678  201.670   2.7977  204.660   2.6181 -2.989456 3.831684 
1 1 1   12    5   56 o  125.982   1.7399  647.419   17.868  673.393   27.351  628.080   23.600  128.417   2.6128  124.044   2.3340 4.372108 3.503489 
1 1 1   12    5   57 o   67.159   2.0733  184.234   11.337  189.964   18.203  180.604   14.490   68.085   3.2896   66.445   2.6809 1.640854 4.243622 
1 1 1   12    5   58 o   80.346   1.9054  263.395   12.479  270.803   19.738  258.461   16.107   81.349   2.9816   79.520   2.4879 1.828827 3.883210 
1 1 1   12    5   59 o  182.331   1.8355  1356.40   27.281  1416.93   41.033  1308.45   36.521  186.238   2.7029  178.997   2.5030 7.241470 3.683843 
1 1 1   12    5   60 o   44.363   2.6940   80.701   9.6962   82.596   16.242   79.652   12.086   44.640   4.5261   43.993   3.3966 0.6470375 5.658795 
1 1 1   12    5   61 o   58.465   2.2360  139.763   10.637  127.093   17.290  147.478   13.492   55.567   3.8409   60.009   2.7655 -4.442627 4.732936 
1 1 1   12    5   62 o   22.537   5.9621   21.720   11.120   21.255   15.197   22.256   16.316   22.807   7.2615   23.398   7.5316 -0.5912800 10.46204 
1 1 1   12    5   63 o   79.918   2.5839  261.247   16.810  262.191   19.650  258.671   32.463   80.010   3.0183   79.122   5.0599 0.8883362 5.891796 
1 1 1   12    5   64 o   56.790   3.1403  132.361   14.480  140.078   17.178  113.415   26.915   58.361   3.6289   51.931   6.5002 6.429211 7.444536 
1 1 1   12    5   65 o   75.774   2.1036  234.630   12.981  220.389   18.597  248.161   18.127   73.319   3.1188   77.844   2.8616 -4.525108 4.232701 
1 1 1   12    5   66 o  121.285   1.8853  600.492   18.639  625.590   33.268  589.010   22.502  123.548   3.3064  120.074   2.2989 3.474022 4.027061 
1 1 1   12    5   67 o  154.800   1.9130  978.348   24.139  1011.30   41.739  961.789   29.589  157.128   3.2587  153.414   2.3661 3.713852 4.027111 
1 1 1   12    5   68 o  145.890   1.8976  869.042   22.567  905.522   39.777  851.727   27.404  148.655   3.2826  144.364   2.3287 4.290909 4.024751 
1 1 1   12    5   69 o  131.625   1.7410  707.261   18.679  669.545   27.818  738.233   25.208  127.929   2.6676  134.396   2.3010 -6.466415 3.522867 
1 1 1   12    5   70 o   44.426   2.4665   80.966   8.8973   92.667   14.189   73.384   11.422   47.358   3.7052   42.169   3.3503 5.189037 4.995259 
1 1 1   12    5   71 o   79.951   1.9264  261.118   12.555  242.839   17.482  280.584   18.042   76.957   2.7915   82.748   2.6783 -5.791130 3.868539 
1 1 1   12    5   72 o   47.759   2.4362   93.566   9.4531   70.404   14.730  109.785   12.326   41.061   4.4731   51.672   2.9385 -10.61121 5.351991 
1 1 1   12    5   73 o   74.371   1.7859  225.935   10.827  224.182   15.906  227.447   14.778   73.937   2.6434   74.508   2.4365 -0.5713959 3.594991 
1 1 1   12    5   74 o   46.757   2.2044   89.626   8.3782   88.558   12.955   90.394   10.984   46.281   3.4590   46.860   2.8897 -0.5797119 4.507242 
1 1 1   12    5   75 o   27.034   3.5757   30.599   7.6868   30.878   11.648   30.383   10.231   26.732   5.5279   26.652   4.8895 0.8029747E-01 7.380017 
1 1 1   12    5   76 o  112.039   1.5618  512.704   14.264  517.583   20.139  507.793   20.205  112.455   2.1970  111.380   2.2254 1.074692 3.127164 
1 1 1   12    5   77 o   32.635   2.7415   44.016   7.2257   34.786   11.731   49.659   9.1724   28.427   5.2560   34.578   3.2940 -6.151186 6.202929 
1 1 1   12    5   78 o   36.375   2.0446   54.326   6.0381   65.901   11.889   50.302   7.0093   39.767   3.7105   34.936   2.4774 4.831554 4.461562 
1 1 1   12    5   79 o  101.456   1.3800  420.406   11.413  425.210   18.425  417.415   14.538  101.865   2.2190  101.027   1.7653 0.8379364 2.835515 
1 1 1   12    5   80 o   27.344   2.4643   30.938   5.4338   44.018   12.681   27.996   6.0139   32.034   5.0212   25.923   2.8954 6.111317 5.796154 
1 1 1   12    5   81 o   28.987   2.1969   34.653   5.1524   30.997   12.405   35.415   5.6640   26.508   5.8937   29.274   2.3945 -2.765463 6.361551 
1 1 1   12    5   82 o   42.914   1.9987   75.635   6.9723   79.584   13.442   74.182   8.1550   43.591   3.8216   42.433   2.3671 1.158440 4.495324 
1 1 1   12    5   83 o   73.883   1.9596  223.919   11.791  223.405   14.853  224.796   19.392   73.657   2.4772   73.621   3.2392 0.3610992E-01 4.077900 
1 1 1   12    5   84 o   27.812   3.8486   32.842   8.4915   40.574   10.780   20.199   13.785   30.786   4.4223   21.515   6.9226 9.271437 8.214574 
1 1 1   12    5   85 o   44.250   2.7060   81.109   9.7138   75.600   11.671   93.530   17.524   42.517   3.3958   46.827   4.6522 -4.310265 5.759731 
1 1 1   12    5   86 o   57.539   2.2581  136.413   10.571  146.583   12.886  115.489   18.484   59.525   2.6624   52.147   4.3890 7.377838 5.133393 
1 1 1   12    5   87 o   28.028   4.0451   33.647   8.9746   27.254   10.842   47.561   15.995   24.694   5.5246   32.490   6.2667 -7.795912 8.354234 
1 1 1   12    5   88 o   23.423   4.4334   23.953   8.1550   26.805   10.443   19.496   13.054   24.493   5.3783   20.928   6.7370 3.565693 8.620548 
1 1 1   12    5   89 o   35.137   3.0250   51.691   8.5799   52.967   11.062   49.764   13.593   35.263   3.9142   33.669   5.1133 1.593903 6.439464 
1 1 1   12    5   90 o   71.835   1.8667  212.172   10.921  208.545   14.114  217.586   17.242   70.998   2.4424   72.287   2.9321 -1.289177 3.816097 
1 1 1   12    5   91 o   15.863   5.3843   10.493   8.3048   11.291   11.399   9.5907   12.124   17.038   6.2580   16.600   6.3765 0.4373379 8.934331 
1 1 1   12    5   92 o   29.957   3.6930   38.367   8.8273   26.033   12.014   52.838   13.013   23.701   6.1620   34.762   4.7138 -11.06148 7.758236 
1 1 1   12    5   93 o   48.227   2.4760   96.586   9.7009   76.474   13.205  120.170   14.299   42.323   3.8702   53.436   3.2989 -11.11224 5.085361 
1 1 1   12    5   94 o   43.646   2.6567   79.445   9.4073   78.325   13.129   80.627   13.486   42.836   3.7995   43.440   3.8482 -0.6043434 5.407831 
1 1 1   12    5   95 o   32.468   3.4775   44.946   9.0606   44.568   10.565   45.998   17.618   32.043   4.1415   30.858   7.1451 1.185436 8.258591 
1 1 1   12    5   96 o   10.804   4.7718  -1.4070   8.2428  -8.4079   9.5300   19.386   16.424   9.9108   4.6520   20.725   7.5274 -10.81440 8.848879 
1 1 1   12    5   97 o   35.780   2.8821   53.937   8.3348   51.064   10.851   58.072   13.017   34.325   3.9502   36.327   4.4914 -2.002106 5.981323 
1 1 1   12    5   98 o   48.685   2.2724   98.585   8.9933   91.410   11.698  108.954   14.063   46.472   3.1059   50.550   3.4332 -4.077351 4.629638 
1 1 1   12    5   99 o   52.719   2.1671  115.491   9.2931   94.368   11.976  147.460   14.733   47.150   3.1337   59.024   3.0728 -11.87385 4.388870 
1 1 1   12    5  100 o   11.675   4.9378   1.8957   8.0961  -5.4573   11.226   9.8645   11.687   11.428   5.2546   16.047   6.2345 -4.618711 8.153502 
1 1 1   12    5  101 o   23.334   4.6599   24.969   8.5531   38.386   12.026   11.234   12.167   28.616   5.3522   16.566   6.3815 12.04985 8.328843 
1 1 1   12    5  102 o   26.556   4.2073   31.684   8.8042   44.220   12.287   18.456   12.622   30.875   5.0568   19.348   6.6363 11.52681 8.343365 
1 1 1   12    5  103 o   12.856   5.0487   5.6350   7.7314   2.0965   10.107   10.627   12.004   12.629   5.4338   16.131   6.3038 -3.501511 8.322469 
1 1 1   12    5  104 o   29.130   3.5894   37.381   8.3432   43.770   10.863   28.191   13.028   30.984   4.4267   23.279   6.5769 7.704975 7.927827 
1 1 1   12    5  105 f   28.243   3.7195   35.510   8.3553   23.969   10.696   53.575   13.382   21.780   5.8859   33.707   5.0237 -11.92667 7.738348 
1 1 1   12    5  106 o   15.188   5.2722   10.734   7.9753   18.341   10.200  -1.2299   12.792   18.976   5.9371   12.745   5.7624 6.230591 8.273742 
1 1 1   12    5  107 f   13.355   5.2036   6.9051   8.1599   7.2355   10.604   6.4255   12.776   14.228   5.8004   14.610   6.1922 -0.3823137 8.484614 
1 1 1   12    5  108 o   11.505   4.9626   1.7786   8.4714  -0.7384   11.495   4.7704   12.533   12.227   5.5010   14.034   6.0445 -1.807052 8.172982 
1 1 1   12    5  109 o   9.6691   4.4851  -4.6281   8.4447  -5.9300   11.572  -3.1449   12.351   11.112   5.1867   12.033   5.5251 -0.9212637 7.578161 
1 1 1   12    5  110 o   14.116   5.3852   8.6008   8.6083   6.2447   11.951   11.141   12.410   14.170   5.9965   15.819   6.3367 -1.648768 8.724155 
1 1 1   12    5  111 o   12.879   5.4949   4.0720   10.177   8.4885   16.554   1.3884   12.904   15.799   6.8752   13.160   5.8816 2.638932 9.047745 
1 1 1   12    5  112 o   7.7342   3.8619 -22.6351   9.9708 -13.2626   15.904 -28.7041   12.798   11.739   5.6484   8.6500   4.3277 3.089215 7.115666 
1 1 1   12    5  113 o   25.416   6.0568   34.194   12.369   9.6370   16.995   61.856   18.038   16.034   6.9721   33.491   6.8387 -17.45683 9.766171 
1 1 1   12    5  114 f   18.049   6.8297   18.034   13.777   22.089   16.995   10.261   23.529   19.225   7.5042   17.025   7.7438 2.200584 10.78327 
1 1 1   12    5  115 o   24.355   6.8062   33.976   14.033   31.442   17.096   39.209   24.568   22.204   7.7184   22.703   8.9739 -0.4985237 11.83658 
1 1 1   12    5  116 o   22.090   7.8031   31.792   17.518   34.368   24.501   29.097   25.057   21.418   8.7840   20.243   8.6289 1.174658 12.31328 
1 1 1   12    5  117 o   16.943   7.7320   11.268   23.702   0.0000   0.0000   11.268   23.702  ?   ?    16.943   7.7320 0.000000 7.731960 
1 1 1   12    5  118 o   18.188   6.8603   19.042   13.875   11.017   16.768   36.464   24.708   16.036   6.9496   21.689   8.8494 -5.652340 11.25204 
1 1 1   12    5  119 o   16.586   6.6987   14.142   13.991   13.704   17.173   15.008   24.129   16.740   7.1399   17.591   7.9372 -0.8503761 10.67600 
1 1 1   12    6 -117 o   11.214   5.3063  -7.3478   12.859  -1.9853   15.272 -20.4098   23.836   13.037   6.0420   13.227   6.4866 -0.1896744 8.864602 
1 1 1   12    6 -116 o   10.126   4.7852  -6.8892   10.395  -1.6209   13.022 -16.1434   17.258   12.312   5.6603   11.687   5.6848 0.6252098 8.022235 
1 1 1   12    6 -115 o   27.504   5.1519   37.966   11.126   28.071   13.866   55.851   18.642   21.633   6.9414   30.207   7.5834 -8.573423 10.28058 
1 1 1   12    6 -114 o   15.758   5.9940   12.477   10.645   17.189   13.347   4.2398   17.647   17.572   6.7051   14.811   6.7250 2.760855 9.496478 
1 1 1   12    6 -113 o   10.750   4.9822  -3.9740   10.385 -17.5785   12.908   20.986   17.485   9.8040   4.8008   18.725   7.5144 -8.920723 8.917086 
1 1 1   12    6 -112 f   13.415   5.6239   5.9582   10.356   5.4755   13.209   6.7282   16.682   14.096   6.1377   15.209   6.7491 -1.113375 9.122588 
1 1 1   12    6 -111 o   16.075   6.0255   12.933   10.667   16.822   13.312   5.9534   17.832   17.625   6.7033   15.347   6.8825 2.277365 9.607451 
1 1 1   12    6 -110 o   19.338   6.1057   20.150   10.764   21.046   13.803   18.759   17.196   19.220   6.9114   18.343   7.4199 0.8778572 10.14014 
1 1 1   12    6 -109 o   13.822   6.0045   4.6358   12.580  -4.7711   18.381   12.925   17.254   13.771   6.4629   16.901   7.1808 -3.130301 9.660880 
1 1 1   12    6 -108 o   15.482   6.5460   9.1179   14.222   3.1949   17.641   20.115   24.037   14.945   6.7608   19.052   8.2879 -4.107374 10.69573 
1 1 1   12    6 -107 o   22.347   6.8322   28.036   13.599   17.952   21.324   34.948   17.655   18.607   7.9467   23.820   7.8464 -5.212994 11.16761 
1 1 1   12    6 -106 o   18.580   5.8176   17.761   9.7919   21.000   12.375   12.337   16.014   19.688   6.5720   16.821   7.0184 2.866726 9.615089 
1 1 1   12    6 -105 o   8.3537   4.1022 -16.1928   9.6334 -16.3431   11.788 -15.8903   16.716   9.5582   4.6604   11.859   5.7273 -2.301270 7.383834 
1 1 1   12    6 -104 o   20.515   6.6497   22.719   12.705   30.189   19.997   17.663   16.452   22.130   8.2591   18.519   7.3361 3.610498 11.04674 
1 1 1   12    6 -103 o   24.755   5.1872   29.699   10.132   23.444   12.398   42.277   17.581   20.988   6.5422   27.169   7.6274 -6.181414 10.04873 
1 1 1   12    6 -102 o   33.148   3.8636   49.027   10.244   49.501   12.754   48.166   17.198   32.431   4.9836   29.904   7.1517 2.526909 8.716819 
1 1 1   12    6 -101 o   36.226   3.3427   57.018   9.7595   60.172   11.659   49.636   17.838   36.783   3.9503   30.466   7.2821 6.317394 8.284583 
1 1 1   12    6 -100 o   31.122   3.8097   42.793   9.4635   35.504   11.160   61.444   17.853   27.445   5.1784   35.073   6.4833 -7.628378 8.297565 
1 1 1   12    6  -99 o   17.951   4.7340   15.025   7.0250   14.701   11.032   15.245   9.1109   17.685   6.1968   17.882   5.6135 -0.1967354 8.361275 
1 1 1   12    6  -98 o   11.418   4.6567   3.1422   6.8380   9.8099   10.809  -1.3068   8.8293   15.707   6.0239   11.031   4.9016 4.676208 7.766181 
1 1 1   12    6  -97 o   13.290   4.8566   6.9410   6.8515   19.414   10.902  -1.2008   8.8082   20.057   6.1145   11.091   4.9138 8.966573 7.844262 
1 1 1   12    6  -96 o   12.896   4.9356   5.7691   7.2456   15.893   13.016   1.2233   8.7219   18.693   6.7129   11.837   5.0694 6.856033 8.412034 
1 1 1   12    6  -95 o   35.916   2.7834   54.326   8.0853   56.415   13.982   53.277   9.9104   35.414   4.9809   35.242   3.4958 0.1714325 6.085208 
1 1 1   12    6  -94 o   21.518   4.4607   20.754   7.5672   23.787   13.097   19.234   9.2713   22.218   6.6868   20.359   5.4704 1.859228 8.639367 
1 1 1   12    6  -93 o   53.625   2.1070  119.014   9.1925  125.851   15.235  115.099   11.527   54.463   3.4494   52.478   2.7039 1.985405 4.382821 
1 1 1   12    6  -92 o   23.543   5.2029   25.212   9.7186   31.483   12.821   16.742   14.900   25.913   6.1608   19.653   7.1650 6.259487 9.449460 
1 1 1   12    6  -91 o   11.351   5.1880  -5.4520   10.726  -6.1104   12.205  -3.2195   22.475   12.062   5.5210   17.024   7.6728 -4.962292 9.452682 
1 1 1   12    6  -90 o   37.256   3.9028   59.457   11.677   63.746   13.266   44.711   24.601   38.388   4.3141   29.361   9.2251 9.026924 10.18397 
1 1 1   12    6  -89 o   19.211   5.6580   16.702   9.4568   17.336   10.371   13.576   23.033   19.554   5.9643   20.657   8.4992 -1.102448 10.38307 
1 1 1   12    6  -88 o   20.564   5.0718   19.022   8.4477   19.339   10.400   18.407   14.484   20.591   5.8956   20.442   7.1046 0.1490135 9.232196 
1 1 1   12    6  -87 o   46.138   2.5867   88.406   9.6895   97.737   12.129   71.950   16.108   48.329   3.0952   40.590   4.9720 7.738503 5.856699 
1 1 1   12    6  -86 o   28.893   3.3634   35.324   7.7735   45.310   11.164   25.927   10.830   32.412   4.3342   23.937   5.6430 8.474136 7.115392 
1 1 1   12    6  -85 o   28.104   3.3866   33.417   7.6022   34.040   10.914   32.830   10.595   27.806   4.9989   27.319   4.9397 0.4874973 7.027822 
1 1 1   12    6  -84 o   21.158   4.4498   19.617   7.4307   15.132   10.484   24.146   10.534   18.690   6.0391   23.179   5.6315 -4.488632 8.257406 
1 1 1   12    6  -83 o   38.394   2.6180   61.133   8.1445   55.868   11.697   66.088   11.347   36.269   4.0241   39.649   3.5484 -3.380798 5.365105 
1 1 1   12    6  -82 o   67.247   1.9978  185.792   10.939  201.142   16.730  174.328   14.458   69.648   2.9535   64.910   2.7386 4.738029 4.027804 
1 1 1   12    6  -81 o   28.201   3.5098   33.560   7.8942   34.490   11.377   32.696   10.963   28.078   5.1610   27.339   5.1070 0.7390251 7.260693 
1 1 1   12    6  -80 o   75.000   1.8840  230.677   11.509  233.432   17.107  228.400   15.554   75.169   2.7968   74.432   2.5675 0.7370300 3.796608 
1 1 1   12    6  -79 o   24.609   3.9745   25.842   7.7014   33.538   11.227   19.003   10.584   27.757   5.1517   20.782   5.9468 6.975277 7.867926 
1 1 1   12    6  -78 o   47.148   2.4450   91.573   9.3648   82.452   14.207   98.581   12.453   44.341   3.9727   48.757   3.1503 -4.415943 5.070147 
1 1 1   12    6  -77 o   80.705   1.8000  266.548   11.841  257.451   17.556  274.141   16.040   79.061   2.7282   81.679   2.4117 -2.617836 3.641309 
1 1 1   12    6  -76 o   48.536   2.3554   96.861   9.2910   88.340   13.931  103.689   12.469   46.035   3.7446   50.072   3.0698 -4.037067 4.842065 
1 1 1   12    6  -75 o   85.072   1.8047  296.008   12.515  296.262   16.331  295.648   19.479   84.970   2.3601   84.759   2.8233 0.2110367 3.679789 
1 1 1   12    6  -74 f   37.983   2.6960   59.521   8.2928   61.153   12.006   58.032   11.468   38.254   3.9050   37.273   3.8290 0.9807129 5.468976 
1 1 1   12    6  -73 o   43.774   2.4505   78.777   8.7090   94.294   12.489   64.091   12.150   47.762   3.2269   39.204   3.8518 8.558418 5.024860 
1 1 1   12    6  -72 o  131.041   1.5981  701.412   17.070  715.998   23.455  684.984   24.891  132.272   2.1753  129.329   2.3611 2.943298 3.210421 
1 1 1   12    6  -71 o   91.334   1.8290  340.907   13.617  331.054   20.336  348.915   18.334   89.805   2.7813   92.273   2.4396 -2.467781 3.699630 
1 1 1   12    6  -70 o   47.244   2.6258   91.718   10.072   93.351   15.427   90.505   13.297   47.404   4.0306   46.778   3.5129 0.6262436 5.346569 
1 1 1   12    6  -69 f   46.912   2.6968   90.449   10.269   90.639   15.734   90.308   13.554   46.691   4.1781   46.726   3.5858 -0.3501129E-01 5.505878 
1 1 1   12    6  -68 o   42.435   3.1457   74.270   10.804   74.600   16.647   74.030   14.201   42.171   4.9360   42.175   4.1859 -0.4379272E-02 6.471920 
1 1 1   12    6  -67 o   98.892   2.0427  399.617   16.466  398.335   27.679  400.320   20.486   98.439   3.4548   98.877   2.5438 -0.4374542 4.290245 
1 1 1   12    6  -66 o   47.662   2.7893   93.316   10.790   99.162   16.322   88.780   14.379   48.916   4.1321   46.320   3.8429 2.596149 5.642848 
1 1 1   12    6  -65 f  141.555   1.5755  817.788   18.179  863.326   30.216  791.952   22.759  145.285   2.5514  139.243   2.0051 6.041626 3.245013 
1 1 1   12    6  -64 o  206.278   1.7557  1736.99   29.521  1761.47   46.937  1720.97   37.972  207.482   2.7753  205.216   2.2699 2.265869 3.585325 
1 1 1   12    6  -63 o  167.879   1.5010  1149.93   20.540  1176.66   29.931  1126.13   28.239  169.719   2.1635  166.049   2.0863 3.670929 3.005549 
1 1 1   12    6  -62 o   45.722   1.9903   85.520   7.4002   68.561   10.852  100.259   10.117   40.782   3.2925   49.462   2.5176 -8.679626 4.144719 
1 1 1   12    6  -61 o  135.852   1.3704  752.820   15.175  773.703   21.318  731.367   21.607  137.671   1.8996  133.842   1.9805 3.828751 2.744229 
1 1 1   12    6  -60 o  109.287   1.4370  487.213   12.802  517.555   17.444  451.800   18.845  112.603   1.9005  105.180   2.1980 7.422539 2.905691 
1 1 1   12    6  -59 o   39.639   2.3326   64.400   7.5037   74.914   10.979   55.184   10.279   42.670   3.1794   36.544   3.4931 6.126286 4.723349 
1 1 1   12    6  -58 o  136.140   1.4444  756.003   16.029  779.241   21.402  726.317   24.190  138.176   1.9001  133.367   2.2251 4.808868 2.925983 
1 1 1   12    6  -57 o  124.897   1.4424  636.275   14.685  653.370   19.555  614.166   22.238  126.529   1.8960  122.643   2.2245 3.885246 2.922842 
1 1 1   12    6  -56 o   77.559   1.7474  245.437   11.048  246.754   14.617  243.683   16.872   77.702   2.3103   77.179   2.6860 0.5230560 3.542903 
1 1 1   12    6  -55 o   70.117   1.7855  200.723   10.197  195.029   12.979  209.906   16.482   69.074   2.3083   71.613   2.8290 -2.538635 3.651253 
1 1 1   12    6  -54 o   76.951   1.6896  241.563   10.598  229.650   13.389  261.553   17.344   74.974   2.1931   79.974   2.6642 -4.999290 3.450793 
1 1 1   12    6  -53 o  111.177   1.4823  504.111   13.433  504.324   17.443  503.801   21.058  111.175   1.9248  111.088   2.3254 0.8650970E-01 3.018687 
1 1 1   12    6  -52 o   64.024   1.7239  167.333   8.9889  160.926   13.712  172.162   11.903   62.712   2.6886   64.906   2.2532 -2.193089 3.507960 
1 1 1   12    6  -51 o   88.563   1.5163  319.882   10.946  331.685   16.549  310.703   14.595   90.147   2.2522   87.259   2.0518 2.887260 3.046673 
1 1 1   12    6  -50 f  127.198   1.4480  659.803   15.014  637.774   21.830  679.576   20.682  125.014   2.1422  129.058   1.9660 -4.044701 2.907615 
1 1 1   12    6  -49 o  136.663   1.5512  761.698   17.280  762.031   27.460  761.481   22.234  136.627   2.4656  136.615   1.9966 0.1182556E-01 3.172643 
1 1 1   12    6  -48 f  131.219   1.5510  702.204   16.590  699.217   26.390  704.156   21.332  130.879   2.4736  131.376   1.9920 -0.4967499 3.175946 
1 1 1   12    6  -47 o  224.641   1.9912  2058.72   36.461  2080.54   52.281  2038.06   50.876  225.717   2.8415  223.408   2.7937 2.309189 3.984796 
1 1 1   12    6  -46 o   60.310   2.0592  148.564   10.108  157.488   15.986  142.619   13.048   62.009   3.1732   59.042   2.7185 2.967144 4.178405 
1 1 1   12    6  -45 o   73.082   1.9029  218.006   11.326  197.533   17.296  233.378   14.987   69.479   3.0614   75.582   2.4357 -6.103477 3.912155 
1 1 1   12    6  -44 o  139.102   1.7088  789.110   19.376  808.179   28.935  773.610   26.088  140.721   2.5225  137.693   2.3243 3.028503 3.430080 
1 1 1   12    6  -43 o  109.825   1.7276  491.891   15.466  460.360   23.042  517.745   20.865  106.169   2.6646  112.649   2.2722 -6.480225 3.501851 
1 1 1   12    6  -42 o  125.950   2.1250  647.123   21.816  624.251   53.315  651.723   23.910  123.303   5.3169  126.386   2.3208 -3.082848 5.801387 
1 1 1   12    6  -41 o  115.408   2.1103  543.327   19.853   0.0000   0.0000  543.327   19.853  ?   ?   115.408   2.1103 0.000000 2.110337 
1 1 1   12    6  -40 o  123.367   1.9384  620.763   19.493  639.428   53.864  617.950   20.911  124.798   5.3070  123.080   2.0842 1.718079 5.701581 
1 1 1   12    6  -39 o   56.619   2.3561  131.020   10.850   97.768   23.773  139.768   12.194   48.420   6.1627   58.467   2.5648 -10.04740 6.675145 
1 1 1   12    6  -38 o   41.382   2.8772   70.240   9.6452   58.161   21.824   73.172   10.752   36.930   7.5058   42.215   3.1472 -5.285686 8.138928 
1 1 1   12    6  -37 o  174.753   1.6510  1245.29   23.519  1198.30   36.414  1278.93   30.807  171.360   2.6069  177.068   2.1344 -5.707123 3.369190 
1 1 1   12    6  -36 o  150.166   1.5921  919.486   19.488  894.028   30.697  936.675   25.224  148.020   2.5441  151.541   2.0419 -3.520416 3.262200 
1 1 1   12    6  -35 o   76.377   1.7210  237.880   10.715  237.678   17.774  237.995   13.429   76.256   2.8646   76.354   2.1597 -0.9745026E-01 3.587506 
1 1 1   12    6  -34 o  160.594   1.6021  1051.61   20.973  1063.52   33.617  1044.03   26.836  161.447   2.5544  159.991   2.0577 1.455399 3.280097 
1 1 1   12    6  -33 o  129.386   1.5528  682.587   16.378  682.959   26.316  682.353   20.923  129.380   2.4953  129.348   1.9844 0.3268433E-01 3.188179 
1 1 1   12    6  -32 o  189.566   1.6782  1465.31   25.932  1468.66   40.769  1463.03   33.608  189.719   2.6362  189.389   2.1769 0.3301239 3.418879 
1 1 1   12    6  -31 f   86.489   1.6172  305.008   11.402  336.935   19.297  287.882   14.133   90.835   2.6088   84.015   2.0636 6.820290 3.326329 
1 1 1   12    6  -30 o  140.548   1.5496  805.418   17.754  786.702   28.147  817.784   22.879  138.864   2.4866  141.605   1.9820 -2.741959 3.179911 
1 1 1   12    6  -29 o   38.506   2.5398   60.754   7.9275   78.653   13.891   52.108   9.6541   43.700   3.9418   35.566   3.3702 8.134113 5.186103 
1 1 1   12    6  -28 o  143.545   1.5503  840.120   18.140  866.599   29.239  823.551   23.129  145.748   2.4611  142.105   1.9967 3.643356 3.169179 
1 1 1   12    6  -27 o  143.792   1.5549  843.009   18.225  844.521   28.951  842.017   23.456  143.880   2.4685  143.689   2.0026 0.1907043 3.178638 
1 1 1   12    6  -26 o  152.779   1.5728  951.683   19.587  962.029   31.196  944.950   25.167  153.564   2.4921  152.218   2.0282 1.345139 3.213184 
1 1 1   12    6  -25 o   69.247   1.7910  195.662   10.101  208.767   16.857  188.320   12.618   71.466   2.8997   67.910   2.2826 3.556389 3.690275 
1 1 1   12    6  -24 o  341.962   2.3841  4770.07   66.457  4765.15  102.252  4773.67   87.444  341.590   3.6722  341.986   3.1368 -0.3966675 4.829575 
1 1 1   12    6  -23 o   92.805   1.5976  351.167   12.085  343.667   19.604  355.765   15.349   91.743   2.6241   93.401   2.0161 -1.657997 3.309120 
1 1 1   12    6  -22 o  231.018   1.9989  2176.44   37.642  2150.20   53.288  2202.56   53.181  229.553   2.8478  232.335   2.8080 -2.781799 3.999387 
1 1 1   12    6  -21 o   76.418   2.0953  238.338   13.040  236.619   17.492  240.489   19.564   76.099   2.8247   76.697   3.1359 -0.5985718 4.220524 
1 1 1   12    6  -20 o  116.202   1.8605  550.606   17.623  549.922   23.198  551.539   27.101  116.109   2.4510  116.261   2.8597 -0.1528244 3.766336 
1 1 1   12    6  -19 o  116.035   2.0787  549.087   19.661  499.577   27.709  599.293   27.902  110.597   3.0765  121.192   2.8244 -10.59503 4.176389 
1 1 1   12    6  -18 o  239.509   2.2139  2339.60   43.223  2449.82   71.739  2276.80   54.157  244.950   3.5929  236.223   2.8125 8.726837 4.562797 
1 1 1   12    6  -17 o  217.333   1.7819  1925.96   31.568  1906.83   48.932  1939.59   41.316  216.184   2.7767  218.068   2.3243 -1.883926 3.621151 
1 1 1   12    6  -16 o  141.609   1.6850  817.629   19.451  837.955   28.632  800.211   26.505  143.327   2.4507  140.068   2.3214 3.259308 3.375647 
1 1 1   12    6  -15 o   76.832   1.8533  240.710   11.607  218.787   17.115  259.381   15.794   73.170   2.8751   79.706   2.4338 -6.536232 3.766910 
1 1 1   12    6  -14 o  112.592   1.6876  516.875   15.489  490.749   22.586  540.069   21.281  109.683   2.5262  115.072   2.2687 -5.389191 3.395365 
1 1 1   12    6  -13 o  134.398   1.6819  736.474   18.426  717.549   22.855  771.613   31.143  132.646   2.1138  137.522   2.7781 -4.876556 3.490805 
1 1 1   12    6  -12 o   13.447   5.1169   5.1241   7.7592   4.8820   11.070   5.3578   10.879   15.138   6.0109   15.213   5.9844 -0.7537746E-01 8.482020 
1 1 1   12    6  -11 f  214.320   1.8921  1873.00   33.056  1815.19   45.941  1935.06   47.598  210.937   2.6719  217.790   2.6811 -6.852493 3.785147 
1 1 1   12    6  -10 o   90.535   1.5612  334.178   11.521  354.162   18.023  320.368   14.983   93.153   2.3754   88.634   2.0738 4.519203 3.153268 
1 1 1   12    6   -9 o  231.578   1.8223  2186.71   34.400  2214.41   53.143  2166.73   45.131  232.971   2.7984  230.481   2.4021 2.490173 3.687999 
1 1 1   12    6   -8 o  183.880   1.6350  1378.56   24.506  1383.49   37.681  1374.95   32.261  184.164   2.5100  183.615   2.1554 0.5491180 3.308478 
1 1 1   12    6   -7 o  192.589   1.6658  1512.26   26.152  1549.57   40.712  1486.05   34.123  194.902   2.5625  190.887   2.1930 4.014862 3.372764 
1 1 1   12    6   -6 o  158.508   1.5579  1024.35   20.130  1005.92   30.795  1038.10   26.600  157.042   2.4056  159.551   2.0452 -2.508957 3.157501 
1 1 1   12    6   -5 o  151.876   1.5498  940.411   19.187  915.790   29.249  959.010   25.421  149.842   2.3946  153.353   2.0336 -3.510910 3.141626 
1 1 1   12    6   -4 o  229.226   1.8154  2142.48   33.922  2182.01   52.612  2114.36   44.378  231.264   2.7909  227.681   2.3911 3.582825 3.675142 
1 1 1   12    6   -3 o  247.508   1.8963  2497.96   38.258  2498.00   58.702  2497.93   50.443  247.433   2.9104  247.464   2.5007 -0.3147888E-01 3.837196 
1 1 1   12    6   -2 o  115.777   1.5102  546.480   14.253  533.577   22.103  555.664   18.648  114.377   2.3707  116.734   1.9597 -2.356613 3.075819 
1 1 1   12    6   -1 o   97.616   1.5429  388.493   12.277  385.821   19.212  390.337   15.961   97.258   2.4234   97.837   2.0014 -0.5792465 3.142951 
1 1 1   12    6    0 o  233.102   2.1620  2215.94   41.080  2185.48   91.289  2223.67   46.001  231.216   4.8436  233.491   2.4169 -2.274323 5.413095 
1 1 1   12    6    1 o  124.066   1.7762  627.607   17.963  637.665   40.637  625.164   20.026  124.890   3.9969  123.818   1.9841 1.071922 4.462266 
1 1 1   12    6    2 o   92.213   1.8289  346.716   13.748  353.386   31.193  345.108   15.315   92.923   4.1284   91.994   2.0424 0.9289551 4.605943 
1 1 1   12    6    3 o  208.728   2.0670  1776.67   35.169  1610.07   78.710  1818.22   39.312  198.454   4.8656  211.142   2.2841 -12.68875 5.375040 
1 1 1   12    6    4 o  167.202   1.5872  1139.80   21.633  1151.99   33.557  1131.13   28.297  168.056   2.4496  166.545   2.0844 1.510880 3.216374 
1 1 1   12    6    5 o   90.080   1.5793  330.828   11.596  327.941   18.127  332.829   15.088   89.630   2.4834   90.342   2.0488 -0.7115021 3.219485 
1 1 1   12    6    6 o  119.501   1.6287  582.231   15.865  555.865   22.556  608.045   22.319  116.741   2.3703  122.102   2.2424 -5.361069 3.262933 
1 1 1   12    6    7 o  166.384   1.5914  1128.69   21.584  1153.62   33.562  1111.11   28.185  168.174   2.4483  165.063   2.0947 3.110596 3.222091 
1 1 1   12    6    8 o  130.114   1.5242  690.221   16.166  715.114   25.344  673.144   20.991  132.412   2.3481  128.480   2.0043 3.931839 3.087128 
1 1 1   12    6    9 o  114.949   1.6493  538.732   15.454  546.914   22.259  531.118   21.473  115.797   2.3581  114.115   2.3084 1.682762 3.299902 
1 1 1   12    6   10 o  220.613   1.7872  1984.50   32.139  1990.46   49.427  1980.14   42.304  220.881   2.7452  220.336   2.3553 0.5446930 3.617138 
1 1 1   12    6   11 f  181.957   1.6382  1349.89   24.299  1352.31   37.429  1348.13   31.945  182.076   2.5219  181.815   2.1555 0.2610779 3.317519 
1 1 1   12    6   12 o   82.385   1.6270  276.727   10.926  282.396   17.124  272.833   14.190   83.165   2.5288   81.765   2.1309 1.400085 3.306899 
1 1 1   12    6   13 o  193.158   1.8100  1521.33   28.499  1512.06   49.864  1525.82   34.730  192.481   3.1780  193.423   2.2027 -0.9417877 3.866787 
1 1 1   12    6   14 o  179.866   1.7590  1319.13   25.790  1316.83   45.291  1320.23   31.372  179.632   3.0931  179.923   2.1391 -0.2918396 3.760697 
1 1 1   12    6   15 o   98.472   1.8298  395.393   14.688  435.661   24.608  373.108   18.307  103.287   2.9258   95.643   2.3481 7.644287 3.751504 
1 1 1   12    6   16 o   12.479   5.0724   2.4416   8.0810   10.388   15.294  -0.6362   9.5180   18.942   7.1895   12.335   5.2895 6.607193 8.925653 
1 1 1   12    6   17 o  251.329   2.0742  2576.00   42.495  2667.01   75.823  2534.32   51.311  255.573   3.6396  249.252   2.5254 6.321381 4.429909 
1 1 1   12    6   18 o   90.790   1.5865  336.070   11.741  330.413   18.253  340.062   15.335   89.965   2.4914   91.316   2.0601 -1.351357 3.232793 
1 1 1   12    6   19 o  127.071   1.5241  658.324   15.786  637.368   24.238  673.762   20.804  125.003   2.3787  128.538   1.9855 -3.534592 3.098494 
1 1 1   12    6   20 o  206.655   1.8678  1741.44   31.464  1743.05   44.794  1739.88   44.206  206.698   2.6586  206.513   2.6260 0.1852875 3.736822 
1 1 1   12    6   21 o  154.499   1.8545  973.356   23.355  958.272   37.224  983.149   29.993  153.238   2.9800  155.251   2.3700 -2.012268 3.807551 
1 1 1   12    6   22 o  160.212   1.7093  1046.60   22.323  1034.84   31.954  1057.81   31.198  159.274   2.4612  161.036   2.3766 -1.762115 3.421385 
1 1 1   12    6   23 o   24.680   4.0737   25.539   7.9097   29.680   12.743   22.944   10.089   26.393   6.0521   23.214   5.4288 3.179073 8.130152 
1 1 1   12    6   24 o  157.560   1.7238  1012.25   22.140  1007.35   31.647  1016.95   30.985  157.142   2.4706  157.893   2.4074 -0.7507629 3.449584 
1 1 1   12    6   25 o   84.513   1.8255  291.251   12.576  303.359   18.214  280.219   17.385   86.191   2.5954   82.836   2.5779 3.354469 3.658030 
1 1 1   12    6   26 o  238.552   2.0290  2320.82   39.454  2305.32   55.642  2336.50   55.953  237.680   2.8719  239.282   2.8687 -1.602478 4.059214 
1 1 1   12    6   27 o  110.281   1.5603  495.871   14.026  518.959   22.297  480.750   18.044  112.790   2.4252  108.572   2.0388 4.217255 3.168306 
1 1 1   12    6   28 o  153.363   1.7038  959.053   21.299  958.374   30.670  959.687   29.602  153.272   2.4548  153.382   2.3676 -0.1099243 3.410506 
1 1 1   12    6   29 o  165.868   1.7368  1121.85   23.483  1111.82   33.599  1131.43   32.835  165.083   2.4968  166.537   2.4187 -1.454285 3.476234 
1 1 1   12    6   30 o  120.869   1.8223  595.754   17.955  578.879   28.811  606.469   22.958  119.093   2.9678  121.932   2.3098 -2.838791 3.760772 
1 1 1   12    6   31 f  163.075   1.8879  1084.51   25.097  1072.99   40.136  1091.90   32.159  162.133   3.0369  163.600   2.4115 -1.467194 3.877841 
1 1 1   12    6   32 o  156.744   1.8701  1001.93   23.895  1017.29   38.529  992.331   30.460  157.870   2.9940  155.963   2.3959 1.907364 3.834616 
1 1 1   12    6   33 o   62.819   2.2293  161.173   11.398  156.229   18.674  164.109   14.389   61.729   3.7285   63.352   2.7931 -1.622948 4.658668 
1 1 1   12    6   34 o   88.594   1.9203  320.102   13.868  292.740   22.199  337.616   17.760   84.614   3.2244   90.938   2.3979 -6.324394 4.018346 
1 1 1   12    6   35 o   51.012   2.6420  106.475   10.949   86.432   18.056  118.131   13.769   45.693   4.9253   53.698   3.1597 -8.004921 5.851698 
1 1 1   12    6   36 o  112.631   1.8846  517.363   17.302  478.369   27.585  542.653   22.216  108.198   3.1310  115.330   2.3631 -7.132042 3.922654 
1 1 1   12    6   37 o  302.544   2.5956  3735.23   64.013  3779.78  102.767  3706.99   81.826  304.053   4.1464  301.278   3.3319 2.775085 5.319182 
1 1 1   12    6   38 o  240.239   2.2545  2354.55   44.149  2316.85   69.743  2379.75   57.030  238.134   3.5929  241.447   2.8977 -3.312439 4.615775 
1 1 1   12    6   39 o   87.776   2.2871  314.550   16.350  333.465   24.674  299.742   21.831   90.293   3.3582   85.619   3.1333 4.673416 4.592965 
1 1 1   12    6   40 o  233.843   2.8715  2232.33   54.736  2171.83   95.318  2262.10   66.859  230.256   5.0784  235.307   3.4857 -5.051163 6.159574 
1 1 1   12    6   41 o   88.992   2.6771  323.529   19.398  284.643   36.155  339.246   22.986   83.165   5.3619   91.095   3.1001 -7.929955 6.193552 
1 1 1   12    6   42 o  220.862   2.7793  1991.17   50.037  2019.16   89.272  1978.35   60.421  222.046   4.9322  220.071   3.3681 1.974792 5.972466 
1 1 1   12    6   43 o  139.540   2.4381  794.566   27.733  757.975   49.826  810.990   33.381  136.018   4.5001  140.939   2.9056 -4.921326 5.356657 
1 1 1   12    6   44 o   47.385   2.9367   92.032   11.288  105.554   19.580   85.301   13.814   50.542   4.8104   45.527   3.7557 5.014732 6.102859 
1 1 1   12    6   45 o   96.022   1.9681  376.109   15.405  379.043   25.687  374.460   19.251   96.268   3.2781   95.756   2.4684 0.5116196 4.103574 
1 1 1   12    6   46 o  209.134   2.0920  1784.39   35.663  1790.55   57.297  1780.50   45.565  209.329   3.3579  208.838   2.6766 0.4903107 4.294149 
1 1 1   12    6   47 o   93.259   1.9447  354.799   14.784  357.679   24.954  353.242   18.351   93.502   3.2792   93.000   2.4228 0.5021439 4.077125 
1 1 1   12    6   48 f  164.142   1.9201  1099.12   25.690  1114.97   41.791  1089.50   32.572  165.199   3.1034  163.375   2.4458 1.823959 3.951333 
1 1 1   12    6   49 o  149.269   2.1756  909.251   26.472  916.220   37.658  902.444   37.219  149.746   3.0851  148.617   3.0723 1.128525 4.353911 
1 1 1   12    6   50 f   41.690   3.0232   71.387   10.204   79.989   18.182   67.431   12.329   43.841   5.1881   40.421   3.7859 3.420174 6.422576 
1 1 1   12    6   51 o  126.606   1.8528  653.939   19.122  658.610   31.447  651.198   24.087  126.954   3.0387  126.304   2.3395 0.6495361 3.834991 
1 1 1   12    6   52 o   96.479   1.8327  379.753   14.413  379.520   22.596  379.913   18.715   96.337   2.8806   96.467   2.3800 -0.1299133 3.736637 
1 1 1   12    6   53 o  101.979   1.8119  424.290   15.062  433.600   23.749  418.025   19.481  102.979   2.8318  101.188   2.3618 1.791016 3.687476 
1 1 1   12    6   54 o  179.831   1.8440  1319.49   27.031  1311.42   40.003  1326.27   36.668  179.163   2.7391  180.211   2.4962 -1.047928 3.705888 
1 1 1   12    6   55 o   57.126   2.3443  133.477   10.893  127.878   18.111  136.650   13.636   55.721   4.0143   57.749   2.9060 -2.027634 4.955739 
1 1 1   12    6   56 o   66.720   2.0966  181.896   11.389  192.056   18.875  176.080   14.281   68.423   3.3948   65.591   2.6766 2.832077 4.323092 
1 1 1   12    6   57 o   62.820   2.1916  161.324   11.205  140.616   18.278  173.793   14.183   58.452   3.8578   65.160   2.6760 -6.707474 4.695052 
1 1 1   12    6   58 o  175.673   2.0125  1259.76   28.818  1260.19   39.126  1259.25   42.607  175.588   2.7336  175.476   2.9787 0.1124268 4.042927 
1 1 1   12    6   59 o   71.609   2.2090  209.601   12.879  196.925   19.083  220.204   17.454   69.271   3.3899   73.322   2.9261 -4.051056 4.478103 
1 1 1   12    6   60 o   73.565   2.3952  221.325   14.344  201.589   25.215  230.768   17.441   69.904   4.4481   75.066   2.8555 -5.161346 5.285784 
1 1 1   12    6   61 o   87.176   2.0172  310.290   14.335  324.113   27.726  305.247   16.747   88.809   3.8391   86.402   2.3800 2.407249 4.516963 
1 1 1   12    6   62 o  150.490   1.9372  924.627   23.764  950.613   41.651  912.084   28.936  152.328   3.3543  149.401   2.3760 2.927704 4.110615 
1 1 1   12    6   63 o   37.550   3.9463   58.522   11.899   53.223   16.299   64.569   17.411   35.400   5.8526   39.125   5.6204 -3.725113 8.114310 
1 1 1   12    6   64 o  120.501   2.0247  593.054   19.888  595.974   26.319  589.167   30.364  120.703   2.6750  119.895   3.1095 0.8077545 4.101767 
1 1 1   12    6   65 f   93.361   2.1782  356.164   16.577  343.520   22.104  372.415   25.059   91.541   2.9661   95.267   3.2316 -3.725395 4.386476 
1 1 1   12    6   66 o  100.696   1.9894  414.208   16.329  381.379   29.538  428.656   19.595   96.267   3.7715  102.391   2.3478 -6.123924 4.442526 
1 1 1   12    6   67 o   90.772   1.9097  336.575   14.130  303.665   22.180  359.054   18.331   85.993   3.1696   93.662   2.4030 -7.668671 3.977549 
1 1 1   12    6   68 o   88.643   2.1105  321.198   15.250  303.998   22.318  336.263   20.886   86.017   3.1885   90.548   2.8332 -4.530479 4.265398 
1 1 1   12    6   69 f   20.813   5.1236   18.683   8.6332   22.274   15.515   17.072   10.390   23.070   7.3360   20.054   5.9371 3.015646 9.437423 
1 1 1   12    6   70 o   84.655   1.8399  292.833   12.696  313.711   20.749  280.337   16.053   87.406   2.9163   82.724   2.3830 4.681252 3.766107 
1 1 1   12    6   71 o  105.383   1.8636  453.897   16.009  459.103   23.220  449.181   22.101  105.792   2.6948  104.699   2.5895 1.092972 3.737375 
1 1 1   12    6   72 o   67.752   1.9383  187.848   10.694  178.242   17.496  193.577   13.511   65.748   3.2749   68.702   2.4164 -2.954048 4.069895 
1 1 1   12    6   73 o   61.809   1.9618  156.422   9.8717  160.492   16.428  154.122   12.350   62.364   3.2427   61.269   2.4779 1.095280 4.081108 
1 1 1   12    6   74 f   79.450   1.7880  258.102   11.580  246.006   18.401  266.033   14.900   77.305   2.9254   80.551   2.2715 -3.246178 3.703752 
1 1 1   12    6   75 o   75.754   1.8919  234.799   11.683  247.072   21.972  229.962   13.794   77.274   3.4972   74.874   2.2627 2.399574 4.165369 
1 1 1   12    6   76 o   19.076   4.4921   15.770   6.8690 -13.5734   15.694   22.723   7.6395   12.941   6.0402   23.031   4.2249 -10.09076 7.371099 
1 1 1   12    6   77 o   49.401   2.2348  100.295   8.9761   97.867   18.316  101.063   10.297   48.115   4.7310   49.527   2.5593 -1.411579 5.378929 
1 1 1   12    6   78 o   50.677   1.7510  105.230   7.2225  113.353   15.523  102.986   8.1594   52.140   3.6760   50.092   2.0023 2.047428 4.185942 
1 1 1   12    6   79 o   31.483   2.2665   40.904   5.7776   65.172   16.484   37.505   6.1689   38.873   5.3432   30.090   2.5387 8.783131 5.915599 
1 1 1   12    6   80 o   60.527   1.6696  150.081   8.2297  151.199   19.215  149.830   9.1074   60.058   3.9468   60.441   1.8507 -0.3833313 4.359156 
1 1 1   12    6   81 o   43.755   3.7751   80.448   13.333   83.581   17.293   75.856   20.936   44.170   4.8846   41.345   6.4202 2.825241 8.067122 
1 1 1   12    6   82 o   46.274   3.6121   89.817   13.517   88.527   17.425   91.766   21.420   45.467   4.7726   45.750   5.8794 -0.2830696 7.572652 
1 1 1   12    6   83 o   27.235   5.6358   33.064   12.099   33.709   21.346   32.758   14.686   26.785   8.6142   26.724   6.7428 0.6133842E-01 10.93938 
1 1 1   12    6   84 o   62.670   2.3904  162.142   12.189  156.480   16.173  169.587   18.546   61.234   3.2519   63.592   3.5923 -2.358040 4.845536 
1 1 1   12    6   85 o   19.964   5.6009   17.863   9.4829   1.5778   12.645   38.797   14.336   14.336   6.1209   29.209   6.2124 -14.87311 8.721149 
1 1 1   12    6   86 o   10.878   4.8894  -3.4242   9.0569   5.1937   12.145 -14.2218   13.594   15.155   6.1964   11.450   5.4291 3.705387 8.238330 
1 1 1   12    6   87 o   38.543   3.2421   62.466   10.092   56.028   13.369   70.994   15.387   35.899   4.6801   40.427   4.7604 -4.527992 6.675660 
1 1 1   12    6   88 o   51.387   2.5213  109.591   10.529  106.356   14.467  113.234   15.353   50.176   3.5601   51.727   3.6648 -1.550541 5.109339 
1 1 1   12    6   89 o   45.854   2.7561   87.698   10.254   86.749   14.334   88.693   14.675   45.076   3.9407   45.554   3.9923 -0.4786873 5.609617 
1 1 1   12    6   90 o   26.396   5.1819   31.310   10.751   41.384   13.368   12.859   18.092   30.213   5.6351   19.240   7.6699 10.97283 9.517421 
1 1 1   12    6   91 o   21.898   5.7885   22.150   10.488   19.964   12.806   26.602   18.274   20.784   6.6710   23.537   7.9870 -2.753916 10.40647 
1 1 1   12    6   92 o   11.935   5.0961   1.0454   8.7657  -4.3641   12.335   6.5649   12.459   12.481   5.6492   15.509   6.3005 -3.027988 8.462276 
1 1 1   12    6   93 o   24.539   4.7672   27.016   9.1923   37.286   13.218   17.396   12.792   28.321   5.9166   19.558   6.6817 8.763172 8.924694 
1 1 1   12    6   94 o   11.658   5.1323  -0.9775   9.4631   1.0865   15.222  -2.2776   12.081   14.984   6.5553   12.755   5.6966 2.228520 8.684669 
1 1 1   12    6   95 o   27.536   4.6483   33.979   10.062   25.554   16.750   38.738   12.587   22.650   7.6468   28.928   5.5395 -6.278214 9.442428 
1 1 1   12    6   96 o   24.841   5.1672   28.499   10.122   50.231   16.834   16.193   12.667   32.104   6.6515   18.772   6.6350 13.33109 9.394981 
1 1 1   12    6   97 o   10.165   4.7472  -7.2035   9.7162 -21.8608   15.859   1.6042   12.294   11.222   5.4568   13.669   5.9368 -2.446487 8.063615 
1 1 1   12    6   98 o   20.544   5.3567   20.058   9.0616   22.441   12.964   17.782   12.671   21.156   6.7034   19.188   6.6462 1.967659 9.439698 
1 1 1   12    6   99 o   29.224   4.0700   38.038   9.4327   52.487   13.632   24.764   13.066   33.625   5.1360   22.034   6.6891 11.59148 8.433415 
1 1 1   12    6  100 o   30.534   3.8704   41.309   9.4173   32.220   13.433   50.093   13.206   25.141   6.5056   32.758   5.1123 -7.617487 8.273945 
1 1 1   12    6  101 o   33.654   3.4997   49.550   9.4605   44.233   13.445   54.764   13.314   30.202   5.6696   34.342   4.8944 -4.140663 7.489960 
1 1 1   12    6  102 o   18.265   5.6003   16.469   9.1286   2.3878   13.104   29.747   12.724   13.803   6.0592   23.927   6.3995 -10.12403 8.812965 
1 1 1   12    6  103 o   43.832   3.1670   83.365   11.239   56.944   17.519  101.847   14.652   32.862   6.7656   47.860   3.7865 -14.99792 7.753150 
1 1 1   12    6  104 o   8.5813   4.1858 -14.2872   9.5378 -16.4480   15.103 -12.8538   12.301   11.161   5.4032   10.344   4.9745 0.8177538 7.344433 
1 1 1   12    6  105 o   11.252   5.0688  -1.3891   9.7942   22.901   15.609 -17.1644   12.579   20.125   7.3340   9.8587   4.8085 10.26665 8.769758 
1 1 1   12    6  106 o   12.627   5.3897   3.4814   9.7997  -6.4820   15.655   9.9015   12.567   12.754   5.9787   15.510   6.3175 -2.756223 8.698002 
1 1 1   12    6  107 o   14.528   5.7305   8.8378   9.9993   16.367   16.453   4.4280   12.592   17.883   7.2491   13.860   6.0142 4.023281 9.419139 
1 1 1   12    6  108 o   18.086   5.8994   17.075   9.9908   14.178   16.025   18.916   12.778   17.141   7.0746   18.613   6.6552 -1.472248 9.712934 
1 1 1   12    6  109 o   11.951   5.2488   1.5076   9.8439   1.3073   16.029   1.6288   12.473   14.109   6.4075   13.030   5.8058 1.079506 8.646565 
1 1 1   12    6  110 o   11.473   5.2343  -2.0485   10.855  -3.4618   15.991  -0.8408   14.782   13.192   6.1371   13.264   6.0731 -0.7245827E-01 8.633978 
1 1 1   12    6  111 o   24.961   6.7791   35.350   14.147   34.886   17.242   36.306   24.747   23.477   7.7550   22.084   8.9127 1.393208 11.81423 
1 1 1   12    6  112 f   14.301   6.2238   5.9116   13.568   1.1787   16.401   16.171   24.148   14.044   6.4176   17.961   8.0353 -3.916795 10.28358 
1 1 1   12    6  113 o   12.813   5.8516  -0.5358   13.609   0.2171   16.747  -1.9996   23.351   13.924   6.4078   15.129   7.1565 -1.205789 9.605963 
1 1 1   12    6  114 o   10.842   5.1903 -10.2331   13.048 -18.8041   16.032   6.5831   22.456   10.967   5.3659   16.072   7.4049 -5.104994 9.144703 
1 1 1   12    6  115 o   24.313   7.8835   39.028   17.855   39.028   17.855   0.0000   0.0000   24.313   7.8835  ?   ?  0.000000 7.883528 
1 1 1   12    6  116 o   12.304   5.8684  -8.7720   16.358  -8.7720   16.358   0.0000   0.0000   12.304   5.8684  ?   ?  0.000000 5.868388 
1 1 1   12    6  117 o   19.578   8.4018   26.260   24.047   26.260   24.047   0.0000   0.0000   19.578   8.4018  ?   ?  0.000000 8.401770 
1 1 1   12    7 -114 o   16.603   6.6355   14.544   13.576   14.544   13.576   0.0000   0.0000   16.603   6.6355  ?   ?  0.000000 6.635457 
1 1 1   12    7 -113 o   13.349   5.7629   5.0904   11.444   8.9104   12.917  -8.8545   24.679   14.793   6.2457   14.443   6.9711 0.3493748 9.359779 
1 1 1   12    7 -112 o   13.386   5.7611   5.2809   11.368   9.4955   12.859  -9.7994   24.325   14.958   6.2686   14.282   6.9000 0.6765194 9.322269 
1 1 1   12    7 -111 o   10.968   5.1210  -4.8483   11.293  -9.6993   12.817   11.995   23.883   10.812   5.1672   17.043   7.7712 -6.230279 9.332272 
1 1 1   12    7 -110 o   33.835   4.7035   55.164   12.622   60.422   14.184   35.154   27.671   34.938   5.1333   21.157   9.0445 13.78183 10.39968 
1 1 1   12    7 -109 o   16.645   6.0577   14.463   10.644   16.257   13.407   11.403   17.506   17.339   6.6935   16.340   7.0907 0.9989452 9.750993 
1 1 1   12    7 -108 o   23.600   5.7920   29.226   11.058   30.907   13.766   26.168   18.566   23.170   6.8270   20.263   7.8619 2.907553 10.41233 
1 1 1   12    7 -107 o   29.742   4.8098   42.685   11.263   41.288   14.106   45.142   18.709   27.614   6.3928   26.721   7.9806 0.8931751 10.22536 
1 1 1   12    7 -106 o   14.502   5.8131   8.7777   10.451   19.545   13.108 -10.0067   17.314   18.743   6.7359   12.662   6.0388 6.080608 9.046505 
1 1 1   12    7 -105 o   12.253   5.5524  -0.9123   11.959   1.9051   16.564  -3.9801   17.284   14.395   6.5278   13.580   6.3388 0.8148756 9.099045 
1 1 1   12    7 -104 o   27.920   4.8388   37.409   10.614   32.535   13.297   45.969   17.620   24.415   6.5471   27.974   7.5522 -3.558905 9.995035 
1 1 1   12    7 -103 o   15.679   5.8591   11.582   10.070   6.5508   12.443   21.134   17.144   14.437   6.1143   19.359   7.5427 -4.922359 9.709626 
1 1 1   12    7 -102 o   8.8328   4.2847 -12.8274   9.6243 -28.6579   11.873   17.499   16.434   8.2353   4.1272   18.335   7.3096 -10.09981 8.394316 
1 1 1   12    7 -101 o   29.487   5.3274   42.414   12.334   33.184   17.004   52.662   17.917   23.676   7.6946   30.809   7.2550 -7.132956 10.57548 
1 1 1   12    7 -100 o   17.561   6.3539   15.414   11.687   33.081   16.646  -1.7619   16.413   23.887   7.5990   13.967   6.3966 9.920334 9.932857 
1 1 1   12    7  -99 f   23.480   6.7411   29.441   13.579   18.880   21.332   36.635   17.606   19.461   8.1087   25.195   7.7869 -5.734013 11.24217 
1 1 1   12    7  -98 o   18.650   4.9763   16.617   7.7052   10.031   12.388   20.774   9.8405   15.892   6.3428   20.483   5.6905 -4.590694 8.521324 
1 1 1   12    7  -97 o   9.2757   4.2485  -3.5922   7.2432   1.6395   11.731  -6.8157   9.2081   13.210   5.7676   9.8173   4.5967 3.393029 7.375299 
1 1 1   12    7  -96 o   22.095   4.2074   22.125   7.3011   13.754   10.674   29.486   10.009   17.209   6.0898   25.072   5.0718 -7.863075 7.925159 
1 1 1   12    7  -95 o   14.322   5.0054   8.8122   7.1951   10.912   10.760   7.1136   9.6771   16.103   6.0483   14.286   5.6367 1.817000 8.267640 
1 1 1   12    7  -94 o   11.748   4.7882   3.3598   7.2243  -5.2076   10.907   10.056   9.6427   11.288   5.1863   15.568   5.7492 -4.279220 7.742840 
1 1 1   12    7  -93 o   24.127   3.9252   25.679   7.4547   30.585   11.471   22.093   9.8080   25.433   5.6771   21.617   5.5409 3.816038 7.932873 
1 1 1   12    7  -92 f   18.933   4.9724   16.505   7.7711   29.433   11.168   4.3728   10.820   25.059   5.6078   13.945   5.7896 11.11494 8.060144 
1 1 1   12    7  -91 o   35.471   2.9643   53.170   8.4927   49.369   11.908   57.104   12.115   33.427   4.4833   36.154   4.1884 -2.726479 6.135385 
1 1 1   12    7  -90 o   48.209   2.4986   96.880   9.7855  115.245   15.069   83.488   12.868   52.002   3.5766   44.213   3.6016 7.788998 5.075791 
1 1 1   12    7  -89 o   41.004   2.7543   70.415   9.1526   69.589   13.939   71.041   12.135   39.982   4.3469   40.758   3.6925 -0.7762108 5.703523 
1 1 1   12    7  -88 o   42.360   2.6945   74.966   9.2557   80.209   14.011   70.907   12.329   43.190   4.0262   40.728   3.7558 2.461998 5.506052 
1 1 1   12    7  -87 o   20.458   5.2134   19.017   8.7180   26.336   12.750   12.591   11.947   23.660   6.4398   17.591   6.4155 6.068989 9.090079 
1 1 1   12    7  -86 o   11.820   5.0141   1.2301   8.3904  -3.6272   11.756   6.2727   11.979   12.396   5.5712   15.313   6.1934 -2.917732 8.330474 
1 1 1   12    7  -85 o   15.978   5.4570   10.671   8.5325   18.203   12.163   3.3723   11.973   20.070   6.5065   14.415   6.0453 5.655039 8.881446 
1 1 1   12    7  -84 o   13.709   5.1861   6.3795   7.9425   12.535   11.827   1.3235   10.719   17.648   6.3909   13.203   5.6364 4.444812 8.521306 
1 1 1   12    7  -83 o   37.689   3.4566   59.981   10.501   82.850   15.469   40.434   14.302   43.914   4.3797   29.777   6.0975 14.13739 7.507432 
1 1 1   12    7  -82 o   36.962   3.0204   57.175   9.0211   59.031   11.704   54.459   14.160   37.239   3.9140   35.254   5.0732 1.984573 6.407536 
1 1 1   12    7  -81 o   61.982   2.1179  158.249   10.685  148.156   13.500  175.170   17.480   59.742   2.7798   64.725   3.3243 -4.982300 4.333407 
1 1 1   12    7  -80 o   35.403   3.0883   52.429   8.8233   37.026   11.221   77.383   14.282   29.107   4.9032   42.660   4.1598 -13.55312 6.430055 
1 1 1   12    7  -79 o   29.652   3.6167   37.223   8.5613   39.845   13.068   35.252   11.332   29.999   5.5484   28.348   5.0910 1.650869 7.530155 
1 1 1   12    7  -78 o   65.364   1.9056  175.417   10.142  178.394   14.117  172.242   14.581   65.697   2.6415   64.504   2.7797 1.192772 3.834587 
1 1 1   12    7  -77 o   75.920   1.7850  236.180   11.047  241.322   15.106  230.270   16.196   76.532   2.4245   74.674   2.6650 1.858711 3.602827 
1 1 1   12    7  -76 o   27.847   3.5567   32.722   7.8894   23.751   11.171   41.649   11.143   23.081   5.9120   31.180   4.5157 -8.098228 7.439285 
1 1 1   12    7  -75 o   17.021   5.0172   12.475   7.4334   4.9554   10.426   20.247   10.601   14.498   5.8080   21.402   5.8911 -6.903805 8.272696 
1 1 1   12    7  -74 o   25.064   3.8702   26.698   7.6527   30.961   10.753   22.323   10.893   26.676   5.1314   22.467   5.8806 4.209803 7.804701 
1 1 1   12    7  -73 o   73.959   1.7872  223.850   10.774  231.935   15.071  215.398   15.409   75.105   2.4650   72.334   2.6177 2.770576 3.595656 
1 1 1   12    7  -72 o  122.716   1.7061  615.907   17.066  602.422   24.587  628.446   23.708  121.128   2.4902  123.767   2.3499 -2.638397 3.423897 
1 1 1   12    7  -71 o   14.793   5.2965   7.9552   8.0964   2.9039   12.207   11.923   10.818   14.794   6.1465   17.576   6.1380 -2.781872 8.686495 
1 1 1   12    7  -70 o   21.512   4.7788   20.031   8.1619   52.227   12.281  -5.4433   10.924   35.197   4.3745   11.777   5.3247 23.42006 6.891219 
1 1 1   12    7  -69 o   79.554   1.8568  258.806   12.041  287.099   18.089  236.297   16.134   83.604   2.6577   75.849   2.6135 7.754761 3.727428 
1 1 1   12    7  -68 o   66.845   1.6409  182.553   8.9408  169.873   14.494  190.341   11.360   64.280   2.7727   68.180   2.0463 -3.900215 3.445985 
1 1 1   12    7  -67 o   77.426   1.5783  244.837   9.9615  239.591   15.885  248.238   12.788   76.421   2.5536   77.885   2.0160 -1.463158 3.253479 
1 1 1   12    7  -66 o   39.615   2.3651   64.470   7.6028   72.651   13.100   60.315   9.3357   41.799   3.8895   38.216   3.0214 3.583302 4.925198 
1 1 1   12    7  -65 o   40.915   2.3579   68.734   7.8307   85.773   13.585   60.257   9.5827   45.501   3.6946   38.191   3.1049 7.309200 4.826060 
1 1 1   12    7  -64 o  124.789   1.5139  635.698   15.400  645.284   23.433  628.410   20.432  125.598   2.2888  123.994   2.0215 1.603539 3.053685 
1 1 1   12    7  -63 o   92.192   1.6365  347.020   12.298  400.857   20.153  315.073   15.524   98.939   2.5008   87.788   2.1694 11.15136 3.310613 
1 1 1   12    7  -62 o  109.197   1.4504  486.612   12.910  492.542   18.438  480.908   18.083  109.788   2.0603  108.486   2.0448 1.302193 2.902731 
1 1 1   12    7  -61 o   46.811   2.2490   89.777   8.5567   87.498   13.509   91.303   11.058   46.020   3.6306   47.130   2.8922 -1.109844 4.641789 
1 1 1   12    7  -60 o  147.359   1.6012  886.260   19.234  921.656   27.126  850.472   27.276  150.177   2.2159  144.243   2.3198 5.934402 3.208035 
1 1 1   12    7  -59 o   41.316   2.9152   70.220   9.7549   75.875   13.961   64.826   13.635   42.779   4.0520   39.466   4.3084 3.313660 5.914460 
1 1 1   12    7  -58 o   93.871   1.7807  359.704   13.626  340.497   19.232  379.061   19.307   91.216   2.5892   96.265   2.4624 -5.049026 3.573159 
1 1 1   12    7  -57 o   40.769   2.3770   68.151   7.8651   70.108   13.533   67.152   9.6650   41.116   4.0920   40.402   2.9551 0.7138786 5.047545 
1 1 1   12    7  -56 o   29.255   3.0649   35.407   7.2005   43.836   11.553   30.052   9.2077   32.348   4.5032   26.701   4.3824 5.647490 6.283655 
1 1 1   12    7  -55 o  139.326   1.4565  791.885   16.541  766.078   23.783  816.065   23.022  136.967   2.1302  141.381   1.9976 -4.414398 2.920300 
1 1 1   12    7  -54 o   99.531   1.5875  404.174   12.879  392.141   18.218  416.196   18.210   97.985   2.2809  100.952   2.2129 -2.966805 3.177989 
1 1 1   12    7  -53 o   81.246   1.6788  269.331   11.118  251.523   15.905  286.349   15.548   78.422   2.4912   83.703   2.2809 -5.280632 3.377599 
1 1 1   12    7  -52 o   87.434   1.7887  311.961   12.748  325.946   16.978  293.883   19.303   89.304   2.3342   84.743   2.7982 4.561317 3.643945 
1 1 1   12    7  -51 o   80.997   1.6050  267.641   10.597  262.055   16.158  271.856   14.037   80.057   2.4790   81.577   2.1128 -1.520103 3.257219 
1 1 1   12    7  -50 o   40.746   2.4147   68.043   7.9842   58.489   12.830   74.082   10.200   37.524   4.2703   42.466   2.9653 -4.941212 5.198888 
1 1 1   12    7  -49 o  102.912   1.5054  431.989   12.629  440.749   19.008  425.068   16.897  103.902   2.2443  102.053   2.0312 1.849533 3.026977 
1 1 1   12    7  -48 o  133.682   1.4760  728.876   16.084  754.247   23.948  708.028   21.708  135.934   2.1612  131.715   2.0219 4.218353 2.959538 
1 1 1   12    7  -47 o  103.697   1.5888  438.608   13.430  431.148   21.958  443.066   16.975  102.709   2.6249  104.199   1.9985 -1.490280 3.299113 
1 1 1   12    7  -46 o   72.529   1.7790  214.605   10.518  198.312   17.511  223.800   13.155   69.587   3.0948   74.017   2.1828 -4.430214 3.787113 
1 1 1   12    7  -45 o  111.630   1.5741  508.250   14.323  493.011   22.995  517.911   18.309  109.878   2.5674  112.661   1.9937 -2.783112 3.250531 
1 1 1   12    7  -44 o  141.345   1.9702  815.160   22.700  830.476   38.882  807.241   27.960  142.521   3.3468  140.616   2.4393 1.904388 4.141406 
1 1 1   12    7  -43 o  115.299   1.7300  542.266   16.260  533.907   31.908  545.197   18.897  114.220   3.4310  115.594   2.0055 -1.374557 3.974145 
1 1 1   12    7  -42 o   88.676   1.8190  320.773   13.148  335.762   27.677  316.405   14.942   90.520   3.7592   88.059   2.0816 2.460831 4.297021 
1 1 1   12    7  -41 o  114.614   1.5860  535.739   14.818  559.429   24.271  521.662   18.709  117.062   2.5435  113.075   2.0298 3.987083 3.254150 
1 1 1   12    7  -40 o  135.089   1.5835  744.239   17.437  719.641   27.580  760.617   22.505  132.774   2.5483  136.542   2.0220 -3.767487 3.253016 
1 1 1   12    7  -39 o   10.165   4.6370  -5.6040   8.5140  -6.9627   20.359  -5.3160   9.3729   16.810   7.4579   10.878   4.9238 5.932178 8.936729 
1 1 1   12    7  -38 o   80.007   1.7766  261.078   11.586  229.338   18.794  280.535   14.715   74.869   3.0861   82.891   2.1797 -8.022079 3.778244 
1 1 1   12    7  -37 o  100.347   1.6710  410.655   13.668  433.005   22.623  397.806   17.153  102.956   2.6980   98.746   2.1310 4.210289 3.438071 
1 1 1   12    7  -36 o  221.717   2.1725  2005.56   39.264  1927.01   62.850  2055.84   50.285  217.151   3.5506  224.412   2.7489 -7.260483 4.490347 
1 1 1   12    7  -35 o   67.546   2.3133  186.376   12.718  134.667   22.143  211.835   15.537   57.149   4.7975   71.993   2.6520 -14.84429 5.481719 
1 1 1   12    7  -34 o   94.492   2.0500  364.218   15.790  332.437   27.424  379.978   19.313   90.110   3.7417   96.466   2.4580 -6.355675 4.476902 
1 1 1   12    7  -33 o   60.884   2.5122  151.529   12.441  209.303   22.213  125.120   15.018   71.455   3.8275   55.244   3.3507 16.21162 5.086969 
1 1 1   12    7  -32 o   26.601   5.1696   29.978   10.806 -14.6301   18.507   53.052   13.310   14.537   6.7066   35.699   4.6871 -21.16185 8.182161 
1 1 1   12    7  -31 o   84.315   1.9827  289.973   13.627  317.093   21.852  272.715   17.431   88.071   3.0484   81.702   2.6207 6.368690 4.020074 
1 1 1   12    7  -30 f   37.025   3.4089   56.469   10.173   38.124   15.722   69.680   13.342   29.880   6.6286   41.087   4.0357 -11.20732 7.760461 
1 1 1   12    7  -29 o  130.846   1.7692  698.210   18.870  679.863   27.876  713.729   25.637  129.068   2.6495  132.261   2.3779 -3.192703 3.560146 
1 1 1   12    7  -28 o  109.010   1.7937  484.615   15.938  499.270   24.101  473.223   21.248  110.605   2.6731  107.694   2.4205 2.910828 3.606149 
1 1 1   12    7  -27 o  142.842   1.9959  832.210   23.239  866.573   31.134  788.978   34.922  145.723   2.6210  139.012   3.0818 6.710464 4.045681 
1 1 1   12    7  -26 o  257.499   2.3877  2705.22   50.118  2693.30   65.094  2722.55   78.538  256.840   3.1091  258.132   3.7325 -1.291962 4.857832 
1 1 1   12    7  -25 o   79.940   2.2285  260.888   14.507  265.580   19.161  254.586   22.206   80.609   2.9210   78.875   3.4623 1.734123 4.529848 
1 1 1   12    7  -24 o  214.921   1.9603  1883.89   34.343  1897.49   49.595  1871.36   47.604  215.619   2.8217  214.138   2.7272 1.480423 3.924222 
1 1 1   12    7  -23 o   79.106   1.7599  255.185   11.348  253.432   18.520  256.239   14.360   78.745   2.8901   79.225   2.2257 -0.4798050 3.647851 
1 1 1   12    7  -22 o   26.713   4.1246   29.847   8.6926   30.476   16.945   29.622   10.126   26.830   7.4724   26.493   4.8684 0.3369484 8.918410 
1 1 1   12    7  -21 o  166.433   1.6382  1129.48   22.225  1077.96   34.474  1166.13   29.073  162.537   2.6020  169.086   2.1093 -6.549103 3.349564 
1 1 1   12    7  -20 o  118.926   1.5783  576.690   15.300  623.589   25.138  549.095   19.283  123.630   2.4945  116.030   2.0388 7.599358 3.221652 
1 1 1   12    7  -19 o  130.385   1.5823  693.164   16.817  673.114   26.512  706.664   21.753  128.444   2.5322  131.631   2.0274 -3.186905 3.243772 
1 1 1   12    7  -18 o  239.150   1.8896  2332.38   36.837  2337.41   57.274  2328.83   48.107  239.310   2.9360  238.919   2.4701 0.3907013 3.836908 
1 1 1   12    7  -17 f   67.244   1.8882  184.546   10.340  181.349   17.031  186.412   13.012   66.577   3.1471   67.557   2.3666 -0.9799576 3.937643 
1 1 1   12    7  -16 o  172.939   1.7753  1219.58   25.027  1194.49   35.965  1243.14   34.848  171.103   2.5786  174.562   2.4490 -3.458832 3.556238 
1 1 1   12    7  -15 o   63.467   2.1071  164.470   10.886  155.493   16.589  171.260   14.427   61.624   3.3145   64.726   2.7406 -3.101856 4.300797 
1 1 1   12    7  -14 o   63.736   2.1120  165.868   10.958  193.399   17.035  146.438   14.311   68.767   3.0466   59.828   2.9435 8.939320 4.236256 
1 1 1   12    7  -13 o  229.664   2.0026  2151.12   37.492  2144.19   53.897  2157.61   52.186  229.217   2.8846  229.943   2.7842 -0.7264252 4.009060 
1 1 1   12    7  -12 o   92.975   1.7976  352.497   13.624  336.365   20.191  365.979   18.459   90.752   2.7326   94.688   2.3934 -3.936096 3.632546 
1 1 1   12    7  -11 f  246.862   2.0583  2485.41   41.419  2493.82   72.048  2481.25   50.619  247.116   3.5767  246.615   2.5180 0.5008850 4.374151 
1 1 1   12    7  -10 o  293.793   2.3001  3520.80   55.084  3564.87   96.400  3499.44   67.121  295.383   4.0037  292.841   2.8119 2.541107 4.892434 
1 1 1   12    7   -9 o   63.810   2.0251  166.225   10.520  154.673   18.639  171.626   12.744   61.425   3.7402   64.818   2.4163 -3.393143 4.452813 
1 1 1   12    7   -8 o  285.868   2.2600  3333.32   52.663  3225.72   89.565  3390.18   65.108  280.999   3.9102  288.240   2.7710 -7.240997 4.792506 
1 1 1   12    7   -7 o  248.112   1.9107  2510.39   38.644  2508.04   59.131  2512.14   51.056  247.903   2.9262  248.147   2.5241 -0.2437134 3.864362 
1 1 1   12    7   -6 o  125.830   1.6623  645.590   17.051  639.780   30.012  648.359   20.719  125.207   2.9406  126.087   2.0159 -0.8803406 3.565197 
1 1 1   12    7   -5 o  187.531   1.8000  1434.05   27.515  1399.94   47.711  1451.05   33.680  185.193   3.1605  188.617   2.1906 -3.424530 3.845446 
1 1 1   12    7   -4 o  247.447   2.0624  2497.18   41.599  2453.25   71.694  2519.48   51.076  245.102   3.5884  248.510   2.5214 -3.408371 4.385670 
1 1 1   12    7   -3 o   51.881   2.2855  110.001   9.6419  116.389   17.664  107.290   11.507   53.214   4.1039   51.203   2.7673 2.011154 4.949769 
1 1 1   12    7   -2 o   74.254   1.7022  224.822   10.303  215.966   15.908  231.221   13.523   72.704   2.6889   75.260   2.2066 -2.556244 3.478419 
1 1 1   12    7   -1 o   62.044   1.8651  157.115   9.4221  162.171   14.979  153.805   12.120   62.971   2.9262   61.355   2.4282 1.615494 3.802443 
1 1 1   12    7    0 o  184.280   1.6521  1384.66   24.817  1404.15   38.545  1370.85   32.435  185.520   2.5488  183.332   2.1704 2.188385 3.347687 
1 1 1   12    7    1 o  143.463   1.5431  839.158   18.046  837.923   27.846  840.052   23.696  143.322   2.3835  143.521   2.0254 -0.1990051 3.127808 
1 1 1   12    7    2 o   39.020   2.6317   62.403   8.3218   59.225   13.353   64.421   10.641   37.810   4.4154   39.585   3.3287 -1.774929 5.529497 
1 1 1   12    7    3 o  159.831   1.8594  1041.73   24.225  1041.79   39.309  1041.69   30.760  159.768   3.0184  159.803   2.3614 -0.3529358E-01 3.832314 
1 1 1   12    7    4 o   68.596   1.9132  192.034   10.687  186.311   19.343  194.549   12.822   67.456   3.5301   69.025   2.2820 -1.568924 4.203418 
1 1 1   12    7    5 o  103.771   1.6929  439.086   14.320  425.746   25.872  444.978   17.194  102.083   3.1128  104.456   2.0193 -2.372734 3.710363 
1 1 1   12    7    6 o  231.632   2.1647  2188.33   40.873  2238.17   92.592  2176.26   45.552  233.921   4.8559  230.973   2.4194 2.948257 5.425215 
1 1 1   12    7    7 o   80.109   1.9407  261.710   12.673  272.372   28.822  259.155   14.110   81.516   4.3533   79.682   2.1744 1.833946 4.866121 
1 1 1   12    7    8 o  115.110   1.6401  540.265   15.390  569.096   27.135  526.594   18.685  118.094   2.8189  113.632   2.0173 4.461800 3.466333 
1 1 1   12    7    9 o  129.327   1.7907  682.016   18.878  676.249   30.013  685.791   24.282  128.730   2.8602  129.663   2.2974 -0.9337769 3.668624 
1 1 1   12    7   10 o  130.285   1.6544  692.110   17.569  670.052   25.071  713.397   24.629  128.162   2.3998  132.248   2.2847 -4.085938 3.313406 
1 1 1   12    7   11 f  114.322   1.5402  532.875   14.353  526.613   22.420  537.224   18.684  113.618   2.4207  114.773   1.9971 -1.155479 3.138219 
1 1 1   12    7   12 o  181.765   1.6445  1347.12   24.366  1377.98   37.983  1325.55   31.762  183.781   2.5354  180.276   2.1614 3.505585 3.331661 
1 1 1   12    7   13 o  162.240   1.5942  1073.24   21.083  1107.08   32.997  1049.89   27.408  164.733   2.4573  160.443   2.0957 4.290482 3.229544 
1 1 1   12    7   14 o  151.331   1.6942  933.811   20.899  918.592   29.696  948.744   29.417  150.057   2.4278  152.503   2.3663 -2.446350 3.390214 
1 1 1   12    7   15 o  176.960   1.7711  1276.95   25.547  1325.25   37.203  1233.86   35.143  180.229   2.5323  173.907   2.4791 6.321686 3.543801 
1 1 1   12    7   16 o   67.417   1.9666  185.514   10.796  188.480   15.825  182.931   14.765   67.899   2.8656   66.901   2.7131 0.9978867 3.946198 
1 1 1   12    7   17 f   60.313   1.9272  148.503   9.4627  137.502   14.945  155.864   12.225   57.950   3.1760   61.763   2.4330 -3.813168 4.000845 
1 1 1   12    7   18 o  147.200   1.6851  883.533   20.220  934.434   29.734  839.748   27.577  151.344   2.4102  143.475   2.3580 7.869720 3.371800 
1 1 1   12    7   19 o   35.631   2.8631   52.145   8.2458   46.205   13.385   55.778   10.468   33.219   5.1064   36.788   3.5342 -3.568554 6.210084 
1 1 1   12    7   20 o   69.787   1.8263  198.746   10.381  208.234   16.423  192.433   13.396   71.375   2.8284   68.638   2.3979 2.736702 3.708061 
1 1 1   12    7   21 o  106.986   1.5824  466.702   13.800  475.770   21.665  460.510   17.901  107.988   2.4612  106.258   2.0667 1.729988 3.213839 
1 1 1   12    7   22 o  190.167   1.6907  1474.65   26.209  1500.17   40.862  1456.81   34.161  191.742   2.6144  188.981   2.2176 2.760849 3.428186 
1 1 1   12    7   23 o   23.807   4.4052   23.913   8.2342   14.551   13.489   29.475   10.396   19.818   6.8577   26.403   5.0135 -6.585388 8.494955 
1 1 1   12    7   24 o  216.413   1.9344  1910.10   34.124  1900.88   59.565  1914.60   41.634  215.745   3.3870  216.634   2.3577 -0.8888397 4.126769 
1 1 1   12    7   25 o   73.750   1.8375  221.812   11.046  220.229   17.754  222.811   14.111   73.390   2.9738   73.865   2.3465 -0.4740372 3.788112 
1 1 1   12    7   26 o   41.513   2.7281   70.635   9.1806   76.974   15.393   67.134   11.438   43.156   4.4388   40.390   3.5088 2.766827 5.658167 
1 1 1   12    7   27 o  237.146   1.8978  2293.64   36.687  2304.72   56.805  2285.71   48.053  237.610   2.9328  236.680   2.4907 0.9299774 3.847730 
1 1 1   12    7   28 o  293.263   2.3448  3508.86   56.054  3471.27   78.926  3547.12   79.622  291.537   3.3212  294.707   3.3144 -3.169159 4.692072 
1 1 1   12    7   29 o  230.697   2.0488  2170.87   38.527  2165.24   54.846  2176.36   54.133  230.302   2.9215  230.899   2.8761 -0.5965576 4.099660 
1 1 1   12    7   30 f  162.623   2.0218  1078.73   26.801  1192.41   45.233  1017.23   33.271  170.870   3.2476  157.879   2.5852 12.99013 4.150907 
1 1 1   12    7   31 o   63.217   2.8316  163.465   14.554  181.357   19.204  139.320   22.309   66.528   3.5541   58.145   4.7481 8.383331 5.930931 
1 1 1   12    7   32 o  141.147   1.8662  812.556   21.471  819.548   31.702  806.631   29.184  141.696   2.7447  140.590   2.5466 1.106415 3.744097 
1 1 1   12    7   33 o  268.542   2.2343  2942.14   48.909  3030.49   71.626  2864.96   66.945  272.398   3.2258  264.875   3.1006 7.522736 4.474266 
1 1 1   12    7   34 o  108.499   2.2669  480.287   20.049  404.988   43.074  501.113   22.653   99.258   5.3434  110.813   2.5078 -11.55540 5.902609 
1 1 1   12    7   35 o  162.223   2.2048  1073.65   29.155  1023.69   60.313  1088.89   33.304  158.058   4.6864  163.347   2.5012 -5.288544 5.312092 
1 1 1   12    7   36 o  113.692   1.9546  527.247   18.114  487.496   42.679  535.981   20.006  108.995   4.8155  114.620   2.1412 -5.625198 5.270059 
1 1 1   12    7   37 o  211.536   2.1232  1825.57   36.611  1816.07   84.026  1827.80   40.675  210.539   4.8961  211.640   2.3577 -1.101334 5.434173 
1 1 1   12    7   38 o  137.067   1.7365  766.247   19.402  727.593   33.693  785.424   23.732  133.466   3.0969  138.750   2.0983 -5.283768 3.740821 
1 1 1   12    7   39 o  150.865   1.7446  928.313   21.455  949.438   38.437  918.752   25.858  152.456   3.0929  150.061   2.1140 2.394562 3.746327 
1 1 1   12    7   40 o  101.184   1.7548  417.590   14.473  425.650   26.366  414.114   17.315  102.020   3.1744  100.745   2.1085 1.275047 3.810790 
1 1 1   12    7   41 o   52.780   2.3886  113.935   10.250  121.441   19.039  110.871   12.163   54.287   4.3385   52.023   2.8795 2.264206 5.207057 
1 1 1   12    7   42 o   84.912   2.0275  294.181   14.033  276.422   23.580  303.922   17.463   82.145   3.5297   86.248   2.4865 -4.102798 4.317566 
1 1 1   12    7   43 o  101.007   1.9242  416.241   15.843  418.433   26.536  415.026   19.750  101.129   3.2231  100.831   2.4029 0.2986298 4.020214 
1 1 1   12    7   44 o  222.334   2.1542  2017.36   39.041  1970.21   61.800  2048.67   50.363  219.496   3.4540  223.959   2.7587 -4.463211 4.420502 
1 1 1   12    7   45 o   84.433   2.0176  290.897   13.886  316.906   23.540  277.017   17.197   87.980   3.2881   82.324   2.5658 5.655807 4.170743 
1 1 1   12    7   46 o  144.008   2.1617  846.425   25.376  836.382   35.814  856.550   35.961  143.050   3.0714  144.767   3.0474 -1.717651 4.326652 
1 1 1   12    7   47 o  119.564   1.8853  583.289   18.374  609.581   30.940  568.964   22.838  122.074   3.1118  118.049   2.3733 4.025322 3.913598 
1 1 1   12    7   48 o   86.855   2.0193  307.871   14.296  307.071   24.012  308.309   17.794   86.571   3.4093   86.850   2.5161 -0.2782822 4.237263 
1 1 1   12    7   49 o   67.266   2.1386  184.884   11.711  182.008   18.933  186.667   14.905   66.598   3.4998   67.538   2.7129 -0.9399796 4.428118 
1 1 1   12    7   50 o   82.470   1.9272  277.566   12.956  283.726   20.506  273.474   16.714   83.246   3.0270   81.784   2.5101 1.461296 3.932302 
1 1 1   12    7   51 o  116.945   1.7692  558.043   16.865  555.968   26.201  559.510   22.037  116.632   2.7560  117.051   2.3096 -0.4194946 3.595785 
1 1 1   12    7   52 o  104.854   1.9643  448.759   16.790  405.799   23.264  495.455   24.255   99.585   2.8689  110.102   2.7025 -10.51705 3.941314 
1 1 1   12    7   53 o  101.855   2.2010  423.644   18.274  438.072   30.502  415.565   22.824  103.344   3.6264  100.785   2.7809 2.560043 4.569897 
1 1 1   12    7   54 o   34.219   4.0832   48.715   11.165   44.833   20.962   50.253   13.192   32.130   8.0272   34.632   4.8021 -2.501686 9.353898 
1 1 1   12    7   55 o   23.593   5.1115   23.807   9.5457   34.463   19.890   20.619   10.881   28.343   8.1654   21.962   5.9371 6.380936 10.09571 
1 1 1   12    7   56 o   16.264   5.7068   9.6906   9.3587   2.6455   20.182   11.621   10.563   18.646   7.8360   17.570   6.0692 1.076138 9.911531 
1 1 1   12    7   57 o   83.187   1.8806  282.507   12.752  265.790   20.119  293.733   16.487   80.520   3.0710   84.747   2.3891 -4.227470 3.890816 
1 1 1   12    7   58 o   25.610   4.3943   27.726   8.8434   50.630   16.067   17.771   10.592   34.487   5.9290   20.499   5.9745 13.98734 8.417105 
1 1 1   12    7   59 o   80.972   1.9082  267.727   12.595  262.348   20.303  271.091   16.059   79.969   3.1206   81.397   2.4230 -1.427696 3.950823 
1 1 1   12    7   60 o   93.582   1.8803  357.625   14.343  353.671   22.636  360.277   18.541   92.880   2.9937   93.838   2.4260 -0.9582291 3.853213 
1 1 1   12    7   61 o   95.779   1.8633  374.641   14.547  370.463   23.070  377.398   18.744   95.050   2.9812   96.069   2.3935 -1.018814 3.823144 
1 1 1   12    7   62 o  134.271   1.7926  736.250   19.620  719.825   29.716  748.945   26.124  132.589   2.7494  135.325   2.3682 -2.735886 3.628752 
1 1 1   12    7   63 o   49.286   2.6292   99.729   10.524   87.270   18.311  105.875   12.861   45.642   5.0037   50.711   3.1264 -5.069241 5.900103 
1 1 1   12    7   64 o   34.773   3.3302   50.106   9.3245   68.919   16.669   41.539   11.249   40.437   5.1756   31.394   4.5263 9.042694 6.875670 
1 1 1   12    7   65 o   84.483   2.2580  292.202   15.536  310.836   20.909  269.232   23.214   87.001   2.9526   80.829   3.5318 6.172028 4.603482 
1 1 1   12    7   66 o   63.999   2.9023  168.376   15.101  133.599   22.554  196.637   20.332   56.511   4.9460   69.012   3.6269 -12.50140 6.133317 
1 1 1   12    7   67 o   80.720   1.9568  266.410   12.875  238.296   22.273  280.519   15.778   75.969   3.6070   82.740   2.3418 -6.770508 4.300521 
1 1 1   12    7   68 o  116.373   1.8406  553.638   17.460  525.613   29.321  569.036   21.734  113.005   3.1863  117.889   2.2617 -4.884338 3.907367 
1 1 1   12    7   69 o   55.818   2.2539  127.812   10.234  127.602   19.063  127.897   12.131   55.317   4.2604   55.763   2.6766 -0.4458389 5.031361 
1 1 1   12    7   70 o   25.601   3.8718   27.706   7.8280   24.723   15.894   28.662   8.9945   23.890   7.4012   25.919   4.4153 -2.028625 8.618146 
1 1 1   12    7   71 o   9.5791   4.3285  -3.6931   7.2066  -6.1312   14.343  -2.8696   8.3352   13.624   6.1359   10.683   4.7538 2.941593 7.762006 
1 1 1   12    7   72 o   81.813   1.7684  273.820   11.794  274.169   18.827  273.595   15.130   81.579   2.8354   81.648   2.2756 -0.6948090E-01 3.635629 
1 1 1   12    7   73 o   22.947   3.6973   22.357   6.6808   26.897   11.464   20.022   8.2212   24.696   5.7949   21.444   4.8207 3.252148 7.537863 
1 1 1   12    7   74 o   54.944   2.0064  123.880   8.9712  124.465   13.338  123.396   12.123   54.847   2.9948   54.679   2.7285 0.1674500 4.051332 
1 1 1   12    7   75 o   27.908   3.1511   32.595   7.0433   23.042   11.463   38.389   8.9272   22.766   6.0674   30.176   3.7070 -7.409969 7.110210 
1 1 1   12    7   76 o   10.565   4.3142   1.9015   5.8786   2.0132   10.869   1.8553   6.9891   13.698   5.7532   11.317   4.6717 2.380277 7.411054 
1 1 1   12    7   77 o   20.585   3.6726   18.158   5.9364   33.754   11.465   12.445   6.9390   27.734   5.2639   16.916   4.8068 10.81854 7.128412 
1 1 1   12    7   78 o   85.237   1.5928  297.466   11.067  303.366   16.677  292.823   14.793   85.804   2.3867   84.384   2.1523 1.419586 3.213870 
1 1 1   12    7   79 o   61.667   1.5083  155.662   7.5821  164.023   13.940  152.149   9.0354   62.940   2.7236   60.880   1.8227 2.059673 3.277237 
1 1 1   12    7   80 o   70.586   2.3151  205.461   13.303  204.258   14.799  210.527   30.360   70.277   2.5877   69.705   5.3849 0.5725784 5.974433 
1 1 1   12    7   81 o   49.514   2.5511  101.558   10.262  102.243   12.797  100.323   17.177   49.458   3.1912   48.456   4.3965 1.002666 5.432581 
1 1 1   12    7   82 o   51.216   2.4957  108.649   10.388   97.851   12.713  130.339   18.018   48.329   3.2459   55.426   4.0152 -7.097633 5.163095 
1 1 1   12    7   83 o   22.234   4.9632   22.065   8.7674   20.694   10.921   24.550   14.705   21.301   6.0227   22.989   7.1183 -1.688145 9.324368 
1 1 1   12    7   84 o   23.739   5.3056   25.406   10.008   19.703   11.073   50.858   23.392   20.771   6.1236   31.818   8.7481 -11.04689 10.67840 
1 1 1   12    7   85 o   36.991   3.9104   58.545   11.613   60.417   13.225   52.245   24.268   37.340   4.4314   31.987   8.9549 5.353090 9.991384 
1 1 1   12    7   86 o   20.096   5.6776   18.442   9.7092   12.576   10.738   44.727   22.729   17.344   6.1108   29.614   8.7846 -12.26923 10.70099 
1 1 1   12    7   87 o   53.937   2.3753  120.658   10.417  120.730   12.836  120.521   17.832   53.705   2.9432   52.972   4.1631 0.7330284 5.098468 
1 1 1   12    7   88 o   23.861   4.6913   25.406   8.7992   24.636   10.807   26.921   15.158   23.067   5.7640   23.636   7.2105 -0.5697231 9.231234 
1 1 1   12    7   89 o   28.709   3.9712   35.776   9.0448   28.809   11.101   49.536   15.601   24.999   5.5882   32.683   6.0795 -7.683958 8.257582 
1 1 1   12    7   90 o   24.767   4.9845   27.774   9.7143   25.895   12.690   30.434   15.097   23.264   6.4617   24.917   7.0935 -1.652266 9.595410 
1 1 1   12    7   91 o   66.557   2.1550  183.633   11.676  164.486   16.223  204.214   16.819   62.357   3.2023   69.673   2.9683 -7.315804 4.366374 
1 1 1   12    7   92 f   17.226   5.6063   13.476   9.0253   10.598   12.769   16.348   12.758   16.737   6.5128   18.903   6.6607 -2.165890 9.315675 
1 1 1   12    7   93 o   19.456   5.1496   17.635   8.2932   23.886   11.008   9.4299   12.612   22.295   5.9474   16.207   6.4222 6.087893 8.753083 
1 1 1   12    7   94 o   12.747   5.1175   4.6967   8.1126   4.3415   10.654   5.1869   12.515   13.742   5.7285   14.740   6.1810 -0.9978838 8.427364 
1 1 1   12    7   95 o   29.979   3.9787   39.763   9.4831   50.481   13.294   28.659   13.532   33.060   5.0966   23.751   6.7001 9.308327 8.418237 
1 1 1   12    7   96 o   30.250   3.6253   40.079   8.7613   34.361   11.382   48.392   13.724   26.908   5.3776   31.986   5.4595 -5.078211 7.663217 
1 1 1   12    7   97 o   12.630   5.0833   4.8414   8.0260   11.887   10.679  -4.3040   12.167   16.332   6.0470   11.995   5.4987 4.336764 8.173240 
1 1 1   12    7   98 o   27.903   4.0518   35.025   8.9466   39.386   12.571   30.548   12.735   28.471   5.6163   24.426   6.3413 4.044771 8.470799 
1 1 1   12    7   99 f   28.497   3.9872   36.594   9.0088   34.171   12.209   39.489   13.348   26.128   5.8754   28.017   6.0237 -1.889139 8.414613 
1 1 1   12    7  100 o   25.200   4.5616   29.720   9.0254   13.768   12.263   48.575   13.332   16.959   6.4375   31.647   5.3591 -14.68836 8.376200 
1 1 1   12    7  101 o   52.186   2.5234  115.686   10.702   91.998   14.451  144.462   15.928   45.204   3.9618   57.377   3.4210 -12.17242 5.234384 
1 1 1   12    7  102 o   19.360   5.4685   18.906   9.0081   16.751   12.257   21.437   13.283   17.956   6.5056   19.772   6.8069 -1.815104 9.415746 
1 1 1   12    7  103 o   26.943   4.3870   33.877   9.3038   30.188   12.744   38.086   13.614   23.670   6.4367   26.836   6.3270 -3.165995 9.025611 
1 1 1   12    7  104 o   36.415   3.2652   58.335   9.5896   49.828   12.960   68.629   14.256   31.999   5.1428   38.117   4.6867 -6.118229 6.957985 
1 1 1   12    7  105 o   11.193   5.0006  -0.3535   9.3190 -11.5029   12.000   16.585   14.791   10.285   4.9377   17.730   6.9770 -7.445134 8.547491 
1 1 1   12    7  106 o   18.473   5.7859   17.884   9.6847   30.284   12.850   1.5777   14.736   23.413   6.5019   13.751   6.2039 9.661788 8.986867 
1 1 1   12    7  107 o   21.251   5.7280   23.656   10.146   25.703   13.386   20.894   15.552   21.140   6.8237   18.984   7.2394 2.155951 9.948422 
1 1 1   12    7  108 o   13.562   5.8265   5.1332   11.589   1.8632   13.429   14.674   22.939   13.322   5.9736   17.667   7.8725 -4.344959 9.882368 
1 1 1   12    7  109 o   12.878   5.6648   2.8802   11.508  -3.1261   13.219   21.683   23.389   12.172   5.6340   18.883   8.1951 -6.710981 9.944952 
1 1 1   12    7  110 o   15.642   6.8427   9.1333   16.584   9.1333   16.584   0.0000   0.0000   15.642   6.8427  ?   ?  0.000000 6.842700 
1 1 1   12    7  111 o   9.0340   4.5610 -40.7892   15.982 -40.7892   15.982   0.0000   0.0000   9.0340   4.5610  ?   ?  0.000000 4.561034 
1 1 1   12    7  112 o   12.771   6.2235 -16.5476   20.947 -16.5476   20.947   0.0000   0.0000   12.771   6.2235  ?   ?  0.000000 6.223489 
1 1 1   12    7  113 o   17.312   7.7477   15.005   22.472   15.005   22.472   0.0000   0.0000   17.312   7.7477  ?   ?  0.000000 7.747710 
1 1 1   12    7  114 o   15.114   7.0465   2.0900   21.259   2.0900   21.259   0.0000   0.0000   15.114   7.0465  ?   ?  0.000000 7.046468 
1 1 1   12    8 -111 o   12.158   5.6028  -1.8869   12.866  -1.8869   12.866   0.0000   0.0000   12.158   5.6028  ?   ?  0.000000 5.602836 
1 1 1   12    8 -110 o   10.637   5.1057 -10.5115   12.814 -10.5115   12.814   0.0000   0.0000   10.637   5.1057  ?   ?  0.000000 5.105692 
1 1 1   12    8 -109 o   16.235   6.5618   13.580   13.435   13.580   13.435   0.0000   0.0000   16.235   6.5618  ?   ?  0.000000 6.561753 
1 1 1   12    8 -108 o   15.880   6.5191   12.218   13.512   12.218   13.512   0.0000   0.0000   15.880   6.5191  ?   ?  0.000000 6.519130 
1 1 1   12    8 -107 o   16.955   7.3087   14.196   18.353   14.196   18.353   0.0000   0.0000   16.955   7.3087  ?   ?  0.000000 7.308736 
1 1 1   12    8 -106 o   17.944   6.8781   18.188   14.086   18.188   14.086   0.0000   0.0000   17.944   6.8781  ?   ?  0.000000 6.878126 
1 1 1   12    8 -105 o   32.581   4.5141   50.454   11.667   36.118   14.262   79.461   20.287   25.139   6.7977   37.862   6.8240 -12.72274 9.632022 
1 1 1   12    8 -104 o   11.919   5.3551  -0.0213   10.850  -6.7599   13.497   12.290   18.243   11.667   5.4951   16.719   7.2471 -5.051873 9.094829 
1 1 1   12    8 -103 o   10.360   4.8533  -5.8793   10.288 -14.8161   12.846   10.104   17.179   10.181   4.9413   16.140   7.0141 -5.959594 8.579824 
1 1 1   12    8 -102 o   30.033   4.6652   43.018   11.050   35.425   13.634   57.556   18.865   25.374   6.5480   31.422   7.4747 -6.048052 9.937178 
1 1 1   12    8 -101 o   20.858   5.9337   22.941   10.568   24.916   12.986   19.067   18.184   21.075   6.7128   18.599   7.5905 2.476368 10.13297 
1 1 1   12    8 -100 o   17.789   5.9903   16.386   10.279   17.607   12.781   14.151   17.295   18.182   6.6349   17.366   7.2732 0.8164997 9.844838 
1 1 1   12    8  -99 o   16.841   5.9571   14.228   10.213   19.795   12.774   4.3662   17.003   19.104   6.6699   15.138   6.7595 3.966520 9.496299 
1 1 1   12    8  -98 o   16.113   5.9267   12.456   10.230   8.2909   12.471   21.024   17.886   15.011   6.2225   19.416   7.6624 -4.404902 9.870749 
1 1 1   12    8  -97 o   48.859   2.5944  101.631   10.296  111.360   14.749   92.384   14.378   50.145   3.6330   45.353   3.9280 4.792301 5.350463 
1 1 1   12    8  -96 f   12.902   5.0334   6.1613   7.6422 -16.3434   11.708   22.869   10.088   9.5709   4.6617   21.320   5.6962 -11.74868 7.360607 
1 1 1   12    8  -95 o   18.836   5.3617   17.358   8.6261   14.546   12.198   20.171   12.201   17.418   6.4601   19.741   6.5237 -2.322092 9.181012 
1 1 1   12    8  -94 o   14.032   5.3114   7.8943   8.3336 -10.0587   11.917   25.075   11.658   10.737   5.0888   22.230   6.2004 -11.49315 8.021296 
1 1 1   12    8  -93 o   9.2707   4.3864  -8.1594   8.7835 -18.2903   14.039  -1.6428   11.259   10.641   5.1651   12.168   5.4619 -1.526238 7.517334 
1 1 1   12    8  -92 o   26.269   4.6613   31.642   9.6157   33.623   15.865   30.492   12.089   25.182   7.3039   24.890   6.0241 0.2925873 9.467671 
1 1 1   12    8  -91 o   30.236   4.0430   40.488   9.7154   56.897   16.275   31.403   12.110   34.422   6.0192   25.430   5.9485 8.992311 8.462546 
1 1 1   12    8  -90 o   16.246   5.4929   11.854   8.6426  -3.4160   12.854   24.453   11.676   12.707   5.7576   22.368   6.1926 -9.660980 8.455642 
1 1 1   12    8  -89 o   26.607   3.9505   31.132   8.3085   23.121   11.641   39.450   11.862   21.834   6.2332   29.327   5.1496 -7.493334 8.085185 
1 1 1   12    8  -88 o   8.7762   4.1395  -7.4828   7.7098  -8.5090   10.668  -6.3607   11.155   10.543   4.9401   11.269   5.2019 -0.7265348 7.173843 
1 1 1   12    8  -87 o   13.349   5.0900   6.1967   7.6876  -2.4782   10.689   15.491   11.064   11.944   5.3445   18.456   6.2149 -6.512420 8.196891 
1 1 1   12    8  -86 o   21.367   4.7005   20.599   7.9642   26.810   11.294   14.454   11.233   23.932   5.8413   18.082   6.2580 5.849930 8.560550 
1 1 1   12    8  -85 f   40.683   2.7996   69.391   9.2276   65.560   13.695   72.576   12.488   38.755   4.4137   41.159   3.7637 -2.404129 5.800593 
1 1 1   12    8  -84 o   48.718   2.3026   98.450   9.1183   95.173   12.404  102.303   13.450   47.505   3.2223   49.180   3.3755 -1.675381 4.666594 
1 1 1   12    8  -83 o   42.415   2.5155   74.877   8.6583   79.203   11.862   69.943   12.667   43.268   3.3902   40.409   3.8938 2.859089 5.162863 
1 1 1   12    8  -82 o   15.539   5.1887   10.236   7.7136   8.6874   10.565   12.004   11.288   15.655   5.9674   17.217   6.2424 -1.561966 8.635831 
1 1 1   12    8  -81 o   13.978   5.4097   6.2399   8.7734  -0.9180   12.064   14.277   12.783   13.247   5.8144   18.501   6.6514 -5.254072 8.834436 
1 1 1   12    8  -80 o   12.840   5.2381   3.5183   8.6552  -5.9239   11.814   14.460   12.717   11.940   5.4524   18.606   6.6407 -6.666179 8.592271 
1 1 1   12    8  -79 o   49.513   2.6259  101.844   10.560  107.161   14.390   95.638   15.547   50.418   3.5235   47.356   4.0667 3.061718 5.380844 
1 1 1   12    8  -78 o   19.874   5.1193   17.685   8.3442   39.345   12.531   0.4308   11.184   29.732   5.3679   13.229   5.7042 16.50264 7.832767 
1 1 1   12    8  -77 o   61.577   2.1675  156.301   10.862  138.032   16.046  171.755   14.758   57.366   3.4474   64.305   2.8224 -6.938919 4.455353 
1 1 1   12    8  -76 o   11.957   5.0222   1.5278   8.2822   0.5648   12.218   2.3465   11.266   13.864   5.9697   13.898   5.8484 -0.3410339E-01 8.357060 
1 1 1   12    8  -75 o   31.956   3.5210   43.101   9.0201   33.719   13.329   51.029   12.252   27.302   6.1385   34.468   4.4656 -7.166170 7.591000 
1 1 1   12    8  -74 o   29.614   4.0793   37.462   9.5858   40.718   13.042   33.635   14.137   30.386   5.4664   27.196   6.4712 3.189409 8.471028 
1 1 1   12    8  -73 o   60.894   2.4111  152.904   11.944  148.186   16.073  158.721   17.849   59.638   3.3195   61.624   3.5686 -1.986435 4.873784 
1 1 1   12    8  -72 o   37.456   2.4681   57.994   7.4936   48.864   13.846   61.776   8.9115   33.533   5.2366   38.573   2.8544 -5.040398 5.964058 
1 1 1   12    8  -71 o   29.674   2.9532   36.712   7.0487   31.701   13.498   38.590   8.2651   26.592   6.3206   30.323   3.4024 -3.731148 7.178221 
1 1 1   12    8  -70 o   16.339   4.4801   11.553   6.1444  -7.2448   11.192   19.664   7.3514   11.467   5.2629   21.307   4.3791 -9.840261 6.846497 
1 1 1   12    8  -69 o   62.236   1.7110  158.611   8.6721  154.361   14.060  161.221   11.018   61.148   2.8283   62.660   2.1603 -1.511982 3.559002 
1 1 1   12    8  -68 o   42.911   2.1366   75.667   7.4500   64.295   12.241   82.359   9.3893   39.163   3.8855   44.690   2.5885 -5.526173 4.668801 
1 1 1   12    8  -67 o   27.363   3.0403   31.215   6.6670   22.691   11.601   35.419   8.1467   22.705   6.1272   29.067   3.5092 -6.361864 7.060974 
1 1 1   12    8  -66 o   43.903   2.2430   79.197   8.0005   72.723   14.490   82.036   9.5959   41.600   4.3366   44.614   2.6505 -3.014572 5.082467 
1 1 1   12    8  -65 o   30.719   3.0214   39.188   7.4679   8.3800   13.548   52.635   8.9504   17.198   6.7038   35.626   3.1133 -18.42784 7.391479 
1 1 1   12    8  -64 o  116.853   1.5579  557.840   14.839  550.655   24.409  562.052   18.689  115.860   2.5846  117.214   1.9560 -1.354156 3.241315 
1 1 1   12    8  -63 o   42.900   2.2201   75.544   7.7373   70.180   12.684   78.722   9.7643   41.052   3.8349   43.714   2.7542 -2.662163 4.721495 
1 1 1   12    8  -62 f   78.725   2.0114  253.634   12.897  233.773   16.249  287.454   21.204   75.465   2.6455   83.580   3.1177 -8.114792 4.088910 
1 1 1   12    8  -61 o  119.202   1.6901  580.456   16.423  562.384   22.157  602.488   24.464  117.214   2.3190  121.285   2.4745 -4.071304 3.391304 
1 1 1   12    8  -60 o  114.342   1.4322  533.698   13.349  562.163   19.175  506.933   18.594  117.264   2.0060  111.348   2.0486 5.916473 2.867197 
1 1 1   12    8  -59 o   79.877   1.5977  260.521   10.403  256.593   15.147  264.028   14.312   79.153   2.3502   80.319   2.1880 -1.165245 3.211044 
1 1 1   12    8  -58 o   7.5312   3.6926 -15.2671   7.7113 -32.1225   14.085  -8.0529   9.2149   9.6805   4.7924   10.049   4.6695 -0.3683004 6.691114 
1 1 1   12    8  -57 o   56.571   2.2841  131.083   10.511  119.205   20.151  135.523   12.320   53.515   4.6659   57.477   2.6367 -3.961430 5.359396 
1 1 1   12    8  -56 o   14.057   5.0717   6.8685   7.4397   15.965   12.857   2.2896   9.1219   20.040   6.6990   12.994   5.3477 7.046431 8.571749 
1 1 1   12    8  -55 o   29.689   3.3463   36.604   7.9575   43.720   14.216   33.356   9.6031   32.012   5.6545   28.143   4.3242 3.868988 7.118376 
1 1 1   12    8  -54 o   20.385   4.4535   17.773   7.1930   39.527   12.691   7.4778   8.7307   30.491   5.2983   14.948   5.4791 15.54222 7.621840 
1 1 1   12    8  -53 o  104.789   1.5146  448.078   12.937  457.591   19.831  441.029   17.070  105.813   2.2992  103.914   2.0152 1.899460 3.057378 
1 1 1   12    8  -52 o  169.152   1.5456  1167.54   21.311  1158.34   31.120  1175.66   29.244  168.369   2.2674  169.652   2.1147 -1.282074 3.100492 
1 1 1   12    8  -51 o   31.820   3.4662   41.986   8.8456   59.403   16.448   34.899   10.492   37.519   5.5450   28.764   4.6320 8.754793 7.225064 
1 1 1   12    8  -50 o  127.978   1.8186  668.541   18.971  689.241   31.292  656.511   23.856  129.784   2.9579  126.763   2.3087 3.020866 3.752210 
1 1 1   12    8  -49 o   16.488   5.4238   10.751   8.4370   5.2815   15.832   12.920   9.9707   17.448   7.0971   18.009   5.8947 -0.5602932 9.225816 
1 1 1   12    8  -48 o  145.730   2.3607  867.594   28.043  881.058   53.192  862.410   33.002  146.350   4.4640  145.227   2.7878 1.123688 5.262996 
1 1 1   12    8  -47 o  118.078   2.3318  569.507   22.444  573.823   43.177  567.909   26.272  118.089   4.4936  117.863   2.7345 0.2258301 5.260257 
1 1 1   12    8  -46 o  135.332   1.7337  747.341   19.125  747.282   24.525  747.431   30.549  135.275   2.2241  135.215   2.7717 0.5931091E-01 3.553730 
1 1 1   12    8  -45 o   67.552   1.9292  186.405   10.612  208.001   15.404  166.896   14.640   71.293   2.6553   63.832   2.8207 7.460587 3.873858 
1 1 1   12    8  -44 o   28.469   3.7538   33.771   8.4992   36.150   12.385   31.654   11.684   29.172   5.4075   27.248   5.4512 1.924322 7.678297 
1 1 1   12    8  -43 o   83.865   1.9042  287.035   13.018  289.591   19.762  285.076   17.302   84.118   2.8864   83.498   2.5450 0.6205750 3.848203 
1 1 1   12    8  -42 o  346.473   2.6305  4904.29   74.292  4868.73  105.394  4939.40  104.739  344.792   3.7499  347.308   3.6996 -2.515472 5.267745 
1 1 1   12    8  -41 o   91.692   1.9181  343.084   14.336  379.939   21.218  312.124   19.447   96.396   2.7030   87.360   2.7343 9.036057 3.844769 
1 1 1   12    8  -40 o  130.155   1.6079  691.009   17.059  710.502   27.735  679.148   21.635  131.892   2.5797  128.999   2.0574 2.893158 3.299695 
1 1 1   12    8  -39 o   63.545   2.0069  164.945   10.382  179.202   17.487  157.184   12.902   66.121   3.2545   61.986   2.5590 4.134731 4.140030 
1 1 1   12    8  -38 o  131.521   1.6019  705.561   17.174  692.615   27.335  714.005   22.076  130.230   2.5750  132.274   2.0474 -2.044220 3.289731 
1 1 1   12    8  -37 o   81.535   1.7485  271.198   11.621  294.927   19.512  258.153   14.467   84.920   2.8226   79.496   2.2348 5.423500 3.600194 
1 1 1   12    8  -36 o   95.426   1.8163  371.493   14.128  375.510   28.961  370.238   16.185   95.725   3.7186   95.251   2.0845 0.4746628 4.262959 
1 1 1   12    8  -35 o   64.110   1.9607  167.851   10.234  163.014   16.955  170.623   12.837   63.060   3.3100   64.602   2.4421 -1.542004 4.113348 
1 1 1   12    8  -34 o   85.892   1.7114  300.923   11.982  331.014   20.037  284.171   14.950   89.987   2.7347   83.416   2.2006 6.570915 3.510183 
1 1 1   12    8  -33 o   28.077   4.3965   33.057   9.7324   19.958   13.984   45.362   13.553   22.114   6.9563   32.845   5.2379 -10.73115 8.707787 
1 1 1   12    8  -32 o  104.054   1.8322  441.663   15.541  438.879   22.777  444.089   21.257  103.638   2.6984  104.301   2.5003 -0.6621628 3.678675 
1 1 1   12    8  -31 o  144.601   1.7890  852.891   21.087  867.145   30.862  840.409   28.880  145.740   2.5978  143.488   2.4692 2.252747 3.584048 
1 1 1   12    8  -30 o   87.578   2.1199  312.940   15.134  298.387   24.725  321.659   19.137   85.360   3.5612   88.723   2.6491 -3.363571 4.438421 
1 1 1   12    8  -29 o   31.899   3.7996   42.195   9.6859   70.442   18.706   31.847   11.322   41.025   5.7514   27.413   5.2580 13.61273 7.792667 
1 1 1   12    8  -28 o   77.860   2.0457  247.482   12.972  196.980   23.931  268.496   15.437   69.247   4.2601   81.080   2.3381 -11.83305 4.859545 
1 1 1   12    8  -27 o  356.723   2.6940  5194.80   78.337  5040.34  134.534  5274.03   96.358  350.802   4.7047  359.292   3.2901 -8.489136 5.740977 
1 1 1   12    8  -26 f   73.641   1.9966  221.382   11.974  266.414   20.395  197.694   14.792   80.705   3.1060   69.545   2.6140 11.16010 4.059551 
1 1 1   12    8  -25 o  143.293   1.8113  837.454   21.157  878.310   39.951  821.529   24.942  146.624   3.3426  141.904   2.1563 4.720505 3.977762 
1 1 1   12    8  -24 o   41.797   3.2660   71.792   11.039   62.565   17.264   78.174   14.358   38.654   5.6456   43.529   4.0947 -4.875778 6.974161 
1 1 1   12    8  -23 o  113.367   1.8826  524.195   17.397  525.898   26.275  522.866   23.215  113.463   2.8431  113.191   2.5161 0.2720566 3.796574 
1 1 1   12    8  -22 o  185.211   1.9228  1399.15   29.029  1357.23   42.215  1436.76   39.982  182.335   2.8403  187.624   2.6142 -5.289063 3.860210 
1 1 1   12    8  -21 o   84.903   2.1284  294.252   14.719  311.926   23.105  282.180   19.095   87.329   3.2513   83.092   2.8232 4.236885 4.306009 
1 1 1   12    8  -20 o   72.882   2.3080  216.946   13.694  235.340   21.363  204.115   17.843   75.817   3.4658   70.631   3.1067 5.186531 4.654398 
1 1 1   12    8  -19 o  128.990   2.0504  678.721   21.560  670.542   29.327  688.339   31.803  128.163   2.8072  129.838   3.0049 -1.674545 4.112133 
1 1 1   12    8  -18 o  144.467   1.8451  851.223   21.728  849.761   32.335  852.427   29.340  144.282   2.7493  144.528   2.4904 -0.2460480 3.709536 
1 1 1   12    8  -17 o   30.171   4.1405   37.917   9.9146   21.174   16.728   46.982   12.310   23.177   7.6379   33.569   4.6209 -10.39261 8.926950 
1 1 1   12    8  -16 o   91.067   1.8922  338.246   14.047  343.645   24.762  335.684   17.056   91.663   3.3195   90.676   2.3095 0.9873810 4.043823 
1 1 1   12    8  -15 o   80.474   1.9702  264.148   12.924  262.049   22.659  265.160   15.735   80.014   3.4824   80.578   2.3982 -0.5637817 4.228287 
1 1 1   12    8  -14 o   34.463   3.5793   49.045   9.9088   58.866   17.539   44.441   12.009   37.425   5.9480   32.630   4.6460 4.795033 7.547434 
1 1 1   12    8  -13 o   89.886   1.8767  329.520   13.751  340.121   24.089  324.396   16.747   91.202   3.2455   89.139   2.3067 2.062454 3.981732 
1 1 1   12    8  -12 o  180.009   2.0151  1321.69   29.568  1353.82   69.278  1314.54   32.696  181.816   4.6783  179.505   2.2345 2.310974 5.184529 
1 1 1   12    8  -11 o  169.180   1.9819  1167.41   27.332  1269.04   65.139  1145.70   30.111  176.055   4.5428  167.584   2.2042 8.471024 5.049308 
1 1 1   12    8  -10 o   44.547   3.1432   81.430   11.340   48.437   27.578   88.145   12.441   33.748   9.5804   46.339   3.3155 -12.59124 10.13785 
1 1 1   12    8   -9 f   34.340   4.4183   49.023   12.081   53.038   26.498   47.970   13.575   35.155   9.1570   33.857   5.0747 1.297707 10.46913 
1 1 1   12    8   -8 o   68.983   2.2866  194.348   12.840  206.754   20.859  186.779   16.293   71.047   3.6136   67.576   2.9650 3.470734 4.674347 
1 1 1   12    8   -7 o  198.952   2.0649  1614.53   33.488  1660.64   54.147  1585.96   42.615  201.652   3.2941  197.134   2.6519 4.517075 4.228953 
1 1 1   12    8   -6 o   63.510   2.4142  164.807   12.476  146.895   19.435  177.361   16.270   59.813   4.0092   65.841   3.0397 -6.028095 5.031285 
1 1 1   12    8   -5 o   76.824   1.9478  240.869   12.188  265.986   22.047  229.815   14.626   80.631   3.3618   75.013   2.3950 5.618073 4.127666 
1 1 1   12    8   -4 o  147.321   1.7250  885.053   20.715  913.538   36.764  871.803   25.074  149.589   3.0150  146.194   2.1041 3.394897 3.676582 
1 1 1   12    8   -3 o   71.369   2.0041  207.912   11.648  199.047   20.430  212.181   14.177   69.708   3.6078   72.074   2.4166 -2.365189 4.342316 
1 1 1   12    8   -2 o   84.307   1.8434  289.870   12.668  285.897   22.341  291.753   15.380   83.607   3.2845   84.539   2.2338 -0.9316254 3.972132 
1 1 1   12    8   -1 o   85.182   1.7271  295.895   11.992  270.852   18.354  314.549   15.841   81.416   2.7696   87.783   2.2156 -6.366669 3.546767 
1 1 1   12    8    0 o   82.184   1.8767  275.458   12.572  269.190   18.187  281.194   17.399   81.167   2.7527   82.972   2.5756 -1.804741 3.769791 
1 1 1   12    8    1 o  145.856   1.6052  867.474   19.085  859.980   29.395  872.936   25.094  145.177   2.4840  146.290   2.1043 -1.112564 3.255503 
1 1 1   12    8    2 o   82.280   1.7520  276.079   11.750  281.268   18.329  272.458   15.311   82.973   2.7136   81.689   2.3016 1.283348 3.558201 
1 1 1   12    8    3 o   54.457   2.1944  121.169   9.7210  123.309   15.117  119.660   12.693   54.842   3.3983   54.066   2.8907 0.7756233 4.461426 
1 1 1   12    8    4 o   60.919   2.1931  151.582   10.872  174.534   20.144  142.147   12.915   65.243   3.8042   58.956   2.6946 6.287243 4.661809 
1 1 1   12    8    5 o  189.319   1.7082  1461.59   26.361  1448.86   40.465  1470.98   34.745  188.423   2.6346  189.889   2.2447 -1.465851 3.461172 
1 1 1   12    8    6 o   45.029   2.5456   83.001   9.3058   71.282   14.940   90.430   11.895   41.505   4.4871   46.958   3.1254 -5.453552 5.468274 
1 1 1   12    8    7 o   92.447   1.8489  348.552   13.933  316.468   19.822  379.885   19.588   88.012   2.7663   96.456   2.4934 -8.443954 3.724222 
1 1 1   12    8    8 o   79.032   1.9796  254.917   12.743  272.092   18.659  239.904   17.445   81.599   2.8094   76.615   2.7980 4.983604 3.965040 
1 1 1   12    8    9 f   38.320   3.3144   60.415   10.251   46.174   15.088   72.626   13.971   33.080   5.8071   41.944   4.1401 -8.864429 7.131848 
1 1 1   12    8   10 o  103.695   2.0007  438.576   16.911  430.074   22.209  450.308   26.090  102.621   2.6572  104.976   3.0521 -2.355194 4.046716 
1 1 1   12    8   11 o  394.104   2.6957  6339.04   86.600  6333.05  132.735  6343.49  114.271  393.553   4.1376  394.043   3.5576 -0.4894409 5.456752 
1 1 1   12    8   12 o  105.231   1.8110  451.611   15.534  437.514   27.017  458.573   18.986  103.457   3.2075  106.023   2.1969 -2.566170 3.887721 
1 1 1   12    8   13 o   29.423   5.1756   36.497   11.960   0.0000   0.0000   36.497   11.960  ?   ?    29.423   5.1756 0.000000 5.175575 
1 1 1   12    8   14 o  142.150   1.7707  824.062   20.518  820.849   35.758  825.638   25.052  141.784   3.0939  142.264   2.1603 -0.4803314 3.773493 
1 1 1   12    8   15 o   23.045   5.1406   22.611   9.4109   19.369   15.118   24.663   12.025   22.139   7.2593   24.052   6.1192 -1.913622 9.494341 
1 1 1   12    8   16 o  182.471   1.7261  1357.85   25.675  1342.17   39.395  1369.43   33.851  181.341   2.6651  183.208   2.2667 -1.867523 3.498646 
1 1 1   12    8   17 o   75.611   1.9935  233.357   12.276  227.354   19.317  237.423   15.899   74.544   3.1864   76.231   2.5623 -1.686378 4.088772 
1 1 1   12    8   18 o   53.850   2.5305  118.604   11.077  103.663   17.687  128.245   14.208   50.147   4.3705   55.952   3.1277 -5.804382 5.374332 
1 1 1   12    8   19 o  131.472   1.8601  704.976   19.934  594.742   33.900  763.238   24.646  120.604   3.4519  136.777   2.2105 -16.17278 4.098997 
1 1 1   12    8   20 o   88.695   2.0812  320.914   15.047  359.397   22.694  290.721   20.101   93.773   2.9726   84.333   2.9285 9.440224 4.172863 
1 1 1   12    8   21 o  218.108   2.0207  1940.48   35.925  1950.26   51.384  1931.13   50.247  218.564   2.8841  217.495   2.8342 1.068359 4.043603 
1 1 1   12    8   22 o   26.600   6.0152   30.195   12.736   42.608   17.834   17.277   18.194   31.558   7.1046   22.171   7.9395 9.386951 10.65419 
1 1 1   12    8   23 o  313.136   2.4652  4001.38   62.925  4032.22   89.920  3971.78   88.088  314.140   3.5115  311.787   3.4659 2.353027 4.933934 
1 1 1   12    8   24 o   96.239   1.9907  377.806   15.617  372.193   22.815  382.754   21.422   95.430   2.9364   96.795   2.7177 -1.364418 4.001023 
1 1 1   12    8   25 o  277.990   2.2768  3153.14   51.593  3177.74   73.789  3129.61   72.165  278.914   3.2455  276.803   3.1983 2.111420 4.556584 
1 1 1   12    8   26 f  176.539   2.0354  1271.39   29.291  1327.31   48.409  1239.08   36.790  180.249   3.2947  174.234   2.5904 6.015350 4.191104 
1 1 1   12    8   27 o  229.246   2.4678  2144.85   46.116   0.0000   0.0000  2144.85   46.116  ?   ?   229.246   2.4678 0.000000 2.467811 
1 1 1   12    8   28 o  153.693   1.7797  963.446   22.296  964.094   39.900  963.152   26.886  153.623   3.1862  153.644   2.1467 -0.2177429E-01 3.841913 
1 1 1   12    8   29 o   86.303   1.9034  303.823   13.390  288.693   24.710  310.113   15.932   83.956   3.6192   87.148   2.2446 -3.192047 4.258729 
1 1 1   12    8   30 o  148.598   1.7594  900.642   21.312  935.030   38.981  885.981   25.452  151.283   3.1610  147.358   2.1189 3.924133 3.805487 
1 1 1   12    8   31 o  119.651   1.6383  583.886   15.979  603.187   26.059  572.255   20.228  121.549   2.6301  118.428   2.0954 3.120598 3.362734 
1 1 1   12    8   32 o  103.095   1.8015  433.549   15.139  468.035   28.626  420.157   17.838  106.964   3.2870  101.472   2.1566 5.491852 3.931321 
1 1 1   12    8   33 o  150.758   1.6313  926.982   20.047  943.166   31.721  916.220   25.867  151.991   2.5603  149.845   2.1178 2.146271 3.322671 
1 1 1   12    8   34 o   70.964   2.1707  205.702   12.542  213.856   18.385  198.605   17.153   72.274   3.1281   69.654   3.0282 2.619461 4.353770 
1 1 1   12    8   35 o  135.431   1.7720  748.208   19.562  759.723   28.309  737.686   27.062  136.405   2.5460  134.420   2.4698 1.985687 3.547101 
1 1 1   12    8   36 o  113.623   1.7870  526.667   16.551  503.560   23.594  549.052   23.223  111.045   2.6066  115.965   2.4567 -4.920074 3.581835 
1 1 1   12    8   37 o  137.267   1.7266  768.630   19.319  787.517   34.468  759.978   23.328  138.815   3.0461  136.464   2.0971 2.351334 3.698203 
1 1 1   12    8   38 o   21.791   5.2227   20.291   9.1561   33.668   17.388   15.159   10.770   28.019   7.4752   19.319   6.1084 8.699533 9.653595 
1 1 1   12    8   39 o  174.021   1.7986  1235.51   25.514  1177.46   44.161  1264.59   31.258  169.702   3.1924  176.016   2.1786 -6.314301 3.864923 
1 1 1   12    8   40 o  135.185   1.7218  745.549   18.973  747.894   33.867  744.476   22.905  135.258   3.0717  135.059   2.0806 0.1994171 3.710019 
1 1 1   12    8   41 o   86.725   1.8582  306.897   13.136  300.975   23.736  309.511   15.772   85.702   3.4044   87.044   2.2247 -1.341507 4.066859 
1 1 1   12    8   42 o   91.140   2.0829  339.056   15.474  325.925   24.515  347.753   19.952   89.186   3.3781   92.220   2.6569 -3.034058 4.297764 
1 1 1   12    8   43 o  163.483   1.7674  1090.53   23.553  1049.98   40.928  1110.61   28.799  160.223   3.1337  164.938   2.1420 -4.715042 3.795825 
1 1 1   12    8   44 o   50.851   2.4747  105.881   10.227  113.937   18.790  102.490   12.191   52.499   4.4322   49.973   3.0066 2.526028 5.355782 
1 1 1   12    8   45 o   79.298   2.0669  256.883   13.349  251.553   31.876  258.016   14.700   78.025   5.0387   79.454   2.2721 -1.428879 5.527300 
1 1 1   12    8   46 o   48.963   2.8944   98.373   11.501   77.870   22.332  105.774   13.417   42.872   6.6018   50.734   3.2615 -7.861732 7.363537 
1 1 1   12    8   47 o   77.483   2.1978  245.368   13.867  207.373   26.118  260.283   16.364   70.892   4.5436   79.771   2.5197 -8.879066 5.195538 
1 1 1   12    8   48 o  126.388   1.9435  652.087   20.023  666.902   36.526  645.722   23.941  127.538   3.5167  125.725   2.3361 1.813133 4.221900 
1 1 1   12    8   49 o   65.667   2.0273  176.236   10.839  160.781   18.382  184.473   13.420   62.526   3.6220   67.143   2.4560 -4.617371 4.376218 
1 1 1   12    8   50 o   23.035   4.6215   22.598   8.3756   16.320   15.580   25.149   9.9330   20.952   7.3623   24.242   5.1836 -3.290476 9.004067 
1 1 1   12    8   51 o   37.258   2.9176   57.150   8.7906   78.684   16.244   48.233   10.453   43.474   4.6563   34.073   3.8299 9.401684 6.029070 
1 1 1   12    8   52 o   68.058   1.9597  189.299   10.860  195.287   19.324  186.534   13.130   68.933   3.4500   67.514   2.3896 1.418739 4.196753 
1 1 1   12    8   53 o  180.381   1.7272  1328.20   25.396  1336.96   41.191  1322.82   32.255  180.749   2.7957  179.930   2.1992 0.8198853 3.557032 
1 1 1   12    8   54 o   86.035   1.8560  302.249   13.016  317.401   24.477  296.275   15.370   87.902   3.4226   85.117   2.2171 2.784943 4.077912 
1 1 1   12    8   55 o   38.084   3.3721   59.953   10.360   81.091   19.560   51.711   12.214   43.879   5.5957   35.171   4.3532 8.708702 7.089619 
1 1 1   12    8   56 o   80.074   1.9528  261.929   12.746  283.822   24.704  253.987   14.880   83.035   3.6588   78.779   2.3197 4.255959 4.332211 
1 1 1   12    8   57 o  140.305   1.7860  803.963   20.427  805.476   37.485  803.323   24.361  140.098   3.2824  140.188   2.1318 -0.9036255E-01 3.913928 
1 1 1   12    8   58 o   80.781   1.9746  266.669   13.003  310.277   25.732  251.716   15.068   86.786   3.6454   78.404   2.3603 8.382278 4.342839 
1 1 1   12    8   59 o   90.673   2.0779  336.132   15.358  304.325   22.019  366.270   21.433   86.049   3.1444   94.494   2.7856 -8.445351 4.200849 
1 1 1   12    8   60 o   49.475   2.5408  100.513   10.213  113.864   17.261   93.322   12.668   52.374   4.0751   47.545   3.2889 4.828800 5.236708 
1 1 1   12    8   61 o   91.253   1.8414  340.315   13.697  346.418   21.776  336.320   17.619   91.836   2.9126   90.602   2.3877 1.234505 3.766182 
1 1 1   12    8   62 f   44.059   2.6047   79.845   9.3130   88.287   16.049   75.559   11.435   45.983   4.3327   42.734   3.3085 3.248924 5.451442 
1 1 1   12    8   63 o   24.536   4.1346   25.566   7.9758   36.475   14.191   20.529   9.6430   28.899   6.2092   21.736   5.4525 7.163422 8.263410 
1 1 1   12    8   64 o   51.228   2.4606  107.832   10.245  137.032   20.808   98.488   11.771   57.260   4.4939   48.861   2.9693 8.399277 5.386307 
1 1 1   12    8   65 o   76.979   2.0054  242.686   12.573  256.249   23.608  237.316   14.855   78.655   3.6925   76.042   2.3995 2.612175 4.403658 
1 1 1   12    8   66 o   14.791   5.3889   7.6745   8.4266   84.715   29.383   0.7704   8.7961   43.220   8.6424   12.162   5.1455 31.05768 10.05819 
1 1 1   12    8   67 o   33.046   4.5817   46.409   12.010   57.612   14.802   24.815   20.550   36.726   5.0801   24.420   8.4637 12.30598 9.871291 
1 1 1   12    8   68 o   26.939   5.3889   31.653   11.420   39.187   14.028   16.847   19.665   29.866   5.9710   21.695   8.1707 8.171114 10.11997 
1 1 1   12    8   69 o   26.635   3.9896   30.141   8.3956   27.721   14.106   31.469   10.448   24.892   6.7729   26.962   4.9356 -2.070000 8.380527 
1 1 1   12    8   70 o   39.370   2.4828   63.980   7.9272   70.007   12.478   59.900   10.265   40.861   3.7893   37.889   3.3584 2.971428 5.063347 
1 1 1   12    8   71 o  115.953   1.6802  550.365   15.881  602.504   24.508  512.623   20.852  121.012   2.4845  111.700   2.2901 9.311790 3.378959 
1 1 1   12    8   72 o   19.599   4.4563   16.773   6.9579   32.433   11.460   7.6300   8.7566   27.153   5.3680   14.791   5.4758 12.36105 7.668148 
1 1 1   12    8   73 o   40.710   2.3143   68.395   7.6484   68.327   12.344   68.438   9.7440   40.271   3.8056   40.562   2.9675 -0.2912407 4.825822 
1 1 1   12    8   74 o   21.378   3.8285   19.663   6.4265   22.017   11.497   18.593   7.7503   22.120   6.1530   20.553   4.7249 1.566441 7.757856 
1 1 1   12    8   75 o   49.013   2.0364   98.870   8.1184   93.267   13.140  102.329   10.324   47.178   3.4406   49.728   2.5556 -2.549522 4.285849 
1 1 1   12    8   76 o   89.135   1.6111  325.540   11.706  316.719   17.072  333.368   16.082   87.608   2.3928   89.997   2.1921 -2.389359 3.245112 
1 1 1   12    8   77 o   60.109   1.8206  148.449   8.9101  125.196   13.832  164.941   11.649   54.769   3.1110   63.226   2.2639 -8.456825 3.847553 
1 1 1   12    8   78 o   22.038   3.3733   20.736   5.8674   13.615   11.026   23.549   6.9301   17.994   6.2014   23.396   3.7612 -5.402369 7.252854 
1 1 1   12    8   79 o   30.790   2.6229   39.545   6.5204   45.457   11.200   36.514   8.0195   32.421   4.3474   29.342   3.4167 3.078625 5.529362 
1 1 1   12    8   80 o   37.322   2.2626   57.704   6.8510   53.042   11.333   60.389   8.6003   35.165   4.0263   38.024   2.7942 -2.859428 4.900898 
1 1 1   12    8   81 o   13.744   5.3267   5.9590   8.5154   4.3734   10.503   8.9998   14.546   14.049   5.7555   17.134   6.8614 -3.084213 8.955655 
1 1 1   12    8   82 o   25.440   4.9642   28.939   9.9247   26.751   11.010   38.421   22.922   24.146   5.6882   27.478   8.9340 -3.332628 10.59110 
1 1 1   12    8   83 o   41.692   2.8500   72.778   9.6276   67.334   11.845   83.375   16.526   39.735   3.6996   43.676   4.7167 -3.940716 5.994490 
1 1 1   12    8   84 o   17.822   5.7777   14.151   9.5907   12.751   12.561   16.108   14.851   17.744   6.5602   19.442   7.1428 -1.698402 9.698271 
1 1 1   12    8   85 f   56.723   2.5740  134.076   11.871  136.180   15.580  131.165   18.328   56.718   3.3852   55.184   4.1039 1.534595 5.319907 
1 1 1   12    8   86 o   44.176   3.0453   82.274   10.899   90.922   14.280   70.208   16.867   46.008   3.8428   39.435   5.3879 6.572975 6.617919 
1 1 1   12    8   87 o   25.056   4.9972   28.541   9.8483   26.296   12.726   31.891   15.549   23.354   6.4650   25.334   7.1943 -1.980669 9.672354 
1 1 1   12    8   88 o   24.056   4.7502   26.226   8.9843   17.343   10.788   46.336   16.231   19.223   6.1177   30.904   6.6409 -11.68097 9.029264 
1 1 1   12    8   89 o   16.631   5.5486   12.453   8.8210   11.688   10.668   14.106   15.683   16.585   6.0602   18.467   7.2087 -1.882915 9.417609 
1 1 1   12    8   90 o   12.432   5.1960   2.9688   8.7999   7.2794   10.642  -6.3537   15.650   14.772   5.8845   13.397   6.1758 1.375525 8.530416 
1 1 1   12    8   91 o   32.318   3.7214   45.648   9.6249   50.041   11.652   36.211   17.076   33.440   4.3799   26.103   7.5796 7.337379 8.754045 
1 1 1   12    8   92 o   10.431   4.7606  -3.7418   8.9879  -8.8794   10.760   8.1175   16.348   10.382   4.8949   16.564   7.0116 -6.182081 8.551169 
1 1 1   12    8   93 o   23.976   5.4042   27.607   10.308   17.844   12.678   46.651   17.707   18.985   6.6437   29.585   7.3700 -10.59937 9.922460 
1 1 1   12    8   94 o   31.318   3.8232   43.504   9.5581   31.116   12.879   58.696   14.261   24.692   6.3598   35.415   5.0859 -10.72258 8.143298 
1 1 1   12    8   95 o   36.051   3.3532   56.679   9.7411   35.506   12.982   83.962   14.736   26.481   6.1346   43.122   4.2474 -16.64140 7.461465 
1 1 1   12    8   96 f   28.910   4.4518   38.612   10.155   35.435   14.848   41.403   13.918   25.527   6.9503   28.484   6.1731 -2.957041 9.295919 
1 1 1   12    8   97 o   20.784   5.4545   21.600   9.3555   33.427   12.715   7.6378   13.815   25.346   6.2049   15.225   6.4453 10.12034 8.946681 
1 1 1   12    8   98 o   58.921   2.3999  146.978   11.502  147.198   15.712  146.724   16.885   57.967   3.3392   57.528   3.6190 0.4397812 4.924230 
1 1 1   12    8   99 o   27.797   4.3092   35.871   9.4482   28.374   12.930   44.459   13.840   22.778   6.5900   29.463   5.9675 -6.684174 8.890403 
1 1 1   12    8  100 o   22.397   5.5186   25.422   10.009   33.827   13.116   13.700   15.488   25.108   6.3926   17.037   6.9852 8.070637 9.468810 
1 1 1   12    8  101 o   19.342   5.8463   19.604   9.9959   26.015   13.319   11.337   15.126   21.459   6.7938   16.249   6.8033 5.210100 9.614616 
1 1 1   12    8  102 o   15.618   5.9891   11.611   10.683   32.990   15.768  -6.5333   14.526   23.436   7.3885   12.173   5.7231 11.26294 9.345769 
1 1 1   12    8  103 o   19.980   6.2397   21.809   11.272   29.967   16.083   13.932   15.803   22.093   7.4928   16.905   7.0059 5.188272 10.25795 
1 1 1   12    8  104 o   18.655   6.2853   19.052   11.316   21.644   16.001   16.458   16.005   19.133   7.3316   17.562   7.1385 1.571386 10.23277 
1 1 1   12    8  105 o   21.644   7.6022   29.604   16.610   29.604   16.610   0.0000   0.0000   21.644   7.6022  ?   ?  0.000000 7.602178 
1 1 1   12    8  106 o   29.203   6.1362   45.630   14.142   45.630   14.142   0.0000   0.0000   29.203   6.1362  ?   ?  0.000000 6.136189 
1 1 1   12    8  107 o   23.344   6.7562   31.606   13.588   31.606   13.588   0.0000   0.0000   23.344   6.7562  ?   ?  0.000000 6.756227 
1 1 1   12    8  108 o   13.646   6.0214   4.3346   13.097   4.3346   13.097   0.0000   0.0000   13.646   6.0214  ?   ?  0.000000 6.021367 
1 1 1   12    8  109 o   15.263   6.3599   10.507   13.124   10.507   13.124   0.0000   0.0000   15.263   6.3599  ?   ?  0.000000 6.359932 
1 1 1   12    8  110 o   16.089   6.9761   11.784   16.915   11.784   16.915   0.0000   0.0000   16.089   6.9761  ?   ?  0.000000 6.976106 
1 1 1   12    8  111 o   10.148   5.0347 -25.6921   15.865 -25.6921   15.865   0.0000   0.0000   10.148   5.0347  ?   ?  0.000000 5.034676 
1 1 1   12    9 -108 o   15.205   6.3888   10.279   13.412   10.279   13.412   0.0000   0.0000   15.205   6.3888  ?   ?  0.000000 6.388819 
1 1 1   12    9 -107 o   12.069   5.5521  -1.5697   12.553  -1.5697   12.553   0.0000   0.0000   12.069   5.5521  ?   ?  0.000000 5.552064 
1 1 1   12    9 -106 o   11.753   5.4804  -3.8086   12.870  -3.8086   12.870   0.0000   0.0000   11.753   5.4804  ?   ?  0.000000 5.480379 
1 1 1   12    9 -105 o   13.625   5.9922   4.6886   12.871   4.6886   12.871   0.0000   0.0000   13.625   5.9922  ?   ?  0.000000 5.992224 
1 1 1   12    9 -104 o   16.214   6.5982   13.256   13.693   13.256   13.693   0.0000   0.0000   16.214   6.5982  ?   ?  0.000000 6.598230 
1 1 1   12    9 -103 o   20.127   6.8773   24.053   13.553   24.053   13.553   0.0000   0.0000   20.127   6.8773  ?   ?  0.000000 6.877311 
1 1 1   12    9 -102 o   19.280   6.8694   21.775   13.602   21.775   13.602   0.0000   0.0000   19.280   6.8694  ?   ?  0.000000 6.869398 
1 1 1   12    9 -101 o   9.7083   4.7533 -17.3892   12.639 -17.3892   12.639   0.0000   0.0000   9.7083   4.7533  ?   ?  0.000000 4.753267 
1 1 1   12    9 -100 o   9.6161   4.7038 -16.9234   12.293 -16.9234   12.293   0.0000   0.0000   9.6161   4.7038  ?   ?  0.000000 4.703785 
1 1 1   12    9  -99 o   24.552   5.9931   31.967   11.888   27.768   13.192   50.104   27.417   22.063   6.7261   24.802   9.5727 -2.739283 11.69942 
1 1 1   12    9  -98 o   16.149   6.2503   12.729   11.712   12.186   13.015   15.045   26.862   16.111   6.4770   18.228   8.2845 -2.117188 10.51589 
1 1 1   12    9  -97 o   9.5578   4.5710  -9.7228   10.068 -11.0553   12.247  -6.9457   17.680   10.483   5.0210   13.269   6.2616 -2.785892 8.026134 
1 1 1   12    9  -96 o   9.7725   4.6369  -8.2695   9.9501  -8.8989   12.079  -6.9408   17.549   10.778   5.1127   13.276   6.2568 -2.497837 8.080043 
1 1 1   12    9  -95 o   14.194   5.4357   8.6474   8.7924   12.722   12.348   4.4571   12.522   16.381   6.3959   13.865   6.0070 2.515923 8.774456 
1 1 1   12    9  -94 o   31.159   3.7439   43.598   9.3187   48.372   13.243   38.916   13.115   31.428   5.3615   27.516   6.0154 3.912590 8.058003 
1 1 1   12    9  -93 o   17.471   5.5254   15.204   8.8117   15.237   12.573   15.172   12.353   17.464   6.5426   17.428   6.4940 0.3685760E-01 9.218331 
1 1 1   12    9  -92 o   28.064   4.1090   35.811   9.1213   31.470   12.909   40.140   12.890   24.516   6.3943   28.408   5.7636 -3.892191 8.608461 
1 1 1   12    9  -91 o   25.710   4.4307   30.453   8.9505   29.497   12.727   31.390   12.590   23.842   6.4105   24.761   6.2408 -0.9186687 8.946622 
1 1 1   12    9  -90 o   10.113   4.6259  -3.6491   8.5483  -8.9579   12.053   1.7244   12.126   10.995   5.1828   13.346   5.8445 -2.351370 7.811505 
1 1 1   12    9  -89 o   16.388   5.4917   12.536   8.6397   11.459   12.324   13.577   12.116   16.483   6.4026   17.234   6.4293 -0.7507401 9.073546 
1 1 1   12    9  -88 o   15.517   5.5238   10.627   8.7933   18.747   12.580   2.8709   12.296   19.443   6.6264   13.846   5.9756 5.596921 8.922867 
1 1 1   12    9  -87 o   13.476   5.4268   5.5165   9.1532   5.8214   14.690   5.3231   11.702   15.580   6.6230   14.406   6.0043 1.174978 8.939557 
1 1 1   12    9  -86 o   13.996   5.2949   7.4125   8.2795   16.563   11.810  -1.4332   11.611   18.716   6.4191   12.546   5.5952 6.169326 8.515378 
1 1 1   12    9  -85 o   33.020   3.3715   46.848   8.9475   65.301   13.205   31.183   12.166   38.469   4.2835   25.505   5.9597 12.96358 7.339392 
1 1 1   12    9  -84 o   18.376   5.5772   15.697   9.0838   7.4614   14.558   20.948   11.624   16.258   6.7298   20.874   6.3034 -4.615602 9.220822 
1 1 1   12    9  -83 o   9.4759   4.4066  -6.1386   8.2312  -7.3306   11.939  -5.0588   11.363   11.535   5.3446   11.694   5.3429 -0.1584425 7.557181 
1 1 1   12    9  -82 o   45.524   2.6651   86.728   9.8466   85.521   14.157   87.858   13.704   44.529   3.9408   45.255   3.7487 -0.7250214 5.438969 
1 1 1   12    9  -81 o   30.097   3.7609   39.077   9.0259   34.767   12.964   43.132   12.574   27.271   5.9954   30.935   5.1688 -3.664410 7.915905 
1 1 1   12    9  -80 o   20.306   4.9159   18.684   8.0489   11.840   10.756   27.391   12.133   16.929   6.0995   24.137   6.1501 -7.208649 8.661809 
1 1 1   12    9  -79 o   22.389   4.6078   22.360   8.1287   24.833   10.738   19.042   12.440   23.185   5.7181   20.335   6.5792 2.850149 8.716801 
1 1 1   12    9  -78 o   36.910   2.8304   57.081   8.4509   56.901   11.233   57.316   12.828   36.443   3.8389   36.293   4.4277 0.1495247 5.860149 
1 1 1   12    9  -77 o   22.437   4.5316   22.329   8.0021   23.579   10.921   20.880   11.758   22.599   5.8750   21.231   6.3234 1.367292 8.631361 
1 1 1   12    9  -76 o   38.083   2.8142   60.642   8.6744   54.419   11.783   68.006   12.817   35.543   4.1446   39.848   4.0000 -4.304367 5.759965 
1 1 1   12    9  -75 o   46.373   2.0386   88.725   7.6873   91.173   12.393   87.194   9.8006   46.565   3.2861   45.784   2.6372 0.7810440 4.213448 
1 1 1   12    9  -74 o   31.295   3.0947   41.198   7.7912   37.137   13.363   43.289   9.5900   28.571   5.9319   31.856   3.7658 -3.284826 7.026259 
1 1 1   12    9  -73 o   29.749   3.0993   37.230   7.4055   37.622   11.367   36.941   9.7616   29.240   4.9451   29.257   4.2146 -0.1677704E-01 6.497406 
1 1 1   12    9  -72 o   45.760   2.1654   86.397   8.0542   98.144   12.568   78.210   10.492   48.439   3.2009   43.291   2.9916 5.147827 4.381276 
1 1 1   12    9  -71 o   24.430   3.6093   25.465   6.9715   32.430   11.263   21.139   8.8764   27.035   5.3002   21.796   5.0889 5.239449 7.347763 
1 1 1   12    9  -70 o   33.477   2.7861   46.679   7.5340   52.851   11.873   42.518   9.7480   35.173   4.2255   31.625   3.8613 3.548029 5.723990 
1 1 1   12    9  -69 o   84.527   1.6720  292.724   11.520  303.382   16.467  282.507   16.122   85.800   2.3567   82.780   2.3917 3.020378 3.357750 
1 1 1   12    9  -68 o   11.121   4.5982   1.7707   6.7862  -0.8504   10.756   3.5040   8.7467   12.732   5.5413   13.017   5.2822 -0.2844048 7.655620 
1 1 1   12    9  -67 o   40.541   2.4572   67.906   8.0823   67.155   12.096   68.512   10.863   39.958   3.7577   40.500   3.3197 -0.5411797 5.014063 
1 1 1   12    9  -66 o   36.929   2.6627   56.482   7.9616   44.089   11.895   66.541   10.716   32.038   4.6938   39.930   3.3224 -7.892277 5.750684 
1 1 1   12    9  -65 o   45.036   3.1204   84.238   11.384   90.394   12.833   61.489   24.668   46.579   3.4032   36.330   8.4842 10.24948 9.141335 
1 1 1   12    9  -64 o   61.591   1.9752  155.611   9.9037  162.647   16.709  151.801   12.297   62.620   3.2849   60.717   2.4898 1.902515 4.121843 
1 1 1   12    9  -63 o   25.311   3.7392   27.127   7.4828   21.357   13.701   29.579   8.9325   22.143   6.8736   26.301   4.3159 -4.158213 8.116295 
1 1 1   12    9  -62 o   54.594   2.1172  122.334   9.4040  128.741   16.235  119.099   11.536   55.647   3.5985   53.762   2.6405 1.885201 4.463316 
1 1 1   12    9  -61 o   86.446   1.6359  305.521   11.528  310.321   19.848  303.078   14.161   86.818   2.8082   86.030   2.0194 0.7875214 3.458933 
1 1 1   12    9  -60 o   63.700   1.9502  166.219   10.114  156.730   21.450  168.932   11.469   61.246   4.3243   64.175   2.1957 -2.928703 4.849859 
1 1 1   12    9  -59 o   10.120   4.4307  -1.4226   6.9656   7.5754   17.168  -3.1956   7.6210   18.366   7.4195   10.060   4.5064 8.306166 8.680878 
1 1 1   12    9  -58 o   54.609   1.9787  122.167   8.7937  146.754   16.262  112.005   10.454   59.588   3.3615   52.212   2.4632 7.376286 4.167439 
1 1 1   12    9  -57 o   42.965   2.2284   75.777   7.7779   87.056   13.365   70.000   9.5644   45.809   3.6082   41.192   2.8663 4.617462 4.608160 
1 1 1   12    9  -56 o  119.480   1.4809  582.929   14.423  602.902   22.046  567.984   19.071  121.366   2.2285  117.850   1.9852 3.515289 2.984469 
1 1 1   12    9  -55 o   39.418   2.4742   63.889   7.9098   76.955   13.686   57.335   9.6928   43.007   3.9478   37.213   3.2272 5.793865 5.099057 
1 1 1   12    9  -54 o   69.788   1.8243  199.151   10.369  184.101   17.177  207.779   13.006   66.877   3.1599   71.226   2.2429 -4.349350 3.874977 
1 1 1   12    9  -53 f   60.316   2.0567  148.909   10.097  154.206   18.520  146.669   12.045   61.085   3.7374   59.802   2.4762 1.282543 4.483254 
1 1 1   12    9  -52 o   57.252   2.2227  134.257   10.353  108.398   18.899  145.344   12.376   50.997   4.5957   59.526   2.5564 -8.529297 5.258890 
1 1 1   12    9  -51 o  105.697   1.7240  456.236   14.854  533.949   26.794  421.756   17.848  114.106   2.8830  101.567   2.1557 12.53862 3.599851 
1 1 1   12    9  -50 o   37.447   2.8869   57.790   8.7443   43.213   14.789   65.626   10.843   31.726   5.9366   39.845   3.3699 -8.118458 6.826393 
1 1 1   12    9  -49 f   96.512   1.7473  380.336   13.746  367.714   19.529  392.730   19.351   94.768   2.5303   97.989   2.4227 -3.220680 3.503135 
1 1 1   12    9  -48 o   72.900   1.8012  217.007   10.703  213.715   16.791  219.261   13.892   72.187   2.8592   73.195   2.3313 -1.007721 3.689140 
1 1 1   12    9  -47 o  125.027   1.5287  637.934   15.580  650.628   23.576  628.093   20.759  126.164   2.2925  123.995   2.0538 2.168732 3.077933 
1 1 1   12    9  -46 o   78.967   1.7057  254.544   10.979  246.156   16.904  260.664   14.440   77.522   2.6791   79.837   2.2210 -2.315414 3.480029 
1 1 1   12    9  -45 o  100.779   1.5605  414.463   12.820  438.268   19.661  396.857   16.908  103.554   2.3291   98.566   2.1044 4.988785 3.139036 
1 1 1   12    9  -44 o  139.365   1.5174  792.509   17.238  782.571   25.468  800.912   23.418  138.394   2.2576  140.037   2.0515 -1.642746 3.050473 
1 1 1   12    9  -43 o   28.934   3.4662   34.798   8.0127   41.230   13.157   31.005   10.102   31.169   5.3723   27.053   4.7546 4.116268 7.174123 
1 1 1   12    9  -42 o   26.649   3.7239   29.680   7.8688   44.261   12.810   20.844   9.9718   32.403   5.0115   22.037   5.5540 10.36616 7.480784 
1 1 1   12    9  -41 o   96.628   1.7545  381.066   13.819  365.759   20.269  394.362   18.890   94.551   2.6324   98.246   2.3588 -3.694557 3.534605 
1 1 1   12    9  -40 o  129.327   1.8374  682.670   19.370  690.618   31.505  677.839   24.561  129.927   2.9747  128.812   2.3391 1.115295 3.784258 
1 1 1   12    9  -39 f   62.862   2.2381  161.593   11.450  183.802   19.047  149.027   14.328   66.894   3.5053   60.292   2.9240 6.601906 4.564716 
1 1 1   12    9  -38 o   98.893   1.9816  399.236   15.974  440.118   25.275  372.044   20.613  103.686   2.9936   95.370   2.6541 8.315796 4.000731 
1 1 1   12    9  -37 o   52.921   2.7026  114.770   11.620  117.830   17.963  112.568   15.238   53.428   4.1573   52.299   3.5962 1.129238 5.496861 
1 1 1   12    9  -36 o   57.958   2.4844  137.485   11.710  135.147   17.321  139.454   15.892   57.311   3.7279   58.272   3.3598 -0.9606552 5.018562 
1 1 1   12    9  -35 o  129.038   1.7140  679.389   18.028  654.295   31.204  691.963   22.088  126.485   3.0265  130.192   2.0813 -3.707596 3.673064 
1 1 1   12    9  -34 o  186.551   1.7325  1419.97   26.346  1417.25   41.669  1421.78   34.007  186.219   2.7450  186.603   2.2357 -0.3840027 3.540267 
1 1 1   12    9  -33 o  115.511   1.8159  544.449   17.098  481.789   32.736  567.956   20.051  108.398   3.7103  117.956   2.0853 -9.558182 4.256175 
1 1 1   12    9  -32 o   49.680   2.4560  101.045   9.9150   70.659   16.311  118.852   12.487   41.175   4.9595   53.851   2.8548 -12.67620 5.722508 
1 1 1   12    9  -31 o   78.020   1.8661  248.381   11.868  256.201   19.689  243.918   14.874   79.103   3.0593   77.253   2.3648 1.849968 3.866695 
1 1 1   12    9  -30 o   75.624   1.8687  233.355   11.519  263.769   19.372  216.716   14.328   80.278   2.9654   72.810   2.4175 7.467590 3.825916 
1 1 1   12    9  -29 o   77.553   1.8637  245.401   11.782  249.499   19.629  243.094   14.730   78.062   3.0910   77.127   2.3457 0.9347534 3.880227 
1 1 1   12    9  -28 o   68.580   2.1049  192.135   11.753  188.861   22.787  193.322   13.719   67.767   4.1450   68.764   2.4514 -0.9969254 4.815633 
1 1 1   12    9  -27 o   81.835   1.8121  273.221   12.088  311.054   20.218  252.172   15.080   87.207   2.8479   78.557   2.3577 8.649971 3.697170 
1 1 1   12    9  -26 o   64.980   2.0427  172.477   10.807  167.538   17.884  175.318   13.562   63.909   3.4457   65.473   2.5461 -1.564201 4.284334 
1 1 1   12    9  -25 o   86.946   1.7781  308.393   12.602  290.149   20.389  319.671   16.031   84.212   2.9748   88.470   2.2247 -4.257919 3.714700 
1 1 1   12    9  -24 o   92.208   1.7505  346.839   13.158  341.378   21.472  350.122   16.650   91.365   2.8867   92.619   2.2053 -1.254799 3.632661 
1 1 1   12    9  -23 o   34.582   3.6352   49.459   10.094   68.238   19.615   42.694   11.773   40.251   6.1750   31.938   4.6592 8.312969 7.735609 
1 1 1   12    9  -22 o  195.326   2.6160  1557.96   41.651   0.0000   0.0000  1557.96   41.651  ?   ?   195.326   2.6160 0.000000 2.615972 
1 1 1   12    9  -21 o  100.336   1.8363  410.700   15.019  418.068   28.673  407.914   17.631  101.051   3.4861   99.978   2.1635 1.073906 4.102850 
1 1 1   12    9  -20 o   50.172   3.0870  103.245   12.564   0.0000   0.0000  103.245   12.564  ?   ?    50.172   3.0870 0.000000 3.086971 
1 1 1   12    9  -19 o   94.498   1.7980  364.264   13.850  339.701   23.660  377.068   17.082   91.118   3.1904   96.125   2.1800 -5.007294 3.864079 
1 1 1   12    9  -18 o  111.828   1.9166  510.176   17.471  485.752   39.976  515.942   19.424  108.791   4.5176  112.446   2.1191 -3.655159 4.989974 
1 1 1   12    9  -17 o  144.998   1.9094  857.692   22.568  859.723   52.089  857.222   25.040  144.811   4.4179  144.942   2.1194 -0.1316223 4.900005 
1 1 1   12    9  -16 o   64.949   2.4034  172.416   12.703  113.070   30.317  185.053   13.990   51.820   7.3860   67.279   2.5556 -15.45918 7.815603 
1 1 1   12    9  -15 o  132.021   2.1241  711.175   22.859   0.0000   0.0000  711.175   22.859  ?   ?   132.021   2.1241 0.000000 2.124140 
1 1 1   12    9  -14 o  109.201   1.7694  486.395   15.750  496.465   27.619  481.542   19.173  110.198   3.0777  108.634   2.1651 1.563667 3.762963 
1 1 1   12    9  -13 o  236.880   2.0507  2289.29   39.596  2355.03   69.816  2258.12   48.077  240.010   3.5685  235.202   2.5076 4.808136 4.361458 
1 1 1   12    9  -12 o  156.061   1.7943  993.414   22.826  944.250   38.381  1020.32   28.392  152.035   3.0969  158.130   2.2027 -6.094467 3.800380 
1 1 1   12    9  -11 o  178.861   2.0023  1305.11   29.193  1316.70   46.557  1297.60   37.476  179.524   3.1815  178.290   2.5786 1.233673 4.095248 
1 1 1   12    9  -10 o   33.610   4.0869   46.892   10.967   71.508   18.057   32.504   13.805   41.388   5.4872   27.573   6.2825 13.81515 8.341394 
1 1 1   12    9   -9 o   97.322   2.0211  386.399   16.033  361.429   25.679  402.353   20.526   93.987   3.3572   99.251   2.5392 -5.263893 4.209262 
1 1 1   12    9   -8 o  153.041   1.9495  955.425   24.320  980.402   39.664  940.378   30.786  154.921   3.1408  151.789   2.4881 3.131592 4.006936 
1 1 1   12    9   -7 o  105.147   1.9826  451.009   16.993  474.755   27.974  437.124   21.392  107.756   3.1883  103.486   2.5359 4.270020 4.073799 
1 1 1   12    9   -6 o   52.016   2.8354  110.802   11.977  121.369   20.064  104.952   14.928   54.251   4.5798   50.539   3.6482 3.712242 5.855243 
1 1 1   12    9   -5 o   87.265   1.9516  310.639   13.882  344.810   25.005  295.413   16.691   91.802   3.3470   85.046   2.4101 6.756302 4.124475 
1 1 1   12    9   -4 o   28.371   4.6424   33.811   10.365   15.364   18.497   42.256   12.515   21.627   7.9671   31.731   5.0040 -10.10373 9.408181 
1 1 1   12    9   -3 o  334.981   2.8103  4581.56   76.738  4719.95  124.475  4496.72   97.462  339.536   4.4974  331.676   3.6048 7.859253 5.763804 
1 1 1   12    9   -2 o   65.718   2.5750  176.556   13.767  160.910   21.492  187.445   17.929   62.566   4.2390   67.658   3.2605 -5.091919 5.347913 
1 1 1   12    9   -1 o  118.814   2.0034  575.882   19.403  578.949   30.652  573.831   25.064  119.009   3.1625  118.567   2.5933 0.4425507 4.089830 
1 1 1   12    9    0 o   98.739   2.1082  397.750   16.968  462.508   27.724  358.962   21.457  106.357   3.2014   93.723   2.8117 12.63422 4.260863 
1 1 1   12    9    1 o  200.242   2.3886  1636.32   38.989  1614.52   54.416  1659.33   55.891  198.781   3.3583  201.513   3.4025 -2.732483 4.780721 
1 1 1   12    9    2 o  142.888   1.9828  832.878   23.094  843.739   36.844  825.848   29.639  143.722   3.1449  142.243   2.5562 1.478760 4.052784 
1 1 1   12    9    3 o  144.591   1.9826  852.849   23.367  864.751   37.149  845.056   30.059  145.501   3.1322  143.887   2.5628 1.614365 4.047010 
1 1 1   12    9    4 o   73.947   2.1368  223.282   12.867  227.794   22.714  221.150   15.614   74.549   3.7499   73.559   2.6080 0.9895172 4.567686 
1 1 1   12    9    5 o  146.292   1.8012  872.904   21.479  842.802   37.179  887.985   26.315  143.637   3.1754  147.525   2.1883 -3.887726 3.856401 
1 1 1   12    9    6 o  320.701   2.3078  4196.90   60.331  4098.39   90.805  4274.74   80.724  316.663   3.5179  323.513   3.0611 -6.850769 4.663209 
1 1 1   12    9    7 o   36.304   3.3741   54.317   9.8707   42.341   15.485   62.514   12.811   31.552   6.2417   38.876   4.1045 -7.324236 7.470287 
1 1 1   12    9    8 o  184.973   1.7327  1395.47   26.126  1392.46   40.176  1397.68   34.391  184.687   2.6686  185.073   2.2796 -0.3860931 3.509745 
1 1 1   12    9    9 o  106.785   1.7050  465.071   14.842  458.453   23.064  469.749   19.390  105.937   2.6730  107.296   2.2169 -1.358719 3.472664 
1 1 1   12    9   10 o   36.019   3.3157   53.459   9.6260   46.864   15.128   57.945   12.478   33.312   5.7809   37.402   4.1631 -4.090179 7.123915 
1 1 1   12    9   11 o  113.164   1.7952  522.343   16.560  517.695   23.727  526.758   23.124  112.614   2.5847  113.601   2.4972 -0.9873428 3.593986 
1 1 1   12    9   12 o   98.573   1.8551  396.349   14.906  394.919   21.474  397.680   20.709   98.315   2.6820   98.667   2.5770 -0.3524857 3.719415 
1 1 1   12    9   13 o  118.336   1.7724  571.176   17.097  542.146   24.108  600.548   24.250  115.242   2.5663  121.299   2.4525 -6.056801 3.549801 
1 1 1   12    9   14 o   41.195   3.1177   69.725   10.392   64.191   15.183   74.602   14.253   39.282   4.8443   42.492   4.1684 -3.210026 6.390821 
1 1 1   12    9   15 o  107.720   1.7862  473.302   15.684  485.802   22.887  462.235   21.536  109.087   2.5738  106.414   2.4828 2.672806 3.576116 
1 1 1   12    9   16 o  210.907   1.7990  1814.43   30.929  1809.86   47.331  1817.84   40.859  210.526   2.7581  211.041   2.3751 -0.5155945 3.639771 
1 1 1   12    9   17 o  135.732   1.6363  751.395   18.104  730.351   28.013  766.490   23.725  133.751   2.5694  137.057   2.1236 -3.305634 3.333357 
1 1 1   12    9   18 o   54.864   2.4560  123.118   10.956  119.085   19.260  125.047   13.321   53.737   4.4364   55.248   2.9688 -1.511189 5.338143 
1 1 1   12    9   19 o  143.246   1.7490  836.989   20.423  812.862   35.351  849.076   25.021  141.048   3.0746  144.249   2.1279 -3.200775 3.739171 
1 1 1   12    9   20 o  214.371   1.9435  1874.90   33.962  1917.29   59.958  1854.87   41.210  216.556   3.3966  213.170   2.3716 3.385406 4.142624 
1 1 1   12    9   21 o   70.815   1.9521  204.759   11.257  196.764   17.857  210.033   14.502   69.314   3.1688   71.683   2.4857 -2.368134 4.027412 
1 1 1   12    9   22 o   48.837   2.6425   97.682   10.481  113.123   20.014   91.848   12.302   52.308   4.7454   47.295   3.2101 5.013042 5.729141 
1 1 1   12    9   23 o   63.677   2.2067  165.691   11.437  183.809   21.716  158.737   13.454   66.885   4.0013   62.289   2.6558 4.596458 4.802489 
1 1 1   12    9   24 o   65.200   2.3959  173.781   12.712  213.779   22.082  153.957   15.546   72.179   3.7662   61.296   3.1216 10.88311 4.891711 
1 1 1   12    9   25 o  109.168   1.6461  486.115   14.648  500.806   23.498  476.778   18.733  110.739   2.6031  108.085   2.1262 2.653564 3.361117 
1 1 1   12    9   26 o  132.587   1.6182  717.053   17.489  756.591   28.018  691.813   22.386  136.118   2.5251  130.198   2.1093 5.920013 3.290168 
1 1 1   12    9   27 o  110.727   1.6389  500.115   14.793  526.086   23.826  483.824   18.871  113.498   2.5753  108.879   2.1262 4.619370 3.339611 
1 1 1   12    9   28 o   66.699   2.0182  181.713   10.960  179.542   17.756  183.049   13.931   66.178   3.3019   66.900   2.5594 -0.7218323 4.177686 
1 1 1   12    9   29 o   71.635   2.0627  209.607   12.032  214.838   22.815  207.591   14.162   72.327   3.8839   71.259   2.4417 1.068398 4.587674 
1 1 1   12    9   30 o  107.622   1.7705  472.552   15.532  469.004   28.044  474.121   18.655  107.044   3.2177  107.776   2.1234 -0.7324371 3.855139 
1 1 1   12    9   31 o  124.223   1.6146  629.485   16.349  650.229   26.174  616.213   20.936  126.172   2.5449  122.870   2.0903 3.301598 3.293361 
1 1 1   12    9   32 o   20.805   5.1565   18.502   8.7005   35.523   14.528   8.9838   10.864   28.774   6.3632   16.570   6.1055 12.20449 8.818541 
1 1 1   12    9   33 o   18.426   5.4051   14.221   8.6450   15.787   14.526   13.362   10.758   20.515   7.1156   18.454   6.1267 2.060818 9.389761 
1 1 1   12    9   34 o   80.452   1.9160  264.155   12.565  286.935   23.101  254.583   14.974   83.662   3.3944   78.921   2.3302 4.740257 4.117262 
1 1 1   12    9   35 o   52.849   2.3406  114.290   10.058  141.165   17.001   99.820   12.476   58.604   3.5759   49.301   3.1203 9.302952 4.745926 
1 1 1   12    9   36 o  158.027   1.7708  1019.05   22.811  1032.08   41.063  1013.23   27.433  158.823   3.1718  157.532   2.1363 1.290543 3.824152 
1 1 1   12    9   37 o   26.638   4.5305   29.948   9.4857   50.173   18.947   23.183   10.958   34.153   7.0399   23.245   5.8017 10.90799 9.122540 
1 1 1   12    9   38 o  126.287   1.7354  650.803   17.864  705.322   33.223  628.629   21.188  131.295   3.1043  124.082   2.0948 7.212379 3.744944 
1 1 1   12    9   39 f   55.104   3.1012  124.636   13.873  124.172   20.492  125.029   18.851   54.763   4.6340   55.023   4.2354 -0.2601471 6.277903 
1 1 1   12    9   40 o   85.432   2.4103  298.442   16.769  338.831   25.147  266.102   22.502   90.892   3.4001   80.527   3.4359 10.36411 4.833847 
1 1 1   12    9   41 o  134.279   1.9374  736.098   21.206  786.220   28.415  673.092   31.859  138.697   2.5133  128.248   3.0475 10.44922 3.950239 
1 1 1   12    9   42 o   60.682   2.3502  150.682   11.603  155.228   19.361  148.135   14.494   61.382   3.8896   60.094   2.9680 1.287628 4.892621 
1 1 1   12    9   43 o  146.605   1.7306  877.236   20.681  903.913   37.180  865.285   24.886  148.592   3.0696  145.555   2.0975 3.037796 3.717761 
1 1 1   12    9   44 o   56.879   2.2534  132.392   10.427  113.183   19.154  140.482   12.430   52.243   4.5428   58.554   2.6109 -6.311089 5.239655 
1 1 1   12    9   45 o   41.397   2.8359   70.457   9.5120   87.731   17.662   63.399   11.289   45.888   4.7922   39.153   3.5766 6.734669 5.979773 
1 1 1   12    9   46 o   68.722   2.0511  193.082   11.477  196.633   20.732  191.513   13.781   69.113   3.6933   68.393   2.4761 0.7197723 4.446530 
1 1 1   12    9   47 o   33.350   3.4218   46.092   9.1704   22.162   16.300   57.174   11.092   23.246   7.5318   37.132   3.7146 -13.88648 8.397973 
1 1 1   12    9   48 o   34.030   3.3964   47.975   9.2959   49.608   16.736   47.246   11.179   34.000   6.2694   33.631   4.1669 0.3694077 7.527834 
1 1 1   12    9   49 f   15.223   5.5232   7.9925   8.8391   15.412   16.119   4.8021   10.570   20.697   7.4656   14.727   5.8652 5.970464 9.493986 
1 1 1   12    9   50 o   13.052   5.3262   2.7386   8.9518 -21.4121   16.150   13.449   10.755   12.126   5.7965   18.401   6.1265 -6.275279 8.434037 
1 1 1   12    9   51 o   65.508   2.3016  175.735   12.271  180.848   20.185  172.737   15.454   66.198   3.7562   64.851   2.9311 1.347107 4.764441 
1 1 1   12    9   52 o   13.710   5.4122   4.4879   8.9262   13.036   16.665   1.0493   10.570   20.008   7.5247   13.419   5.6570 6.589143 9.413989 
1 1 1   12    9   53 f   12.781   5.1753   2.9866   8.3750  -7.9416   15.414   7.5641   9.9760   13.936   6.3105   15.491   5.8228 -1.555753 8.586463 
1 1 1   12    9   54 o   25.066   4.3031   26.679   8.4757   36.336   15.485   22.548   10.127   28.808   6.7182   22.809   5.5094 5.998995 8.688436 
1 1 1   12    9   55 o   64.709   1.9706  171.360   10.382  160.822   17.912  176.691   12.741   62.402   3.5359   65.647   2.3848 -3.245705 4.264962 
1 1 1   12    9   56 o   67.754   2.0568  187.952   11.346  196.920   18.416  182.466   14.405   69.115   3.2782   66.656   2.6565 2.459419 4.219396 
1 1 1   12    9   57 o   21.983   4.4932   20.757   7.7795   9.5790   14.342   25.417   9.2602   17.960   6.9256   24.307   4.8437 -6.347748 8.451401 
1 1 1   12    9   58 o   81.397   1.8545  270.935   12.305  262.307   24.411  273.874   14.247   79.590   3.7734   81.764   2.1394 -2.174675 4.337722 
1 1 1   12    9   59 o  138.136   1.7271  780.109   19.447  770.811   36.127  783.903   23.076  136.783   3.2402  138.386   2.0457 -1.603409 3.831899 
1 1 1   12    9   60 o   68.623   2.1030  193.039   11.750  168.819   21.792  202.967   13.952   63.609   4.2269   70.299   2.4384 -6.690132 4.879780 
1 1 1   12    9   61 o   50.261   2.2917  103.798   9.3644  112.225   15.733   99.174   11.653   51.926   3.7421   49.000   2.9309 2.925880 4.753294 
1 1 1   12    9   62 o   70.403   1.9213  203.088   11.016  213.758   17.959  196.652   13.949   71.938   3.0695   69.156   2.4784 2.782394 3.945181 
1 1 1   12    9   63 o   26.336   3.6102   29.257   7.5465   28.926   14.170   29.388   8.9161   25.434   6.7309   26.213   4.3234 -0.7783432 7.999825 
1 1 1   12    9   64 o   27.072   3.4609   30.834   7.4629   30.082   14.128   31.125   8.7891   25.898   6.6565   27.031   4.1188 -1.133463 7.827719 
1 1 1   12    9   65 o   63.298   1.8765  164.292   9.6715  173.467   17.327  160.141   11.656   64.640   3.2993   62.399   2.2956 2.241467 4.019354 
1 1 1   12    9   66 o   89.873   1.7782  330.841   13.027  337.956   26.466  328.566   14.966   90.073   3.6119   89.490   2.0515 0.5825577 4.153857 
1 1 1   12    9   67 o   11.331   4.6604   2.0235   6.9223  -5.6580   13.446   4.7937   8.0746   13.091   5.9144   13.201   5.1668 -0.1096525 7.853424 
1 1 1   12    9   68 o   30.913   3.0522   39.956   7.5909   32.560   13.951   43.067   9.0474   26.794   6.4628   31.974   3.5300 -5.179989 7.364034 
1 1 1   12    9   69 o   26.455   4.4104   30.260   9.1762   39.207   13.907   23.361   12.212   29.595   5.9708   22.731   6.3482 6.863724 8.714937 
1 1 1   12    9   70 o   18.839   4.1993   15.515   6.2838   23.369   11.066   11.778   7.6341   22.756   5.9126   16.540   5.1302 6.216204 7.828043 
1 1 1   12    9   71 o   35.128   2.4736   51.168   7.0377   41.240   11.803   56.645   8.7665   30.747   4.8716   36.842   2.9436 -6.094797 5.691839 
1 1 1   12    9   72 o   42.886   2.3178   76.044   8.0724   88.533   13.954   69.763   9.8966   45.766   3.7739   40.875   2.9909 4.890263 4.815391 
1 1 1   12    9   73 o   56.453   1.9195  131.133   8.8201  110.865   13.258  147.226   11.814   51.474   3.1751   59.652   2.4347 -8.177528 4.001146 
1 1 1   12    9   74 o   16.886   4.4659   12.608   6.2403   6.1397   10.699   15.942   7.6825   14.822   5.9016   18.888   4.9359 -4.066227 7.693588 
1 1 1   12    9   75 o   24.171   3.2751   24.854   6.2871   16.591   11.317   28.544   7.5615   19.306   6.2773   25.791   3.7027 -6.485525 7.287987 
1 1 1   12    9   76 o   49.536   1.8817  101.077   7.5842  112.870   12.827   94.738   9.4042   51.916   3.0443   47.788   2.4220 4.127274 3.890285 
1 1 1   12    9   77 o   38.460   2.1886   61.262   6.8331   64.660   12.038   59.646   8.2998   38.889   3.8478   37.787   2.7126 1.101387 4.707828 
1 1 1   12    9   78 o   34.780   2.4555   50.370   6.9166   41.072   13.943   53.405   7.9658   29.900   5.9301   35.720   2.7571 -5.820002 6.539713 
1 1 1   12    9   79 o   35.126   2.3772   51.332   6.7667   42.939   13.340   54.240   7.8517   30.773   5.5211   36.009   2.6945 -5.236546 6.143485 
1 1 1   12    9   80 o   24.049   3.0440   24.581   5.8338   36.093   13.214   21.794   6.5018   27.858   5.9967   22.410   3.6873 5.447235 7.039665 
1 1 1   12    9   81 o   37.772   2.8799   59.991   8.8002   64.759   11.886   54.206   13.092   38.821   3.8047   35.018   4.7057 3.803902 6.051376 
1 1 1   12    9   82 o   39.249   2.8406   64.771   9.0266   75.754   12.061   50.783   13.611   42.114   3.5462   33.580   5.1353 8.533951 6.240709 
1 1 1   12    9   83 o   53.845   2.2674  120.504   9.9299  124.334   13.215  115.538   15.049   54.307   2.9969   51.983   3.5732 2.324078 4.663583 
1 1 1   12    9   84 o   19.026   5.5208   16.915   9.0625   10.173   11.021   30.992   15.925   16.100   6.1048   24.724   7.3577 -8.624630 9.560604 
1 1 1   12    9   85 o   46.137   2.5312   89.202   9.4828   91.287   12.570   86.448   14.446   46.198   3.3610   44.502   4.0257 1.696255 5.244345 
1 1 1   12    9   86 o   31.446   3.5303   42.847   8.8933   46.284   11.685   38.115   13.710   32.068   4.6019   28.027   6.1688 4.040817 7.696188 
1 1 1   12    9   87 o   38.101   3.2333   62.310   9.9472   49.483   13.838   76.024   14.308   32.504   5.4132   41.336   4.3097 -8.832481 6.919228 
1 1 1   12    9   88 o   12.334   5.1979   2.8272   8.9187  -6.5477   12.075   14.081   13.230   11.544   5.3577   17.671   6.6914 -6.127338 8.572028 
1 1 1   12    9   89 o   18.139   5.6079   15.909   9.1305   14.457   12.683   17.471   13.155   17.641   6.5787   18.834   6.7504 -1.192734 9.425901 
1 1 1   12    9   90 o   26.787   4.4355   32.851   9.3462   19.024   12.990   47.691   13.458   19.341   6.7277   31.591   5.4211 -12.24978 8.640038 
1 1 1   12    9   91 o   40.797   2.9866   71.530   9.8634   65.915   13.747   77.487   14.160   37.921   4.5373   41.409   4.2555 -3.488056 6.220629 
1 1 1   12    9   92 o   20.417   5.7214   21.025   9.9015   26.771   15.073   16.664   13.132   21.893   7.2517   18.152   6.7083 3.741362 9.878685 
1 1 1   12    9   93 o   32.608   3.9612   48.065   10.313   46.222   15.745   49.449   13.649   29.419   6.7140   31.760   5.4694 -2.341185 8.659821 
1 1 1   12    9   94 o   12.127   5.3431   1.0674   10.276  -1.8933   14.501   4.0540   14.564   13.159   6.0213   14.450   6.3640 -1.291159 8.761103 
1 1 1   12    9   95 o   21.661   5.4843   23.721   9.6915   17.564   12.832   31.894   14.786   18.196   6.6469   23.628   7.1036 -5.432133 9.728371 
1 1 1   12    9   96 o   40.195   3.2671   70.997   10.612   65.313   14.037   78.581   16.213   37.117   4.7480   40.409   5.0309 -3.291534 6.917603 
1 1 1   12    9   97 o   15.690   5.7225   11.948   9.5058   10.623   12.732   13.618   14.288   15.634   6.3625   16.788   6.7733 -1.153174 9.292960 
1 1 1   12    9   98 o   13.669   5.4867   7.2930   9.3238   18.736   14.527  -0.7221   12.158   18.368   6.9986   12.345   5.5960 6.022910 8.960812 
1 1 1   12    9   99 o   17.017   5.5808   14.902   8.9351   17.473   12.964   12.576   12.332   17.884   6.6548   16.097   6.3594 1.786386 9.204757 
1 1 1   12    9  100 o   17.732   5.8811   16.638   9.9131   8.3573   13.620   25.964   14.455   14.983   6.3734   20.892   7.1034 -5.909385 9.543511 
1 1 1   12    9  101 o   16.016   6.1914   12.796   11.483   13.717   13.514   10.405   21.774   16.501   6.6118   16.714   7.5410 -0.2129250 10.02907 
1 1 1   12    9  102 o   24.007   6.8320   33.473   14.007   33.473   14.007   0.0000   0.0000   24.007   6.8320  ?   ?  0.000000 6.831974 
1 1 1   12    9  103 o   20.114   6.8515   23.961   13.449   23.961   13.449   0.0000   0.0000   20.114   6.8515  ?   ?  0.000000 6.851498 
1 1 1   12    9  104 o   17.034   6.6805   15.838   13.522   15.838   13.522   0.0000   0.0000   17.034   6.6805  ?   ?  0.000000 6.680478 
1 1 1   12    9  105 o   18.611   6.7896   20.436   13.383   20.436   13.383   0.0000   0.0000   18.611   6.7896  ?   ?  0.000000 6.789582 
1 1 1   12    9  106 o   12.808   5.7989   1.1896   13.009   1.1896   13.009   0.0000   0.0000   12.808   5.7989  ?   ?  0.000000 5.798940 
1 1 1   12    9  107 o   22.846   7.0350   31.923   14.386   31.923   14.386   0.0000   0.0000   22.846   7.0350  ?   ?  0.000000 7.034988 
1 1 1   12    9  108 o   16.027   7.0171   11.346   17.472   11.346   17.472   0.0000   0.0000   16.027   7.0171  ?   ?  0.000000 7.017116 
1 1 1   12   10 -105 o   14.056   6.8534 -13.3075   25.494 -13.3075   25.494   0.0000   0.0000   14.056   6.8534  ?   ?  0.000000 6.853400 
1 1 1   12   10 -104 o   21.520   6.8765   28.195   13.619   28.195   13.619   0.0000   0.0000   21.520   6.8765  ?   ?  0.000000 6.876522 
1 1 1   12   10 -103 o   14.446   6.2058   7.9494   13.145   7.9494   13.145   0.0000   0.0000   14.446   6.2058  ?   ?  0.000000 6.205780 
1 1 1   12   10 -102 o   14.433   6.1834   7.9430   12.985   7.9430   12.985   0.0000   0.0000   14.433   6.1834  ?   ?  0.000000 6.183439 
1 1 1   12   10 -101 o   15.320   6.3788   10.780   13.188   10.780   13.188   0.0000   0.0000   15.320   6.3788  ?   ?  0.000000 6.378815 
1 1 1   12   10 -100 o   30.623   5.6373   48.659   13.553   48.659   13.553   0.0000   0.0000   30.623   5.6373  ?   ?  0.000000 5.637309 
1 1 1   12   10  -99 f   16.367   6.5730   13.792   13.389   13.792   13.389   0.0000   0.0000   16.367   6.5730  ?   ?  0.000000 6.573002 
1 1 1   12   10  -98 f   15.701   6.4482   11.544   13.226   11.544   13.226   0.0000   0.0000   15.701   6.4482  ?   ?  0.000000 6.448187 
1 1 1   12   10  -97 o   22.772   6.6767   29.759   13.194   29.759   13.194   0.0000   0.0000   22.772   6.6767  ?   ?  0.000000 6.676670 
1 1 1   12   10  -96 o   16.874   6.5694   14.879   12.998   14.879   12.998   0.0000   0.0000   16.874   6.5694  ?   ?  0.000000 6.569448 
1 1 1   12   10  -95 o   10.857   5.1633  -8.9227   12.477  -8.9227   12.477   0.0000   0.0000   10.857   5.1633  ?   ?  0.000000 5.163321 
1 1 1   12   10  -94 o   16.227   6.4240   12.786   12.608   12.786   12.608   0.0000   0.0000   16.227   6.4240  ?   ?  0.000000 6.423981 
1 1 1   12   10  -93 o   16.231   6.2186   12.916   11.511   10.940   12.810   21.205   26.237   15.713   6.3866   19.243   8.5053 -3.529100 10.63618 
1 1 1   12   10  -92 o   16.885   6.2079   14.494   11.221   16.023   12.420   7.6954   26.185   17.513   6.5141   17.264   7.9692 0.2490234 10.29282 
1 1 1   12   10  -91 o   20.064   5.6092   20.659   9.5290   15.277   12.398   28.427   14.895   17.275   6.4917   22.111   7.2026 -4.835972 9.696359 
1 1 1   12   10  -90 o   30.160   4.2595   42.018   10.181   36.901   13.253   49.386   15.902   26.495   6.2400   30.392   6.6076 -3.897234 9.088322 
1 1 1   12   10  -89 o   16.586   5.5668   13.573   8.8773   6.2231   11.920   22.725   13.302   14.247   6.0068   20.332   6.8142 -6.085520 9.083758 
1 1 1   12   10  -88 o   19.354   5.4699   18.690   9.0101   36.891   12.431  -1.4529   13.078   27.115   5.7998   12.796   5.8016 14.31954 8.203401 
1 1 1   12   10  -87 o   19.313   5.4917   18.464   9.0542   26.677   12.352   8.9247   13.312   22.581   6.4120   15.630   6.4492 6.950741 9.094259 
1 1 1   12   10  -86 o   27.037   4.4002   33.483   9.3644   29.503   12.880   37.945   13.639   23.868   6.4626   27.368   6.2513 -3.500423 8.991330 
1 1 1   12   10  -85 o   9.9906   4.6694  -6.5817   9.4300   3.2951   12.222 -21.1123   14.824   13.829   5.9627   10.641   5.1964 3.187955 7.909259 
1 1 1   12   10  -84 o   12.309   5.1825   2.9256   8.8533  -2.6480   12.522   8.4967   12.519   12.547   5.6841   15.552   6.3164 -3.005330 8.497423 
1 1 1   12   10  -83 o   26.417   4.4622   31.685   9.2672   37.333   13.316   26.379   12.906   27.597   6.0833   22.797   6.5802 4.799908 8.961346 
1 1 1   12   10  -82 o   12.544   5.2197   3.3764   8.8225   6.8864   12.661   0.0632   12.301   15.250   6.2907   13.202   5.8301 2.047688 8.576837 
1 1 1   12   10  -81 o   36.527   3.2293   57.107   9.5163   53.441   13.696   60.528   13.232   34.188   5.0679   36.819   4.5022 -2.631748 6.778889 
1 1 1   12   10  -80 o   11.910   4.9435   2.7661   7.8856  -1.8154   10.596   8.4541   11.806   11.976   5.3426   15.636   6.2079 -3.659819 8.190361 
1 1 1   12   10  -79 o   28.639   3.9433   35.885   8.9616   30.699   12.967   40.627   12.399   25.190   6.3249   29.736   5.3101 -4.546247 8.258438 
1 1 1   12   10  -78 o   32.554   3.5162   45.510   9.1828   60.982   13.422   31.896   12.590   37.159   4.5245   25.920   6.0669 11.23890 7.568241 
1 1 1   12   10  -77 o   22.197   3.6323   21.429   6.3452   30.147   12.858   18.623   7.2953   25.138   6.2907   20.343   4.5171 4.794762 7.744501 
1 1 1   12   10  -76 o   66.219   1.6668  180.414   8.9901  163.990   14.131  191.581   11.652   62.609   2.7757   68.050   2.1031 -5.441200 3.482498 
1 1 1   12   10  -75 o   18.114   4.4871   14.719   6.5910   17.013   12.598   13.854   7.7338   19.415   6.6307   17.519   5.1049 1.895510 8.368181 
1 1 1   12   10  -74 o   62.601   1.8607  161.483   9.4845  143.202   16.043  171.305   11.759   58.208   3.3960   64.318   2.2464 -6.110168 4.071727 
1 1 1   12   10  -73 o   29.654   3.0901   37.177   7.3602   40.997   13.259   35.476   8.8488   30.016   5.6256   28.667   3.8868 1.349880 6.837723 
1 1 1   12   10  -72 o   12.624   4.7464   5.4651   6.6296   11.675   11.473   2.3518   8.1231   17.114   6.2795   12.057   5.0121 5.056658 8.034573 
1 1 1   12   10  -71 o   20.788   4.2643   19.063   6.9835   22.746   13.135   17.612   8.2453   22.072   6.7081   19.748   5.0900 2.323730 8.420549 
1 1 1   12   10  -70 o   33.960   2.6392   48.113   7.2486   45.456   11.743   49.749   9.2133   32.266   4.5944   34.304   3.3370 -2.037327 5.678334 
1 1 1   12   10  -69 o   18.803   5.1799   15.862   8.1920   15.688   11.227   16.060   11.980   18.898   6.2584   19.165   6.4672 -0.2671566 8.999503 
1 1 1   12   10  -68 o   20.486   5.2057   18.863   8.7097   16.369   11.128   22.807   13.993   19.236   6.2226   22.256   6.9523 -3.020502 9.330326 
1 1 1   12   10  -67 o   35.472   2.7837   52.477   7.9845   44.197   11.735   59.616   10.896   31.881   4.6525   37.544   3.6044 -5.663570 5.885372 
1 1 1   12   10  -66 o   8.8815   4.0299  -3.3187   6.3239  -1.3329   10.892  -4.3285   7.7671   12.603   5.5286   9.7327   4.4356 2.870525 7.087997 
1 1 1   12   10  -65 o  101.046   1.5187  418.110   12.509  424.593   19.184  413.314   16.500  101.510   2.3184  100.285   2.0185 1.225319 3.073941 
1 1 1   12   10  -64 o   35.736   2.5377   52.965   7.3443   70.264   12.212   43.162   9.1926   40.817   3.7108   31.954   3.5913 8.862425 5.164032 
1 1 1   12   10  -63 o   13.296   4.6929   6.7098   6.3353   17.030   10.980   1.5594   7.7568   19.700   6.1592   11.665   4.8771 8.035355 7.856318 
1 1 1   12   10  -62 o   24.330   3.8941   25.340   7.4626   3.3989   18.407   29.656   8.1636   17.402   7.4062   26.355   3.9192 -8.952230 8.379242 
1 1 1   12   10  -61 o   27.553   3.2834   31.921   7.2294   32.267   14.283   31.802   8.3824   26.676   6.6041   27.342   3.8690 -0.6659889 7.654015 
1 1 1   12   10  -60 o   58.805   1.9347  141.931   9.2612  149.544   17.280  138.863   10.970   59.874   3.5564   58.076   2.3219 1.798302 4.247297 
1 1 1   12   10  -59 f   33.047   2.8115   45.354   7.5018   49.689   14.601   43.799   8.7441   33.783   5.4905   32.341   3.3660 1.441887 6.440145 
1 1 1   12   10  -58 o   93.603   1.6454  358.477   12.555  349.576   21.491  363.089   15.469   92.030   2.8682   94.112   2.0164 -2.082565 3.506104 
1 1 1   12   10  -57 o   69.493   1.7940  197.820   10.154  192.005   17.993  200.537   12.299   68.075   3.2519   69.891   2.1615 -1.815514 3.904693 
1 1 1   12   10  -56 o   52.260   2.0841  112.110   8.8605  116.063   15.915  110.335   10.666   52.771   3.7238   51.756   2.5360 1.014946 4.505327 
1 1 1   12   10  -55 o   83.477   1.7979  285.128   12.234  302.984   19.784  274.073   15.567   85.758   2.8340   81.700   2.3399 4.058357 3.675148 
1 1 1   12   10  -54 o   67.612   1.8838  187.218   10.372  197.829   16.497  180.282   13.338   69.269   2.9283   66.230   2.4750 3.039017 3.834146 
1 1 1   12   10  -53 o   23.545   4.2456   23.702   7.8486   36.470   14.195   18.081   9.4193   28.802   6.2280   20.384   5.5298 8.418087 8.328650 
1 1 1   12   10  -52 o   54.496   2.0642  121.745   9.1528  110.017   15.834  127.631   11.217   51.438   3.8031   55.730   2.4753 -4.291485 4.537706 
1 1 1   12   10  -51 o   9.9657   4.4145  -2.2267   7.1055  -5.4971   13.164  -0.8822   8.4407   13.135   5.9003   11.391   4.9334 1.744723 7.691016 
1 1 1   12   10  -50 o  107.680   1.5774  473.665   13.845  484.964   22.161  466.431   17.732  108.768   2.4994  106.772   2.0374 1.995583 3.224606 
1 1 1   12   10  -49 o   77.582   1.6669  245.917   10.542  252.421   16.192  241.132   13.889   78.435   2.5358   76.719   2.2232 1.716469 3.372373 
1 1 1   12   10  -48 o   31.038   3.4032   40.104   8.4692   43.068   12.997   37.917   11.165   31.764   5.1992   29.874   4.7433 1.890253 7.037796 
1 1 1   12   10  -47 o   54.908   2.0691  123.473   9.2444  133.568   14.806  117.024   11.835   56.924   3.2038   53.356   2.7301 3.568169 4.209255 
1 1 1   12   10  -46 o   64.725   1.9148  171.379   10.092  166.392   15.778  174.832   13.128   63.594   3.0525   65.295   2.4710 -1.700611 3.927277 
1 1 1   12   10  -45 o   33.328   3.2819   46.061   8.8003   28.840   14.327   56.496   11.152   25.705   6.7516   36.853   3.7653 -11.14751 7.730543 
1 1 1   12   10  -44 f  104.822   1.8267  448.887   15.608  469.779   21.689  426.445   22.479  107.127   2.4838  101.989   2.7062 5.137230 3.673265 
1 1 1   12   10  -43 o  112.472   1.8096  516.721   16.591  513.527   22.724  520.367   24.279  112.013   2.4888  112.727   2.6423 -0.7135391 3.629809 
1 1 1   12   10  -42 o   59.222   2.4663  143.753   11.880  168.403   16.643  118.143   16.964   63.989   3.2008   53.434   3.9220 10.55456 5.062333 
1 1 1   12   10  -41 o   7.8214   3.8325 -16.2166   8.2672 -34.7997   13.534  -5.1556   10.442   9.1115   4.5417   11.602   5.2294 -2.490466 6.926311 
1 1 1   12   10  -40 o   76.016   1.8239  235.983   11.301  241.434   17.631  232.181   14.724   76.732   2.8236   75.309   2.4016 1.423103 3.706825 
1 1 1   12   10  -39 o   36.651   3.1325   55.452   9.2690   29.655   15.145   70.901   11.720   26.153   6.9760   41.418   3.5043 -15.26480 7.806696 
1 1 1   12   10  -38 o   45.578   2.4977   85.213   9.2441   96.825   14.482   77.227   12.009   48.419   3.6971   43.254   3.4341 5.164791 5.045971 
1 1 1   12   10  -37 o   81.409   1.9862  270.690   13.180  182.729   24.392  306.963   15.664   66.442   4.5309   86.641   2.2197 -20.19888 5.045376 
1 1 1   12   10  -36 o   44.177   2.6683   80.126   9.5639  101.628   16.535   69.315   11.724   49.547   4.1315   40.955   3.5469 8.592663 5.445105 
1 1 1   12   10  -35 o   43.453   2.9739   77.658   10.470  107.584   16.778   58.569   13.400   51.006   4.0690   37.461   4.4767 13.54539 6.049596 
1 1 1   12   10  -34 o   79.810   2.4114  260.588   15.670  259.668   21.922  261.549   22.408   79.524   3.3896   79.801   3.4529 -0.2770767 4.838567 
1 1 1   12   10  -33 o  109.358   1.8255  488.199   16.273  483.138   24.607  492.133   21.694  108.641   2.7810  109.731   2.4254 -1.090462 3.689995 
1 1 1   12   10  -32 o   94.589   2.0648  365.384   15.921  450.254   29.523  330.584   18.905  104.758   3.4621   89.885   2.5829 14.87266 4.319384 
1 1 1   12   10  -31 o   36.411   3.2236   54.709   9.4691   74.405   16.560   45.140   11.542   42.224   4.9025   32.847   4.4230 9.376301 6.602833 
1 1 1   12   10  -30 o  116.686   1.8267  555.751   17.375  555.483   33.810  555.847   20.254  116.363   3.5687  116.665   2.1298 -0.3021088 4.155928 
1 1 1   12   10  -29 o  161.439   1.7097  1063.58   22.498  967.511   35.068  1130.79   29.330  153.813   2.7969  166.399   2.1624 -12.58589 3.535359 
1 1 1   12   10  -28 o   15.434   5.6172   8.0713   9.1522   4.1429   16.413   9.8440   11.026   17.397   7.1679   16.968   6.1668 0.4289856 9.455611 
1 1 1   12   10  -27 o   86.295   1.8906  303.963   13.299  318.551   23.632  297.202   16.088   88.148   3.2946   85.267   2.3168 2.881027 4.027690 
1 1 1   12   10  -26 o   28.784   4.5061   34.845   10.226   36.871   16.713   33.634   12.929   29.208   7.0917   28.025   5.8487 1.183191 9.192373 
1 1 1   12   10  -25 o  121.691   1.9147  604.457   18.993  609.377   43.783  603.316   21.080  121.720   4.4201  121.555   2.1275 0.1642456 4.905417 
1 1 1   12   10  -24 o  109.382   1.9445  488.366   17.337  429.968   38.470  503.249   19.421  102.174   4.6310  111.018   2.1461 -8.843124 5.104155 
1 1 1   12   10  -23 o   65.098   2.3865  173.335   12.643  149.597   28.832  178.985   14.067   59.882   5.9868   66.129   2.6148 -6.247093 6.532872 
1 1 1   12   10  -22 o   89.871   2.0356  329.710   14.912  329.607   34.539  329.733   16.532   89.418   4.7557   89.829   2.2596 -0.4107437 5.265203 
1 1 1   12   10  -21 o  116.593   1.7379  554.680   16.517  594.201   28.989  535.683   20.098  120.546   2.9501  114.544   2.1525 6.002090 3.651941 
1 1 1   12   10  -20 o   70.483   2.0467  202.960   11.747  229.668   20.384  189.682   14.373   74.837   3.3500   68.086   2.5945 6.751541 4.237213 
1 1 1   12   10  -19 o  102.123   1.7775  425.548   14.797  393.556   24.860  443.101   18.414   98.044   3.1145  104.178   2.1684 -6.134644 3.794986 
1 1 1   12   10  -18 o   40.158   3.1012   66.343   10.073   88.908   17.322   54.813   12.382   46.300   4.6527   36.310   4.2645 9.989189 6.311411 
1 1 1   12   10  -17 o  106.196   1.9351  460.248   16.751  480.906   36.731  454.824   18.822  108.216   4.1718  105.549   2.1877 2.666580 4.710626 
1 1 1   12   10  -16 o   17.077   5.8953   10.911   9.9657   2.8810   21.089   13.220   11.308   19.137   8.0243   18.547   6.2830 0.5901012 10.19138 
1 1 1   12   10  -15 o   58.548   2.5196  140.271   11.997  181.402   26.311  129.475   13.479   66.266   4.9056   56.202   2.9526 10.06371 5.725679 
1 1 1   12   10  -14 o   48.377   2.8805   95.988   11.308   97.863   24.250   95.467   12.782   48.287   6.3118   48.201   3.2726 0.8551788E-01 7.109777 
1 1 1   12   10  -13 o   53.558   2.5001  117.408   10.885  121.570   18.781  115.303   13.357   54.284   4.2790   53.014   3.1044 1.270790 5.286495 
1 1 1   12   10  -12 o  148.723   1.7620  902.412   21.361  895.179   36.885  906.062   26.201  147.973   3.0579  148.985   2.1575 -1.011658 3.742396 
1 1 1   12   10  -11 o   86.695   1.8935  306.694   13.381  324.460   23.677  298.358   16.219   89.009   3.2689   85.452   2.3307 3.556915 4.014698 
1 1 1   12   10  -10 o   78.164   1.9788  249.484   12.598  256.691   21.982  245.960   15.373   79.138   3.4157   77.571   2.4341 1.566689 4.194270 
1 1 1   12   10   -9 o  164.995   1.7911  1110.69   24.089  1092.63   41.407  1119.93   29.617  163.479   3.1072  165.637   2.1936 -2.158340 3.803518 
1 1 1   12   10   -8 o   65.050   2.2100  172.932   11.702  163.046   20.071  178.023   14.403   62.973   3.9296   65.960   2.6844 -2.986492 4.758906 
1 1 1   12   10   -7 o   42.092   3.1961   72.858   10.884  100.021   17.830   56.724   13.742   49.180   4.4974   36.890   4.6746 12.28929 6.486787 
1 1 1   12   10   -6 o   89.241   2.0913  325.037   15.213  360.181   23.987  301.391   19.676   93.808   3.1414   85.839   2.8158 7.968704 4.218653 
1 1 1   12   10   -5 o   34.464   3.9565   49.279   10.914   43.691   16.837   53.329   14.333   31.939   6.6822   35.681   5.0704 -3.742147 8.388127 
1 1 1   12   10   -4 o   42.220   3.3265   73.351   11.356   78.187   17.949   70.124   14.664   43.315   5.1866   41.117   4.4457 2.198696 6.831219 
1 1 1   12   10   -3 o   50.246   2.6316  103.404   10.741  120.668   18.858   95.115   13.068   54.086   4.3132   48.108   3.3533 5.977661 5.463316 
1 1 1   12   10   -2 o   78.317   2.1374  250.530   13.632  258.081   22.021  245.839   17.358   79.358   3.4122   77.524   2.7511 1.833565 4.383121 
1 1 1   12   10   -1 o   95.578   1.9902  372.782   15.506  373.043   24.748  372.613   19.895   95.467   3.1847   95.483   2.5584 -0.1683044E-01 4.085027 
1 1 1   12   10    0 o   82.181   2.0904  275.818   13.992  285.097   22.597  270.047   17.820   83.426   3.3296   81.262   2.6938 2.163757 4.282877 
1 1 1   12   10    1 o   27.252   4.9000   31.408   10.485   40.199   17.047   26.059   13.298   30.578   6.9917   24.682   6.5150 5.896029 9.556602 
1 1 1   12   10    2 o   97.807   2.1824  390.477   17.400  403.533   25.503  379.107   23.800   99.299   3.1547   96.258   3.0370 3.040588 4.378992 
1 1 1   12   10    3 o  104.415   2.1590  445.003   18.376  443.978   26.538  445.948   25.471  104.164   3.1290  104.412   2.9958 -0.2482452 4.331889 
1 1 1   12   10    4 o   56.786   2.6402  131.999   12.188  136.812   19.771  129.049   15.478   57.622   4.2388   56.066   3.4028 1.556347 5.435713 
1 1 1   12   10    5 o  144.790   2.1605  855.705   25.500  857.705   36.186  853.732   35.940  144.852   3.0646  144.518   3.0508 0.3339844 4.324286 
1 1 1   12   10    6 o   88.279   2.3400  318.400   16.824  361.480   24.311  278.803   23.307   93.973   3.1782   82.478   3.4745 11.49451 4.708816 
1 1 1   12   10    7 o   48.344   3.3765   96.060   13.222   82.642   18.695  109.489   18.703   44.535   5.2505   51.472   4.5030 -6.936684 6.916986 
1 1 1   12   10    8 o  102.960   1.9605  432.588   16.454  440.156   26.439  427.804   21.020  103.712   3.1310  102.348   2.5196 1.363251 4.018867 
1 1 1   12   10    9 o  104.607   1.9584  446.539   16.699  452.812   26.730  442.524   21.386  105.193   3.1207  104.093   2.5205 1.100204 4.011421 
1 1 1   12   10   10 o   37.819   3.3225   58.950   10.139   76.009   18.028   51.058   12.262   42.674   5.2961   35.016   4.3922 7.657799 6.880461 
1 1 1   12   10   11 o  109.677   1.7953  490.785   16.050  424.075   26.804  528.076   20.040  101.780   3.2349  113.740   2.1615 -11.96070 3.890551 
1 1 1   12   10   12 o   72.041   2.2476  212.083   13.182  193.475   21.344  223.557   16.761   68.628   3.8306   73.915   2.7869 -5.287140 4.737134 
1 1 1   12   10   13 o  108.764   1.7975  482.661   15.936  522.208   28.488  464.649   19.226  112.971   3.0964  106.686   2.2108 6.284882 3.804664 
1 1 1   12   10   14 o   79.471   1.8496  257.702   11.982  265.504   18.705  252.273   15.604   80.551   2.8532   78.558   2.4397 1.992821 3.754057 
1 1 1   12   10   15 o  113.358   1.7988  524.314   16.621  519.996   29.359  526.351   20.164  112.711   3.1987  113.549   2.1785 -0.8376846 3.870068 
1 1 1   12   10   16 o  124.776   1.7718  635.245   18.021  620.504   31.930  642.137   21.831  123.131   3.1839  125.421   2.1354 -2.289696 3.833636 
1 1 1   12   10   17 o  161.311   1.7998  1061.76   23.666  1106.19   42.496  1041.78   28.493  164.456   3.1701  159.743   2.1882 4.712723 3.851929 
1 1 1   12   10   18 o  176.173   1.6973  1266.29   24.375  1200.16   36.602  1318.98   32.673  171.390   2.6199  179.735   2.2301 -8.344833 3.440530 
1 1 1   12   10   19 o   33.276   3.5097   45.829   9.3769   58.702   15.318   38.114   11.858   37.429   5.1575   30.050   5.0179 7.379528 7.195796 
1 1 1   12   10   20 o   13.063   5.2663   3.1430   8.6301   2.3189   14.035   3.6440   10.944   15.776   6.5756   14.571   5.9101 1.205751 8.841194 
1 1 1   12   10   21 o   40.579   2.8894   67.663   9.4950   67.998   15.029   67.440   12.249   40.422   4.6454   40.398   3.7630 0.2428055E-01 5.978313 
1 1 1   12   10   22 o   16.174   5.5068   9.9616   8.6879   5.7978   13.968   12.589   11.096   16.783   6.7227   18.190   6.2226 -1.407379 9.160528 
1 1 1   12   10   23 o   34.803   3.3673   50.042   9.4338   48.744   15.199   50.856   12.032   33.925   5.6980   34.938   4.3164 -1.012642 7.148286 
1 1 1   12   10   24 o  162.742   1.7906  1080.83   23.754  1047.46   41.078  1097.59   29.116  159.997   3.1496  163.949   2.1786 -3.951767 3.829692 
1 1 1   12   10   25 o  168.405   1.8075  1157.41   24.813  1146.56   43.546  1162.63   30.194  167.381   3.1915  168.732   2.1952 -1.350540 3.873635 
1 1 1   12   10   26 o  152.012   1.9257  943.238   23.862  895.579   53.056  955.323   26.717  147.583   4.4152  152.955   2.1428 -5.372345 4.907737 
1 1 1   12   10   27 o   63.280   2.4195  163.842   12.458  165.105   21.037  163.160   15.460   63.297   4.0992   63.081   3.0153 0.2159500 5.088776 
1 1 1   12   10   28 o   94.661   1.8323  365.729   14.138  410.323   26.168  347.345   16.802  100.068   3.2122   92.219   2.2351 7.849190 3.913344 
1 1 1   12   10   29 o  136.257   1.7524  757.698   19.464  760.362   34.920  756.497   23.443  136.296   3.1431  136.108   2.1130 0.1884155 3.787322 
1 1 1   12   10   30 o  128.951   1.8966  678.809   19.936  719.739   46.594  669.637   22.057  132.273   4.3272  128.053   2.1131 4.219955 4.815592 
1 1 1   12   10   31 o  121.909   1.6353  606.456   16.251  621.824   25.850  596.415   20.896  123.334   2.5713  120.845   2.1213 2.488464 3.333334 
1 1 1   12   10   32 o  113.566   1.9422  526.583   17.980  531.935   30.001  523.583   22.460  113.920   3.2339  113.186   2.4344 0.7343903 4.047782 
1 1 1   12   10   33 o  149.867   1.9458  917.067   23.770  962.732   39.426  890.989   29.794  153.328   3.1545  147.638   2.4757 5.689514 4.009966 
1 1 1   12   10   34 o  133.989   1.7604  732.834   19.227  739.115   27.991  727.224   26.456  134.449   2.5540  133.383   2.4332 1.066208 3.527529 
1 1 1   12   10   35 o   53.747   2.8228  118.534   12.324  106.673   16.256  134.563   18.898   50.809   3.9562   57.076   4.0890 -6.267643 5.689587 
1 1 1   12   10   36 o   66.744   1.9939  182.100   10.836  183.985   17.760  180.982   13.676   66.923   3.2654   66.479   2.5283 0.4446335 4.129848 
1 1 1   12   10   37 o   67.712   1.9846  187.423   10.942  167.030   17.231  201.205   14.165   63.742   3.3278   70.101   2.4828 -6.359814 4.151932 
1 1 1   12   10   38 o   74.811   1.9008  228.712   11.582  236.038   18.828  224.251   14.691   75.844   3.0516   74.014   2.4383 1.829803 3.906110 
1 1 1   12   10   39 o   65.867   2.0143  177.402   10.802  209.854   17.313  156.714   13.823   71.513   2.9764   61.814   2.7502 9.698860 4.052489 
1 1 1   12   10   40 o   69.644   1.9605  198.297   11.119  219.617   17.862  184.809   14.207   73.149   3.0020   67.153   2.6003 5.995995 3.971624 
1 1 1   12   10   41 o   63.253   2.0898  163.688   10.761  145.535   17.165  175.441   13.811   59.418   3.5604   65.421   2.5950 -6.003052 4.405698 
1 1 1   12   10   42 o   47.858   2.6153   94.040   10.164  105.218   16.596   87.331   12.857   50.379   4.0760   45.985   3.4553 4.393955 5.343487 
1 1 1   12   10   43 o   61.369   2.2074  154.202   11.024  176.419   18.126  141.159   13.888   65.447   3.4094   58.611   2.9161 6.836685 4.486393 
1 1 1   12   10   44 f  107.980   1.9939  476.557   17.550  463.581   26.498  486.697   23.424  106.254   3.0625  109.008   2.6361 -2.754196 4.040838 
1 1 1   12   10   45 o   43.076   3.0610   76.527   10.678   76.813   15.247   76.253   14.960   42.886   4.4249   42.744   4.3542 0.1419220 6.207987 
1 1 1   12   10   46 o   77.789   2.1630  247.708   13.702  244.348   20.877  250.251   18.161   77.029   3.3328   78.061   2.8589 -1.032234 4.391009 
1 1 1   12   10   47 o   77.094   1.8890  242.936   11.871  236.738   20.479  246.072   14.569   75.806   3.3222   77.501   2.3087 -1.694885 4.045608 
1 1 1   12   10   48 o   35.917   3.1144   53.392   9.0282   78.302   17.257   44.005   10.594   43.110   5.0035   32.383   4.1053 10.72723 6.472129 
1 1 1   12   10   49 o   26.657   3.9290   29.956   8.2818   23.191   14.981   32.933   9.9387   23.270   7.1813   27.836   4.5362 -4.565805 8.493966 
1 1 1   12   10   50 o   30.559   3.3630   38.907   8.2389   44.008   14.638   36.541   9.9677   31.903   5.8440   29.403   4.2848 2.500330 7.246491 
1 1 1   12   10   51 o   27.992   4.0256   33.070   8.9216   12.576   19.014   38.856   10.103   20.455   7.9508   30.344   4.1966 -9.888760 8.990379 
1 1 1   12   10   52 o   50.351   2.5792  104.303   10.550  121.086   20.594   98.332   12.285   53.688   4.7550   48.780   3.1056 4.907406 5.679337 
1 1 1   12   10   53 o   49.346   2.8898  100.478   11.573   92.781   20.336  104.165   14.074   46.680   5.4466   50.113   3.4668 -3.432861 6.456314 
1 1 1   12   10   54 o   41.106   2.7326   69.757   9.1042   56.911   14.861   77.474   11.519   36.496   5.1372   43.210   3.2952 -6.713799 6.103240 
1 1 1   12   10   55 o   23.345   4.2444   23.356   7.7796   26.547   14.124   21.967   9.3210   24.456   6.8260   22.424   5.2005 2.032871 8.581376 
1 1 1   12   10   56 o   77.962   1.7512  248.707   11.129  239.633   18.750  253.642   13.828   76.173   3.0258   78.623   2.1597 -2.449982 3.717457 
1 1 1   12   10   57 o   65.905   1.8894  178.028   10.140  192.877   17.826  170.927   12.328   68.243   3.2136   64.476   2.3496 3.766403 3.980954 
1 1 1   12   10   58 o   9.9901   4.4146  -1.9160   7.0645  -1.1156   13.245  -2.2341   8.3516   14.115   6.1462   10.843   4.7953 3.272315 7.795537 
1 1 1   12   10   59 f   9.2689   4.2201  -4.0873   7.0096  -4.8992   13.573  -3.7920   8.1857   13.368   5.9992   10.260   4.6269 3.108305 7.576154 
1 1 1   12   10   60 o   25.100   3.7933   26.809   7.5192   30.367   14.256   25.438   8.8503   25.907   6.7009   24.196   4.6562 1.710518 8.159811 
1 1 1   12   10   61 o   51.501   2.1460  109.125   8.9895  135.951   16.716   98.210   10.663   57.023   3.6148   48.719   2.6954 8.304314 4.509140 
1 1 1   12   10   62 o   62.993   1.9428  162.967   9.9638  169.945   17.727  159.744   12.047   63.827   3.4196   62.248   2.3785 1.578083 4.165507 
1 1 1   12   10   63 o   10.919   4.6250   0.7185   7.1208   1.3426   13.620   0.4837   8.3535   14.816   6.3399   11.660   4.9766 3.155910 8.059834 
1 1 1   12   10   64 o   75.736   1.7512  235.193   10.811  268.402   19.332  220.079   13.042   80.411   2.9543   73.106   2.1909 7.304527 3.678066 
1 1 1   12   10   65 o   12.406   4.8192   4.4548   6.9823  -6.4428   13.365   8.5459   8.1887   12.793   5.8257   14.930   5.3288 -2.137183 7.895281 
1 1 1   12   10   66 o   44.680   2.4253   82.622   8.8001   78.172   19.116   83.819   9.9130   42.042   5.7267   44.916   2.7202 -2.874229 6.339927 
1 1 1   12   10   67 o   25.655   3.7403   28.184   7.5918   24.195   13.305   30.110   9.2446   22.912   6.7010   26.278   4.4761 -3.366079 8.058488 
1 1 1   12   10   68 o   29.202   3.3011   36.062   7.7204   24.856   13.178   41.919   9.5265   23.157   6.6386   31.334   3.8078 -8.176756 7.653098 
1 1 1   12   10   69 o   21.532   4.0964   20.253   6.9274   20.439   13.288   20.184   8.1178   21.174   6.7952   21.277   4.7956 -0.1026955 8.316986 
1 1 1   12   10   70 o   40.888   2.4036   69.374   7.9756   66.981   14.228   70.471   9.6311   39.305   4.5231   41.047   2.8970 -1.742188 5.371374 
1 1 1   12   10   71 o   14.800   5.6776   7.4114   9.6033   6.6857   16.390   7.7908   11.850   17.073   7.1102   15.791   6.2354 1.281842 9.456976 
1 1 1   12   10   72 o   33.716   2.9355   47.766   7.9873   40.272   17.110   49.854   9.0317   28.870   7.2748   34.329   3.2668 -5.459682 7.974625 
1 1 1   12   10   73 o   32.443   2.9015   44.251   7.5924   44.531   17.823   44.189   8.3919   30.319   7.2996   32.304   3.2302 -1.985352 7.982361 
1 1 1   12   10   74 o   23.992   3.5742   24.803   6.7770   16.810   13.716   27.385   7.7949   19.522   6.9039   25.095   3.9402 -5.573254 7.949122 
1 1 1   12   10   75 o   59.340   1.9093  145.258   9.2233  161.795   16.850  138.183   11.021   61.871   3.3536   57.698   2.3482 4.172756 4.093979 
1 1 1   12   10   76 o   50.674   2.0826  106.279   8.5841  129.508   16.225   97.249   10.116   55.117   3.6315   48.272   2.5802 6.844250 4.454819 
1 1 1   12   10   77 o   36.583   2.4761   55.895   7.3403   55.013   14.347   56.208   8.5431   34.926   5.1974   36.526   2.8929 -1.599499 5.948239 
1 1 1   12   10   78 o   14.151   4.6820   8.5853   6.2839   18.414   13.582   5.9084   7.0882   19.883   6.8813   12.947   4.8989 6.936069 8.446971 
1 1 1   12   10   79 o   32.672   2.7266   44.986   7.1955   46.449   14.414   44.500   8.3041   31.495   5.8291   32.298   3.1960 -0.8027744 6.647811 
1 1 1   12   10   80 o   45.658   2.2411   86.828   8.3155  137.822   19.323   75.238   9.2121   56.067   4.2598   42.294   2.6859 13.77250 5.035891 
1 1 1   12   10   81 o   24.717   5.7594   29.202   11.388   18.829   23.083   32.539   13.092   20.733   8.5171   25.784   6.2868 -5.050432 10.58612 
1 1 1   12   10   82 o   23.008   6.0626   25.938   11.528   57.905   23.474   15.779   13.233   31.995   8.7502   18.443   6.7480 13.55167 11.04992 
1 1 1   12   10   83 o   12.045   5.4301  -2.4033   11.264   3.2586   22.532  -4.2895   13.005   17.174   7.7164   12.479   5.7072 4.694782 9.597631 
1 1 1   12   10   84 o   19.390   6.3198   18.699   11.467   22.431   22.887   17.448   13.250   20.963   8.5305   18.866   6.7731 2.096880 10.89241 
1 1 1   12   10   85 o   14.651   5.8008   7.9653   10.282   1.8279   16.639   11.756   13.077   15.031   6.7010   16.679   6.5612 -1.647790 9.378338 
1 1 1   12   10   86 o   36.302   4.1481   59.247   12.055   61.940   17.917   57.020   16.294   34.897   6.5387   33.863   6.1285 1.034229 8.961699 
1 1 1   12   10   87 o   14.833   5.7691   8.9883   10.016   14.992   16.052   5.1612   12.816   17.922   7.1974   14.402   6.1561 3.520367 9.471024 
1 1 1   12   10   88 o   34.702   3.7340   53.686   10.396   50.975   13.701   57.366   15.962   32.413   5.3737   33.757   6.0217 -1.344009 8.070843 
1 1 1   12   10   89 o   26.249   4.8858   32.983   10.069   37.109   13.419   27.666   15.234   26.607   6.2874   21.946   7.2909 4.660885 9.627542 
1 1 1   12   10   90 o   14.849   5.6852   9.7559   9.6165 -10.2591   12.509   38.676   15.037   10.792   5.1430   26.420   6.9061 -15.62787 8.610673 
1 1 1   12   10   91 o   16.919   5.7661   14.486   9.5257   16.307   12.346   11.807   14.973   17.668   6.5089   16.417   6.8129 1.250664 9.422390 
1 1 1   12   10   92 o   10.773   4.8646  -1.5157   9.0835  -4.3385   11.826   2.5458   14.185   11.483   5.3199   13.861   6.1828 -2.378002 8.156485 
1 1 1   12   10   93 o   38.812   3.4145   66.853   10.693   58.377   13.930   79.007   16.682   34.629   5.0865   40.171   5.2178 -5.542042 7.286781 
1 1 1   12   10   94 o   26.346   5.2925   34.704   10.971   34.707   13.400   34.699   19.107   25.107   6.4979   22.921   8.1442 2.185705 10.41872 
1 1 1   12   10   95 o   10.123   4.7838  -7.2577   10.390 -11.2503   12.860   0.2466   17.631   10.668   5.1190   14.236   6.5601 -3.568476 8.320969 
1 1 1   12   10   96 o   9.5296   4.5602  -9.4619   10.053 -17.4748   12.091   8.4877   18.096   9.4346   4.6254   15.835   7.0280 -6.400184 8.413478 
1 1 1   12   10   97 o   12.578   5.5019   2.8943   10.719   2.4875   13.122   3.7103   18.584   13.299   5.9384   14.972   6.8377 -1.672426 9.056439 
1 1 1   12   10   98 f   23.821   6.6221   32.412   13.322   32.412   13.322   0.0000   0.0000   23.821   6.6221  ?   ?  0.000000 6.622149 
1 1 1   12   10   99 f   12.623   5.8999  -3.8015   15.057  -3.8015   15.057   0.0000   0.0000   12.623   5.8999  ?   ?  0.000000 5.899941 
1 1 1   12   10  100 o   10.164   4.9246 -13.3032   12.618 -13.3032   12.618   0.0000   0.0000   10.164   4.9246  ?   ?  0.000000 4.924585 
1 1 1   12   10  101 o   12.315   5.6605  -1.2575   13.012  -1.2575   13.012   0.0000   0.0000   12.315   5.6605  ?   ?  0.000000 5.660526 
1 1 1   12   10  102 o   9.9276   4.9459 -28.1527   15.960 -28.1527   15.960   0.0000   0.0000   9.9276   4.9459  ?   ?  0.000000 4.945889 
1 1 1   12   10  103 o   30.462   7.4182   56.907   18.246   56.907   18.246   0.0000   0.0000   30.462   7.4182  ?   ?  0.000000 7.418213 
1 1 1   12   10  104 o   11.279   5.4923 -15.5806   16.226 -15.5806   16.226   0.0000   0.0000   11.279   5.4923  ?   ?  0.000000 5.492255 
1 1 1   12   10  105 o   11.634   5.8279 -38.5758   23.560 -38.5758   23.560   0.0000   0.0000   11.634   5.8279  ?   ?  0.000000 5.827865 
1 1 1   12   11 -101 o   10.238   5.1990 -58.7728   22.782 -58.7728   22.782   0.0000   0.0000   10.238   5.1990  ?   ?  0.000000 5.199030 
1 1 1   12   11 -100 o   11.432   5.5399 -13.2864   15.980 -13.2864   15.980   0.0000   0.0000   11.432   5.5399  ?   ?  0.000000 5.539915 
1 1 1   12   11  -99 o   13.821   6.3673   1.6391   16.597   1.6391   16.597   0.0000   0.0000   13.821   6.3673  ?   ?  0.000000 6.367336 
1 1 1   12   11  -98 f   12.418   5.8955  -6.4182   16.128  -6.4182   16.128   0.0000   0.0000   12.418   5.8955  ?   ?  0.000000 5.895491 
1 1 1   12   11  -97 o   17.201   7.1328   16.820   16.395   16.820   16.395   0.0000   0.0000   17.201   7.1328  ?   ?  0.000000 7.132832 
1 1 1   12   11  -96 o   15.506   6.8411   9.2530   16.899   9.2530   16.899   0.0000   0.0000   15.506   6.8411  ?   ?  0.000000 6.841121 
1 1 1   12   11  -95 o   10.813   5.1645  -9.2684   12.761  -9.2684   12.761   0.0000   0.0000   10.813   5.1645  ?   ?  0.000000 5.164455 
1 1 1   12   11  -94 o   25.424   6.4767   36.353   13.458   36.353   13.458   0.0000   0.0000   25.424   6.4767  ?   ?  0.000000 6.476729 
1 1 1   12   11  -93 o   12.190   5.6264  -2.4101   13.048  -2.4101   13.048   0.0000   0.0000   12.190   5.6264  ?   ?  0.000000 5.626428 
1 1 1   12   11  -92 o   15.848   6.0203   12.605   10.730   7.2109   12.725   25.873   19.959   14.381   6.1403   19.858   8.0077 -5.476936 10.09092 
1 1 1   12   11  -91 o   18.627   6.0468   18.838   10.503   28.920   12.503  -5.3325   19.359   22.714   6.4517   13.785   6.5192 8.929176 9.171892 
1 1 1   12   11  -90 o   11.230   5.0937  -1.3947   10.093   2.4689   12.164  -9.9300   18.080   13.033   5.7744   12.843   6.1374 0.1903791 8.426879 
1 1 1   12   11  -89 o   17.025   5.9912   15.083   10.320   24.251   12.387  -5.7165   18.658   20.797   6.5477   13.651   6.4391 7.145649 9.183367 
1 1 1   12   11  -88 o   14.360   5.7159   8.6017   10.034   5.2804   12.029   16.196   18.190   13.824   5.9376   17.784   7.4544 -3.960251 9.530128 
1 1 1   12   11  -87 o   10.271   4.7461  -4.0444   9.3217 -13.7896   11.838   11.860   15.123   9.8683   4.7787   16.380   6.8263 -6.511542 8.332728 
1 1 1   12   11  -86 o   18.735   5.7501   18.177   9.6205   24.480   12.339   8.4067   15.363   21.106   6.5182   15.578   6.7009 5.528024 9.348238 
1 1 1   12   11  -85 o   9.1603   4.3861  -9.7084   9.3299 -12.4307   11.823  -5.2158   15.189   10.105   4.8640   12.765   5.9527 -2.659817 7.687251 
1 1 1   12   11  -84 o   12.544   5.3503   3.3343   9.6439  -0.7493   12.332   9.7646   15.474   12.575   5.6742   16.112   6.8211 -3.536860 8.872643 
1 1 1   12   11  -83 o   30.161   4.2528   41.671   10.166   60.933   13.141   12.968   16.042   36.277   4.5433   17.195   7.0857 19.08278 8.417171 
1 1 1   12   11  -82 o   31.736   4.0347   45.385   10.202   47.496   13.088   42.117   16.286   31.462   5.2909   27.824   7.1444 3.637880 8.890208 
1 1 1   12   11  -81 o   11.715   5.0155   1.9173   8.5314   1.5960   11.729   2.2782   12.432   13.102   5.7426   13.564   5.9295 -0.4624367 8.254418 
1 1 1   12   11  -80 o   13.196   5.3128   5.5634   8.7699   13.154   12.135  -2.7364   12.689   17.000   6.4150   12.539   5.6969 4.461312 8.579395 
1 1 1   12   11  -79 o   21.152   3.9219   20.121   6.5131   10.861   12.974   23.242   7.5309   16.421   6.5116   22.602   4.2433 -6.181004 7.772121 
1 1 1   12   11  -78 o   14.239   4.7841   8.9547   6.5563   13.220   12.902   7.4699   7.6123   17.321   6.5966   13.706   5.0996 3.614485 8.337903 
1 1 1   12   11  -77 f   17.132   4.7310   13.602   6.8245   12.142   12.969   14.161   8.0256   17.042   6.5820   17.378   5.2354 -0.3369598 8.410268 
1 1 1   12   11  -76 o   35.005   2.7313   51.801   7.7320   36.515   13.546   59.188   9.4167   27.365   6.2150   37.227   3.1322 -9.861971 6.959629 
1 1 1   12   11  -75 o   29.273   3.2559   36.795   7.6380   22.685   13.366   43.638   9.3075   21.409   6.8091   31.699   3.6697 -10.29009 7.735040 
1 1 1   12   11  -74 o   28.846   3.0904   35.501   7.1536   37.712   11.702   34.182   9.0395   28.654   5.2013   27.839   4.1066 0.8149071 6.627072 
1 1 1   12   11  -73 o   47.194   2.1311   92.447   8.1771   89.131   13.192   94.515   10.421   45.600   3.5776   47.461   2.7047 -1.861298 4.484974 
1 1 1   12   11  -72 o   29.988   3.6479   38.803   8.7340   47.195   11.988   29.309   12.751   32.591   4.6435   24.728   6.3068 7.862894 7.831877 
1 1 1   12   11  -71 o   11.892   5.0382   1.5948   8.4531   4.6281   11.955  -1.4377   11.954   14.603   6.0762   12.906   5.7210 1.696316 8.345666 
1 1 1   12   11  -70 o   47.892   2.2941   95.247   8.9298  103.399   14.444   90.203   11.361   49.237   3.6243   46.287   3.0277 2.950611 4.722546 
1 1 1   12   11  -69 o   35.153   2.6711   51.736   7.5967   37.110   13.110   59.128   9.3209   28.315   5.8730   37.435   3.0818 -9.120380 6.632484 
1 1 1   12   11  -68 o   40.378   2.5956   68.035   8.4977   92.997   17.717   60.576   9.6844   46.032   4.7916   37.874   3.1658 8.157688 5.742958 
1 1 1   12   11  -67 o   11.255   4.5682   2.7463   6.5432  -4.9592   11.377   6.5546   7.9984   11.837   5.3844   13.741   5.2030 -1.904506 7.487479 
1 1 1   12   11  -66 o   9.8396   4.3208  -1.0693   6.6685  -9.2220   12.292   2.3309   7.9382   11.490   5.3573   11.937   4.9578 -0.4470968 7.299369 
1 1 1   12   11  -65 o   34.632   2.9249   50.343   8.1798   47.372   17.974   51.119   9.1863   31.478   7.1660   34.772   3.2797 -3.293612 7.880884 
1 1 1   12   11  -64 o   37.216   2.7692   57.875   8.3405   60.211   18.078   57.243   9.4008   36.200   6.3581   36.876   3.1578 -0.6758804 7.099113 
1 1 1   12   11  -63 o   20.141   4.6718   18.072   7.5210   33.088   17.311   14.578   8.3502   26.199   7.6386   18.067   5.3155 8.131618 9.306016 
1 1 1   12   11  -62 o   19.806   4.7052   17.463   7.4832   5.3047   13.553   22.795   8.9754   15.732   6.5008   22.580   5.0076 -6.848455 8.205855 
1 1 1   12   11  -61 o   44.323   2.4071   81.370   8.6643   70.352   14.519   87.464   10.798   40.407   4.4832   45.793   2.9077 -5.385437 5.343587 
1 1 1   12   11  -60 o   13.387   4.9454   6.3456   7.1358   11.294   12.928   4.1775   8.5574   17.566   6.6229   13.102   5.2573 4.464202 8.455903 
1 1 1   12   11  -59 o   71.356   1.8071  209.095   10.502  205.130   18.168  211.085   12.871   70.124   3.1867   71.563   2.2090 -1.439079 3.877525 
1 1 1   12   11  -58 o   34.785   2.7870   50.402   7.8365   69.429   14.704   42.854   9.2613   40.201   4.5680   31.810   3.6370 8.391397 5.839086 
1 1 1   12   11  -57 o   44.890   2.3014   83.197   8.3933  103.506   15.333   74.508   10.029   49.552   3.8257   42.306   2.9263 7.246399 4.816587 
1 1 1   12   11  -56 o   55.053   2.0577  124.684   9.2179  116.854   16.264  128.389   11.188   52.703   3.8116   55.754   2.4679 -3.051258 4.540822 
1 1 1   12   11  -55 o   72.295   1.8283  214.432   10.766  202.940   18.420  220.394   13.268   69.837   3.2445   73.178   2.2268 -3.341141 3.935175 
1 1 1   12   11  -54 o   61.226   1.8627  153.832   9.2857  152.506   14.662  154.719   11.999   60.643   2.9752   61.264   2.4074 -0.6205368 3.827125 
1 1 1   12   11  -53 o   35.437   2.7990   52.143   8.0196   50.893   14.098   52.741   9.7509   34.252   5.2137   35.484   3.4132 -1.231979 6.231524 
1 1 1   12   11  -52 f   66.867   1.7855  183.264   9.7237  188.288   15.266  179.834   12.613   67.511   2.7800   66.104   2.3445 1.406845 3.636650 
1 1 1   12   11  -51 o   21.451   4.3301   19.917   7.3102   5.1565   11.891   28.885   9.2687   15.259   6.1710   25.879   4.5603 -10.62028 7.673119 
1 1 1   12   11  -50 o   40.341   2.4621   67.140   8.0577   73.672   12.900   62.962   10.318   41.923   3.8168   38.876   3.2868 3.047535 5.036919 
1 1 1   12   11  -49 o   13.421   5.2961   4.5888   8.5442  -0.7800   11.787   10.534   12.403   13.433   5.8239   17.431   6.5048 -3.998495 8.730981 
1 1 1   12   11  -48 o   81.812   1.8175  273.954   12.120  268.062   16.439  280.971   17.941   80.737   2.5009   82.610   2.6677 -1.872620 3.656654 
1 1 1   12   11  -47 o   63.390   2.4737  165.244   12.757  180.153   17.109  146.574   19.146   66.002   3.1895   59.271   3.9858 6.730267 5.104908 
1 1 1   12   11  -46 o   45.736   2.4611   86.101   9.1415   97.483   15.325   79.814   11.390   48.324   3.9243   43.877   3.2066 4.446251 5.067789 
1 1 1   12   11  -45 o   48.865   2.4889   98.243   9.8815   91.044   15.282  103.416   12.954   46.670   4.0574   49.989   3.1957 -3.319317 5.164739 
1 1 1   12   11  -44 o   30.879   3.3948   39.794   8.4041   45.829   12.355   34.598   11.465   32.824   4.7561   28.331   5.1543 4.493040 7.013318 
1 1 1   12   11  -43 o   9.6807   4.4424  -5.5320   7.9698  -1.0850   11.825  -9.2334   10.788   13.448   5.8319   10.848   5.0448 2.600023 7.711139 
1 1 1   12   11  -42 o   75.409   1.8566  232.544   11.413  238.148   16.235  227.070   16.047   76.142   2.6196   74.340   2.6523 1.801567 3.727852 
1 1 1   12   11  -41 o   32.823   3.1557   44.714   8.3393   51.322   13.042   40.143   10.847   34.831   4.7142   30.802   4.4487 4.028629 6.481840 
1 1 1   12   11  -40 o  118.244   1.5556  571.086   14.993  567.909   22.201  573.749   20.330  117.761   2.3128  118.413   2.1062 -0.6520004 3.128118 
1 1 1   12   11  -39 o   81.416   1.8659  270.968   12.383  269.742   20.763  271.645   15.427   80.948   3.1527   81.417   2.3268 -0.4692917 3.918341 
1 1 1   12   11  -38 o   61.913   2.1842  157.042   11.006  156.430   18.750  157.364   13.594   61.481   3.7592   61.892   2.7011 -0.4102783 4.628975 
1 1 1   12   11  -37 o   82.801   1.7694  280.138   11.943  302.716   18.736  264.687   15.499   85.893   2.6793   80.371   2.3684 5.521698 3.576041 
1 1 1   12   11  -36 f   38.505   2.9465   61.185   9.1782   79.794   14.559   48.910   11.824   43.772   4.1291   34.129   4.3487 9.642429 5.996727 
1 1 1   12   11  -35 o   46.251   2.7937   88.009   10.484   92.443   18.812   86.012   12.626   46.938   4.9932   45.614   3.4207 1.324295 6.052493 
1 1 1   12   11  -34 o   80.143   1.9918  262.537   13.012  255.601   21.986  266.277   16.143   78.782   3.4318   80.614   2.4595 -1.832321 4.222128 
1 1 1   12   11  -33 o   44.003   2.9913   79.773   10.666   75.472   18.176   82.031   13.172   42.281   5.3966   44.507   3.6630 -2.225994 6.522349 
1 1 1   12   11  -32 o   38.973   3.3084   62.803   10.411   67.425   18.151   60.537   12.710   39.846   5.7549   38.098   4.1600 1.747826 7.101025 
1 1 1   12   11  -31 o   12.351   5.5955  -6.5742   12.137   15.477   21.715 -16.5910   14.636   22.321   8.5439   11.977   5.6655 10.34364 10.25159 
1 1 1   12   11  -30 o   94.348   2.0157  363.740   15.502  333.755   30.441  374.239   18.013   89.903   4.1651   95.661   2.3100 -5.757774 4.762766 
1 1 1   12   11  -29 o   32.050   4.7038   43.298   11.923   38.953   22.519   44.991   14.055   29.877   8.7122   32.499   5.5016 -2.621784 10.30389 
1 1 1   12   11  -28 o   83.871   2.0871  287.457   14.269  264.181   21.407  306.067   19.141   80.184   3.2820   86.423   2.7205 -6.238548 4.262984 
1 1 1   12   11  -27 o   65.691   2.3712  176.689   12.676  171.237   19.662  180.567   16.583   64.445   3.7591   66.306   3.0764 -1.861702 4.857526 
1 1 1   12   11  -26 o   92.378   2.2968  348.864   17.295  347.053   36.128  349.402   19.699   91.536   4.8593   92.371   2.6189 -0.8348465 5.520126 
1 1 1   12   11  -25 o   88.890   2.0785  322.823   15.061  339.447   24.723  313.014   18.991   90.916   3.3417   87.421   2.6681 3.495300 4.276201 
1 1 1   12   11  -24 o   30.898   3.9682   39.872   9.7639   33.465   17.451   42.792   11.780   27.760   7.5249   31.887   4.6706 -4.127426 8.856565 
1 1 1   12   11  -23 f  109.781   1.9438  492.202   17.395  448.006   27.622  521.247   22.392  104.497   3.2467  112.909   2.4330 -8.411568 4.057166 
1 1 1   12   11  -22 o   94.336   1.8798  363.390   14.456  382.691   25.776  354.535   17.460   96.571   3.2791   93.137   2.2997 3.434433 4.005177 
1 1 1   12   11  -21 o   15.154   5.6506   7.2973   9.3559   25.957   16.421  -1.6705   11.384   24.759   7.4953   13.141   5.7102 11.61847 9.422679 
1 1 1   12   11  -20 o  102.364   1.8282  427.796   15.255  465.276   26.883  409.996   18.526  106.540   3.0988  100.166   2.2690 6.374535 3.840669 
1 1 1   12   11  -19 o   48.680   2.8923   97.324   11.425   97.946   18.287   96.926   14.633   48.539   4.6796   48.457   3.7333 0.8269882E-01 5.986373 
1 1 1   12   11  -18 o   72.433   2.2245  214.559   13.119  218.070   21.102  212.346   16.749   72.834   3.5651   71.979   2.8603 0.8542023 4.570696 
1 1 1   12   11  -17 o   73.348   2.2210  219.995   13.264  202.061   20.922  232.045   17.151   70.087   3.6749   75.260   2.8005 -5.172569 4.620368 
1 1 1   12   11  -16 o   92.963   2.0182  352.920   15.294  380.680   24.823  335.933   19.417   96.363   3.1644   90.599   2.6320 5.763626 4.115944 
1 1 1   12   11  -15 o   94.578   2.0100  365.273   15.496  329.483   24.163  390.276   20.196   89.618   3.3133   97.673   2.5387 -8.055016 4.174092 
1 1 1   12   11  -14 o   22.979   5.5100   22.688   10.187   18.175   16.174   25.657   13.116   21.777   7.5105   24.420   6.4820 -2.643209 9.920866 
1 1 1   12   11  -13 o   71.544   2.5746  209.527   14.990  196.807   20.496  224.158   21.981   69.183   3.6473   73.843   3.6632 -4.660439 5.169302 
1 1 1   12   11  -12 o  101.578   2.6771  422.207   22.148   0.0000   0.0000  422.207   22.148  ?   ?   101.578   2.6771 0.000000 2.677145 
1 1 1   12   11  -11 o   86.808   2.1039  307.745   14.887  318.241   22.974  300.146   19.547   88.102   3.2043   85.617   2.8046 2.484818 4.258325 
1 1 1   12   11  -10 o   75.401   2.4138  232.563   14.817  251.126   29.218  226.136   17.191   77.990   4.6166   74.299   2.8438 3.691673 5.422162 
1 1 1   12   11   -9 o  152.760   1.9325  952.679   24.064  912.335   51.864  963.747   27.165  148.949   4.2760  153.611   2.1695 -4.662308 4.794912 
1 1 1   12   11   -8 f  162.213   1.9597  1074.27   25.912  1131.94   58.572  1060.24   28.893  165.908   4.3347  161.114   2.2000 4.793457 4.861070 
1 1 1   12   11   -7 o  101.154   1.9840  417.756   16.359  398.551   35.258  423.025   18.467   98.371   4.4082  101.767   2.2261 -3.395981 4.938408 
1 1 1   12   11   -6 o   58.351   2.3680  139.340   11.240  117.966   18.937  150.964   13.966   53.399   4.3893   60.688   2.8308 -7.289452 5.223005 
1 1 1   12   11   -5 o  139.853   1.7630  798.253   20.099  742.282   33.720  829.097   25.032  134.676   3.0715  142.482   2.1552 -7.806168 3.752252 
1 1 1   12   11   -4 o   51.211   2.6265  107.489   10.927   88.291   18.597  117.614   13.505   46.024   5.0392   53.517   3.1091 -7.493164 5.921167 
1 1 1   12   11   -3 o  172.389   1.8219  1212.97   25.602  1215.68   44.458  1211.62   31.316  172.331   3.1648  172.231   2.2306 0.1003876 3.871915 
1 1 1   12   11   -2 o   50.688   2.6236  105.307   10.803  109.567   18.861  103.228   13.180   51.424   4.5464   50.109   3.2441 1.315113 5.585132 
1 1 1   12   11   -1 o   17.059   5.8195   11.107   9.7034   4.8996   16.933   14.142   11.840   17.828   7.3061   19.070   6.4292 -1.242514 9.732076 
1 1 1   12   11    0 o  127.019   1.7679  658.460   18.304  616.673   31.145  680.511   22.624  122.709   3.1162  129.087   2.1501 -6.377426 3.785940 
1 1 1   12   11    1 o  137.389   1.7752  770.371   19.881  816.759   35.095  748.450   24.125  141.278   3.0475  135.372   2.1863 5.905289 3.750597 
1 1 1   12   11    2 o   14.114   5.5988   4.4416   9.5952   22.899   16.760  -4.5580   11.703   23.680   7.6344   12.601   5.6186 11.07938 9.479077 
1 1 1   12   11    3 o  112.640   1.7911  517.838   16.446  546.640   28.915  504.065   19.995  115.534   3.0730  111.092   2.2080 4.441902 3.784006 
1 1 1   12   11    4 o   53.955   2.4977  119.226   10.956  122.816   19.181  117.488   13.347   54.501   4.3538   53.493   3.0738 1.007614 5.329520 
1 1 1   12   11    5 o   78.948   2.0026  254.636   12.877  216.782   21.952  274.494   15.900   72.618   3.7209   81.930   2.3833 -9.312263 4.418680 
1 1 1   12   11    6 o  141.277   1.7705  814.602   20.389  870.862   36.317  788.708   24.638  145.877   3.0542  138.965   2.1750 6.911789 3.749502 
1 1 1   12   11    7 o  137.166   1.7684  767.890   19.772  728.220   33.795  788.536   24.381  133.385   3.1082  138.952   2.1525 -5.567230 3.780778 
1 1 1   12   11    8 f  233.704   2.2458  2231.05   42.784  2304.09   97.782  2213.75   47.580  236.421   5.0738  232.733   2.5080 3.688065 5.659853 
1 1 1   12   11    9 o   36.729   3.7665   55.898   11.117   30.389   25.291   62.008   12.377   27.642   9.3959   38.668   3.9836 -11.02668 10.20546 
1 1 1   12   11   10 o   51.402   2.8475  108.408   11.884  126.947   27.193  104.031   13.213   55.015   6.1700   50.301   3.2397 4.714256 6.968853 
1 1 1   12   11   11 o   67.674   2.4008  187.381   13.223  169.465   20.465  200.220   17.324   64.140   3.9332   69.877   3.0488 -5.736855 4.976476 
1 1 1   12   11   12 o   98.028   2.2508  392.563   17.985  399.515   25.427  385.603   25.444   98.731   3.1634   96.985   3.2229 1.746292 4.516006 
1 1 1   12   11   13 o   28.051   5.4113   33.568   11.925   35.275   16.889   31.871   16.840   28.533   7.2484   27.175   7.4029 1.357870 10.36063 
1 1 1   12   11   14 o   80.249   2.1935  263.257   14.335  306.322   22.852  235.318   18.407   86.420   3.2498   75.769   2.9861 10.65157 4.413378 
1 1 1   12   11   15 o  125.181   1.7664  639.626   18.024  620.812   31.056  649.183   22.134  123.100   3.0974  126.068   2.1539 -2.967773 3.772629 
1 1 1   12   11   16 o   85.173   1.9382  296.202   13.457  270.986   23.083  309.183   16.562   81.229   3.4943   86.952   2.3388 -5.723221 4.204737 
1 1 1   12   11   17 o   76.978   2.1856  242.263   13.700  250.723   22.079  236.965   17.471   78.128   3.4756   76.051   2.8231 2.076477 4.477691 
1 1 1   12   11   18 o   38.865   3.5351   62.442   11.077   75.000   17.970   54.746   14.067   42.283   5.3320   36.119   4.9045 6.163723 7.244621 
1 1 1   12   11   19 o  107.564   1.9656  472.479   17.235  460.365   27.395  480.415   22.172  105.965   3.1751  108.398   2.5093 -2.432854 4.046920 
1 1 1   12   11   20 o  130.592   1.9337  696.411   20.585  672.043   32.190  713.269   26.775  128.100   3.0828  132.081   2.4869 -3.981659 3.960801 
1 1 1   12   11   21 o  130.301   1.9512  693.360   20.724  710.596   33.212  682.369   26.521  131.715   3.0933  129.180   2.5186 2.535263 3.988967 
1 1 1   12   11   22 o  148.043   1.9611  895.074   23.666  863.707   37.349  916.116   30.590  145.192   3.1558  149.676   2.5072 -4.484406 4.030497 
1 1 1   12   11   23 f   77.210   2.0396  243.683   12.825  229.905   18.391  256.727   17.895   74.862   3.0200   79.153   2.7777 -4.291374 4.103183 
1 1 1   12   11   24 o   68.507   2.1727  191.971   12.118  218.088   17.929  170.010   16.441   72.905   3.0235   64.335   3.1446 8.569977 4.362346 
1 1 1   12   11   25 o   32.904   3.8493   45.084   10.130   38.056   15.148   50.770   13.624   29.665   6.4486   34.722   4.9540 -5.056913 8.131794 
1 1 1   12   11   26 o   39.144   3.2833   63.268   10.380   52.130   15.584   72.149   13.916   35.026   5.6505   41.668   4.1522 -6.642269 7.012069 
1 1 1   12   11   27 o   81.983   2.1768  274.895   14.535  275.747   24.155  274.412   18.198   81.859   3.6289   81.830   2.7320 0.2921295E-01 4.542346 
1 1 1   12   11   28 o   21.201   5.7071   19.313   10.080   23.050   14.892   16.154   13.694   23.358   7.1512   20.321   6.9137 3.037281 9.946789 
1 1 1   12   11   29 o   22.056   5.4661   20.977   9.7773   25.123   18.175   19.289   11.599   24.604   7.9519   21.303   6.2639 3.301315 10.12265 
1 1 1   12   11   30 o   91.275   2.1196  340.530   15.770  352.303   26.169  333.817   19.761   92.553   3.4749   90.253   2.6891 2.300140 4.393842 
1 1 1   12   11   31 o  119.378   1.8237  582.111   17.747  549.723   31.141  597.688   21.597  115.675   3.3060  120.906   2.1913 -5.231308 3.966256 
1 1 1   12   11   32 o   49.280   3.2843  100.137   13.118   62.653   21.267  123.157   16.666   37.995   7.1284   54.581   3.7691 -16.58543 8.063475 
1 1 1   12   11   33 o   54.090   2.4807  120.010   10.908  191.722   19.106   85.325   13.287   68.216   3.4470   45.406   3.6198 22.81040 4.998517 
1 1 1   12   11   34 o   75.058   2.0002  230.443   12.227  223.088   19.860  234.932   15.516   73.617   3.3180   75.706   2.5178 -2.089973 4.165194 
1 1 1   12   11   35 o   44.026   2.9275   79.852   10.446   59.358   18.882   88.892   12.541   37.092   6.4807   46.391   3.3386 -9.298866 7.290156 
1 1 1   12   11   36 f   66.437   2.0080  180.625   10.862  180.131   17.163  180.956   14.028   66.143   3.1927   66.408   2.5965 -0.2649689 4.115246 
1 1 1   12   11   37 o   55.020   2.1942  124.054   9.8209  133.894   15.598  117.591   12.641   56.959   3.3747   53.454   2.9121 3.504837 4.457468 
1 1 1   12   11   38 o   20.012   5.0536   17.306   8.2443   15.588   13.302   18.378   10.505   19.892   6.8131   20.677   5.9271 -0.7845058 9.030419 
1 1 1   12   11   39 o   31.940   3.3503   42.425   8.5931   44.450   13.536   41.057   11.122   32.236   5.3378   31.164   4.5089 1.072695 6.987357 
1 1 1   12   11   40 o   80.517   1.7164  264.926   11.265  279.964   17.196  253.620   14.910   82.600   2.5570   78.660   2.3280 3.940147 3.457999 
1 1 1   12   11   41 o   27.431   3.7396   31.616   8.1445   31.669   12.783   31.580   10.567   26.932   5.9788   27.129   4.9610 -0.1967163 7.769042 
1 1 1   12   11   42 o   71.835   1.9280  211.230   11.280  215.278   16.185  207.407   15.729   72.360   2.7489   71.029   2.7216 1.330826 3.868291 
1 1 1   12   11   43 o   56.353   2.2691  130.316   10.402  129.559   15.707  130.908   13.883   55.937   3.4617   56.330   3.0347 -0.3931808 4.603523 
1 1 1   12   11   44 o   76.018   1.8718  236.410   11.599  247.261   16.830  226.593   16.007   77.550   2.6663   74.239   2.6494 3.311699 3.758788 
1 1 1   12   11   45 o   58.150   2.2872  138.834   10.820  134.469   17.093  141.752   13.977   56.889   3.7062   58.622   2.9343 -1.732334 4.727140 
1 1 1   12   11   46 o   40.265   2.8023   66.997   9.1403   63.262   16.061   68.786   11.116   38.462   5.2606   40.676   3.3831 -2.214619 6.254487 
1 1 1   12   11   47 o   54.621   2.2127  122.522   9.8317  138.686   17.333  114.854   11.938   57.740   3.7021   52.764   2.7855 4.975204 4.632978 
1 1 1   12   11   48 o   46.584   2.5932   89.478   9.8080   73.696   13.573  106.724   14.189   41.909   4.0225   50.672   3.4558 -8.762955 5.303101 
1 1 1   12   11   49 o   59.781   2.6326  147.297   12.798  155.027   17.293  137.937   19.028   61.080   3.4877   57.394   4.0941 3.685997 5.378284 
1 1 1   12   11   50 o   63.056   2.3881  163.592   12.252  164.890   19.609  162.760   15.693   62.841   3.8465   62.701   3.0798 0.1393509 4.927564 
1 1 1   12   11   51 o   61.699   2.0056  156.237   10.073  147.107   17.275  160.941   12.400   59.416   3.5835   62.519   2.4378 -3.103844 4.334106 
1 1 1   12   11   52 f   57.291   2.0925  134.859   9.7556  161.393   16.930  121.669   11.937   62.305   3.3457   54.265   2.7071 8.039856 4.303728 
1 1 1   12   11   53 o   34.740   2.9805   50.247   8.3588   50.462   14.659   50.144   10.175   34.003   5.4747   34.518   3.6725 -0.5150261 6.592431 
1 1 1   12   11   54 o   41.237   2.5853   70.363   8.6465   52.637   15.319   78.651   10.475   34.644   5.6168   43.505   2.9715 -8.860600 6.354416 
1 1 1   12   11   55 o   56.204   2.0994  129.939   9.6014  123.824   16.769  132.922   11.711   54.293   3.8132   56.726   2.5391 -2.433628 4.581242 
1 1 1   12   11   56 o   30.108   3.2984   38.122   7.9628   44.399   14.689   35.510   9.4760   31.552   5.9288   28.786   4.1588 2.765966 7.241987 
1 1 1   12   11   57 o   36.398   2.7768   55.117   8.1768   34.812   14.601   64.395   9.8696   27.575   6.5865   39.262   3.1092 -11.68711 7.283446 
1 1 1   12   11   58 o   34.475   2.8952   49.598   8.0611   66.964   15.029   42.584   9.5512   39.379   4.7799   31.663   3.7749 7.716148 6.090706 
1 1 1   12   11   59 o   20.639   4.5644   18.775   7.4750   18.500   14.036   18.884   8.8316   20.608   6.9998   20.548   5.2531 0.6033897E-01 8.751692 
1 1 1   12   11   60 o   32.451   3.2227   44.302   8.4123   47.171   14.296   42.783   10.404   32.547   5.5896   31.569   4.1431 0.9785728 6.957669 
1 1 1   12   11   61 o   13.707   5.0957   6.6212   7.5980  -6.1823   13.220   12.936   9.2846   12.710   5.7901   17.344   5.6889 -4.634007 8.117244 
1 1 1   12   11   62 o   51.385   2.4699  109.439   10.315  114.208   20.550  107.832   11.926   51.225   4.9845   50.850   2.8892 0.3747330 5.761308 
1 1 1   12   11   63 o   39.210   2.7163   64.107   8.6280   50.386   18.366   67.993   9.7737   32.667   7.1003   40.288   2.9975 -7.621349 7.707103 
1 1 1   12   11   64 o   36.305   2.8789   55.200   8.4501   82.807   18.803   48.213   9.4591   43.165   5.4664   33.699   3.4941 9.465828 6.487664 
1 1 1   12   11   65 o   21.729   4.4605   20.923   7.6358   2.4083   16.982   25.614   8.5487   16.216   7.0105   24.076   4.5219 -7.860586 8.342290 
1 1 1   12   11   66 o   14.563   4.9603   8.7818   7.0492 -12.8686   13.538   16.836   8.2569   11.540   5.4559   19.276   5.1550 -7.735270 7.506033 
1 1 1   12   11   67 o   38.844   2.5559   62.909   8.0481   76.132   15.000   57.564   9.5371   41.838   4.4673   36.914   3.2011 4.923637 5.495771 
1 1 1   12   11   68 o   24.187   3.8211   25.391   7.2838   22.434   13.810   26.531   8.5733   21.796   6.9201   24.483   4.4600 -2.687462 8.232823 
1 1 1   12   11   69 o   17.065   4.8271   13.091   7.0138   16.516   13.577   11.844   8.1915   19.339   6.8660   16.427   5.3407 2.912188 8.698523 
1 1 1   12   11   70 o   11.453   4.6234   3.1069   6.6611   6.2583   12.388   1.8251   7.9004   15.327   6.2614   11.671   4.9036 3.656940 7.952999 
1 1 1   12   11   71 o   26.312   3.3722   29.692   7.0666   27.678   13.044   30.528   8.4071   23.992   6.5069   26.416   4.0318 -2.424576 7.654778 
1 1 1   12   11   72 o   48.611   2.8477   99.303   11.235  104.395   14.618   91.955   17.561   49.371   3.6582   45.536   4.8033 3.834339 6.037699 
1 1 1   12   11   73 o   52.712   2.4886  116.022   10.663  120.222   15.331  112.087   14.840   53.000   3.5694   51.160   3.5811 1.839741 5.056179 
1 1 1   12   11   74 o   42.826   2.2114   76.336   7.6937   94.403   12.919   66.407   9.5772   46.998   3.3951   39.594   2.9894 7.403732 4.523684 
1 1 1   12   11   75 o   31.679   3.1481   42.893   8.0220   21.423   13.513   54.577   9.9687   20.870   6.8640   35.593   3.4803 -14.72277 7.695952 
1 1 1   12   11   76 o   21.289   4.2687   20.464   7.1498   15.904   13.246   22.339   8.4933   18.558   6.7572   21.977   4.8693 -3.418869 8.328827 
1 1 1   12   11   77 f   8.4673   3.9391  -4.9257   6.5872  -4.2885   12.782  -5.1562   7.6865   12.411   5.6692   9.2350   4.2821 3.176203 7.104689 
1 1 1   12   11   78 o   17.158   4.8174   13.751   7.0126 -14.8638   12.987   25.529   8.3317   10.615   5.1066   23.628   4.4900 -13.01285 6.799789 
1 1 1   12   11   79 o   22.673   3.9783   23.107   7.0846   37.353   13.201   17.344   8.3960   27.490   6.0551   19.017   5.2460 8.473209 8.011521 
1 1 1   12   11   80 o   12.871   4.7690   6.5943   6.6443   14.254   12.413   3.5186   7.8660   17.453   6.5085   11.997   4.9546 5.456352 8.179756 
1 1 1   12   11   81 o   31.441   4.0628   44.436   10.170   42.090   13.207   47.853   15.940   29.311   5.7330   30.472   6.6078 -1.161573 8.748115 
1 1 1   12   11   82 o   33.250   3.8995   49.475   10.369   55.687   13.412   40.245   16.347   34.446   4.9159   27.040   7.2630 7.405880 8.770254 
1 1 1   12   11   83 o   17.842   5.8354   15.999   9.7719   16.957   12.696   14.606   15.305   18.193   6.6168   17.569   7.0374 0.6240120 9.659511 
1 1 1   12   11   84 o   22.713   5.3930   25.676   9.8350   29.056   12.829   20.859   15.317   23.228   6.5138   19.441   7.2336 3.786938 9.734190 
1 1 1   12   11   85 o   33.405   3.9372   50.633   10.515   69.973   13.940   25.102   16.017   38.752   4.4965   20.720   7.4460 18.03148 8.698332 
1 1 1   12   11   86 o   24.260   5.1463   28.994   9.8612   24.800   12.847   35.008   15.385   21.114   6.6709   24.594   7.2096 -3.479998 9.822389 
1 1 1   12   11   87 o   17.580   5.7990   15.970   9.6422   12.931   12.324   20.767   15.482   16.347   6.3876   19.106   7.2378 -2.759310 9.653349 
1 1 1   12   11   88 o   15.965   5.9072   12.543   10.188   13.122   12.057   11.097   19.055   16.348   6.3376   16.725   7.3252 -0.3771992 9.686282 
1 1 1   12   11   89 o   15.269   5.8904   10.915   10.377   7.5124   12.316   19.245   19.270   14.497   6.1086   18.488   7.7052 -3.990324 9.832873 
1 1 1   12   11   90 o   18.359   6.0933   18.204   10.641   20.141   12.673   13.575   19.593   18.900   6.6401   17.124   7.4654 1.775572 9.991184 
1 1 1   12   11   91 o   16.425   6.0444   13.962   10.642   22.939   12.754  -6.6092   19.307   19.974   6.6721   13.598   6.4540 6.376351 9.282838 
1 1 1   12   11   92 o   15.141   5.9322   10.802   10.653   5.9756   12.733   22.059   19.447   14.046   6.0715   18.916   7.7991 -4.869882 9.883761 
1 1 1   12   11   93 o   12.878   5.6076   3.7039   11.027  -1.1104   13.318   14.198   19.663   12.548   5.7523   17.057   7.4567 -4.509614 9.417578 
1 1 1   12   11   94 o   9.5489   4.5967 -10.6807   10.562 -11.9140   12.496  -7.5955   19.765   10.316   4.9746   13.471   6.4321 -3.154716 8.131352 
1 1 1   12   11   95 o   15.267   6.7458   8.2725   16.491   8.2725   16.491   0.0000   0.0000   15.267   6.7458  ?   ?  0.000000 6.745844 
1 1 1   12   11   96 o   22.153   7.7700   32.959   17.348   32.959   17.348   0.0000   0.0000   22.153   7.7700  ?   ?  0.000000 7.770022 
1 1 1   12   11   97 o   9.5129   4.7492 -28.6952   15.047 -28.6952   15.047   0.0000   0.0000   9.5129   4.7492  ?   ?  0.000000 4.749187 
1 1 1   12   11   98 f   14.632   6.5369   6.4987   15.923   6.4987   15.923   0.0000   0.0000   14.632   6.5369  ?   ?  0.000000 6.536927 
1 1 1   12   11   99 o   14.795   6.5789   7.3960   15.932   7.3960   15.932   0.0000   0.0000   14.795   6.5789  ?   ?  0.000000 6.578909 
1 1 1   12   11  100 o   10.705   5.3851 -41.5148   21.184 -41.5148   21.184   0.0000   0.0000   10.705   5.3851  ?   ?  0.000000 5.385147 
1 1 1   12   11  101 o   23.857   9.0168   47.041   23.996   47.041   23.996   0.0000   0.0000   23.857   9.0168  ?   ?  0.000000 9.016816 
1 1 1   12   12    0 o   30.914   7.2843   41.157   18.053   0.0000   0.0000   41.157   18.053  ?   ?    30.914   7.2843 0.000000 7.284263 
1 1 1   12   12    1 o   48.158   3.0743   95.466   12.005  124.568   26.690   88.085   13.442   54.323   6.1345   46.163   3.6006 8.159389 7.113100 
1 1 1   12   12    2 o   10.410   4.8904 -10.9650   10.573 -13.7441   23.272 -10.2423   11.868   16.768   7.6556   11.411   5.3015 5.356582 9.312053 
1 1 1   12   12    3 o   32.064   4.4700   43.215   11.366  162.966   27.364   18.248   12.495   62.430   5.4311   20.943   6.5736 41.48643 8.527028 
1 1 1   12   12    4 o   80.415   2.0694  264.455   13.554  246.077   23.305  273.848   16.661   77.277   3.7105   81.769   2.5025 -4.491402 4.475578 
1 1 1   12   12    5 o  129.613   1.8263  686.166   19.295  728.159   33.840  665.936   23.487  133.249   3.1155  127.616   2.2578 5.633186 3.847591 
1 1 1   12   12    6 o  143.572   1.8227  841.927   21.332  819.460   36.471  853.609   26.299  141.340   3.1655  144.488   2.2329 -3.147781 3.873846 
1 1 1   12   12    7 o   23.647   5.4658   24.135   10.325   41.782   18.114   15.642   12.566   30.895   7.3079   19.816   6.6227 11.07947 9.862311 
1 1 1   12   12    8 o   12.832   5.4789  -0.0064   10.132  -7.6157   17.578   3.7793   12.399   15.155   6.8118   15.298   6.2584 -0.1427565 9.250354 
1 1 1   12   12    9 o   83.011   2.0850  281.832   14.097  268.220   24.275  288.759   17.316   80.677   3.7011   83.956   2.5331 -3.279411 4.484928 
1 1 1   12   12   10 o   12.772   5.5031  -0.7291   10.395 -20.0974   17.849   9.2114   12.787   13.211   6.2514   17.328   6.5747 -4.117078 9.072315 
1 1 1   12   12   11 o  128.141   1.8558  670.792   19.385  679.622   33.983  666.533   23.601  128.637   3.2435  127.661   2.2679 0.9759521 3.957745 
1 1 1   12   12   12 o  166.129   1.8789  1127.55   25.444  1124.95   44.199  1128.84   31.116  165.534   3.2756  166.125   2.2978 -0.5911407 4.001195 
1 1 1   12   12   13 o   24.464   5.9310   25.954   11.703 -22.7305   19.257   54.468   14.737   13.558   6.4383   35.877   5.1899 -22.31848 8.269656 
1 1 1   12   12   14 o  100.169   1.9651  410.052   16.045  412.171   28.214  409.039   19.506  100.085   3.4635   99.980   2.3935 0.1056671 4.210081 
1 1 1   12   12   15 o   47.011   3.6358   91.446   13.824   0.0000   0.0000   91.446   13.824  ?   ?    47.011   3.6358 0.000000 3.635751 
1 1 1   12   12   16 o   72.622   2.2274  215.921   13.170  247.591   23.850  202.026   15.797   77.451   3.7892   70.157   2.7677 7.293785 4.692365 
1 1 1   12   12   17 o   37.644   3.6209   58.831   10.974   74.760   19.729   51.694   13.205   41.908   5.9416   35.024   4.7476 6.884171 7.605368 
1 1 1   12   12   18 o   31.658   5.5487   42.922   13.797   56.755   19.062   27.698   19.997   36.188   6.7088   25.672   8.3443 10.51620 10.70680 
1 1 1   12   12   19 o   73.322   2.8020  220.738   16.716  250.725   23.272  188.776   24.026   77.951   3.6728   67.428   4.3953 10.52324 5.727813 
1 1 1   12   12   20 o   18.964   6.6560   13.612   12.731   5.2392   17.505   23.014   18.550   17.995   7.4073   23.803   8.0473 -5.807302 10.93741 
1 1 1   12   12   21 o   29.520   4.7677   37.018   11.082   36.263   17.491   37.525   14.323   28.681   7.4244   29.388   6.1756 -0.7076302 9.657107 
1 1 1   12   12   22 o   75.384   2.0807  232.595   12.773  239.469   22.340  229.257   15.569   76.171   3.6082   74.760   2.5586 1.411255 4.423330 
1 1 1   12   12   23 o   21.389   5.8982   19.779   10.616   1.4713   23.363   24.542   11.917   19.420   8.3066   23.734   6.1202 -4.313971 10.31775 
1 1 1   12   12   24 o   73.453   2.1073  220.896   12.605  197.438   21.713  232.820   15.480   69.063   3.8724   75.337   2.5243 -6.274208 4.622517 
1 1 1   12   12   25 f   40.751   3.1290   68.643   10.315   97.807   18.325   55.119   12.479   48.314   4.7130   36.245   4.3078 12.06811 6.385098 
1 1 1   12   12   26 o   81.436   2.0016  271.241   13.287  299.457   24.079  258.889   15.932   85.198   3.4745   79.451   2.4630 5.747787 4.258919 
1 1 1   12   12   27 o   37.541   3.3385   58.459   10.110   68.499   18.294   54.044   12.131   40.029   5.7731   35.892   4.2271 4.137302 7.155250 
1 1 1   12   12   28 o   49.673   2.9832  101.746   12.023   93.752   19.040  107.048   15.506   47.165   5.0300   50.782   3.7729 -3.617039 6.287688 
1 1 1   12   12   29 o   46.032   2.7575   87.292   10.299   78.101   18.127   91.674   12.516   42.909   5.2949   47.075   3.2822 -4.165981 6.229632 
1 1 1   12   12   30 o   94.463   1.8551  364.917   14.285  367.607   25.382  363.670   17.281   94.410   3.3033   94.227   2.2499 0.1832809 3.996740 
1 1 1   12   12   31 o   16.603   5.5631   11.000   8.8658   10.252   15.029   11.400   10.980   18.387   7.0899   17.425   6.1755 0.9619789 9.402320 
1 1 1   12   12   32 o   79.957   2.0987  261.947   13.667  271.099   22.592  256.665   17.164   80.989   3.4298   79.018   2.6686 1.971481 4.345717 
1 1 1   12   12   33 o   40.544   3.3316   68.245   10.914   73.548   15.699   63.285   15.182   41.739   4.6955   38.609   4.9368 3.130184 6.813223 
1 1 1   12   12   34 o   31.626   3.7099   41.933   9.3825   56.519   12.662   24.173   13.972   36.619   4.3253   23.471   6.8678 13.14780 8.116337 
1 1 1   12   12   35 f   24.046   5.2440   25.199   9.9885   23.132   14.418   27.106   13.850   23.037   7.0334   24.728   6.7043 -1.690802 9.716805 
1 1 1   12   12   36 o   70.210   2.2846  202.382   13.058  183.707   17.963  223.307   19.015   66.618   3.3184   73.508   3.1809 -6.890007 4.596681 
1 1 1   12   12   37 o   57.140   2.3570  134.218   10.955  143.491   17.011  127.647   14.320   58.767   3.5679   55.528   3.1769 3.239708 4.777282 
1 1 1   12   12   38 o   11.096   4.9243  -2.6961   8.8828  -4.1837   14.629  -1.8272   11.180   14.147   6.2965   12.808   5.6102 1.338945 8.433257 
1 1 1   12   12   39 o   51.558   2.5051  109.512   10.497  120.535   16.828  102.491   13.430   53.711   3.8695   49.667   3.3366 4.043282 5.109370 
1 1 1   12   12   40 o   33.362   3.5194   46.633   9.4269   47.577   15.267   46.052   11.985   32.940   5.9026   32.841   4.6031 0.9879684E-01 7.485257 
1 1 1   12   12   41 o   31.102   3.5248   40.622   8.7790   32.420   12.771   47.970   12.088   27.034   5.9562   33.532   4.5389 -6.497461 7.488513 
1 1 1   12   12   42 o   47.347   2.4774   92.457   9.5280   81.929   13.712  102.288   13.249   44.189   3.8449   49.588   3.2966 -5.398586 5.064618 
1 1 1   12   12   43 o   51.741   2.3370  110.266   9.8311  112.756   14.245  108.001   13.585   52.030   3.3768   50.945   3.2890 1.085148 4.713848 
1 1 1   12   12   44 o   51.790   2.1731  110.352   9.1536  105.170   14.126  114.103   12.018   50.192   3.4740   52.499   2.8187 -2.306454 4.473686 
1 1 1   12   12   45 o   54.732   2.1170  123.204   9.4271  139.184   14.611  111.809   12.339   57.884   3.1081   51.920   2.9273 5.963795 4.269576 
1 1 1   12   12   46 o   42.984   2.4754   76.369   8.6368  100.521   13.816   60.876   11.065   49.021   3.4802   38.050   3.6108 10.97148 5.014923 
1 1 1   12   12   47 o   25.819   3.8417   28.463   7.8394   26.049   12.555   30.005   10.036   23.971   6.3321   26.189   4.8807 -2.218033 7.994818 
1 1 1   12   12   48 o   33.805   2.9506   47.696   8.0492   56.893   12.756   41.612   10.375   36.463   4.3794   31.181   4.1878 5.281599 6.059446 
1 1 1   12   12   49 o   53.081   2.0994  116.024   9.0661  129.176   14.341  107.269   11.701   55.655   3.1743   50.820   2.8358 4.834759 4.256490 
1 1 1   12   12   50 o   52.657   2.0925  114.211   8.9636  124.076   14.151  107.601   11.584   54.512   3.1987   50.895   2.8030 3.616837 4.253060 
1 1 1   12   12   51 o   36.440   2.7151   55.260   8.0067   69.870   12.774   45.807   10.276   40.578   3.9104   32.780   3.9234 7.797161 5.539358 
1 1 1   12   12   52 o   56.532   2.1648  131.796   9.9574  165.540   18.693  118.428   11.766   62.702   3.6734   53.406   2.7115 9.296539 4.565768 
1 1 1   12   12   53 o   46.913   3.3493   92.442   12.724   62.543   19.068  116.443   17.084   36.981   6.5659   52.342   4.0351 -15.36114 7.706666 
1 1 1   12   12   54 o   17.757   6.2764   13.000   11.335   6.8979   17.221   17.664   15.057   17.540   7.2950   20.308   7.2282 -2.768663 10.26956 
1 1 1   12   12   55 o   43.158   2.8618   77.772   10.011   91.616   18.912   72.383   11.800   45.691   5.1685   41.370   3.5328 4.320576 6.260489 
1 1 1   12   12   56 o   60.345   2.1594  150.383   10.605  152.540   21.693  149.705   12.157   59.501   4.5061   60.081   2.4876 -0.5804482 5.147202 
1 1 1   12   12   57 o   11.850   4.8330   2.9054   7.3660   0.8956   13.580   3.7431   8.7679   14.448   6.2576   12.961   5.2778 1.487243 8.186191 
1 1 1   12   12   58 o   22.156   4.5799   21.830   7.9980   54.977   16.596   11.802   9.1279   34.631   6.1016   16.636   5.6448 17.99549 8.312252 
1 1 1   12   12   59 o   42.882   2.5731   76.612   8.9529   72.971   17.641   77.875   10.390   40.340   5.5086   43.079   2.9772 -2.738430 6.261687 
1 1 1   12   12   60 o   60.514   2.1178  151.380   10.431  151.469   20.217  151.348   12.176   59.324   4.2080   60.351   2.4804 -1.026295 4.884633 
1 1 1   12   12   61 o   11.634   4.8352   2.1987   7.5577   10.187   15.902  -0.1319   8.5897   17.757   7.1523   11.444   4.9665 6.313326 8.707540 
1 1 1   12   12   62 o   20.347   4.6274   18.606   7.5009   22.321   14.418   17.228   8.7830   21.705   7.0875   19.393   5.3717 2.311867 8.893108 
1 1 1   12   12   63 f   33.155   2.9965   46.412   8.0110   75.159   15.027   34.998   9.4687   41.429   4.5232   28.254   4.2421 13.17446 6.201226 
1 1 1   12   12   64 o   20.125   4.5513   18.234   7.2906   26.733   13.943   15.036   8.5531   23.469   6.8588   18.140   5.3907 5.329382 8.723716 
1 1 1   12   12   65 o   15.406   5.0402   10.374   7.2898   18.769   14.084   7.3025   8.5198   20.108   7.0047   14.186   5.3703 5.921599 8.826387 
1 1 1   12   12   66 o   19.735   4.7115   17.724   7.4743   36.713   14.311   10.602   8.7646   27.592   6.4751   15.783   5.5239 11.80844 8.511156 
1 1 1   12   12   67 f   33.737   3.1004   48.392   8.4310   49.515   18.704   48.106   9.4450   31.315   7.4384   33.441   3.5174 -2.126015 8.228156 
1 1 1   12   12   68 o   7.8891   3.7634  -7.9986   6.7344 -13.1597   13.771  -6.3764   7.7205   11.419   5.4287   9.0176   4.2180 2.401045 6.874748 
1 1 1   12   12   69 o   22.819   4.1102   23.228   7.3642   17.872   13.752   25.382   8.7197   19.431   6.9088   23.588   4.7001 -4.157267 8.355997 
1 1 1   12   12   70 o   38.009   2.6636   60.933   8.2004   75.642   15.197   54.892   9.7400   41.063   4.6204   35.698   3.3877 5.364552 5.729306 
1 1 1   12   12   71 o   31.148   3.1638   41.678   7.9217   44.706   14.625   40.421   9.4238   30.316   6.1293   30.274   3.9100 0.4219246E-01 7.270227 
1 1 1   12   12   72 o   17.170   5.1721   13.880   7.8330  -3.8261   13.752   22.382   9.5300   12.898   5.8872   21.589   5.4232 -8.691144 8.004383 
1 1 1   12   12   73 o   24.903   4.1549   27.990   8.1375   13.931   14.150   34.937   9.9469   17.663   6.8608   27.611   4.5798 -9.948069 8.248952 
1 1 1   12   12   74 o   16.861   5.9812   13.344   10.302   10.867   13.438   16.876   16.044   16.447   6.5921   18.748   7.2989 -2.300816 9.835131 
1 1 1   12   12   75 o   18.271   5.8686   16.499   9.9096   10.777   12.600   25.775   16.044   16.164   6.4147   21.655   7.4798 -5.491440 9.853755 
1 1 1   12   12   76 o   18.751   4.9721   16.912   7.7226   25.816   12.658   11.632   9.7468   22.142   6.5524   15.911   5.7959 6.231027 8.747883 
1 1 1   12   12   77 o   15.403   5.7418   10.677   9.6592   0.4884   12.083   28.718   16.078   12.857   5.7225   22.428   7.4911 -9.570328 9.426758 
1 1 1   12   12   78 o   16.410   5.8413   13.090   9.8332   13.604   12.449   12.237   16.035   16.843   6.4634   16.910   7.0366 -0.6699371E-01 9.554547 
1 1 1   12   12   79 o   13.485   5.5189   6.1988   9.6460   11.441   12.180  -2.6199   15.798   15.942   6.3132   13.456   6.2038 2.485886 8.851225 
1 1 1   12   12   80 o   12.615   5.3674   3.7650   9.6641  -0.7098   12.305   10.967   15.611   12.487   5.6480   16.291   6.8717 -3.804469 8.894980 
1 1 1   12   12   81 o   15.219   5.7353   10.827   9.6927   21.491   12.381  -6.0552   15.578   19.717   6.5735   12.686   5.9525 7.030814 8.868052 
1 1 1   12   12   82 o   12.145   5.3311   1.7573   10.143   14.764   12.106 -28.8948   18.584   16.953   6.4050   11.069   5.4843 5.883933 8.432221 
1 1 1   12   12   83 o   9.6694   4.6001  -8.4657   9.9213 -18.4004   11.568   19.177   19.296   9.0876   4.4691   18.497   7.7099 -9.409617 8.911504 
1 1 1   12   12   84 o   11.580   5.1865  -0.0513   10.090  -1.0265   11.883   2.4685   19.101   12.118   5.5086   14.991   6.8784 -2.872075 8.812360 
1 1 1   12   12   85 f   10.912   5.0244  -3.1419   10.316   7.2218   12.225 -28.7675   19.223   14.304   6.0595   11.214   5.5598 3.089876 8.223677 
1 1 1   12   12   86 o   24.540   5.5863   31.247   10.923   29.345   12.954   35.926   20.319   22.662   6.6077   22.601   8.3459 0.6057358E-01 10.64503 
1 1 1   12   12   87 o   10.340   4.8675  -6.3234   10.567  -9.2675   12.652   0.4657   19.213   10.817   5.1598   14.524   6.7468 -3.706834 8.493733 
1 1 1   12   12   88 o   20.763   6.1241   23.875   11.072   21.353   13.054   30.341   20.901   19.110   6.7372   20.731   8.2506 -1.620766 10.65186 
1 1 1   12   12   89 o   11.983   5.4868  -1.3358   12.069   3.2415   15.416  -8.5839   19.399   14.003   6.3288   13.222   6.3292 0.7807369 8.950544 
1 1 1   12   12   90 o   11.402   5.3274  -4.4636   12.258  -8.2012   15.592   1.5850   19.835   12.056   5.7442   14.669   6.8281 -2.613759 8.922903 
1 1 1   12   12   91 o   13.398   6.1798   0.0846   15.700   0.0846   15.700   0.0000   0.0000   13.398   6.1798  ?   ?  0.000000 6.179792 
1 1 1   12   12   92 o   17.680   7.1612   18.667   16.041   18.667   16.041   0.0000   0.0000   17.680   7.1612  ?   ?  0.000000 7.161202 
1 1 1   12   12   93 o   16.542   6.9494   14.784   15.864   14.784   15.864   0.0000   0.0000   16.542   6.9494  ?   ?  0.000000 6.949410 
1 1 1   12   12   94 o   20.577   7.4653   28.375   16.148   28.375   16.148   0.0000   0.0000   20.577   7.4653  ?   ?  0.000000 7.465260 
1 1 1   12   12   95 o   15.121   6.6687   9.0744   16.044   9.0744   16.044   0.0000   0.0000   15.121   6.6687  ?   ?  0.000000 6.668695 
1 1 1   12   12   96 f   9.9255   4.9414 -26.9228   15.817 -26.9228   15.817   0.0000   0.0000   9.9255   4.9414  ?   ?  0.000000 4.941428 
1 1 1   13    0 -125 o   16.649   8.5277   21.539   14.664   21.539   14.664   21.539   14.664   16.649   8.5277   16.649   8.5277 0.000000 0.000000 
1 1 1   13    0 -124 o   11.688   7.2806   8.0224   14.052   8.0224   14.052   8.0224   14.052   11.688   7.2806   11.688   7.2806 -0.000000 0.000000 
1 1 1   13    0 -123 o   9.3764   6.2925  -1.1913   13.535  -1.1913   13.535  -1.1913   13.535   9.3764   6.2925   9.3764   6.2925 0.000000 0.000000 
1 1 1   13    0 -122 o   9.2091   6.2342  -2.6792   13.846  -2.6792   13.846  -2.6792   13.846   9.2091   6.2342   9.2091   6.2342 -0.000000 0.000000 
1 1 1   13    0 -121 o   50.438   4.1871  112.218   16.933  112.218   16.933  112.218   16.933   50.438   4.1871   50.438   4.1871 -0.000000 0.000000 
1 1 1   13    0 -120 f   13.220   7.7799   12.532   14.235   12.532   14.235   12.532   14.235   13.220   7.7799   13.220   7.7799 -0.000000 0.000000 
1 1 1   13    0 -119 o   10.445   6.7742   3.1243   13.707   3.1243   13.707   3.1243   13.707   10.445   6.7742   10.445   6.7742 -0.000000 0.000000 
1 1 1   13    0 -118 o   13.862   8.3630   13.701   17.237   13.701   17.237   13.701   17.237   13.862   8.3630   13.862   8.3630 -0.000000 0.000000 
1 1 1   13    0 -117 o   23.192   8.9581   35.187   16.065   35.187   16.065   35.187   16.065   23.192   8.9581   23.192   8.9581 0.000000 0.000000 
1 1 1   13    0 -116 o   10.064   6.7174  -0.6859   15.054  -0.6859   15.054  -0.6859   15.054   10.064   6.7174   10.064   6.7174 -0.000000 0.000000 
1 1 1   13    0 -115 f   9.4439   6.4272  -4.3901   15.120  -4.3901   15.120  -4.3901   15.120   9.4439   6.4272   9.4439   6.4272 0.000000 0.000000 
1 1 1   13    0 -114 o   16.477   8.1781   19.566   13.262   19.566   13.262   19.566   13.262   16.477   8.1781   16.477   8.1781 -0.000000 0.000000 
1 1 1   13    0 -113 o   39.978   5.5151   73.978   17.000   73.978   17.000   73.978   17.000   39.978   5.5151   39.978   5.5151 -0.000000 0.000000 
1 1 1   13    0 -112 o   24.366   7.7700   33.738   13.591   33.738   13.591   33.738   13.591   24.366   7.7700   24.366   7.7700 -0.000000 0.000000 
1 1 1   13    0 -111 o   10.631   6.7122   4.2831   12.384   4.2831   12.384   4.2831   12.384   10.631   6.7122   10.631   6.7122 -0.000000 0.000000 
1 1 1   13    0 -110 f   11.121   6.9400   5.3779   12.828   5.3779   12.828   5.3779   12.828   11.121   6.9400   11.121   6.9400 -0.000000 0.000000 
1 1 1   13    0 -109 o   8.7292   5.9292  -4.7763   12.738  -4.7763   12.738  -4.7763   12.738   8.7292   5.9292   8.7292   5.9292 -0.000000 0.000000 
1 1 1   13    0 -108 o   38.099   4.7533   64.504   14.142   64.504   14.142   64.504   14.142   38.099   4.7533   38.099   4.7533 -0.000000 0.000000 
1 1 1   13    0 -107 o   13.437   7.5934   11.647   12.752   11.647   12.752   11.647   12.752   13.437   7.5934   13.437   7.5934 0.000000 0.000000 
1 1 1   13    0 -106 o   11.049   6.8359   5.1382   12.181   5.1382   12.181   5.1382   12.181   11.049   6.8359   11.049   6.8359 -0.000000 0.000000 
1 1 1   13    0 -105 o   51.262   3.5660  110.923   14.732  110.923   14.732  110.923   14.732   51.262   3.5660   51.262   3.5660 -0.000000 0.000000 
1 1 1   13    0 -104 o   39.881   4.3525   68.941   13.722   68.941   13.722   68.941   13.722   39.881   4.3525   39.881   4.3525 -0.000000 0.000000 
1 1 1   13    0 -103 o   71.458   2.9286  211.792   16.994  211.792   16.994  211.792   16.994   71.458   2.9286   71.458   2.9286 -0.000000 0.000000 
1 1 1   13    0 -102 o   15.568   8.1942   15.903   13.798   15.903   13.798   15.903   13.798   15.568   8.1942   15.568   8.1942 0.000000 0.000000 
1 1 1   13    0 -101 o   22.639   8.5145   29.925   14.688   29.925   14.688   29.925   14.688   22.639   8.5145   22.639   8.5145 0.000000 0.000000 
1 1 1   13    0 -100 o   42.686   4.7007   78.882   15.851   78.882   15.851   78.882   15.851   42.686   4.7007   42.686   4.7007 0.000000 0.000000 
1 1 1   13    0  -99 o   56.705   3.2695  134.031   14.997  134.031   14.997  134.031   14.997   56.705   3.2695   56.705   3.2695 0.000000 0.000000 
1 1 1   13    0  -98 o   14.859   7.7849   14.122   12.411   14.122   12.411   14.122   12.411   14.859   7.7849   14.859   7.7849 0.000000 0.000000 
1 1 1   13    0  -97 o   13.746   7.6356   11.539   12.621   11.539   12.621   11.539   12.621   13.746   7.6356   13.746   7.6356 0.000000 0.000000 
1 1 1   13    0  -96 o   24.729   7.2607   31.579   12.716   31.579   12.716   31.579   12.716   24.729   7.2607   24.729   7.2607 0.000000 0.000000 
1 1 1   13    0  -95 o   10.492   6.6740   2.0627   12.506   2.0627   12.506   2.0627   12.506   10.492   6.6740   10.492   6.6740 0.000000 0.000000 
1 1 1   13    0  -94 o   13.447   8.1887   7.9860   16.856   7.9860   16.856   7.9860   16.856   13.447   8.1887   13.447   8.1887 0.000000 0.000000 
1 1 1   13    0  -93 o   19.918   9.1675   24.919   16.323   24.919   16.323   24.919   16.323   19.918   9.1675   19.918   9.1675 0.000000 0.000000 
1 1 1   13    0  -92 o   21.405   9.3242   28.083   16.873   28.083   16.873   28.083   16.873   21.405   9.3242   21.405   9.3242 0.000000 0.000000 
1 1 1   13    0  -91 o   12.156   7.6954   3.2560   16.399   3.2560   16.399   3.2560   16.399   12.156   7.6954   12.156   7.6954 0.000000 0.000000 
1 1 1   13    0  -90 o   68.084   2.9427  191.041   16.262  191.041   16.262  191.041   16.262   68.084   2.9427   68.084   2.9427 0.000000 0.000000 
1 1 1   13    0  -89 o   26.034   7.0422   33.629   12.915   33.629   12.915   33.629   12.915   26.034   7.0422   26.034   7.0422 -0.000000 0.000000 
1 1 1   13    0  -88 o   95.761   2.5824  375.932   20.125  375.932   20.125  375.932   20.125   95.761   2.5824   95.761   2.5824 0.000000 0.000000 
1 1 1   13    0  -87 o   11.714   7.0140   6.1401   11.944   6.1401   11.944   6.1401   11.944   11.714   7.0140   11.714   7.0140 0.000000 0.000000 
1 1 1   13    0  -86 o   15.444   7.9609   14.656   12.831   14.656   12.831   14.656   12.831   15.444   7.9609   15.444   7.9609 0.000000 0.000000 
1 1 1   13    0  -85 o   71.139   3.4787  208.778   20.062  208.778   20.062  208.778   20.062   71.139   3.4787   71.139   3.4787 -0.000000 0.000000 
1 1 1   13    0  -84 o   46.724   4.7371   92.420   17.583   92.420   17.583   92.420   17.583   46.724   4.7371   46.724   4.7371 -0.000000 0.000000 
1 1 1   13    0  -83 o   44.727   4.9977   85.228   17.639   85.228   17.639   85.228   17.639   44.727   4.9977   44.727   4.9977 -0.000000 0.000000 
1 1 1   13    0  -82 o   9.9689   6.5393  -1.8614   13.301  -1.8614   13.301  -1.8614   13.301   9.9689   6.5393   9.9689   6.5393 0.000000 0.000000 
1 1 1   13    0  -81 o   83.992   3.0020  289.416   20.494  289.416   20.494  289.416   20.494   83.992   3.0020   83.992   3.0020 -0.000000 0.000000 
1 1 1   13    0  -80 o   15.298   8.2228   13.906   14.144   13.906   14.144   13.906   14.144   15.298   8.2228   15.298   8.2228 -0.000000 0.000000 
1 1 1   13    0  -79 o   13.393   7.8348   8.8724   14.291   8.8724   14.291   8.8724   14.291   13.393   7.8348   13.393   7.8348 -0.000000 0.000000 
1 1 1   13    0  -78 o   36.997   5.0885   59.185   14.522   59.185   14.522   59.185   14.522   36.997   5.0885   36.997   5.0885 -0.000000 0.000000 
1 1 1   13    0  -77 o   11.960   7.3522   4.7754   13.878   4.7754   13.878   4.7754   13.878   11.960   7.3522   11.960   7.3522 -0.000000 0.000000 
1 1 1   13    0  -76 o   75.527   1.7114  232.995   10.524  232.995   10.524  232.995   10.524   75.527   1.7114   75.527   1.7114 -0.000000 0.000000 
1 1 1   13    0  -75 o   82.352   1.7501  276.955   11.736  276.955   11.736  276.955   11.736   82.352   1.7501   82.352   1.7501 -0.000000 0.000000 
1 1 1   13    0  -74 o  107.712   1.8301  473.571   16.058  473.571   16.058  473.571   16.058  107.712   1.8301  107.712   1.8301 0.000000 0.000000 
1 1 1   13    0  -73 o   8.8588   5.5818   1.4549   8.5144   1.4549   8.5144   1.4549   8.5144   8.8588   5.5818   8.8588   5.5818 -0.000000 0.000000 
1 1 1   13    0  -72 o  129.464   2.0365  684.129   21.480  684.129   21.480  684.129   21.480  129.464   2.0365  129.464   2.0365 0.000000 0.000000 
1 1 1   13    0  -71 o  184.126   2.1932  1383.43   32.906  1383.43   32.906  1383.43   32.906  184.126   2.1932  184.126   2.1932 -0.000000 0.000000 
1 1 1   13    0  -70 o  104.442   2.0298  445.370   17.266  445.370   17.266  445.370   17.266  104.442   2.0298  104.442   2.0298 -0.000000 0.000000 
1 1 1   13    0  -69 o   13.511   6.6546   11.012   8.7523   11.012   8.7523   11.012   8.7523   13.511   6.6546   13.511   6.6546 -0.000000 0.000000 
1 1 1   13    0  -68 o  116.823   2.0543  557.077   19.549  557.077   19.549  557.077   19.549  116.823   2.0543  116.823   2.0543 -0.000000 0.000000 
1 1 1   13    0  -67 o  117.491   2.9966  564.372   28.657  564.372   28.657  564.372   28.657  117.491   2.9966  117.491   2.9966 -0.000000 0.000000 
1 1 1   13    0  -66 o  154.324   3.0373  972.888   38.175  972.888   38.175  972.888   38.175  154.324   3.0373  154.324   3.0373 -0.000000 0.000000 
1 1 1   13    0  -65 o   30.567   4.1966   40.248   9.8973   40.248   9.8973   40.248   9.8973   30.567   4.1966   30.567   4.1966 -0.000000 0.000000 
1 1 1   13    0  -64 o   26.317   4.9891   31.148   9.5836   31.148   9.5836   31.148   9.5836   26.317   4.9891   26.317   4.9891 -0.000000 0.000000 
1 1 1   13    0  -63 o   11.828   6.5806   7.7934   9.3917   7.7934   9.3917   7.7934   9.3917   11.828   6.5806   11.828   6.5806 -0.000000 0.000000 
1 1 1   13    0  -62 o   65.780   2.5417  177.258   13.583  177.258   13.583  177.258   13.583   65.780   2.5417   65.780   2.5417 0.000000 0.000000 
1 1 1   13    0  -61 o  123.254   2.4490  620.244   24.583  620.244   24.583  620.244   24.583  123.254   2.4490  123.254   2.4490 -0.000000 0.000000 
1 1 1   13    0  -60 o  131.684   2.1621  707.640   23.194  707.640   23.194  707.640   23.194  131.684   2.1621  131.684   2.1621 -0.000000 0.000000 
1 1 1   13    0  -59 o  123.547   2.4064  623.145   24.214  623.145   24.214  623.145   24.214  123.547   2.4064  123.547   2.4064 -0.000000 0.000000 
1 1 1   13    0  -58 o   40.388   3.3409   67.900   10.820   67.900   10.820   67.900   10.820   40.388   3.3409   40.388   3.3409 0.000000 0.000000 
1 1 1   13    0  -57 o  115.382   2.0492  543.302   19.259  543.302   19.259  543.302   19.259  115.382   2.0492  115.382   2.0492 -0.000000 0.000000 
1 1 1   13    0  -56 o  133.973   2.0402  732.301   22.269  732.301   22.269  732.301   22.269  133.973   2.0402  133.973   2.0402 0.000000 0.000000 
1 1 1   13    0  -55 o  180.305   2.6245  1326.57   38.555  1326.57   38.555  1326.57   38.555  180.305   2.6245  180.305   2.6245 0.000000 0.000000 
1 1 1   13    0  -54 o  101.736   2.0574  422.498   17.046  422.498   17.046  422.498   17.046  101.736   2.0574  101.736   2.0574 -0.000000 0.000000 
1 1 1   13    0  -53 o  316.050   2.9779  4074.93   76.704  4074.93   76.704  4074.93   76.704  316.050   2.9779  316.050   2.9779 -0.000000 0.000000 
1 1 1   13    0  -52 o  111.771   2.0117  509.812   18.315  509.812   18.315  509.812   18.315  111.771   2.0117  111.771   2.0117 -0.000000 0.000000 
1 1 1   13    0  -51 o  250.559   2.5465  2560.71   51.997  2560.71   51.997  2560.71   51.997  250.559   2.5465  250.559   2.5465 0.000000 0.000000 
1 1 1   13    0  -50 o  122.761   2.0121  614.894   20.122  614.894   20.122  614.894   20.122  122.761   2.0121  122.761   2.0121 -0.000000 0.000000 
1 1 1   13    0  -49 f   66.725   2.3049  182.174   12.503  182.174   12.503  182.174   12.503   66.725   2.3049   66.725   2.3049 -0.000000 0.000000 
1 1 1   13    0  -48 o  277.870   2.7120  3149.36   61.415  3149.36   61.415  3149.36   61.415  277.870   2.7120  277.870   2.7120 -0.000000 0.000000 
1 1 1   13    0  -47 o   43.733   3.0476   79.128   10.741   79.128   10.741   79.128   10.741   43.733   3.0476   43.733   3.0476 -0.000000 0.000000 
1 1 1   13    0  -46 o  270.574   3.0675  2986.79   67.638  2986.79   67.638  2986.79   67.638  270.574   3.0675  270.574   3.0675 0.000000 0.000000 
1 1 1   13    0  -45 o  114.492   2.3080  535.094   21.520  535.094   21.520  535.094   21.520  114.492   2.3080  114.492   2.3080 -0.000000 0.000000 
1 1 1   13    0  -44 o  103.341   2.3327  436.070   19.628  436.070   19.628  436.070   19.628  103.341   2.3327  103.341   2.3327 -0.000000 0.000000 
1 1 1   13    0  -43 o  245.509   2.8850  2458.85   57.719  2458.85   57.719  2458.85   57.719  245.509   2.8850  245.509   2.8850 -0.000000 0.000000 
1 1 1   13    0  -42 o   53.351   2.6745  116.926   11.564  116.926   11.564  116.926   11.564   53.351   2.6745   53.351   2.6745 0.000000 0.000000 
1 1 1   13    0  -41 o  130.076   1.9292  690.204   20.445  690.204   20.445  690.204   20.445  130.076   1.9292  130.076   1.9292 -0.000000 0.000000 
1 1 1   13    0  -40 o   77.466   1.8715  245.060   11.802  245.060   11.802  245.060   11.802   77.466   1.8715   77.466   1.8715 0.000000 0.000000 
1 1 1   13    0  -39 o  114.456   1.7415  534.383   16.239  534.383   16.239  534.383   16.239  114.456   1.7415  114.456   1.7415 -0.000000 0.000000 
1 1 1   13    0  -38 o  270.219   2.3604  2977.59   51.984  2977.59   51.984  2977.59   51.984  270.219   2.3604  270.219   2.3604 0.000000 0.000000 
1 1 1   13    0  -37 o  226.583   2.1262  2093.52   39.263  2093.52   39.263  2093.52   39.263  226.583   2.1262  226.583   2.1262 -0.000000 0.000000 
1 1 1   13    0  -36 o  130.584   1.9196  695.574   20.423  695.574   20.423  695.574   20.423  130.584   1.9196  130.584   1.9196 -0.000000 0.000000 
1 1 1   13    0  -35 o  187.183   1.9434  1428.76   29.646  1428.76   29.646  1428.76   29.646  187.183   1.9434  187.183   1.9434 -0.000000 0.000000 
1 1 1   13    0  -34 o  452.879   3.5342  8365.65  130.453  8365.65  130.453  8365.65  130.453  452.879   3.5342  452.879   3.5342 -0.000000 0.000000 
1 1 1   13    0  -33 o  213.872   2.0655  1865.18   36.001  1865.18   36.001  1865.18   36.001  213.872   2.0655  213.872   2.0655 -0.000000 0.000000 
1 1 1   13    0  -32 o  163.391   1.8557  1088.67   24.708  1088.67   24.708  1088.67   24.708  163.391   1.8557  163.391   1.8557 0.000000 0.000000 
1 1 1   13    0  -31 o  552.718   4.2195 12462.59  190.085 12462.59  190.085 12462.59  190.085  552.718   4.2195  552.718   4.2195 0.000000 0.000000 
1 1 1   13    0  -30 o  338.240   2.7824  4665.29   76.705  4665.29   76.705  4665.29   76.705  338.240   2.7824  338.240   2.7824 0.000000 0.000000 
1 1 1   13    0  -29 o  346.686   3.1671  4901.78   89.486  4901.78   89.486  4901.78   89.486  346.686   3.1671  346.686   3.1671 0.000000 0.000000 
1 1 1   13    0  -28 o  194.117   2.2028  1536.67   34.846  1536.67   34.846  1536.67   34.846  194.117   2.2028  194.117   2.2028 0.000000 0.000000 
1 1 1   13    0  -27 o  391.724   3.4915  6258.32  111.468  6258.32  111.468  6258.32  111.468  391.724   3.4915  391.724   3.4915 -0.000000 0.000000 
1 1 1   13    0  -26 o   40.320   3.8784   68.111   12.459   68.111   12.459   68.111   12.459   40.320   3.8784   40.320   3.8784 0.000000 0.000000 
1 1 1   13    0  -25 o  239.188   2.8461  2333.38   55.475  2333.38   55.475  2333.38   55.475  239.188   2.8461  239.188   2.8461 0.000000 0.000000 
1 1 1   13    0  -24 o  107.323   2.3443  470.201   20.487  470.201   20.487  470.201   20.487  107.323   2.3443  107.323   2.3443 0.000000 0.000000 
1 1 1   13    0  -23 o  207.075   3.1485  1749.41   53.118  1749.41   53.118  1749.41   53.118  207.075   3.1485  207.075   3.1485 -0.000000 0.000000 
1 1 1   13    0  -22 o  276.927   3.7622  3128.65   84.892  3128.65   84.892  3128.65   84.892  276.927   3.7622  276.927   3.7622 -0.000000 0.000000 
1 1 1   13    0  -21 o  353.829   3.6832  5106.24  106.205  5106.24  106.205  5106.24  106.205  353.829   3.6832  353.829   3.6832 -0.000000 0.000000 
1 1 1   13    0  -20 o  203.691   2.5428  1692.10   42.205  1692.10   42.205  1692.10   42.205  203.691   2.5428  203.691   2.5428 -0.000000 0.000000 
1 1 1   13    0  -19 o  370.596   3.8270  5601.64  115.581  5601.64  115.581  5601.64  115.581  370.596   3.8270  370.596   3.8270 -0.000000 0.000000 
1 1 1   13    0  -18 f  189.730   2.1816  1467.93   33.731  1467.93   33.731  1467.93   33.731  189.730   2.1816  189.730   2.1816 -0.000000 0.000000 
1 1 1   13    0  -17 o   13.996   6.9497   11.757   9.5792   11.757   9.5792   11.757   9.5792   13.996   6.9497   13.996   6.9497 0.000000 0.000000 
1 1 1   13    0  -16 o  286.270   2.7433  3341.61   64.002  3341.61   64.002  3341.61   64.002  286.270   2.7433  286.270   2.7433 -0.000000 0.000000 
1 1 1   13    0  -15 o  304.923   2.8730  3791.30   71.397  3791.30   71.397  3791.30   71.397  304.923   2.8730  304.923   2.8730 0.000000 0.000000 
1 1 1   13    0  -14 o  134.763   2.2320  740.896   24.504  740.896   24.504  740.896   24.504  134.763   2.2320  134.763   2.2320 -0.000000 0.000000 
1 1 1   13    0  -13 o  105.900   2.2428  457.757   19.341  457.757   19.341  457.757   19.341  105.900   2.2428  105.900   2.2428 0.000000 0.000000 
1 1 1   13    0  -12 o  561.963   5.5152 12883.73  252.585 12883.73  252.585 12883.73  252.585  561.963   5.5152  561.963   5.5152 0.000000 0.000000 
1 1 1   13    0  -11 o   13.126   7.1868   9.7894   11.003   9.7894   11.003   9.7894   11.003   13.126   7.1868   13.126   7.1868 -0.000000 0.000000 
1 1 1   13    0  -10 o  347.118   3.6417  4913.91  103.017  4913.91  103.017  4913.91  103.017  347.118   3.6417  347.118   3.6417 -0.000000 0.000000 
1 1 1   13    0   -9 o   56.151   3.3449  129.898   15.185  129.898   15.185  129.898   15.185   56.151   3.3449   56.151   3.3449 0.000000 0.000000 
1 1 1   13    0   -8 o  469.687   4.6947  8998.14  179.702  8998.14  179.702  8998.14  179.702  469.687   4.6947  469.687   4.6947 0.000000 0.000000 
1 1 1   13    0   -7 o  304.166   3.2912  3772.92   81.580  3772.92   81.580  3772.92   81.580  304.166   3.2912  304.166   3.2912 -0.000000 0.000000 
1 1 1   13    0   -6 o   54.990   2.9227  124.310   13.016  124.310   13.016  124.310   13.016   54.990   2.9227   54.990   2.9227 -0.000000 0.000000 
1 1 1   13    0   -5 o   90.120   2.3005  331.694   16.875  331.694   16.875  331.694   16.875   90.120   2.3005   90.120   2.3005 -0.000000 0.000000 
1 1 1   13    0   -4 f  163.045   2.3444  1084.28   31.144  1084.28   31.144  1084.28   31.144  163.045   2.3444  163.045   2.3444 0.000000 0.000000 
1 1 1   13    0   -3 o  124.460   2.2679  632.040   22.991  632.040   22.991  632.040   22.991  124.460   2.2679  124.460   2.2679 -0.000000 0.000000 
1 1 1   13    0   -2 o  523.823   6.3526 11197.32  271.164 11197.32  271.164 11197.32  271.164  523.823   6.3526  523.823   6.3526 -0.000000 0.000000 
1 1 1   13    0   -1 o  130.982   2.8823  700.373   30.741  700.373   30.741  700.373   30.741  130.982   2.8823  130.982   2.8823 -0.000000 0.000000 
1 1 1   13    0    0 o  606.144   7.2590 14996.75  358.551 14996.75  358.551 14996.75  358.551  606.144   7.2590  606.144   7.2590 0.000000 0.000000 
1 1 1   13    0    1 o  112.003   2.9063  512.409   26.494  512.409   26.494  512.409   26.494  112.003   2.9063  112.003   2.9063 0.000000 0.000000 
1 1 1   13    0    2 o   21.474   8.9042   26.434   15.507   26.434   15.507   26.434   15.507   21.474   8.9042   21.474   8.9042 -0.000000 0.000000 
1 1 1   13    0    3 o  287.369   3.8604  3368.61   90.393  3368.61   90.393  3368.61   90.393  287.369   3.8604  287.369   3.8604 0.000000 0.000000 
1 1 1   13    0    4 f  194.132   2.5386  1537.01   40.156  1537.01   40.156  1537.01   40.156  194.132   2.5386  194.132   2.5386 -0.000000 0.000000 
1 1 1   13    0    5 o  305.804   4.0383  3814.71  100.626  3814.71  100.626  3814.71  100.626  305.804   4.0383  305.804   4.0383 0.000000 0.000000 
1 1 1   13    0    6 o  127.306   2.7218  661.557   28.216  661.557   28.216  661.557   28.216  127.306   2.7218  127.306   2.7218 0.000000 0.000000 
1 1 1   13    0    7 o   13.687   7.6973   10.161   13.021   10.161   13.021   10.161   13.021   13.687   7.6973   13.687   7.6973 0.000000 0.000000 
1 1 1   13    0    8 o  237.363   4.7788  2300.21   92.378  2300.21   92.378  2300.21   92.378  237.363   4.7788  237.363   4.7788 -0.000000 0.000000 
1 1 1   13    0    9 o   99.342   2.7929  403.250   22.576  403.250   22.576  403.250   22.576   99.342   2.7929   99.342   2.7929 0.000000 0.000000 
1 1 1   13    0   10 o  400.398   5.0104  6540.76  163.475  6540.76  163.475  6540.76  163.475  400.398   5.0104  400.398   5.0104 0.000000 0.000000 
1 1 1   13    0   11 o  109.924   2.7381  493.479   24.500  493.479   24.500  493.479   24.500  109.924   2.7381  109.924   2.7381 -0.000000 0.000000 
1 1 1   13    0   12 o  147.151   2.3251  883.307   27.873  883.307   27.873  883.307   27.873  147.151   2.3251  147.151   2.3251 -0.000000 0.000000 
1 1 1   13    0   13 o  390.337   4.0162  6214.19  127.758  6214.19  127.758  6214.19  127.758  390.337   4.0162  390.337   4.0162 -0.000000 0.000000 
1 1 1   13    0   14 o  506.185   5.0269 10452.25  207.372 10452.25  207.372 10452.25  207.372  506.185   5.0269  506.185   5.0269 -0.000000 0.000000 
1 1 1   13    0   15 o  121.692   2.3120  604.301   22.916  604.301   22.916  604.301   22.916  121.692   2.3120  121.692   2.3120 -0.000000 0.000000 
1 1 1   13    0   16 o  500.184   4.9734 10206.01  202.731 10206.01  202.731 10206.01  202.731  500.184   4.9734  500.184   4.9734 -0.000000 0.000000 
1 1 1   13    0   17 o  210.267   3.2046  1803.69   54.898  1803.69   54.898  1803.69   54.898  210.267   3.2046  210.267   3.2046 0.000000 0.000000 
1 1 1   13    0   18 f  204.965   2.5933  1713.36   43.313  1713.36   43.313  1713.36   43.313  204.965   2.5933  204.965   2.5933 -0.000000 0.000000 
1 1 1   13    0   19 o  426.009   4.3212  7402.75  150.022  7402.75  150.022  7402.75  150.022  426.009   4.3212  426.009   4.3212 0.000000 0.000000 
1 1 1   13    0   20 o  164.277   2.3893  1100.78   31.980  1100.78   31.980  1100.78   31.980  164.277   2.3893  164.277   2.3893 -0.000000 0.000000 
1 1 1   13    0   21 o   90.593   3.0923  335.760   22.775  335.760   22.775  335.760   22.775   90.593   3.0923   90.593   3.0923 0.000000 0.000000 
1 1 1   13    0   22 o   65.397   3.2723  175.669   17.344  175.669   17.344  175.669   17.344   65.397   3.2723   65.397   3.2723 -0.000000 0.000000 
1 1 1   13    0   23 o  464.255   5.7017  8797.14  215.699  8797.14  215.699  8797.14  215.699  464.255   5.7017  464.255   5.7017 0.000000 0.000000 
1 1 1   13    0   24 o  388.292   4.8975  6152.56  154.957  6152.56  154.957  6152.56  154.957  388.292   4.8975  388.292   4.8975 -0.000000 0.000000 
1 1 1   13    0   25 o   99.697   2.8151  406.182   22.836  406.182   22.836  406.182   22.836   99.697   2.8151   99.697   2.8151 0.000000 0.000000 
1 1 1   13    0   26 o   79.788   2.4553  260.257   15.935  260.257   15.935  260.257   15.935   79.788   2.4553   79.788   2.4553 -0.000000 0.000000 
1 1 1   13    0   27 o  214.578   2.6610  1877.95   46.528  1877.95   46.528  1877.95   46.528  214.578   2.6610  214.578   2.6610 0.000000 0.000000 
1 1 1   13    0   28 o  234.470   2.7943  2242.28   53.391  2242.28   53.391  2242.28   53.391  234.470   2.7943  234.470   2.7943 -0.000000 0.000000 
1 1 1   13    0   29 o  294.533   3.2404  3538.38   77.777  3538.38   77.777  3538.38   77.777  294.533   3.2404  294.533   3.2404 -0.000000 0.000000 
1 1 1   13    0   30 o  333.692   3.5524  4542.17   96.603  4542.17   96.603  4542.17   96.603  333.692   3.5524  333.692   3.5524 0.000000 0.000000 
1 1 1   13    0   31 o   85.726   2.4156  300.311   16.850  300.311   16.850  300.311   16.850   85.726   2.4156   85.726   2.4156 0.000000 0.000000 
1 1 1   13    0   32 o   10.453   6.4609   3.1890   10.855   3.1890   10.855   3.1890   10.855   10.453   6.4609   10.453   6.4609 -0.000000 0.000000 
1 1 1   13    0   33 o   36.093   4.2657   55.322   12.090   55.322   12.090   55.322   12.090   36.093   4.2657   36.093   4.2657 0.000000 0.000000 
1 1 1   13    0   34 o  167.226   2.4040  1140.76   32.755  1140.76   32.755  1140.76   32.755  167.226   2.4040  167.226   2.4040 -0.000000 0.000000 
1 1 1   13    0   35 o   40.766   3.8192   69.546   12.421   69.546   12.421   69.546   12.421   40.766   3.8192   40.766   3.8192 0.000000 0.000000 
1 1 1   13    0   36 o  161.861   2.3918  1068.80   31.542  1068.80   31.542  1068.80   31.542  161.861   2.3918  161.861   2.3918 -0.000000 0.000000 
1 1 1   13    0   37 o   88.772   2.4316  322.005   17.566  322.005   17.566  322.005   17.566   88.772   2.4316   88.772   2.4316 0.000000 0.000000 
1 1 1   13    0   38 o   83.779   2.4734  286.909   16.858  286.909   16.858  286.909   16.858   83.779   2.4734   83.779   2.4734 -0.000000 0.000000 
1 1 1   13    0   39 o  282.122   3.1554  3246.94   72.545  3246.94   72.545  3246.94   72.545  282.122   3.1554  282.122   3.1554 0.000000 0.000000 
1 1 1   13    0   40 o  158.280   2.3978  1022.10   30.921  1022.10   30.921  1022.10   30.921  158.280   2.3978  158.280   2.3978 -0.000000 0.000000 
1 1 1   13    0   41 o  168.712   2.4342  1161.21   33.460  1161.21   33.460  1161.21   33.460  168.712   2.4342  168.712   2.4342 -0.000000 0.000000 
1 1 1   13    0   42 o   48.540   4.4269   98.509   17.164   98.509   17.164   98.509   17.164   48.540   4.4269   48.540   4.4269 -0.000000 0.000000 
1 1 1   13    0   43 o   17.513   8.8281   18.441   15.572   18.441   15.572   18.441   15.572   17.513   8.8281   17.513   8.8281 -0.000000 0.000000 
1 1 1   13    0   45 o  348.956   4.5272  4971.80  128.728  4971.80  128.728  4971.80  128.728  348.956   4.5272  348.956   4.5272 -0.000000 0.000000 
1 1 1   13    0   46 o   95.419   2.4178  371.935   18.779  371.935   18.779  371.935   18.779   95.419   2.4178   95.419   2.4178 0.000000 0.000000 
1 1 1   13    0   47 o  272.863   3.0896  3037.58   68.700  3037.58   68.700  3037.58   68.700  272.863   3.0896  272.863   3.0896 0.000000 0.000000 
1 1 1   13    0   48 o   9.9718   6.3465   1.0467   11.328   1.0467   11.328   1.0467   11.328   9.9718   6.3465   9.9718   6.3465 -0.000000 0.000000 
1 1 1   13    0   49 f   89.524   2.4381  327.508   17.762  327.508   17.762  327.508   17.762   89.524   2.4381   89.524   2.4381 -0.000000 0.000000 
1 1 1   13    0   50 o   11.326   6.8602   4.8896   11.693   4.8896   11.693   4.8896   11.693   11.326   6.8602   11.326   6.8602 0.000000 0.000000 
1 1 1   13    0   51 o  171.975   2.4655  1206.68   34.546  1206.68   34.546  1206.68   34.546  171.975   2.4655  171.975   2.4655 -0.000000 0.000000 
1 1 1   13    0   52 o   74.850   2.6624  229.329   16.198  229.329   16.198  229.329   16.198   74.850   2.6624   74.850   2.6624 -0.000000 0.000000 
1 1 1   13    0   53 o   21.510   7.7635   25.074   12.476   25.074   12.476   25.074   12.476   21.510   7.7635   21.510   7.7635 -0.000000 0.000000 
1 1 1   13    0   54 o  277.441   3.8552  3142.59   87.150  3142.59   87.150  3142.59   87.150  277.441   3.8552  277.441   3.8552 -0.000000 0.000000 
1 1 1   13    0   55 o  115.685   2.4147  546.414   22.748  546.414   22.748  546.414   22.748  115.685   2.4147  115.685   2.4147 -0.000000 0.000000 
1 1 1   13    0   56 o   32.818   5.4383   47.440   13.348   47.440   13.348   47.440   13.348   32.818   5.4383   32.818   5.4383 0.000000 0.000000 
1 1 1   13    0   57 o  221.371   3.4152  2000.69   61.594  2000.69   61.594  2000.69   61.594  221.371   3.4152  221.371   3.4152 -0.000000 0.000000 
1 1 1   13    0   58 o   15.843   8.6311   14.462   15.789   14.462   15.789   14.462   15.789   15.843   8.6311   15.843   8.6311 -0.000000 0.000000 
1 1 1   13    0   59 o   80.837   3.4301  268.049   22.509  268.049   22.509  268.049   22.509   80.837   3.4301   80.837   3.4301 -0.000000 0.000000 
1 1 1   13    0   60 o  167.556   3.1764  1146.57   43.348  1146.57   43.348  1146.57   43.348  167.556   3.1764  167.556   3.1764 -0.000000 0.000000 
1 1 1   13    0   61 o   31.306   8.7814   48.492   19.394   48.492   19.394   48.492   19.394   31.306   8.7814   31.306   8.7814 -0.000000 0.000000 
1 1 1   13    0   62 o   96.129   3.3412  378.397   26.110  378.397   26.110  378.397   26.110   96.129   3.3412   96.129   3.3412 -0.000000 0.000000 
1 1 1   13    0   63 o   71.057   4.7524  209.002   27.240  209.002   27.240  209.002   27.240   71.057   4.7524   71.057   4.7524 -0.000000 0.000000 
1 1 1   13    0   64 o   44.263   6.5311   85.225   22.061   85.225   22.061   85.225   22.061   44.263   6.5311   44.263   6.5311 0.000000 0.000000 
1 1 1   13    0   65 o  150.033   4.1227  921.307   50.334  921.307   50.334  921.307   50.334  150.033   4.1227  150.033   4.1227 -0.000000 0.000000 
1 1 1   13    0   66 o   24.901   8.7807   33.386   16.180   33.386   16.180   33.386   16.180   24.901   8.7807   24.901   8.7807 -0.000000 0.000000 
1 1 1   13    0   67 o   67.768   5.8265  192.095   31.616  192.095   31.616  192.095   31.616   67.768   5.8265   67.768   5.8265 0.000000 0.000000 
1 1 1   13    0   68 o   84.366   2.9185  291.468   20.016  291.468   20.016  291.468   20.016   84.366   2.9185   84.366   2.9185 -0.000000 0.000000 
1 1 1   13    0   69 o  111.348   2.6557  506.697   24.073  506.697   24.073  506.697   24.073  111.348   2.6557  111.348   2.6557 -0.000000 0.000000 
1 1 1   13    0   70 o   92.789   2.2389  351.793   16.912  351.793   16.912  351.793   16.912   92.789   2.2389   92.789   2.2389 -0.000000 0.000000 
1 1 1   13    0   71 o   31.597   4.5711   43.288   11.057   43.288   11.057   43.288   11.057   31.597   4.5711   31.597   4.5711 -0.000000 0.000000 
1 1 1   13    0   72 o   56.224   3.1397  130.257   14.286  130.257   14.286  130.257   14.286   56.224   3.1397   56.224   3.1397 -0.000000 0.000000 
1 1 1   13    0   73 o   68.321   2.5227  191.237   14.006  191.237   14.006  191.237   14.006   68.321   2.5227   68.321   2.5227 0.000000 0.000000 
1 1 1   13    0   74 o  232.628   2.4896  2208.96   47.198  2208.96   47.198  2208.96   47.198  232.628   2.4896  232.628   2.4896 -0.000000 0.000000 
1 1 1   13    0   75 o  184.164   2.2471  1384.35   33.722  1384.35   33.722  1384.35   33.722  184.164   2.2471  184.164   2.2471 -0.000000 0.000000 
1 1 1   13    0   76 o   90.516   2.2141  334.880   16.314  334.880   16.314  334.880   16.314   90.516   2.2141   90.516   2.2141 -0.000000 0.000000 
1 1 1   13    0   77 o   69.320   2.4290  196.829   13.687  196.829   13.687  196.829   13.687   69.320   2.4290   69.320   2.4290 -0.000000 0.000000 
1 1 1   13    0   78 o   6.9210   4.8223  -9.1519   9.7926  -9.1519   9.7926  -9.1519   9.7926   6.9210   4.8223   6.9210   4.8223 -0.000000 0.000000 
1 1 1   13    0   79 o  111.723   2.1297  509.892   19.379  509.892   19.379  509.892   19.379  111.723   2.1297  111.723   2.1297 -0.000000 0.000000 
1 1 1   13    0   80 o   7.4676   5.2697 -15.2429   12.846 -15.2429   12.846 -15.2429   12.846   7.4676   5.2697   7.4676   5.2697 -0.000000 0.000000 
1 1 1   13    0   81 o  168.118   2.6018  1155.17   35.637  1155.17   35.637  1155.17   35.637  168.118   2.6018  168.118   2.6018 0.000000 0.000000 
1 1 1   13    0   82 o   56.299   3.3407  131.013   15.206  131.013   15.206  131.013   15.206   56.299   3.3407   56.299   3.3407 0.000000 0.000000 
1 1 1   13    0   83 o   61.287   2.7501  154.421   13.676  154.421   13.676  154.421   13.676   61.287   2.7501   61.287   2.7501 0.000000 0.000000 
1 1 1   13    0   84 o  124.634   2.0411  634.638   20.724  634.638   20.724  634.638   20.724  124.634   2.0411  124.634   2.0411 0.000000 0.000000 
1 1 1   13    0   85 o   7.9330   5.2599  -2.2404   8.9748  -2.2404   8.9748  -2.2404   8.9748   7.9330   5.2599   7.9330   5.2599 0.000000 0.000000 
1 1 1   13    0   86 o  178.453   2.4557  1302.28   35.707  1302.28   35.707  1302.28   35.707  178.453   2.4557  178.453   2.4557 -0.000000 0.000000 
1 1 1   13    0   87 o   17.574   6.8104   17.460   9.2725   17.460   9.2725   17.460   9.2725   17.574   6.8104   17.574   6.8104 0.000000 0.000000 
1 1 1   13    0   88 o   9.9999   5.9888   4.4052   8.7105   4.4052   8.7105   4.4052   8.7105   9.9999   5.9888   9.9999   5.9888 -0.000000 0.000000 
1 1 1   13    0   89 o   63.139   2.4399  163.783   12.515  163.783   12.515  163.783   12.515   63.139   2.4399   63.139   2.4399 0.000000 0.000000 
1 1 1   13    0   90 o  109.092   2.1801  487.132   19.370  487.132   19.370  487.132   19.370  109.092   2.1801  109.092   2.1801 -0.000000 0.000000 
1 1 1   13    0   91 o   30.331   3.8432   39.621   9.0870   39.621   9.0870   39.621   9.0870   30.331   3.8432   30.331   3.8432 -0.000000 0.000000 
1 1 1   13    0   92 o   54.002   2.3429  120.027   10.269  120.027   10.269  120.027   10.269   54.002   2.3429   54.002   2.3429 0.000000 0.000000 
1 1 1   13    0   93 o   7.6099   4.9077   0.1359   7.0586   0.1359   7.0586   0.1359   7.0586   7.6099   4.9077   7.6099   4.9077 0.000000 0.000000 
1 1 1   13    0   94 o   88.575   1.9796  321.356   14.277  321.356   14.277  321.356   14.277   88.575   1.9796   88.575   1.9796 -0.000000 0.000000 
1 1 1   13    0   95 o   91.391   1.9735  342.153   14.686  342.153   14.686  342.153   14.686   91.391   1.9735   91.391   1.9735 -0.000000 0.000000 
1 1 1   13    0   96 o   5.0975   3.6471 -10.6402   6.9661 -10.6402   6.9661 -10.6402   6.9661   5.0975   3.6471   5.0975   3.6471 -0.000000 0.000000 
1 1 1   13    0   97 o   11.947   6.3286   8.8251   8.2730   8.8251   8.2730   8.8251   8.2730   11.947   6.3286   11.947   6.3286 0.000000 0.000000 
1 1 1   13    0   98 o   14.940   6.6403   13.632   8.5490   13.632   8.5490   13.632   8.5490   14.940   6.6403   14.940   6.6403 0.000000 0.000000 
1 1 1   13    0   99 o   15.407   6.6235   14.327   8.5256   14.327   8.5256   14.327   8.5256   15.407   6.6235   15.407   6.6235 -0.000000 0.000000 
1 1 1   13    0  100 o   39.133   2.9017   64.089   9.1366   64.089   9.1366   64.089   9.1366   39.133   2.9017   39.133   2.9017 0.000000 0.000000 
1 1 1   13    0  101 o   22.444   5.1288   24.011   8.1744   24.011   8.1744   24.011   8.1744   22.444   5.1288   22.444   5.1288 -0.000000 0.000000 
1 1 1   13    0  102 o   16.197   6.3839   15.272   8.0943   15.272   8.0943   15.272   8.0943   16.197   6.3839   16.197   6.3839 -0.000000 0.000000 
1 1 1   13    0  103 o   8.7379   5.4598   2.3249   7.9662   2.3249   7.9662   2.3249   7.9662   8.7379   5.4598   8.7379   5.4598 0.000000 0.000000 
1 1 1   13    0  104 o   16.843   6.4325   16.371   8.3237   16.371   8.3237   16.371   8.3237   16.843   6.4325   16.843   6.4325 0.000000 0.000000 
1 1 1   13    0  105 o   37.938   3.0723   60.723   9.3532   60.723   9.3532   60.723   9.3532   37.938   3.0723   37.938   3.0723 -0.000000 0.000000 
1 1 1   13    0  106 o   40.609   2.9576   69.329   9.6684   69.329   9.6684   69.329   9.6684   40.609   2.9576   40.609   2.9576 0.000000 0.000000 
1 1 1   13    0  107 o   43.684   2.3826   79.335   8.4260   79.335   8.4260   79.335   8.4260   43.684   2.3826   43.684   2.3826 -0.000000 0.000000 
1 1 1   13    0  108 o   33.008   2.9504   46.261   7.7858   46.261   7.7858   46.261   7.7858   33.008   2.9504   33.008   2.9504 -0.000000 0.000000 
1 1 1   13    0  109 o   6.0024   4.1163  -3.8589   6.4653  -3.8589   6.4653  -3.8589   6.4653   6.0024   4.1163   6.0024   4.1163 -0.000000 0.000000 
1 1 1   13    0  110 f   13.088   7.3320   11.407   11.758   11.407   11.758   11.407   11.758   13.088   7.3320   13.088   7.3320 -0.000000 0.000000 
1 1 1   13    0  111 o   18.027   9.0247   23.698   16.216   23.698   16.216   23.698   16.216   18.027   9.0247   18.027   9.0247 0.000000 0.000000 
1 1 1   13    0  112 o   15.568   8.6605   17.961   16.266   17.961   16.266   17.961   16.266   15.568   8.6605   15.568   8.6605 0.000000 0.000000 
1 1 1   13    0  113 o   9.7869   6.6120  -3.1896   15.422  -3.1896   15.422  -3.1896   15.422   9.7869   6.6120   9.7869   6.6120 0.000000 0.000000 
1 1 1   13    0  114 o   9.4101   6.2275  -0.2498   12.485  -0.2498   12.485  -0.2498   12.485   9.4101   6.2275   9.4101   6.2275 0.000000 0.000000 
1 1 1   13    0  115 f   40.104   4.6193   72.190   14.581   72.190   14.581   72.190   14.581   40.104   4.6193   40.104   4.6193 0.000000 0.000000 
1 1 1   13    0  116 o   8.5984   5.8811  -5.0926   13.003  -5.0926   13.003  -5.0926   13.003   8.5984   5.8811   8.5984   5.8811 0.000000 0.000000 
1 1 1   13    0  117 o   19.060   8.4472   25.245   13.835   25.245   13.835   25.245   13.835   19.060   8.4472   19.060   8.4472 0.000000 0.000000 
1 1 1   13    0  118 o   10.961   7.2486   1.7800   16.864   1.7800   16.864   1.7800   16.864   10.961   7.2486   10.961   7.2486 -0.000000 0.000000 
1 1 1   13    0  119 o   12.446   7.5150   10.159   13.943   10.159   13.943   10.159   13.943   12.446   7.5150   12.446   7.5150 -0.000000 0.000000 
1 1 1   13    0  120 f   25.065   8.1147   37.227   14.652   37.227   14.652   37.227   14.652   25.065   8.1147   25.065   8.1147 -0.000000 0.000000 
1 1 1   13    0  121 o   10.213   6.6917   2.1259   13.871   2.1259   13.871   2.1259   13.871   10.213   6.6917   10.213   6.6917 -0.000000 0.000000 
1 1 1   13    0  122 o   10.471   7.0124   0.0062   16.648   0.0062   16.648   0.0062   16.648   10.471   7.0124   10.471   7.0124 -0.000000 0.000000 
1 1 1   13    0  123 o   8.7088   5.9851  -5.4714   13.837  -5.4714   13.837  -5.4714   13.837   8.7088   5.9851   8.7088   5.9851 -0.000000 0.000000 
1 1 1   13    0  124 o   37.663   6.8045   71.540   18.867   71.540   18.867   71.540   18.867   37.663   6.8045   37.663   6.8045 -0.000000 0.000000 
1 1 1   13    0  125 o   41.263   9.3032   96.462   27.301   96.462   27.301   96.462   27.301   41.263   9.3032   41.263   9.3032 -0.000000 0.000000 
1 1 1   13    1 -124 o   32.070   7.0405   58.591   17.899   84.084   25.301   33.047   25.326   35.713   8.7589   21.106   8.8176 14.60759 12.42855 
1 1 1   13    1 -123 o   15.736   6.1256   12.153   11.299  -3.4222   17.805   22.656   14.621   13.620   6.3819   19.494   7.0990 -5.874849 9.545912 
1 1 1   13    1 -122 o   16.483   5.8711   14.122   9.9352  -6.9723   13.724   37.348   14.401   11.670   5.5101   25.528   6.7994 -13.85724 8.751719 
1 1 1   13    1 -121 o   14.636   5.7089   9.6937   9.8305   0.4171   13.487   20.209   14.359   13.003   5.8939   18.718   6.9961 -5.715883 9.147853 
1 1 1   13    1 -120 o   13.775   5.7717   6.4483   10.898   10.359   17.071   3.7587   14.158   16.151   7.0055   14.000   6.2148 2.150755 9.364824 
1 1 1   13    1 -119 o   15.215   5.7796   10.910   9.8884   21.532   13.880  -0.0366   14.091   19.395   6.9360   13.191   5.9973 6.203627 9.169222 
1 1 1   13    1 -118 o   14.767   5.7026   9.7713   9.7336   20.598   13.571  -1.6978   13.968   19.151   6.8573   12.857   5.8929 6.294549 9.041503 
1 1 1   13    1 -117 o   16.291   6.0853   13.072   10.861  -2.4959   13.522   41.376   18.233   12.568   5.7744   25.856   7.9121 -13.28827 9.795168 
1 1 1   13    1 -116 o   17.659   5.8316   16.035   9.7501   12.165   13.615   20.109   13.970   16.325   6.6028   19.060   6.9394 -2.734259 9.578691 
1 1 1   13    1 -115 o   9.9851   4.6970  -6.8730   9.8070  -6.6763   12.815  -7.1511   15.236   11.546   5.4114   12.473   5.8632 -0.9275103 7.978745 
1 1 1   13    1 -114 o   19.032   5.9303   18.694   10.188   27.670   15.107   11.205   13.798   21.993   7.2587   16.206   6.6128 5.786287 9.819252 
1 1 1   13    1 -113 o   9.7399   4.6023  -7.7670   9.6103 -11.4190   14.529  -4.9262   12.814   11.607   5.5343   11.948   5.5361 -0.3410273 7.827996 
1 1 1   13    1 -112 o   14.305   5.6938   7.8487   9.9553   4.7641   13.191   11.930   15.174   14.332   6.1872   16.783   6.9012 -2.451280 9.268658 
1 1 1   13    1 -111 o   35.634   3.7817   56.517   10.817   63.744   14.335   46.960   16.485   36.879   4.8890   29.639   6.9453 7.239414 8.493501 
1 1 1   13    1 -110 o   25.624   5.0149   31.122   10.100   46.134   13.439   11.640   15.309   30.883   5.5421   16.957   6.9477 13.92624 8.887398 
1 1 1   13    1 -109 o   13.573   5.4118   6.2223   9.0089   17.044   12.497  -5.4865   12.999   18.607   6.5889   12.144   5.6091 6.462538 8.653078 
1 1 1   13    1 -108 o   15.754   5.5606   11.087   8.8948   25.970   12.467  -4.3415   12.694   22.653   6.4451   12.297   5.6294 10.35609 8.557465 
1 1 1   13    1 -107 o   12.737   5.2460   3.9903   8.7872  -3.4281   12.067   12.365   12.821   12.246   5.5604   17.088   6.5590 -4.842739 8.598763 
1 1 1   13    1 -106 o   34.725   3.4373   51.994   9.6021   52.959   13.424   50.984   13.740   34.078   4.9796   33.242   5.2445 0.8359833 7.231891 
1 1 1   13    1 -105 o   23.063   4.8693   24.371   8.8662   29.544   12.466   19.076   12.612   24.704   6.2010   19.949   6.6341 4.755329 9.080951 
1 1 1   13    1 -104 o   11.187   4.9011  -0.5546   8.5350  -2.2682   11.939   1.2367   12.206   12.630   5.6503   13.654   5.9230 -1.023220 8.185843 
1 1 1   13    1 -103 o   24.636   4.7503   27.317   9.1937   16.825   12.822   38.418   13.189   19.239   6.6846   28.719   5.8332 -9.480459 8.871897 
1 1 1   13    1 -102 o   27.174   4.1978   32.348   8.9992   30.137   12.714   34.569   12.740   25.265   6.2164   27.264   5.9037 -1.999172 8.573092 
1 1 1   13    1 -101 o   9.1792   4.3275  -8.2754   8.4079  -3.3147   11.658 -13.6527   12.138   12.369   5.5544   10.601   5.0559 1.767574 7.510905 
1 1 1   13    1 -100 o   23.887   4.6285   25.333   8.6867   23.618   11.986   27.230   12.608   22.488   6.2923   24.102   6.3351 -1.613600 8.928982 
1 1 1   13    1  -99 o   40.346   3.1432   68.441   10.256   65.562   13.394   72.520   15.944   38.978   4.2862   40.679   4.9074 -1.700443 6.515674 
1 1 1   13    1  -98 o   49.004   2.6446   99.875   10.525  127.032   14.258   67.356   15.602   55.039   3.1916   39.180   4.9988 15.85893 5.930815 
1 1 1   13    1  -97 o   64.336   2.5195  171.540   13.188  168.145   18.581  174.987   18.720   63.141   3.6254   64.444   3.5776 -1.303642 5.093369 
1 1 1   13    1  -96 o   28.712   4.4068   35.775   9.9850   36.599   15.129   35.139   13.291   28.065   6.7051   27.775   6.0427 0.2901497 9.026213 
1 1 1   13    1  -95 o   14.174   5.5772   5.7364   9.4511   15.491   14.433  -1.5860   12.505   19.511   7.0608   13.420   5.9042 6.091191 9.204004 
1 1 1   13    1  -94 o   50.570   2.8334  106.230   11.633  122.268   19.817   97.798   14.370   53.476   4.5906   48.200   3.6852 5.275318 5.886835 
1 1 1   13    1  -93 o   31.977   4.0164   43.544   10.239   33.361   17.171   49.162   12.754   26.761   7.5471   33.725   4.7725 -6.964540 8.929443 
1 1 1   13    1  -92 o   38.502   3.4163   62.126   10.611   62.735   17.888   61.795   13.180   37.654   6.0313   38.091   4.3211 -0.4372368 7.419477 
1 1 1   13    1  -91 o   61.322   2.4797  155.075   12.370  130.205   19.715  171.220   15.885   55.481   4.3952   64.255   3.0415 -8.773182 5.344950 
1 1 1   13    1  -90 o   13.494   5.5500   3.0807   9.8170   7.6958   16.606   0.6013   12.172   17.943   7.2794   13.981   5.9882 3.961879 9.425935 
1 1 1   13    1  -89 o   64.955   2.1864  173.313   11.560  167.115   16.131  179.857   16.574   63.524   3.1249   65.917   3.0932 -2.393116 4.396919 
1 1 1   13    1  -88 o   64.344   2.1786  169.972   11.410  191.052   16.448  150.419   15.841   68.013   2.9740   60.258   3.2370 7.755207 4.395748 
1 1 1   13    1  -87 o   80.575   1.9742  265.850   12.966  270.562   18.197  260.989   18.481   81.061   2.7579   79.584   2.8535 1.477119 3.968381 
1 1 1   13    1  -86 o   51.356   2.5569  108.530   10.670  107.805   15.075  109.257   15.104   50.932   3.6555   51.280   3.6369 -0.3482857 5.156518 
1 1 1   13    1  -85 o   51.061   2.8581  107.467   11.849  111.961   14.752   99.299   19.889   51.978   3.5022   48.478   5.1099 3.499889 6.194924 
1 1 1   13    1  -84 f   45.410   1.7787   84.420   6.5713   87.752   14.408   83.545   7.3840   45.923   3.8853   45.146   2.0116 0.7772827 4.375121 
1 1 1   13    1  -83 o   69.472   1.5664  197.121   8.8707  212.615   17.012  191.335   10.396   71.911   2.9083   68.390   1.8665 3.520508 3.455714 
1 1 1   13    1  -82 o   16.921   4.2232   12.291   5.8062   25.550   16.588   10.440   6.1984   24.447   7.5588   15.716   4.5674 8.730635 8.831552 
1 1 1   13    1  -81 o   55.485   1.9162  125.959   8.6538  130.798   19.540  124.778   9.6519   56.116   4.3046   55.197   2.1493 0.9192696 4.811348 
1 1 1   13    1  -80 o   55.619   1.9986  126.584   9.0466  115.725   20.835  129.107   10.043   52.643   4.9121   56.148   2.1985 -3.505589 5.381614 
1 1 1   13    1  -79 o   98.075   1.6281  392.679   13.016  365.999   22.353  406.366   16.010   94.471   2.9062   99.732   1.9694 -5.260803 3.510604 
1 1 1   13    1  -78 o  135.343   1.6023  747.686   17.677  761.797   29.447  739.735   22.103  136.441   2.6476  134.564   2.0151 1.876740 3.327214 
1 1 1   13    1  -77 o  129.004   1.6223  679.230   17.060  718.878   27.963  655.724   21.531  132.572   2.5876  126.694   2.0849 5.878296 3.323009 
1 1 1   13    1  -76 o   25.961   5.0813   28.753   10.368   30.877   14.523   26.545   14.806   26.716   6.6858   24.872   7.0058 1.843039 9.684043 
1 1 1   13    1  -75 o   74.452   2.1695  226.603   13.152  239.672   18.398  212.943   18.810   76.473   2.9569   72.039   3.2112 4.433678 4.365247 
1 1 1   13    1  -74 f   52.599   2.6634  113.396   11.382   99.659   15.714  128.559   16.509   49.126   3.9577   55.885   3.6440 -6.759186 5.379792 
1 1 1   13    1  -73 o   44.206   1.8708   79.903   6.7260   79.622   9.1481   80.234   9.9231   44.067   2.5577   44.213   2.7672 -0.1469154 3.768195 
1 1 1   13    1  -72 o   53.324   1.7272  116.146   7.4977  118.893   10.138  112.828   11.140   53.905   2.3125   52.481   2.6122 1.424358 3.488755 
1 1 1   13    1  -71 o  100.481   1.4506  411.825   11.881  405.569   16.408  418.721   17.227   99.679   2.0194  101.277   2.0867 -1.598251 2.903858 
1 1 1   13    1  -70 o   68.002   1.9363  188.874   10.722  251.663   20.541  165.355   12.571   78.370   3.2222   63.583   2.4300 14.78748 4.035753 
1 1 1   13    1  -69 o   32.168   2.6350   42.555   6.8489   48.445   10.039   37.426   9.3675   34.208   3.6569   29.974   3.9283 4.233404 5.366979 
1 1 1   13    1  -68 o  120.148   1.4411  588.742   14.114  599.029   19.906  578.341   20.016  121.156   2.0156  119.042   2.0627 2.114128 2.883970 
1 1 1   13    1  -67 o   69.753   1.6510  198.466   9.3875  198.303   12.924  198.648   13.658   69.662   2.2790   69.712   2.4072 -0.5025482E-01 3.314861 
1 1 1   13    1  -66 o  119.346   1.4539  580.869   14.144  569.589   19.715  592.833   20.304  118.147   2.0471  120.532   2.0665 -2.385193 2.908785 
1 1 1   13    1  -65 o  149.189   1.6342  907.797   19.873  923.806   31.591  897.312   25.566  150.418   2.5765  148.289   2.1150 2.129593 3.333422 
1 1 1   13    1  -64 o  151.800   1.7729  939.940   21.937  951.273   32.026  929.921   30.111  152.644   2.5738  150.934   2.4473 1.710526 3.551647 
1 1 1   13    1  -63 o  134.375   1.5238  736.356   16.691  725.170   22.441  750.208   24.972  133.320   2.0649  135.588   2.2594 -2.268295 3.060868 
1 1 1   13    1  -62 o   69.196   1.7665  195.415   9.9558  195.779   14.283  195.071   13.884   69.211   2.5360   69.090   2.4693 0.1203156 3.539607 
1 1 1   13    1  -61 o   22.784   4.2739   21.927   7.6460   29.955   12.252   16.807   9.7853   26.504   5.8299   20.000   5.7163 6.503151 8.164780 
1 1 1   13    1  -60 o  109.525   1.5782  489.159   14.090  487.813   20.946  490.272   19.042  109.340   2.3500  109.626   2.1309 -0.2861633 3.172310 
1 1 1   13    1  -59 o  184.768   1.6198  1392.14   24.397  1411.91   34.967  1373.39   34.055  186.027   2.3059  183.474   2.2771 2.553162 3.240711 
1 1 1   13    1  -58 o  108.653   1.5823  481.387   14.014  490.694   19.908  472.245   19.731  109.673   2.2269  107.590   2.2498 2.082458 3.165544 
1 1 1   13    1  -57 o   24.871   4.1841   25.980   8.1817   35.582   11.724   16.865   11.423   29.050   5.1392   20.299   6.2720 8.751038 8.108575 
1 1 1   13    1  -56 o  189.337   1.6180  1461.80   24.972  1497.64   35.658  1427.30   34.982  191.600   2.2831  187.045   2.2944 4.554825 3.236801 
1 1 1   13    1  -55 o  163.497   1.5437  1089.96   20.573  1100.51   29.167  1079.51   29.023  164.253   2.1784  162.678   2.1886 1.575043 3.087996 
1 1 1   13    1  -54 o  193.133   1.7415  1521.04   27.416  1529.88   35.738  1508.41   42.739  193.658   2.2639  192.257   2.7272 1.401093 3.544377 
1 1 1   13    1  -53 o  146.886   1.4739  879.675   17.647  855.976   24.592  904.834   25.339  144.868   2.0825  148.945   2.0870 -4.076797 2.948275 
1 1 1   13    1  -52 o   68.890   1.8619  193.675   10.446  214.872   17.415  181.762   13.056   72.498   2.9530   66.706   2.4049 5.791862 3.808392 
1 1 1   13    1  -51 o  113.429   1.5112  524.571   13.972  534.106   18.963  513.245   20.667  114.438   2.0328  112.173   2.2602 2.265572 3.039870 
1 1 1   13    1  -50 o  134.765   1.4537  740.459   15.969  744.067   22.605  736.866   22.562  135.072   2.0531  134.417   2.0592 0.6554718 2.907781 
1 1 1   13    1  -49 o  196.840   1.6044  1579.78   25.743  1571.39   36.327  1588.23   36.485  196.280   2.2705  197.329   2.2682 -1.048859 3.209351 
1 1 1   13    1  -48 o  218.669   1.6840  1949.66   30.017  1938.91   42.271  1960.60   42.631  218.022   2.3785  219.237   2.3855 -1.215286 3.368664 
1 1 1   13    1  -47 o  332.164   2.1856  4499.91   59.179  4372.87   81.871  4638.90   85.638  327.335   3.0683  337.138   3.1162 -9.803192 4.373262 
1 1 1   13    1  -46 o   53.195   1.7031  115.494   7.3754  113.531   11.658  116.804   9.5234   52.681   2.7241   53.471   2.1895 -0.7900238 3.494975 
1 1 1   13    1  -45 f   22.455   3.4014   21.048   6.0313   17.171   9.6685   23.517   7.7170   20.202   5.6510   23.649   4.1546 -3.447544 7.013887 
1 1 1   13    1  -44 o   94.070   1.4270  360.767   10.942  365.362   16.053  356.778   14.955   94.653   2.0805   93.538   1.9614 1.115471 2.859331 
1 1 1   13    1  -43 o  192.671   1.4687  1513.42   23.067  1514.12   34.904  1512.89   30.736  192.680   2.2223  192.616   1.9576 0.6455994E-01 2.961553 
1 1 1   13    1  -42 o  107.139   1.3267  467.945   11.586  465.455   17.728  469.802   15.308  106.837   2.0357  107.342   1.7495 -0.5051193 2.684154 
1 1 1   13    1  -41 o  125.860   1.4813  645.807   15.197  629.117   23.480  657.839   19.936  124.199   2.3192  127.016   1.9255 -2.816597 3.014384 
1 1 1   13    1  -40 o   33.076   2.6552   44.915   7.0988   34.255   11.392   51.682   9.0767   28.522   5.0863   35.447   3.1749 -6.925098 5.995897 
1 1 1   13    1  -39 o  102.190   1.5937  425.750   13.276  430.711   23.396  423.394   16.123  102.714   2.7970  101.900   1.9410 0.8142014 3.404484 
1 1 1   13    1  -38 o  139.906   1.5015  797.974   17.124  772.351   26.246  816.962   22.595  137.615   2.3397  141.547   1.9582 -3.931961 3.051081 
1 1 1   13    1  -37 o  120.177   1.2879  588.751   12.617  569.827   17.040  611.714   18.771  118.220   1.7682  122.485   1.8800 -4.265198 2.580884 
1 1 1   13    1  -36 o  362.146   2.0758  5347.88   61.277  5381.91   87.070  5314.48   86.252  363.209   2.9409  360.927   2.9317 2.281281 4.152514 
1 1 1   13    1  -35 o  368.648   2.1044  5541.66   63.237  5550.98   89.559  5532.38   89.303  368.868   2.9785  368.250   2.9750 0.6180725 4.209785 
1 1 1   13    1  -34 o  101.671   1.3592  421.389   11.265  414.481   14.805  430.887   17.360  100.826   1.8013  102.797   2.0717 -1.970276 2.745324 
1 1 1   13    1  -33 o  201.810   1.5092  1660.33   24.827  1679.28   33.277  1636.55   37.284  202.940   2.0116  200.329   2.2832 2.610718 3.042957 
1 1 1   13    1  -32 o  368.089   2.2204  5524.98   66.621  5578.73   89.848  5459.35   99.291  369.801   2.9806  365.781   3.3301 4.019409 4.469176 
1 1 1   13    1  -31 f  221.970   1.5775  2008.65   28.543  1991.05   37.902  2031.70   43.384  220.975   2.1042  223.205   2.3845 -2.230148 3.180125 
1 1 1   13    1  -30 o  271.934   1.8764  3014.97   41.594  2997.91   52.536  3043.62   68.091  271.136   2.3770  273.146   3.0582 -2.010193 3.873305 
1 1 1   13    1  -29 o  325.557   2.0093  4321.41   53.323  4296.00   71.505  4353.24   80.034  324.548   2.7028  326.677   3.0055 -2.128693 4.042089 
1 1 1   13    1  -28 o  161.613   1.4541  1064.74   19.156  1080.90   27.903  1050.34   26.344  162.818   2.1024  160.502   2.0136 2.315414 2.911129 
1 1 1   13    1  -27 o  354.612   2.2804  5127.59   65.916  5112.98   93.552  5141.99   92.892  354.023   3.2418  355.029   3.2098 -1.006165 4.562012 
1 1 1   13    1  -26 o  220.048   1.7649  1974.04   31.657  1963.80   49.132  1981.31   41.394  219.434   2.7468  220.432   2.3037 -0.9976044 3.584948 
1 1 1   13    1  -25 o  312.583   2.2115  3983.95   56.349  4021.59   87.512  3957.29   73.648  313.967   3.4194  311.490   2.9006 2.477356 4.483894 
1 1 1   13    1  -24 o  230.853   1.6873  2172.58   31.751  2161.63   45.147  2183.30   44.663  230.243   2.4055  231.396   2.3678 -1.153030 3.375384 
1 1 1   13    1  -23 o  277.694   1.8970  3143.85   42.941  3141.12   61.081  3146.51   60.380  277.534   2.7000  277.773   2.6666 -0.2398376 3.794831 
1 1 1   13    1  -22 o  191.845   1.5346  1500.32   23.998  1473.93   34.088  1526.26   33.792  190.132   2.1994  193.480   2.1426 -3.347687 3.070528 
1 1 1   13    1  -21 o  114.613   1.3748  535.473   12.844  535.253   18.575  535.674   17.779  114.581   1.9888  114.628   1.9028 -0.4647827E-01 2.752404 
1 1 1   13    1  -20 o  340.441   2.2015  4725.41   61.094  4732.55   86.825  4718.41   85.981  340.638   3.1269  340.130   3.1011 0.5073242 4.403944 
1 1 1   13    1  -19 o  200.057   1.5724  1631.50   25.643  1606.64   36.504  1655.72   36.029  198.509   2.2559  201.520   2.1933 -3.011093 3.146379 
1 1 1   13    1  -18 o  339.046   2.3388  4686.88   64.638  4689.81   98.853  4684.68   85.432  339.068   3.5766  338.920   3.0923 0.1485901 4.728047 
1 1 1   13    1  -17 o  165.202   1.5309  1112.51   20.615  1131.35   31.876  1098.96   27.028  166.578   2.3476  164.184   2.0195 2.394104 3.096688 
1 1 1   13    1  -16 o  112.305   1.4424  514.116   13.205  535.726   20.438  498.631   17.300  114.631   2.1872  110.595   1.9190 4.035988 2.909732 
1 1 1   13    1  -15 o  152.993   1.6114  954.153   20.096  965.574   28.777  943.282   28.076  153.893   2.2940  152.107   2.2644 1.786148 3.223276 
1 1 1   13    1  -14 o  425.014   2.8205  7365.87   97.715  7269.93  128.215  7498.79  150.924  422.161   3.7258  428.692   4.3190 -6.530975 5.703967 
1 1 1   13    1  -13 o   39.789   2.3993   64.782   7.7458   69.564   10.875   59.858   11.035   41.171   3.2671   38.140   3.5919 3.031010 4.855468 
1 1 1   13    1  -12 o  177.320   1.5909  1281.70   22.995  1255.25   30.498  1316.54   35.006  175.470   2.1322  179.697   2.3898 -4.226761 3.202724 
1 1 1   13    1  -11 o  136.593   1.4920  760.530   16.613  744.731   22.301  780.226   24.900  135.159   2.0242  138.339   2.2081 -3.180359 2.995517 
1 1 1   13    1  -10 o   93.424   1.5158  355.781   11.543  355.652   15.778  355.929   16.933   93.402   2.0723   93.437   2.2232 -0.3470612E-01 3.039250 
1 1 1   13    1   -9 o  270.899   2.1599  2991.82   47.696  3007.69   68.529  2976.91   66.425  271.579   3.0956  270.190   3.0159 1.389435 4.321865 
1 1 1   13    1   -8 o  186.702   1.9180  1420.99   29.190  1480.51   47.934  1385.92   36.800  190.541   3.0862  184.372   2.4486 6.169250 3.939571 
1 1 1   13    1   -7 o  181.871   1.7558  1348.36   26.030  1365.41   38.070  1333.39   35.672  183.000   2.5521  180.845   2.4198 2.155121 3.516899 
1 1 1   13    1   -6 o  329.575   3.0424  4429.27   81.736  4469.03  116.659  4390.93  114.553  330.967   4.3241  328.065   4.2836 2.901611 6.086652 
1 1 1   13    1   -5 o  372.623   3.3522  5662.48  101.820  5598.40  142.981  5728.41  145.030  370.398   4.7356  374.673   4.7486 -4.275085 6.706376 
1 1 1   13    1   -4 o  170.894   1.8686  1190.52   26.030  1160.21   33.102  1239.64   42.137  168.694   2.4072  174.359   2.9647 -5.665253 3.818928 
1 1 1   13    1   -3 o  139.523   1.7789  793.540   20.231  805.501   26.227  775.962   31.793  140.563   2.2890  137.951   2.8273 2.611435 3.637713 
1 1 1   13    1   -2 o   83.723   1.6621  285.729   11.343  296.945   16.527  275.741   15.597   85.310   2.3790   82.208   2.3298 3.102737 3.329792 
1 1 1   13    1   -1 o  200.418   1.8045  1637.40   29.480  1656.01   42.235  1619.72   41.167  201.536   2.5709  199.317   2.5338 2.219070 3.609640 
1 1 1   13    1    0 o   98.223   1.7538  393.281   14.042  390.603   18.611  396.820   21.394   97.882   2.3326   98.618   2.6638 -0.7356644 3.540735 
1 1 1   13    1    1 o  361.199   2.6624  5319.39   78.388  5414.42  112.494  5229.69  109.289  364.342   3.7878  358.076   3.7443 6.266022 5.326059 
1 1 1   13    1    2 o  480.727   3.7154  9425.80  145.592  8879.53  218.909  9859.08  194.961  466.351   5.7586  491.524   4.8659 -25.17245 7.539128 
1 1 1   13    1    3 o  128.860   1.9679  676.915   20.671  726.451   42.982  662.011   23.576  133.392   3.9573  127.430   2.2697 5.962433 4.561961 
1 1 1   13    1    4 o   39.635   3.0687   64.442   9.8373   66.662   14.271   62.431   13.579   40.179   4.4308   38.875   4.3602 1.303043 6.216343 
1 1 1   13    1    5 o  159.367   1.8470  1035.33   23.994  1026.09   30.828  1049.54   38.215  158.644   2.3839  160.434   2.9221 -1.789932 3.771185 
1 1 1   13    1    6 o  245.735   2.0259  2461.71   40.581  2509.70   58.342  2416.73   56.483  248.090   2.8849  243.454   2.8462 4.636978 4.052624 
1 1 1   13    1    7 o   33.769   3.3764   46.970   9.1695   56.194   12.610   36.619   13.358   36.867   4.2752   29.441   5.7724 7.426054 7.183196 
1 1 1   13    1    8 o  296.872   2.5178  3593.31   60.930  3565.29   78.419  3636.01   96.787  295.677   3.2536  298.552   3.9770 -2.874969 5.138372 
1 1 1   13    1    9 o  124.013   1.9673  626.951   19.887  623.804   23.322  635.336   38.072  123.696   2.3130  124.748   3.7483 -1.051689 4.404492 
1 1 1   13    1   10 o  130.760   1.7745  697.002   18.915  698.140   24.869  695.442   29.132  130.858   2.3314  130.598   2.7365 0.2606964 3.595035 
1 1 1   13    1   11 o  280.868   2.7075  3216.59   61.988  3279.84   89.194  3157.49   86.210  283.555   3.8589  278.219   3.8013 5.335480 5.416750 
1 1 1   13    1   12 o  497.966   3.8377 10115.36  155.779 10091.98  200.877 10150.64  246.736  497.247   4.9559  498.510   6.0719 -1.263062 7.837646 
1 1 1   13    1   13 o  147.206   1.8097  883.365   21.715  873.173   28.201  898.209   34.034  146.344   2.3641  148.417   2.8131 -2.072922 3.674588 
1 1 1   13    1   14 o  405.134   3.5814  6694.90  118.273  6606.15  165.595  6787.31  168.984  402.284   5.0498  407.759   5.0840 -5.474426 7.165754 
1 1 1   13    1   15 o  145.495   1.7790  862.950   21.098  892.819   33.875  844.020   26.968  147.969   2.8085  143.880   2.2994 4.088898 3.629691 
1 1 1   13    1   16 o  172.315   2.0775  1210.53   29.181  1196.32   41.202  1224.82   41.334  171.277   2.9511  173.306   2.9259 -2.028732 4.155701 
1 1 1   13    1   17 o  217.564   3.2587  1930.56   57.792   0.0000   0.0000  1930.56   57.792  ?   ?   217.564   3.2587 0.000000 3.258700 
1 1 1   13    1   18 o  279.999   3.1010  3197.44   70.777  3186.54  121.719  3203.00   86.997  279.343   5.3455  280.197   3.8089 -0.8534851 6.563680 
1 1 1   13    1   19 o  270.596   3.0266  2986.24   66.758  3027.43  116.272  2965.99   81.537  272.283   5.2387  269.634   3.7098 2.649628 6.419182 
1 1 1   13    1   20 o  151.049   2.2752  930.252   28.014  907.951   47.333  942.276   34.755  149.123   3.8972  152.007   2.8049 -2.884125 4.801627 
1 1 1   13    1   21 o   51.185   2.4649  107.076   10.254  120.955   14.079   91.394   14.965   54.363   3.1911   47.164   3.9281 7.198307 5.060903 
1 1 1   13    1   22 o  290.906   2.2698  3450.51   53.824  3423.67   75.885  3477.68   76.356  289.716   3.2133  291.993   3.2080 -2.276794 4.540514 
1 1 1   13    1   23 o  324.337   2.4578  4289.49   64.980  4274.22   91.916  4304.75   91.876  323.682   3.4837  324.837   3.4698 -1.155304 4.916832 
1 1 1   13    1   24 o  170.193   1.8701  1180.89   25.944  1177.03   41.270  1183.42   33.361  169.877   2.9803  170.359   2.4024 -0.4818878 3.828025 
1 1 1   13    1   25 o  176.735   1.7386  1273.39   25.047  1291.78   35.973  1256.07   34.897  177.984   2.4795  175.508   2.4392 2.475677 3.478150 
1 1 1   13    1   26 o  140.292   1.6444  802.365   18.805  793.011   26.768  811.480   26.424  139.455   2.3547  141.071   2.2979 -1.616196 3.290154 
1 1 1   13    1   27 o  201.826   1.8368  1660.69   30.218  1708.34   43.628  1616.76   41.894  204.669   2.6151  199.109   2.5812 5.559814 3.674379 
1 1 1   13    1   28 o  228.495   1.9584  2128.68   36.476  2146.81   52.034  2111.16   51.149  229.425   2.7823  227.513   2.7580 1.911499 3.917632 
1 1 1   13    1   29 o  294.624   2.2990  3539.64   55.214  3568.99   78.682  3511.16   77.500  295.768   3.2635  293.364   3.2408 2.403931 4.599299 
1 1 1   13    1   30 o  199.251   1.8355  1618.64   29.812  1700.37   43.566  1546.66   40.884  204.185   2.6175  194.739   2.5755 9.445999 3.672127 
1 1 1   13    1   31 f  266.272   2.1484  2891.05   46.630  2886.54   66.083  2895.53   65.808  266.002   3.0477  266.417   3.0303 -0.4151306 4.297782 
1 1 1   13    1   32 o  141.664   1.6634  818.177   19.208  839.579   27.877  798.831   26.505  143.484   2.3835  139.960   2.3232 3.523193 3.328364 
1 1 1   13    1   33 o  243.981   2.0379  2427.20   40.531  2417.72   57.426  2436.61   57.213  243.451   2.8938  244.401   2.8718 -0.9507904 4.076894 
1 1 1   13    1   34 o  277.371   2.2093  3137.29   49.951  3158.60   71.157  3116.59   70.137  278.237   3.1374  276.383   3.1132 1.854279 4.419825 
1 1 1   13    1   35 o  249.876   2.0659  2545.99   42.079  2590.34   60.382  2504.11   58.672  251.982   2.9397  247.756   2.9052 4.226746 4.133004 
1 1 1   13    1   36 o  164.445   1.7124  1102.53   22.955  1099.71   32.665  1105.28   32.264  164.207   2.4404  164.624   2.4043 -0.4166870 3.425802 
1 1 1   13    1   37 o  230.669   1.9699  2169.57   37.040  2225.61   53.464  2117.85   51.365  233.576   2.8080  227.854   2.7655 5.721909 3.941176 
1 1 1   13    1   38 o  283.884   3.8837  3290.36   89.873   0.0000   0.0000  3290.36   89.873  ?   ?   283.884   3.8837 0.000000 3.883736 
1 1 1   13    1   39 o  263.245   3.0271  2827.46   64.957  2937.44  116.533  2777.89   78.240  268.011   5.3341  260.860   3.6795 7.151398 6.480015 
1 1 1   13    1   40 o  353.455   3.7329  5100.42  107.552  5024.41  185.185  5139.11  132.119  350.216   6.4868  354.644   4.5702 -4.427826 7.935107 
1 1 1   13    1   41 o   59.797   3.0207  146.273   14.676  108.336   26.182  163.656   17.723   51.028   6.4373   63.226   3.4518 -12.19823 7.304387 
1 1 1   13    1   42 o   77.705   1.9317  246.212   12.236  267.957   19.714  232.588   15.605   80.982   2.9916   75.469   2.5402 5.513168 3.924584 
1 1 1   13    1   43 o  284.302   2.4525  3296.88   56.836  3301.84   90.076  3293.61   73.261  284.349   3.8862  284.087   3.1636 0.2612000 5.011085 
1 1 1   13    1   44 o   91.769   1.8462  343.397   13.811  330.911   21.664  351.944   17.925   90.006   2.9568   92.861   2.3700 -2.855034 3.789426 
1 1 1   13    1   45 f  126.864   1.7821  656.248   18.429  710.681   30.228  624.048   23.249  131.979   2.8098  123.695   2.3058 8.284203 3.634772 
1 1 1   13    1   46 o  236.925   2.1906  2289.36   42.306  2370.92   68.576  2239.25   53.754  240.987   3.4910  234.268   2.8149 6.719193 4.484478 
1 1 1   13    1   47 o   67.131   2.0944  183.968   11.447  167.306   18.257  194.762   14.694   63.918   3.5175   69.045   2.6156 -5.126793 4.383407 
1 1 1   13    1   48 o  209.492   2.0642  1789.81   35.250  1718.68   54.877  1839.78   45.994  205.191   3.2809  212.354   2.6571 -7.162689 4.221896 
1 1 1   13    1   49 o  298.333   2.5489  3630.96   61.985  3659.18   98.880  3612.69   79.558  299.272   4.0533  297.488   3.2808 1.783722 5.214649 
1 1 1   13    1   50 o  201.413   2.0329  1654.43   33.376  1614.14   52.220  1682.26   43.396  198.852   3.2216  203.057   2.6218 -4.205658 4.153614 
1 1 1   13    1   51 o  129.698   1.8270  685.953   19.316  705.262   31.011  673.714   24.690  131.460   2.8939  128.514   2.3568 2.945984 3.732225 
1 1 1   13    1   52 o  153.882   1.8778  965.657   23.554  997.331   37.983  945.865   30.025  156.319   2.9809  152.268   2.4190 4.050095 3.838894 
1 1 1   13    1   53 o  232.594   2.1953  2206.71   41.623  2157.13   65.089  2241.01   54.140  229.830   3.4743  234.333   2.8343 -4.502991 4.483757 
1 1 1   13    1   54 o  284.732   2.4928  3307.78   57.858  3519.05   95.745  3186.26   72.617  293.441   4.0028  279.360   3.1889 14.08136 5.117709 
1 1 1   13    1   55 o  279.012   2.4646  3176.24   56.055  3233.43   90.111  3140.15   71.593  281.282   3.9301  277.326   3.1670 3.955750 5.047287 
1 1 1   13    1   56 o  122.220   1.9262  609.233   19.191  634.422   31.190  593.888   24.344  124.656   3.0695  120.644   2.4754 4.011795 3.943293 
1 1 1   13    1   57 o  243.998   2.2976  2428.91   45.698  2466.99   73.115  2404.50   58.540  245.717   3.6504  242.689   2.9592 3.027115 4.699136 
1 1 1   13    1   58 o  165.015   2.5825  1111.22   34.738   0.0000   0.0000  1111.22   34.738  ?   ?   165.015   2.5825 0.000000 2.582544 
1 1 1   13    1   59 o  145.394   2.4251  862.566   28.742  840.690   49.246  873.868   35.396  143.311   4.2201  146.302   2.9680 -2.990341 5.159346 
1 1 1   13    1   60 o  108.905   2.4137  483.964   21.427  500.631   37.725  476.027   26.034  110.553   4.1938  107.935   2.9618 2.618202 5.134215 
1 1 1   13    1   61 o   72.905   2.7065  217.272   16.056  205.133   26.835  224.041   20.040   70.624   4.6879   73.979   3.3317 -3.354752 5.751184 
1 1 1   13    1   62 o   20.244   5.6486   17.304   9.6733 -13.6607   14.920   39.760   12.706   12.723   5.9222   30.713   5.2644 -17.98942 7.923792 
1 1 1   13    1   63 o  228.947   2.1859  2138.81   40.794  2151.94   65.122  2130.34   52.335  229.445   3.4818  228.407   2.8109 1.038727 4.474862 
1 1 1   13    1   64 o  151.304   1.9041  933.927   23.485  917.956   37.314  944.404   30.221  149.896   3.0538  152.106   2.4374 -2.209946 3.907293 
1 1 1   13    1   65 o   28.193   4.4408   33.347   9.8685   16.396   15.512   44.870   12.790   21.063   7.3504   32.712   4.9514 -11.64939 8.862538 
1 1 1   13    1   66 o  186.437   1.8640  1418.06   28.328  1413.18   41.137  1422.46   39.068  186.015   2.7130  186.645   2.5678 -0.6297607 3.735500 
1 1 1   13    1   67 o   39.889   3.5237   65.590   11.340   66.619   22.502   65.240   13.129   39.529   7.2507   39.700   4.1166 -0.1709785 8.337814 
1 1 1   13    1   68 o   84.532   1.9102  291.567   13.162  296.156   20.010  288.068   17.474   85.083   2.8894   83.946   2.5566 1.136841 3.858088 
1 1 1   13    1   69 o   95.001   2.0569  368.365   15.929  370.297   21.492  366.011   23.726   95.155   2.7738   94.564   3.0821 0.5905457 4.146454 
1 1 1   13    1   70 o   46.599   2.6835   89.019   10.150   85.599   15.505   91.584   13.428   45.492   4.2295   47.171   3.5174 -1.678787 5.501010 
1 1 1   13    1   71 o   74.249   2.1220  225.248   12.830  199.283   20.713  241.412   16.343   69.658   3.6607   76.821   2.6137 -7.162971 4.498018 
1 1 1   13    1   72 o  176.278   1.5451  1267.67   22.203  1295.12   36.336  1251.31   28.048  178.043   2.5037  175.087   1.9652 2.955826 3.182810 
1 1 1   13    1   73 o  116.492   1.5333  553.621   14.560  543.689   22.149  561.179   19.320  115.366   2.3553  117.242   2.0216 -1.875961 3.103911 
1 1 1   13    1   74 f   59.999   2.6521  147.454   12.939   0.0000   0.0000  147.454   12.939  ?   ?    59.999   2.6521 0.000000 2.652071 
1 1 1   13    1   75 o  111.303   1.7606  505.648   15.973  561.584   25.677  470.334   20.402  117.187   2.6880  107.288   2.3328 9.898132 3.559119 
1 1 1   13    1   76 o   39.585   2.8419   64.447   9.1090   64.026   12.426   64.937   13.393   39.293   3.9322   39.523   4.2224 -0.2301674 5.769835 
1 1 1   13    1   77 o   45.781   2.8613   86.126   10.625   98.286   16.198   76.945   14.075   48.719   4.1173   43.076   4.0562 5.642681 5.779724 
1 1 1   13    1   78 o  102.913   1.8648  432.527   15.644  483.592   22.850  387.480   21.462  108.720   2.5784   97.262   2.7096 11.45824 3.740349 
1 1 1   13    1   79 o   94.647   1.7021  365.767   13.132  348.352   21.055  376.855   16.800   92.182   2.8053   96.020   2.1464 -3.837830 3.532307 
1 1 1   13    1   80 o   58.626   1.8437  140.543   8.8000  166.656   13.455  121.025   11.633   63.749   2.5948   54.302   2.6359 9.446522 3.698758 
1 1 1   13    1   81 o  117.280   1.3825  561.377   13.217  585.148   20.566  544.654   17.250  119.628   2.1090  115.460   1.8329 4.168159 2.794171 
1 1 1   13    1   82 o   94.652   1.4069  365.707   10.855  361.121   16.838  368.967   14.199   93.952   2.1986   95.022   1.8331 -1.069572 2.862561 
1 1 1   13    1   83 o   41.960   2.0596   72.190   7.0230   74.426   11.123   70.708   9.0564   42.424   3.2410   41.438   2.6958 0.9857178 4.215628 
1 1 1   13    1   84 f   35.341   2.3129   51.372   6.6263   55.661   10.406   48.447   8.5941   36.579   3.5337   34.185   3.1184 2.394115 4.712931 
1 1 1   13    1   85 o   99.766   1.4040  406.478   11.418  420.001   18.912  398.721   14.323  101.245   2.2915   98.750   1.7794 2.494652 2.901238 
1 1 1   13    1   86 o  103.690   1.3311  439.067   11.251  447.155   17.420  433.279   14.736  104.503   2.0450  102.931   1.7563 1.572197 2.695648 
1 1 1   13    1   87 o   50.862   1.7501  105.950   7.2450  101.815   11.251  108.880   9.4697   49.673   2.7898   51.479   2.2622 -1.806160 3.591755 
1 1 1   13    1   88 o   57.959   1.6032  137.474   7.5671  133.415   11.558  140.519   10.011   56.930   2.4967   58.512   2.1023 -1.582245 3.263909 
1 1 1   13    1   89 o   52.559   1.6725  113.148   7.1565  121.415   11.151  107.359   9.3319   54.279   2.5272   51.094   2.2461 3.185051 3.381102 
1 1 1   13    1   90 o   37.829   2.0134   58.851   6.1864   52.711   9.6557   63.126   8.0573   35.501   3.3772   39.081   2.5430 -3.580177 4.227603 
1 1 1   13    1   91 o   9.9753   4.0371   1.9025   5.0934   8.5976   8.3516  -2.0623   6.4269   15.093   5.3821   9.4118   4.1821 5.681079 6.815974 
1 1 1   13    1   92 o   53.958   1.5929  119.302   6.9985  131.613   11.016  110.971   9.0622   56.488   2.3979   51.924   2.1457 4.564030 3.217756 
1 1 1   13    1   93 o   50.906   1.6863  106.299   6.9878  109.347   11.415  104.471   8.8373   51.366   2.7360   50.363   2.1576 1.002541 3.484447 
1 1 1   13    1   94 o   11.073   4.1689   3.9337   5.1184  -2.9378   8.5806   7.7292   6.3772   10.721   4.7936   13.883   4.7181 -3.161699 6.726027 
1 1 1   13    1   95 o   18.640   3.5134   14.978   5.1428   9.7583   8.2289   18.323   6.5879   15.533   5.3572   20.507   4.0845 -4.974604 6.736652 
1 1 1   13    1   96 o   17.832   3.5714   13.776   5.0102   17.969   7.9894   11.058   6.4322   20.071   4.9216   15.906   4.6613 4.165084 6.778617 
1 1 1   13    1   97 o   55.847   1.4873  127.887   6.7645  124.056   10.737  130.409   8.7109   54.736   2.4123   56.289   1.9012 -1.552914 3.071422 
1 1 1   13    1   98 o   85.359   1.3056  298.241   9.0843  281.191   14.040  310.519   11.914   82.582   2.0873   86.976   1.6805 -4.393143 2.679750 
1 1 1   13    1   99 o   12.241   4.3754   5.6531   5.5229   16.275   8.0120  -3.9637   7.6235   19.011   5.0752   9.6771   4.4041 9.333533 6.719641 
1 1 1   13    1  100 o   22.646   3.2213   21.888   5.7788   15.607   8.4616   27.378   7.9112   18.581   5.3172   25.100   4.0008 -6.518559 6.654301 
1 1 1   13    1  101 o   11.349   4.2509   4.3775   5.3069   3.7144   8.0567   4.8856   7.0532   12.528   5.0748   12.521   4.8492 0.7335663E-02 7.019130 
1 1 1   13    1  102 o   10.265   3.9187   3.3065   4.5602   2.1888   8.1208   3.8213   5.5111   11.944   4.9918   11.134   4.2933 0.8095903 6.584099 
1 1 1   13    1  103 o   6.4294   3.0608  -5.3698   4.4079  -1.1215   8.3702  -7.0000   5.1851   10.943   4.8218   6.7860   3.2547 4.157154 5.817455 
1 1 1   13    1  104 o   43.458   1.6658   77.855   5.8903   74.131   10.570   79.533   7.0939   41.814   3.1237   43.819   1.9912 -2.004509 3.704360 
1 1 1   13    1  105 o   35.290   1.8333   51.552   5.2556   63.257   10.095   47.200   6.1556   38.498   3.2471   33.628   2.2587 4.869381 3.955460 
1 1 1   13    1  106 o   43.383   1.8971   78.003   6.6924   69.609   10.305   84.126   8.8007   40.386   3.1554   44.827   2.4174 -4.440586 3.974954 
1 1 1   13    1  107 o   36.287   2.9200   56.034   8.5642   60.323   9.9522   43.791   16.813   37.447   3.2939   29.146   7.1351 8.301723 7.858720 
1 1 1   13    1  108 o   17.660   5.4911   14.845   8.7401   5.4209   10.502   36.082   15.765   13.912   5.7330   26.180   7.1752 -12.26819 9.184267 
1 1 1   13    1  109 o   10.077   4.5354  -2.1347   7.8209   3.3285   10.358  -9.3805   11.929   13.099   5.5644   10.882   5.1378 2.216072 7.573583 
1 1 1   13    1  110 o   35.225   3.6784   54.765   10.407   51.311   16.911   56.871   13.202   31.379   6.8077   35.059   4.7410 -3.680529 8.295878 
1 1 1   13    1  111 o   36.407   3.2528   57.712   9.5517   62.131   13.710   53.543   13.315   36.573   4.7077   33.668   5.0037 2.904984 6.870201 
1 1 1   13    1  112 o   12.894   5.2492   5.2696   8.6701  -3.9588   12.377   14.160   12.149   11.973   5.5098   17.102   6.4262 -5.128804 8.464824 
1 1 1   13    1  113 o   18.829   5.5042   17.767   8.9784   21.643   12.752   13.955   12.644   20.053   6.6707   17.019   6.5182 3.034008 9.326632 
1 1 1   13    1  114 o   16.336   5.6013   13.056   8.9917   9.4216   13.048   16.343   12.408   15.515   6.3918   17.838   6.5329 -2.323009 9.139706 
1 1 1   13    1  115 o   16.059   5.6164   12.597   9.0598   21.451   13.417   5.1774   12.283   19.711   6.8386   14.005   6.0074 5.705888 9.102437 
1 1 1   13    1  116 o   13.510   5.4319   6.7966   9.1549   17.930   13.385  -2.9897   12.549   18.278   6.7694   12.101   5.5610 6.176628 8.760692 
1 1 1   13    1  117 o   23.136   5.3223   26.802   9.8283   45.394   14.553   11.209   13.327   29.322   6.2779   15.940   6.5009 13.38193 9.037336 
1 1 1   13    1  118 o   23.944   5.6689   29.473   10.892   17.742   17.705   36.616   13.816   18.172   7.4615   25.859   6.5486 -7.687550 9.927675 
1 1 1   13    1  119 o   14.923   5.9696   9.6830   10.998  -2.1015   14.444   25.937   16.964   12.908   5.9442   20.531   7.6177 -7.623363 9.662412 
1 1 1   13    1  120 o   14.097   5.7914   7.6107   10.673   8.6645   16.973   6.9214   13.728   15.755   6.9065   14.656   6.3194 1.098881 9.361308 
1 1 1   13    1  121 o   25.236   5.4842   32.557   10.959   43.942   17.384   25.048   14.117   26.755   7.6100   20.568   7.0193 6.186899 10.35292 
1 1 1   13    1  122 o   25.285   6.8288   36.788   14.403   44.259   18.000   23.491   24.014   26.429   7.8117   19.175   8.3130 7.254354 11.40739 
1 1 1   13    1  123 o   18.221   6.9082   18.928   14.111  -1.6734   17.133   62.385   24.883   13.707   6.3684   28.890   9.3014 -15.18320 11.27265 
1 1 1   13    1  124 o   20.307   7.8951   26.728   18.752   30.086   25.836   22.988   27.261   20.461   8.7430   19.168   8.5591 1.292799 12.23511 
1 1 1   13    2 -122 o   11.304   5.2942  -5.4753   12.226  -3.0033   17.273  -7.9571   17.308   13.529   6.3219   12.804   6.0868 0.7249384 8.775900 
1 1 1   13    2 -121 o   17.867   6.5381   17.759   12.424   0.9847   17.369   35.331   17.778   14.198   6.5309   23.199   7.8777 -9.001248 10.23286 
1 1 1   13    2 -120 o   14.073   6.0139   6.5376   12.226 -13.8240   17.176   27.449   17.407   11.991   5.7945   20.655   7.7063 -8.663994 9.641751 
1 1 1   13    2 -119 o   16.354   7.0799   11.422   17.367   11.422   17.367   0.0000   0.0000   16.354   7.0799  ?   ?  0.000000 7.079916 
1 1 1   13    2 -118 f   18.447   7.0768   19.284   14.920   35.839   17.871 -18.8078   27.108   23.618   7.8980   14.316   6.9989 9.302536 10.55288 
1 1 1   13    2 -117 o   10.673   5.1625 -14.1637   13.714 -14.1637   13.714   0.0000   0.0000   10.673   5.1625  ?   ?  0.000000 5.162488 
1 1 1   13    2 -116 o   13.853   5.9640   5.1761   12.191   7.1003   13.616  -2.5976   27.368   14.765   6.3290   16.088   7.6498 -1.322516 9.928542 
1 1 1   13    2 -115 o   12.272   5.3887   1.7282   10.371  -6.7747   13.112   15.938   16.950   11.601   5.4489   17.722   7.2913 -6.120773 9.102407 
1 1 1   13    2 -114 o   9.4717   4.5582 -11.3637   10.369  -8.8895   13.134 -15.4570   16.893   11.274   5.3428   11.896   5.7481 -0.6224804 7.847675 
1 1 1   13    2 -113 o   14.250   5.7396   7.8353   10.240   14.933   13.131  -3.1811   16.360   17.265   6.6349   13.542   6.2682 3.722287 9.127540 
1 1 1   13    2 -112 o   39.925   3.9421   71.875   12.662   56.266   16.687   93.065   19.442   32.793   6.4723   43.462   5.6192 -10.66938 8.571251 
1 1 1   13    2 -111 o   11.050   5.1390  -5.5546   11.198   3.4135   14.804 -17.5481   17.120   14.453   6.3885   11.855   5.7422 2.598083 8.589844 
1 1 1   13    2 -110 o   22.626   6.1647   26.591   11.677   37.547   15.609   12.669   17.595   26.046   7.1403   17.373   7.3099 8.672663 10.21849 
1 1 1   13    2 -109 o   45.690   3.2008   90.504   11.846   76.358   14.709  116.612   19.982   40.792   4.4982   49.869   4.9821 -9.077835 6.712273 
1 1 1   13    2 -108 f   17.671   5.9901   15.277   10.279   14.194   12.749   17.288   17.375   17.391   6.5724   18.876   7.5191 -1.485037 9.986674 
1 1 1   13    2 -107 o   17.743   6.1519   15.130   10.857   18.540   12.698   5.8573   20.938   19.238   6.6538   17.053   7.5647 2.184233 10.07462 
1 1 1   13    2 -106 o   16.010   5.8174   11.295   9.8107   24.613   12.901  -6.9709   15.108   21.964   6.6422   12.894   5.9874 9.069210 8.942507 
1 1 1   13    2 -105 o   54.863   2.6713  126.866   11.910  119.944   15.535  136.738   18.552   52.602   3.6455   55.733   4.1126 -3.130550 5.495740 
1 1 1   13    2 -104 o   45.690   2.8096   88.184   10.413  118.133   14.950   59.959   14.513   52.399   3.5206   36.241   5.0498 16.15800 6.155902 
1 1 1   13    2 -103 o   9.2337   4.3773  -9.0194   8.8281  -5.9392   12.429 -12.1560   12.542   12.015   5.5262   10.932   5.1924 1.083885 7.582849 
1 1 1   13    2 -102 o   26.488   4.4392   31.266   9.2460   37.000   13.057   25.499   13.094   28.027   5.9022   22.861   6.6370 5.165781 8.881742 
1 1 1   13    2 -101 o   21.007   5.2645   20.359   8.9958   24.395   12.819   16.444   12.627   22.512   6.5759   19.060   6.6328 3.452791 9.340075 
1 1 1   13    2 -100 o   19.975   5.3422   18.325   8.8673   23.437   12.507   13.158   12.574   22.213   6.4972   17.837   6.5690 4.375774 9.239387 
1 1 1   13    2  -99 o   27.714   4.1363   33.476   9.0586   52.512   12.848   14.660   12.773   34.546   4.6831   18.528   6.6505 16.01834 8.133877 
1 1 1   13    2  -98 o   9.2466   4.3377  -7.5527   8.2652 -10.1949   11.504  -4.7335   11.883   10.849   5.0983   12.193   5.5291 -1.343614 7.520863 
1 1 1   13    2  -97 o   43.840   2.7328   80.173   9.7173   82.965   13.267   76.941   14.273   44.177   3.7187   42.297   4.1948 1.880451 5.605850 
1 1 1   13    2  -96 o   21.862   5.1485   21.539   9.0223   18.407   11.963   25.671   13.740   20.167   6.4450   23.393   6.8007 -3.225908 9.369447 
1 1 1   13    2  -95 f   53.682   2.4629  119.432   10.749  118.652   14.038  120.537   16.712   53.181   3.2538   53.290   3.8737 -0.1090431 5.058906 
1 1 1   13    2  -94 o   28.709   4.1605   35.556   9.4532   32.127   12.738   39.760   14.104   26.528   6.0280   29.570   6.0551 -3.041649 8.544056 
1 1 1   13    2  -93 o   46.943   2.9333   91.832   11.168   82.510   18.384   97.285   14.060   43.423   5.3037   48.053   3.6160 -4.629848 6.419103 
1 1 1   13    2  -92 o   40.456   3.7157   69.109   12.117   86.515   26.090   64.323   13.681   43.090   7.7109   38.745   4.4103 4.345329 8.883116 
1 1 1   13    2  -91 o   19.317   3.3475   15.951   5.0801   25.117   21.970   15.433   5.2216   24.087   8.7120   18.954   3.5088 5.132818 9.392072 
1 1 1   13    2  -90 o   29.389   2.5238   35.861   5.9876   28.024   22.997   36.431   6.2014   25.176   8.9360   29.608   2.5957 -4.432230 9.305362 
1 1 1   13    2  -89 o   61.239   1.6363  153.648   8.1609  159.241   20.181  152.555   8.9230   61.539   4.0455   60.988   1.7968 0.5514641 4.426594 
1 1 1   13    2  -88 o   15.937   4.0189   11.019   5.2193  -1.2386   11.986   13.886   5.7978   13.369   5.8335   17.887   4.0686 -4.517913 7.112162 
1 1 1   13    2  -87 o   15.095   4.1921   9.8094   5.3415   8.8619   12.238   10.032   5.9368   16.714   6.4099   15.313   4.4757 1.401326 7.817813 
1 1 1   13    2  -86 o   53.715   1.7196  118.181   7.5197   91.349   14.622  127.829   8.7680   46.727   3.8738   55.832   1.9295 -9.105019 4.327684 
1 1 1   13    2  -85 o   32.107   3.0601   42.872   7.9120   46.448   13.507   41.005   9.7622   32.846   5.2191   31.192   3.9263 1.654753 6.531082 
1 1 1   13    2  -84 o   29.991   3.3176   37.552   7.9752   50.223   13.333   30.494   9.9516   34.320   4.9054   26.640   4.7574 7.680510 6.833375 
1 1 1   13    2  -83 o  113.324   1.6177  524.845   14.944  515.019   23.113  531.902   19.589  112.037   2.5309  113.975   2.1085 -1.937424 3.294075 
1 1 1   13    2  -82 o   68.449   1.6146  191.440   9.0089  188.772   16.423  192.588   10.775   67.702   2.9833   68.591   1.9290 -0.8885651 3.552601 
1 1 1   13    2  -81 o   38.330   2.2458   60.351   6.9862   59.421   13.744   60.676   8.1125   37.574   4.5820   38.381   2.6085 -0.8078423 5.272498 
1 1 1   13    2  -80 o   29.499   2.9767   36.076   7.0599   48.118   13.914   31.900   8.1930   33.613   5.2497   27.578   3.7409 6.034893 6.446218 
1 1 1   13    2  -79 f   28.016   3.2413   32.661   7.2657   41.331   14.296   29.642   8.4365   30.968   5.8784   26.518   4.0296 4.449890 7.126896 
1 1 1   13    2  -78 o   56.019   2.1483  128.503   9.7917  136.521   19.990  125.972   11.231   57.349   4.3077   55.419   2.4926 1.929749 4.976904 
1 1 1   13    2  -77 o  104.883   1.8013  449.294   15.400  492.016   30.269  434.374   17.889  109.410   3.3981  103.083   2.1289 6.326256 4.009907 
1 1 1   13    2  -76 f   67.440   2.0807  186.028   11.425  170.630   23.010  191.066   13.162   64.179   4.4255   68.312   2.3672 -4.133553 5.018773 
1 1 1   13    2  -75 o   51.543   2.4710  108.893   10.352  111.900   16.077  106.764   13.530   52.051   3.8155   50.926   3.2766 1.125340 5.029389 
1 1 1   13    2  -74 o  135.001   1.9118  744.224   21.038  781.680   28.722  700.864   30.903  138.255   2.5486  130.849   2.8973 7.406036 3.858673 
1 1 1   13    2  -73 o   57.598   2.3099  135.781   10.823  135.918   16.400  135.674   14.406   57.469   3.5176   57.481   3.0859 -0.1190567E-01 4.679385 
1 1 1   13    2  -72 f   50.241   2.4739  103.412   10.100   90.165   18.644  108.914   12.016   46.512   4.9957   51.518   2.8727 -5.005733 5.762795 
1 1 1   13    2  -71 o   37.266   2.2124   56.919   6.6904   52.592   8.5872   63.603   10.672   35.731   2.9752   39.266   3.3668 -3.534401 4.493053 
1 1 1   13    2  -70 o  120.659   1.4365  593.868   14.129  597.654   19.667  589.829   20.312  120.996   1.9940  120.194   2.0731 0.8024673 2.876436 
1 1 1   13    2  -69 o   58.526   1.6774  139.872   7.9943  140.755   10.941  138.861   11.709   58.663   2.2925   58.249   2.4715 0.4133911 3.371090 
1 1 1   13    2  -68 o   98.243   1.4552  393.683   11.653  390.302   16.063  397.440   16.933   97.785   2.0152   98.668   2.1053 -0.8834000 2.914294 
1 1 1   13    2  -67 o  115.991   1.5336  548.804   14.500  555.919   19.137  539.214   22.217  116.706   2.0117  114.907   2.3719 1.798790 3.110132 
1 1 1   13    2  -66 o  152.398   1.5547  947.362   19.314  967.591   26.097  922.866   28.718  153.968   2.0793  150.338   2.3434 3.629822 3.132922 
1 1 1   13    2  -65 o   61.480   2.0098  154.415   10.059  156.968   17.109  153.067   12.434   61.854   3.4064   61.172   2.4989 0.6814880 4.224736 
1 1 1   13    2  -64 o  111.932   1.6371  511.049   14.937  526.184   24.130  501.647   19.019  113.508   2.6079  110.869   2.1045 2.639145 3.351088 
1 1 1   13    2  -63 o  180.364   1.7073  1326.97   25.101  1348.30   39.368  1312.36   32.583  181.701   2.6580  179.316   2.2291 2.384644 3.468965 
1 1 1   13    2  -62 o   75.612   1.5970  233.178   9.8431  243.530   13.894  222.749   13.946   77.216   2.2097   73.837   2.3200 3.379013 3.203952 
1 1 1   13    2  -61 o  105.592   1.4801  454.686   12.740  447.763   17.791  461.974   18.251  104.755   2.0834  106.404   2.1043 -1.648209 2.961193 
1 1 1   13    2  -60 o   80.887   1.6925  266.848   11.159  254.256   16.461  277.558   15.180   78.878   2.5635   82.440   2.2611 -3.562447 3.418181 
1 1 1   13    2  -59 o   74.141   1.6975  224.189   10.259  208.070   13.726  244.590   15.442   71.365   2.3628   77.374   2.4514 -6.009583 3.404735 
1 1 1   13    2  -58 o  124.148   1.5444  628.513   15.629  625.523   20.975  632.246   23.434  123.826   2.0781  124.476   2.3096 -0.6498184 3.106839 
1 1 1   13    2  -57 o   11.729   4.8956   1.0428   7.7958  -3.2362   11.156   5.1264   10.898   12.639   5.5679   15.117   5.9765 -2.478681 8.168197 
1 1 1   13    2  -56 f  273.378   2.2088  3048.99   49.221  2953.38   68.129  3153.38   71.191  268.930   3.1078  277.881   3.1429 -8.951019 4.419997 
1 1 1   13    2  -55 o  134.952   1.6503  742.666   18.154  712.772   26.414  769.430   24.993  132.167   2.4517  137.333   2.2326 -5.166031 3.315914 
1 1 1   13    2  -54 o  160.077   1.7627  1045.01   23.001  1035.63   32.354  1054.60   32.705  159.310   2.4914  160.762   2.4957 -1.452484 3.526438 
1 1 1   13    2  -53 o   50.052   2.7887  102.570   11.333  103.874   13.581   99.580   20.567   50.322   3.3295   49.031   5.2264 1.291481 6.196873 
1 1 1   13    2  -52 o   71.873   1.8276  210.803   10.699  198.645   14.524  225.229   15.820   69.725   2.5597   74.246   2.6181 -4.520927 3.661485 
1 1 1   13    2  -51 f  160.486   1.6111  1050.20   21.076  1046.44   28.231  1054.95   31.680  160.168   2.1623  160.802   2.4169 -0.6342621 3.242947 
1 1 1   13    2  -50 o  157.037   1.7512  1005.62   22.417  971.641   32.383  1036.88   31.062  154.314   2.5744  159.423   2.3902 -5.108551 3.512934 
1 1 1   13    2  -49 o  107.233   1.4113  468.815   12.336  445.891   18.096  488.717   16.861  104.557   2.1233  109.471   1.8895 -4.914444 2.842281 
1 1 1   13    2  -48 o  217.188   1.6479  1923.39   29.174  1928.31   42.099  1918.83   40.466  217.415   2.3754  216.887   2.2889 0.5279236 3.298739 
1 1 1   13    2  -47 o  129.726   1.4900  686.138   15.756  677.230   21.697  696.078   22.918  128.861   2.0655  130.638   2.1522 -1.777130 2.983007 
1 1 1   13    2  -46 o  163.182   1.4638  1085.66   19.471  1125.33   28.813  1052.31   26.416  166.107   2.1279  160.633   2.0174 5.473999 2.932240 
1 1 1   13    2  -45 o  152.730   1.4366  951.013   17.885  928.658   25.895  971.403   24.731  150.897   2.1052  154.338   1.9657 -3.440247 2.880310 
1 1 1   13    2  -44 o   57.620   1.7055  135.493   8.0016  142.025   12.407  130.842   10.470   58.945   2.5885   56.592   2.2742 2.353035 3.445627 
1 1 1   13    2  -43 o  262.504   1.9738  2810.07   42.236  2796.24   56.030  2828.29   64.276  261.800   2.6255  263.258   2.9952 -1.457214 3.983064 
1 1 1   13    2  -42 o   32.321   2.8994   42.968   7.5576   50.230   10.667   35.648   10.709   34.864   3.8157   29.171   4.6606 5.692877 6.023340 
1 1 1   13    2  -41 o   96.454   1.5508  379.304   12.193  393.691   16.912  363.727   17.597   98.252   2.1116   94.434   2.2860 3.818016 3.111976 
1 1 1   13    2  -40 o  179.922   1.6235  1319.86   23.810  1334.34   32.047  1302.01   35.574  180.881   2.1735  178.661   2.4427 2.220322 3.269686 
1 1 1   13    2  -39 o  127.681   1.5053  664.643   15.667  680.694   21.418  646.169   22.977  129.198   2.0337  125.871   2.2394 3.326424 3.025067 
1 1 1   13    2  -38 o  110.787   1.3831  500.371   12.490  509.933   18.599  492.517   16.857  111.824   2.0405  109.903   1.8817 1.921799 2.775631 
1 1 1   13    2  -37 o  269.771   1.8698  2967.50   41.118  2889.47   57.739  3047.77   58.568  266.140   2.6615  273.336   2.6286 -7.196106 3.740731 
1 1 1   13    2  -36 o   81.893   1.7697  273.443   11.814  255.530   19.883  283.218   14.688   79.073   3.0906   83.307   2.1647 -4.234482 3.773322 
1 1 1   13    2  -35 o   16.323   4.8569   11.017   6.9396   4.9366   11.255   14.748   8.8147   15.256   6.0599   18.799   5.4418 -3.542647 8.144707 
1 1 1   13    2  -34 o  179.817   1.5882  1318.25   23.279  1313.67   31.264  1323.95   34.875  179.482   2.1369  180.171   2.3746 -0.6894226 3.194558 
1 1 1   13    2  -33 o  122.911   1.4471  615.883   14.498  619.727   19.778  611.417   21.317  123.282   1.9681  122.447   2.1357 0.8342972 2.904196 
1 1 1   13    2  -32 o  158.753   1.5213  1027.46   19.686  989.241   26.111  1077.81   29.967  155.755   2.0566  162.570   2.2614 -6.815155 3.056684 
1 1 1   13    2  -31 o  169.489   1.5744  1171.14   21.752  1167.14   34.212  1173.86   28.182  169.163   2.4810  169.669   2.0376 -0.5059967 3.210525 
1 1 1   13    2  -30 o  138.642   1.6316  783.659   18.440  859.110   36.145  757.112   21.440  145.109   3.0557  136.266   1.9302 8.843353 3.614269 
1 1 1   13    2  -29 o   97.713   1.4962  389.241   11.917  376.856   19.195  397.010   15.202   96.095   2.4524   98.676   1.8900 -2.581459 3.096208 
1 1 1   13    2  -28 o  125.954   1.4804  646.742   15.200  656.877   24.304  640.232   19.479  126.914   2.3492  125.308   1.9070 1.605438 3.025841 
1 1 1   13    2  -27 o  122.072   1.3792  607.471   13.724  582.870   19.646  630.921   19.181  119.561   2.0158  124.395   1.8916 -4.833916 2.764340 
1 1 1   13    2  -26 o  299.555   2.0049  3658.81   48.956  3612.34   68.986  3705.95   69.486  297.583   2.8439  301.416   2.8281 -3.832520 4.010727 
1 1 1   13    2  -25 o  136.166   1.3995  755.844   15.534  770.551   22.722  742.938   21.286  137.469   2.0277  134.986   1.9345 2.483017 2.802443 
1 1 1   13    2  -24 o  113.918   1.3900  529.025   12.908  534.505   18.871  524.207   17.695  114.494   2.0219  113.388   1.9144 1.105934 2.784455 
1 1 1   13    2  -23 o   47.096   1.9447   90.588   7.4498   73.064   10.975  105.564   10.145   42.196   3.2149   50.818   2.4564 -8.622108 4.045889 
1 1 1   13    2  -22 o   38.788   2.2258   61.550   7.0080   62.590   10.740   60.778   9.2479   39.018   3.4112   38.486   2.9709 0.5318031 4.523509 
1 1 1   13    2  -21 o  174.874   1.4916  1246.66   21.262  1260.58   30.741  1233.90   29.439  175.828   2.1449  173.960   2.0760 1.868134 2.985032 
1 1 1   13    2  -20 o  164.518   1.4622  1103.36   19.609  1156.68   28.856  1057.61   26.729  168.428   2.1017  161.056   2.0359 7.372482 2.926156 
1 1 1   13    2  -19 o  384.779   2.4344  6037.58   76.356  6049.58  108.524  6025.81  107.452  385.057   3.4575  384.303   3.4301 0.7540894 4.870319 
1 1 1   13    2  -18 o   85.035   1.4719  294.772   10.203  298.966   15.259  291.382   13.721   85.600   2.1886   84.538   1.9911 1.062042 2.958809 
1 1 1   13    2  -17 o  236.481   1.7246  2279.88   33.244  2226.39   46.971  2333.57   47.058  233.659   2.4661  239.220   2.4132 -5.561172 3.450398 
1 1 1   13    2  -16 o  134.384   1.5050  736.186   16.487  771.477   26.926  715.020   20.853  137.547   2.4015  132.430   1.9317 5.117065 3.081952 
1 1 1   13    2  -15 o   54.700   1.9518  122.144   8.6889  122.399   15.080  122.017   10.631   54.669   3.4009   54.650   2.3922 0.1908875E-01 4.157959 
1 1 1   13    2  -14 o  326.356   2.4618  4343.15   65.492  4390.48  115.149  4320.51   79.625  327.962   4.3073  325.465   3.0013 2.496429 5.249804 
1 1 1   13    2  -13 o  224.132   1.9190  2048.06   35.059  2023.61   61.159  2060.03   42.788  222.722   3.3687  224.770   2.3353 -2.048111 4.099002 
1 1 1   13    2  -12 f  259.827   2.0954  2752.48   44.381  2752.62   77.633  2752.41   54.091  259.740   3.6666  259.801   2.5542 -0.6091309E-01 4.468573 
1 1 1   13    2  -11 o  126.877   1.4684  656.218   15.187  641.269   23.385  667.122   19.972  125.409   2.2875  127.920   1.9154 -2.510696 2.983530 
1 1 1   13    2  -10 o  121.523   1.6148  602.017   15.996  610.297   22.873  594.090   22.379  122.343   2.2936  120.708   2.2744 1.635056 3.230057 
1 1 1   13    2   -9 f  336.438   2.5243  4615.58   69.228  4710.67   99.465  4526.23   96.412  339.802   3.5909  333.087   3.5509 6.715210 5.050123 
1 1 1   13    2   -8 o  366.035   2.5043  5463.30   74.723  5469.32   99.211  5455.40  113.591  366.171   3.3238  365.657   3.8109 0.5138550 5.056791 
1 1 1   13    2   -7 o  175.333   2.1601  1253.38   30.873  1253.38   30.873   0.0000   0.0000  175.333   2.1601  ?   ?  0.000000 2.160110 
1 1 1   13    2   -6 o  360.851   2.4716  5309.54   72.701  5435.36   98.331  5157.83  107.974  365.038   3.3046  355.557   3.7254 9.480042 4.979850 
1 1 1   13    2   -5 o  317.556   2.2402  4111.54   57.989  4126.06   77.309  4092.86   87.684  318.071   2.9818  316.758   3.3959 1.312775 4.519198 
1 1 1   13    2   -4 o  228.138   1.8060  2121.79   33.586  2149.27   45.211  2087.96   50.172  229.589   2.4158  226.278   2.7201 3.311096 3.637980 
1 1 1   13    2   -3 o   82.299   1.7246  276.117   11.570  267.203   14.830  289.978   18.494   80.923   2.2504   84.284   2.6953 -3.361038 3.511252 
1 1 1   13    2   -2 o   44.856   2.2513   82.241   8.2055   70.026   11.552   94.680   11.657   41.288   3.4643   48.090   2.9886 -6.801868 4.575268 
1 1 1   13    2   -1 o  214.000   1.7498  1866.94   30.523  1889.53   41.175  1839.37   45.477  215.273   2.3464  212.385   2.6269 2.887024 3.522216 
1 1 1   13    2    0 o  317.554   2.2431  4111.48   58.063  4109.71   77.209  4113.78   88.088  317.442   2.9838  317.569   3.4029 -0.1270447 4.525755 
1 1 1   13    2    1 o  132.215   1.5249  712.591   16.434  718.136   22.531  706.288   24.024  132.719   2.0827  131.616   2.2392 1.102570 3.058051 
1 1 1   13    2    2 o  253.666   1.9243  2623.28   39.790  2586.02   52.581  2673.21   60.866  251.832   2.5614  256.025   2.9165 -4.192383 3.881585 
1 1 1   13    2    3 o   60.035   2.2237  147.152   10.864  133.803   19.232  153.408   13.165   57.110   4.1596   61.279   2.6418 -4.168304 4.927660 
1 1 1   13    2    4 o  139.093   1.9720  788.745   22.359  801.888   46.300  784.748   25.534  140.125   4.0578  138.734   2.2578 1.390869 4.643638 
1 1 1   13    2    5 o  239.261   1.9967  2333.86   38.943  2340.27   55.589  2327.69   54.573  239.553   2.8468  238.910   2.8022 0.6428070 3.994576 
1 1 1   13    2    6 o  290.957   2.2660  3451.64   53.744  3466.26   76.557  3437.44   75.465  291.516   3.2217  290.304   3.1890 1.212280 4.533121 
1 1 1   13    2    7 o  123.199   1.6290  618.739   16.360  628.957   23.559  609.222   22.735  124.200   2.3270  122.237   2.2817 1.963081 3.259032 
1 1 1   13    2    8 o  144.440   1.8138  850.527   21.355  841.389   27.696  863.928   33.538  143.650   2.3652  145.548   2.8268 -1.898209 3.685825 
1 1 1   13    2    9 f  177.511   1.8992  1284.62   27.481  1277.42   35.815  1294.92   42.851  176.996   2.4824  178.186   2.9502 -1.190613 3.855635 
1 1 1   13    2   10 o  190.648   1.9584  1481.83   30.435  1483.82   39.700  1478.99   47.399  190.756   2.5531  190.425   3.0536 0.3310699 3.980288 
1 1 1   13    2   11 o  384.005   3.0742  6014.51   96.229  6027.29  124.737  5995.72  151.237  384.317   3.9817  383.196   4.8417 1.120880 6.268665 
1 1 1   13    2   12 f  253.009   2.2696  2610.09   46.808  2608.86   60.819  2611.87   73.312  252.914   2.9501  253.020   3.5545 -0.1065216 4.619261 
1 1 1   13    2   13 o  193.230   3.1534  1523.00   49.669  1523.00   49.669   0.0000   0.0000  193.230   3.1534  ?   ?  0.000000 3.153363 
1 1 1   13    2   14 o  484.771   4.8460  9596.54  191.494  9607.00  235.100  9575.91  330.086  484.799   5.9491  483.328   8.3782 1.471680 10.27550 
1 1 1   13    2   15 o  381.595   3.4234  5940.67  106.488  6014.89  152.424  5869.90  148.833  383.779   4.8723  379.134   4.8158 4.644989 6.850686 
1 1 1   13    2   16 o  116.173   2.0272  550.264   19.197  543.213   27.949  556.562   26.413  115.365   2.9746  116.818   2.7737 -1.453346 4.067153 
1 1 1   13    2   17 o  162.217   1.8700  1072.83   24.728  1111.32   32.914  1022.96   37.467  165.084   2.4459  158.368   2.9023 6.716080 3.795507 
1 1 1   13    2   18 o  250.448   2.2652  2557.64   46.244  2585.40   60.446  2518.45   71.810  251.764   2.9454  248.440   3.5459 3.324341 4.609633 
1 1 1   13    2   19 o  191.436   1.7948  1494.10   28.008  1540.41   40.827  1452.93   38.494  194.350   2.5771  188.754   2.5018 5.595825 3.591715 
1 1 1   13    2   20 o   39.304   2.7411   63.312   8.7271   62.446   13.219   63.981   11.619   38.881   4.2394   39.428   3.6569 -0.5467262 5.598710 
1 1 1   13    2   21 o  170.074   1.7220  1179.25   23.872  1187.07   34.365  1171.96   33.187  170.612   2.4710  169.525   2.4016 1.087006 3.445781 
1 1 1   13    2   22 o   85.017   1.7350  294.677   12.024  281.354   17.603  306.329   16.462   83.017   2.6045   86.640   2.3330 -3.622948 3.496620 
1 1 1   13    2   23 o   34.836   3.0501   49.884   8.5738   45.343   13.042   53.341   11.378   32.942   5.0148   35.934   3.9496 -2.992073 6.383379 
1 1 1   13    2   24 o  277.900   2.2100  3149.16   50.062  3172.62   71.602  3126.72   70.022  278.862   3.1499  276.842   3.1029 2.020416 4.421532 
1 1 1   13    2   25 o  218.615   1.9208  1948.63   34.229  1903.01   48.120  1995.35   48.699  215.999   2.7330  221.179   2.7011 -5.180206 3.842565 
1 1 1   13    2   26 o  368.636   2.9800  5543.76   89.547  5490.42  140.566  5580.19  116.171  366.606   4.7038  369.730   3.8546 -3.124817 6.081361 
1 1 1   13    2   27 o   31.528   3.5573   41.083   8.9829   32.093   14.221   47.050   11.587   27.453   6.4628   33.669   4.3214 -6.215572 7.774516 
1 1 1   13    2   28 o  232.739   2.1623  2208.84   41.022  2169.42   64.250  2235.97   53.300  230.565   3.4185  234.124   2.7928 -3.558929 4.414336 
1 1 1   13    2   29 o  135.495   1.7848  748.520   19.713  774.370   31.718  732.251   25.162  137.778   2.8241  133.999   2.3037 3.779617 3.644536 
1 1 1   13    2   30 o  211.848   2.0596  1830.04   35.566  1808.58   56.055  1844.51   46.014  210.526   3.2664  212.650   2.6546 -2.123810 4.209047 
1 1 1   13    2   31 o   30.115   3.7057   37.577   8.9050   39.348   14.850   36.583   11.128   30.460   6.1921   29.548   4.7835 0.9118538 7.824538 
1 1 1   13    2   32 o   73.166   1.9977  218.446   11.903  195.741   19.151  232.738   15.194   69.171   3.4070   75.500   2.4722 -6.328720 4.209445 
1 1 1   13    2   33 o  238.171   2.4663  2313.63   47.883  2337.74   97.757  2306.02   54.922  239.141   5.0149  237.752   2.8339 1.389236 5.760208 
1 1 1   13    2   34 o  261.381   3.0145  2787.58   64.229  2824.76  113.639  2770.12   77.858  262.819   5.3044  260.493   3.6666 2.325470 6.448303 
1 1 1   13    2   35 o  132.447   2.3565  715.461   25.441  669.727   45.152  736.735   30.795  127.967   4.3348  134.382   2.8113 -6.414970 5.166587 
1 1 1   13    2   36 o  137.456   2.3525  770.612   26.359  767.059   47.734  772.170   31.617  136.963   4.2808  137.574   2.8193 -0.6113434 5.125807 
1 1 1   13    2   37 o  294.565   2.5160  3539.32   60.413  3632.92   97.628  3481.25   76.906  298.249   4.0157  292.062   3.2304 6.186401 5.153738 
1 1 1   13    2   38 o  171.853   1.8897  1204.26   26.472  1161.30   41.598  1233.50   34.318  168.699   3.0250  173.901   2.4209 -5.202469 3.874474 
1 1 1   13    2   39 o  104.867   1.7902  448.405   15.303  458.100   24.923  442.538   19.388  105.920   2.8893  104.165   2.2834 1.754509 3.682648 
1 1 1   13    2   40 o  226.374   2.1307  2089.90   39.317  2090.11   62.642  2089.76   50.504  226.280   3.3961  226.322   2.7375 -0.4202271E-01 4.362089 
1 1 1   13    2   41 o  101.429   1.8064  419.492   14.935  400.282   23.924  431.758   19.118   98.998   2.9680  102.888   2.2795 -3.889923 3.742336 
1 1 1   13    2   42 o  123.624   1.7911  623.165   18.049  622.424   29.145  623.626   22.988  123.506   2.8950  123.652   2.2807 -0.1466141 3.685434 
1 1 1   13    2   43 o  184.720   1.9486  1391.45   29.341  1392.94   46.996  1390.50   37.561  184.740   3.1208  184.624   2.4958 0.1157532 3.996018 
1 1 1   13    2   44 o  327.414   2.7259  4373.93   72.752  4567.38  119.093  4258.75   91.891  334.293   4.3704  322.964   3.4905 11.32959 5.593214 
1 1 1   13    2   45 o   49.663   2.5340  100.882   10.224  100.252   16.679  101.261   12.941   49.356   4.1852   49.703   3.2112 -0.3477173 5.275228 
1 1 1   13    2   46 o  102.697   1.8232  430.072   15.263  409.720   24.436  443.089   19.543  100.150   2.9966  104.224   2.3004 -4.074066 3.777774 
1 1 1   13    2   47 o  149.572   1.8456  912.295   22.502  912.276   36.119  912.307   28.766  149.508   2.9637  149.548   2.3598 -0.3987122E-01 3.788420 
1 1 1   13    2   48 o  141.384   1.8335  815.151   21.131  776.797   33.436  840.658   27.267  137.957   2.9732  143.555   2.3301 -5.597763 3.777532 
1 1 1   13    2   49 o  164.876   1.8911  1108.61   25.416  1100.24   40.666  1113.97   32.559  164.177   3.0387  165.244   2.4172 -1.067429 3.882800 
1 1 1   13    2   50 o   30.749   3.9188   39.257   9.5995   61.286   16.500   27.985   11.803   38.306   5.4367   25.628   5.7871 12.67826 7.940279 
1 1 1   13    2   51 f  125.269   2.0890  640.066   21.331  672.687   31.267  611.662   29.175  128.371   2.9880  122.413   2.9238 5.957176 4.180548 
1 1 1   13    2   52 o  273.216   2.4271  3045.67   54.054  3123.86   87.305  2997.06   68.834  276.474   3.8739  270.934   3.1168 5.539612 4.972063 
1 1 1   13    2   53 o   93.632   2.0073  357.590   15.321  326.920   24.755  376.630   19.505   89.399   3.4032   96.041   2.4936 -6.641380 4.218999 
1 1 1   13    2   54 o  144.012   2.1628  846.037   25.389  901.184   51.915  828.702   29.107  148.376   4.2969  142.507   2.5057 5.868286 4.974101 
1 1 1   13    2   55 o  246.240   2.9211  2475.31   58.632  2405.93  100.457  2511.16   72.206  242.364   5.0848  247.916   3.5730 -5.552170 6.214663 
1 1 1   13    2   56 f   69.672   2.8027  198.471   15.885  198.946   28.573  198.259   19.110   69.506   5.0781   69.585   3.3792 -0.7923126E-01 6.099724 
1 1 1   13    2   57 o  104.279   2.1212  443.611   18.031  434.549   26.649  451.262   24.487  103.100   3.1747  105.095   2.8610 -1.995392 4.273644 
1 1 1   13    2   58 o  145.076   2.1341  858.684   25.238  870.015   36.040  847.780   35.354  145.956   3.0292  144.081   3.0102 1.875336 4.270515 
1 1 1   13    2   59 o   91.097   2.2274  338.620   16.540  323.955   23.415  353.226   23.368   88.987   3.2333   92.940   3.0888 -3.953003 4.471587 
1 1 1   13    2   60 o   83.930   2.0291  287.391   13.882  242.595   22.484  314.987   17.647   76.946   3.5947   87.811   2.4679 -10.86529 4.360266 
1 1 1   13    2   61 o  196.497   2.0309  1575.37   32.530  1603.77   52.579  1557.76   41.406  198.093   3.2562  195.328   2.6005 2.764877 4.167147 
1 1 1   13    2   62 o   92.727   1.9374  350.802   14.644  362.410   24.452  344.311   18.286   94.113   3.1920   91.805   2.4457 2.307983 4.021224 
1 1 1   13    2   63 o   58.604   2.4140  140.447   11.507  129.189   19.395  146.563   14.295   55.994   4.2817   59.822   2.9405 -3.827702 5.194213 
1 1 1   13    2   64 o  120.001   1.7651  587.463   17.266  592.039   26.212  583.956   22.947  120.396   2.6709  119.599   2.3537 0.7964172 3.560019 
1 1 1   13    2   65 o  139.829   1.7692  797.679   20.166  777.641   29.849  814.506   27.353  137.977   2.6539  141.241   2.3758 -3.263611 3.561933 
1 1 1   13    2   66 o  216.715   1.9745  1916.67   34.881  2028.69   52.577  1828.62   46.616  222.791   2.8951  211.558   2.7031 11.23315 3.960892 
1 1 1   13    2   67 o   37.963   3.4709   59.475   10.622   84.617   22.326   52.119   12.077   44.837   6.2805   35.395   4.2720 9.442780 7.595728 
1 1 1   13    2   68 o   81.338   2.0027  270.041   13.278  232.687   22.021  291.384   16.645   75.294   3.5982   84.427   2.4211 -9.133255 4.336919 
1 1 1   13    2   69 o   35.904   3.1759   53.152   9.1992   35.188   14.761   64.559   11.763   28.600   6.4819   39.526   3.6936 -10.92618 7.460396 
1 1 1   13    2   70 o   97.404   2.0617  387.353   16.370  406.906   21.937  362.782   24.591   99.734   2.7008   94.095   3.2108 5.639763 4.195648 
1 1 1   13    2   71 o  220.417   2.4949  1985.44   44.827  1966.38   51.518  2044.88   90.961  219.258   2.8825  222.792   5.0086 -3.533981 5.778843 
1 1 1   13    2   72 f   34.218   4.0340   48.725   11.036   41.677   12.141   82.239   26.474   31.446   4.8958   43.735   7.7074 -12.28968 9.130857 
1 1 1   13    2   73 o  135.495   2.5496  750.629   28.159  750.629   28.159   0.0000   0.0000  135.495   2.5496  ?   ?  0.000000 2.549555 
1 1 1   13    2   74 o   82.098   1.8937  275.221   12.673  275.922   19.660  274.722   16.577   82.043   2.9445   81.932   2.4849 0.1111984 3.852919 
1 1 1   13    2   75 o   36.360   2.8608   54.458   8.4107   52.375   15.709   55.295   9.9584   35.111   5.6826   36.564   3.3794 -1.453449 6.611547 
1 1 1   13    2   76 f   60.821   1.8751  151.229   9.2853  169.923   15.494  140.753   11.599   64.332   2.9626   58.612   2.4330 5.720444 3.833560 
1 1 1   13    2   77 o   38.911   2.9996   62.433   9.4409   63.249   15.300   61.932   11.997   38.787   4.9519   38.607   3.8641 0.1799774 6.281146 
1 1 1   13    2   78 o   48.442   2.0174   96.080   7.9487   87.395   12.921  101.368   10.082   45.985   3.4728   49.700   2.4966 -3.715702 4.277065 
1 1 1   13    2   79 f  114.589   1.3895  535.950   12.979  546.853   20.337  528.458   16.859  115.631   2.1576  113.727   1.8186 1.904022 2.821823 
1 1 1   13    2   80 o   82.144   1.4691  275.500   9.8372  292.809   15.970  264.916   12.488   84.544   2.3195   80.503   1.9030 4.040550 3.000212 
1 1 1   13    2   81 o   36.596   2.2501   55.034   6.6799   51.200   11.215   57.142   8.3161   34.978   4.0055   37.218   2.7608 -2.240353 4.864747 
1 1 1   13    2   82 o   50.932   1.7453  106.159   7.2354  105.957   11.846  106.280   9.1378   50.706   2.8779   50.898   2.2077 -0.1924553 3.627139 
1 1 1   13    2   83 o   40.652   1.9920   67.796   6.5811   71.903   11.062   65.545   8.1877   41.643   3.2854   39.890   2.5311 1.752869 4.147275 
1 1 1   13    2   84 o   71.033   1.4458  206.140   8.3714  189.037   13.499  216.829   10.671   67.830   2.4454   72.804   1.7981 -4.974457 3.035324 
1 1 1   13    2   85 o   50.358   1.6777  103.831   6.8771  111.161   11.617   99.877   8.5330   51.910   2.7552   49.320   2.1275 2.590321 3.481018 
1 1 1   13    2   86 o   23.039   3.0155   22.254   5.5274   11.935   9.8841   26.949   6.6675   17.253   5.8737   25.325   3.3088 -8.072065 6.741563 
1 1 1   13    2   87 o   97.167   1.3260  385.784   10.503  399.616   17.039  377.309   13.338   98.699   2.1178   96.014   1.7042 2.685249 2.718353 
1 1 1   13    2   88 o   43.004   1.8618   75.924   6.5109   76.081   11.877   75.856   7.7848   42.679   3.4431   42.917   2.2330 -0.2378502 4.103797 
1 1 1   13    2   89 o   24.078   2.7833   24.242   5.3623   37.379   10.991   20.138   6.1430   29.399   4.7480   21.724   3.5946 7.675547 5.955273 
1 1 1   13    2   90 o   26.851   2.5444   29.984   5.5025   24.823   10.519   31.929   6.4563   23.588   5.5619   27.633   2.9099 -4.044552 6.277110 
1 1 1   13    2   91 o   32.115   2.5615   42.822   6.6501   46.138   9.8506   40.046   9.0142   33.018   3.7249   30.752   3.6683 2.265980 5.227959 
1 1 1   13    2   92 o   46.174   2.0098   87.776   7.5467   79.830   10.534   96.157   10.817   43.769   2.9700   48.120   2.7694 -4.351635 4.060865 
1 1 1   13    2   93 o   29.695   2.1606   36.490   5.1942   34.420   9.4175   37.395   6.2271   28.246   4.2193   29.970   2.5739 -1.723673 4.942438 
1 1 1   13    2   94 o   29.309   2.2910   35.641   5.4300   36.011   11.498   35.535   6.1602   28.508   5.1370   29.187   2.6170 -0.6786556 5.765188 
1 1 1   13    2   95 f   39.735   1.8875   65.053   6.0962   71.980   12.764   63.006   6.9387   41.126   3.8524   39.031   2.1897 2.095387 4.431188 
1 1 1   13    2   96 o   42.934   1.7454   75.835   6.0958   83.072   12.785   73.705   6.9348   44.303   3.5703   42.260   2.0190 2.043728 4.101666 
1 1 1   13    2   97 o   39.089   2.1740   63.240   6.8999   63.203   12.734   63.255   8.2095   38.327   4.1416   38.966   2.5994 -0.6397095 4.889776 
1 1 1   13    2   98 o   12.677   4.2640   6.5646   5.2082   3.5303   11.399   7.3652   5.8551   14.153   5.9144   13.392   4.5211 0.7601862 7.444490 
1 1 1   13    2   99 o   12.483   5.0511   3.7205   7.9716  -4.9445   11.069   13.055   11.489   11.651   5.3043   17.628   6.3097 -5.976692 8.243052 
1 1 1   13    2  100 o   12.539   5.0455   4.0085   7.9047   4.8269   11.504   3.2765   10.880   14.527   5.9949   13.750   5.7644 0.7769785 8.316714 
1 1 1   13    2  101 o   20.994   4.9213   20.099   8.2744   17.424   11.935   22.574   11.481   19.414   6.4536   21.804   6.1788 -2.389826 8.934610 
1 1 1   13    2  102 o   19.028   5.2619   16.771   8.4354   20.117   11.783   13.253   12.081   20.527   6.3748   17.596   6.4459 2.930946 9.065772 
1 1 1   13    2  103 o   38.709   3.3686   64.158   10.523   56.293   13.292   77.368   17.226   35.443   4.7177   41.208   5.2473 -5.765129 7.056251 
1 1 1   13    2  104 o   32.180   3.9591   45.491   10.167   45.358   12.899   45.708   16.518   31.332   5.2351   30.222   6.8621 1.109905 8.631037 
1 1 1   13    2  105 o   12.451   4.9887   4.5559   7.6932   4.3052   10.038   4.9129   11.977   13.410   5.5727   14.383   6.0401 -0.9737902 8.218118 
1 1 1   13    2  106 o   10.489   4.6120  -0.4920   7.6204  -8.8432   9.7064   12.926   12.303   9.7510   4.6129   17.106   6.4584 -7.354940 7.936587 
1 1 1   13    2  107 o   34.429   3.1208   51.037   8.6634   46.552   11.266   57.526   13.552   32.032   4.4335   35.333   4.8317 -3.301186 6.557570 
1 1 1   13    2  108 f   30.132   3.3373   39.631   8.0600   32.550   10.138   51.794   13.287   26.303   4.9089   33.175   5.0745 -6.871832 7.060304 
1 1 1   13    2  109 o   23.147   4.3756   24.817   7.9537   16.636   10.020   38.748   13.076   18.218   5.9057   27.773   5.9548 -9.555031 8.386691 
1 1 1   13    2  110 o   28.073   4.3308   36.287   9.5921   32.441   13.908   39.776   13.247   24.526   6.7465   28.037   5.9787 -3.511324 9.014452 
1 1 1   13    2  111 o   9.5403   4.4996  -7.2319   9.1076  -3.5477   13.189 -10.5895   12.591   12.375   5.6921   10.838   5.1636 1.536901 7.685240 
1 1 1   13    2  112 o   9.5600   4.5004  -6.8449   9.0341 -10.3165   13.106  -3.7020   12.470   11.105   5.2841   12.004   5.5263 -0.8996811 7.646042 
1 1 1   13    2  113 o   24.255   5.1061   28.758   9.7757   13.792   14.114   42.559   13.553   16.973   6.7716   28.821   5.9656 -11.84799 9.024548 
1 1 1   13    2  114 o   14.860   5.6461   9.9664   9.4386   11.272   13.572   8.7435   13.135   16.038   6.5530   15.197   6.3497 0.8408546 9.124734 
1 1 1   13    2  115 o   21.254   5.6426   23.261   9.9381   21.760   14.371   24.637   13.758   19.576   7.0507   20.795   6.9293 -1.218508 9.885746 
1 1 1   13    2  116 o   9.5530   4.5793 -10.2319   10.234 -11.4386   16.444  -9.4691   13.074   12.184   5.8310   11.105   5.2824 1.079291 7.867932 
1 1 1   13    2  117 o   11.276   5.2224  -4.0718   11.384   4.4849   23.430  -6.7163   13.025   16.212   7.5031   11.510   5.4138 4.702758 9.252329 
1 1 1   13    2  118 f   19.365   6.5360   20.989   12.237   30.891   27.689   18.586   13.641   20.689   8.9481   18.258   6.8201 2.430759 11.25084 
1 1 1   13    2  119 o   14.829   6.2703   8.3487   13.050   6.1841   22.968   9.3806   15.859   16.237   7.4840   15.643   6.7689 0.5938263 10.09095 
1 1 1   13    2  120 o   21.905   7.7753   31.217   17.412   12.401   25.139   48.564   24.138   17.339   7.9317   25.089   9.1237 -7.750023 12.08943 
1 1 1   13    2  121 o   24.868   9.2416   49.019   24.986   49.019   24.986   0.0000   0.0000   24.868   9.2416  ?   ?  0.000000 9.241610 
1 1 1   13    2  122 o   21.233   7.1059   27.160   14.466   25.293   17.963   30.603   24.401   19.920   7.7320   20.598   8.6337 -0.6781940 11.58988 
1 1 1   13    3 -120 o   20.379   6.7016   24.141   12.881   4.8220   17.651   46.153   18.841   14.935   6.7590   26.606   8.0230 -11.67039 10.49061 
1 1 1   13    3 -119 o   12.848   5.8866  -0.7019   13.921 -19.9290   17.121   36.810   23.914   11.256   5.5154   21.955   8.7959 -10.69899 10.38204 
1 1 1   13    3 -118 o   12.507   5.6338   0.6435   12.097 -18.4460   17.007   20.190   17.209   11.389   5.5627   18.465   7.4393 -7.076082 9.289030 
1 1 1   13    3 -117 o   10.512   5.0215  -9.7688   12.076 -25.1541   17.215   5.1366   16.944   10.816   5.3442   14.921   6.6989 -4.105340 8.569489 
1 1 1   13    3 -116 o   32.661   5.1743   52.677   13.317   39.405   18.340   67.479   19.369   24.681   7.9889   34.490   7.1250 -9.809978 10.70454 
1 1 1   13    3 -115 o   17.718   6.5679   16.947   12.605  -0.4210   17.317   36.524   18.384   14.090   6.4956   23.738   8.0113 -9.648441 10.31376 
1 1 1   13    3 -114 o   29.782   5.6515   45.024   13.218   48.442   18.844   41.713   18.546   28.030   7.9065   25.674   8.0015 2.356125 11.24888 
1 1 1   13    3 -113 o   17.255   6.5268   15.375   12.579   5.2111   17.805   25.503   17.773   15.366   6.8853   20.455   7.7534 -5.089034 10.36927 
1 1 1   13    3 -112 o   15.366   5.9434   10.781   10.585   13.466   13.458   6.4264   17.140   16.698   6.6286   15.510   6.8640 1.188068 9.542192 
1 1 1   13    3 -111 o   11.143   5.1862  -5.3490   11.437  -2.1216   15.647  -9.0516   16.759   13.475   6.1987   12.738   6.0363 0.7376366 8.652219 
1 1 1   13    3 -110 o   10.460   4.8894  -6.1193   10.347 -10.2923   13.234   0.4429   16.595   11.158   5.3096   14.321   6.5100 -3.163525 8.400688 
1 1 1   13    3 -109 o   15.389   6.2408   9.5250   12.199   0.1156   13.826   42.606   25.924   13.374   6.0237   24.499   9.3457 -11.12562 11.11875 
1 1 1   13    3 -108 o   23.022   6.8048   28.881   13.659   23.361   15.729   45.806   27.542   20.442   7.3745   25.181   9.6262 -4.738956 12.12633 
1 1 1   13    3 -107 o   28.877   6.1755   42.459   14.097   48.004   16.372   26.564   27.719   30.074   6.8341   21.226   9.0625 8.848568 11.35054 
1 1 1   13    3 -106 f   15.645   5.8976   10.722   10.250   0.8579   12.979   27.071   16.710   13.416   5.9535   21.999   7.6317 -8.582973 9.679179 
1 1 1   13    3 -105 o   12.109   5.3057   0.5958   10.005  -1.5095   12.469   4.4011   16.765   12.737   5.7301   15.639   6.8598 -2.902413 8.938155 
1 1 1   13    3 -104 o   51.799   2.8901  114.067   12.155  113.480   15.504  115.002   19.579   50.949   3.7597   50.201   4.8448 0.7484131 6.132473 
1 1 1   13    3 -103 o   28.154   4.7095   36.219   10.427   32.727   13.203   42.006   16.997   25.641   6.3502   28.330   7.3113 -2.688091 9.684002 
1 1 1   13    3 -102 o   16.046   6.4344   9.0958   12.810   9.0958   12.810   0.0000   0.0000   16.046   6.4344  ?   ?  0.000000 6.434444 
1 1 1   13    3 -101 o   17.356   6.1282   13.463   10.804   1.5844   12.722   44.189   20.461   13.890   6.0362   28.629   8.2920 -14.73825 10.25635 
1 1 1   13    3 -100 o   36.719   3.7899   58.361   11.181   53.497   13.337   69.860   20.509   34.502   4.8783   37.897   6.8926 -3.395458 8.444288 
1 1 1   13    3  -99 o   35.897   2.0843   53.473   6.0726   58.104   12.923   52.161   6.8794   36.325   4.4578   35.349   2.4017 0.9754028 5.063633 
1 1 1   13    3  -98 o   44.959   1.8765   83.448   6.8618   68.895   13.891   88.145   7.8918   39.731   4.3607   46.134   2.1041 -6.402752 4.841815 
1 1 1   13    3  -97 o   34.123   2.1984   48.339   6.0825   35.426   13.158   51.848   6.8593   27.584   6.0215   35.285   2.3991 -7.700918 6.481787 
1 1 1   13    3  -96 o   10.286   4.0289   2.9099   4.9128 -15.8976   11.839   6.8223   5.3997   10.085   4.8579   12.900   4.3417 -2.814949 6.515318 
1 1 1   13    3  -95 o   42.943   1.9001   76.036   6.6349   64.134   13.333   79.954   7.6492   38.503   4.3226   43.969   2.1406 -5.465977 4.823570 
1 1 1   13    3  -94 o   10.155   4.4222  -0.6291   6.8584  -7.0981   11.325   3.1170   8.6183   11.386   5.2505   12.652   5.2016 -1.266718 7.390888 
1 1 1   13    3  -93 o   29.701   3.2765   37.325   7.8011   25.538   12.456   44.932   10.007   23.456   6.3573   32.401   3.8648 -8.945518 7.439888 
1 1 1   13    3  -92 o   49.731   1.8597  101.763   7.5254   85.992   14.318  107.783   8.8456   44.957   3.9471   51.108   2.1279 -6.151260 4.484181 
1 1 1   13    3  -91 o   31.307   2.5897   40.813   6.5499   56.322   16.819   38.041   7.1112   35.367   6.0515   30.127   2.9328 5.240068 6.724724 
1 1 1   13    3  -90 o   55.646   1.8476  127.255   8.3691  123.844   18.272  128.160   9.4147   53.986   4.1848   55.784   2.0740 -1.798439 4.670535 
1 1 1   13    3  -89 f   72.763   1.7035  217.031   10.104  199.166   21.114  222.337   11.507   68.843   3.7769   73.566   1.9205 -4.723175 4.237171 
1 1 1   13    3  -88 o   18.337   4.2371   14.700   6.2063   23.622   15.967   13.112   6.7359   22.956   7.4560   17.291   4.6700 5.665100 8.797771 
1 1 1   13    3  -87 o   16.419   4.6880   11.712   6.5846 -30.5567   21.195   16.227   6.9274   13.211   6.3968   19.247   4.4969 -6.035851 7.819266 
1 1 1   13    3  -86 o   33.061   2.7982   45.432   7.4703   60.552   23.406   43.718   7.8826   36.027   8.1601   32.374   3.0219 3.652576 8.701669 
1 1 1   13    3  -85 o   47.992   2.0962   94.681   8.1807   80.562   16.556   99.241   9.4097   43.487   4.7476   49.082   2.3588 -5.595203 5.301300 
1 1 1   13    3  -84 o   19.873   4.2767   17.109   6.7225   31.525   12.725   11.527   7.9176   26.662   6.0003   16.565   5.2373 10.09706 7.964518 
1 1 1   13    3  -83 o   9.7356   4.2622  -1.2643   6.4451  -1.1927   12.460  -1.2905   7.5308   13.706   5.9647   10.564   4.6165 3.142290 7.542558 
1 1 1   13    3  -82 o  104.779   1.6647  448.965   14.218  450.728   21.854  447.671   18.723  104.746   2.5594  104.498   2.1981 0.2478943 3.373754 
1 1 1   13    3  -81 o   54.260   2.0596  120.733   9.0931  128.116   15.416  116.794   11.261   55.605   3.4176   53.269   2.6012 2.335888 4.294878 
1 1 1   13    3  -80 o   27.739   3.2454   32.116   7.1997   36.405   13.158   30.283   8.6016   28.923   5.7832   26.743   4.0744 2.180286 7.074282 
1 1 1   13    3  -79 o  120.370   1.6693  592.096   16.379  595.305   25.003  589.683   21.678  120.486   2.5457  120.004   2.2161 0.4814682 3.375209 
1 1 1   13    3  -78 o   63.692   1.9164  166.016   9.9381  175.615   16.745  160.796   12.348   65.284   3.1559   62.604   2.4243 2.679863 3.979540 
1 1 1   13    3  -77 o   24.656   3.8397   25.643   7.4658   34.299   13.535   21.858   8.9505   28.083   6.0884   22.505   5.0080 5.577524 7.883489 
1 1 1   13    3  -76 o   23.986   4.0864   24.380   7.7038   24.081   14.096   24.507   9.1991   23.633   6.8934   23.890   4.8886 -0.2569942 8.450880 
1 1 1   13    3  -75 o   61.146   2.1987  153.093   10.941  136.045   19.707  160.689   13.155   57.262   4.2524   62.591   2.5838 -5.329159 4.975818 
1 1 1   13    3  -74 o   68.660   2.2038  192.945   12.318  176.931   23.205  199.229   14.535   65.338   4.3822   69.720   2.5620 -4.381920 5.076132 
1 1 1   13    3  -73 o  101.024   1.9422  416.911   15.994  412.787   28.441  418.819   19.343  100.211   3.4870  101.202   2.3447 -0.9911423 4.202002 
1 1 1   13    3  -72 f  107.379   1.8886  470.886   16.531  489.602   29.554  462.364   19.943  109.215   3.3236  106.352   2.3004 2.862663 4.042043 
1 1 1   13    3  -71 o   14.353   5.2132   7.0282   7.8779   10.652   14.516   5.5152   9.3793   18.557   7.0131   14.408   5.5886 4.149358 8.967504 
1 1 1   13    3  -70 o   75.677   1.6939  233.745   10.449  228.958   13.229  241.686   17.037   74.832   2.1710   76.817   2.7252 -1.984970 3.484236 
1 1 1   13    3  -69 o   77.242   1.6973  243.499   10.687  246.819   13.604  238.150   17.269   77.706   2.1498   76.253   2.7829 1.453056 3.516576 
1 1 1   13    3  -68 o   28.895   2.9651   34.516   6.8851   31.129   8.8458   39.720   10.966   27.238   4.1120   30.765   4.5065 -3.527073 6.100585 
1 1 1   13    3  -67 o   9.8029   4.2644  -1.1202   6.3637   5.6227   8.2685 -10.9178   9.9669   13.900   5.2838   10.023   4.7210 3.876886 7.085650 
1 1 1   13    3  -66 o   39.905   2.3007   65.252   7.4519   57.732   9.7409   75.862   11.571   37.423   3.2246   42.922   3.3333 -5.499084 4.637782 
1 1 1   13    3  -65 o   78.873   2.0521  254.120   13.183  271.787   19.247  238.510   18.092   81.480   2.9025   76.321   2.9134 5.159027 4.112522 
1 1 1   13    3  -64 o   45.762   2.7804   85.904   10.323   94.607   15.581   79.095   13.782   47.872   4.0300   43.761   3.9045 4.111053 5.611270 
1 1 1   13    3  -63 o  153.933   1.6944  966.720   21.261  966.610   26.374  966.925   35.930  153.883   2.1026  153.808   2.8658 0.7521057E-01 3.554368 
1 1 1   13    3  -62 o  116.963   1.6457  558.064   15.690  550.782   19.545  571.262   26.313  116.168   2.0640  118.247   2.7299 -2.078796 3.422343 
1 1 1   13    3  -61 o  152.286   1.6988  946.048   21.088  948.124   26.362  942.359   35.142  152.415   2.1219  151.868   2.8388 0.5469971 3.544125 
1 1 1   13    3  -60 o   63.889   1.9357  166.700   10.069  170.267   14.133  163.022   14.350   64.510   2.6935   63.110   2.7964 1.399548 3.882626 
1 1 1   13    3  -59 o   90.280   1.6078  332.434   11.832  327.279   15.794  339.027   17.862   89.551   2.1637   91.098   2.4075 -1.547348 3.236917 
1 1 1   13    3  -58 o  160.754   1.6037  1053.97   21.014  1036.43   27.806  1077.34   32.088  159.367   2.1404  162.454   2.4232 -3.086380 3.233148 
1 1 1   13    3  -57 o  182.915   1.6654  1364.63   24.832  1340.92   32.859  1396.20   37.915  181.268   2.2238  184.934   2.5151 -3.666260 3.357275 
1 1 1   13    3  -56 o  194.186   1.7090  1537.98   27.052  1540.67   36.230  1534.60   40.670  194.301   2.2875  193.885   2.5733 0.4159241 3.443020 
1 1 1   13    3  -55 o   22.245   3.7993   20.799   6.6420   21.067   10.193   20.600   8.7560   22.227   5.6228   21.986   4.9992 0.2416191 7.523817 
1 1 1   13    3  -54 o   20.872   4.5848   18.532   7.5867   20.817   10.487   16.023   10.989   22.114   5.7610   19.805   6.1571 2.309002 8.432029 
1 1 1   13    3  -53 o  142.766   1.7695  831.269   20.593  827.553   24.770  839.586   37.054  142.425   2.1336  143.374   3.1705 -0.9490509 3.821547 
1 1 1   13    3  -52 o  120.536   1.9537  592.615   19.196  595.977   23.675  586.165   32.796  120.854   2.4033  119.741   3.3633 1.112328 4.133724 
1 1 1   13    3  -51 o  157.512   1.9730  1011.96   25.332  990.338   31.697  1050.18   42.145  155.786   2.4961  160.359   3.2242 -4.573074 4.077472 
1 1 1   13    3  -50 f  201.363   2.6901  1654.89   44.156  1654.89   44.156   0.0000   0.0000  201.363   2.6901  ?   ?  0.000000 2.690117 
1 1 1   13    3  -49 o   94.689   1.7458  365.642   13.475  359.945   20.282  370.144   18.029   93.875   2.6531   95.248   2.3221 -1.373505 3.525769 
1 1 1   13    3  -48 o   50.331   2.0585  103.499   8.4277   98.627   12.875  107.152   11.148   49.038   3.2389   51.170   2.6821 -2.131725 4.205225 
1 1 1   13    3  -47 f   97.585   1.6303  388.311   12.968  373.406   21.767  396.513   16.146   95.609   2.7959   98.598   2.0090 -2.989006 3.442836 
1 1 1   13    3  -46 o  138.878   1.4525  786.382   16.444  801.520   24.260  773.518   22.365  140.179   2.1231  137.715   1.9923 2.463989 2.911489 
1 1 1   13    3  -45 o  151.096   1.4588  930.830   17.967  944.020   26.334  919.344   24.575  152.133   2.1235  150.137   2.0080 1.995453 2.922592 
1 1 1   13    3  -44 o  142.140   1.4375  823.727   16.655  832.810   24.465  815.883   22.737  142.893   2.1004  141.440   1.9721 1.453491 2.881119 
1 1 1   13    3  -43 o  212.292   1.6364  1837.64   28.317  1862.84   41.057  1814.77   39.107  213.694   2.3570  210.925   2.2745 2.768600 3.275487 
1 1 1   13    3  -42 o   52.564   1.8315  112.809   7.8354  121.612   12.090  106.435   10.288   54.524   2.7290   51.017   2.4814 3.506828 3.688447 
1 1 1   13    3  -41 o   39.658   2.2612   64.360   7.2795   60.364   11.059   67.415   9.6695   38.280   3.5860   40.537   2.9464 -2.256569 4.641187 
1 1 1   13    3  -40 o  187.706   1.5470  1436.54   23.671  1441.35   34.202  1432.11   32.794  187.983   2.2320  187.385   2.1469 0.5983276 3.096944 
1 1 1   13    3  -39 o  350.772   2.2668  5018.64   64.816  5050.52   92.719  4988.17   90.644  351.746   3.2337  349.577   3.1810 2.169006 4.536025 
1 1 1   13    3  -38 o  174.832   1.5064  1246.20   21.468  1220.74   30.858  1270.09   29.886  173.005   2.1882  176.473   2.0776 -3.467926 3.017344 
1 1 1   13    3  -37 o  227.641   1.6952  2112.93   31.457  2107.67   45.222  2117.87   43.786  227.307   2.4406  227.863   2.3574 -0.5558167 3.393229 
1 1 1   13    3  -36 o   68.133   1.6835  189.277   9.3497  180.176   15.753  194.227   11.617   66.385   2.9181   68.981   2.0684 -2.595665 3.576853 
1 1 1   13    3  -35 o  172.830   1.7295  1217.92   24.365  1204.16   44.698  1223.74   29.062  171.766   3.1924  173.227   2.0582 -1.461258 3.798345 
1 1 1   13    3  -34 o  171.178   1.7184  1194.74   23.977  1270.31   45.324  1165.38   28.255  176.425   3.1516  169.047   2.0504 7.378235 3.759885 
1 1 1   13    3  -33 o  190.737   1.7971  1483.42   27.941  1444.18   50.234  1500.99   33.622  188.103   3.2762  191.846   2.1500 -3.742645 3.918627 
1 1 1   13    3  -32 o   31.600   3.0700   41.133   7.8086   86.310   18.460   31.288   8.6175   45.667   5.0429   27.396   3.9748 18.27141 6.421039 
1 1 1   13    3  -31 o  138.639   1.6449  783.667   18.589  789.653   27.002  778.273   25.630  139.141   2.3807  138.139   2.2762 1.001877 3.293702 
1 1 1   13    3  -30 o  102.000   1.6060  424.180   13.353  390.133   19.858  452.279   18.041   97.766   2.4938  105.312   2.1015 -7.545532 3.261230 
1 1 1   13    3  -29 o   92.504   1.5739  348.867   11.868  338.059   17.373  358.323   16.250   91.012   2.3437   93.737   2.1267 -2.724770 3.164822 
1 1 1   13    3  -28 o  170.584   1.6729  1186.41   23.262  1148.34   32.910  1224.41   32.886  167.794   2.4061  173.267   2.3284 -5.472717 3.348253 
1 1 1   13    3  -27 o   80.462   1.6287  263.954   10.683  249.956   15.713  275.984   14.567   78.244   2.4668   82.236   2.1749 -3.991714 3.288638 
1 1 1   13    3  -26 o  168.950   1.6898  1163.78   23.272  1138.82   40.821  1175.80   28.325  167.067   2.9975  169.807   2.0464 -2.739716 3.629373 
1 1 1   13    3  -25 o   68.473   1.7917  191.297   9.9917  165.041   18.428  202.230   11.891   63.487   3.5753   70.392   2.0747 -6.905064 4.133630 
1 1 1   13    3  -24 f   63.232   1.7420  163.141   8.9701  171.392   15.379  158.886   11.043   64.750   2.9213   62.382   2.1750 2.367828 3.642073 
1 1 1   13    3  -23 o   89.399   1.5427  325.828   11.242  322.412   18.531  327.817   14.141   88.871   2.5606   89.664   1.9348 -0.7933807 3.209405 
1 1 1   13    3  -22 o   69.564   1.6810  197.295   9.5322  216.771   16.430  187.412   11.703   72.844   2.7720   67.760   2.1215 5.084320 3.490653 
1 1 1   13    3  -21 o  149.868   1.4357  915.640   17.539  876.697   25.026  953.228   24.587  146.627   2.0938  152.897   1.9727 -6.270187 2.876789 
1 1 1   13    3  -20 o  142.206   1.4172  824.403   16.428  825.612   23.953  823.329   22.574  142.292   2.0651  142.099   1.9489 0.1931763 2.839496 
1 1 1   13    3  -19 o  160.479   1.4591  1049.90   19.087  1067.01   27.805  1034.65   26.247  161.761   2.1087  159.292   2.0214 2.468735 2.921077 
1 1 1   13    3  -18 o   66.922   1.6237  182.584   8.8575  195.120   13.547  173.222   11.707   69.127   2.4077   65.138   2.2080 3.989059 3.266845 
1 1 1   13    3  -17 o  372.886   2.3776  5670.51   72.267  5730.68  103.579  5613.43  100.878  374.742   3.3908  370.895   3.3366 3.846344 4.757163 
1 1 1   13    3  -16 o   64.276   1.6681  168.549   8.7325  186.706   13.513  155.529   11.443   67.616   2.4557   61.715   2.2786 5.901733 3.349996 
1 1 1   13    3  -15 o  116.239   1.5310  550.827   14.506  548.776   19.668  553.274   21.481  116.010   2.0799  116.480   2.2624 -0.4695511 3.073150 
1 1 1   13    3  -14 o  269.979   2.0104  2972.00   44.243  2970.55   58.851  2973.90   67.094  269.870   2.6752  269.992   3.0486 -0.1221619 4.055938 
1 1 1   13    3  -13 o  128.779   1.5390  676.083   16.156  668.832   21.809  684.901   24.051  128.073   2.0890  129.597   2.2767 -1.523956 3.089860 
1 1 1   13    3  -12 o   96.772   1.6512  381.789   13.025  399.006   18.989  366.492   17.900   98.915   2.3551   94.801   2.3163 4.114944 3.303318 
1 1 1   13    3  -11 o  221.038   1.7906  1991.95   32.263  1961.25   42.646  2033.03   49.337  219.300   2.3856  223.259   2.7110 -3.958466 3.611166 
1 1 1   13    3  -10 o  242.348   1.7531  2394.51   34.633  2396.70   49.529  2392.42   48.445  242.419   2.5064  242.206   2.4537 0.2134094 3.507559 
1 1 1   13    3   -9 o  298.437   2.1416  3631.69   52.098  3488.35   77.789  3748.27   70.155  292.401   3.2637  303.137   2.8391 -10.73660 4.325755 
1 1 1   13    3   -8 o  153.655   1.5391  962.495   19.278  954.557   29.927  968.126   25.204  152.994   2.3996  154.091   2.0066 -1.096664 3.128050 
1 1 1   13    3   -7 o  115.236   1.4966  541.348   14.059  555.507   22.260  531.954   18.133  116.715   2.3397  114.223   1.9475 2.491730 3.044154 
1 1 1   13    3   -6 f  208.172   1.8558  1766.82   31.491  1744.04   44.709  1789.27   44.365  206.789   2.6523  209.456   2.5984 -2.667099 3.713039 
1 1 1   13    3   -5 o  188.808   1.6471  1453.31   25.349  1484.17   39.630  1431.95   32.978  190.767   2.5485  187.397   2.1589 3.369675 3.339991 
1 1 1   13    3   -4 o  157.587   1.4605  1012.36   18.762  1017.48   27.186  1007.71   25.924  157.967   2.1113  157.210   2.0230 0.7574005 2.924039 
1 1 1   13    3   -3 o  316.410   2.0964  4082.16   54.070  4088.92   76.896  4075.54   76.045  316.605   2.9795  316.089   2.9514 0.5157471 4.193828 
1 1 1   13    3   -2 o  287.068   2.0850  3360.11   48.790  3309.95   74.024  3398.64   64.877  284.838   3.1881  288.664   2.7572 -3.825958 4.214992 
1 1 1   13    3   -1 o  160.330   1.5845  1047.95   20.708  991.028   32.049  1088.75   27.132  155.887   2.5222  163.409   2.0369 -7.521927 3.241970 
1 1 1   13    3    0 o  102.644   1.5289  429.506   12.792  413.147   17.502  448.269   18.744  100.660   2.1330  104.850   2.1931 -4.189987 3.059315 
1 1 1   13    3    1 o   82.715   1.7078  278.930   11.515  274.063   17.141  282.932   15.544   81.936   2.5696   83.266   2.2923 -1.329865 3.443520 
1 1 1   13    3    2 o  119.505   1.5316  582.207   14.920  579.178   20.496  585.622   21.760  119.182   2.1097  119.840   2.2275 -0.6582794 3.067981 
1 1 1   13    3    3 o  296.478   2.3154  3584.36   55.958  3570.11   68.724  3612.40   96.394  295.849   2.8497  297.487   3.9751 -1.638153 4.891009 
1 1 1   13    3    4 o  188.025   2.1976  1441.58   33.682  1401.09   48.154  1480.37   47.130  185.318   3.1877  190.498   3.0351 -5.179825 4.401500 
1 1 1   13    3    5 o  222.761   1.9424  2023.21   35.270  2042.12   43.933  1988.94   59.155  223.777   2.4085  220.791   3.2868 2.986130 4.074762 
1 1 1   13    3    6 f  201.236   1.8526  1651.06   30.390  1680.51   38.084  1599.44   50.423  203.005   2.3014  198.005   3.1240 4.999374 3.880235 
1 1 1   13    3    7 o  107.038   1.6930  467.090   14.772  497.620   19.211  422.924   23.106  110.471   2.1333  101.789   2.7873 8.682114 3.510031 
1 1 1   13    3    8 o  145.184   1.6883  859.343   19.980  910.873   30.112  818.813   26.706  149.450   2.4718  141.702   2.3120 7.748093 3.384550 
1 1 1   13    3    9 o  464.646   3.3079  8808.87  125.288  9057.60  181.861  8584.18  172.849  470.892   4.7379  458.445   4.6253 12.44745 6.621272 
1 1 1   13    3   10 o  344.918   3.6628  4855.35  102.984  4996.01  129.214  4610.41  170.509  349.754   4.5322  335.680   6.2314 14.07419 7.705266 
1 1 1   13    3   11 o  211.958   2.0669  1831.85   35.712  1870.27   58.029  1808.44   45.308  214.095   3.3251  210.570   2.6396 3.525391 4.245453 
1 1 1   13    3   12 o  152.276   1.8182  945.401   22.569  888.868   35.017  985.572   29.517  147.615   2.9101  155.461   2.3293 -7.846573 3.727510 
1 1 1   13    3   13 o  173.449   1.7425  1226.55   24.637  1211.94   35.257  1240.49   34.442  172.384   2.5090  174.407   2.4227 -2.022873 3.487778 
1 1 1   13    3   14 o  135.575   1.6576  749.360   18.318  742.248   26.452  755.912   25.393  134.909   2.4054  136.149   2.2880 -1.239975 3.319766 
1 1 1   13    3   15 o   71.416   1.8981  208.099   11.040  208.581   16.390  207.698   14.937   71.452   2.8196   71.315   2.5736 0.1374130 3.817534 
1 1 1   13    3   16 o  179.351   1.9299  1311.55   28.215  1322.19   45.816  1305.05   35.812  180.019   3.1222  178.884   2.4559 1.135086 3.972388 
1 1 1   13    3   17 o  379.997   2.7951  5890.19   86.580  5794.04  121.358  5989.87  123.557  376.724   3.9519  383.037   3.9572 -6.312653 5.592618 
1 1 1   13    3   18 o  175.538   1.9395  1256.39   27.752  1285.96   36.787  1217.34   42.279  177.565   2.5416  172.739   3.0026 4.826569 3.933851 
1 1 1   13    3   19 o  211.452   2.3028  1823.41   39.693  1840.10   56.656  1807.31   55.626  212.355   3.2730  210.457   3.2425 1.898163 4.607241 
1 1 1   13    3   20 o  159.447   2.0825  1036.68   27.067  1013.66   38.217  1059.86   38.340  157.626   2.9744  161.181   2.9181 -3.555023 4.166786 
1 1 1   13    3   21 o  317.040   2.9683  4100.75   76.711  4107.01  108.761  4094.56  108.213  317.123   4.2074  316.644   4.1925 0.4788513 5.939607 
1 1 1   13    3   22 o  157.849   2.0739  1016.02   26.685  1027.66   38.021  1004.72   37.462  158.712   2.9388  156.930   2.9285 1.781464 4.148829 
1 1 1   13    3   23 o   14.292   5.3790   6.0718   8.5194   7.3152   14.516   5.4184   10.522   17.620   6.9183   15.057   5.8967 2.562993 9.090329 
1 1 1   13    3   24 f  122.814   1.7728  614.976   17.748  594.985   28.142  628.179   22.870  120.766   2.8587  124.111   2.2606 -3.344955 3.644518 
1 1 1   13    3   25 o  173.533   1.8881  1227.86   26.708  1196.84   42.253  1248.51   34.466  171.270   3.0265  174.962   2.4167 -3.691986 3.872984 
1 1 1   13    3   26 o  261.453   2.3196  2787.86   49.437  2753.64   77.899  2810.93   63.969  259.716   3.6796  262.477   2.9898 -2.760193 4.741131 
1 1 1   13    3   27 o  102.340   2.0083  427.080   16.754  403.874   35.039  433.958   19.076   99.338   4.3376  103.154   2.2687 -3.816269 4.895030 
1 1 1   13    3   28 o  103.968   2.0113  440.779   17.045  432.976   36.426  442.966   19.287  102.857   4.3544  104.218   2.2703 -1.360985 4.910687 
1 1 1   13    3   29 o  157.216   2.4013  1008.12   30.774  1020.80   55.421  1002.47   37.003  158.017   4.3067  156.749   2.8960 1.268051 5.189817 
1 1 1   13    3   30 o  130.235   2.3233  691.765   24.664  712.630   44.570  682.555   29.612  132.020   4.1468  129.344   2.8086 2.675766 5.008348 
1 1 1   13    3   31 o   46.221   2.9979   87.538   11.234   88.884   16.423   86.354   15.401   46.436   4.3909   45.790   4.1720 0.6459694 6.056889 
1 1 1   13    3   32 o  167.814   2.0981  1148.45   28.701  1110.57   40.344  1187.26   40.837  164.973   3.0001  170.578   2.9370 -5.605042 4.198366 
1 1 1   13    3   33 o  163.791   1.8610  1093.93   24.847  1089.99   39.898  1096.43   31.756  163.436   2.9948  163.954   2.3761 -0.5182800 3.822920 
1 1 1   13    3   34 o  112.445   1.7828  515.552   16.341  525.663   26.635  509.450   20.693  113.466   2.8821  111.763   2.2713 1.703979 3.669525 
1 1 1   13    3   35 o  142.930   1.7991  832.998   20.961  841.994   33.783  827.367   26.728  143.650   2.8851  142.426   2.3022 1.223709 3.691086 
1 1 1   13    3   36 o  122.961   1.7788  616.497   17.829  627.586   29.007  609.765   22.602  124.018   2.8694  122.271   2.2677 1.747055 3.657282 
1 1 1   13    3   37 o   45.574   2.6096   85.011   9.6541  103.060   16.170   75.013   12.034   50.070   3.9949   42.723   3.4859 7.347801 5.301940 
1 1 1   13    3   38 o  152.138   1.8381  943.830   22.795  929.128   36.409  953.308   29.234  150.889   2.9602  152.876   2.3459 -1.986893 3.777006 
1 1 1   13    3   39 o   81.818   1.9336  272.989   12.896  255.014   20.965  283.929   16.356   78.971   3.2639   83.394   2.4086 -4.422859 4.056348 
1 1 1   13    3   40 o  315.007   2.6480  4048.60   67.996  4143.54  109.870  3989.67   86.564  318.418   4.2330  312.600   3.3971 5.818420 5.427588 
1 1 1   13    3   41 o  159.125   1.8673  1032.56   24.221  1006.36   38.474  1049.77   31.174  157.026   3.0058  160.419   2.3840 -3.392563 3.836464 
1 1 1   13    3   42 o  146.632   1.8382  876.779   21.971  842.510   35.033  898.998   28.208  143.675   2.9913  148.454   2.3310 -4.779221 3.792298 
1 1 1   13    3   43 o  105.464   1.8210  453.568   15.655  456.461   25.749  451.872   19.718  105.710   2.9912  105.250   2.2983 0.4599457 3.772219 
1 1 1   13    3   44 o  118.290   1.8107  570.605   17.459  551.536   28.361  582.241   22.155  116.204   2.9966  119.471   2.2750 -3.267563 3.762330 
1 1 1   13    3   45 o  124.780   1.8243  634.946   18.556  626.508   30.112  640.111   23.561  123.890   2.9817  125.265   2.3074 -1.375359 3.770216 
1 1 1   13    3   46 o   83.606   1.9871  285.090   13.542  264.987   22.451  296.588   16.979   80.478   3.4302   85.226   2.4466 -4.747978 4.213315 
1 1 1   13    3   47 f   79.681   2.0495  259.138   13.301  280.153   22.501  247.851   16.491   82.758   3.3424   77.891   2.6009 4.866669 4.235141 
1 1 1   13    3   48 o  144.391   1.8916  850.297   22.265  819.768   35.792  869.565   28.436  141.696   3.0988  145.989   2.3895 -4.292648 3.913105 
1 1 1   13    3   49 o   55.013   2.8518  123.872   12.745  119.579   26.498  125.164   14.537   53.624   6.1745   55.266   3.2410 -1.641857 6.973471 
1 1 1   13    3   50 f  154.527   2.4559  974.356   30.935  898.007   53.223  1013.31   38.016  148.093   4.4138  157.544   2.9602 -9.451050 5.314601 
1 1 1   13    3   51 o  137.282   2.4038  768.987   26.900  806.846   48.826  752.489   32.233  140.388   4.2716  135.766   2.9125 4.621719 5.170081 
1 1 1   13    3   52 o   95.406   2.1950  371.342   17.071  337.050   25.444  399.414   23.020   90.765   3.4452   98.872   2.8593 -8.106918 4.477193 
1 1 1   13    3   53 o  213.886   2.1232  1866.31   37.019  1912.92   60.002  1837.66   47.038  216.380   3.4018  212.174   2.7197 4.206268 4.355329 
1 1 1   13    3   54 o  221.370   2.1474  1999.33   38.750  2029.53   62.387  1980.36   49.443  222.859   3.4342  220.245   2.7540 2.614334 4.402100 
1 1 1   13    3   55 o   84.805   2.0004  293.395   13.829  312.600   23.061  282.610   17.281   87.411   3.2421   83.169   2.5520 4.242447 4.125984 
1 1 1   13    3   56 o  135.636   2.1286  750.644   23.535  747.383   33.440  753.844   33.128  135.264   3.0329  135.851   2.9915 -0.5875092 4.260002 
1 1 1   13    3   57 o   53.462   2.4950  116.932   10.843   97.762   18.540  126.898   13.368   48.609   4.7391   55.658   2.9570 -7.049160 5.585992 
1 1 1   13    3   58 o   51.763   2.5471  109.659   10.714   97.095   18.391  116.114   13.183   48.438   4.7174   53.222   3.0515 -4.783222 5.618295 
1 1 1   13    3   59 o  131.373   1.8401  704.094   19.705  704.151   32.345  704.060   24.849  131.273   3.0228  131.333   2.3211 -0.6037903E-01 3.811121 
1 1 1   13    3   60 o  126.020   1.8513  647.919   19.017  616.562   30.988  666.863   24.087  122.783   3.0986  127.813   2.3119 -5.029991 3.866047 
1 1 1   13    3   61 o  241.071   2.2407  2372.27   44.031  2405.85   71.077  2351.36   56.089  242.477   3.5960  239.888   2.8684 2.588715 4.599888 
1 1 1   13    3   62 o  106.527   1.7695  462.983   15.365  460.389   23.773  464.844   20.136  106.116   2.7507  106.702   2.3151 -0.5858536 3.595269 
1 1 1   13    3   63 o   84.659   1.8663  292.467   12.880  291.241   20.448  293.273   16.582   84.351   2.9785   84.709   2.4039 -0.3571472 3.827608 
1 1 1   13    3   64 o  115.575   1.7410  545.021   16.403  532.488   25.099  554.364   21.670  114.151   2.6974  116.516   2.2816 -2.364830 3.532917 
1 1 1   13    3   65 o   52.455   2.3762  112.611   10.134   96.648   16.955  121.482   12.640   48.333   4.3500   54.437   2.8585 -6.103905 5.205116 
1 1 1   13    3   66 o   95.745   1.9661  374.197   15.345  384.823   22.024  364.173   21.392   96.981   2.7889   94.342   2.7847 2.639580 3.941113 
1 1 1   13    3   67 o   31.045   3.8579   40.119   9.5530   26.708   14.817   49.659   12.497   24.989   6.9977   34.466   4.5599 -9.477785 8.352277 
1 1 1   13    3   68 o   16.884   6.9762   3.6412   15.606   5.8910   20.481   0.5267   24.098   19.547   8.0256   19.781   8.4479 -0.2336731 11.65239 
1 1 1   13    3   69 o  102.153   2.3348  426.391   19.442  450.520   30.480  409.841   25.244  104.767   3.5743  100.008   3.1003 4.759018 4.731554 
1 1 1   13    3   70 o  146.227   2.2704  873.708   27.062  846.179   39.821  897.336   36.891  143.679   3.4000  148.039   3.0571 -4.359879 4.572296 
1 1 1   13    3   71 o   67.354   2.5221  185.773   13.823  182.279   18.572  190.112   20.698   66.583   3.4334   67.946   3.7515 -1.362625 5.085492 
1 1 1   13    3   72 f   35.956   2.9513   53.300   8.5741   51.845   13.054   54.404   11.371   35.155   4.6706   36.174   3.9188 -1.018635 6.096832 
1 1 1   13    3   73 o   27.497   4.6519   32.044   10.055   42.550   13.597   19.363   14.938   31.597   5.4776   21.876   7.2179 9.720860 9.061023 
1 1 1   13    3   74 o   56.027   2.2297  128.552   10.163  131.838   15.033  125.786   13.792   56.585   3.2731   55.300   3.0716 1.284325 4.488666 
1 1 1   13    3   75 o   71.676   1.8114  210.003   10.575  211.153   15.426  208.982   14.524   71.755   2.6419   71.407   2.4991 0.3470383 3.636620 
1 1 1   13    3   76 o   48.558   1.9636   96.533   7.7562   95.367   12.896   97.194   9.7086   48.064   3.3117   48.662   2.4555 -0.5983124 4.122688 
1 1 1   13    3   77 o   33.144   2.5125   45.254   6.7375   46.433   11.545   44.645   8.2969   33.228   4.3682   32.820   3.1394 0.4072113 5.379366 
1 1 1   13    3   78 o   81.006   1.4928  267.970   9.8574  275.207   15.780  263.339   12.623   81.939   2.3651   80.251   1.9297 1.688194 3.052411 
1 1 1   13    3   79 o   41.042   2.1193   69.127   7.0663   67.170   13.453   69.872   8.3042   40.059   4.1812   41.211   2.4835 -1.151623 4.863159 
1 1 1   13    3   80 o   26.813   2.7172   29.820   5.8570   28.888   10.778   30.210   6.9773   25.812   5.3000   26.891   3.2488 -1.079704 6.216456 
1 1 1   13    3   81 o   7.9282   3.6224  -3.4177   5.2230 -11.3084   10.030  -0.4818   6.1181   9.9086   4.6879   9.7796   4.2178 0.1290684 6.306079 
1 1 1   13    3   82 o   36.372   2.0897   54.380   6.1696   59.119   11.075   52.248   7.4291   37.613   3.6582   35.570   2.5798 2.043678 4.476341 
1 1 1   13    3   83 o   47.122   1.7528   90.988   6.7210  104.802   11.848   84.434   8.1611   50.353   2.8989   45.317   2.2160 5.035488 3.648873 
1 1 1   13    3   84 o   12.603   4.3045   6.1597   5.3091   8.2068   11.057   5.5463   6.0524   16.021   6.1054   12.571   4.5690 3.449994 7.625731 
1 1 1   13    3   85 o   63.205   1.5508  163.418   7.9898  170.114   14.946  160.739   9.4541   64.143   2.8657   62.609   1.8545 1.534130 3.413445 
1 1 1   13    3   86 o   53.334   1.9739  116.836   8.5667  101.416   13.467  127.318   11.103   49.315   3.3702   55.563   2.4575 -6.247559 4.171052 
1 1 1   13    3   87 o   48.228   2.0635   95.679   8.0933  100.579   11.707   91.194   11.201   49.222   2.9311   46.857   2.9475 2.365620 4.156800 
1 1 1   13    3   88 o   11.450   4.1069   4.7538   4.8703   17.671   10.741   1.4111   5.4642   19.990   6.0642   10.001   4.1298 9.988874 7.336881 
1 1 1   13    3   89 f   24.175   2.6083   24.409   5.0588   23.174   10.121   24.820   5.8408   22.742   5.5168   24.284   3.0154 -1.541996 6.287097 
1 1 1   13    3   90 o   95.407   1.3534  372.439   10.525  379.297   16.815  368.020   13.497   96.000   2.1487   94.717   1.7481 1.282318 2.770002 
1 1 1   13    3   91 o   47.569   1.5847   92.846   6.1363  102.453   11.512   89.033   7.2523   49.606   2.8592   46.508   1.9171 3.097546 3.442413 
1 1 1   13    3   92 o   46.547   1.8311   89.140   6.9341   89.948   11.238   88.643   8.8114   46.400   2.9872   46.279   2.3434 0.1212196 3.796656 
1 1 1   13    3   93 o   47.907   2.3595   95.061   9.1859   83.744   11.173  118.667   16.137   44.702   3.0852   52.910   3.7661 -8.208019 4.868454 
1 1 1   13    3   94 o   43.702   2.5102   79.364   8.9047   74.844   10.934   88.263   15.344   42.181   3.2041   45.340   4.1993 -3.159115 5.282032 
1 1 1   13    3   95 o   11.041   4.7126   0.6423   7.4912  -6.7985   9.3673   13.845   12.477   10.197   4.7278   18.239   6.5697 -8.042633 8.093976 
1 1 1   13    3   96 o   16.261   5.0041   11.672   7.2803   9.0398   9.5579   15.309   11.236   15.437   5.7198   18.595   6.2631 -3.158126 8.481839 
1 1 1   13    3   97 o   29.799   3.2994   37.783   7.8803   27.792   10.169   52.803   12.468   24.734   5.2085   34.709   4.5137 -9.974716 6.892118 
1 1 1   13    3   98 o   40.919   2.8006   70.253   9.2852   68.748   10.817   74.466   18.099   40.242   3.3273   40.470   5.6395 -0.2282829 6.547838 
1 1 1   13    3   99 o   24.104   4.5149   25.992   8.5452   27.478   9.9849   21.925   16.519   24.493   5.1641   21.430   7.5767 3.062607 9.169195 
1 1 1   13    3  100 o   19.576   5.1519   17.750   8.3310   21.222   9.7733   8.5194   15.934   21.245   5.5746   16.989   7.0372 4.256710 8.977647 
1 1 1   13    3  101 o   17.808   5.1981   14.704   8.0127   15.522   11.119   13.821   11.557   18.301   6.2299   17.619   6.3256 0.6820030 8.878367 
1 1 1   13    3  102 o   28.236   3.6185   34.754   8.1374   33.920   10.964   35.776   12.142   27.033   5.1639   27.491   5.6083 -0.4585972 7.623571 
1 1 1   13    3  103 o   19.447   5.0903   17.837   8.1617   13.990   10.841   22.869   12.401   17.401   6.1391   21.345   6.5239 -3.944191 8.958236 
1 1 1   13    3  104 o   11.584   4.8156   2.7951   7.4994  -6.6458   9.4959   18.444   12.226   10.060   4.6964   19.295   6.5329 -9.235691 8.045846 
1 1 1   13    3  105 o   45.533   2.6233   87.738   9.6956   75.448   12.870  103.867   14.744   41.333   3.8646   48.649   3.7467 -7.315502 5.382652 
1 1 1   13    3  106 f   36.683   3.1151   58.120   9.2267   44.342   12.337   75.609   13.900   30.596   5.1278   40.950   4.2246 -10.35396 6.643943 
1 1 1   13    3  107 o   18.715   5.3587   17.260   8.5915   23.699   11.449   8.9589   12.998   21.374   6.2062   15.525   6.3859 5.849639 8.904841 
1 1 1   13    3  108 o   17.386   5.5473   14.976   8.8655   15.935   11.996   13.821   13.160   17.770   6.4362   17.064   6.6195 0.7066021 9.232692 
1 1 1   13    3  109 o   22.470   5.3117   24.953   9.5746   21.508   13.694   28.247   13.392   19.844   6.9074   22.731   6.7429 -2.886629 9.652931 
1 1 1   13    3  110 o   18.250   5.7383   16.958   9.5169   37.394   13.711  -2.0435   13.221   26.586   6.4033   12.650   5.7734 13.93581 8.621757 
1 1 1   13    3  111 o   22.454   5.6948   25.796   10.437   29.274   16.599   23.522   13.423   22.110   7.6092   20.531   6.8444 1.578341 10.23459 
1 1 1   13    3  112 o   12.643   5.4393   3.3049   10.126   20.479   15.974  -8.2300   13.092   19.062   7.3200   11.355   5.3673 7.706771 9.076866 
1 1 1   13    3  113 o   18.594   6.0563   18.301   10.531   21.725   16.979   16.161   13.426   19.352   7.5157   17.565   6.7194 1.787220 10.08149 
1 1 1   13    3  114 o   18.732   6.0384   18.688   10.485   7.9218   16.211   26.430   13.748   15.532   6.7807   21.432   6.9148 -5.899878 9.684657 
1 1 1   13    3  115 o   11.828   5.3906  -1.6429   11.473  -6.6030   16.872   2.6229   15.647   12.964   6.1174   14.193   6.3989 -1.228448 8.852603 
1 1 1   13    3  116 o   10.157   4.8612 -10.1619   11.433  -3.5025   16.886 -15.7985   15.535   13.413   6.2621   11.198   5.4350 2.214294 8.291744 
1 1 1   13    3  117 o   26.996   5.8176   38.089   12.424   30.079   17.780   45.733   17.368   21.513   7.8293   27.423   7.5374 -5.910286 10.86792 
1 1 1   13    3  118 o   11.339   5.4107  -9.5665   13.943 -16.6192   17.213   3.8947   23.780   11.666   5.6754   15.935   7.4368 -4.268558 9.355019 
1 1 1   13    3  119 o   9.7273   4.7822 -19.2502   13.212 -28.3981   16.161  -0.8158   22.942   10.073   5.0117   15.130   7.1377 -5.056926 8.721522 
1 1 1   13    3  120 o   14.816   6.4011   7.7392   14.139   0.3886   17.476   21.670   24.059   14.104   6.5105   18.756   8.2225 -4.652160 10.48795 
1 1 1   13    4 -118 o   13.153   6.2104  -5.4213   17.440  -5.4213   17.440   0.0000   0.0000   13.153   6.2104  ?   ?  0.000000 6.210434 
1 1 1   13    4 -117 o   13.307   5.8472   3.8900   12.231   29.896   17.220 -22.5917   17.377   21.370   7.7152   11.062   5.4473 10.30815 9.444384 
1 1 1   13    4 -116 o   17.425   6.5019   16.712   12.392   30.569   17.755   3.5519   17.303   21.504   7.8241   14.604   6.6420 6.900335 10.26316 
1 1 1   13    4 -115 o   15.812   6.3488   12.012   12.488   25.931   18.282  -0.1619   17.098   20.071   7.7977   13.947   6.4388 6.123788 10.11245 
1 1 1   13    4 -114 o   10.293   4.9570 -11.9868   12.314 -33.6562   17.347   10.023   17.483   10.143   5.0693   16.069   7.0278 -5.925811 8.665308 
1 1 1   13    4 -113 o   17.942   6.6160   17.654   12.761   15.991   18.170   19.271   17.925   17.579   7.4142   18.401   7.5261 -0.8213329 10.56471 
1 1 1   13    4 -112 o   13.652   5.9679   4.1070   12.595   11.375   18.214  -2.5522   17.435   16.607   7.2196   13.793   6.4139 2.814497 9.657174 
1 1 1   13    4 -111 o   12.935   5.7742   1.3373   12.396  -7.3652   17.620   9.8663   17.444   13.161   6.2226   16.223   7.0588 -3.062943 9.410002 
1 1 1   13    4 -110 o   12.960   5.9318  -1.5154   14.085   33.299   23.759 -20.3803   17.489   21.896   8.7689   11.521   5.6302 10.37540 10.42081 
1 1 1   13    4 -109 o   43.593   3.9469   86.092   13.873   76.241   19.957   95.304   19.299   37.697   6.7423   43.909   5.5132 -6.212265 8.709416 
1 1 1   13    4 -108 o   23.274   6.4400   29.150   12.631   17.682   18.037   40.185   17.694   18.449   7.5483   25.909   7.7666 -7.459309 10.83036 
1 1 1   13    4 -107 o   14.533   5.8371   8.2480   10.559   6.4045   13.486   11.169   16.975   14.757   6.3114   16.746   7.1189 -1.989028 9.513829 
1 1 1   13    4 -106 o   15.540   6.0316   10.634   10.930   10.026   13.972   11.593   17.547   15.940   6.5951   17.014   7.2355 -1.073135 9.790237 
1 1 1   13    4 -105 o   19.433   6.3658   19.711   11.627   1.2963   15.434   43.872   17.680   14.260   6.3984   27.739   7.5969 -13.47935 9.932375 
1 1 1   13    4 -104 o   13.575   5.9835   1.8127   12.898   9.8745   15.000 -21.0573   25.265   16.319   6.7995   14.318   6.9448 2.001119 9.719230 
1 1 1   13    4 -103 o   12.864   5.6098   1.6325   11.070  -9.8465   14.566   17.326   17.032   12.046   5.6842   18.928   7.4749 -6.881928 9.390626 
1 1 1   13    4 -102 o   9.9944   4.7112  -8.2578   9.9597  -3.4824   12.600 -16.2104   16.260   12.391   5.6480   11.937   5.7353 0.4537354 8.049393 
1 1 1   13    4 -101 o   26.581   5.6940   34.038   11.966   24.902   13.387   70.353   26.690   22.037   6.7863   34.391   9.2992 -12.35371 11.51217 
1 1 1   13    4 -100 o   30.496   4.9076   42.639   11.786   45.773   13.184   30.172   26.298   31.296   5.3606   23.337   9.2653 7.959385 10.70432 
1 1 1   13    4  -99 o   20.214   6.2128   19.801   11.226   31.689   12.669 -23.6577   24.223   25.530   6.1593   14.327   6.9130 11.20283 9.258801 
1 1 1   13    4  -98 o   9.1621   4.0329  -0.9321   5.8417  -3.1830   11.871  -0.2129   6.7104   12.334   5.5661   10.073   4.3806 2.260542 7.083117 
1 1 1   13    4  -97 o   13.992   4.5386   8.4673   5.9178   10.189   12.637   7.9838   6.6975   16.594   6.4727   13.891   4.8309 2.703054 8.076696 
1 1 1   13    4  -96 o   35.668   2.4755   53.153   7.1528   72.360   13.866   46.188   8.3495   40.749   4.2362   32.988   3.1430 7.761166 5.274786 
1 1 1   13    4  -95 o   83.985   1.8736  290.631   12.827  288.343   18.674  292.675   17.648   83.084   2.7612   83.832   2.5856 -0.7474060 3.782823 
1 1 1   13    4  -94 o   38.677   2.5177   62.362   7.8945   70.007   13.701   58.562   9.6592   40.197   4.2455   37.213   3.2158 2.983494 5.325909 
1 1 1   13    4  -93 o   34.474   2.7093   49.721   7.5524   45.794   13.025   51.710   9.2701   32.028   5.1644   34.951   3.2925 -2.923252 6.124717 
1 1 1   13    4  -92 o   22.728   3.9147   22.461   6.9908   35.595   12.551   16.554   8.4174   27.946   5.7031   19.132   5.2428 8.813234 7.746728 
1 1 1   13    4  -91 o   20.399   4.0069   18.210   6.4249   26.359   12.174   15.064   7.5640   23.827   6.2070   18.331   4.9479 5.496572 7.937765 
1 1 1   13    4  -90 o   15.792   4.6151   10.947   6.3129   12.634   11.733   10.259   7.4894   17.664   6.3695   15.551   5.1099 2.112720 8.165880 
1 1 1   13    4  -89 o   36.818   2.4574   56.271   7.3328   67.464   13.277   51.359   8.7959   39.692   4.1657   34.971   3.1182 4.720753 5.203527 
1 1 1   13    4  -88 o   22.197   3.8031   21.252   6.6337   31.103   12.474   17.367   7.8334   26.141   5.9833   19.748   4.8918 6.392847 7.728494 
1 1 1   13    4  -87 o   25.051   3.9935   27.016   7.8813   47.862   16.219   20.573   9.0175   32.471   6.3554   21.459   5.2084 11.01203 8.216928 
1 1 1   13    4  -86 o   54.127   2.2663  120.825   9.9773  121.431   18.731  120.585   11.789   53.442   4.3369   53.944   2.6895 -0.5019646 5.103153 
1 1 1   13    4  -85 o   50.576   2.3473  105.546   9.6506   93.242   17.969  110.533   11.441   46.625   4.7964   51.650   2.7270 -5.025269 5.517389 
1 1 1   13    4  -84 o   76.576   1.9423  240.735   12.114  266.082   22.613  230.531   14.347   79.880   3.4812   74.807   2.3557 5.073105 4.203331 
1 1 1   13    4  -83 o   39.498   2.7554   64.678   8.8156   70.781   18.123   62.786   10.090   40.290   5.6753   38.793   3.2197 1.496811 6.524969 
1 1 1   13    4  -82 o   39.035   2.9370   63.263   9.2770   29.890   22.130   70.378   10.218   25.931   8.7893   41.150   3.0684 -15.21838 9.309513 
1 1 1   13    4  -81 o   84.574   1.8730  292.975   12.912  268.930   22.188  305.289   15.878   80.512   3.3884   86.207   2.2615 -5.695442 4.073746 
1 1 1   13    4  -80 o   13.738   5.0261   6.5686   7.3414   16.241   14.362   3.1474   8.5417   20.176   7.0704   12.844   5.2171 7.331694 8.786825 
1 1 1   13    4  -79 o   49.063   2.2597   98.929   9.0131  105.800   14.917   94.979   11.311   50.413   3.6548   47.941   2.9082 2.472591 4.670630 
1 1 1   13    4  -78 o   56.542   2.1990  131.204   10.116  115.316   17.679  138.938   12.334   52.526   4.1630   58.106   2.6108 -5.579933 4.913968 
1 1 1   13    4  -77 o   76.906   1.8442  241.916   11.561  227.608   18.105  251.769   15.023   74.323   2.9944   78.334   2.3554 -4.010765 3.809824 
1 1 1   13    4  -76 o   20.769   4.6538   18.631   7.6830   26.674   13.113   14.427   9.4807   24.641   6.4532   18.504   5.7134 6.137463 8.618964 
1 1 1   13    4  -75 o   28.536   3.5748   34.071   8.1333   26.493   13.512   38.377   10.185   24.594   6.6021   30.160   4.2615 -5.565371 7.857978 
1 1 1   13    4  -74 o   24.839   4.1474   26.160   8.1016   19.707   13.903   29.478   9.9691   21.714   6.9489   26.247   4.8376 -4.533329 8.466969 
1 1 1   13    4  -73 o   56.203   2.1739  129.404   9.9406  126.841   16.181  130.957   12.598   55.397   3.6029   56.455   2.7458 -1.058239 4.529953 
1 1 1   13    4  -72 o   31.500   3.7291   41.398   9.3897   44.737   14.846   39.172   12.122   32.269   5.8598   30.333   5.0823 1.935772 7.756764 
1 1 1   13    4  -71 o   77.751   1.9907  247.205   12.606  245.428   19.850  248.406   16.320   77.277   3.1579   77.853   2.5752 -0.5760269 4.074758 
1 1 1   13    4  -70 o   66.869   2.3559  183.106   12.822  261.346   25.265  155.965   14.880   79.603   3.9056   61.619   2.9713 17.98383 4.907334 
1 1 1   13    4  -69 o   49.405   2.2936  100.002   9.2115  105.597   12.764   93.920   13.307   50.664   3.1055   47.717   3.4444 2.947277 4.637675 
1 1 1   13    4  -68 o   40.420   2.6561   67.131   8.7031   63.243   12.021   71.413   12.617   39.054   3.8250   41.531   3.7678 -2.477993 5.369074 
1 1 1   13    4  -67 f  185.574   2.0045  1406.49   30.321  1416.17   38.632  1390.95   48.934  186.094   2.5467  184.234   3.2584 1.859512 4.135535 
1 1 1   13    4  -66 o   23.325   4.6996   23.197   8.6264   22.997   10.034   23.763   16.890   23.135   5.4166   23.994   7.6570 -0.8591919 9.379139 
1 1 1   13    4  -65 o   37.557   3.8267   58.462   11.552   55.605   15.025   62.593   18.065   36.354   5.2196   38.448   5.9567 -2.093567 7.920020 
1 1 1   13    4  -64 o  105.845   1.8846  457.318   16.260  461.709   17.912  436.753   38.762  106.336   2.0665  102.938   4.6313 3.397629 5.071450 
1 1 1   13    4  -63 o   68.271   2.1495  190.515   11.947  196.648   13.067  159.257   29.500   69.346   2.3148   61.792   5.9294 7.553692 6.365250 
1 1 1   13    4  -62 o   96.185   1.6992  377.497   13.322  391.822   16.677  352.234   22.147   97.965   2.0884   92.761   2.9327 5.203644 3.600286 
1 1 1   13    4  -61 o  109.012   1.5626  484.792   13.885  499.815   18.594  465.853   20.877  110.650   2.0615  106.795   2.3982 3.855667 3.162459 
1 1 1   13    4  -60 o  112.272   1.5515  514.199   14.199  497.770   18.728  536.414   21.778  110.426   2.0806  114.609   2.3311 -4.183281 3.124525 
1 1 1   13    4  -59 o  118.485   1.4895  572.623   14.386  551.215   22.200  588.123   18.889  116.183   2.3441  120.047   1.9303 -3.863449 3.036590 
1 1 1   13    4  -58 o   63.789   1.6546  166.103   8.5963  154.965   12.688  175.552   11.687   61.545   2.5346   65.542   2.1907 -3.996769 3.350095 
1 1 1   13    4  -57 o   65.271   1.6464  173.895   8.7526  179.137   12.944  169.480   11.880   66.193   2.4030   64.393   2.2668 1.799927 3.303468 
1 1 1   13    4  -56 o  147.337   1.4510  885.325   17.426  930.945   25.766  846.863   23.658  151.034   2.0928  144.059   2.0147 6.975067 2.904973 
1 1 1   13    4  -55 o   74.607   1.8355  227.083   11.163  219.540   13.828  241.198   18.915   73.300   2.3172   76.768   3.0286 -3.467926 3.813333 
1 1 1   13    4  -54 o   54.392   2.2250  120.946   9.8444  109.071   12.358  141.564   16.284   51.585   2.9513   58.742   3.4156 -7.156933 4.514010 
1 1 1   13    4  -53 o  137.958   1.5219  776.193   17.115  776.397   23.519  775.964   24.954  137.939   2.0917  137.890   2.2201 0.4864502E-01 3.050232 
1 1 1   13    4  -52 o   94.473   1.5484  363.990   11.924  378.967   16.709  348.448   17.021   96.372   2.1270   92.403   2.2598 3.968643 3.103361 
1 1 1   13    4  -51 o   18.549   5.0946   14.549   7.9380   7.0046   10.332   25.417   12.401   15.553   5.9079   24.395   6.2184 -8.842114 8.577382 
1 1 1   13    4  -50 o  105.781   1.4638  456.286   12.622  452.456   18.397  459.693   17.349  105.307   2.1432  106.152   2.0050 -0.8458557 2.934819 
1 1 1   13    4  -49 o  102.446   1.6479  428.010   13.762  435.620   18.447  418.460   20.666  103.329   2.1901  101.257   2.5038 2.072067 3.326451 
1 1 1   13    4  -48 o   62.343   1.8556  158.666   9.4193  155.434   14.013  161.331   12.722   61.641   2.7961   62.825   2.4892 -1.184101 3.743557 
1 1 1   13    4  -47 o   86.089   1.6233  302.228   11.391  306.263   17.068  298.986   15.297   86.600   2.4202   85.579   2.1946 1.020851 3.267029 
1 1 1   13    4  -46 o   64.614   2.0081  170.461   10.564  162.421   16.758  175.762   13.608   62.977   3.2757   65.578   2.5506 -2.601112 4.151598 
1 1 1   13    4  -45 o  201.232   2.2994  1652.14   37.717   0.0000   0.0000  1652.14   37.717  ?   ?   201.232   2.2994 0.000000 2.299361 
1 1 1   13    4  -44 o   75.488   2.0799  232.628   12.786  175.129   26.515  250.050   14.595   65.199   5.0278   78.253   2.2906 -13.05387 5.525017 
1 1 1   13    4  -43 o  195.359   1.6180  1556.28   25.767  1536.86   36.861  1574.84   36.033  194.085   2.3299  196.475   2.2499 -2.390427 3.238875 
1 1 1   13    4  -42 o  129.218   1.4748  680.811   15.534  711.825   23.033  654.932   21.039  132.100   2.1390  126.716   2.0369 5.383987 2.953683 
1 1 1   13    4  -41 f   81.904   1.5724  273.534   10.498  272.050   15.543  274.779   14.235   81.627   2.3384   82.048   2.1303 -0.4211426 3.163216 
1 1 1   13    4  -40 o  150.479   1.5720  923.298   19.283  941.622   30.698  911.356   24.782  151.916   2.4790  149.481   2.0339 2.435349 3.206525 
1 1 1   13    4  -39 o  113.457   1.5216  524.858   14.073  534.022   22.861  519.267   17.857  114.408   2.4514  112.838   1.9414 1.570221 3.127026 
1 1 1   13    4  -38 o  150.653   1.6980  925.481   20.853  973.524   40.189  907.782   24.393  154.420   3.1928  149.191   2.0058 5.229065 3.770566 
1 1 1   13    4  -37 o  185.334   1.7967  1400.69   27.144  1400.43   49.958  1400.80   32.333  185.201   3.3092  185.321   2.1403 -0.1198730 3.941051 
1 1 1   13    4  -36 o   66.806   1.9276  182.158   10.486  177.271   22.368  183.535   11.872   65.726   4.1969   67.045   2.1751 -1.319244 4.727036 
1 1 1   13    4  -35 o   56.907   1.9078  132.214   8.8372  124.402   15.168  136.229   10.873   55.094   3.3939   57.743   2.3148 -2.649643 4.108100 
1 1 1   13    4  -34 o   93.874   1.5474  359.297   11.841  347.688   19.332  366.267   14.980   92.279   2.5725   94.770   1.9391 -2.490852 3.221484 
1 1 1   13    4  -33 o  169.308   1.6005  1168.77   22.089  1168.49   34.921  1168.95   28.519  169.239   2.5314  169.299   2.0665 -0.6044006E-01 3.267757 
1 1 1   13    4  -32 o  180.165   1.6327  1323.49   23.977  1299.74   37.423  1340.04   31.230  178.489   2.5721  181.264   2.1136 -2.774902 3.329107 
1 1 1   13    4  -31 o  144.888   1.5352  855.898   18.132  847.088   28.714  861.740   23.383  144.102   2.4445  145.365   1.9733 -1.263077 3.141587 
1 1 1   13    4  -30 o  149.572   1.5519  912.133   18.922  877.067   29.611  936.332   24.599  146.629   2.4774  151.526   1.9916 -4.896957 3.178666 
1 1 1   13    4  -29 o  145.524   1.5357  863.414   18.217  813.839   28.328  898.376   23.789  141.247   2.4603  148.425   1.9662 -7.177856 3.149487 
1 1 1   13    4  -28 o   30.864   2.9581   39.227   7.3510   50.678   12.906   33.728   8.9436   34.904   4.6517   28.465   3.9618 6.439939 6.110126 
1 1 1   13    4  -27 o  185.663   1.6467  1405.46   24.922  1389.93   38.948  1416.22   32.431  184.583   2.5886  186.349   2.1350 -1.765625 3.355418 
1 1 1   13    4  -26 o  120.192   1.5097  588.971   14.791  576.134   23.700  597.161   18.930  118.845   2.4464  121.013   1.9190 -2.168243 3.109252 
1 1 1   13    4  -25 o  296.316   2.1335  3580.83   51.532  3579.68   68.685  3582.31   77.945  296.197   2.8447  296.260   3.2276 -0.6213379E-01 4.302319 
1 1 1   13    4  -24 o  146.081   1.5233  870.017   18.139  853.392   24.458  890.338   27.041  144.659   2.0742  147.750   2.2452 -3.090851 3.056679 
1 1 1   13    4  -23 o  158.679   1.5535  1026.56   20.094  1000.49   26.916  1059.38   30.203  156.630   2.1081  161.165   2.2990 -4.534546 3.119226 
1 1 1   13    4  -22 o   71.960   1.6333  211.126   9.5806  202.617   13.487  219.794   13.612   70.443   2.3520   73.375   2.2786 -2.932358 3.274766 
1 1 1   13    4  -21 o   88.600   1.5127  320.040   10.925  320.051   17.089  320.033   14.207   88.551   2.3696   88.590   1.9674 -0.3916168E-01 3.079851 
1 1 1   13    4  -20 o   59.271   1.7734  143.369   8.5583  142.284   13.597  144.081   11.014   58.986   2.8361   59.393   2.2791 -0.4070892 3.638420 
1 1 1   13    4  -19 o   92.802   1.6669  351.134   12.610  335.348   17.806  367.014   17.860   90.642   2.4121   94.862   2.3097 -4.219467 3.339592 
1 1 1   13    4  -18 o  107.329   1.6298  469.658   14.259  457.132   20.195  482.111   20.135  105.869   2.3401  108.725   2.2719 -2.856087 3.261559 
1 1 1   13    4  -17 o  184.937   1.7738  1394.52   26.741  1356.52   37.391  1434.30   38.257  182.364   2.5153  187.520   2.5028 -5.156387 3.548386 
1 1 1   13    4  -16 o  261.144   2.1212  2781.03   45.154  2681.03   62.479  2890.37   65.333  256.336   2.9901  266.153   3.0114 -9.817261 4.243710 
1 1 1   13    4  -15 o   88.475   1.5539  319.138   11.207  305.889   17.720  327.968   14.467   86.562   2.5140   89.683   1.9790 -3.120392 3.199491 
1 1 1   13    4  -14 o   53.161   1.8588  115.374   8.0427  117.339   12.281  113.898   10.642   53.556   2.8232   52.786   2.4802 0.7703362 3.757890 
1 1 1   13    4  -13 o   80.515   1.5154  264.289   9.9458  253.616   14.808  273.060   13.424   78.824   2.3071   81.831   2.0125 -3.007050 3.061536 
1 1 1   13    4  -12 o   96.262   1.4463  377.766   11.349  380.433   16.770  375.513   15.414   96.587   2.1300   95.964   1.9705 0.6228943 2.901685 
1 1 1   13    4  -11 o  209.105   1.6271  1782.68   27.734  1766.40   39.596  1798.35   38.858  208.114   2.3341  209.992   2.2701 -1.877396 3.255931 
1 1 1   13    4  -10 o  122.763   1.4257  614.388   14.267  617.591   20.947  611.616   19.485  123.065   2.0881  122.473   1.9518 0.5927811 2.858229 
1 1 1   13    4   -9 o  200.832   1.7109  1644.44   28.009  1651.23   37.717  1636.11   41.822  201.218   2.2995  200.279   2.5617 0.9381714 3.442400 
1 1 1   13    4   -8 o   82.944   1.5160  280.474   10.250  275.732   15.226  284.404   13.862   82.195   2.2747   83.514   2.0362 -1.319443 3.052946 
1 1 1   13    4   -7 o  152.219   1.4584  944.605   18.096  932.620   26.154  955.612   25.064  151.229   2.1216  153.086   2.0085 -1.856888 2.921535 
1 1 1   13    4   -6 o  106.533   1.4272  462.680   12.394  428.928   17.906  493.725   17.173  102.559   2.1418  110.039   1.9145 -7.480164 2.872762 
1 1 1   13    4   -5 o  147.097   1.5563  882.135   18.661  889.028   25.328  873.949   27.600  147.654   2.1044  146.388   2.3129 1.265396 3.127003 
1 1 1   13    4   -4 o  235.213   1.8537  2255.80   35.542  2259.99   47.550  2250.50   53.504  235.395   2.4781  234.877   2.7945 0.5173645 3.735006 
1 1 1   13    4   -3 o  163.663   1.8386  1092.14   24.529  1083.26   38.637  1098.13   31.747  162.949   2.9088  164.090   2.3735 -1.141037 3.754275 
1 1 1   13    4   -2 o  118.796   1.6374  575.365   15.856  567.467   23.157  582.337   21.757  117.957   2.4084  119.498   2.2336 -1.541100 3.284698 
1 1 1   13    4   -1 o  113.232   1.6508  522.737   15.237  529.362   22.368  517.000   20.813  113.927   2.4086  112.594   2.2677 1.333748 3.308126 
1 1 1   13    4    0 o  223.432   1.7968  2035.44   32.726  2078.72   51.454  2006.03   42.408  225.736   2.7963  221.783   2.3458 3.952377 3.649921 
1 1 1   13    4    1 o  172.534   1.6096  1213.63   22.638  1200.40   35.312  1222.85   29.496  171.554   2.5252  173.171   2.0895 -1.617325 3.277592 
1 1 1   13    4    2 o  152.828   1.4696  952.179   18.308  955.797   26.786  949.007   25.081  153.096   2.1464  152.556   2.0169 0.5399933 2.945282 
1 1 1   13    4    3 o  133.133   1.5417  722.602   16.731  726.662   26.974  720.064   21.329  133.478   2.4792  132.888   1.9690 0.5900574 3.165943 
1 1 1   13    4    4 o  245.130   2.4825  2450.79   49.605   0.0000   0.0000  2450.79   49.605  ?   ?   245.130   2.4825 0.000000 2.482507 
1 1 1   13    4    5 o  180.471   1.7836  1327.95   26.238  1430.31   49.925  1288.89   30.841  187.217   3.2714  177.783   2.1281 9.433533 3.902738 
1 1 1   13    4    6 o   68.674   1.7840  192.417   9.9783  211.426   16.962  182.358   12.339   71.931   2.8988   66.831   2.2683 5.099174 3.680793 
1 1 1   13    4    7 o   83.590   1.5362  284.863   10.467  263.696   15.527  302.496   14.171   80.374   2.3725   86.130   2.0185 -5.755386 3.114944 
1 1 1   13    4    8 o   88.092   1.5335  316.374   11.012  284.722   16.232  343.361   14.988   83.519   2.3867   91.764   2.0037 -8.244324 3.116281 
1 1 1   13    4    9 o  220.508   1.7979  1982.52   32.317  2021.08   43.915  1936.98   47.729  222.607   2.4201  217.910   2.6870 4.698013 3.616213 
1 1 1   13    4   10 o  384.939   2.6202  6044.20   82.216  6186.02  111.072  5872.31  122.277  389.306   3.5001  379.230   3.9555 10.07507 5.281753 
1 1 1   13    4   11 o   69.056   2.0969  194.642   11.790  210.927   16.274  176.654   17.104   71.852   2.7838   65.718   3.2024 6.134270 4.243252 
1 1 1   13    4   12 o  214.146   1.8993  1869.88   33.155  1858.14   47.122  1881.40   46.657  213.426   2.7086  214.760   2.6652 -1.334625 3.799963 
1 1 1   13    4   13 o  226.231   2.1482  2087.14   39.615  2088.02   51.450  2085.86   62.086  226.236   2.7899  226.071   3.3691 0.1651154 4.374280 
1 1 1   13    4   14 o   64.285   1.9820  168.675   10.374  160.912   15.341  175.214   14.081   62.727   3.0091   65.486   2.6432 -2.758373 4.005195 
1 1 1   13    4   15 o  108.841   1.6601  482.993   14.729  458.961   21.196  505.433   20.482  106.078   2.4512  111.325   2.2570 -5.247246 3.332079 
1 1 1   13    4   16 o  304.657   2.5770  3786.03   63.996  3770.46  101.166  3796.42   82.630  303.842   4.0846  304.992   3.3236 -1.150055 5.265989 
1 1 1   13    4   17 o  123.102   1.7851  617.881   17.912  643.809   29.426  602.618   22.577  125.618   2.8737  121.556   2.2785 4.061722 3.667430 
1 1 1   13    4   18 o  140.007   1.7982  799.249   20.523  759.139   32.506  825.834   26.464  136.403   2.9235  142.299   2.2815 -5.895676 3.708341 
1 1 1   13    4   19 o  240.054   2.4588  2350.48   48.113  2251.44   94.111  2385.53   55.982  234.671   4.9198  241.806   2.8402 -7.134476 5.680736 
1 1 1   13    4   20 o  121.238   1.9963  599.383   19.729  592.711   41.749  601.302   22.386  120.377   4.2615  121.423   2.2617 -1.046364 4.824453 
1 1 1   13    4   21 o  220.625   2.3558  1985.32   42.368  2005.83   86.935  1978.93   48.520  221.509   4.8147  220.245   2.7026 1.264053 5.521323 
1 1 1   13    4   22 o   75.016   2.2105  229.701   13.502  221.270   29.657  231.906   15.165   73.394   4.9867   75.361   2.4720 -1.966728 5.565815 
1 1 1   13    4   23 o   94.449   2.4452  364.108   18.810  429.657   34.972  337.427   22.312  102.469   4.1957   90.884   3.0159 11.58483 5.167210 
1 1 1   13    4   24 o  238.985   4.9700  2335.52   96.819   0.0000   0.0000  2335.52   96.819  ?   ?   238.985   4.9700 0.000000 4.969974 
1 1 1   13    4   25 o  138.823   2.3592  786.058   26.697  784.915   32.691  788.349   46.257  138.695   2.8915  138.860   4.0911 -0.1645660 5.009783 
1 1 1   13    4   26 o  248.181   2.9265  2513.33   59.205  2489.11   72.081  2563.56  103.796  246.910   3.5813  250.353   5.0862 -3.442459 6.220560 
1 1 1   13    4   27 o   94.243   1.8187  362.164   13.972  359.935   22.508  363.561   17.821   93.872   2.9451   94.412   2.3156 -0.5395355 3.746429 
1 1 1   13    4   28 o   30.536   3.6978   38.631   9.0170   41.554   15.212   37.047   11.196   31.308   6.1802   29.731   4.7818 1.576988 7.814090 
1 1 1   13    4   29 o  259.107   2.3112  2738.38   48.814  2714.50   77.126  2754.35   63.050  257.826   3.6698  259.796   2.9773 -1.970520 4.725595 
1 1 1   13    4   30 o  138.383   1.8054  780.867   20.365  761.763   32.641  793.043   26.059  136.627   2.9308  139.438   2.2927 -2.810608 3.721049 
1 1 1   13    4   31 o   73.949   1.9904  223.169   11.987  230.180   19.712  219.055   15.100   75.024   3.2309   73.234   2.5333 1.789970 4.105596 
1 1 1   13    4   32 o  200.769   2.0174  1643.85   33.015  1645.34   52.719  1642.89   42.348  200.766   3.2214  200.671   2.5889 0.9480286E-01 4.132763 
1 1 1   13    4   33 o   66.445   2.1136  180.246   11.433  173.455   18.673  184.319   14.461   65.080   3.5332   67.161   2.6466 -2.081055 4.414470 
1 1 1   13    4   34 o   83.177   1.9120  282.138   12.964  290.386   21.057  277.103   16.452   84.292   3.0697   82.381   2.4526 1.910965 3.929172 
1 1 1   13    4   35 o  177.269   1.9267  1281.52   27.841  1303.33   44.835  1267.83   35.520  178.691   3.0781  176.287   2.4718 2.404556 3.947686 
1 1 1   13    4   36 o  203.811   2.0367  1694.13   33.837  1730.43   54.636  1671.54   43.098  205.877   3.2556  202.404   2.6122 3.472809 4.174018 
1 1 1   13    4   37 o  149.923   1.8433  916.606   22.527  908.070   35.971  922.114   28.895  149.159   2.9585  150.347   2.3577 -1.187851 3.783025 
1 1 1   13    4   38 o  159.402   1.8777  1036.20   24.398  1044.67   39.401  1030.94   31.071  159.978   3.0214  158.967   2.3978 1.010681 3.857273 
1 1 1   13    4   39 o  178.270   1.9445  1296.11   28.257  1309.02   45.438  1287.97   36.083  179.066   3.1129  177.673   2.4914 1.393539 3.987125 
1 1 1   13    4   40 o  222.481   2.1429  2019.01   38.862  2001.51   61.851  2030.42   49.954  221.377   3.4275  223.052   2.7475 -1.674438 4.392770 
1 1 1   13    4   41 f  103.819   1.9058  439.583   16.129  424.244   26.163  448.986   20.484  101.886   3.1540  104.904   2.3955 -3.018005 3.960564 
1 1 1   13    4   42 o  114.742   1.8939  536.951   17.714  552.950   29.132  527.566   22.313  116.336   3.0747  113.712   2.4072 2.624115 3.904926 
1 1 1   13    4   43 o  161.705   1.9345  1066.50   25.500  1078.56   41.017  1058.90   32.555  162.527   3.0960  161.091   2.4792 1.436493 3.966356 
1 1 1   13    4   44 o  164.877   2.4852  1109.30   33.401  1121.48   59.245  1103.62   40.441  165.511   4.3951  164.408   3.0176 1.103210 5.331334 
1 1 1   13    4   45 o   56.179   6.5823  131.440   29.572  131.440   29.572   0.0000   0.0000   56.179   6.5823  ?   ?  0.000000 6.582321 
1 1 1   13    4   46 o  106.413   4.4981  464.165   38.929  464.165   38.929   0.0000   0.0000  106.413   4.4981  ?   ?  0.000000 4.498085 
1 1 1   13    4   47 o   23.472   5.8551   23.496   11.165   24.663   17.678   22.722   14.400   24.657   7.8297   23.377   7.0062 1.280001 10.50667 
1 1 1   13    4   48 o  115.321   1.8952  542.442   17.816  525.005   28.831  553.212   22.659  113.337   3.1237  116.435   2.3874 -3.098236 3.931582 
1 1 1   13    4   49 o   55.530   2.4864  126.099   11.226   91.908   18.560  145.824   14.097   47.112   4.9046   59.689   2.9061 -12.57739 5.700922 
1 1 1   13    4   50 o   90.269   1.9532  332.401   14.372  314.884   23.389  343.029   18.218   87.728   3.2764   91.646   2.4408 -3.917915 4.085659 
1 1 1   13    4   51 o  101.575   1.8837  420.871   15.597  409.727   25.633  427.423   19.654  100.095   3.1455  102.338   2.3560 -2.242188 3.930023 
1 1 1   13    4   52 o  232.154   2.4775  2200.04   46.885  2165.40   65.599  2236.22   67.035  230.142   3.4967  233.871   3.5163 -3.729263 4.959018 
1 1 1   13    4   53 o   85.612   1.9589  299.032   13.670  307.827   22.777  294.081   17.091   86.726   3.2276   84.839   2.4740 1.887901 4.066685 
1 1 1   13    4   54 o  162.566   1.8985  1078.19   25.158  1081.46   40.655  1076.16   32.026  162.682   3.0658  162.362   2.4198 0.3200836 3.905724 
1 1 1   13    4   55 o   42.526   2.9733   74.252   10.242   61.078   17.991   80.569   12.458   38.070   5.9957   44.249   3.4818 -6.179276 6.933367 
1 1 1   13    4   56 o  150.456   1.8722  923.588   22.961  894.269   36.883  942.140   29.339  147.920   3.0589  151.912   2.3693 -3.992096 3.869192 
1 1 1   13    4   57 o   19.893   5.4401   16.796   9.0737   14.248   16.373   17.926   10.901   20.535   7.5070   20.676   6.0706 -0.1418991 9.654364 
1 1 1   13    4   58 o  213.645   2.1020  1863.04   36.606  1920.17   59.856  1828.91   46.268  216.645   3.3894  211.582   2.6827 5.062332 4.322572 
1 1 1   13    4   59 o  226.152   2.1641  2087.91   39.894  2132.73   64.789  2060.54   50.630  228.271   3.4819  224.549   2.7661 3.722763 4.446877 
1 1 1   13    4   60 o   26.058   4.3766   28.611   8.9671   11.014   15.095   38.208   11.147   18.969   7.1554   30.149   4.6880 -11.18090 8.554366 
1 1 1   13    4   61 o   31.480   3.9677   41.261   9.9557   49.702   15.369   35.158   13.068   34.270   5.7020   28.690   5.7878 5.579412 8.124723 
1 1 1   13    4   62 o   34.972   3.6166   50.629   10.161   55.151   16.158   47.672   13.069   36.140   5.6714   33.700   4.9009 2.439201 7.495602 
1 1 1   13    4   63 o   53.925   2.8727  119.254   12.582  155.041   23.688  105.191   14.850   61.207   4.7859   50.538   3.6288 10.66911 6.006085 
1 1 1   13    4   64 o   93.220   1.9839  354.785   15.076  359.880   28.525  352.810   17.758   93.609   3.7459   92.899   2.3469 0.7095718 4.420353 
1 1 1   13    4   65 o   68.730   2.1905  193.148   12.257  202.647   24.203  189.872   14.214   70.096   4.2560   68.103   2.5651 1.992722 4.969177 
1 1 1   13    4   66 o   80.000   1.8999  261.304   12.390  239.136   19.906  275.322   15.830   76.342   3.2059   82.044   2.3694 -5.702209 3.986494 
1 1 1   13    4   67 f  144.598   1.7572  853.528   20.712  844.589   31.083  860.667   27.777  143.693   2.6537  145.111   2.3483 -1.418106 3.543542 
1 1 1   13    4   68 o   53.917   3.3064  119.630   14.462  137.107   23.491  108.964   18.352   57.383   5.0743   51.245   4.4370 6.137653 6.740620 
1 1 1   13    4   69 o   61.731   2.6831  156.261   13.469  149.310   18.313  164.453   19.880   60.165   3.7527   63.127   3.8821 -2.962727 5.399410 
1 1 1   13    4   70 o   96.669   2.2030  382.031   17.359  410.268   23.647  349.029   25.564  100.024   2.9033   92.142   3.4095 7.881920 4.478132 
1 1 1   13    4   71 o   71.198   2.0619  207.372   11.954  200.131   19.389  211.812   15.183   69.717   3.4223   71.880   2.5954 -2.163322 4.295142 
1 1 1   13    4   72 o   38.908   2.9329   62.427   9.2334   58.537   15.810   64.440   11.375   37.154   5.3765   39.424   3.5785 -2.269520 6.458508 
1 1 1   13    4   73 o   31.185   3.3798   40.439   8.4545   34.721   12.360   45.467   11.590   28.395   5.5391   32.869   4.4390 -4.473635 7.098320 
1 1 1   13    4   74 o   78.327   1.6994  250.646   10.850  261.831   15.678  240.366   15.031   79.924   2.4093   76.574   2.4111 3.349457 3.408504 
1 1 1   13    4   75 o   57.366   1.9194  134.718   8.9629  145.860   13.278  125.390   12.148   59.561   2.7421   55.221   2.7071 4.340279 3.853262 
1 1 1   13    4   76 o   17.276   4.9643   12.751   7.3608   18.371   10.858   7.9705   10.013   20.656   6.0569   15.619   5.8413 5.037011 8.414688 
1 1 1   13    4   77 o   26.380   3.3385   29.133   7.0185   27.598   11.203   30.124   9.0045   25.145   5.6085   26.614   4.2970 -1.468779 7.065359 
1 1 1   13    4   78 o   84.682   1.4584  292.975   10.067  287.717   16.187  296.292   12.855   83.721   2.3744   85.098   1.8533 -1.376923 3.012013 
1 1 1   13    4   79 o   37.615   2.2071   58.206   6.7377   60.316   13.127   57.451   7.8506   37.806   4.3382   37.302   2.5981 0.5039368 5.056678 
1 1 1   13    4   80 o   46.583   1.9105   89.016   7.2393   86.748   13.895   89.861   8.4814   45.562   3.7751   46.750   2.2321 -1.187721 4.385569 
1 1 1   13    4   81 o   75.486   1.5359  233.014   9.4507  230.255   16.694  234.315   11.465   74.717   2.7457   75.638   1.8595 -0.9211044 3.316099 
1 1 1   13    4   82 o   42.059   2.2726   72.875   7.7627   76.147   11.715   70.314   10.365   42.722   3.3919   41.119   3.1154 1.603405 4.605515 
1 1 1   13    4   83 o   35.369   2.5260   51.774   7.2348   50.030   11.269   52.997   9.4365   34.340   4.1070   35.601   3.2889 -1.261494 5.261534 
1 1 1   13    4   84 o   64.936   1.5336  172.571   8.1174  172.773   13.580  172.458   10.126   64.680   2.5808   64.811   1.9187 -0.1308365 3.215899 
1 1 1   13    4   85 o   33.811   2.1257   47.167   5.8290   49.876   10.978   46.104   6.8787   34.260   4.0066   33.337   2.5507 0.9231796 4.749578 
1 1 1   13    4   86 o   7.6498   3.4346  -1.9494   4.4548   1.3997   10.201  -2.7387   4.9520   13.050   5.5321   7.8501   3.5636 5.200238 6.580480 
1 1 1   13    4   87 o   52.402   1.5717  112.600   6.7059  115.770   12.242  111.242   8.0155   52.772   2.8565   52.014   1.8937 0.7579193 3.427197 
1 1 1   13    4   88 o   35.598   2.0976   52.331   6.0598   49.412   11.011   53.599   7.2577   33.988   4.0543   35.933   2.4933 -1.945045 4.759636 
1 1 1   13    4   89 o   12.245   5.0252   2.8195   8.0253  -0.2245   9.9835   8.3786   13.492   12.354   5.3580   16.686   6.6326 -4.332201 8.526408 
1 1 1   13    4   90 o   14.334   5.4083   7.1292   8.6245   0.0911   11.064   18.030   13.769   13.024   5.6446   20.213   6.9313 -7.188846 8.938925 
1 1 1   13    4   91 o   42.444   2.7324   75.139   9.4035   75.582   11.827   74.377   15.505   42.282   3.4618   41.339   4.6836 0.9425545 5.824107 
1 1 1   13    4   92 o   48.811   2.4310   98.881   9.6420   91.699   11.825  113.129   16.656   46.728   3.1223   51.453   4.0027 -4.724262 5.076484 
1 1 1   13    4   93 o   22.681   5.6703   23.676   10.455   31.602   11.633  -9.6045   23.838   26.300   5.5983   16.497   7.6112 9.802296 9.448333 
1 1 1   13    4   94 o   26.258   5.0540   31.035   10.425   24.113   11.489   63.298   24.803   22.695   6.0859   35.063   8.7155 -12.36895 10.63009 
1 1 1   13    4   95 o   41.312   3.4612   72.603   11.549   71.506   12.842   77.238   26.405   40.762   3.9128   38.829   8.5721 1.933426 9.422896 
1 1 1   13    4   96 o   43.293   2.6744   78.495   9.3920   72.587   13.192   84.568   13.374   40.953   4.0028   44.394   3.7303 -3.440422 5.471554 
1 1 1   13    4   97 o   45.283   2.6570   85.959   9.7645   86.552   13.824   85.368   13.794   44.788   3.8229   44.466   3.8435 0.3221092 5.420974 
1 1 1   13    4   98 o   8.2496   3.9703 -10.5936   7.8698 -12.3835   10.894  -8.6400   11.381   9.9519   4.7582   10.912   5.1097 -0.9600945 6.982063 
1 1 1   13    4   99 o   15.422   5.4005   10.301   8.3783   10.891   11.738   9.6878   11.963   16.438   6.2841   16.055   6.2876 0.3830128 8.889534 
1 1 1   13    4  100 o   24.372   4.2514   26.716   8.1391   34.078   10.723   16.709   12.502   27.125   5.0348   18.731   6.5941 8.393349 8.296503 
1 1 1   13    4  101 o   21.610   4.6699   21.612   7.9855   26.231   10.361   14.851   12.533   23.357   5.5282   17.891   6.5636 5.465891 8.581519 
1 1 1   13    4  102 o   34.212   3.0485   50.244   8.4126   61.195   10.934   34.354   13.171   37.399   3.6322   26.176   6.2576 11.22267 7.235357 
1 1 1   13    4  103 o   17.661   5.1570   14.960   7.8853   8.6908   10.066   24.918   12.687   14.837   5.7798   21.889   6.5798 -7.052401 8.757830 
1 1 1   13    4  104 o   11.678   4.8970   2.8678   7.8550   8.4242   10.083  -5.7091   12.528   14.648   5.7617   11.765   5.4593 2.882936 7.937282 
1 1 1   13    4  105 o   42.532   2.5727   76.905   8.8779   73.593   11.264   82.336   14.425   40.979   3.4027   42.593   4.2097 -1.614197 5.412958 
1 1 1   13    4  106 o   22.754   4.5888   24.449   8.2172   29.825   10.615   16.409   12.981   24.538   5.4487   17.933   6.6618 6.604961 8.606262 
1 1 1   13    4  107 o   11.174   4.8809   0.8591   8.4104   6.5141   11.472  -5.7124   12.367   14.207   5.9349   11.558   5.3839 2.648341 8.013032 
1 1 1   13    4  108 o   34.315   3.4092   52.029   9.4103   57.137   13.031   46.462   13.603   34.816   4.7126   30.449   5.6898 4.367077 7.387996 
1 1 1   13    4  109 o   25.921   5.2160   33.079   10.639   49.479   17.597   23.631   13.357   29.395   7.3611   20.535   6.8271 8.860033 10.03964 
1 1 1   13    4  110 o   13.987   5.6655   7.4981   10.040  -1.7570   16.026   13.478   12.882   13.576   6.2553   16.601   6.5176 -3.025386 9.033704 
1 1 1   13    4  111 o   13.810   5.8149   6.1057   11.147   11.319   16.656   1.8765   15.002   16.434   7.0212   13.924   6.2727 2.510691 9.415073 
1 1 1   13    4  112 o   13.930   5.8729   6.3872   11.393   20.188   16.955  -4.9759   15.385   18.753   7.4414   12.733   5.9553 6.020307 9.531028 
1 1 1   13    4  113 o   12.887   5.6673   2.7350   11.510   4.7628   16.781   0.9334   15.817   14.878   6.6741   13.877   6.3264 1.001122 9.196024 
1 1 1   13    4  114 o   12.848   5.6313   2.9963   11.280   18.077   16.559 -10.0614   15.408   17.991   7.2798   11.888   5.6769 6.102746 9.231653 
1 1 1   13    4  115 o   12.665   5.7900  -0.8210   13.368   7.4473   16.556 -16.3052   22.657   15.280   6.7550   13.372   6.5065 1.908764 9.378999 
1 1 1   13    4  116 o   15.430   6.4843   10.326   13.819   10.074   17.209   10.785   23.186   15.899   6.9625   16.811   7.6622 -0.9117146 10.35300 
1 1 1   13    4  117 o   9.5337   4.7132 -21.9135   13.454 -13.0106   17.108 -36.3448   21.781   12.019   5.8019   11.382   5.6871 0.6373320 8.124324 
1 1 1   13    4  118 o   12.153   5.6394  -3.2121   13.369   12.711   16.585 -32.7465   22.588   16.411   7.0086   11.889   5.9167 4.522345 9.172121 
1 1 1   13    5 -116 o   11.010   5.2965 -11.6662   13.972   7.0564   17.481 -44.7746   23.247   15.278   6.8357   11.257   5.6596 4.021087 8.874597 
1 1 1   13    5 -115 o   13.476   5.9327   4.1602   12.646   18.089   18.566  -7.8952   17.272   17.784   7.4971   12.716   6.0550 5.068174 9.636933 
1 1 1   13    5 -114 o   11.294   5.3040  -5.6764   12.417   1.9889   17.712 -13.0851   17.413   14.366   6.6034   12.092   5.8411 2.273630 8.816079 
1 1 1   13    5 -113 o   17.389   6.5733   16.633   12.754   2.8694   17.993   30.531   18.081   14.644   6.7032   21.425   7.8795 -6.780927 10.34502 
1 1 1   13    5 -112 o   12.787   5.7406   1.2093   12.443  -4.5438   17.830   6.6719   17.374   13.466   6.3340   15.295   6.8310 -1.828584 9.315646 
1 1 1   13    5 -111 f   11.564   5.2464  -1.1513   10.713 -10.3849   13.536   14.330   17.527   11.084   5.3006   17.057   7.2420 -5.973713 8.974514 
1 1 1   13    5 -110 o   21.144   7.8802   28.742   18.192   28.742   18.192   0.0000   0.0000   21.144   7.8802  ?   ?  0.000000 7.880249 
1 1 1   13    5 -109 o   16.201   6.4526   12.598   12.794   6.6711   18.446   18.092   17.761   15.679   7.0181   18.180   7.4700 -2.501124 10.24963 
1 1 1   13    5 -108 o   14.047   6.0303   5.6815   12.396   10.930   17.718   0.6503   17.348   16.495   7.1460   14.354   6.5748 2.140741 9.710443 
1 1 1   13    5 -107 o   22.496   5.7317   26.168   10.539   25.144   13.173   27.988   17.567   21.130   6.7641   21.292   7.7772 -0.1617851 10.30718 
1 1 1   13    5 -106 o   15.498   6.0732   10.791   11.168   6.3931   12.321   31.031   26.433   14.327   6.0769   21.361   8.9719 -7.033737 10.83626 
1 1 1   13    5 -105 o   27.891   4.8723   37.216   10.675   23.674   13.037   64.765   18.594   20.717   6.7377   34.725   6.8125 -14.00763 9.581553 
1 1 1   13    5 -104 o   14.553   5.7473   8.6447   10.069   16.963   12.268  -8.5208   17.624   18.072   6.5138   13.182   6.2300 4.889683 9.013454 
1 1 1   13    5 -103 o   29.560   4.6629   40.979   10.864   49.203   13.698   27.037   17.835   31.667   5.5064   21.420   7.8343 10.24706 9.575816 
1 1 1   13    5 -102 o   35.755   3.4590   56.216   9.9558   52.808   11.864   64.330   18.305   33.914   4.3948   35.172   6.6279 -1.257732 7.952530 
1 1 1   13    5 -101 o   13.887   5.5036   7.0553   9.2629   8.6907   11.013   3.1005   17.126   15.012   5.9842   15.287   6.8077 -0.2743435 9.063957 
1 1 1   13    5 -100 o   18.690   5.7958   17.187   9.7443   12.418   11.927   26.761   16.898   16.693   6.3459   22.047   7.6731 -5.353558 9.957289 
1 1 1   13    5  -99 o   23.655   5.3653   26.811   10.107   15.221   12.410   49.635   17.416   17.937   6.5391   30.891   7.0696 -12.95423 9.630093 
1 1 1   13    5  -98 o   23.177   5.4077   25.660   10.029   26.411   12.785   24.459   16.169   22.832   6.5369   21.610   7.5067 1.222057 9.953960 
1 1 1   13    5  -97 o   29.690   2.9937   37.664   7.1464   19.340   11.678   48.635   9.0360   19.878   6.3693   33.591   3.3444 -13.71278 7.193974 
1 1 1   13    5  -96 o   36.607   2.4747   56.215   7.3411   58.672   12.302   54.857   9.1485   36.453   4.2179   35.841   3.1639 0.6126556 5.272603 
1 1 1   13    5  -95 o   10.592   4.4254   1.7008   6.3796   2.2825   10.630   1.3734   7.9754   13.165   5.6163   11.459   4.8758 1.706040 7.437502 
1 1 1   13    5  -94 o   33.745   2.6137   47.803   7.1336   70.662   11.878   34.909   8.9216   40.555   3.6316   28.248   3.9851 12.30745 5.391625 
1 1 1   13    5  -93 o   10.805   4.4864   1.8988   6.4980  -5.5051   10.843   6.0484   8.1171   11.326   5.1914   13.479   5.2069 -2.153155 7.352730 
1 1 1   13    5  -92 o   36.194   2.6959   54.890   7.8967   63.476   11.674   47.648   10.722   38.455   3.7727   33.142   4.0530 5.313633 5.537166 
1 1 1   13    5  -91 o   55.510   2.1042  127.418   9.5041  128.654   12.851  125.925   14.120   55.447   2.8529   54.682   3.1815 0.7652512 4.273307 
1 1 1   13    5  -90 o   13.382   5.1760   5.7135   8.0284   18.576   10.480 -12.5557   12.490   20.102   5.9655   11.002   5.2131 9.099890 7.922350 
1 1 1   13    5  -89 o   15.066   5.2643   9.2235   7.9583   8.1270   10.484   10.714   12.224   15.408   5.9268   16.965   6.4303 -1.556322 8.745025 
1 1 1   13    5  -88 o   35.961   2.6525   53.955   7.7208   46.992   11.107   60.466   10.740   32.959   4.2316   37.755   3.5307 -4.796455 5.511119 
1 1 1   13    5  -87 o   29.305   3.1235   36.233   7.3466   33.848   10.624   38.419   10.170   27.656   4.8914   29.747   4.3205 -2.091042 6.526307 
1 1 1   13    5  -86 o   45.257   2.2061   84.642   8.1140   92.287   11.805   77.795   11.171   46.953   3.1016   43.053   3.2062 3.899826 4.460935 
1 1 1   13    5  -85 o   9.2064   4.1807  -3.5631   6.8232 -13.5009   10.119   4.7220   9.2396   9.4485   4.5356   13.650   5.4678 -4.201801 7.104144 
1 1 1   13    5  -84 o   27.908   3.5898   33.107   7.9776   28.309   12.857   36.110   10.173   24.848   6.3306   28.860   4.4685 -4.011908 7.748788 
1 1 1   13    5  -83 o   86.009   1.9246  303.762   13.493  307.897   23.482  301.724   16.487   85.881   3.3608   85.526   2.3671 0.3546524 4.110775 
1 1 1   13    5  -82 o   21.231   4.8116   19.883   8.1339   37.472   16.553   14.283   9.3392   28.441   7.1488   18.145   5.6815 10.29579 9.131538 
1 1 1   13    5  -81 o   20.067   6.9339   16.862   13.788   0.0000   0.0000   16.862   13.788  ?   ?    20.067   6.9339 0.000000 6.933889 
1 1 1   13    5  -80 o   35.178   4.5668   52.988   12.787   56.674   22.403   51.207   15.572   34.832   8.0515   34.085   5.8130 0.7473335 9.930613 
1 1 1   13    5  -79 o   32.139   4.4601   44.160   11.370   43.941   16.687   44.349   15.534   31.208   6.7559   31.550   6.2611 -0.3421993 9.211062 
1 1 1   13    5  -78 o   32.959   4.3714   46.233   11.455   22.204   17.721   63.479   15.013   22.894   7.8629   38.520   4.8915 -15.62581 9.260244 
1 1 1   13    5  -77 o   30.711   4.7500   40.458   11.508   19.773   16.943   58.175   15.680   21.974   7.6809   36.713   5.4007 -14.73955 9.389513 
1 1 1   13    5  -76 o   17.266   5.3281   12.633   8.2466 -12.4266   14.624   24.317   9.9857   12.525   5.8410   23.563   5.3247 -11.03803 7.903793 
1 1 1   13    5  -75 o   42.664   2.7841   75.180   9.6297   80.226   16.412   72.530   11.892   43.568   4.6952   41.736   3.5285 1.832943 5.873278 
1 1 1   13    5  -74 o   35.859   3.4891   53.585   10.070   38.468   16.682   62.251   12.631   29.378   7.0550   38.528   4.0839 -9.149279 8.151739 
1 1 1   13    5  -73 o   33.295   3.1686   46.043   8.4961   54.147   13.493   40.719   10.936   35.750   4.7475   31.000   4.4557 4.750502 6.510929 
1 1 1   13    5  -72 o   10.332   4.6026  -2.8627   7.8338   4.0191   12.991  -6.7952   9.8202   15.573   6.3925   10.734   4.9278 4.838731 8.071426 
1 1 1   13    5  -71 o   25.784   4.1277   28.155   8.3829   21.463   13.232   32.642   10.835   22.355   6.7196   27.599   5.0000 -5.244610 8.375704 
1 1 1   13    5  -70 o   15.368   5.3926   8.7870   8.3565  -5.3024   13.583   17.367   10.600   13.459   6.0235   20.189   6.0015 -6.729836 8.502989 
1 1 1   13    5  -69 o   62.057   2.1811  157.723   11.016  153.034   17.303  160.919   14.285   60.893   3.5008   62.584   2.8073 -1.691177 4.487361 
1 1 1   13    5  -68 o   53.092   2.1344  115.447   9.2185  115.789   12.470  115.035   13.689   53.063   2.8938   52.839   3.1932 0.2246361 4.309368 
1 1 1   13    5  -67 o  104.355   1.7603  444.776   14.974  447.948   18.781  439.241   24.807  104.665   2.2013  103.469   2.9443 1.196388 3.676216 
1 1 1   13    5  -66 o  149.892   1.8288  917.654   22.346  944.251   33.596  896.553   29.925  151.857   2.7140  148.028   2.4800 3.828629 3.676446 
1 1 1   13    5  -65 o   90.095   1.6987  331.399   12.476  319.069   16.602  347.393   18.909   88.310   2.3083   92.116   2.5206 -3.805687 3.417799 
1 1 1   13    5  -64 o  147.811   1.6166  891.761   19.478  910.914   26.228  868.210   29.085  149.306   2.1551  145.710   2.4487 3.596268 3.261986 
1 1 1   13    5  -63 o  133.459   1.5234  726.826   16.573  714.320   25.584  735.867   21.753  132.192   2.3743  134.230   1.9881 -2.037933 3.096731 
1 1 1   13    5  -62 o   48.278   2.0402   95.362   8.0108   99.468   12.762   92.693   10.291   49.174   3.2013   47.532   2.6667 1.642384 4.166457 
1 1 1   13    5  -61 o   88.832   1.5453  321.985   11.190  330.521   17.594  316.187   14.500   89.899   2.4031   87.994   2.0216 1.905075 3.140306 
1 1 1   13    5  -60 o   72.531   1.6430  214.673   9.7140  222.150   15.420  209.753   12.508   73.675   2.5716   71.633   2.1445 2.041733 3.348410 
1 1 1   13    5  -59 o   33.860   2.6718   47.159   7.3146   65.684   11.672   35.180   9.3862   39.871   3.6312   28.999   4.0837 10.87212 5.464683 
1 1 1   13    5  -58 o   83.161   1.7998  282.240   12.201  287.411   15.184  272.820   20.494   83.861   2.2232   81.600   3.0867 2.261078 3.803967 
1 1 1   13    5  -57 o   71.619   1.8952  209.497   11.055  219.337   13.806  191.918   18.453   73.246   2.3153   68.394   3.3198 4.851700 4.047403 
1 1 1   13    5  -56 o  100.166   1.7095  409.383   13.958  394.901   17.145  437.851   24.038   98.348   2.1386  103.450   2.8533 -5.101845 3.565800 
1 1 1   13    5  -55 o   75.899   1.6540  235.025   10.233  239.590   14.423  230.397   14.520   76.562   2.3137   75.072   2.3758 1.490440 3.316285 
1 1 1   13    5  -54 o   9.7720   4.2903  -1.7031   6.5718  -0.0160   9.7601  -3.1023   8.8886   12.653   5.3892   11.116   4.9299 1.537066 7.303928 
1 1 1   13    5  -53 o  119.167   1.4505  579.191   14.090  573.989   20.571  583.788   19.339  118.584   2.1281  119.604   1.9836 -1.019669 2.909188 
1 1 1   13    5  -52 o   92.230   1.4956  346.942   11.244  348.144   16.529  345.906   15.341   92.352   2.1956   92.064   2.0442 0.2880325 2.999947 
1 1 1   13    5  -51 o   27.901   3.2480   32.255   7.2492   35.338   11.094   29.958   9.5765   28.956   4.8730   26.659   4.5712 2.296181 6.681511 
1 1 1   13    5  -50 o   49.559   2.5073  100.539   10.096   77.830   16.458  114.241   12.784   43.305   4.7396   52.791   2.9828 -9.486530 5.600121 
1 1 1   13    5  -49 o   60.674   1.7845  150.308   8.8162  141.843   13.284  156.970   11.786   58.864   2.7764   61.968   2.3374 -3.103447 3.629286 
1 1 1   13    5  -48 o   77.405   1.6164  244.372   10.199  255.893   15.398  235.367   13.613   79.139   2.3897   75.910   2.2023 3.228851 3.249734 
1 1 1   13    5  -47 o  244.303   1.7855  2434.57   35.558  2365.91   50.061  2504.48   50.514  240.729   2.5512  247.686   2.5019 -6.957428 3.573258 
1 1 1   13    5  -46 o   77.222   1.8440  243.254   11.607  241.434   15.670  245.467   17.278   76.865   2.5043   77.485   2.7398 -0.6201019 3.711897 
1 1 1   13    5  -45 o  152.518   1.5938  948.657   19.815  1001.98   31.795  914.794   25.336  156.677   2.4895  149.739   2.0757 6.938141 3.241356 
1 1 1   13    5  -44 o  126.669   1.6682  654.365   17.224  683.989   26.086  631.466   22.935  129.454   2.4720  124.399   2.2617 5.055367 3.350561 
1 1 1   13    5  -43 o   55.670   2.2359  126.655   10.126  133.074   16.000  122.367   13.078   56.961   3.4623   54.663   2.9459 2.298779 4.545996 
1 1 1   13    5  -42 o  106.156   1.9393  459.662   16.781  417.536   30.019  478.810   20.239  101.007   3.6520  108.327   2.2920 -7.320320 4.311653 
1 1 1   13    5  -41 o  171.621   1.9948  1201.44   27.907  1139.11   47.326  1234.66   34.554  166.972   3.4772  173.943   2.4370 -6.971207 4.246114 
1 1 1   13    5  -40 o   82.611   2.3254  278.667   15.644  213.157   41.143  289.739   16.914   71.613   7.1432   84.227   2.4662 -12.61460 7.556903 
1 1 1   13    5  -39 o   96.461   2.0862  379.564   16.403  327.044   25.404  417.120   21.482   89.402   3.4926  101.063   2.6098 -11.66039 4.359998 
1 1 1   13    5  -38 o   54.543   2.4057  121.623   10.669  105.838   19.474  128.393   12.754   50.623   4.7755   56.013   2.8022 -5.390217 5.536966 
1 1 1   13    5  -37 o  120.679   1.6138  593.864   15.875  585.826   25.473  598.968   20.298  119.810   2.6082  121.177   2.0550 -1.366829 3.320513 
1 1 1   13    5  -36 o  152.611   1.6265  949.723   20.234  938.800   32.199  956.852   26.012  151.672   2.6043  153.158   2.0835 -1.486649 3.335208 
1 1 1   13    5  -35 o   42.486   2.5647   73.928   8.8410   56.585   15.147   82.889   10.888   36.812   5.1918   44.961   2.9878 -8.148739 5.990170 
1 1 1   13    5  -34 o   35.864   2.8935   52.844   8.3874   56.721   14.902   51.046   10.147   36.876   5.0934   35.167   3.5901 1.708267 6.231508 
1 1 1   13    5  -33 o  136.206   1.5724  756.459   17.458  766.227   28.068  750.295   22.296  137.036   2.5127  135.630   2.0167 1.405273 3.221903 
1 1 1   13    5  -32 o  210.150   1.7694  1800.94   30.311  1806.83   47.629  1796.93   39.296  210.410   2.7769  209.877   2.2969 0.5330658 3.603769 
1 1 1   13    5  -31 o  223.708   1.8187  2040.85   33.165  2019.73   51.524  2055.80   43.336  222.457   2.8414  224.482   2.3683 -2.024628 3.698933 
1 1 1   13    5  -30 o   78.409   1.7032  250.699   10.886  240.081   17.904  256.927   13.712   76.643   2.8709   79.339   2.1221 -2.695229 3.570059 
1 1 1   13    5  -29 o  173.682   1.6285  1230.00   23.056  1205.80   35.972  1246.87   30.037  171.910   2.5670  174.843   2.1075 -2.933380 3.321329 
1 1 1   13    5  -28 o  102.120   1.5720  425.204   13.086  409.666   21.173  434.808   16.646  100.168   2.5952  103.254   1.9777 -3.086029 3.262902 
1 1 1   13    5  -27 o  104.030   1.5667  441.258   13.286  430.271   21.453  448.094   16.922  102.693   2.5627  104.820   1.9804 -2.127525 3.238796 
1 1 1   13    5  -26 o  213.492   1.7685  1858.59   30.776  1814.57   47.420  1890.62   40.453  210.874   2.7587  215.287   2.3052 -4.412109 3.595005 
1 1 1   13    5  -25 o  181.703   1.6521  1346.21   24.471  1358.33   38.759  1338.18   31.555  182.461   2.6060  181.134   2.1371 1.327042 3.370214 
1 1 1   13    5  -24 o  193.869   1.8520  1532.68   29.268  1559.19   42.441  1508.64   40.415  195.483   2.6634  192.295   2.5784 3.188293 3.706965 
1 1 1   13    5  -23 o   96.257   1.7609  377.809   13.817  388.840   20.488  368.607   18.713   97.592   2.5777   95.027   2.4177 2.564934 3.534117 
1 1 1   13    5  -22 o   41.202   2.7807   69.586   9.2847   67.224   13.861   71.508   12.505   40.332   4.2813   41.679   3.7197 -1.346264 5.671456 
1 1 1   13    5  -21 o  135.952   1.6910  753.631   18.740  750.554   27.134  756.438   25.913  135.642   2.4541  136.178   2.3344 -0.5364075 3.387024 
1 1 1   13    5  -20 o  105.145   1.4434  450.732   12.371  437.608   18.011  462.454   17.022  103.584   2.1331  106.490   1.9609 -2.905540 2.897444 
1 1 1   13    5  -19 o  134.262   1.6318  734.995   17.859  692.077   25.104  778.976   25.412  130.255   2.3643  138.197   2.2559 -7.940948 3.267863 
1 1 1   13    5  -18 o  261.759   2.1248  2794.43   45.337  2743.47   63.766  2846.52   64.472  259.276   3.0171  264.103   2.9948 -4.827271 4.251054 
1 1 1   13    5  -17 o  187.753   1.6674  1437.33   25.519  1393.58   33.748  1495.73   38.996  184.845   2.2398  191.482   2.4983 -6.637405 3.355355 
1 1 1   13    5  -16 o  164.961   1.5939  1109.49   21.433  1165.24   29.658  1048.55   31.009  169.029   2.1525  160.331   2.3726 8.698410 3.203525 
1 1 1   13    5  -15 o  131.412   1.5539  704.082   16.645  685.899   22.364  726.667   24.924  129.685   2.1155  133.476   2.2908 -3.791229 3.118183 
1 1 1   13    5  -14 o  171.643   1.6203  1201.20   22.671  1179.71   30.174  1229.05   34.352  170.075   2.1765  173.581   2.4278 -3.506134 3.260610 
1 1 1   13    5  -13 o  210.057   1.7575  1799.14   30.094  1782.07   39.951  1821.52   45.755  209.023   2.3448  211.301   2.6564 -2.277954 3.543242 
1 1 1   13    5  -12 o   84.062   1.7819  288.133   12.210  289.767   15.513  285.472   19.794   84.258   2.2607   83.592   2.9094 0.6665955 3.684460 
1 1 1   13    5  -11 o  110.187   1.5684  495.007   14.088  463.634   18.887  534.352   21.150  106.621   2.1731  114.461   2.2669 -7.839668 3.140222 
1 1 1   13    5  -10 o  268.180   2.1585  2933.17   47.186  2893.74   66.302  2973.64   67.169  266.286   3.0545  269.937   3.0526 -3.651215 4.318361 
1 1 1   13    5   -9 o  137.104   1.5218  766.376   17.007  730.457   25.855  793.773   22.580  133.822   2.3702  139.517   1.9854 -5.695297 3.091866 
1 1 1   13    5   -8 o  256.750   1.9428  2688.12   40.660  2644.38   61.769  2721.57   54.012  254.564   2.9767  258.293   2.5653 -3.729126 3.929587 
1 1 1   13    5   -7 o  172.882   1.6054  1218.59   22.624  1250.50   35.497  1196.76   29.361  175.088   2.4871  171.305   2.1026 3.783051 3.256783 
1 1 1   13    5   -6 o  108.632   1.5183  481.122   13.445  492.799   21.238  473.313   17.368  109.917   2.3703  107.735   1.9777 2.182655 3.087013 
1 1 1   13    5   -5 o  166.016   1.5839  1123.70   21.435  1143.11   33.502  1110.25   27.891  167.404   2.4551  164.999   2.0737 2.404770 3.213641 
1 1 1   13    5   -4 o  153.631   1.4840  962.261   18.585  953.412   26.979  970.253   25.638  152.897   2.1646  154.247   2.0390 -1.349945 2.973766 
1 1 1   13    5   -3 o  146.722   1.4620  877.654   17.486  874.798   25.552  880.168   23.979  146.459   2.1403  146.914   2.0023 -0.4544830 2.930932 
1 1 1   13    5   -2 o  169.741   1.6211  1174.72   22.430  1197.97   35.938  1159.89   28.707  171.367   2.5727  168.646   2.0882 2.720398 3.313532 
1 1 1   13    5   -1 o   69.738   1.7803  198.430   10.112  212.270   17.336  191.293   12.449   72.065   2.9574   68.450   2.2342 3.615074 3.706429 
1 1 1   13    5    0 o   75.653   1.7206  233.361   10.610  242.371   17.970  228.538   13.147   77.019   2.8673   74.827   2.1576 2.191612 3.588433 
1 1 1   13    5    1 o  125.174   1.5571  638.820   15.888  620.738   25.589  650.164   20.268  123.357   2.5449  126.269   1.9691 -2.911987 3.217737 
1 1 1   13    5    2 o  156.054   1.4902  992.852   18.956  950.532   27.275  1032.39   26.364  152.665   2.1917  159.110   2.0327 -6.445068 2.989221 
1 1 1   13    5    3 o   63.888   1.8601  166.577   9.6768  160.411   15.856  170.237   12.216   62.618   3.1161   64.563   2.3249 -1.945690 3.887861 
1 1 1   13    5    4 o  167.866   1.7086  1148.96   23.380  1173.01   41.067  1137.43   28.439  169.547   2.9714  167.005   2.0890 2.541412 3.632274 
1 1 1   13    5    5 o  260.567   2.3155  2769.24   49.180  2697.97  108.156  2787.81   55.219  256.823   5.1663  261.416   2.5913 -4.593262 5.779772 
1 1 1   13    5    6 o  277.258   2.2102  3135.17   49.952  3026.58   84.870  3192.72   61.788  272.234   3.8245  279.745   2.7096 -7.510315 4.687066 
1 1 1   13    5    7 o  180.006   1.6374  1321.11   24.026  1344.16   37.432  1304.95   31.332  181.524   2.5297  178.879   2.1488 2.645142 3.319171 
1 1 1   13    5    8 o  166.346   1.6028  1128.19   21.734  1119.77   33.497  1134.31   28.562  165.684   2.4802  166.775   2.1010 -1.091858 3.250459 
1 1 1   13    5    9 o  124.002   1.6593  626.937   16.772  615.868   24.309  636.995   23.171  122.876   2.4270  124.972   2.2746 -2.095901 3.326248 
1 1 1   13    5   10 o  356.823   2.4611  5193.67   71.585  5223.23  110.211  5172.09   94.148  357.635   3.7805  355.972   3.2446 1.663025 4.981923 
1 1 1   13    5   11 o  144.873   1.8254  855.811   21.556  800.768   33.551  894.503   28.130  140.085   2.9382  148.090   2.3303 -8.004730 3.750082 
1 1 1   13    5   12 o  219.665   1.9397  1967.68   34.732  1998.33   61.487  1953.32   42.091  221.249   3.4093  218.835   2.3596 2.414551 4.146209 
1 1 1   13    5   13 o  235.005   2.4421  2252.79   46.782   0.0000   0.0000  2252.79   46.782  ?   ?   235.005   2.4421 0.000000 2.442106 
1 1 1   13    5   14 o  129.793   1.6628  686.872   17.592  678.204   31.540  690.787   21.196  128.915   3.0014  130.151   1.9979 -1.236008 3.605524 
1 1 1   13    5   15 o  184.429   1.7896  1386.95   26.904  1449.02   48.579  1359.49   32.312  188.421   3.1629  182.575   2.1711 5.845947 3.836355 
1 1 1   13    5   16 o   30.505   3.5730   38.513   8.7164   40.261   12.849   37.023   11.863   30.941   5.2842   29.672   5.0880 1.269133 7.335546 
1 1 1   13    5   17 o   68.520   1.7808  191.569   9.9379  194.048   15.978  190.005   12.691   68.902   2.8510   68.214   2.2857 0.6874771 3.654127 
1 1 1   13    5   18 o  124.575   1.8257  632.819   18.540  616.432   24.111  656.523   28.999  122.930   2.4062  126.845   2.8046 -3.915504 3.695325 
1 1 1   13    5   19 o  173.264   1.9294  1224.22   27.250  1228.29   35.693  1218.55   42.193  173.518   2.5235  172.796   2.9955 0.7224121 3.916784 
1 1 1   13    5   20 o  244.273   2.2462  2433.78   44.726  2437.99   58.101  2427.66   70.070  244.422   2.9161  243.833   3.5254 0.5892029 4.575155 
1 1 1   13    5   21 o   23.566   5.6149   23.653   10.632   36.290   16.064   13.803   14.183   29.158   6.8720   19.753   7.0169 9.404936 9.821424 
1 1 1   13    5   22 o   73.148   2.2463  218.448   13.378  224.030   27.212  216.668   15.363   73.887   4.5401   72.829   2.5919 1.058479 5.227869 
1 1 1   13    5   23 o  156.796   1.8621  1002.54   23.800  1014.44   38.236  995.019   30.410  157.659   2.9752  156.180   2.3886 1.479004 3.815403 
1 1 1   13    5   24 o  106.697   1.8222  464.229   15.848  465.841   25.462  463.210   20.249  106.799   2.9275  106.563   2.3311 0.2365417 3.742246 
1 1 1   13    5   25 o  156.245   1.8655  995.526   23.760  1003.79   38.222  990.317   30.333  156.826   2.9899  155.809   2.3883 1.017151 3.826671 
1 1 1   13    5   26 o  218.655   2.1105  1949.98   37.617  1970.19   60.435  1937.19   48.061  219.665   3.3751  217.888   2.7060 1.777222 4.325969 
1 1 1   13    5   27 o   99.326   2.1119  402.381   17.099  419.933   24.642  386.084   23.745  101.389   2.9849   97.212   3.0001 4.176895 4.232041 
1 1 1   13    5   28 o  141.102   2.0852  812.037   23.983  795.903   33.655  828.684   34.186  139.643   2.9566  142.491   2.9432 -2.847672 4.171809 
1 1 1   13    5   29 o  117.246   2.0817  560.677   19.896  576.186   28.601  546.135   27.695  118.814   2.9531  115.638   2.9404 3.176308 4.167362 
1 1 1   13    5   30 o   96.210   2.1369  377.553   16.759  369.762   23.753  385.274   23.648   95.125   3.0673   97.108   2.9910 -1.982956 4.284233 
1 1 1   13    5   31 o   86.301   2.2418  304.018   15.757  324.035   22.648  285.238   21.937   89.036   3.1253   83.521   3.2282 5.515518 4.493210 
1 1 1   13    5   32 o   93.780   1.9047  358.674   14.561  384.763   24.183  343.837   18.237   97.034   3.0612   91.769   2.4401 5.265358 3.914712 
1 1 1   13    5   33 o   43.849   2.9606   78.842   10.520   79.195   18.331   78.669   12.846   43.664   5.2557   43.733   3.6364 -0.6895447E-01 6.391071 
1 1 1   13    5   34 o   76.976   2.1199  241.876   13.289  243.342   22.093  241.046   16.635   77.103   3.5245   76.809   2.6609 0.2940903 4.416119 
1 1 1   13    5   35 o  118.924   1.9001  576.812   18.420  576.848   30.521  576.791   23.101  118.816   3.1541  118.899   2.3835 -0.8264923E-01 3.953437 
1 1 1   13    5   36 o  184.827   2.0145  1393.38   30.350  1435.12   49.804  1368.73   38.279  187.458   3.2593  183.141   2.5641 4.317032 4.146998 
1 1 1   13    5   37 o  173.052   2.2271  1221.74   31.416  1218.38   45.612  1224.78   43.333  172.721   3.2397  173.192   3.0694 -0.4710541 4.462810 
1 1 1   13    5   38 o  215.205   2.4161  1889.77   42.384  1717.35   57.775  2090.71   62.369  205.029   3.4569  226.232   3.3821 -21.20352 4.836185 
1 1 1   13    5   39 o  249.175   2.9790  2534.98   60.508  2621.87  108.824  2496.10   72.798  252.937   5.2781  247.155   3.6134 5.782120 6.396493 
1 1 1   13    5   40 o   46.686   4.0644   89.792   15.314  100.909   29.510   85.695   17.914   48.911   7.6523   45.485   4.9093 3.425484 9.091708 
1 1 1   13    5   41 o  328.957   3.0942  4419.10   82.971  4395.45  166.327  4426.94   95.734  327.096   6.2381  329.142   3.5682 -2.046509 7.186500 
1 1 1   13    5   42 o  124.731   1.9239  634.592   19.561  638.047   32.164  632.564   24.643  124.947   3.1605  124.503   2.4281 0.4445953 3.985545 
1 1 1   13    5   43 o   53.094   2.6635  115.359   11.491   97.229   18.895  125.998   14.475   48.479   4.8464   55.445   3.2165 -6.965588 5.816598 
1 1 1   13    5   44 o  100.698   1.9339  413.635   15.874  413.181   26.053  413.902   20.020  100.519   3.1837  100.705   2.4388 -0.1860123 4.010433 
1 1 1   13    5   45 o   89.563   1.9538  327.237   14.264  309.761   23.145  337.941   18.113   87.007   3.2692   90.960   2.4451 -3.953423 4.082426 
1 1 1   13    5   46 o   76.068   2.0944  236.274   12.974  213.650   21.383  249.457   16.323   72.191   3.6455   78.128   2.5665 -5.936768 4.458289 
1 1 1   13    5   47 o  121.759   1.8490  604.776   18.352  577.459   29.633  621.773   23.374  118.846   3.0613  123.426   2.3232 -4.580101 3.843073 
1 1 1   13    5   48 o   24.359   4.9753   25.223   9.5447   39.002   16.193   17.886   11.816   30.166   6.7537   20.813   6.3695 9.352417 9.283478 
1 1 1   13    5   49 o   59.166   2.8370  143.326   13.643  186.908   19.932  104.908   18.714   67.497   3.6360   50.378   4.6080 17.11933 5.869787 
1 1 1   13    5   50 o   85.398   1.9742  297.573   13.743  320.909   23.349  285.205   16.999   88.540   3.2407   83.539   2.4991 5.001076 4.092350 
1 1 1   13    5   51 o   49.657   2.6820  101.010   10.816  100.193   18.876  101.410   13.197   49.188   4.7676   49.694   3.2761 -0.5065651 5.784728 
1 1 1   13    5   52 o  138.083   1.8659  777.973   21.003  786.479   34.385  772.911   26.526  138.711   3.0410  137.588   2.3651 1.122940 3.852492 
1 1 1   13    5   53 o  122.380   1.8498  611.103   18.454  594.886   30.227  620.739   23.299  120.586   3.0776  123.301   2.3181 -2.714912 3.853003 
1 1 1   13    5   54 o   48.899   2.6499   97.977   10.523   75.354   17.960  109.801   12.985   42.473   5.3029   51.727   3.0937 -9.253979 6.139338 
1 1 1   13    5   55 o   63.891   2.2320  166.876   11.607  174.386   20.239  163.195   14.168   65.128   3.8293   63.131   2.7598 1.996986 4.720114 
1 1 1   13    5   56 o  142.503   2.0761  829.014   24.117  838.537   35.463  820.820   32.893  143.187   3.0384  141.696   2.8478 1.490860 4.164349 
1 1 1   13    5   57 o  118.805   2.1867  576.351   21.177  517.002   33.293  616.682   27.445  112.279   3.6424  122.826   2.7411 -10.54762 4.558622 
1 1 1   13    5   58 o   93.294   2.2508  355.473   17.117  372.582   28.853  346.181   21.263   95.272   3.7224   91.968   2.8396 3.304596 4.681833 
1 1 1   13    5   59 o   91.803   2.0015  344.080   14.978  344.103   28.163  344.071   17.687   91.530   3.7828   91.741   2.3671 -0.2107697 4.462390 
1 1 1   13    5   60 o   24.614   4.9271   25.827   9.5407   64.565   21.155   15.936   10.690   38.837   6.9368   19.628   6.0677 19.20933 9.216097 
1 1 1   13    5   61 o  105.577   1.7739  454.970   15.267  424.510   23.443  477.401   20.117  101.827   2.8270  108.095   2.2831 -6.268646 3.633821 
1 1 1   13    5   62 o   37.449   3.0680   57.805   9.2835   45.912   15.695   64.206   11.514   32.762   6.1013   39.399   3.6257 -6.637352 7.097299 
1 1 1   13    5   63 o   95.429   1.8228  371.809   14.180  407.421   23.007  349.997   18.006   99.732   2.8329   92.499   2.3900 7.233337 3.706414 
1 1 1   13    5   64 o   30.186   3.8649   38.038   9.2919   34.989   16.332   39.497   11.299   28.363   7.0852   30.608   4.6767 -2.244373 8.489510 
1 1 1   13    5   65 o  120.387   1.8046  591.838   17.709  598.934   27.692  586.928   23.034  120.942   2.8090  119.806   2.3586 1.136368 3.667902 
1 1 1   13    5   66 o   44.804   2.8689   82.572   10.423   48.413   17.911  100.063   12.816   33.414   6.8072   49.287   3.2075 -15.87277 7.524980 
1 1 1   13    5   67 o  133.285   1.7898  725.618   19.445  734.923   29.900  718.797   25.598  133.943   2.7385  132.550   2.3692 1.393570 3.621114 
1 1 1   13    5   68 o   51.902   3.4369  111.197   14.459   93.781   22.789  122.931   18.706   46.985   6.0936   54.407   4.2516 -7.422436 7.430166 
1 1 1   13    5   69 o   63.922   2.5580  167.633   13.302  188.070   18.158  143.964   19.541   67.568   3.3068   58.919   4.0941 8.649044 5.262808 
1 1 1   13    5   70 o   69.514   2.3680  198.077   13.399  203.193   17.931  191.611   20.161   70.257   3.1389   68.103   3.6449 2.154137 4.810260 
1 1 1   13    5   71 o   38.742   2.7444   61.881   8.6108   61.632   14.777   62.008   10.596   38.207   4.8540   38.666   3.3962 -0.4584274 5.924180 
1 1 1   13    5   72 o   63.640   2.0115  165.868   10.422  168.143   17.168  164.540   13.115   63.816   3.3115   63.293   2.5473 0.5225449 4.177921 
1 1 1   13    5   73 o   34.134   2.8199   48.191   7.7764   42.959   11.992   51.988   10.215   31.770   4.7785   35.307   3.5997 -3.536478 5.982601 
1 1 1   13    5   74 o   73.203   1.8661  219.379   11.126  202.125   17.231  231.717   14.571   70.008   3.0265   75.131   2.3822 -5.122658 3.851609 
1 1 1   13    5   75 o   82.529   1.7717  278.635   11.919  287.023   18.710  272.907   15.462   83.499   2.7527   81.534   2.3288 1.965401 3.605611 
1 1 1   13    5   76 o   52.952   2.1336  115.129   9.1906  135.410   15.174  103.379   11.550   57.161   3.2703   50.027   2.8440 7.133682 4.333982 
1 1 1   13    5   77 o   97.406   1.8392  388.488   14.603  374.109   21.111  401.682   20.222   95.288   2.7207   98.818   2.5125 -3.529732 3.703329 
1 1 1   13    5   78 o   72.291   1.9749  214.373   11.627  212.235   14.696  217.949   19.009   71.786   2.5154   72.507   3.2242 -0.7208099 4.089312 
1 1 1   13    5   79 o   46.313   1.9100   88.072   7.1952   98.339   12.529   83.020   8.7891   48.634   3.1778   44.863   2.4122 3.771141 3.989601 
1 1 1   13    5   80 o   11.080   4.2315   3.6797   5.3186   6.3934   10.923   2.8364   6.0891   15.195   5.9907   11.140   4.4467 4.055379 7.460683 
1 1 1   13    5   81 o   62.474   1.8556  160.202   9.4393  156.276   15.355  162.587   11.968   61.325   3.0815   62.807   2.3417 -1.482304 3.870293 
1 1 1   13    5   82 o   31.738   2.2743   41.665   5.8447   19.238   12.402   48.067   6.6267   20.832   6.5508   34.073   2.4013 -13.24041 6.977005 
1 1 1   13    5   83 o   37.146   2.1327   56.937   6.4306   25.329   14.386   64.830   7.1888   23.502   6.9929   39.622   2.2348 -16.12034 7.341329 
1 1 1   13    5   84 o   12.693   4.1307   6.6331   4.8996   20.731   11.861   3.7328   5.3800   21.392   6.3460   11.104   4.2521 10.28749 7.638887 
1 1 1   13    5   85 o   37.022   1.8816   56.453   5.6598   48.717   11.431   58.966   6.5143   33.652   4.2627   37.785   2.1235 -4.133118 4.762381 
1 1 1   13    5   86 o   55.989   2.2574  129.520   10.281  119.682   12.539  149.706   17.961   53.588   2.8811   59.526   3.7203 -5.938110 4.705463 
1 1 1   13    5   87 o   31.106   3.5512   41.159   8.8434   47.136   11.034   30.423   14.788   33.058   4.1885   25.366   6.9482 7.692476 8.113029 
1 1 1   13    5   88 o   20.864   5.5339   19.845   9.5647   23.264   10.417   1.4738   24.148   22.538   5.6744   18.490   8.1669 4.047771 9.944674 
1 1 1   13    5   89 o   42.887   3.0546   77.219   10.609   74.060   11.567   93.945   26.619   41.842   3.4213   44.264   7.6543 -2.421772 8.384074 
1 1 1   13    5   90 o   31.872   3.9626   43.803   10.073   42.953   10.961   48.420   25.555   31.359   4.4095   30.268   9.3861 1.091728 10.37024 
1 1 1   13    5   91 o   32.161   3.6994   44.373   9.5220   41.120   12.143   49.566   15.344   30.291   5.0987   32.818   5.9551 -2.526209 7.839652 
1 1 1   13    5   92 o   13.873   5.2892   6.6771   8.3009   15.108   10.406  -8.0765   13.765   18.311   6.0235   12.436   5.7540 5.874134 8.330114 
1 1 1   13    5   93 o   69.177   2.2414  198.513   12.623  173.747   16.276  235.889   19.995   64.188   3.1201   74.672   3.2930 -10.48374 4.536405 
1 1 1   13    5   94 o   29.182   3.9279   37.150   9.1063   31.623   12.662   43.073   13.106   25.748   6.1227   30.597   5.4550 -4.849789 8.200253 
1 1 1   13    5   95 o   25.344   4.1045   28.423   8.1897   26.788   10.621   30.821   12.863   23.861   5.5634   25.216   6.2814 -1.355362 8.390880 
1 1 1   13    5   96 o   34.185   3.1506   49.919   8.6805   38.632   11.131   67.440   13.868   29.135   4.8577   38.946   4.4479 -9.811049 6.586419 
1 1 1   13    5   97 o   15.968   5.3364   11.536   8.1588   4.3671   10.363   23.226   13.233   13.591   5.6562   21.486   6.7679 -7.895383 8.820313 
1 1 1   13    5   98 o   46.285   2.5240   90.151   9.4869   79.207   12.095  107.649   15.293   42.759   3.5008   49.622   3.8100 -6.863216 5.174200 
1 1 1   13    5   99 o   22.583   4.6699   23.651   8.3128   18.905   10.684   30.932   13.233   19.543   6.0703   24.640   6.4969 -5.096472 8.891457 
1 1 1   13    5  100 o   39.096   2.8456   65.228   9.0066   61.460   11.617   70.903   14.259   37.239   3.8842   39.490   4.5105 -2.250526 5.952463 
1 1 1   13    5  101 o   15.228   5.3295   10.614   8.1586   11.615   10.694   9.2194   12.620   16.062   6.0303   15.599   6.3395 0.4625435 8.749561 
1 1 1   13    5  102 o   19.057   5.3629   17.949   8.6804   17.945   11.696   17.955   12.951   18.667   6.3887   18.635   6.6957 0.3218842E-01 9.254601 
1 1 1   13    5  103 o   10.544   4.7407  -1.5506   8.5201  -8.7556   11.677   6.6516   12.459   10.694   5.0593   14.590   6.1456 -3.895185 7.960247 
1 1 1   13    5  104 o   7.3906   3.6695 -17.9975   8.4896 -10.1013   11.711 -26.7431   12.325   10.451   4.9793   8.6564   4.3179 1.794711 6.590714 
1 1 1   13    5  105 o   13.752   5.3670   7.6106   8.6918  -2.2723   11.740   19.600   12.930   11.949   5.4485   19.045   6.7060 -7.095494 8.640388 
1 1 1   13    5  106 o   15.123   5.5038   10.737   8.7865   11.017   11.829   10.393   13.123   15.689   6.2188   15.713   6.4347 -0.2387238E-01 8.948668 
1 1 1   13    5  107 o   20.999   5.5930   22.658   9.7443   13.212   12.313   38.491   15.941   16.459   6.3979   25.715   7.2784 -9.255335 9.690623 
1 1 1   13    5  108 o   33.493   3.8754   51.046   10.386   43.618   13.362   62.381   16.506   29.127   5.8313   34.688   6.0580 -5.560738 8.408504 
1 1 1   13    5  109 o   17.945   6.3336   17.313   11.539   26.944   16.930   8.9568   15.769   20.874   7.6333   15.649   6.7604 5.225601 10.19657 
1 1 1   13    5  110 o   9.9936   4.7832 -10.0806   11.073 -14.1152   16.143  -6.4963   15.216   11.654   5.6283   12.388   5.8345 -0.7333927 8.106709 
1 1 1   13    5  111 f   9.6296   4.6542 -12.3257   11.093 -14.8892   16.112 -10.0150   15.297   11.512   5.5748   11.849   5.6578 -0.3369284 7.942835 
1 1 1   13    5  112 o   10.359   5.0267 -14.5642   13.274  -5.4652   16.496 -31.2771   22.357   12.919   6.0815   11.990   5.9536 0.9281445 8.510547 
1 1 1   13    5  113 o   16.071   6.5586   12.602   13.575   13.995   16.640   9.8301   23.474   16.757   7.0827   16.704   7.6500 0.5288315E-01 10.42529 
1 1 1   13    5  114 o   15.248   6.7589   7.7438   16.685   7.7438   16.685   0.0000   0.0000   15.248   6.7589  ?   ?  0.000000 6.758933 
1 1 1   13    5  115 o   21.898   7.7341   31.613   17.209   31.613   17.209   0.0000   0.0000   21.898   7.7341  ?   ?  0.000000 7.734121 
1 1 1   13    5  116 o   12.409   5.9242  -9.0279   16.752  -9.0279   16.752   0.0000   0.0000   12.409   5.9242  ?   ?  0.000000 5.924181 
1 1 1   13    6 -114 o   17.358   7.8852   14.287   24.300   0.0000   0.0000   14.287   24.300  ?   ?    17.358   7.8852 0.000000 7.885226 
1 1 1   13    6 -113 o   12.394   5.5500   1.3455   11.550   8.1161   13.170 -21.2066   24.037   14.611   6.2429   13.131   6.4546 1.480359 8.979747 
1 1 1   13    6 -112 o   14.361   5.9922   8.3304   11.674   4.4351   13.326   21.180   24.204   13.705   6.0594   18.447   8.1606 -4.741916 10.16429 
1 1 1   13    6 -111 o   9.8090   4.7466 -12.5355   11.626 -12.8429   13.318 -11.5510   23.834   10.553   5.1002   14.012   6.7844 -3.459465 8.487593 
1 1 1   13    6 -110 o   11.577   5.3415  -2.8425   11.742  -2.1303   13.522  -5.0254   23.675   12.418   5.7305   14.745   7.0401 -2.326313 9.077501 
1 1 1   13    6 -109 o   11.300   5.1402  -1.4763   10.368  -0.6196   12.808  -3.1050   17.660   12.499   5.6960   13.616   6.3724 -1.117542 8.547053 
1 1 1   13    6 -108 o   28.741   5.5313   42.129   12.489   48.129   14.010   18.917   27.555   30.388   5.8685   18.547   8.4140 11.84131 10.25837 
1 1 1   13    6 -107 o   14.969   5.9512   10.022   10.864   15.266   13.573   0.6730   18.123   17.082   6.6950   14.448   6.6552 2.633510 9.440032 
1 1 1   13    6 -106 o   15.735   6.0112   11.981   10.735   21.699   13.343  -5.8546   18.077   19.517   6.8167   13.463   6.3463 6.054431 9.313597 
1 1 1   13    6 -105 o   29.607   4.7276   41.988   11.026   40.766   13.810   44.137   18.312   27.622   6.2764   26.648   7.8800 0.9745331 10.07409 
1 1 1   13    6 -104 o   17.442   6.0278   15.811   10.420   5.2089   12.818   36.466   17.892   14.073   6.0874   24.123   7.8963 -10.05037 9.970355 
1 1 1   13    6 -103 o   12.343   5.5733  -0.6769   11.923   9.3210   16.530 -11.5169   17.212   16.059   6.9295   12.524   5.9861 3.534522 9.157005 
1 1 1   13    6 -102 o   18.032   6.4542   17.031   12.021   34.273   17.207   0.5924   16.802   23.815   7.7404   14.355   6.5350 9.459573 10.13012 
1 1 1   13    6 -101 o   11.181   5.2461  -6.9740   12.098 -11.8485   16.908  -1.8603   17.317   12.443   5.9434   14.114   6.5028 -1.670686 8.809675 
1 1 1   13    6 -100 o   30.256   5.3640   44.670   12.745   48.869   17.846   40.300   18.208   29.413   7.4395   25.971   7.8988 3.442114 10.85069 
1 1 1   13    6  -99 o   10.824   5.1102  -8.5541   11.800 -16.8892   16.273   0.6875   17.135   11.644   5.6302   14.676   6.6489 -3.031659 8.712454 
1 1 1   13    6  -98 o   9.1473   4.4073 -11.8778   9.7605 -22.2949   12.095   7.5712   16.527   9.0733   4.4825   16.094   6.9367 -7.021103 8.258979 
1 1 1   13    6  -97 o   25.449   4.8510   30.320   9.6959   30.419   11.590   30.090   17.698   24.797   5.8322   23.095   7.8598 1.702131 9.787246 
1 1 1   13    6  -96 o   13.817   4.9882   8.0136   7.1981   24.532   12.371  -0.4403   8.8504   21.917   6.4758   11.214   4.9490 10.70276 8.150320 
1 1 1   13    6  -95 o   36.205   3.2408   56.454   9.4634   53.984   13.667   58.728   13.116   34.148   5.0632   36.021   4.5697 -1.873253 6.820395 
1 1 1   13    6  -94 o   12.856   5.2557   4.3484   8.7361  -8.0393   12.636   15.692   12.092   11.604   5.4176   18.279   6.4804 -6.674483 8.446630 
1 1 1   13    6  -93 o   19.756   5.3629   18.424   8.8561   23.138   12.967   14.303   12.124   21.575   6.6852   17.825   6.4684 3.750299 9.302279 
1 1 1   13    6  -92 o   8.7613   4.2076 -11.1415   8.7310 -11.7102   10.956 -10.1518   14.453   10.095   4.8114   12.245   5.7416 -2.149703 7.491065 
1 1 1   13    6  -91 o   19.439   5.4837   17.641   9.0644   21.006   11.185   11.202   15.472   20.967   6.1473   17.643   7.0727 3.324104 9.370817 
1 1 1   13    6  -90 o   10.931   4.6689   0.8183   7.3618 -10.0804   10.699   10.619   10.146   10.291   4.8606   16.141   5.9080 -5.849946 7.650461 
1 1 1   13    6  -89 o   21.545   4.4811   20.770   7.6132   18.920   11.099   22.414   10.463   20.130   6.1757   21.904   5.7776 -1.774452 8.456978 
1 1 1   13    6  -88 o   10.732   4.6017   0.4408   7.2024  -4.3366   10.398   4.8476   9.9862   11.377   5.1644   13.882   5.6402 -2.504561 7.647358 
1 1 1   13    6  -87 o   20.147   4.6037   18.184   7.3947   17.832   10.647   18.512   10.278   19.709   6.0490   20.047   5.8970 -0.3374844 8.447850 
1 1 1   13    6  -86 o   23.853   4.2363   24.963   7.9353   19.138   10.665   32.186   11.877   20.392   6.0092   26.524   5.6653 -6.131887 8.258755 
1 1 1   13    6  -85 o   26.987   3.7087   31.284   7.9429   31.814   10.614   30.609   11.974   26.668   5.0680   25.812   5.8293 0.8561172 7.724315 
1 1 1   13    6  -84 f   56.864   2.1672  133.579   10.027  133.824   13.103  133.233   15.576   56.642   2.8471   56.237   3.4140 0.4050064 4.445365 
1 1 1   13    6  -83 o   54.753   2.2645  123.941   10.085  122.880   12.863  125.634   16.249   54.266   2.9186   54.504   3.6789 -0.2377243 4.695972 
1 1 1   13    6  -82 o   9.3706   4.3593  -6.5500   8.0670 -18.1251   10.652   9.0150   12.353   9.0786   4.4274   16.504   6.4103 -7.425830 7.790625 
1 1 1   13    6  -81 o   15.408   5.3140   9.6233   8.0967   13.660   10.695   4.2036   12.393   17.965   6.1099   14.960   6.2023 3.005209 8.706299 
1 1 1   13    6  -80 o   38.483   2.6884   61.565   8.3803   59.881   11.863   63.242   11.840   37.536   3.9356   38.634   3.8092 -1.097794 5.477114 
1 1 1   13    6  -79 f   45.059   2.3699   83.899   8.6739   83.346   12.293   84.447   12.240   44.586   3.4083   44.895   3.3693 -0.3091774 4.792597 
1 1 1   13    6  -78 o   57.912   2.0073  137.902   9.4617  160.264   13.405  115.699   13.357   62.239   2.6482   52.706   3.1229 9.533207 4.094615 
1 1 1   13    6  -77 o   43.379   2.6038   77.897   9.1649   71.918   11.980   86.337   14.232   41.387   3.5863   45.259   3.8955 -3.872250 5.294919 
1 1 1   13    6  -76 o   14.111   5.2431   6.8308   8.0415   26.993   12.861  -6.1117   10.304   24.460   6.3836   11.113   5.0814 13.34743 8.159081 
1 1 1   13    6  -75 o   29.959   3.5676   37.805   8.5413   27.887   12.778   45.816   11.484   24.924   6.2901   32.763   4.4121 -7.838461 7.683210 
1 1 1   13    6  -74 o   71.423   1.9411  209.210   11.290  222.296   17.102  199.101   15.032   73.358   2.8655   69.485   2.6588 3.873390 3.908978 
1 1 1   13    6  -73 o   50.288   2.3575  104.080   9.6370   95.908   14.585  110.411   12.839   47.906   3.7652   51.629   3.0645 -3.722504 4.854630 
1 1 1   13    6  -72 o   61.605   2.0931  155.728   10.495  149.822   16.034  160.156   13.883   60.128   3.2839   62.327   2.7392 -2.199078 4.276343 
1 1 1   13    6  -71 o   61.212   2.4701  154.078   12.300  158.842   28.475  152.985   13.638   60.970   5.7993   60.930   2.7530 0.3998947E-01 6.419562 
1 1 1   13    6  -70 o   11.515   5.1033  -2.8136   9.5074 -43.1184   23.184   5.3350   10.424   13.046   6.3978   14.723   5.8373 -1.677384 8.660576 
1 1 1   13    6  -69 f   42.451   3.1303   74.587   10.756   97.500   26.384   70.020   11.779   47.262   7.0650   41.031   3.5569 6.230583 7.909817 
1 1 1   13    6  -68 o   22.191   5.1690   21.383   9.1757   11.863   16.992   25.301   10.902   19.597   7.5434   24.083   5.6512 -4.485601 9.425415 
1 1 1   13    6  -67 o   25.664   4.3454   28.014   8.7663   18.251   13.832   34.569   11.333   21.061   6.9454   28.393   5.0834 -7.331497 8.606990 
1 1 1   13    6  -66 o   12.121   4.6067   4.3518   6.2843  -2.4626   10.358   8.3207   7.9053   12.216   5.3740   14.955   5.2452 -2.739311 7.509475 
1 1 1   13    6  -65 o   89.701   1.4931  328.524   10.917  320.202   16.474  335.041   14.579   88.424   2.2874   90.527   1.9756 -2.102867 3.022485 
1 1 1   13    6  -64 o   82.632   1.5544  278.799   10.470  279.989   15.897  277.887   13.913   82.678   2.3613   82.414   2.0727 0.2642517 3.141937 
1 1 1   13    6  -63 o  114.150   1.4735  531.889   13.711  530.129   20.279  533.372   18.609  113.857   2.1850  114.236   1.9984 -0.3789673 2.961057 
1 1 1   13    6  -62 o   63.180   1.8599  163.206   9.5682  172.313   14.835  156.718   12.521   64.791   2.8156   61.833   2.4892 2.958351 3.758140 
1 1 1   13    6  -61 o   32.541   3.0323   43.773   7.9506   51.937   12.298   37.912   10.421   35.228   4.3769   30.015   4.3890 5.212618 6.198406 
1 1 1   13    6  -60 o   78.769   1.8363  253.377   11.790  268.798   15.877  234.417   17.605   81.038   2.4062   75.605   2.8617 5.433014 3.738851 
1 1 1   13    6  -59 o  110.016   2.0208  494.419   18.123  524.283   25.243  462.655   26.034  113.184   2.7361  106.236   3.0093 6.947815 4.067172 
1 1 1   13    6  -58 o   61.340   1.8507  153.767   9.2433  162.845   14.758  147.906   11.857   63.008   2.8810   60.100   2.4253 2.908203 3.765915 
1 1 1   13    6  -57 o   76.090   1.6832  236.306   10.440  239.127   15.085  233.712   14.464   76.447   2.4237   75.584   2.3504 0.8626251 3.376230 
1 1 1   13    6  -56 o   41.754   2.3736   71.474   8.0454   91.290   13.101   59.478   10.194   47.072   3.4382   37.958   3.3282 9.113628 4.785202 
1 1 1   13    6  -55 o  123.643   1.5243  623.734   15.363  647.443   24.402  608.165   19.774  125.876   2.3782  122.045   1.9877 3.831009 3.099427 
1 1 1   13    6  -54 o   51.156   2.0419  107.021   8.4975   98.584   13.586  112.443   10.891   48.939   3.4274   52.388   2.5580 -3.449684 4.276672 
1 1 1   13    6  -53 f   62.223   1.9157  158.190   9.7053  158.451   14.608  157.983   12.985   62.177   2.8902   62.121   2.5699 0.5567932E-01 3.867471 
1 1 1   13    6  -52 o  108.043   1.5585  476.236   13.726  500.232   19.459  452.472   19.365  110.683   2.1568  105.257   2.2570 5.425468 3.121767 
1 1 1   13    6  -51 o   71.652   1.7355  209.493   10.136  205.720   14.405  213.193   14.266   70.916   2.4958   72.201   2.4274 -1.285164 3.481591 
1 1 1   13    6  -50 o   34.903   2.8329   50.124   7.9906   49.705   11.678   50.493   10.957   34.553   4.2347   34.881   3.9214 -0.3280754 5.771483 
1 1 1   13    6  -49 o  100.287   1.7269  410.360   14.117  411.171   20.779  409.665   19.240  100.291   2.5437  100.156   2.3566 0.1354141 3.467604 
1 1 1   13    6  -48 o  100.983   1.5855  415.988   13.051  374.814   20.550  443.820   16.896   95.746   2.6355  104.281   1.9876 -8.534630 3.300990 
1 1 1   13    6  -47 o   32.975   3.1373   44.858   8.3312   46.746   13.375   43.661   10.649   33.355   5.0795   32.382   4.1282 0.9733200 6.545461 
1 1 1   13    6  -46 o   60.336   2.1759  148.789   10.684  182.891   23.787  140.171   11.958   66.640   4.4036   58.532   2.5121 8.107964 5.069784 
1 1 1   13    6  -45 o   49.611   2.4700  100.751   9.9576  106.690   21.971   99.215   11.171   50.658   5.4039   49.201   2.7968 1.457508 6.084792 
1 1 1   13    6  -44 o   37.475   3.0409   57.769   9.2093   78.387   21.720   53.250   10.169   43.152   6.3656   35.910   3.5190 7.242188 7.273562 
1 1 1   13    6  -43 f   30.560   3.8233   38.811   9.3163   44.653   13.419   33.375   12.945   32.573   5.2308   27.966   5.8659 4.606878 7.859375 
1 1 1   13    6  -42 o   76.727   1.7226  240.136   10.774  226.402   17.724  248.185   13.568   74.385   2.9288   77.955   2.1372 -3.570549 3.625628 
1 1 1   13    6  -41 o  106.492   1.5772  462.517   13.691  458.633   22.123  464.929   17.430  105.985   2.5607  106.747   2.0031 -0.7616425 3.251113 
1 1 1   13    6  -40 o  108.984   1.5833  484.417   14.066  511.520   23.268  468.806   17.658  111.934   2.5501  107.192   2.0209 4.741669 3.253779 
1 1 1   13    6  -39 o   77.843   1.7615  247.160   11.177  223.259   18.209  261.610   14.158   73.865   3.0306   80.040   2.1721 -6.175018 3.728587 
1 1 1   13    6  -38 o  205.375   1.9102  1720.62   31.978  1792.41   59.820  1691.90   37.839  209.398   3.5046  203.616   2.2798 5.782196 4.180873 
1 1 1   13    6  -37 o  100.850   1.6390  414.789   13.474  439.885   22.581  400.914   16.790  103.767   2.6718   99.130   2.0778 4.637810 3.384641 
1 1 1   13    6  -36 o   74.296   1.8149  225.144   10.992  240.296   18.431  216.781   13.693   76.652   2.9554   72.850   2.3087 3.801811 3.750282 
1 1 1   13    6  -35 o   44.521   2.7345   81.223   9.8760   66.843   18.894   86.628   11.585   39.909   5.9928   45.950   3.1112 -6.040119 6.752252 
1 1 1   13    6  -34 o  197.916   2.0535  1597.92   33.130  1584.93   54.051  1605.74   41.930  196.961   3.3666  198.346   2.5933 -1.385712 4.249606 
1 1 1   13    6  -33 o   14.208   5.5944   4.6668   9.5151  -4.7833   17.961   8.3539   11.219   16.094   7.0784   16.506   6.1809 -0.4113998 9.397202 
1 1 1   13    6  -32 o   67.089   2.3353  183.869   12.751  220.573   23.362  168.294   15.218   73.348   3.9216   64.138   2.9185 9.210686 4.888408 
1 1 1   13    6  -31 o   88.780   1.9687  321.495   14.247  307.808   22.173  331.120   18.594   86.761   3.1403   90.041   2.5359 -3.279343 4.036373 
1 1 1   13    6  -30 o   97.258   2.0043  385.837   15.890  346.746   26.151  408.719   20.007   92.059   3.4911  100.080   2.4525 -8.021545 4.266454 
1 1 1   13    6  -29 o   23.251   5.3884   23.047   10.013   34.291   16.905   16.971   12.427   28.324   7.2820   20.548   6.5690 7.776451 9.807143 
1 1 1   13    6  -28 o   15.059   6.3213   1.3102   13.110  -6.3269   15.678   19.061   23.903   14.579   6.5016   24.343   9.0405 -9.764291 11.13560 
1 1 1   13    6  -27 o   39.548   3.8324   64.522   12.200   77.446   16.246   47.810   18.474   43.250   4.6829   33.481   6.9951 9.769444 8.417862 
1 1 1   13    6  -26 o   85.317   2.2664  297.168   15.748  282.768   20.582  317.499   24.457   83.166   3.0412   88.098   3.4121 -4.932495 4.570684 
1 1 1   13    6  -25 o  221.230   2.0028  1996.27   36.118  1963.99   51.833  2026.73   50.356  219.344   2.8990  222.836   2.7723 -3.491135 4.011174 
1 1 1   13    6  -24 o   92.593   1.8620  349.656   14.054  314.799   20.734  379.281   19.114   87.770   2.9020   96.384   2.4348 -8.614281 3.788122 
1 1 1   13    6  -23 o  249.042   2.1130  2529.90   42.896  2494.69   61.037  2564.26   60.298  247.198   3.0291  250.632   2.9514 -3.433655 4.229228 
1 1 1   13    6  -22 o  175.290   1.8027  1253.06   25.758  1235.23   45.808  1261.31   31.149  173.928   3.2310  175.843   2.1731 -1.915314 3.893812 
1 1 1   13    6  -21 o   78.901   2.2690  254.165   14.578   0.0000   0.0000  254.165   14.578  ?   ?    78.901   2.2690 0.000000 2.269003 
1 1 1   13    6  -20 o  344.078   2.4136  4830.13   67.694  4704.81  102.423  4927.34   90.206  339.354   3.7026  347.394   3.1855 -8.039612 4.884318 
1 1 1   13    6  -19 o  238.366   1.8933  2317.18   36.787  2323.90   57.433  2312.50   47.903  238.606   2.9529  238.074   2.4684 0.5323639 3.848667 
1 1 1   13    6  -18 o   84.531   1.7152  291.376   11.819  290.751   19.603  291.733   14.814   84.355   2.8550   84.543   2.1514 -0.1884079 3.574802 
1 1 1   13    6  -17 o  112.180   1.5902  513.119   14.541  510.865   23.633  514.493   18.446  111.894   2.5911  112.315   2.0148 -0.4215927 3.282228 
1 1 1   13    6  -16 o   54.655   2.1040  122.017   9.3563  120.927   15.717  122.616   11.644   54.296   3.5709   54.756   2.6164 -0.4597588 4.426835 
1 1 1   13    6  -15 o   83.058   1.6950  281.303   11.476  273.194   15.772  290.426   16.729   81.799   2.3679   84.338   2.4359 -2.538239 3.397091 
1 1 1   13    6  -14 o   94.268   1.5268  362.324   11.732  359.004   17.502  365.034   15.810   93.812   2.2888   94.605   2.0501 -0.7925873 3.072666 
1 1 1   13    6  -13 o  211.955   1.7774  1831.96   30.709  1834.25   41.263  1829.11   45.976  212.044   2.3873  211.722   2.6639 0.3217010 3.577097 
1 1 1   13    6  -12 o   90.952   1.6511  337.307   12.241  333.171   17.026  341.734   17.613   90.344   2.3138   91.496   2.3636 -1.151352 3.307597 
1 1 1   13    6  -11 o  121.055   1.5703  597.503   15.495  608.602   21.446  585.380   22.414  122.152   2.1538  119.793   2.2954 2.359138 3.147631 
1 1 1   13    6  -10 o   38.294   2.7651   60.151   8.5732   43.728   12.064   76.907   12.185   32.363   4.7114   43.258   3.4852 -10.89481 5.860403 
1 1 1   13    6   -9 o  281.882   1.9525  3240.43   44.863  3289.11   64.682  3195.30   62.279  283.901   2.7950  279.831   2.7303 4.070190 3.907241 
1 1 1   13    6   -8 o  135.102   1.5872  744.227   17.479  757.675   28.627  736.234   22.071  136.273   2.5771  134.358   2.0152 1.914490 3.271507 
1 1 1   13    6   -7 f  147.600   1.6037  888.287   19.295  881.393   31.022  892.636   24.640  146.978   2.5893  147.942   2.0432 -0.9639587 3.298401 
1 1 1   13    6   -6 o   58.062   2.0808  137.669   9.8321  142.837   17.217  135.168   11.977   59.031   3.5951   57.502   2.5617 1.528851 4.414419 
1 1 1   13    6   -5 o   77.738   1.7607  246.427   11.157  229.782   18.591  255.797   13.948   74.969   3.0485   79.163   2.1635 -4.194313 3.738222 
1 1 1   13    6   -4 o   57.398   1.9082  134.499   8.9156  102.938   13.379  159.708   11.957   50.106   3.2940   62.527   2.3502 -12.42141 4.046487 
1 1 1   13    6   -3 o  162.551   1.5143  1077.31   20.065  1061.30   28.967  1092.08   27.820  161.306   2.2030  163.635   2.0857 -2.328842 3.033672 
1 1 1   13    6   -2 o   24.692   3.8646   25.503   7.5236   27.744   11.753   23.946   9.7930   25.522   5.7837   23.731   5.2060 1.791292 7.781589 
1 1 1   13    6   -1 o  159.998   1.5876  1043.77   20.705  1047.41   32.066  1041.17   27.116  160.233   2.4550  159.776   2.0820 0.4571075 3.219003 
1 1 1   13    6    0 o   29.453   3.3813   35.882   7.9709   25.617   12.892   42.235   10.142   24.541   6.3845   31.906   3.9862 -7.364382 7.526765 
1 1 1   13    6    1 o  133.716   1.5421  729.015   16.808  725.397   26.175  731.554   21.927  133.349   2.4080  133.932   2.0084 -0.5830841 3.135643 
1 1 1   13    6    2 o  218.615   1.9279  1949.03   34.356  1915.31   59.716  1965.71   42.004  216.586   3.3824  219.518   2.3474 -2.932266 4.117136 
1 1 1   13    6    3 o   37.689   2.9546   58.329   9.0048   62.963   16.979   56.515   10.622   38.830   5.5196   37.031   3.5627 1.799187 6.569530 
1 1 1   13    6    4 o   89.639   1.7425  327.650   12.732  304.210   22.968  338.049   15.298   86.260   3.2724   91.042   2.0613 -4.782181 3.867540 
1 1 1   13    6    5 o   71.083   2.0912  206.259   12.104  204.199   20.353  207.387   15.056   70.624   3.5467   71.248   2.5968 -0.6235809 4.395713 
1 1 1   13    6    6 o   99.905   1.8650  407.022   15.188  430.586   25.743  394.440   18.811  102.662   3.0797   98.333   2.3468 4.328636 3.871961 
1 1 1   13    6    7 f  305.111   2.3716  3797.59   58.983  3785.80  102.678  3803.40   72.059  304.361   4.1386  305.278   2.8957 -0.9170837 5.051074 
1 1 1   13    6    8 o  198.531   1.8413  1607.29   29.797  1614.96   51.929  1603.53   36.383  198.895   3.2029  198.272   2.2512 0.6234436 3.914909 
1 1 1   13    6    9 o  208.694   1.8831  1776.12   32.034  1733.58   54.892  1798.09   39.448  206.063   3.2680  209.952   2.3050 -3.888809 3.999058 
1 1 1   13    6   10 o  309.510   2.3887  3907.97   60.267  3890.67  104.112  3916.69   73.909  308.542   4.1395  309.784   2.9268 -1.241821 5.069723 
1 1 1   13    6   11 o   47.064   2.4698   90.617   9.4420   89.749   16.697   91.024   11.448   46.643   4.4454   47.129   2.9954 -0.4868088 5.360404 
1 1 1   13    6   12 o  100.999   1.8831  415.995   15.503  408.360   20.314  426.645   23.992  100.046   2.4909  102.204   2.8827 -2.157478 3.809790 
1 1 1   13    6   13 o   69.936   1.9637  199.629   11.184  198.691   16.288  200.465   15.383   69.715   2.8724   70.039   2.6995 -0.3232880 3.941803 
1 1 1   13    6   14 o  123.424   1.6888  621.170   16.991  586.454   23.975  656.201   24.083  119.895   2.4531  126.830   2.3295 -6.935425 3.382952 
1 1 1   13    6   15 o   91.765   1.7767  343.387   13.290  341.091   19.189  345.503   18.425   91.395   2.5783   91.992   2.4592 -0.5974960 3.563035 
1 1 1   13    6   16 o   80.627   1.7067  265.078   11.217  254.272   17.589  272.486   14.562   78.889   2.7393   81.704   2.1884 -2.814728 3.506144 
1 1 1   13    6   17 o   86.024   1.6721  301.753   11.725  312.367   18.575  294.722   15.117   87.456   2.6084   84.974   2.1843 2.481888 3.402217 
1 1 1   13    6   18 o   52.594   2.1940  113.026   9.3853  101.140   15.171  120.395   11.946   49.612   3.7798   54.249   2.7099 -4.637047 4.650874 
1 1 1   13    6   19 o  130.234   1.6988  691.620   18.034  696.401   26.116  687.263   24.934  130.648   2.4523  129.793   2.3567 0.8548584 3.401139 
1 1 1   13    6   20 o   42.735   2.6015   74.795   9.0192   75.363   14.718   74.453   11.413   42.721   4.2842   42.572   3.3150 0.1489601 5.416964 
1 1 1   13    6   21 o  126.392   1.5834  651.379   16.313  658.405   25.773  646.682   21.071  127.030   2.4890  125.916   2.0529 1.114105 3.226387 
1 1 1   13    6   22 o   50.227   2.3842  103.154   9.7335  114.612   16.314   96.821   12.129   52.824   3.8144   48.602   3.0773 4.222324 4.900945 
1 1 1   13    6   23 o  181.396   1.6963  1341.79   25.082  1358.10   39.053  1330.35   32.724  182.428   2.6262  180.587   2.2230 1.841537 3.440738 
1 1 1   13    6   24 o  154.691   1.7745  975.862   22.376  1011.57   40.735  960.433   26.778  157.396   3.1750  153.444   2.1409 3.952637 3.829333 
1 1 1   13    6   25 o  101.206   1.7145  417.689   14.144  411.355   22.419  421.878   18.230  100.355   2.7431  101.694   2.1991 -1.338699 3.515806 
1 1 1   13    6   26 o  184.735   1.7254  1391.71   25.982  1395.36   40.506  1389.17   33.867  184.903   2.6875  184.529   2.2515 0.3735352 3.505940 
1 1 1   13    6   27 o   40.481   3.1298   67.312   10.247   81.057   18.809   61.510   12.220   44.159   5.3332   38.592   3.9398 5.567749 6.630632 
1 1 1   13    6   28 o  118.636   1.7912  574.003   17.322  584.513   31.282  569.356   20.802  119.591   3.2119  118.138   2.1602 1.452919 3.870707 
1 1 1   13    6   29 o  166.898   2.0011  1136.21   27.225  1094.60   43.694  1162.62   34.807  163.704   3.2743  168.786   2.5299 -5.082535 4.137811 
1 1 1   13    6   30 o   70.246   3.6260  202.176   20.692   0.0000   0.0000  202.176   20.692  ?   ?    70.246   3.6260 0.000000 3.626008 
1 1 1   13    6   31 o   89.098   2.4139  324.165   17.515  346.240   26.849  307.810   23.110   91.981   3.5878   86.749   3.2741 5.231964 4.857111 
1 1 1   13    6   32 o   74.392   3.0725  226.371   18.592  237.003   23.504  208.602   30.386   76.051   3.8035   71.150   5.2768 4.900986 6.504698 
1 1 1   13    6   33 o   34.815   6.7243   51.518   18.392   67.364   28.406   40.079   24.134   39.558   9.0111   30.817   9.0286 8.741247 12.75600 
1 1 1   13    6   34 o   83.330   2.8235  283.819   19.151  276.953   35.039  286.744   22.869   82.026   5.2683   83.710   3.3583 -1.684662 6.247645 
1 1 1   13    6   35 o  193.385   2.6879  1526.64   42.372  1534.99   74.813  1522.70   51.413  193.591   4.7408  193.063   3.2669 0.5283813 5.757461 
1 1 1   13    6   36 o  248.168   2.3024  2513.16   46.576  2433.80   73.012  2567.61   60.480  243.994   3.6710  250.745   2.9590 -6.750824 4.715019 
1 1 1   13    6   37 o  180.561   1.9949  1330.02   29.361  1342.33   47.646  1322.47   37.281  181.259   3.2247  179.996   2.5409 1.263214 4.105452 
1 1 1   13    6   38 o  135.185   1.8771  745.471   20.685  704.557   32.920  772.161   26.589  131.329   3.0751  137.549   2.3714 -6.219879 3.883288 
1 1 1   13    6   39 o   60.449   2.4294  149.393   11.947  158.805   20.059  144.219   14.872   62.172   3.9788   59.335   3.0855 2.837238 5.034987 
1 1 1   13    6   40 o  172.725   1.9507  1217.15   27.465  1207.24   43.946  1223.50   35.183  171.886   3.1365  173.120   2.4932 -1.234863 4.006687 
1 1 1   13    6   41 o   63.265   2.3245  163.587   11.967  167.733   20.622  161.482   14.695   63.892   3.9792   62.809   2.8778 1.083626 4.910793 
1 1 1   13    6   42 o   79.419   2.0984  257.569   13.573  232.942   22.160  272.355   17.171   75.376   3.6171   81.629   2.5838 -6.252525 4.445183 
1 1 1   13    6   43 f   89.245   1.9892  324.987   14.471  317.216   23.967  329.445   18.153   88.017   3.3465   89.793   2.4825 -1.775291 4.166810 
1 1 1   13    6   44 o  127.871   1.8830  667.117   19.627  624.363   31.366  694.629   25.161  123.554   3.1169  130.441   2.3663 -6.887260 3.913366 
1 1 1   13    6   45 o  121.106   1.8780  598.423   18.540  596.557   30.357  599.533   23.413  120.768   3.0863  121.180   2.3703 -0.4121399 3.891424 
1 1 1   13    6   46 o  106.478   2.2224  462.813   19.289  485.634   27.545  440.853   27.020  108.947   3.1048  103.786   3.1977 5.161118 4.457042 
1 1 1   13    6   47 o   59.290   2.4396  143.796   11.765  126.808   19.666  153.266   14.682   55.433   4.3880   61.164   2.9536 -5.730820 5.289478 
1 1 1   13    6   48 o   98.046   1.9427  392.316   15.526  390.250   25.606  393.517   19.525   97.624   3.2222   98.160   2.4402 -0.5353470 4.041866 
1 1 1   13    6   49 o  181.446   1.9918  1343.77   29.461  1354.49   47.566  1337.09   37.524  181.962   3.2069  180.913   2.5445 1.048584 4.093709 
1 1 1   13    6   50 o  206.813   2.3340  1746.82   39.347  1701.38   55.987  1791.17   55.310  203.881   3.3688  209.223   3.2431 -5.342865 4.676169 
1 1 1   13    6   51 o   38.509   4.1397   61.528   12.791   39.641   25.389   68.972   14.807   30.565   9.3336   40.730   4.5368 -10.16441 10.37777 
1 1 1   13    6   52 o   41.966   3.7240   72.735   12.607   72.229   25.836   72.894   14.443   40.910   8.0343   41.923   4.2867 -1.013771 9.106372 
1 1 1   13    6   53 f  127.215   2.3644  661.136   24.519  636.914   44.769  671.514   29.304  124.428   4.4209  128.150   2.8053 -3.721565 5.235867 
1 1 1   13    6   54 o   64.833   2.4450  172.000   12.898  190.131   29.196  167.604   14.377   67.682   5.3350   63.962   2.7640 3.720467 6.008517 
1 1 1   13    6   55 o  112.942   1.7771  520.639   16.360  537.045   25.470  509.116   21.346  114.597   2.7266  111.626   2.3459 2.970978 3.596936 
1 1 1   13    6   56 o   61.475   2.1689  154.563   10.851  155.411   17.906  154.071   13.642   61.459   3.5898   61.314   2.7363 0.1455040 4.513789 
1 1 1   13    6   57 o   43.484   2.7631   77.670   9.7434   83.100   17.049   75.036   11.873   44.659   4.7565   42.645   3.4449 2.014221 5.872944 
1 1 1   13    6   58 o   71.875   2.0561  211.189   12.034  193.554   19.590  221.877   15.251   68.603   3.5148   73.614   2.5453 -5.011520 4.339679 
1 1 1   13    6   59 o   79.242   1.9870  256.647   12.825  273.405   21.240  247.032   16.088   81.611   3.1990   77.673   2.5445 3.938591 4.087563 
1 1 1   13    6   60 o  132.837   1.8024  720.555   19.517  714.534   29.928  725.011   25.744  132.109   2.7792  133.155   2.3719 -1.046204 3.653687 
1 1 1   13    6   61 o   25.829   4.6711   28.374   9.4727   20.585   16.925   31.927   11.431   22.731   7.6867   27.300   5.3279 -4.569496 9.352625 
1 1 1   13    6   62 o   32.356   3.7746   43.637   9.7687   78.332   18.036   29.234   11.621   43.152   5.2344   26.028   5.6404 17.12424 7.695004 
1 1 1   13    6   63 o   51.219   2.5440  107.669   10.588   89.932   18.006  117.044   13.091   46.355   4.8364   53.333   3.0235 -6.978233 5.703715 
1 1 1   13    6   64 o   39.275   2.9645   63.634   9.4207   67.152   16.290   61.867   11.548   39.894   5.1277   38.589   3.7170 1.304523 6.333241 
1 1 1   13    6   65 o   15.211   5.4119   8.3947   8.4398   12.126   15.111   6.7030   10.175   19.150   7.1730   15.215   5.8421 3.934993 9.251052 
1 1 1   13    6   66 o   62.291   2.0966  158.907   10.630  160.617   17.280  157.867   13.484   62.380   3.4113   61.993   2.6746 0.3873711 4.334814 
1 1 1   13    6   67 o   54.063   2.2532  119.879   9.9080  131.290   16.721  113.704   12.300   56.301   3.6632   52.544   2.8828 3.756966 4.661508 
1 1 1   13    6   68 o   41.299   3.2714   70.660   10.923   0.0000   0.0000   70.660   10.923  ?   ?    41.299   3.2714 0.000000 3.271379 
1 1 1   13    6   69 f   27.168   5.8272   32.246   12.518   26.189   21.590   35.313   15.364   25.145   8.6772   28.235   6.7644 -3.090481 11.00232 
1 1 1   13    6   70 o   34.602   4.6341   50.780   12.743   42.863   22.366   54.585   15.505   30.693   8.5981   35.623   5.5179 -4.930122 10.21636 
1 1 1   13    6   71 o   67.183   2.2089  185.235   12.080  201.571   20.343  176.337   15.014   69.700   3.5927   65.405   2.8228 4.294197 4.568980 
1 1 1   13    6   72 o   74.115   2.1446  225.389   12.943  210.800   20.893  234.473   16.487   71.236   3.6099   75.453   2.6849 -4.216660 4.498881 
1 1 1   13    6   73 o   49.857   2.2530  102.219   9.1326  108.711   13.225   96.301   12.627   51.196   3.1848   48.160   3.2352 3.035721 4.539716 
1 1 1   13    6   74 o   80.082   1.8002  262.625   11.751  267.891   16.409  257.081   16.837   80.667   2.4984   78.982   2.6188 1.684776 3.619439 
1 1 1   13    6   75 o   71.209   1.7648  207.684   10.244  212.588   15.365  203.760   13.745   71.784   2.6303   70.347   2.4004 1.437019 3.560939 
1 1 1   13    6   76 o   49.944   2.1088  102.604   8.5661   96.392   13.221  107.099   11.246   48.054   3.3970   50.875   2.7217 -2.820919 4.352849 
1 1 1   13    6   77 o   67.032   1.7778  184.303   9.7055  186.082   14.582  182.887   13.004   67.089   2.6718   66.601   2.3993 0.4880142 3.590955 
1 1 1   13    6   78 o   24.328   3.4720   25.132   6.6901   19.528   11.144   28.290   8.3650   20.899   6.1386   25.638   4.1440 -4.738232 7.406434 
1 1 1   13    6   79 f   11.607   4.4956   3.8798   6.0622   13.270   10.914  -0.3103   7.2903   17.912   6.1699   10.646   4.5979 7.266282 7.694721 
1 1 1   13    6   80 o   63.592   1.9216  166.252   9.9494  160.834   14.081  171.654   14.060   62.252   2.7820   64.354   2.6861 -2.102409 3.867108 
1 1 1   13    6   81 o   66.816   1.5251  182.902   8.3062  176.710   14.437  185.966   10.155   65.254   2.7202   67.265   1.8539 -2.011360 3.291838 
1 1 1   13    6   82 o   54.956   1.6169  123.959   7.2354  123.200   13.227  124.284   8.6432   54.329   2.9983   54.946   1.9328 -0.6170464 3.567220 
1 1 1   13    6   83 o   27.316   2.4906   31.121   5.4847   38.959   11.385   28.752   6.2588   29.741   4.8642   26.113   2.9944 3.627529 5.712013 
1 1 1   13    6   84 f   51.119   1.9979  107.764   8.3092  106.831   12.757  108.452   10.951   50.477   3.1156   51.060   2.6400 -0.5833702 4.083677 
1 1 1   13    6   85 o   45.845   3.3095   88.602   12.285   84.854   14.016  101.022   25.516   44.578   3.8963   46.553   6.9354 -1.975655 7.954975 
1 1 1   13    6   86 o   35.777   3.2028   54.046   9.2419   65.570   11.854   36.185   14.758   39.189   3.7568   27.670   6.6299 11.51931 7.620317 
1 1 1   13    6   87 o   17.900   5.4067   14.435   8.5514   17.549   10.831   9.2816   13.935   19.578   6.1166   16.919   6.7356 2.658636 9.098413 
1 1 1   13    6   88 o   20.017   5.6389   18.487   9.5914   20.660   12.826   15.730   14.447   20.985   6.6698   19.179   7.0450 1.806286 9.701457 
1 1 1   13    6   89 o   20.029   5.6960   18.616   9.7398   17.091   13.051   20.533   14.633   19.430   6.7443   20.926   7.1463 -1.496269 9.826268 
1 1 1   13    6   90 o   39.621   2.7899   65.986   8.9530   73.937   11.689   54.699   13.926   41.611   3.4778   34.882   5.0439 6.729378 6.126640 
1 1 1   13    6   91 o   48.635   2.3916   98.640   9.4522   96.931   12.325  101.081   14.730   47.799   3.1813   48.444   3.7594 -0.6449738 4.924822 
1 1 1   13    6   92 o   17.604   5.3227   14.335   8.2846   28.755   11.018  -4.4249   12.567   24.696   5.6022   12.399   5.6472 12.29785 7.954569 
1 1 1   13    6   93 o   7.8153   3.8121 -13.1291   7.9092  -8.4633   10.324 -19.7584   12.306   10.277   4.8296   9.6571   4.7201 0.6200905 6.753101 
1 1 1   13    6   94 o   25.423   4.2464   29.020   8.4898   34.242   11.183   21.917   13.043   27.042   5.2626   20.908   6.7345 6.134537 8.546852 
1 1 1   13    6   95 o   37.805   2.9291   60.930   8.9563   59.553   11.707   62.872   13.908   36.712   3.9754   37.187   4.6924 -0.4749222 6.149966 
1 1 1   13    6   96 o   23.078   4.6227   24.642   8.3929   22.164   10.896   28.258   13.161   21.083   6.0341   23.428   6.6072 -2.345142 8.947944 
1 1 1   13    6   97 o   9.7350   4.6017  -8.3668   9.6241 -30.8803   14.760   8.2828   12.693   9.5867   4.7729   15.426   6.3242 -5.839638 7.923121 
1 1 1   13    6   98 o   27.581   4.1139   34.475   8.9666   27.471   12.023   43.252   13.459   23.093   6.2403   29.608   5.7841 -6.515265 8.508633 
1 1 1   13    6   99 o   9.4021   4.4188  -6.6261   8.6465   2.4418   11.719 -17.4615   12.810   13.206   5.7651   9.9907   4.8684 3.215103 7.545678 
1 1 1   13    6  100 o   11.352   4.9545   0.9650   8.6507   11.853   11.719 -12.0734   12.824   16.119   6.2484   10.716   5.1338 5.403541 8.086932 
1 1 1   13    6  101 o   14.091   5.4391   8.2761   8.8519   5.7176   12.073   11.250   13.017   14.128   6.0049   16.052   6.4690 -1.923645 8.826524 
1 1 1   13    6  102 o   26.362   4.5302   32.702   9.3840   14.130   12.543   56.316   14.143   16.931   6.4901   33.989   5.2758 -17.05804 8.363930 
1 1 1   13    6  103 o   22.532   5.4147   25.544   9.8209   32.141   12.438   14.619   16.006   24.632   6.1998   17.343   7.1047 7.289537 9.429457 
1 1 1   13    6  104 o   22.084   5.6107   25.048   10.119   24.485   13.006   25.910   16.107   20.871   6.7250   20.800   7.4678 0.7027435E-01 10.04954 
1 1 1   13    6  105 o   14.606   5.7054   9.3891   9.8297   5.6645   12.700   14.955   15.524   14.110   6.0810   17.218   7.0186 -3.108407 9.286537 
1 1 1   13    6  106 o   15.408   5.8656   11.313   10.199   7.7663   13.433   16.139   15.670   14.838   6.3212   17.524   7.0850 -2.685699 9.495024 
1 1 1   13    6  107 o   25.352   5.3019   32.331   10.604   15.333   13.740   57.370   16.676   17.112   6.7272   32.516   6.5187 -15.40430 9.367390 
1 1 1   13    6  108 o   20.184   6.2971   22.628   11.483   31.325   16.960   15.264   15.605   22.144   7.6882   17.122   7.0149 5.021561 10.40750 
1 1 1   13    6  109 o   12.698   6.0194  -7.2577   16.692  -7.2577   16.692   0.0000   0.0000   12.698   6.0194  ?   ?  0.000000 6.019421 
1 1 1   13    6  110 o   19.229   7.4755   22.948   16.811   22.948   16.811   0.0000   0.0000   19.229   7.4755  ?   ?  0.000000 7.475502 
1 1 1   13    6  111 o   31.402   7.2112   58.041   18.069   58.041   18.069   0.0000   0.0000   31.402   7.2112  ?   ?  0.000000 7.211191 
1 1 1   13    6  112 o   13.214   6.1559  -2.1799   16.176  -2.1799   16.176   0.0000   0.0000   13.214   6.1559  ?   ?  0.000000 6.155892 
1 1 1   13    6  113 o   16.174   6.9904   12.003   16.874   12.003   16.874   0.0000   0.0000   16.174   6.9904  ?   ?  0.000000 6.990401 
1 1 1   13    7 -111 o   14.151   6.3900   3.7140   15.671   3.7140   15.671   0.0000   0.0000   14.151   6.3900  ?   ?  0.000000 6.389956 
1 1 1   13    7 -110 o   14.523   6.2539   7.7364   13.411   7.7364   13.411   0.0000   0.0000   14.523   6.2539  ?   ?  0.000000 6.253905 
1 1 1   13    7 -109 o   10.777   5.1532  -9.4787   12.787  -9.4787   12.787   0.0000   0.0000   10.777   5.1532  ?   ?  0.000000 5.153237 
1 1 1   13    7 -108 o   25.340   7.5620   40.642   16.803   40.642   16.803   0.0000   0.0000   25.340   7.5620  ?   ?  0.000000 7.561950 
1 1 1   13    7 -107 o   13.775   6.0811   4.4898   13.372   4.4898   13.372   0.0000   0.0000   13.775   6.0811  ?   ?  0.000000 6.081108 
1 1 1   13    7 -106 o   16.395   6.3288   13.925   11.986   15.857   13.543   6.9447   25.743   17.122   6.6944   16.584   7.7391 0.5379562 10.23268 
1 1 1   13    7 -105 o   16.343   6.7840   12.881   14.852   11.662   18.471   15.111   24.981   16.483   7.2160   17.748   8.0356 -1.264383 10.80003 
1 1 1   13    7 -104 f   19.971   6.1164   21.760   10.893   21.118   13.509   22.953   18.417   19.150   6.8433   19.315   7.7255 -0.1646156 10.32050 
1 1 1   13    7 -103 o   21.069   6.1404   24.114   11.189   31.986   13.945   9.8873   18.747   23.601   6.8485   16.303   7.1983 7.298452 9.935673 
1 1 1   13    7 -102 o   21.222   6.0664   24.226   11.020   19.088   13.337   35.280   19.562   18.504   6.7737   22.985   8.2326 -4.480391 10.66104 
1 1 1   13    7 -101 f   15.872   5.9845   12.242   10.556   13.396   12.886   9.8882   18.404   16.525   6.5092   16.376   7.1849 0.1489029 9.695013 
1 1 1   13    7 -100 o   30.576   4.6213   44.245   11.159   49.204   13.754   34.694   19.089   31.316   5.5933   23.216   8.1502 8.099129 9.884880 
1 1 1   13    7  -99 o   24.763   5.5632   30.945   10.955   22.567   13.227   49.242   19.547   20.139   6.7953   28.320   8.0744 -8.181145 10.55328 
1 1 1   13    7  -98 o   14.457   5.7773   8.3601   10.290   0.1474   12.688   24.142   17.589   12.880   5.7886   20.282   7.7073 -7.401155 9.639033 
1 1 1   13    7  -97 o   14.080   5.6852   7.3626   10.075   0.3731   12.451   20.615   17.145   12.886   5.7669   19.334   7.5400 -6.448806 9.492584 
1 1 1   13    7  -96 o   13.961   5.6785   6.8340   10.136  -0.5137   12.469   21.145   17.402   12.739   5.7306   19.623   7.6121 -6.883965 9.528021 
1 1 1   13    7  -95 o   13.272   5.5226   4.9122   9.8763   5.8947   12.141   2.9906   16.980   14.375   6.0617   15.144   6.7592 -0.7691183 9.079118 
1 1 1   13    7  -94 o   20.521   5.1363   20.298   8.5708   17.351   12.662   22.789   11.644   18.595   6.6275   21.062   6.2972 -2.466818 9.142058 
1 1 1   13    7  -93 o   9.1787   4.3692  -9.1819   8.9768 -16.5780   15.451  -5.4135   11.029   11.496   5.5405   11.160   5.1588 0.3363066 7.570410 
1 1 1   13    7  -92 o   18.756   5.5747   17.018   9.1463  -2.7355   15.800   26.972   11.217   13.917   6.3362   23.401   5.8864 -9.484467 8.648502 
1 1 1   13    7  -91 o   52.195   2.4140  114.261   10.243  115.330   15.754  113.479   13.482   51.401   3.7866   51.448   3.2310 -0.4744720E-01 4.977734 
1 1 1   13    7  -90 o   21.989   4.8994   22.441   8.5568   34.104   13.082   13.720   11.312   26.394   6.1885   17.408   6.2573 8.985710 8.800648 
1 1 1   13    7  -89 o   21.352   4.9718   21.129   8.4912   12.648   12.728   27.931   11.398   17.326   6.5628   24.133   5.8547 -6.806328 8.794765 
1 1 1   13    7  -88 o   33.777   3.3540   48.904   9.1127   62.026   13.645   38.340   12.243   37.334   4.5797   28.761   5.4210 8.572638 7.096490 
1 1 1   13    7  -87 o   24.293   4.2737   26.231   8.1540   16.802   11.279   36.555   11.802   19.009   6.2720   28.199   5.3294 -9.190527 8.230472 
1 1 1   13    7  -86 o   42.592   2.5254   75.777   8.7286   75.735   12.195   75.821   12.499   42.067   3.5905   42.039   3.6848 0.2855682E-01 5.144820 
1 1 1   13    7  -85 o   41.597   2.7626   72.542   9.3143   71.315   13.938   73.532   12.521   40.467   4.2905   41.405   3.7504 -0.9383430 5.698578 
1 1 1   13    7  -84 o   37.808   2.7995   59.952   8.5668   57.424   11.747   62.823   12.520   36.463   4.0190   38.115   4.0937 -1.652649 5.736760 
1 1 1   13    7  -83 o   40.682   2.5877   69.026   8.5370   91.180   12.237   48.022   11.915   46.488   3.2497   33.101   4.5351 13.38649 5.579253 
1 1 1   13    7  -82 o   34.803   2.9527   50.903   8.2977   49.542   11.627   52.316   11.846   33.763   4.3235   34.731   4.2743 -0.9677391 6.079678 
1 1 1   13    7  -81 o   40.146   2.6381   67.198   8.5854   72.720   11.948   61.304   12.344   41.390   3.5765   37.753   4.0758 3.636890 5.422500 
1 1 1   13    7  -80 o   33.204   3.2140   46.539   8.5904   67.998   11.267   16.747   13.276   40.079   3.4834   19.577   6.8018 20.50215 7.641903 
1 1 1   13    7  -79 o   54.203   2.4556  121.781   10.822  130.367   15.171  112.887   15.441   55.686   3.3578   51.639   3.6925 4.046799 4.990918 
1 1 1   13    7  -78 o   14.797   5.2649   8.5491   7.9876   15.011   10.547  -0.1439   12.233   18.521   6.0625   13.596   5.9135 4.924852 8.468978 
1 1 1   13    7  -77 o   18.151   4.9771   14.646   7.5832   16.565   10.458   12.519   11.012   19.296   6.0077   17.517   6.1868 1.779287 8.623698 
1 1 1   13    7  -76 o   17.450   5.0964   13.408   7.7004   27.612   10.973  -0.3770   10.809   24.780   5.5682   12.822   5.5679 11.95848 7.874425 
1 1 1   13    7  -75 o   35.230   2.9196   51.797   8.3093   42.886   11.565   61.305   11.947   31.462   4.6493   38.015   3.9110 -6.552971 6.075516 
1 1 1   13    7  -74 o   15.844   5.3920   10.221   8.3293   13.247   10.759   5.6949   13.158   17.887   6.1273   15.846   6.4607 2.041380 8.904239 
1 1 1   13    7  -73 o   63.906   2.1180  168.003   11.018  155.454   14.052  188.029   17.752   61.250   2.8221   67.198   3.2504 -5.948502 4.304599 
1 1 1   13    7  -72 o   16.362   5.4052   11.106   8.3762   18.748   10.964   0.3960   12.981   20.574   6.1008   14.289   6.1530 6.284825 8.664824 
1 1 1   13    7  -71 o   11.198   4.7567   0.5548   7.5690  -3.7419   10.513   5.1797   10.907   11.833   5.2972   14.766   5.9318 -2.933575 7.952765 
1 1 1   13    7  -70 o   79.564   1.7437  259.210   11.309  258.624   15.568  259.864   16.456   79.272   2.4120   79.419   2.5452 -0.1465149 3.506526 
1 1 1   13    7  -69 o   58.129   1.7553  138.449   8.3076  145.998   13.648  134.005   10.471   59.449   2.8245   57.090   2.2545 2.358730 3.613899 
1 1 1   13    7  -68 o   25.388   3.2122   27.040   6.4991   29.209   11.283   25.964   7.9503   25.790   5.5330   24.655   4.0999 1.135502 6.886471 
1 1 1   13    7  -67 o   16.925   4.4529   12.397   6.2250   3.5401   10.914   16.669   7.5788   14.295   5.8627   19.563   4.7913 -5.267928 7.571473 
1 1 1   13    7  -66 o   24.404   3.4669   25.086   6.7030   25.246   11.642   25.006   8.1983   23.933   5.9837   24.163   4.3210 -0.2297516 7.380744 
1 1 1   13    7  -65 o  105.020   1.5334  450.690   13.127  447.522   21.048  452.707   16.793  104.434   2.4725  105.169   1.9589 -0.7346191 3.154481 
1 1 1   13    7  -64 o   32.356   3.0146   43.434   7.8597   11.910   15.649   54.068   9.0893   19.135   7.2702   36.111   3.1184 -16.97530 7.910802 
1 1 1   13    7  -63 o   37.228   3.2943   57.510   9.8937   41.105   15.668   68.389   12.759   30.610   6.4816   40.483   3.9153 -9.873001 7.572327 
1 1 1   13    7  -62 o  102.077   1.7509  425.858   14.569  420.793   20.964  430.590   20.261  101.281   2.5412  102.512   2.4247 -1.230675 3.512402 
1 1 1   13    7  -61 o  123.167   1.5499  619.562   15.561  629.998   25.168  613.104   19.799  124.001   2.4899  122.444   1.9837 1.556442 3.183496 
1 1 1   13    7  -60 o   63.303   2.0197  164.026   10.409  157.002   16.598  168.579   13.363   61.708   3.3118   64.094   2.5629 -2.385975 4.187674 
1 1 1   13    7  -59 o   24.435   4.0814   25.282   7.8429   50.836   14.146   13.942   9.4238   34.610   5.1727   18.302   5.7036 16.30772 7.699912 
1 1 1   13    7  -58 o   34.357   3.1478   48.852   8.7180   30.473   16.409   56.080   10.290   26.426   7.3509   36.774   3.4740 -10.34894 8.130417 
1 1 1   13    7  -57 o   57.382   2.2369  134.862   10.443  197.328   20.201  112.080   12.199   69.186   3.5942   52.215   2.8774 16.97136 4.604048 
1 1 1   13    7  -56 o   25.419   4.6743   27.515   9.3285   89.656   22.160   14.132   10.284   45.995   6.0576   18.608   5.9786 27.38683 8.511057 
1 1 1   13    7  -55 o   19.659   5.0442   16.599   8.1227   24.735   14.034   12.500   9.9607   23.985   6.8425   17.752   5.8955 6.233316 9.031993 
1 1 1   13    7  -54 o   86.025   1.7151  302.127   12.027  300.881   19.579  302.882   15.242   85.680   2.8072   86.061   2.1744 -0.3805237 3.550796 
1 1 1   13    7  -53 f   62.913   1.9439  161.809   9.9571  159.680   16.733  162.975   12.389   62.320   3.3057   63.089   2.4136 -0.7685356 4.093043 
1 1 1   13    7  -52 o   77.922   1.7367  247.864   11.031  260.328   18.330  240.786   13.812   79.704   2.8257   76.732   2.2105 2.971855 3.587643 
1 1 1   13    7  -51 o  101.215   1.6080  418.081   13.267  417.564   21.611  418.393   16.807  101.010   2.6268  101.214   2.0372 -0.2035217 3.324205 
1 1 1   13    7  -50 o   32.905   3.0495   44.701   8.0864   38.010   14.069   48.002   9.8819   29.770   6.0050   34.023   3.6185 -4.253862 7.010972 
1 1 1   13    7  -49 o   57.133   2.2448  133.553   10.434  146.989   23.467  130.242   11.649   59.536   4.8783   56.389   2.5408 3.147121 5.500351 
1 1 1   13    7  -48 o  110.359   2.0908  497.349   18.808  516.112   43.441  493.020   20.865  111.868   4.7748  109.852   2.3301 2.016388 5.313030 
1 1 1   13    7  -47 o   69.863   2.0155  199.438   11.466  197.622   19.087  200.463   14.342   69.383   3.3850   69.992   2.5178 -0.6096725 4.218738 
1 1 1   13    7  -46 o  122.119   1.7955  608.622   17.873  658.229   30.054  581.477   22.232  126.863   2.9063  119.316   2.2858 7.546890 3.697475 
1 1 1   13    7  -45 f   57.040   2.2839  133.094   10.598  135.604   17.948  131.751   13.132   57.384   3.8594   56.693   2.8507 0.6907005 4.798059 
1 1 1   13    7  -44 o  127.539   1.7109  663.723   17.787  638.189   26.107  685.845   24.300  124.974   2.5627  129.588   2.3004 -4.614197 3.443726 
1 1 1   13    7  -43 o  132.988   1.7355  721.649   18.814  741.449   27.925  705.192   25.460  134.713   2.5430  131.398   2.3770 3.314865 3.480961 
1 1 1   13    7  -42 o  231.527   2.0267  2188.06   38.250  2174.29   54.749  2201.19   53.462  230.614   2.9124  232.057   2.8263 -1.442886 4.058317 
1 1 1   13    7  -41 o   85.300   1.8706  296.916   13.006  298.862   19.619  295.391   17.373   85.466   2.8200   85.002   2.5100 0.4642563 3.775284 
1 1 1   13    7  -40 o   91.135   2.1131  339.027   15.698  360.714   20.541  308.581   24.339   93.923   2.6857   86.771   3.4479 7.152565 4.370472 
1 1 1   13    7  -39 o   63.977   2.1358  167.253   11.123  154.930   16.758  176.956   14.870   61.451   3.3583   65.750   2.7807 -4.299355 4.360141 
1 1 1   13    7  -38 o   67.869   2.0351  188.152   11.246  212.389   17.616  171.481   14.611   72.022   3.0073   64.726   2.7756 7.296158 4.092386 
1 1 1   13    7  -37 o   49.191   2.5027   99.066   10.002   97.105   15.574  100.442   13.049   48.534   3.9713   49.456   3.2550 -0.9225273 5.134803 
1 1 1   13    7  -36 o   71.074   1.8461  206.237   10.687  214.615   18.167  201.803   13.215   72.397   3.0854   70.272   2.3102 2.125237 3.854453 
1 1 1   13    7  -35 o   33.570   3.4957   46.588   9.4259   45.177   22.377   46.893   10.393   32.365   8.4072   33.629   3.8613 -1.263947 9.251538 
1 1 1   13    7  -34 o   79.899   2.0044  260.651   13.044  270.799   19.411  252.295   17.614   81.360   2.9317   78.545   2.7554 2.815071 4.023290 
1 1 1   13    7  -33 o  165.886   1.8147  1122.60   24.539  1082.20   34.915  1162.04   34.496  162.792   2.6311  168.704   2.5085 -5.912460 3.635289 
1 1 1   13    7  -32 o   91.249   1.9008  339.690   14.139  353.285   20.952  328.324   19.158   92.965   2.7680   89.631   2.6249 3.333725 3.814695 
1 1 1   13    7  -31 f  124.842   1.7873  635.761   18.188  658.872   26.776  615.962   24.784  127.033   2.5858  122.836   2.4752 4.197243 3.579493 
1 1 1   13    7  -30 o   52.526   2.2633  112.805   9.6678  114.221   16.308  112.038   12.005   52.704   3.8220   52.301   2.8263 0.4026031 4.753540 
1 1 1   13    7  -29 o  227.911   1.8675  2118.91   34.695  2074.33   54.004  2150.24   45.274  225.356   2.9398  229.522   2.4198 -4.165787 3.807635 
1 1 1   13    7  -28 o   43.320   2.8144   76.953   9.8844   76.558   18.948   77.101   11.586   42.831   5.5580   43.312   3.3066 -0.4804382 6.467197 
1 1 1   13    7  -27 f   93.401   1.8265  355.839   13.906  395.223   26.827  341.367   16.262   98.286   3.3533   91.467   2.1810 6.819244 4.000222 
1 1 1   13    7  -26 o   90.564   1.8803  334.559   13.881  378.020   27.472  319.660   16.085   96.106   3.5127   88.482   2.2320 7.624283 4.161777 
1 1 1   13    7  -25 o  171.019   1.8301  1192.94   25.513  1211.19   46.877  1185.26   30.412  172.171   3.3402  170.440   2.1889 1.731644 3.993511 
1 1 1   13    7  -24 o  310.339   2.4414  3930.50   61.760  3738.60  105.419  4030.78   76.207  302.260   4.2786  314.173   2.9757 -11.91379 5.211648 
1 1 1   13    7  -23 o   95.924   1.7998  375.288   14.073  403.121   23.673  360.074   17.502   99.318   2.9273   93.940   2.2856 5.378227 3.713874 
1 1 1   13    7  -22 o   89.381   1.8724  325.848   13.642  324.311   22.563  326.733   17.127   89.058   3.1129   89.452   2.3509 -0.3945313 3.900848 
1 1 1   13    7  -21 o  312.771   2.4660  3992.15   62.871  4018.45   90.737  3967.86   87.196  313.588   3.5497  311.634   3.4325 1.953674 4.937852 
1 1 1   13    7  -20 o  131.407   1.8536  704.280   19.855  668.595   29.501  733.832   26.846  127.975   2.8280  134.100   2.4559 -6.125015 3.745521 
1 1 1   13    7  -19 o   92.855   2.2364  351.772   16.927  371.805   24.235  332.689   23.654   95.366   3.1217   90.195   3.2224 5.170876 4.486522 
1 1 1   13    7  -18 o  207.308   2.1328  1753.23   36.041  1821.68   59.149  1712.81   45.454  211.161   3.4364  204.845   2.7222 6.315704 4.383918 
1 1 1   13    7  -17 o   62.206   2.5535  158.187   12.920  155.648   20.451  159.874   16.668   61.557   4.0991   62.476   3.2844 -0.9190598 5.252619 
1 1 1   13    7  -16 o   98.150   2.0921  392.982   16.738  370.891   27.475  406.019   21.107   95.207   3.5465   99.707   2.5992 -4.500259 4.396954 
1 1 1   13    7  -15 o  184.956   1.7875  1395.16   26.949  1448.52   43.577  1362.12   34.293  188.367   2.8381  182.714   2.3025 5.653137 3.654581 
1 1 1   13    7  -14 o   54.190   2.5715  120.116   11.327  112.485   19.198  124.190   14.028   52.229   4.5548   55.056   3.1388 -2.827106 5.531586 
1 1 1   13    7  -13 o  110.644   1.9053  499.322   17.184  482.965   35.259  504.417   19.679  108.611   3.9894  111.195   2.1712 -2.584557 4.541915 
1 1 1   13    7  -12 o   76.502   2.1874  238.954   13.627  189.432   28.283  253.925   15.551   67.803   5.1560   78.848   2.4224 -11.04523 5.696683 
1 1 1   13    7  -11 o   33.508   4.1088   46.595   10.988   20.897   24.444   53.102   12.301   24.999   9.1672   35.775   4.3045 -10.77668 10.12748 
1 1 1   13    7  -10 o  281.999   2.3102  3244.55   53.106  3183.81   93.760  3273.23   64.439  279.029   4.1222  283.175   2.7916 -4.145660 4.978535 
1 1 1   13    7   -9 o  123.090   1.6892  617.863   16.948  616.432   27.684  618.721   21.435  122.890   2.7636  123.155   2.1352 -0.2647552 3.492351 
1 1 1   13    7   -8 o   66.751   2.1084  181.940   11.458  161.007   19.674  192.684   14.095   62.643   3.8718   68.669   2.5223 -6.026215 4.620925 
1 1 1   13    7   -7 o   98.643   1.9258  396.867   15.485  366.616   23.033  421.816   20.917   94.714   2.9870  101.670   2.5239 -6.955711 3.910570 
1 1 1   13    7   -6 o  177.249   2.0145  1281.48   29.106  1302.95   47.144  1268.25   36.999  178.618   3.2379  176.288   2.5747 2.329239 4.136810 
1 1 1   13    7   -5 o  217.665   2.1653  1932.73   38.418  1969.83   61.868  1909.44   49.013  219.592   3.4563  216.287   2.7800 3.305298 4.435602 
1 1 1   13    7   -4 o  286.873   2.3077  3357.57   53.965  3222.96   74.434  3506.72   78.354  280.924   3.2505  293.024   3.2803 -12.10025 4.618034 
1 1 1   13    7   -3 o  245.058   2.0970  2449.66   41.889  2409.55   58.960  2490.53   59.525  242.941   2.9773  246.992   2.9565 -4.051559 4.195865 
1 1 1   13    7   -2 o  103.433   1.6704  436.267   14.083  429.196   22.138  441.075   18.254  102.516   2.6514  103.983   2.1535 -1.467049 3.415777 
1 1 1   13    7   -1 o   83.597   1.7764  285.004   12.105  293.634   19.486  279.582   15.447   84.768   2.8240   82.750   2.2922 2.017891 3.637207 
1 1 1   13    7    0 o  112.369   1.6359  514.898   14.984  514.825   23.621  514.946   19.384  112.319   2.5799  112.355   2.1164 -0.3629303E-01 3.336932 
1 1 1   13    7    1 o   63.370   2.0506  163.973   10.579  153.236   16.795  171.035   13.620   61.158   3.3820   64.687   2.5883 -3.529636 4.258825 
1 1 1   13    7    2 o   52.839   2.4627  114.172   10.578   95.564   15.767  129.404   14.266   48.179   4.0522   56.209   3.1258 -8.029846 5.117716 
1 1 1   13    7    3 o  100.825   1.6942  414.552   13.924  423.233   22.276  408.985   17.839  101.798   2.6869  100.128   2.1857 1.670197 3.463592 
1 1 1   13    7    4 o  152.754   1.6424  951.509   20.451  932.663   31.801  964.799   26.705  151.176   2.5806  153.790   2.1303 -2.613480 3.346280 
1 1 1   13    7    5 o  133.789   1.6258  729.905   17.731  752.487   27.965  714.724   22.929  135.794   2.5264  132.367   2.1250 3.427719 3.301274 
1 1 1   13    7    6 o  128.349   1.7802  671.826   18.625  644.370   26.408  699.002   26.273  125.657   2.5782  130.883   2.4626 -5.225830 3.565294 
1 1 1   13    7    7 o  164.699   1.9904  1106.42   26.722  1091.03   42.811  1116.24   34.203  163.450   3.2132  165.389   2.5370 -1.939621 4.093990 
1 1 1   13    7    8 o  280.107   2.2787  3201.02   52.029  3151.55   73.237  3251.42   73.927  277.793   3.2343  282.163   3.2141 -4.370911 4.559733 
1 1 1   13    7    9 o   86.005   2.0097  301.713   14.090  300.612   20.613  302.678   19.303   85.759   2.9530   86.069   2.7549 -0.3104095 4.038539 
1 1 1   13    7   10 o  232.196   1.9005  2198.99   35.972  2211.26   55.721  2190.22   47.103  232.729   2.9372  231.673   2.4942 1.055725 3.853344 
1 1 1   13    7   11 o  195.363   1.7733  1556.54   28.240  1515.12   43.287  1587.23   37.262  192.662   2.7563  197.236   2.3176 -4.574203 3.601182 
1 1 1   13    7   12 o  116.344   1.6921  552.007   16.047  550.436   25.269  553.069   20.774  116.130   2.6693  116.434   2.1888 -0.3044586 3.451974 
1 1 1   13    7   13 o  118.677   1.8369  574.425   17.770  601.266   26.095  551.215   24.266  121.374   2.6375  116.218   2.5614 5.156898 3.676573 
1 1 1   13    7   14 o  201.317   1.9314  1653.09   31.695  1610.77   54.263  1675.00   39.049  198.572   3.3523  202.609   2.3643 -4.036453 4.102225 
1 1 1   13    7   15 o   31.514   4.3611   41.397   10.903   53.599   19.594   35.924   13.122   35.481   7.0234   29.093   5.7372 6.387598 9.068858 
1 1 1   13    7   16 o   96.630   2.1140  380.914   16.652  437.978   27.900  349.339   20.753  103.495   3.3114   92.469   2.7564 11.02648 4.308486 
1 1 1   13    7   17 o   94.063   2.3820  361.262   18.250  416.464   27.642  318.610   24.298  100.913   3.3651   88.248   3.3840 12.66490 4.772349 
1 1 1   13    7   18 o   61.528   2.8637  154.886   14.323  209.239   24.930  128.103   17.500   71.388   4.3040   55.846   3.8681 15.54219 5.786819 
1 1 1   13    7   19 o  105.278   1.8078  452.035   15.514  450.245   24.370  453.255   20.117  104.979   2.8505  105.396   2.3415 -0.4173355 3.688869 
1 1 1   13    7   20 o   80.190   1.9734  262.295   12.900  265.653   20.616  260.134   16.537   80.591   3.1442   79.797   2.5455 0.7940063 4.045456 
1 1 1   13    7   21 o   89.845   2.1780  329.322   15.951  335.232   21.502  322.088   23.786   90.566   2.9164   88.736   3.2942 1.829750 4.399662 
1 1 1   13    7   22 o  100.547   2.0802  412.423   17.050  416.032   22.985  408.008   25.422  100.910   2.7970   99.902   3.1256 1.008720 4.194403 
1 1 1   13    7   23 o  139.744   1.8069  796.486   20.583  811.803   30.204  783.205   28.125  141.026   2.6274  138.530   2.4907 2.495895 3.620309 
1 1 1   13    7   24 o  246.207   2.1187  2473.05   42.521  2513.48   61.425  2435.85   58.920  248.082   3.0375  244.234   2.9595 3.848297 4.240894 
1 1 1   13    7   25 o  168.285   1.8296  1155.10   25.097  1204.87   37.097  1113.10   34.080  171.801   2.6490  165.140   2.5317 6.661270 3.664232 
1 1 1   13    7   26 o   91.829   1.7711  343.937   13.257  357.669   21.813  335.893   16.695   93.546   2.8639   90.728   2.2574 2.817764 3.646625 
1 1 1   13    7   27 f   75.185   2.0541  230.793   12.577  219.947   23.843  234.975   14.804   73.214   4.0104   75.840   2.3977 -2.626259 4.672531 
1 1 1   13    7   28 o   68.572   2.1084  192.032   11.771  209.335   23.013  185.901   13.699   71.422   3.9683   67.440   2.4962 3.982605 4.688127 
1 1 1   13    7   29 o  106.286   1.7823  460.788   15.442  459.689   28.868  461.228   18.276  106.002   3.3451  106.320   2.1088 -0.3184967 3.954348 
1 1 1   13    7   30 o   79.775   1.8363  259.607   11.941  257.271   19.525  261.004   15.094   79.300   3.0260   79.936   2.3189 -0.6359482 3.812344 
1 1 1   13    7   31 f  117.505   1.6271  563.142   15.585  570.052   25.267  558.899   19.801  118.158   2.6233  117.036   2.0755 1.122208 3.345104 
1 1 1   13    7   32 o   57.460   2.3296  134.987   10.889  145.868   20.128  130.485   12.947   59.540   4.1737   56.451   2.8226 3.088943 5.038536 
1 1 1   13    7   33 o  104.697   1.7593  447.141   15.015  470.588   27.455  437.137   17.934  107.259   3.1436  103.498   2.1257 3.761284 3.794826 
1 1 1   13    7   34 o  132.745   1.7278  718.807   18.696  734.190   33.769  712.007   22.451  134.033   3.0908  132.090   2.0851 1.942535 3.728428 
1 1 1   13    7   35 o  121.799   1.7334  605.162   17.210  599.528   31.034  607.664   20.681  121.068   3.1473  122.027   2.0791 -0.9584045 3.772031 
1 1 1   13    7   36 o   81.149   1.9119  268.686   12.647  235.681   23.361  282.371   15.042   75.787   3.7935   83.145   2.2214 -7.357750 4.396067 
1 1 1   13    7   37 o   93.950   2.0573  360.215   15.755  380.216   25.804  348.328   19.894   96.370   3.2897   92.310   2.6466 4.060196 4.222115 
1 1 1   13    7   38 o   64.423   2.4601  169.725   12.895  201.407   21.686  152.395   16.039   70.033   3.8131   60.962   3.2392 9.071648 5.003182 
1 1 1   13    7   39 o   56.507   2.6710  130.729   12.268  150.496   20.408  119.544   15.352   60.454   4.1668   53.937   3.5107 6.517117 5.448647 
1 1 1   13    7   40 o   47.114   3.1231   91.163   11.927  112.484   19.751   78.927   14.963   52.134   4.6980   43.669   4.2573 8.464581 6.340061 
1 1 1   13    7   41 o   91.911   1.9682  344.773   14.746  325.545   23.995  356.440   18.692   89.140   3.3080   93.386   2.4576 -4.245399 4.120993 
1 1 1   13    7   42 o   36.814   3.2199   55.863   9.5652   82.985   18.066   45.299   11.275   44.639   5.0537   32.954   4.2998 11.68426 6.635362 
1 1 1   13    7   43 o   23.324   6.0369   23.314   11.566   6.7678   16.744   38.410   15.994   18.295   7.3496   29.871   6.7307 -11.57581 9.965836 
1 1 1   13    7   44 o   28.113   4.9107   33.436   10.844   25.115   23.552   35.675   12.216   25.803   9.0532   28.975   5.3699 -3.171745 10.52597 
1 1 1   13    7   45 f   61.518   2.9205  155.114   14.604  168.072   28.889  150.666   16.925   63.576   5.6327   60.561   3.4427 3.015202 6.601519 
1 1 1   13    7   46 o   24.908   5.9506   26.666   11.916   22.115   23.857   28.178   13.754   24.977   9.0722   25.587   6.5632 -0.6104240 11.19733 
1 1 1   13    7   47 o   31.337   4.8901   41.363   12.084   68.143   26.056   34.026   13.639   39.611   8.3342   28.143   6.1201 11.46777 10.33994 
1 1 1   13    7   48 o   32.390   3.7815   43.601   9.7964   28.646   16.688   51.464   12.101   25.898   7.4850   35.133   4.3159 -9.234898 8.640154 
1 1 1   13    7   49 o   62.309   2.3002  158.835   11.663  156.749   20.521  159.831   14.175   61.643   4.1073   62.449   2.7916 -0.8052864 4.966155 
1 1 1   13    7   50 o   35.525   3.4185   52.194   9.7772   37.178   17.077   59.516   11.925   29.273   7.2060   37.876   3.9190 -8.603701 8.202744 
1 1 1   13    7   51 o  129.723   1.8731  687.077   19.807  697.103   32.877  681.364   24.817  130.469   3.0913  129.117   2.3579 1.352539 3.887937 
1 1 1   13    7   52 o  161.203   1.8326  1061.01   24.081  1056.84   36.002  1064.38   32.393  160.710   2.7482  161.345   2.4630 -0.6344452 3.690392 
1 1 1   13    7   53 f   89.180   1.9490  324.824   14.168  309.194   22.397  335.252   18.293   86.803   3.1706   90.509   2.4819 -3.705467 4.026479 
1 1 1   13    7   54 o   38.639   3.2999   61.668   10.294   74.194   19.093   56.535   12.223   41.904   5.7404   36.837   4.1421 5.066605 7.078809 
1 1 1   13    7   55 o  102.739   1.9503  431.198   16.333  440.892   27.867  426.125   20.159  103.612   3.3037  102.068   2.4230 1.543625 4.096954 
1 1 1   13    7   56 o   91.705   2.0497  343.687   15.322  302.568   25.758  366.205   19.061   85.707   3.6956   94.571   2.4747 -8.864212 4.447647 
1 1 1   13    7   57 o   17.761   5.8589   12.626   9.8425   0.5872   18.607   17.303   11.598   17.367   7.4205   20.347   6.3253 -2.979715 9.750534 
1 1 1   13    7   58 o   51.306   2.6287  108.097   10.957  119.743   20.098  103.172   13.070   53.595   4.6461   50.024   3.2224 3.571106 5.654222 
1 1 1   13    7   59 o   54.343   2.4956  121.187   11.026  101.293   19.051  131.206   13.520   49.198   4.8118   56.476   2.9470 -7.277843 5.642575 
1 1 1   13    7   60 o   22.475   4.9271   21.775   8.7772   6.0532   15.123   29.761   10.778   17.207   6.9591   26.300   5.2118 -9.093136 8.694361 
1 1 1   13    7   61 o   52.590   2.3610  113.482   10.095  114.367   16.580  112.961   12.726   52.494   3.9026   52.362   2.9941 0.1314240 4.918853 
1 1 1   13    7   62 o   23.635   4.5293   23.930   8.4086   15.340   14.442   28.335   10.342   20.050   7.0848   25.634   5.1288 -5.583296 8.746360 
1 1 1   13    7   63 o   48.843   2.5730   98.122   10.208   75.629   19.127  107.081   12.071   42.066   5.7265   50.966   2.9177 -8.899975 6.426926 
1 1 1   13    7   64 o   20.524   5.2155   18.318   8.7421   14.732   17.111   19.585   10.169   20.505   7.6425   21.204   5.7430 -0.6984653 9.559846 
1 1 1   13    7   65 o   39.018   3.2171   63.166   10.141   51.719   18.481   68.098   12.131   34.207   6.8666   40.404   3.7252 -6.197025 7.811980 
1 1 1   13    7   66 o   81.407   1.9975  271.374   13.255  251.783   19.088  289.622   18.422   78.128   3.0027   83.896   2.6973 -5.767990 4.036325 
1 1 1   13    7   67 o   33.381   3.3818   46.519   9.0752   32.610   14.644   55.191   11.563   27.023   6.6852   36.234   3.9805 -9.210171 7.780518 
1 1 1   13    7   68 o   23.185   4.8029   23.364   8.7785   53.133   18.771   15.031   9.9315   34.487   6.9181   18.768   5.8562 15.71892 9.063969 
1 1 1   13    7   69 o   53.936   2.2407  119.616   9.8298  103.574   16.004  129.335   12.456   49.703   3.9834   55.968   2.7386 -6.265606 4.834017 
1 1 1   13    7   70 o   60.051   2.5656  148.709   12.530  133.883   16.679  167.913   18.982   56.638   3.6318   63.432   3.6870 -6.793655 5.175367 
1 1 1   13    7   71 o   74.186   2.2778  226.414   13.758  204.515   18.112  256.283   21.153   70.194   3.1737   78.531   3.3119 -8.337044 4.587011 
1 1 1   13    7   72 o   29.497   3.4383   36.646   8.1124   8.4846   14.252   50.143   9.8667   17.228   6.8270   34.528   3.5565 -17.29958 7.697816 
1 1 1   13    7   73 o   47.520   2.1970   93.046   8.4874   93.875   12.947   92.420   11.239   47.387   3.3739   47.159   2.9383 0.2275696 4.474016 
1 1 1   13    7   74 o   89.175   1.7594  326.055   12.789  314.954   17.254  339.593   19.053   87.377   2.4248   90.661   2.5808 -3.284035 3.541183 
1 1 1   13    7   75 o   30.020   3.0696   37.800   7.4060   41.360   12.052   35.639   9.3878   30.758   4.9766   28.821   4.1125 1.937660 6.455911 
1 1 1   13    7   76 o   35.163   2.6990   51.467   7.6771   40.699   12.273   58.388   9.8397   30.403   5.1350   37.291   3.2701 -6.887556 6.087864 
1 1 1   13    7   77 o   55.159   1.9624  125.243   8.8097  130.028   13.533  121.725   11.605   55.847   2.9837   54.163   2.6365 1.683731 3.981609 
1 1 1   13    7   78 o   46.065   2.4230   87.928   9.0664  110.424   14.590   73.775   11.572   51.191   3.5177   41.837   3.4231 9.354134 4.908379 
1 1 1   13    7   79 o   27.856   3.3394   32.924   7.4317   20.733   11.332   42.123   9.8441   21.259   6.1749   31.331   3.9415 -10.07158 7.325662 
1 1 1   13    7   80 o   20.446   3.9112   18.245   6.2811   22.835   10.906   15.966   7.6835   22.270   5.9101   18.855   4.9405 3.414925 7.703121 
1 1 1   13    7   81 o   28.089   2.7905   33.135   6.3048   26.341   11.260   36.238   7.6095   23.907   5.8309   29.239   3.2474 -5.331947 6.674187 
1 1 1   13    7   82 o   18.698   3.4299   15.136   5.0352   42.634   13.326   10.556   5.4383   30.697   5.5291   15.454   4.2056 15.24246 6.946763 
1 1 1   13    7   83 o   30.543   2.1013   38.683   5.1997   37.064   13.799   38.951   5.6135   28.195   6.1753   30.607   2.2661 -2.411654 6.577968 
1 1 1   13    7   84 o   24.748   5.1061   27.741   9.9586   34.950   13.504   19.147   14.744   27.277   6.2128   20.488   7.1650 6.789152 9.483468 
1 1 1   13    7   85 o   48.443   2.5952   97.971   10.211   96.409   12.742  100.773   17.068   47.710   3.2967   48.089   4.4030 -0.3789978 5.500420 
1 1 1   13    7   86 o   37.289   3.1212   58.901   9.4001   58.472   11.688   59.685   15.817   36.735   3.9661   36.150   5.5443 0.5848045 6.816845 
1 1 1   13    7   87 o   10.697   4.8648  -3.9869   9.2807 -10.0306   12.122   4.5741   14.427   11.110   5.2247   15.465   6.5682 -4.354887 8.392800 
1 1 1   13    7   88 o   44.756   2.7339   84.254   9.9264   71.665   12.171  109.262   17.154   40.736   3.7059   49.934   4.2549 -9.198757 5.642503 
1 1 1   13    7   89 o   30.004   3.9644   39.562   9.4591   18.977   11.460   83.575   16.756   19.837   6.3044   43.072   4.8571 -23.23557 7.958492 
1 1 1   13    7   90 o   43.787   2.8438   81.190   10.095   69.251   12.237  106.632   17.863   39.832   3.8155   48.856   4.5373 -9.024441 5.928293 
1 1 1   13    7   91 o   38.002   3.2444   62.108   9.9540   64.499   12.148   57.223   17.364   38.260   3.9520   33.978   6.5063 4.282375 7.612481 
1 1 1   13    7   92 o   26.673   4.8475   32.996   10.151   32.280   12.800   34.210   16.666   25.405   6.2295   25.097   7.5406 0.3081837 9.781019 
1 1 1   13    7   93 o   10.119   4.6537  -4.3463   8.8123   2.9712   12.094 -12.6302   12.867   13.695   5.9183   10.824   5.1739 2.871451 7.861059 
1 1 1   13    7   94 o   11.134   5.0320  -2.3124   9.7449   4.1919   14.400  -7.8073   13.236   14.751   6.4159   11.752   5.5055 2.998524 8.454301 
1 1 1   13    7   95 o   19.427   5.5725   18.802   9.2829   11.940   12.760   26.516   13.530   16.460   6.4793   22.170   6.8216 -5.709455 9.408319 
1 1 1   13    7   96 o   31.091   3.7924   43.331   9.4126   37.313   12.596   50.941   14.164   27.198   5.8549   32.151   5.6085 -4.952255 8.107727 
1 1 1   13    7   97 o   44.783   3.0099   86.790   10.924   83.394   13.876   92.324   17.714   42.950   4.0098   44.022   5.0264 -1.072086 6.429841 
1 1 1   13    7   98 o   25.535   5.0519   31.678   10.143   33.409   13.023   29.009   16.172   25.041   6.3669   22.144   7.5136 2.896532 9.848425 
1 1 1   13    7   99 o   21.597   5.5506   23.719   9.8244   20.587   12.479   28.824   15.932   19.427   6.6002   22.051   7.4578 -2.624407 9.958967 
1 1 1   13    7  100 o   8.2164   4.0414 -16.2063   9.4729  -6.3839   12.297 -30.5443   14.857   11.310   5.3011   9.4638   4.7238 1.846668 7.100426 
1 1 1   13    7  101 f   25.104   6.2832   33.888   12.826   33.888   12.826   0.0000   0.0000   25.104   6.2832  ?   ?  0.000000 6.283220 
1 1 1   13    7  102 o   25.384   6.4702   35.358   13.426   35.358   13.426   0.0000   0.0000   25.384   6.4702  ?   ?  0.000000 6.470213 
1 1 1   13    7  103 o   13.858   5.6205   7.5102   9.8969  -6.4896   12.715   29.026   15.763   11.392   5.3554   21.773   7.4176 -10.38184 9.148775 
1 1 1   13    7  104 f   16.163   6.3744   12.919   12.371   17.166   15.451   5.3349   20.649   17.703   7.0776   15.727   7.1921 1.975494 10.09057 
1 1 1   13    7  105 o   11.639   5.3909  -3.5198   12.134 -12.2638   15.029   12.848   20.562   11.400   5.4867   16.964   7.5123 -5.563711 9.302644 
1 1 1   13    7  106 o   22.144   6.5769   28.061   12.734   17.348   15.950   46.892   21.147   17.630   7.1408   25.710   8.5914 -8.080101 11.17149 
1 1 1   13    7  107 o   13.251   6.4436 -15.2055   22.115 -15.2055   22.115   0.0000   0.0000   13.251   6.4436  ?   ?  0.000000 6.443578 
1 1 1   13    7  108 o   12.865   6.0648  -5.0198   16.510  -5.0198   16.510   0.0000   0.0000   12.865   6.0648  ?   ?  0.000000 6.064817 
1 1 1   13    7  109 o   12.537   5.9503  -6.7694   16.403  -6.7694   16.403   0.0000   0.0000   12.537   5.9503  ?   ?  0.000000 5.950252 
1 1 1   13    7  110 o   14.313   6.5168   3.4403   16.715   3.4403   16.715   0.0000   0.0000   14.313   6.5168  ?   ?  0.000000 6.516838 
1 1 1   13    8 -108 o   17.375   7.1974   17.165   16.668   17.165   16.668   0.0000   0.0000   17.375   7.1974  ?   ?  0.000000 7.197356 
1 1 1   13    8 -107 o   19.249   7.3445   23.575   16.013   23.575   16.013   0.0000   0.0000   19.249   7.3445  ?   ?  0.000000 7.344493 
1 1 1   13    8 -106 o   17.330   6.7423   17.149   13.683   17.149   13.683   0.0000   0.0000   17.330   6.7423  ?   ?  0.000000 6.742298 
1 1 1   13    8 -105 o   25.350   6.5809   36.825   13.717   36.825   13.717   0.0000   0.0000   25.350   6.5809  ?   ?  0.000000 6.580927 
1 1 1   13    8 -104 o   16.115   6.4868   13.227   13.072   13.227   13.072   0.0000   0.0000   16.115   6.4868  ?   ?  0.000000 6.486848 
1 1 1   13    8 -103 o   11.024   5.2418  -8.3902   12.850  -8.3902   12.850   0.0000   0.0000   11.024   5.2418  ?   ?  0.000000 5.241817 
1 1 1   13    8 -102 o   20.802   6.8478   25.581   13.448   25.581   13.448   0.0000   0.0000   20.802   6.8478  ?   ?  0.000000 6.847768 
1 1 1   13    8 -101 o   37.489   4.9536   68.631   14.767   68.631   14.767   0.0000   0.0000   37.489   4.9536  ?   ?  0.000000 4.953574 
1 1 1   13    8 -100 o   14.327   6.2032   6.2497   13.336   6.2497   13.336   0.0000   0.0000   14.327   6.2032  ?   ?  0.000000 6.203222 
1 1 1   13    8  -99 o   11.767   5.4673  -4.2045   12.628  -4.2045   12.628   0.0000   0.0000   11.767   5.4673  ?   ?  0.000000 5.467290 
1 1 1   13    8  -98 o   11.813   5.2804   0.2197   10.405  -2.9878   12.604   7.0825   18.437   12.023   5.5424   15.733   7.0311 -3.710047 8.952900 
1 1 1   13    8  -97 o   9.0029   4.3739 -13.3027   10.130 -19.1659   12.329  -1.1173   17.774   9.4026   4.6220   14.171   6.5500 -4.768197 8.016593 
1 1 1   13    8  -96 f   17.903   6.0359   16.750   10.436   28.091   13.092  -3.0147   17.283   22.469   6.6675   13.777   6.3997 8.691576 9.241782 
1 1 1   13    8  -95 o   9.3632   4.5038 -11.1010   10.095 -13.5291   12.175  -5.7596   18.058   10.107   4.8825   13.628   6.3991 -3.521886 8.049085 
1 1 1   13    8  -94 o   12.573   5.4371   2.7876   10.220   3.9215   12.370   0.3500   18.137   13.690   5.9506   14.688   6.7258 -0.9976921 8.980336 
1 1 1   13    8  -93 o   31.765   3.5963   44.940   9.1481   44.368   13.020   45.499   12.857   29.939   5.5388   30.485   5.3699 -0.5459881 7.714566 
1 1 1   13    8  -92 o   13.508   5.2970   6.9734   8.4999   17.230   12.192  -2.7274   11.857   18.287   6.5047   11.981   5.4680 6.305352 8.497711 
1 1 1   13    8  -91 o   33.627   3.4109   49.581   9.2204   42.058   13.230   56.687   12.857   29.144   5.7733   35.008   4.6180 -5.863462 7.393045 
1 1 1   13    8  -90 o   15.068   5.4760   10.033   8.6935   5.4264   12.576   14.249   12.031   14.488   6.1420   17.342   6.4188 -2.853525 8.883983 
1 1 1   13    8  -89 o   13.920   5.3461   7.4816   8.5213   8.8054   12.128   6.1907   11.976   15.476   6.2416   14.590   6.0771 0.8856516 8.711394 
1 1 1   13    8  -88 o   29.489   3.8555   38.511   9.0460   51.734   13.345   27.271   12.304   33.352   5.0680   23.235   6.3271 10.11650 8.106557 
1 1 1   13    8  -87 o   9.4999   4.4503  -6.7996   8.6484  -3.4289   12.835  -9.6025   11.704   12.583   5.7218   10.790   5.0928 1.792291 7.659986 
1 1 1   13    8  -86 o   18.327   5.2254   15.807   8.1863   0.8592   11.168   33.169   12.035   12.894   5.6284   26.296   5.7733 -13.40223 8.062897 
1 1 1   13    8  -85 o   22.365   4.7186   22.908   8.3317   17.766   11.466   28.661   12.128   19.270   6.3220   24.279   6.1284 -5.008863 8.804781 
1 1 1   13    8  -84 o   24.738   4.8853   27.957   9.5015   18.255   15.301   34.047   12.122   19.807   7.2545   26.877   5.7094 -7.069567 9.231739 
1 1 1   13    8  -83 o   43.662   3.0080   80.600   10.640   87.829   17.280   76.186   13.504   44.357   4.8584   41.871   4.0054 2.485836 6.296597 
1 1 1   13    8  -82 o   51.324   2.8829  110.742   12.013  132.643   18.285   94.111   15.933   55.361   4.0805   46.472   4.2533 8.889015 5.894151 
1 1 1   13    8  -81 o   36.457   3.1477   56.295   9.2627   46.810   13.359   65.075   12.854   32.149   5.2810   38.708   4.1380 -6.558674 6.709109 
1 1 1   13    8  -80 o   18.529   5.1175   15.631   7.9845   19.373   10.950   11.381   11.668   20.385   6.1093   16.934   6.3111 3.451340 8.783704 
1 1 1   13    8  -79 o   43.931   2.4824   80.339   8.8533   75.354   11.833   86.678   13.343   42.120   3.4775   45.095   3.6614 -2.975487 5.049636 
1 1 1   13    8  -78 o   6.5422   3.2754 -19.9986   7.3918 -14.9884   10.021 -25.9795   10.948   9.0818   4.3976   8.2609   4.1125 0.8209028 6.020906 
1 1 1   13    8  -77 o   17.195   5.1656   13.187   7.8213   25.456   10.760  -0.5588   11.389   23.533   5.6753   12.955   5.6690 10.57745 8.021640 
1 1 1   13    8  -76 o   21.791   4.9392   21.340   8.5700   23.746   12.475   19.189   11.793   22.543   6.4581   20.459   6.3812 2.083765 9.078916 
1 1 1   13    8  -75 o   25.807   4.0281   28.859   8.1971   39.123   11.370   17.749   11.829   29.778   4.8508   19.849   6.4151 9.929146 8.042630 
1 1 1   13    8  -74 o   34.662   3.2243   50.621   9.0057   48.345   11.779   53.822   13.971   33.391   4.4375   34.967   5.0475 -1.576393 6.720735 
1 1 1   13    8  -73 o   53.554   2.3627  118.654   10.289  109.856   13.293  131.797   16.249   51.209   3.2005   55.920   3.5835 -4.711220 4.804640 
1 1 1   13    8  -72 o   20.916   4.0591   19.058   6.6710   10.967   11.214   23.489   8.2990   16.923   6.2086   23.112   4.5670 -6.189363 7.707412 
1 1 1   13    8  -71 o   66.982   1.6694  183.948   9.1148  190.457   14.636  179.824   11.650   67.803   2.6532   66.059   2.1664 1.743355 3.425300 
1 1 1   13    8  -70 o   71.771   1.6365  211.083   9.5740  213.622   15.250  209.432   12.300   71.857   2.6078   71.329   2.1178 0.5282974 3.359459 
1 1 1   13    8  -69 o   51.705   1.9203  109.891   8.0793  124.729   13.245  101.099   10.196   54.772   2.9778   49.432   2.5388 5.339386 3.913163 
1 1 1   13    8  -68 o   37.964   2.4081   59.601   7.4138   67.654   12.212   54.901   9.3299   40.051   3.7854   36.230   3.1918 3.820995 4.951440 
1 1 1   13    8  -67 o   35.440   2.5599   52.036   7.3455   60.777   11.977   46.766   9.2999   37.921   3.9316   33.356   3.4710 4.565105 5.244594 
1 1 1   13    8  -66 o   17.565   5.1944   13.383   7.9571   6.2664   10.732   22.072   11.858   15.077   5.9399   22.222   6.2732 -7.145928 8.639133 
1 1 1   13    8  -65 o   9.5762   4.4474  -6.8844   8.3418  -4.3984   10.658 -10.8160   13.403   11.773   5.2969   12.065   5.6147 -0.2912970 7.718945 
1 1 1   13    8  -64 o   87.286   1.6459  311.751   11.710  304.444   16.725  318.779   16.402   86.038   2.3870   88.075   2.2865 -2.036133 3.305454 
1 1 1   13    8  -63 o   56.139   1.8566  129.200   8.4844  151.282   11.923  106.545   12.076   60.633   2.4171   50.747   2.9319 9.886532 3.799772 
1 1 1   13    8  -62 o   71.361   1.7684  208.396   10.287  215.133   13.147  197.762   16.518   72.385   2.2309   69.210   2.9346 3.174126 3.686243 
1 1 1   13    8  -61 o   42.562   2.2896   74.518   7.9144   78.325   11.066   70.532   11.323   43.466   3.1446   41.174   3.4041 2.291698 4.634262 
1 1 1   13    8  -60 o   74.745   1.7379  228.494   10.589  217.593   14.697  240.259   15.269   72.769   2.4814   76.476   2.4525 -3.707382 3.488839 
1 1 1   13    8  -59 o   32.775   2.9438   44.537   7.7811   43.447   11.596   45.430   10.494   31.987   4.5778   32.874   3.9984 -0.8861980 6.078090 
1 1 1   13    8  -58 o  153.919   1.7356  968.563   21.776  929.703   31.218  1005.39   30.390  150.535   2.5441  156.606   2.3806 -6.071655 3.484197 
1 1 1   13    8  -57 o   49.313   2.4404   99.922   9.7793  121.538   17.243   89.673   11.874   54.068   3.9394   46.581   3.1455 7.486736 5.041082 
1 1 1   13    8  -56 o   51.804   2.3147  110.123   9.7497  123.027   16.036  102.555   12.280   54.501   3.6302   49.865   3.0356 4.636120 4.732126 
1 1 1   13    8  -55 o  131.223   1.5903  703.341   17.010  728.429   27.675  688.108   21.565  133.318   2.5466  129.704   2.0397 3.614075 3.262752 
1 1 1   13    8  -54 o   49.069   2.2449   98.739   8.9553  101.913   16.113   97.321   10.772   49.523   4.0263   48.643   2.7276 0.8795776 4.863238 
1 1 1   13    8  -53 o   57.577   2.2280  135.835   10.437  131.124   23.306  137.017   11.673   55.920   5.1714   57.790   2.4838 -1.870300 5.736902 
1 1 1   13    8  -52 o   15.959   5.4312   9.8568   8.4509   14.040   21.438   9.0871   9.1954   21.782   8.4491   15.846   5.6478 5.935427 10.16295 
1 1 1   13    8  -51 o   53.622   2.2708  117.823   9.9033  119.806   17.736  116.924   11.938   53.755   4.0780   53.349   2.7544 0.4058647 4.921043 
1 1 1   13    8  -50 o  110.558   1.8311  499.299   16.502  605.662   35.443  469.858   18.647  121.330   3.5875  107.206   2.1338 14.12382 4.174146 
1 1 1   13    8  -49 o   45.470   2.5539   84.879   9.4280   89.480   16.984   82.830   11.335   46.337   4.5552   44.836   3.1209 1.501320 5.521737 
1 1 1   13    8  -48 o   82.068   1.7945  275.043   12.005  265.354   19.945  280.546   15.032   80.406   3.0486   82.812   2.2289 -2.405777 3.776470 
1 1 1   13    8  -47 o  101.700   1.8264  422.359   15.141  426.397   23.072  419.305   20.065  102.019   2.7770  101.257   2.4310 0.7625961 3.690730 
1 1 1   13    8  -46 o  137.954   1.6181  776.787   18.196  809.436   29.629  757.020   23.055  140.666   2.5840  136.123   2.0778 4.542206 3.315775 
1 1 1   13    8  -45 o  108.328   1.6277  478.963   14.373  492.910   23.639  470.783   18.104  109.768   2.6419  107.353   2.0689 2.415161 3.355601 
1 1 1   13    8  -44 o   88.019   1.7056  316.234   12.237  305.356   20.142  322.598   15.407   86.329   2.8662   88.864   2.1269 -2.535454 3.569174 
1 1 1   13    8  -43 o   31.316   3.3271   40.633   8.3633   34.040   14.865   43.687   10.116   28.053   6.6098   32.388   3.9108 -4.335537 7.680105 
1 1 1   13    8  -42 o   77.468   1.7790  244.966   11.234  237.278   18.720  249.293   14.044   76.076   3.0248   78.087   2.2086 -2.011009 3.745247 
1 1 1   13    8  -41 o   69.801   1.8737  199.039   10.651  207.572   17.848  194.319   13.274   71.143   3.0850   68.920   2.3662 2.223351 3.887959 
1 1 1   13    8  -40 o   54.517   2.2834  121.626   10.125  131.712   16.051  114.962   13.048   56.588   3.4968   52.915   3.0378 3.672356 4.632040 
1 1 1   13    8  -39 o  110.383   2.1237  497.564   19.109  502.375   26.901  492.665   27.148  110.771   2.9820  109.685   3.0393 1.086090 4.257868 
1 1 1   13    8  -38 o  105.819   2.1381  457.257   18.443  458.786   25.735  455.643   26.443  105.858   2.9853  105.480   3.0788 0.3785400 4.288454 
1 1 1   13    8  -37 o  115.142   1.9088  541.149   17.916  547.482   27.962  536.739   23.334  115.654   2.9685  114.611   2.4977 1.043152 3.879466 
1 1 1   13    8  -36 o   99.229   1.7421  401.801   14.092  424.511   25.120  391.373   17.022  101.826   3.0298   97.904   2.1329 3.922287 3.705292 
1 1 1   13    8  -35 o  134.124   1.6997  734.018   18.583  782.065   33.275  712.240   22.402  138.287   2.9519  132.082   2.0807 6.204880 3.611494 
1 1 1   13    8  -34 o   10.905   4.7974  -2.2495   8.2559 -16.7854   14.176   5.2116   10.156   11.732   5.5573   14.722   5.7849 -2.989731 8.021707 
1 1 1   13    8  -33 o   32.159   3.4182   42.803   8.8232   30.306   14.981   49.441   10.918   26.545   6.8706   34.508   3.9526 -7.963291 7.926424 
1 1 1   13    8  -32 o  123.469   1.7907  622.043   18.023  622.833   35.654  621.772   20.888  123.288   3.5514  123.417   2.0763 -0.1289139 4.113836 
1 1 1   13    8  -31 o   93.087   1.8096  353.575   13.731  368.939   24.524  346.559   16.572   94.923   3.1739   92.133   2.2066 2.789978 3.865554 
1 1 1   13    8  -30 o  205.846   1.7908  1728.87   30.049  1736.78   47.376  1723.55   38.867  206.151   2.8192  205.453   2.3208 0.6980133 3.651588 
1 1 1   13    8  -29 o   85.028   1.7973  294.980   12.457  272.412   20.363  308.476   15.747   81.570   3.0680   86.898   2.2249 -5.327988 3.789839 
1 1 1   13    8  -28 o  100.134   1.8065  409.102   14.746  404.315   27.550  411.024   17.457   99.355   3.4067  100.349   2.1341 -0.9930954 4.019974 
1 1 1   13    8  -27 o   63.896   2.0622  166.796   10.727  141.459   17.664  181.596   13.501   58.670   3.7126   66.638   2.4898 -7.968731 4.470199 
1 1 1   13    8  -26 o  106.773   1.6818  465.061   14.638  449.217   23.668  474.875   18.627  104.823   2.7723  107.866   2.1185 -3.042809 3.489093 
1 1 1   13    8  -25 o   53.469   2.3633  116.949   10.275  116.266   17.141  117.332   12.837   53.135   3.9864   53.503   2.9550 -0.3675652 4.962233 
1 1 1   13    8  -24 o   85.853   1.7808  300.694   12.463  274.427   20.310  316.557   15.783   81.886   3.0480   88.066   2.1987 -6.180122 3.758270 
1 1 1   13    8  -23 o   65.374   2.0276  174.565   10.792  179.503   18.387  171.970   13.330   66.163   3.4209   64.847   2.5265 1.315964 4.252746 
1 1 1   13    8  -22 o   50.028   2.7978  102.555   11.364   99.377   20.576  103.951   13.632   48.911   5.2424   50.311   3.3429 -1.399876 6.217537 
1 1 1   13    8  -21 o   98.621   1.8113  396.782   14.561  395.875   27.509  397.135   17.163   98.329   3.4374   98.647   2.1344 -0.3181534 4.046107 
1 1 1   13    8  -20 o   90.867   1.8650  336.857   13.814  288.712   25.419  357.035   16.456   83.919   3.7252   93.534   2.1583 -9.614510 4.305273 
1 1 1   13    8  -19 o  121.352   1.8040  600.750   17.845  565.807   35.159  612.874   20.711  117.548   3.6739  122.553   2.0732 -5.005768 4.218478 
1 1 1   13    8  -18 o   95.899   1.8948  375.198   14.812  395.418   30.564  368.992   16.933   98.229   3.8244   95.088   2.1846 3.141640 4.404419 
1 1 1   13    8  -17 o  127.593   1.8043  664.109   18.766  647.608   36.686  669.957   21.840  125.788   3.5815  128.135   2.0909 -2.347099 4.147202 
1 1 1   13    8  -16 o  121.918   1.6539  606.256   16.437  581.192   26.423  622.076   20.992  119.299   2.7171  123.473   2.0857 -4.173668 3.425336 
1 1 1   13    8  -15 o  126.214   1.6529  649.723   17.006  618.895   27.075  669.809   21.855  123.111   2.6980  128.123   2.0926 -5.011818 3.414361 
1 1 1   13    8  -14 o  174.986   1.7141  1248.93   24.449  1226.02   38.423  1264.52   31.694  173.275   2.7203  176.031   2.2088 -2.756363 3.504115 
1 1 1   13    8  -13 o  134.440   1.6649  737.172   18.246  715.354   29.111  751.289   23.416  132.360   2.6981  135.692   2.1170 -3.331726 3.429532 
1 1 1   13    8  -12 f  112.794   1.6979  518.910   15.611  568.444   26.003  490.996   19.520  117.990   2.7036  109.693   2.1831 8.297356 3.474956 
1 1 1   13    8  -11 o  150.924   1.7693  929.095   21.767  911.106   38.066  937.835   26.533  149.334   3.1271  151.605   2.1470 -2.271027 3.793248 
1 1 1   13    8  -10 o  208.604   1.9356  1775.20   32.914  1789.76   57.894  1768.25   40.009  209.259   3.3940  208.149   2.3580 1.110107 4.132749 
1 1 1   13    8   -9 o  102.170   1.8266  425.797   15.213  445.366   27.152  416.843   18.366  104.356   3.1957  101.070   2.2293 3.285873 3.896455 
1 1 1   13    8   -8 o  119.541   1.9132  582.943   18.643  567.720   30.122  592.395   23.735  117.841   3.1386  120.475   2.4169 -2.633980 3.961325 
1 1 1   13    8   -7 f  216.328   2.1437  1909.44   37.802  1878.33   59.922  1930.01   48.720  214.375   3.4291  217.413   2.7491 -3.037857 4.395003 
1 1 1   13    8   -6 o  148.013   1.9266  893.695   23.245  910.543   37.976  883.602   29.395  149.295   3.1205  147.135   2.4509 2.160187 3.967928 
1 1 1   13    8   -5 o   94.253   2.0119  362.421   15.458  353.984   25.514  367.313   19.429   93.009   3.3708   94.828   2.5157 -1.819679 4.206124 
1 1 1   13    8   -4 o  146.069   1.9182  870.357   22.840  886.646   37.283  860.571   28.897  147.326   3.1045  145.206   2.4413 2.119797 3.949426 
1 1 1   13    8   -3 o  145.688   1.9295  865.832   22.915  829.610   36.652  889.074   29.360  142.504   3.1553  147.592   2.4404 -5.087921 3.988881 
1 1 1   13    8   -2 f  119.183   1.7744  579.370   17.238  552.544   24.676  604.942   24.092  116.342   2.6019  121.746   2.4277 -5.403969 3.558595 
1 1 1   13    8   -1 o   84.042   1.9564  288.127   13.402  283.071   19.897  292.325   18.133   83.203   2.9383   84.580   2.6332 -1.377525 3.945598 
1 1 1   13    8    0 f  134.713   1.9937  740.335   21.893  746.665   28.239  730.800   34.661  135.247   2.5614  133.747   3.1792 1.499832 4.082695 
1 1 1   13    8    1 o   12.414   5.5157  -4.1270   11.176  -3.1717   14.427  -5.5608   17.674   14.591   6.3826   15.776   6.9766 -1.185450 9.455698 
1 1 1   13    8    2 f  208.355   2.1556  1771.27   36.610  1765.04   47.117  1780.77   58.158  207.913   2.7801  208.741   3.4180 -0.8283691 4.405852 
1 1 1   13    8    3 o   93.460   1.7934  356.277   13.663  394.017   21.730  331.602   17.571   98.200   2.7173   90.108   2.3943 8.092789 3.621656 
1 1 1   13    8    4 o  197.959   1.7691  1598.36   28.548  1590.21   43.940  1604.32   37.553  197.353   2.7314  198.274   2.3235 -0.9212494 3.585953 
1 1 1   13    8    5 o   99.805   1.7120  406.263   13.928  408.538   21.948  404.730   18.021   99.996   2.6951   99.593   2.2198 0.4038162 3.491592 
1 1 1   13    8    6 o  121.089   1.6471  597.993   16.257  580.152   25.232  610.658   21.258  119.212   2.5965  122.338   2.1317 -3.126038 3.359470 
1 1 1   13    8    7 f   18.298   5.5864   13.781   9.0959   28.990   14.902   4.7507   11.483   26.061   6.9052   15.276   6.1035 10.78549 9.215989 
1 1 1   13    8    8 o  109.598   1.8081  489.951   16.153  469.007   28.705  499.657   19.541  107.082   3.2925  110.659   2.1663 -3.577019 3.941235 
1 1 1   13    8    9 o  101.087   1.6896  416.767   13.922  424.646   22.082  411.569   17.936  101.951   2.6593  100.430   2.1910 1.520584 3.445623 
1 1 1   13    8   10 o   33.804   3.4188   47.181   9.2914   36.639   15.094   53.612   11.790   29.268   6.4963   35.966   4.0943 -6.697353 7.678828 
1 1 1   13    8   11 o   87.304   1.9252  310.932   13.701  305.186   20.121  315.900   18.708   86.398   2.8609   87.926   2.6130 -1.527512 3.874645 
1 1 1   13    8   12 f  197.786   1.9031  1595.84   30.683  1582.32   43.684  1609.00   43.108  196.854   2.7223  198.514   2.6640 -1.660187 3.808901 
1 1 1   13    8   13 o  138.863   1.7663  786.542   19.993  782.585   28.808  790.219   27.770  138.454   2.5525  139.137   2.4485 -0.6827393 3.536985 
1 1 1   13    8   14 o  100.150   1.8388  409.150   15.011  394.998   21.818  421.871   20.685   98.314   2.7251  101.658   2.4962 -3.343582 3.695566 
1 1 1   13    8   15 o  186.452   1.8557  1418.17   28.204  1445.18   40.798  1393.46   39.033  188.131   2.6604  184.742   2.5920 3.388458 3.714324 
1 1 1   13    8   16 o   22.042   5.1720   20.737   9.1318   8.1255   14.552   28.930   11.729   17.837   6.9492   26.035   5.6861 -8.198294 8.979044 
1 1 1   13    8   17 o  103.023   1.6762  432.915   14.076  443.583   22.250  425.796   18.176  104.196   2.6217  102.146   2.1829 2.049667 3.411562 
1 1 1   13    8   18 o  290.608   2.1482  3446.38   50.888  3406.38   77.559  3476.62   67.432  288.672   3.2960  291.745   2.8355 -3.072723 4.347848 
1 1 1   13    8   19 o   93.643   1.8551  357.745   14.161  342.319   25.091  364.956   17.154   91.441   3.3719   94.563   2.2254 -3.122032 4.040096 
1 1 1   13    8   20 o  102.240   1.7805  426.417   14.839  433.044   26.717  423.461   17.845  102.881   3.1897  101.864   2.1491 1.016891 3.846081 
1 1 1   13    8   21 o   78.846   2.1292  253.890   13.672  244.987   31.992  255.879   15.123   77.075   5.1210   79.137   2.3469 -2.062553 5.633192 
1 1 1   13    8   22 o  127.577   1.8886  664.054   19.640  602.779   44.186  679.141   21.925  121.178   4.4810  129.004   2.0850 -7.825912 4.942341 
1 1 1   13    8   23 o   82.502   1.9388  277.723   13.039  280.085   24.266  276.764   15.461   82.661   3.6100   82.308   2.3066 0.3532867 4.283947 
1 1 1   13    8   24 o   59.181   2.2959  143.186   11.055  132.151   16.555  152.064   14.851   56.720   3.5993   60.927   2.9995 -4.207024 4.685233 
1 1 1   13    8   25 o   40.766   2.8133   68.218   9.2913   73.128   15.170   65.270   11.754   41.993   4.5019   39.770   3.6669 2.223145 5.806313 
1 1 1   13    8   26 o   30.031   3.7636   37.488   9.0114   31.241   15.023   40.999   11.262   26.975   6.8273   31.297   4.5476 -4.321362 8.203243 
1 1 1   13    8   27 o   18.538   5.4594   14.363   8.8050   35.167   15.007   3.4412   10.873   28.621   6.5714   14.476   5.8839 14.14514 8.820583 
1 1 1   13    8   28 o   48.605   2.4696   96.725   9.7525  104.470   16.163   92.291   12.229   50.346   3.9706   47.402   3.1834 2.943825 5.089180 
1 1 1   13    8   29 o   18.069   5.5057   13.490   8.8408   32.823   14.985   3.1674   10.950   27.631   6.7189   14.420   5.8882 13.21084 8.933899 
1 1 1   13    8   30 o  104.085   1.7958  442.037   15.237  468.691   29.131  431.998   17.877  106.982   3.3445  102.874   2.1319 4.108162 3.966210 
1 1 1   13    8   31 o   34.221   3.3363   48.365   9.1888   42.280   15.556   51.626   11.388   31.453   6.2873   35.265   4.0341 -3.811651 7.470181 
1 1 1   13    8   32 o   33.074   3.4111   45.238   9.0645   31.849   15.343   52.418   11.235   27.203   6.9075   35.549   3.9433 -8.345280 7.953860 
1 1 1   13    8   33 o   40.806   2.8669   68.406   9.4757   80.315   15.825   61.750   11.831   44.007   4.4737   38.636   3.8059 5.370438 5.873559 
1 1 1   13    8   34 o  100.647   1.7848  413.365   14.643  433.602   26.948  404.886   17.443  102.892   3.2170   99.582   2.1488 3.309258 3.868632 
1 1 1   13    8   35 o   54.363   2.4539  120.977   10.846  122.779   21.470  120.359   12.567   54.419   4.8922   54.181   2.8555 0.2373581 5.664639 
1 1 1   13    8   36 o   44.297   3.0115   80.631   10.809   96.789   26.156   77.303   11.871   47.815   6.9109   43.321   3.3885 4.494011 7.696885 
1 1 1   13    8   37 o   65.071   2.3118  173.169   12.243  168.592   29.059  174.156   13.499   63.660   5.6588   65.233   2.5435 -1.572773 6.204144 
1 1 1   13    8   38 o   36.437   3.5215   54.891   10.329   48.522   24.665   56.245   11.375   33.370   8.9029   36.839   3.8444 -3.468525 9.697464 
1 1 1   13    8   39 o  115.409   3.0959  545.484   29.099   0.0000   0.0000  545.484   29.099  ?   ?   115.409   3.0959 0.000000 3.095915 
1 1 1   13    8   40 o   48.055   2.8291   94.778   11.033  100.603   18.807   91.722   13.624   49.216   4.7468   47.173   3.5695 2.042675 5.939186 
1 1 1   13    8   41 o   73.768   2.1981  222.477   13.203  215.038   21.374  227.067   16.789   72.328   3.6370   74.458   2.7710 -2.130798 4.572290 
1 1 1   13    8   42 o   73.960   2.2373  223.680   13.473  241.479   21.898  212.838   17.091   76.669   3.5132   72.060   2.9156 4.608849 4.565393 
1 1 1   13    8   43 o   62.075   2.4715  157.771   12.481  130.998   19.858  175.254   16.047   56.266   4.3637   65.359   3.0201 -9.092842 5.306856 
1 1 1   13    8   44 o   30.606   4.3409   39.290   10.526   64.090   16.874   23.490   13.468   38.999   5.4572   23.448   6.7079 15.55129 8.647340 
1 1 1   13    8   45 o   40.108   2.9051   66.200   9.4336   90.482   17.640   56.473   11.164   46.615   4.7067   36.898   3.7646 9.717121 6.027005 
1 1 1   13    8   46 o   22.782   4.9886   22.259   9.0068   23.538   17.785   21.818   10.445   24.013   7.8736   22.506   5.6911 1.507372 9.715001 
1 1 1   13    8   47 o   56.312   2.3245  129.864   10.647  152.025   20.286  121.438   12.509   60.640   4.1286   54.387   2.8313 6.253151 5.006110 
1 1 1   13    8   48 o   45.342   3.2870   84.772   12.066   99.161   19.648   76.059   15.289   48.710   5.0201   42.721   4.4559 5.989799 6.712353 
1 1 1   13    8   49 o   43.706   2.8867   78.602   10.227   89.202   18.717   74.091   12.211   46.147   5.0584   42.318   3.5732 3.828918 6.193126 
1 1 1   13    8   50 o   61.672   2.4730  155.899   12.407  185.235   20.911  139.961   15.413   66.978   3.8463   58.305   3.2560 8.672855 5.039399 
1 1 1   13    8   51 o   27.439   4.4493   31.874   9.6113   25.372   18.020   34.459   11.362   24.611   7.9146   28.411   5.0934 -3.799978 9.411902 
1 1 1   13    8   52 o   14.633   5.4423   6.9465   8.6682  -0.6748   15.878   10.182   10.346   15.778   6.7997   16.766   5.9891 -0.9883003 9.061184 
1 1 1   13    8   53 o   91.366   1.7647  341.051   13.143  346.089   22.654  338.495   16.136   91.773   3.0324   90.965   2.1762 0.8078613 3.732486 
1 1 1   13    8   54 o   44.110   2.5766   79.997   9.2240   65.649   16.384   86.654   11.161   39.377   5.2339   45.846   3.0030 -6.468472 6.034178 
1 1 1   13    8   55 o   64.221   1.9927  168.830   10.419  164.312   17.902  171.144   12.813   63.072   3.4958   64.591   2.4379 -1.519722 4.261928 
1 1 1   13    8   56 o   38.972   2.7289   62.618   8.6143   58.831   15.365   64.355   10.403   37.206   5.2088   39.415   3.2672 -2.208942 6.148682 
1 1 1   13    8   57 o   42.011   2.7214   72.744   9.2695   44.695   19.667   80.754   10.510   31.628   7.7014   44.235   2.9313 -12.60686 8.240437 
1 1 1   13    8   58 o   90.208   2.1851  333.285   16.068  307.223   26.305  348.797   20.294   86.124   3.7559   92.126   2.7053 -6.002335 4.628798 
1 1 1   13    8   59 o   43.257   2.7951   77.223   9.8030   76.482   19.226   77.483   11.396   42.230   5.7328   43.235   3.2575 -1.004681 6.593677 
1 1 1   13    8   60 o   69.110   1.9658  195.684   11.063  207.313   18.199  188.867   13.933   70.847   3.1592   67.779   2.5263 3.068069 4.045108 
1 1 1   13    8   61 o   13.495   5.1228   5.6224   7.7658   0.8450   13.872   7.8030   9.3719   15.007   6.4094   15.217   5.6590 -0.2095299 8.550085 
1 1 1   13    8   62 o   54.937   2.2267  124.000   9.9506  127.156   16.285  122.120   12.570   55.269   3.6350   54.380   2.8456 0.8885612 4.616311 
1 1 1   13    8   63 o   74.312   1.9299  226.380   11.680  210.258   18.679  236.733   14.968   71.245   3.2247   75.868   2.4234 -4.622719 4.033748 
1 1 1   13    8   64 o   83.242   1.8674  283.854   12.671  296.026   20.029  275.731   16.361   84.656   2.9068   81.856   2.4548 2.800041 3.804671 
1 1 1   13    8   65 o   9.5162   4.3536  -4.8040   7.5769  -2.2219   13.322  -6.0385   9.2118   13.848   6.0931   10.410   4.7766 3.437807 7.742209 
1 1 1   13    8   66 o   41.994   2.6354   72.973   8.9759   78.381   15.372   70.174   11.057   42.949   4.4554   40.991   3.3379 1.957829 5.567040 
1 1 1   13    8   67 o   14.708   5.1198   8.4414   7.5234   25.650   13.434   0.5774   9.0812   23.796   6.6627   12.170   5.1915 11.62578 8.446470 
1 1 1   13    8   68 o   38.890   2.7638   62.814   8.7046   56.241   14.546   66.481   10.865   35.988   5.1014   39.836   3.3777 -3.847740 6.118231 
1 1 1   13    8   69 o   70.082   2.4920  202.848   14.213   0.0000   0.0000  202.848   14.213  ?   ?    70.082   2.4920 0.000000 2.491950 
1 1 1   13    8   70 o   52.884   2.2185  115.322   9.5423  106.780   15.615  120.413   12.055   50.306   3.8370   53.874   2.7542 -3.568249 4.723137 
1 1 1   13    8   71 o   62.835   2.4898  163.290   12.727  153.887   16.679  176.398   19.693   60.622   3.3887   64.727   3.7485 -4.105423 5.053155 
1 1 1   13    8   72 o   40.084   3.8870   68.269   12.541   60.738   14.262   93.957   26.338   37.397   4.7881   44.905   7.4568 -7.508572 8.861723 
1 1 1   13    8   73 o   12.252   4.8607   3.9178   7.2324  -9.1682   11.022   13.814   9.5845   10.814   5.0523   17.815   5.7759 -7.001079 7.673750 
1 1 1   13    8   74 o   25.797   4.0246   28.788   8.1868   19.607   11.279   39.011   11.902   20.729   6.1977   29.654   5.1080 -8.925262 8.031420 
1 1 1   13    8   75 o   38.466   2.5083   61.531   7.8218   52.043   11.989   68.561   10.321   34.674   4.3364   40.383   3.1604 -5.709351 5.365857 
1 1 1   13    8   76 o   9.8818   4.3496  -1.2515   6.7941   1.1787   12.661  -2.2343   8.0516   14.085   6.0710   10.476   4.6665 3.608220 7.657227 
1 1 1   13    8   77 o   12.631   4.7669   5.4162   6.7008   20.021   12.928   0.0509   7.8356   20.834   6.7040   11.050   4.7695 9.783894 8.227506 
1 1 1   13    8   78 o   26.025   3.4444   28.981   7.1277   24.915   13.426   30.576   8.4109   22.923   6.7390   26.528   4.0150 -3.604795 7.844361 
1 1 1   13    8   79 o   27.002   3.0246   30.871   6.5431   29.415   11.388   31.589   7.9944   25.263   5.6696   27.067   3.7217 -1.804420 6.781995 
1 1 1   13    8   80 o   9.3185   3.9921   0.1961   5.4119  -3.8958   11.109   1.4693   6.1969   11.889   5.3732   10.444   4.3625 1.445085 6.921147 
1 1 1   13    8   81 o   13.615   4.3831   7.9431   5.5256   4.3010   11.048   9.1582   6.3811   14.120   5.8553   14.555   4.7123 -0.4349251 7.515969 
1 1 1   13    8   82 o   47.911   1.9676   94.953   7.6681   88.065   12.825   98.785   9.5662   45.425   3.4905   48.688   2.4179 -3.263107 4.246132 
1 1 1   13    8   83 o   58.119   2.3948  140.772   11.321  118.827   13.763  186.683   19.907   52.927   3.2052   65.948   3.7183 -13.02053 4.909055 
1 1 1   13    8   84 o   15.801   5.8823   10.106   10.131   5.2372   11.192   32.209   23.845   14.340   5.9148   24.429   9.0375 -10.08911 10.80097 
1 1 1   13    8   85 o   27.854   4.2921   34.600   9.4327   33.386   11.452   37.160   16.633   26.685   5.4494   26.815   7.3786 -0.1294098 9.172752 
1 1 1   13    8   86 o   19.509   5.8995   18.364   10.177   14.183   12.789   25.584   16.805   17.796   6.6122   22.169   7.6552 -4.372208 10.11549 
1 1 1   13    8   87 o   11.667   5.1729  -0.8443   9.7796   9.6875   12.385 -18.2875   15.939   15.999   6.3563   11.594   5.5975 4.404847 8.469595 
1 1 1   13    8   88 o   34.183   3.9339   51.741   10.762   46.046   13.346   62.327   18.196   31.139   5.4568   35.275   6.5698 -4.135654 8.540443 
1 1 1   13    8   89 o   14.227   5.7005   7.0151   10.046   10.602   12.499   0.4685   16.885   16.174   6.3984   14.844   6.6737 1.330322 9.245437 
1 1 1   13    8   90 o   37.108   3.6882   60.711   11.008   62.165   13.713   58.074   18.462   36.739   4.6856   33.232   7.0347 3.506405 8.452290 
1 1 1   13    8   91 o   19.630   5.8876   19.507   10.166   26.022   12.550   7.0747   17.337   22.210   6.5118   16.121   7.0254 6.088734 9.579184 
1 1 1   13    8   92 o   16.475   6.0794   12.965   10.778   3.4248   12.267   45.265   22.571   13.643   5.9279   26.284   8.8767 -12.64091 10.67411 
1 1 1   13    8   93 o   29.280   4.9219   40.947   11.331   36.276   12.859   57.174   23.967   26.501   6.0817   29.249   9.0929 -2.748466 10.93934 
1 1 1   13    8   94 o   38.312   4.4788   68.286   13.723   61.001   15.977   88.785   26.801   34.775   5.8433   37.497   8.9020 -2.722191 10.64844 
1 1 1   13    8   95 o   16.792   6.5188   13.844   12.769   3.8612   15.018   39.890   24.259   14.452   6.4090   23.664   9.0372 -9.211919 11.07912 
1 1 1   13    8   96 f   29.727   4.9625   42.695   11.601   39.814   15.588   46.272   17.370   26.461   7.0859   28.167   7.4514 -1.705627 10.28264 
1 1 1   13    8   97 o   14.115   5.6522   8.0414   9.8705   1.4109   12.417   19.422   16.268   12.957   5.7818   18.605   7.3182 -5.647784 9.326592 
1 1 1   13    8   98 o   36.917   3.6169   61.264   10.745   69.869   13.759   47.815   17.202   38.546   4.4613   28.569   7.3458 9.976767 8.594412 
1 1 1   13    8   99 o   24.283   5.8497   30.992   11.441   39.735   13.462   8.2522   21.710   27.234   6.2031   16.436   7.4613 10.79765 9.703049 
1 1 1   13    8  100 o   33.469   4.6035   53.480   12.227   55.186   14.400   49.074   23.146   32.971   5.5552   25.803   8.9802 7.168360 10.55953 
1 1 1   13    8  101 o   11.933   5.4062  -0.5991   11.329  -1.6665   13.244   2.3134   21.878   12.451   5.7184   15.418   7.1748 -2.967230 9.174808 
1 1 1   13    8  102 o   14.232   5.9089   7.9662   11.271   4.0645   13.369   17.554   20.957   13.704   6.0636   17.841   7.7501 -4.136678 9.840340 
1 1 1   13    8  103 o   21.453   6.2051   25.614   11.465   22.390   13.483   34.031   21.786   19.447   6.8477   21.553   8.4717 -2.105867 10.89316 
1 1 1   13    8  104 o   20.778   6.8703   25.908   13.531   25.908   13.531   0.0000   0.0000   20.778   6.8703  ?   ?  0.000000 6.870327 
1 1 1   13    8  105 o   22.358   6.8604   29.974   13.696   29.974   13.696   0.0000   0.0000   22.358   6.8604  ?   ?  0.000000 6.860429 
1 1 1   13    8  106 o   18.376   7.4032   21.037   17.042   21.037   17.042   0.0000   0.0000   18.376   7.4032  ?   ?  0.000000 7.403245 
1 1 1   13    8  107 o   12.156   6.0303 -28.1741   22.738 -28.1741   22.738   0.0000   0.0000   12.156   6.0303  ?   ?  0.000000 6.030256 
1 1 1   13    9 -104 o   12.554   5.7383  -0.0674   13.123  -0.0674   13.123   0.0000   0.0000   12.554   5.7383  ?   ?  0.000000 5.738289 
1 1 1   13    9 -103 o   17.038   6.6422   16.415   13.301   16.415   13.301   0.0000   0.0000   17.038   6.6422  ?   ?  0.000000 6.642208 
1 1 1   13    9 -102 o   20.138   6.8528   24.738   13.454   24.738   13.454   0.0000   0.0000   20.138   6.8528  ?   ?  0.000000 6.852779 
1 1 1   13    9 -101 o   27.602   6.2814   42.172   13.814   42.172   13.814   0.0000   0.0000   27.602   6.2814  ?   ?  0.000000 6.281425 
1 1 1   13    9 -100 o   13.273   5.9353   2.8546   13.159   2.8546   13.159   0.0000   0.0000   13.273   5.9353  ?   ?  0.000000 5.935337 
1 1 1   13    9  -99 o   24.797   6.6133   35.173   13.613   35.173   13.613   0.0000   0.0000   24.797   6.6133  ?   ?  0.000000 6.613298 
1 1 1   13    9  -98 o   11.467   5.3837  -5.6331   12.777  -5.6331   12.777   0.0000   0.0000   11.467   5.3837  ?   ?  0.000000 5.383723 
1 1 1   13    9  -97 o   16.931   6.6273   15.252   13.285   15.252   13.285   0.0000   0.0000   16.931   6.6273  ?   ?  0.000000 6.627316 
1 1 1   13    9  -96 f   19.906   6.6842   22.783   12.799   22.783   12.799   0.0000   0.0000   19.906   6.6842  ?   ?  0.000000 6.684217 
1 1 1   13    9  -95 o   13.192   5.8089   3.1913   12.130   3.1913   12.130   0.0000   0.0000   13.192   5.8089  ?   ?  0.000000 5.808931 
1 1 1   13    9  -94 o   35.469   4.8386   60.657   13.625   60.657   13.625   0.0000   0.0000   35.469   4.8386  ?   ?  0.000000 4.838588 
1 1 1   13    9  -93 o   10.070   4.7907  -8.8312   10.760  -8.4133   11.796 -10.9030   26.265   10.667   5.0578   14.954   7.2112 -4.286793 8.808170 
1 1 1   13    9  -92 o   17.293   5.8122   15.390   9.6771   16.775   12.214   13.053   15.862   17.782   6.4863   16.804   6.9961 0.9777355 9.540298 
1 1 1   13    9  -91 o   12.608   5.3347   4.0302   9.4563   20.628   12.244 -20.5074   14.887   19.419   6.5378   10.474   5.1346 8.944834 8.313066 
1 1 1   13    9  -90 o   30.417   3.8649   41.934   9.3666   39.809   12.795   44.387   13.749   27.962   5.8039   29.437   5.9349 -1.474516 8.301099 
1 1 1   13    9  -89 f   10.427   4.7433  -2.5126   8.8304  -2.1220   12.358  -2.9201   12.622   12.260   5.5904   12.205   5.5969 0.5580139E-01 7.910595 
1 1 1   13    9  -88 o   33.040   4.0180   49.452   10.599   50.769   16.379   48.504   13.903   30.925   6.6921   31.275   5.6617 -0.3496532 8.765782 
1 1 1   13    9  -87 o   15.955   5.5785   12.048   8.9374   12.300   12.249   11.762   13.070   16.475   6.3877   16.423   6.5280 0.5164909E-01 9.133303 
1 1 1   13    9  -86 o   21.654   5.2068   22.687   9.0772   11.595   12.365   35.650   13.367   16.362   6.3969   26.405   6.2988 -10.04314 8.977483 
1 1 1   13    9  -85 o   21.642   5.1776   22.496   9.0114   9.7323   12.357   36.996   13.170   15.803   6.3256   27.205   6.0908 -11.40191 8.781309 
1 1 1   13    9  -84 o   14.641   5.7556   8.0280   10.057   17.721   12.275 -11.7665   17.541   18.903   6.5419   13.060   6.1850 5.842836 9.002842 
1 1 1   13    9  -83 o   27.360   4.9216   34.740   10.573   27.342   13.177   48.109   17.714   23.103   6.6431   30.273   7.2700 -7.170057 9.848042 
1 1 1   13    9  -82 o   15.516   5.8248   9.9358   9.9765   8.2180   12.712   12.691   16.099   15.643   6.3606   17.824   7.1903 -2.181112 9.599894 
1 1 1   13    9  -81 o   11.936   5.2484  -0.2918   9.8694   8.4507   12.395 -15.4337   16.313   15.712   6.3194   12.225   5.8389 3.486574 8.603910 
1 1 1   13    9  -80 o   27.104   4.4042   32.897   9.3969   36.252   11.350   25.588   16.754   28.042   5.1554   22.381   7.6466 5.661150 9.222202 
1 1 1   13    9  -79 o   47.720   2.6626   95.585   10.316   97.813   12.603   91.061   17.959   47.942   3.2440   44.997   4.9793 2.944546 5.942859 
1 1 1   13    9  -78 o   9.5128   4.4409  -6.7235   8.4888   9.5800   10.323 -40.7802   14.919   15.702   5.9185   9.0240   4.5367 6.677921 7.457207 
1 1 1   13    9  -77 o   31.519   4.1147   43.403   10.320   50.067   13.440   33.830   16.108   33.318   5.1116   26.048   7.2968 7.270306 8.909032 
1 1 1   13    9  -76 o   12.923   5.2656   3.9774   8.7334   3.4626   12.761   4.4309   11.978   14.605   6.1892   14.562   6.0724 0.4324627E-01 8.670705 
1 1 1   13    9  -75 o   35.981   2.6578   54.198   7.7401   40.872   15.921   58.322   8.8573   29.147   6.8221   37.222   2.9431 -8.074919 7.429880 
1 1 1   13    9  -74 o   23.013   3.9409   23.126   7.1268   23.166   15.247   23.115   8.0616   22.094   7.2924   22.795   4.4983 -0.7015247 8.568225 
1 1 1   13    9  -73 o   30.905   3.1827   40.450   7.9035   55.106   17.259   36.561   8.8903   34.411   6.3881   29.119   3.8389 5.292475 7.452874 
1 1 1   13    9  -72 o   22.898   3.7968   22.749   6.8388   10.410   11.270   29.942   8.6040   16.537   6.1945   26.196   4.1689 -9.658588 7.466707 
1 1 1   13    9  -71 o   36.205   2.5412   54.616   7.4520   47.015   11.873   59.558   9.5724   32.786   4.5662   37.600   3.1522 -4.813557 5.548599 
1 1 1   13    9  -70 o   34.593   2.5734   49.879   7.2048   63.790   11.693   41.365   9.1476   38.691   3.7545   31.119   3.6772 7.572874 5.255277 
1 1 1   13    9  -69 f   39.645   2.3267   65.145   7.4860   67.864   12.112   63.464   9.5228   39.941   3.7644   38.905   3.0266 1.036396 4.830200 
1 1 1   13    9  -68 o   36.016   3.2036   54.569   9.3072   53.592   11.937   56.084   14.863   35.287   4.2346   35.611   5.2800 -0.3237000 6.768313 
1 1 1   13    9  -67 o   88.174   1.6483  318.867   11.847  302.040   17.034  334.634   16.489   85.462   2.4477   90.088   2.2454 -4.625877 3.321562 
1 1 1   13    9  -66 o   66.148   1.8151  179.760   9.7779  172.546   14.449  185.856   13.281   64.473   2.7556   67.050   2.4340 -2.576988 3.676634 
1 1 1   13    9  -65 o   39.614   2.4835   65.030   7.9792   53.251   11.963   74.472   10.710   35.260   4.2476   42.203   3.1355 -6.943348 5.279548 
1 1 1   13    9  -64 o   14.252   4.8420   8.1768   6.7163   7.3632   11.334   8.6171   8.3378   15.635   6.1209   15.023   5.3754 0.6120949 8.146197 
1 1 1   13    9  -63 o   45.640   2.1481   85.837   7.9692   72.488   12.450   95.104   10.373   41.469   3.7225   47.907   2.6668 -6.437901 4.579173 
1 1 1   13    9  -62 o   29.712   3.0010   36.928   7.1687   36.978   11.872   36.899   8.9931   29.025   5.2095   29.466   3.8350 -0.4413776 6.468873 
1 1 1   13    9  -61 o   69.869   1.5909  199.842   9.0606  190.315   13.121  208.525   12.527   67.961   2.3721   71.207   2.1607 -3.245987 3.208647 
1 1 1   13    9  -60 o   32.961   2.5986   45.042   6.9255   42.569   10.784   46.777   9.0351   31.577   4.3012   33.408   3.3635 -1.830898 5.460154 
1 1 1   13    9  -59 o   17.786   4.8027   13.809   7.1249   12.066   13.844   14.437   8.3098   18.379   6.8695   18.212   5.2871 0.1665554 8.668537 
1 1 1   13    9  -58 o   57.419   1.8509  135.189   8.6518  150.267   14.263  126.413   10.882   60.276   2.9116   55.403   2.4155 4.873550 3.783091 
1 1 1   13    9  -57 o   23.371   4.0311   23.372   7.4023   31.859   14.846   20.565   8.5395   26.608   6.8155   21.685   4.9414 4.922359 8.418347 
1 1 1   13    9  -56 o   93.437   1.8678  357.487   14.226  375.549   25.500  349.325   17.142   95.252   3.2891   92.260   2.2794 2.992310 4.001734 
1 1 1   13    9  -55 o  141.737   1.7383  821.911   20.084  838.781   31.101  809.842   26.305  142.815   2.6715  140.493   2.2969 2.321518 3.523180 
1 1 1   13    9  -54 o   71.858   1.8685  211.470   10.935  227.490   17.851  201.846   13.835   74.268   2.9545   70.087   2.4253 4.181084 3.822459 
1 1 1   13    9  -53 o   55.283   2.3070  125.528   10.373  119.636   19.583  127.826   12.230   53.380   4.5436   55.709   2.7013 -2.329285 5.285991 
1 1 1   13    9  -52 o   68.891   2.0551  194.480   11.528  190.428   21.223  196.176   13.730   67.710   3.8613   69.115   2.4408 -1.405350 4.568042 
1 1 1   13    9  -51 o   33.531   3.0982   46.653   8.3725   39.688   17.327   48.775   9.5631   29.864   7.2018   34.215   3.4771 -4.350559 7.997273 
1 1 1   13    9  -50 o   52.080   2.1371  111.219   9.0532   91.814   15.699  120.888   11.081   46.901   4.1490   54.239   2.5132 -7.338070 4.850802 
1 1 1   13    9  -49 o  114.701   1.5953  537.462   14.915  519.464   24.004  548.781   19.036  112.543   2.6165  115.822   2.0163 -3.278748 3.303277 
1 1 1   13    9  -48 o  101.115   1.7684  417.845   14.576  400.768   28.810  423.720   16.898   98.547   3.5924  101.778   2.0368 -3.231377 4.129652 
1 1 1   13    9  -47 o  103.631   1.6407  438.687   13.859  449.264   23.184  432.806   17.288  104.633   2.7206  102.867   2.0618 1.766319 3.413553 
1 1 1   13    9  -46 o   62.449   2.2159  159.771   11.262  153.835   18.023  163.574   14.426   61.009   3.6407   63.090   2.8121 -2.081772 4.600265 
1 1 1   13    9  -45 o   52.440   2.3986  112.808   10.226  114.021   20.716  112.418   11.759   52.190   4.9278   52.293   2.7684 -0.1037598 5.652204 
1 1 1   13    9  -44 o   72.370   2.2272  214.441   13.123  194.584   19.313  231.474   17.887   68.710   3.4593   75.069   2.9287 -6.359489 4.532563 
1 1 1   13    9  -43 o   38.347   3.8791   61.163   11.959  102.081   19.572   36.788   15.106   49.394   4.9267   29.064   6.5353 20.32990 8.184346 
1 1 1   13    9  -42 f   30.350   4.9054   39.071   11.722   17.137   18.402   54.048   15.206   21.867   7.9640   35.691   5.3949 -13.82467 9.619246 
1 1 1   13    9  -41 o   86.068   1.8343  302.577   12.869  302.109   21.771  302.828   15.955   85.770   3.1190   86.024   2.2774 -0.2533035 3.861958 
1 1 1   13    9  -40 o  102.419   1.7271  428.324   14.419  430.874   23.788  426.842   18.130  102.522   2.8492  102.187   2.1765 0.3355408 3.585397 
1 1 1   13    9  -39 o   53.805   2.3424  118.600   10.249  121.921   17.729  116.933   12.561   54.285   4.0353   53.352   2.8991 0.9332428 4.968697 
1 1 1   13    9  -38 o   86.122   1.8149  302.871   12.741  322.893   21.472  291.991   15.829   88.734   2.9728   84.482   2.3007 4.251678 3.759111 
1 1 1   13    9  -37 o  141.795   1.6509  820.703   19.081  826.749   30.784  816.931   24.316  142.145   2.6568  141.401   2.1096 0.7442627 3.392509 
1 1 1   13    9  -36 o   87.201   1.7671  310.445   12.561  287.646   20.411  324.343   15.936   83.754   2.9945   89.091   2.1944 -5.337570 3.712482 
1 1 1   13    9  -35 o   82.170   1.8001  275.659   12.057  295.067   19.936  264.464   15.141   84.853   2.8864   80.407   2.3124 4.445351 3.698477 
1 1 1   13    9  -34 o   91.022   2.1344  338.453   15.836  317.259   20.662  368.632   24.656   87.996   2.8844   94.805   3.1950 -6.809372 4.304398 
1 1 1   13    9  -33 o   29.447   3.9742   36.246   9.2964   34.300   14.891   37.488   11.900   28.161   6.6025   29.737   5.0925 -1.575804 8.338225 
1 1 1   13    9  -32 o  134.701   1.9610  740.880   21.531  732.002   37.760  745.157   26.210  133.585   3.4706  135.030   2.3813 -1.445099 4.208956 
1 1 1   13    9  -31 o   58.223   2.5643  138.854   12.140  142.946   21.927  137.045   14.579   58.755   4.6153   57.774   3.1070 0.9806137 5.563677 
1 1 1   13    9  -30 o  154.270   1.6668  971.224   20.961  980.172   33.670  965.562   26.784  154.826   2.6679  153.757   2.1370 1.069016 3.418199 
1 1 1   13    9  -29 o   90.315   1.9291  333.003   14.202  350.558   29.217  327.571   16.251   92.352   3.8898   89.551   2.2263 2.800621 4.481793 
1 1 1   13    9  -28 o  143.048   1.6630  835.006   19.391  833.756   31.291  835.785   24.708  142.802   2.6881  143.061   2.1187 -0.2585144 3.422718 
1 1 1   13    9  -27 o   79.392   1.9239  257.301   12.451  259.805   21.930  256.110   15.125   79.575   3.3886   79.143   2.3471 0.4317169 4.122091 
1 1 1   13    9  -26 o   34.152   3.4822   48.265   9.5585   82.817   17.289   33.056   11.471   44.607   4.8320   27.879   5.2400 16.72833 7.127780 
1 1 1   13    9  -25 o   60.146   2.7235  148.193   13.318  168.218   30.294  143.396   14.828   63.525   5.9185   59.120   3.0876 4.405170 6.675409 
1 1 1   13    9  -24 o   56.658   2.5787  131.457   11.878  175.055   30.107  123.419   12.927   64.858   5.7543   54.859   2.9011 9.998825 6.444293 
1 1 1   13    9  -23 o   76.384   2.1855  238.446   13.593  224.776   32.893  241.261   14.928   73.616   5.5217   76.813   2.3870 -3.197891 6.015597 
1 1 1   13    9  -22 o   43.799   2.8229   78.756   10.025   81.407   17.488   77.458   12.235   44.213   4.9366   43.352   3.4916 0.8615074 6.046600 
1 1 1   13    9  -21 o  167.910   1.7008  1150.39   23.278  1155.18   37.043  1147.26   29.926  168.115   2.7031  167.619   2.1902 0.4960785 3.479030 
1 1 1   13    9  -20 o   17.845   5.5422   13.068   8.9063   6.1309   14.799   17.008   11.152   17.263   6.9182   20.246   6.1865 -2.983398 9.280835 
1 1 1   13    9  -19 o   86.854   1.8151  307.840   12.851  316.452   21.061  302.732   16.220   87.923   2.9427   86.066   2.3141 1.856987 3.743654 
1 1 1   13    9  -18 o   21.970   5.1697   20.657   9.1031   0.9842   15.214   31.628   11.361   16.004   6.7689   27.261   5.3035 -11.25698 8.599149 
1 1 1   13    9  -17 o   38.040   3.0762   59.562   9.4574   59.103   15.939   59.811   11.749   37.518   5.3641   38.015   3.8443 -0.4970474 6.599433 
1 1 1   13    9  -16 f  114.288   1.8038  532.981   16.805  510.219   31.404  542.115   19.893  111.595   3.4564  115.238   2.1177 -3.642982 4.053550 
1 1 1   13    9  -15 o   70.542   2.1910  203.355   12.584  204.327   27.279  203.092   14.183   70.363   4.7846   70.471   2.4728 -0.1083908 5.385795 
1 1 1   13    9  -14 o   27.489   4.6298   31.858   10.006   23.701   21.196   34.197   11.350   24.900   8.5975   28.420   5.0861 -3.520321 9.989235 
1 1 1   13    9  -13 o   95.847   1.9587  374.914   15.303  349.464   32.556  382.132   17.338   92.198   4.3440   96.748   2.1984 -4.549789 4.868628 
1 1 1   13    9  -12 o   88.008   1.8681  316.058   13.402  328.430   23.983  310.440   16.160   89.543   3.2914   87.168   2.2763 2.374863 4.001873 
1 1 1   13    9  -11 o   94.896   1.8354  367.450   14.198  390.961   25.451  356.828   17.107   97.721   3.1993   93.489   2.2448 4.232231 3.908303 
1 1 1   13    9  -10 o   40.971   3.0507   69.005   10.115   87.527   18.292   60.845   12.141   45.891   4.9689   38.340   3.9407 7.551716 6.341869 
1 1 1   13    9   -9 o   46.367   2.7210   88.139   10.239   87.797   18.059   88.301   12.430   45.977   4.8935   46.345   3.3122 -0.3673477 5.909073 
1 1 1   13    9   -8 o   22.955   5.1716   22.514   9.4440   37.485   16.522   15.249   11.510   29.512   6.9785   19.518   6.3295 9.993553 9.421331 
1 1 1   13    9   -7 o   67.106   2.4041  184.122   13.129  195.009   20.530  176.589   17.078   68.923   3.6674   65.636   3.2017 3.287422 4.868332 
1 1 1   13    9   -6 f  107.627   1.9858  472.725   17.422  476.633   27.349  470.055   22.601  107.926   3.1119  107.275   2.5846 0.6510315 4.045290 
1 1 1   13    9   -5 f   36.098   3.8017   53.940   11.019   41.327   17.138   62.830   14.387   31.006   6.9526   38.859   4.6331 -7.853273 8.354949 
1 1 1   13    9   -4 o   20.077   6.3352   16.426   11.590   16.726   16.813   16.154   15.999   21.515   7.6402   21.082   7.4562 0.4330330 10.67552 
1 1 1   13    9   -3 o  104.398   1.8029  444.676   15.343  458.038   27.068  438.350   18.623  105.796   3.1422  103.626   2.2047 2.170273 3.838489 
1 1 1   13    9   -2 o  124.964   1.7569  637.094   17.896  653.312   31.379  629.275   21.787  126.419   3.0450  124.164   2.1527 2.255295 3.729057 
1 1 1   13    9   -1 o   71.964   2.2605  211.626   13.244  218.899   21.492  207.174   16.815   73.044   3.6209   71.141   2.9058 1.902847 4.642705 
1 1 1   13    9    0 o   64.909   2.4076  172.271   12.717  185.590   20.786  164.304   16.076   67.218   3.8092   63.317   3.1244 3.900478 4.926687 
1 1 1   13    9    1 o  107.863   1.9624  474.770   17.254  431.081   26.905  505.287   22.487  102.623   3.2203  111.234   2.4800 -8.611221 4.064567 
1 1 1   13    9    2 o  191.756   2.0469  1500.68   31.995  1493.79   50.708  1505.23   41.241  191.119   3.2549  191.962   2.6356 -0.8426971 4.188144 
1 1 1   13    9    3 o   20.375   5.8712   17.486   10.282   13.603   16.551   19.926   13.122   20.370   7.5304   21.925   6.7129 -1.555660 10.08811 
1 1 1   13    9    4 o   39.351   3.4265   63.826   10.882   55.340   18.055   68.667   13.637   36.100   6.3682   40.723   4.1667 -4.623360 7.610211 
1 1 1   13    9    5 f   70.278   1.9683  201.713   11.264  196.356   17.503  205.500   14.717   69.232   3.1095   70.887   2.5511 -1.654953 4.022077 
1 1 1   13    9    6 f   93.307   1.8966  355.254   14.426  353.588   20.451  356.904   20.351   92.993   2.7008   93.431   2.6749 -0.4382858 3.801234 
1 1 1   13    9    7 o  162.208   1.9623  1073.74   25.947  1067.15   33.569  1083.50   40.894  161.640   2.5477  162.794   3.0816 -1.153625 3.998437 
1 1 1   13    9    8 o   90.923   2.3168  337.754   17.157  308.888   24.369  366.128   24.160   86.818   3.4502   94.575   3.1383 -7.756424 4.664028 
1 1 1   13    9    9 o   82.636   2.1867  278.953   14.717  271.055   19.377  289.719   22.623   81.383   2.9256   84.095   3.3067 -2.711784 4.415155 
1 1 1   13    9   10 o  163.989   1.7933  1097.24   23.972  1105.88   34.480  1089.16   33.350  164.540   2.5707  163.301   2.5054 1.239517 3.589648 
1 1 1   13    9   11 o   75.038   2.0589  229.994   12.582  230.899   18.709  229.247   17.000   75.087   3.0631   74.848   2.7913 0.2389832 4.144110 
1 1 1   13    9   12 o  104.577   1.8152  446.234   15.474  455.254   22.709  438.415   21.142  105.563   2.6390  103.604   2.5034 1.958397 3.637547 
1 1 1   13    9   13 o   49.357   2.6973   99.833   10.811  103.052   16.169   97.231   14.539   49.989   4.0014   48.590   3.6984 1.398647 5.448809 
1 1 1   13    9   14 o   63.281   2.7322  163.938   14.060  166.334   22.124  162.315   18.211   63.537   4.2969   62.868   3.5683 0.6692352 5.585349 
1 1 1   13    9   15 o   63.708   2.4585  166.021   12.744  185.954   22.001  155.957   15.633   67.235   4.0329   61.675   3.1197 5.559952 5.098720 
1 1 1   13    9   16 f   49.182   2.7172   99.148   10.851  106.750   20.214   96.070   12.861   50.721   4.9521   48.347   3.2829 2.374115 5.941501 
1 1 1   13    9   17 o  187.269   1.8663  1431.16   28.489  1468.28   50.802  1414.13   34.409  189.429   3.2900  186.095   2.2683 3.334015 3.996136 
1 1 1   13    9   18 o  120.450   1.6401  591.900   16.103  609.986   25.538  579.961   20.748  122.188   2.5640  119.187   2.1356 3.000801 3.336888 
1 1 1   13    9   19 o   50.156   2.4658  103.010   10.050  139.606   16.865   82.857   12.515   58.279   3.5672   44.857   3.4492 13.42210 4.962064 
1 1 1   13    9   20 o   67.738   1.9873  187.452   10.961  190.108   17.803  185.831   13.911   68.087   3.2168   67.394   2.5367 0.6933594 4.096684 
1 1 1   13    9   21 o   35.563   3.2478   52.183   9.3112   44.485   15.005   57.003   11.874   32.333   5.9111   37.073   3.9919 -4.740540 7.132789 
1 1 1   13    9   22 o  175.628   1.6908  1258.59   24.206  1264.95   37.559  1254.07   31.658  175.933   2.6190  175.242   2.2162 0.6911926 3.430814 
1 1 1   13    9   23 o   84.194   1.7973  289.290   12.335  285.066   19.634  292.045   15.855   83.442   2.8909   84.528   2.3032 -1.085815 3.696259 
1 1 1   13    9   24 o  149.940   1.6453  917.319   20.109  922.353   31.612  913.898   26.062  150.231   2.5814  149.604   2.1371 0.6266022 3.351264 
1 1 1   13    9   25 o   76.918   1.9879  241.689   12.453  242.573   22.191  241.282   15.046   76.867   3.5513   76.812   2.4059 0.5433655E-01 4.289533 
1 1 1   13    9   26 o  105.124   1.9437  451.120   16.656  440.415   38.099  453.649   18.519  103.411   4.5307  105.399   2.1555 -1.987427 5.017352 
1 1 1   13    9   27 o  138.894   2.1184  787.780   23.985  767.964   48.899  794.058   27.523  136.637   4.3960  139.406   2.4220 -2.769028 5.019114 
1 1 1   13    9   28 o  100.026   1.9623  408.472   16.000  395.180   36.999  411.529   17.744   97.902   4.6495  100.382   2.1686 -2.479797 5.130321 
1 1 1   13    9   29 o  196.724   1.8936  1579.83   30.365  1490.79   51.922  1626.12   37.433  190.779   3.3388  199.509   2.3018 -8.729431 4.055311 
1 1 1   13    9   30 o   77.688   1.8510  246.375   11.722  221.726   18.666  262.426   15.062   73.529   3.1213   80.111   2.3089 -6.582436 3.882486 
1 1 1   13    9   31 o   31.213   3.7597   40.536   9.3734   52.624   17.486   35.661   11.103   35.093   6.3463   29.040   4.8622 6.052670 7.994794 
1 1 1   13    9   32 o   15.923   5.6961   8.9776   9.3618   28.593   14.649  -4.5646   12.172   25.747   6.8576   12.879   5.7372 12.86710 8.941051 
1 1 1   13    9   33 o  175.667   2.0081  1260.24   28.755  1352.75   48.713  1210.76   35.624  181.698   3.2890  172.083   2.5396 9.615631 4.155351 
1 1 1   13    9   34 o  116.701   1.7910  555.987   17.038  552.850   25.012  558.703   23.272  116.261   2.6392  116.905   2.4421 -0.6433945 3.595710 
1 1 1   13    9   35 o   58.690   2.2193  140.952   10.598  136.927   17.284  143.378   13.417   57.640   3.6982   59.126   2.7916 -1.485977 4.633573 
1 1 1   13    9   36 o   26.884   4.7623   30.674   10.054   42.814   15.313   21.475   13.330   31.572   6.1715   22.532   6.7380 9.040359 9.137156 
1 1 1   13    9   37 o   19.619   5.3916   16.441   8.8875   5.1944   15.101   22.401   10.993   17.046   6.9321   22.800   5.8775 -5.753866 9.088388 
1 1 1   13    9   38 o   39.573   3.0349   64.535   9.7151   77.217   16.497   57.801   12.021   42.990   4.7890   37.276   4.0194 5.713211 6.252189 
1 1 1   13    9   39 o   31.067   3.8703   40.283   9.5891   42.143   15.967   39.233   11.993   31.220   6.4862   30.417   5.0112 0.8022785 8.196492 
1 1 1   13    9   40 o   47.465   2.7946   92.584   10.765  133.549   20.263   76.477   12.706   56.735   4.4163   42.988   3.6609 13.74745 5.736376 
1 1 1   13    9   41 o   64.212   2.5120  168.992   13.123  151.899   21.715  178.826   16.471   60.510   4.4332   65.968   3.0715 -5.458267 5.393280 
1 1 1   13    9   42 f   44.620   3.3647   82.216   12.148  108.762   20.907   68.687   14.926   50.972   5.1003   40.515   4.6007 10.45689 6.868727 
1 1 1   13    9   43 o   49.695   2.7921  101.521   11.265  145.658   22.010   85.855   13.113   59.172   4.5992   45.559   3.5591 13.61305 5.815487 
1 1 1   13    9   44 o   47.513   2.7619   92.829   10.651   86.299   19.543   95.589   12.703   45.232   5.4074   48.134   3.2567 -2.901676 6.312419 
1 1 1   13    9   45 o   50.517   2.5932  104.819   10.643   99.938   19.679  106.837   12.653   48.807   5.0177   50.926   3.0622 -2.118496 5.878275 
1 1 1   13    9   46 o   94.494   1.9906  365.084   15.333  384.659   23.533  350.644   20.212   96.758   2.9873   92.449   2.6849 4.309433 4.016561 
1 1 1   13    9   47 o   34.923   3.7388   50.838   10.478   39.809   15.900   59.304   13.930   30.153   6.6482   37.538   4.6520 -7.385132 8.114158 
1 1 1   13    9   48 o   50.923   2.6670  106.631   11.032  112.649   17.029  102.279   14.482   52.054   4.0449   49.689   3.5999 2.364113 5.414869 
1 1 1   13    9   49 o   21.630   4.8667   20.224   8.3727   28.670   14.690   16.160   10.190   25.535   6.8967   19.505   5.9042 6.030237 9.078810 
1 1 1   13    9   50 o   84.346   1.7824  290.843   12.255  285.618   20.518  293.740   15.280   83.292   3.0270   84.666   2.2159 -1.373802 3.751403 
1 1 1   13    9   51 o   32.706   3.8085   44.807   9.9637   62.688   19.572   38.552   11.576   37.921   6.5697   30.033   4.8971 7.887877 8.194057 
1 1 1   13    9   52 o   19.938   5.5691   17.236   9.3976   1.7812   18.027   23.003   11.012   17.206   7.3263   22.908   5.8709 -5.701542 9.388410 
1 1 1   13    9   53 o   24.611   4.8446   26.161   9.3727   27.741   17.961   25.569   10.987   25.164   7.8791   24.150   5.6776 1.014431 9.711583 
1 1 1   13    9   54 o   29.350   3.4869   36.092   8.1793   35.260   14.513   36.479   9.9015   28.203   6.4531   29.316   4.2688 -1.112328 7.737265 
1 1 1   13    9   55 o   54.534   2.2868  122.222   10.143  104.721   16.054  133.849   13.086   50.047   3.9678   56.952   2.8276 -6.905186 4.872203 
1 1 1   13    9   56 o   64.463   1.9359  170.365   10.161  157.336   17.174  177.382   12.603   61.557   3.4363   65.686   2.3577 -4.129131 4.167355 
1 1 1   13    9   57 o   12.474   4.9134   3.9624   7.3420   10.248   13.235   1.1681   8.8244   17.591   6.6853   12.269   5.1702 5.321904 8.451313 
1 1 1   13    9   58 o   9.3779   4.2892  -4.6728   7.3473  -7.0934   13.779  -3.7111   8.6850   13.019   5.9235   10.647   4.7867 2.372231 7.615749 
1 1 1   13    9   59 o   24.577   3.9641   25.809   7.6715   40.821   14.202   19.624   9.1158   30.366   5.9505   21.085   5.3081 9.281004 7.973980 
1 1 1   13    9   60 o   66.850   1.8733  183.337   10.198  185.337   17.988  182.389   12.380   66.752   3.3163   66.571   2.2847 0.1815948 4.027111 
1 1 1   13    9   61 o   56.160   2.0362  129.643   9.3062  140.929   16.606  124.475   11.236   58.078   3.5242   54.905   2.5173 3.172413 4.330934 
1 1 1   13    9   62 o   19.620   4.7852   16.969   7.5837   13.969   13.967   18.224   9.0307   18.984   6.9347   20.250   5.3800 -1.266285 8.776917 
1 1 1   13    9   63 o   19.599   4.7614   16.957   7.5307   8.6795   13.807   20.463   8.9849   17.055   6.7317   21.450   5.1945 -4.394630 8.502897 
1 1 1   13    9   64 o   21.585   4.4300   20.392   7.5333   12.582   14.081   23.524   8.9168   18.437   6.9203   23.081   4.8915 -4.644081 8.474497 
1 1 1   13    9   65 o   41.255   2.4782   70.505   8.2954   82.200   14.848   65.198   10.002   43.926   4.1977   39.474   3.1341 4.451633 5.238659 
1 1 1   13    9   66 o   43.068   2.6070   76.996   9.1094   82.774   14.693   73.387   11.610   44.072   4.1382   41.763   3.4410 2.308910 5.381937 
1 1 1   13    9   67 o   44.195   2.5803   81.096   9.2553   74.825   15.154   84.826   11.688   41.658   4.5359   44.982   3.2088 -3.324474 5.556129 
1 1 1   13    9   68 o   34.710   3.0783   50.591   8.6195   59.398   14.236   45.494   10.830   36.881   4.8529   32.498   4.1856 4.383045 6.408519 
1 1 1   13    9   69 f   25.079   3.9542   27.203   7.8159   26.018   17.574   27.496   8.7265   23.525   7.8313   25.039   4.4379 -1.514797 9.001354 
1 1 1   13    9   70 o   35.972   2.9286   54.257   8.5134   54.310   18.340   54.242   9.6117   34.029   6.8490   35.823   3.3297 -1.793858 7.615466 
1 1 1   13    9   71 o   24.584   4.0862   26.338   7.9011   12.995   17.696   29.660   8.8301   19.171   7.6039   26.031   4.3122 -6.860096 8.741539 
1 1 1   13    9   72 o   25.543   3.6206   28.050   7.3275   35.052   13.894   25.352   8.6244   27.350   6.3539   23.898   4.5940 3.451546 7.840706 
1 1 1   13    9   73 o   39.456   2.8729   65.281   9.1766   58.544   12.293   73.759   13.791   36.785   4.1734   41.348   4.1475 -4.562828 5.883810 
1 1 1   13    9   74 o   38.770   3.1793   63.495   9.9594   60.621   12.502   68.485   16.476   37.412   4.1704   39.117   5.3036 -1.704918 6.746876 
1 1 1   13    9   75 o   31.276   2.7823   41.127   7.0195   57.659   12.034   32.601   8.6420   36.466   4.1206   27.369   3.9911 9.097536 5.736547 
1 1 1   13    9   76 o   22.097   3.8174   21.352   6.6275   22.449   11.502   20.808   8.1091   21.777   6.1887   21.448   4.7624 0.3290844 7.808994 
1 1 1   13    9   77 o   40.978   2.2562   69.822   7.5071   74.975   12.723   67.070   9.2984   41.741   3.7801   39.913   2.8773 1.828865 4.750557 
1 1 1   13    9   78 o   24.453   3.4131   25.812   6.6182   28.434   11.902   24.639   7.9630   24.432   6.0164   23.508   4.3145 0.9246426 7.403574 
1 1 1   13    9   79 o   16.163   4.4464   11.826   6.0411   9.2501   11.354   12.843   7.1347   15.817   6.1452   16.771   4.9078 -0.9532146 7.864460 
1 1 1   13    9   80 o   28.636   2.8666   34.833   6.6014   30.474   11.938   36.754   7.9231   25.211   5.9120   29.192   3.3927 -3.981922 6.816319 
1 1 1   13    9   81 o   14.025   4.6187   8.6098   6.1175  -6.3614   12.486   13.339   7.0174   11.886   5.4924   16.994   4.8356 -5.108095 7.317722 
1 1 1   13    9   82 o   17.138   4.3261   13.453   6.0434   1.9322   12.609   16.889   6.8858   13.783   5.9991   19.163   4.4876 -5.380058 7.491827 
1 1 1   13    9   83 o   12.154   4.4562   5.7543   5.7757   10.151   14.573   4.9350   6.2909   16.636   6.7930   11.930   4.5905 4.705699 8.198636 
1 1 1   13    9   84 o   11.095   4.9836  -1.9374   9.3918   11.946   13.853 -13.7453   12.776   16.942   6.7253   10.624   5.0991 6.318036 8.439844 
1 1 1   13    9   85 o   27.451   4.7173   34.946   10.175   58.637   15.378   16.497   13.571   34.925   5.5902   18.375   6.8142 16.54995 8.813777 
1 1 1   13    9   86 o   17.435   6.2879   14.710   11.434   32.713   14.746 -12.4431   18.109   24.626   7.0103   13.044   6.2083 11.58123 9.364174 
1 1 1   13    9   87 o   34.586   3.7573   53.268   10.423   59.046   13.903   45.853   15.750   35.389   4.9551   29.487   6.7046 5.901222 8.336938 
1 1 1   13    9   88 o   30.075   4.2691   41.566   10.172   52.063   13.608   28.273   15.313   32.806   5.2671   22.262   7.3063 10.54358 9.006892 
1 1 1   13    9   89 f   21.066   5.6163   22.569   9.8197   19.641   12.899   26.605   15.144   19.081   6.6995   21.502   7.2710 -2.420868 9.886882 
1 1 1   13    9   90 o   19.865   6.0604   20.831   10.708   21.974   15.175   19.698   15.111   19.681   7.2220   18.900   7.1525 0.7810078 10.16440 
1 1 1   13    9   91 o   30.199   4.1715   42.092   9.9949   42.320   12.909   41.750   15.793   28.924   5.6779   27.178   7.0646 1.746031 9.063549 
1 1 1   13    9   92 o   8.2137   4.0231 -14.4432   9.0815 -12.9543   11.833 -16.5775   14.167   9.9868   4.8219   10.603   5.1563 -0.6166515 7.059584 
1 1 1   13    9   93 o   12.451   5.3954   2.8987   10.106   2.6544   12.150   3.4472   18.203   13.148   5.8007   15.047   6.8311 -1.898989 8.961698 
1 1 1   13    9   94 o   15.411   5.9060   11.327   10.385   10.375   12.605   13.338   18.320   15.406   6.3075   16.991   7.3131 -1.585028 9.657450 
1 1 1   13    9   95 o   13.532   5.6362   6.3511   10.301   3.9838   12.544   11.252   18.049   13.527   5.9335   16.420   7.1618 -2.893353 9.300447 
1 1 1   13    9   96 f   18.014   6.1319   17.604   10.772   24.213   13.218   4.5360   18.588   20.404   6.7918   15.149   6.8877 5.254996 9.673058 
1 1 1   13    9   97 o   17.400   6.1539   16.360   10.899   12.537   13.279   24.248   19.076   16.045   6.5094   19.476   7.8375 -3.431776 10.18814 
1 1 1   13    9   98 o   11.625   5.1372   1.3008   9.5671   1.6459   12.825   0.8677   14.365   12.953   5.8206   13.279   6.0443 -0.3263893 8.391212 
1 1 1   13    9   99 o   11.735   5.1625   1.7714   9.5593  -0.9313   12.913   5.0490   14.220   12.396   5.6758   14.105   6.2466 -1.708552 8.440058 
1 1 1   13    9  100 o   15.386   6.7058   9.3518   15.800   9.3518   15.800   0.0000   0.0000   15.386   6.7058  ?   ?  0.000000 6.705809 
1 1 1   13    9  101 o   15.372   6.7462   9.2613   16.234   9.2613   16.234   0.0000   0.0000   15.372   6.7462  ?   ?  0.000000 6.746157 
1 1 1   13    9  102 o   16.440   6.9558   14.088   16.075   14.088   16.075   0.0000   0.0000   16.440   6.9558  ?   ?  0.000000 6.955762 
1 1 1   13    9  103 o   12.789   5.9588  -2.2777   15.165  -2.2777   15.165   0.0000   0.0000   12.789   5.9588  ?   ?  0.000000 5.958832 
1 1 1   13    9  104 o   14.644   6.6382   5.1706   17.109   5.1706   17.109   0.0000   0.0000   14.644   6.6382  ?   ?  0.000000 6.638193 
1 1 1   13   10 -100 o   14.812   6.7112   6.0579   17.464   6.0579   17.464   0.0000   0.0000   14.812   6.7112  ?   ?  0.000000 6.711210 
1 1 1   13   10  -99 o   13.442   6.2440  -0.3573   16.456  -0.3573   16.456   0.0000   0.0000   13.442   6.2440  ?   ?  0.000000 6.244017 
1 1 1   13   10  -98 o   15.325   6.7768   9.2504   16.674   9.2504   16.674   0.0000   0.0000   15.325   6.7768  ?   ?  0.000000 6.776844 
1 1 1   13   10  -97 o   27.023   6.2035   40.375   13.376   40.375   13.376   0.0000   0.0000   27.023   6.2035  ?   ?  0.000000 6.203542 
1 1 1   13   10  -96 o   12.409   5.6713  -0.4200   12.813  -0.4200   12.813   0.0000   0.0000   12.409   5.6713  ?   ?  0.000000 5.671286 
1 1 1   13   10  -95 o   9.3551   4.6103 -19.2982   12.527 -19.2982   12.527   0.0000   0.0000   9.3551   4.6103  ?   ?  0.000000 4.610346 
1 1 1   13   10  -94 o   9.8343   4.7914 -15.0009   12.394 -15.0009   12.394   0.0000   0.0000   9.8343   4.7914  ?   ?  0.000000 4.791391 
1 1 1   13   10  -93 o   16.882   6.5654   15.295   12.971   15.295   12.971   0.0000   0.0000   16.882   6.5654  ?   ?  0.000000 6.565427 
1 1 1   13   10  -92 o   12.110   5.5805  -2.3637   12.763  -2.3637   12.763   0.0000   0.0000   12.110   5.5805  ?   ?  0.000000 5.580534 
1 1 1   13   10  -91 o   16.458   6.4717   13.842   12.718   13.842   12.718   0.0000   0.0000   16.458   6.4717  ?   ?  0.000000 6.471679 
1 1 1   13   10  -90 o   12.301   5.3843   2.3851   10.280  -0.0526   12.030   8.9834   19.792   12.370   5.5910   16.218   7.2638 -3.847760 9.166320 
1 1 1   13   10  -89 o   13.060   5.5564   4.7118   10.355   8.6632   12.294  -4.9353   19.209   14.821   6.1638   13.898   6.5488 0.9222546 8.993310 
1 1 1   13   10  -88 o   18.017   5.9749   17.124   10.232   15.156   12.156   21.908   18.952   17.093   6.4269   19.240   7.7872 -2.146975 10.09682 
1 1 1   13   10  -87 o   15.020   5.8133   10.199   10.132   14.627   11.962  -1.0472   19.064   16.932   6.3735   14.556   6.7473 2.376838 9.281570 
1 1 1   13   10  -86 o   12.431   5.3014   3.4988   9.4663   8.8772   11.912  -5.7211   15.596   14.934   6.1248   12.768   5.9795 2.166675 8.559675 
1 1 1   13   10  -85 o   11.441   5.0932  -0.0953   9.5769   9.3819   12.251 -14.9836   15.356   15.229   6.2248   11.367   5.4895 3.862299 8.299537 
1 1 1   13   10  -84 o   15.291   5.7497   10.693   9.7295   16.737   12.329   0.7144   15.841   17.951   6.5216   14.123   6.3960 3.827912 9.134562 
1 1 1   13   10  -83 o   16.874   5.8187   14.044   9.7077   12.044   12.455   17.141   15.496   16.322   6.4085   18.321   7.1616 -1.999048 9.610246 
1 1 1   13   10  -82 o   11.733   5.1608   0.5143   9.5484  -9.3430   12.234   15.875   15.272   10.927   5.1721   18.056   7.0943 -7.129111 8.779552 
1 1 1   13   10  -81 o   17.902   5.6367   15.732   9.1800   22.354   12.612   8.2697   13.388   20.662   6.6189   15.522   6.4419 5.139651 9.236268 
1 1 1   13   10  -80 o   10.578   4.8036  -2.9224   9.0091  -5.6103   12.535  -0.0506   12.957   11.858   5.4879   13.243   5.9079 -1.384952 8.063503 
1 1 1   13   10  -79 o   11.586   5.0530   0.5881   8.9831  -7.6788   12.674   8.9342   12.734   11.576   5.4112   15.706   6.3736 -4.130238 8.360866 
1 1 1   13   10  -78 o   12.423   4.7083   5.6877   6.5534   13.010   13.032   3.2094   7.5818   17.231   6.6129   11.789   4.8661 5.441114 8.210299 
1 1 1   13   10  -77 o   14.449   4.8427   9.2236   6.7182   7.1200   13.092   9.9756   7.8274   15.406   6.3799   15.058   5.2233 0.3484888 8.245404 
1 1 1   13   10  -76 o   19.205   4.5503   16.942   7.0136   4.9753   13.521   21.347   8.2036   15.014   6.3668   21.488   4.8044 -6.474038 7.976115 
1 1 1   13   10  -75 o   17.934   4.7879   14.840   7.1305  -5.5094   13.021   23.556   8.5218   12.357   5.6734   22.666   4.7639 -10.30894 7.408243 
1 1 1   13   10  -74 o   9.3251   4.1905  -2.2782   6.6477   4.5003   11.165  -6.0006   8.2741   14.085   5.8673   9.5024   4.4187 4.582224 7.345023 
1 1 1   13   10  -73 o   37.979   2.5356   60.433   7.8050   71.290   12.590   53.656   9.9470   40.572   3.8531   35.344   3.4984 5.228191 5.204325 
1 1 1   13   10  -72 o   9.9169   4.3495  -0.8057   6.7388 -13.0717   11.112   6.3295   8.4751   10.011   4.7915   13.723   5.3153 -3.711976 7.156191 
1 1 1   13   10  -71 o   20.135   5.1747   18.655   8.5390   31.480   11.577   3.3517   12.646   26.044   5.6184   14.498   6.1532 11.54592 8.332351 
1 1 1   13   10  -70 o   18.007   4.8144   14.696   7.2031   6.6676   13.601   17.825   8.4917   15.885   6.5330   19.711   5.2079 -3.826256 8.354758 
1 1 1   13   10  -69 o   46.965   2.2482   91.504   8.5819   96.310   14.458   88.889   10.664   47.450   3.7690   46.041   2.8554 1.408089 4.728458 
1 1 1   13   10  -68 o   23.418   3.9453   23.933   7.2636   12.997   12.257   29.853   9.0177   17.751   6.4943   26.020   4.4088 -8.268822 7.849458 
1 1 1   13   10  -67 o   8.7220   4.0840  -6.5128   7.2692   6.6272   12.424 -13.3534   8.9638   15.539   6.2991   8.6227   4.1714 6.915989 7.555116 
1 1 1   13   10  -66 o   21.497   4.5300   20.578   7.6872   16.405   14.970   22.072   8.9585   19.617   7.1771   22.082   5.0823 -2.465826 8.794384 
1 1 1   13   10  -65 o   40.376   2.4888   67.815   8.1513   62.159   14.723   70.315   9.7885   37.566   4.9266   40.949   2.9523 -3.383236 5.743436 
1 1 1   13   10  -64 o   10.860   4.5756   1.1724   6.9091  -0.5909   12.346   1.9764   8.3368   13.473   5.8988   12.062   5.0507 1.410896 7.765647 
1 1 1   13   10  -63 o   52.815   1.9758  114.976   8.4912  107.472   13.385  120.029   10.984   50.572   3.2645   53.781   2.5125 -3.209068 4.119422 
1 1 1   13   10  -62 o   42.128   2.7474   73.966   9.3833   64.648   18.569   77.161   10.874   37.693   6.2632   42.892   3.1316 -5.199009 7.002509 
1 1 1   13   10  -61 o   23.058   4.2163   23.194   7.6328   47.255   13.537   11.978   9.2421   32.670   5.2618   16.846   5.6802 15.82391 7.742820 
1 1 1   13   10  -60 o   11.385   4.7231   1.9008   7.1928  -8.0728   13.185   6.1270   8.5825   12.318   5.6750   13.921   5.3603 -1.602394 7.806344 
1 1 1   13   10  -59 o   68.695   1.7986  193.807   10.063  199.207   17.731  191.242   12.221   69.104   3.1560   68.108   2.2042 0.9958115 3.849538 
1 1 1   13   10  -58 o   35.725   2.5723   52.993   7.4406   42.849   12.293   58.857   9.3471   31.300   4.9853   37.513   3.0839 -6.213633 5.862071 
1 1 1   13   10  -57 o   26.401   3.3301   29.464   7.0075   29.125   11.999   29.639   8.6327   25.398   5.9074   26.222   4.1789 -0.8234310 7.236073 
1 1 1   13   10  -56 o   24.690   3.7610   26.047   7.3306   7.6221   13.034   34.572   8.8657   16.423   6.5219   28.464   3.9255 -12.04126 7.612156 
1 1 1   13   10  -55 o   50.292   2.0328  104.033   8.3163   97.098   13.145  108.660   10.738   48.200   3.3669   51.259   2.5782 -3.059181 4.240666 
1 1 1   13   10  -54 o   30.491   2.9616   38.816   7.2682   33.680   11.921   41.856   9.1697   27.601   5.4917   31.489   3.6393 -3.887730 6.588102 
1 1 1   13   10  -53 o   53.321   1.9787  116.788   8.5852  115.759   13.485  117.489   11.133   52.771   3.1492   53.339   2.5680 -0.5679588 4.063548 
1 1 1   13   10  -52 o   15.289   4.8949   9.7439   6.8982   18.059   11.087   4.4928   8.8111   20.305   6.1614   13.478   5.3592 6.826995 8.166019 
1 1 1   13   10  -51 o   65.216   1.9636  174.511   10.427  200.890   19.984  164.645   12.222   69.468   3.5409   63.246   2.3749 6.221336 4.263533 
1 1 1   13   10  -50 o   52.255   2.1389  112.209   9.0915  106.540   15.842  114.993   11.102   50.442   3.8827   52.801   2.5872 -2.358952 4.665738 
1 1 1   13   10  -49 o   40.211   3.0344   67.102   9.8728   81.985   14.862   55.346   13.209   44.138   4.1805   36.063   4.5975 8.074623 6.214025 
1 1 1   13   10  -48 o   40.660   3.0383   68.565   9.9971   76.020   14.806   62.319   13.553   42.460   4.3387   38.381   4.4122 4.079086 6.188001 
1 1 1   13   10  -47 o   22.806   5.1921   22.735   9.4350   29.863   14.108   16.967   12.690   25.878   6.6519   20.155   6.6530 5.723324 9.407999 
1 1 1   13   10  -46 o   81.286   1.8731  270.430   12.411  290.041   24.167  263.404   14.465   83.658   3.5520   80.126   2.2167 3.532051 4.186932 
1 1 1   13   10  -45 o   78.014   2.9717  250.914   18.864   0.0000   0.0000  250.914   18.864  ?   ?    78.014   2.9717 0.000000 2.971746 
1 1 1   13   10  -44 o   35.766   3.4818   53.305   10.023   59.807   19.258   50.890   11.737   36.939   6.6400   34.757   4.2298 2.181587 7.872800 
1 1 1   13   10  -43 o   78.317   1.9146  250.949   12.223  265.146   19.228  241.322   15.833   80.241   2.9447   76.649   2.5376 3.592056 3.887241 
1 1 1   13   10  -42 o   21.126   5.1245   19.392   8.7334   41.412   14.774   7.5633   10.828   30.816   6.0973   15.790   6.0359 15.02544 8.579579 
1 1 1   13   10  -41 o   72.807   2.0284  217.067   12.026  187.488   23.308  227.799   14.040   67.108   4.2832   74.535   2.3136 -7.426453 4.868134 
1 1 1   13   10  -40 o   28.564   3.6864   34.201   8.3832   36.481   14.779   33.120   10.179   28.841   6.4485   27.881   4.6420 0.9602127 7.945480 
1 1 1   13   10  -39 o   25.020   4.2981   26.624   8.4500   34.960   14.744   22.547   10.312   28.228   6.5365   22.769   5.5962 5.459225 8.604826 
1 1 1   13   10  -38 o   81.673   1.8175  272.632   12.100  285.729   20.081  265.166   15.162   83.367   2.9597   80.444   2.3146 2.923698 3.757304 
1 1 1   13   10  -37 o   83.686   1.8226  286.218   12.433  296.024   20.773  280.745   15.519   84.857   3.0080   82.783   2.3020 2.073166 3.787786 
1 1 1   13   10  -36 o   43.679   2.7104   78.510   9.6030   69.590   16.686   82.928   11.743   40.589   5.1596   44.807   3.2368 -4.217911 6.090876 
1 1 1   13   10  -35 o   66.503   2.2314  181.145   12.079  207.551   24.452  172.622   13.893   70.746   4.2599   64.854   2.6334 5.891541 5.008136 
1 1 1   13   10  -34 o   43.224   3.4056   77.268   11.902   71.266   18.271   81.693   15.688   40.984   5.6165   44.242   4.4086 -3.257835 7.140122 
1 1 1   13   10  -33 o   95.448   1.8415  372.217   14.328  385.244   23.756  364.769   17.963   96.860   3.0124   94.418   2.3339 2.441887 3.810752 
1 1 1   13   10  -32 o   31.163   4.0691   40.690   10.090   59.434   17.715   31.689   12.276   37.278   6.0361   27.087   5.7384 10.19111 8.328456 
1 1 1   13   10  -31 o   47.635   4.3439   94.402   16.681   0.0000   0.0000   94.402   16.681  ?   ?    47.635   4.3439 0.000000 4.343853 
1 1 1   13   10  -30 o   69.332   2.3504  196.850   13.264  165.242   26.900  207.006   15.247   62.888   5.2965   71.057   2.6369 -8.168785 5.916628 
1 1 1   13   10  -29 o   88.775   2.2654  322.466   16.380  330.915   30.135  318.923   19.515   89.528   4.1405   88.211   2.7173 1.316902 4.952536 
1 1 1   13   10  -28 o   29.052   4.2262   35.479   9.7150   37.559   16.757   34.425   11.923   29.339   7.0868   28.370   5.3521 0.9689369 8.880800 
1 1 1   13   10  -27 o   65.062   2.3536  173.329   12.462  183.794   19.410  165.990   16.254   66.803   3.5775   63.552   3.1475 3.250751 4.764990 
1 1 1   13   10  -26 o   63.776   2.6451  166.734   13.721  135.442   25.677  179.243   16.234   56.864   5.6125   66.071   3.0221 -9.207329 6.374455 
1 1 1   13   10  -25 o  145.196   1.8356  860.907   21.726  847.666   31.921  872.333   29.653  143.909   2.7212  146.038   2.4910 -2.128860 3.689118 
1 1 1   13   10  -24 o   29.590   3.9625   36.622   9.3175   38.114   15.756   35.819   11.554   29.649   6.6802   29.033   5.0663 0.6154366 8.384053 
1 1 1   13   10  -23 o   16.858   5.6209   11.171   9.0526   1.3572   15.128   16.646   11.299   15.993   6.7562   20.039   6.2454 -4.045733 9.200623 
1 1 1   13   10  -22 o   17.735   5.5737   12.907   8.9797  -0.5017   15.061   20.302   11.185   15.484   6.6472   21.783   6.0725 -6.298643 9.003369 
1 1 1   13   10  -21 o  128.432   1.8100  673.448   18.950  627.290   27.398  715.777   26.237  123.819   2.7146  132.314   2.4326 -8.495674 3.645043 
1 1 1   13   10  -20 o   68.497   2.0429  191.811   11.394  204.644   18.684  184.213   14.376   70.591   3.2557   67.057   2.6352 3.534302 4.188575 
1 1 1   13   10  -19 o   74.727   1.9512  228.192   11.875  228.184   19.348  228.197   15.042   74.563   3.1907   74.669   2.4747 -0.1056519 4.037901 
1 1 1   13   10  -18 o   10.643   4.8327  -5.3635   9.1157  -9.3531   15.879  -3.4024   11.133   13.981   6.3601   12.521   5.5370 1.459629 8.432643 
1 1 1   13   10  -17 o   93.190   1.8442  354.546   14.009  397.715   25.039  334.874   16.903   98.497   3.1225   90.497   2.2932 7.999649 3.874125 
1 1 1   13   10  -16 o  125.613   1.9152  644.251   19.610  684.621   31.857  619.619   24.884  129.316   3.0221  123.114   2.4795 6.202492 3.909108 
1 1 1   13   10  -15 o  161.913   1.9540  1070.45   25.790  1084.15   41.347  1061.73   32.995  162.715   3.1173  161.155   2.5117 1.559692 4.003289 
1 1 1   13   10  -14 o   76.264   2.1918  237.789   13.612  272.394   22.326  217.315   17.172   81.463   3.3694   72.817   2.8989 8.645554 4.444805 
1 1 1   13   10  -13 o   70.727   2.5832  204.795   14.868  212.962   20.904  196.436   21.151   71.981   3.5739   69.092   3.7697 2.889648 5.194584 
1 1 1   13   10  -12 o   43.109   3.6687   76.759   12.770   94.938   17.859   57.743   18.265   47.806   4.6413   36.808   6.3149 10.99736 7.837039 
1 1 1   13   10  -11 o   36.755   4.1683   56.195   12.268   42.685   16.908   71.217   17.829   31.448   6.7943   41.178   5.4448 -9.729759 8.706838 
1 1 1   13   10  -10 o  106.927   1.9426  466.797   16.932  486.158   27.253  454.625   21.609  108.938   3.0721  105.462   2.5136 3.475922 3.969407 
1 1 1   13   10   -9 o  144.684   1.9143  854.617   22.578  877.031   49.626  848.766   25.353  146.057   4.1725  144.156   2.1576 1.900848 4.697358 
1 1 1   13   10   -8 o   19.782   5.8366   16.456   10.056   47.690   21.710   7.9239   11.347   33.079   8.1140   16.317   6.1927 16.76218 10.20716 
1 1 1   13   10   -7 o  136.911   2.0863  765.477   23.284  722.399   45.252  780.988   27.154  132.546   4.1936  138.246   2.4096 -5.700607 4.836553 
1 1 1   13   10   -6 o  101.611   1.8325  421.445   15.178  389.071   26.617  437.044   18.476   97.402   3.3574  103.441   2.1912 -6.039520 4.009192 
1 1 1   13   10   -5 o   65.662   2.1893  176.294   11.702  178.406   20.450  175.265   14.268   65.838   3.8269   65.417   2.6814 0.4207916 4.672856 
1 1 1   13   10   -4 o   24.215   5.0287   25.042   9.6010   23.598   16.975   25.721   11.642   23.974   7.6790   24.453   5.9074 -0.4786892 9.688338 
1 1 1   13   10   -3 o  126.048   1.7640  648.450   18.125  645.376   31.401  649.986   22.195  125.575   3.0676  126.154   2.1584 -0.5797882 3.750845 
1 1 1   13   10   -2 o   23.435   5.1534   23.514   9.5762   4.8036   16.634   32.790   11.712   17.667   7.2407   27.731   5.3752 -10.06451 9.017781 
1 1 1   13   10   -1 o  133.517   1.7600  727.568   19.155  781.235   34.050  702.721   23.169  138.170   3.0232  131.171   2.1669 6.998871 3.719583 
1 1 1   13   10    0 o  128.642   1.7612  675.410   18.468  686.914   32.257  669.800   22.525  129.556   3.0544  128.063   2.1578 1.492722 3.739705 
1 1 1   13   10    1 o   31.994   3.8254   42.573   9.7790   35.154   17.290   46.063   11.858   28.500   7.3834   33.176   4.5007 -4.675877 8.646983 
1 1 1   13   10    2 o   82.990   1.9287  281.171   13.047  275.032   22.653  284.219   15.960   81.868   3.4018   83.373   2.3508 -1.504593 4.135070 
1 1 1   13   10    3 o   66.673   2.1833  181.752   11.850  172.822   20.535  186.210   14.510   64.784   3.9067   67.437   2.6447 -2.653000 4.717697 
1 1 1   13   10    4 o   51.272   2.5898  107.735   10.789  115.669   18.820  103.851   13.168   52.867   4.4072   50.259   3.2312 2.607681 5.464798 
1 1 1   13   10    5 o   70.865   2.1272  205.273   12.274  221.368   21.731  197.733   14.873   73.393   3.6438   69.496   2.6303 3.896339 4.493972 
1 1 1   13   10    6 o  197.274   1.9071  1588.74   30.668  1637.21   54.115  1565.80   37.222  199.932   3.3205  195.766   2.3325 4.165695 4.057854 
1 1 1   13   10    7 o   77.583   2.0514  245.958   12.962  244.658   23.215  246.547   15.624   77.153   3.7020   77.631   2.4722 -0.4773254 4.451574 
1 1 1   13   10    8 o  113.943   1.9592  530.071   18.197  520.083   42.339  532.334   20.153  112.326   4.6341  114.164   2.1656 -1.838112 5.115095 
1 1 1   13   10    9 o   94.421   2.0440  364.053   15.732  368.924   37.079  362.983   17.373   94.522   4.8284   94.262   2.2610 0.2599869 5.331533 
1 1 1   13   10   10 o   37.608   3.6482   58.529   11.044   60.252   27.423   58.196   12.065   37.037   9.1400   37.439   4.0161 -0.4018478 9.983363 
1 1 1   13   10   11 o   64.915   2.1919  172.328   11.582  156.979   20.413  179.614   14.065   61.692   4.0822   66.229   2.6104 -4.537571 4.845482 
1 1 1   13   10   12 o   57.540   2.3873  135.531   11.173  132.100   19.685  137.162   13.571   56.528   4.3043   57.828   2.8882 -1.300194 5.183526 
1 1 1   13   10   13 o   31.760   3.9783   42.049   10.074   52.289   14.603   32.750   13.916   35.221   5.2460   27.554   6.3292 7.667789 8.220653 
1 1 1   13   10   14 o   94.632   1.9015  365.621   14.668  383.862   21.297  349.160   20.231   96.842   2.7005   92.359   2.6901 4.483086 3.811674 
1 1 1   13   10   15 o  131.668   2.1745  708.199   23.338  689.979   32.987  726.460   33.024  129.807   3.1175  133.210   3.0413 -3.402466 4.355236 
1 1 1   13   10   16 o   16.746   5.7079   10.735   9.3345 -11.9179   17.207   20.181   11.112   14.223   6.5272   21.737   6.0498 -7.513868 8.899685 
1 1 1   13   10   17 o   58.122   2.8672  138.579   13.542   0.0000   0.0000  138.579   13.542  ?   ?    58.122   2.8672 0.000000 2.867228 
1 1 1   13   10   18 o  112.137   1.7844  513.330   16.311  518.394   28.951  510.975   19.742  112.452   3.1614  111.837   2.1656 0.6155243 3.832033 
1 1 1   13   10   19 o   85.208   1.9364  296.483   13.450  313.014   24.375  289.247   16.127   87.307   3.4317   84.091   2.3551 3.216003 4.162121 
1 1 1   13   10   20 o   54.779   2.2769  122.844   10.145  114.963   15.861  128.301   13.198   52.794   3.7091   55.909   2.9059 -3.115086 4.711884 
1 1 1   13   10   21 o   86.121   1.7896  302.802   12.564  333.905   20.063  282.736   16.114   90.294   2.7290   83.131   2.3804 7.163300 3.621282 
1 1 1   13   10   22 o  107.829   1.6773  474.605   14.743  485.296   23.142  467.302   19.127  108.920   2.6065  106.938   2.1942 1.981583 3.407085 
1 1 1   13   10   23 o   52.857   2.4161  114.472   10.382  119.726   16.752  111.195   13.230   53.847   3.8417   51.999   3.1358 1.848248 4.959018 
1 1 1   13   10   24 o   42.759   3.0342   75.272   10.507   83.146   15.796   69.023   14.071   44.718   4.3900   40.722   4.3040 3.996021 6.147912 
1 1 1   13   10   25 o   96.667   2.0759  381.801   16.358  382.181   21.901  381.321   24.601   96.581   2.7848   96.404   3.1347 0.1762695 4.193014 
1 1 1   13   10   26 o  129.081   1.9846  680.661   20.882  728.185   28.318  624.020   30.915  133.400   2.6042  123.395   3.0736 10.00526 4.028478 
1 1 1   13   10   27 o   97.732   2.2911  390.522   18.252  383.555   26.626  396.699   25.070   96.618   3.3860   98.318   3.1321 -1.700256 4.612439 
1 1 1   13   10   28 o   68.998   2.4528  194.995   13.773  191.114   18.872  199.417   20.146   68.150   3.4080   69.587   3.5635 -1.437675 4.930846 
1 1 1   13   10   29 o   50.924   2.7689  106.515   11.451  104.774   17.468  107.827   15.163   50.229   4.3079   51.090   3.6652 -0.8609238 5.656155 
1 1 1   13   10   30 o   28.535   5.0198   34.676   11.250   39.929   15.692   29.121   16.137   30.328   6.5401   25.914   7.3190 4.413486 9.815284 
1 1 1   13   10   31 o   64.213   2.5350  169.042   13.243  128.235   21.948  192.404   16.607   55.437   4.9074   68.438   2.9840 -13.00105 5.743399 
1 1 1   13   10   32 o  106.770   2.3633  466.436   20.568  509.040   30.084  429.043   28.184  111.281   3.3202  102.136   3.3899 9.144493 4.745068 
1 1 1   13   10   33 o   16.627   6.1531   9.2144   11.055   23.320   19.279   2.3041   13.494   24.081   8.2031   15.382   6.4320 8.698867 10.42408 
1 1 1   13   10   34 o  110.261   1.8691  496.796   16.799  464.036   24.453  526.081   23.119  106.350   2.8232  113.348   2.5022 -6.997681 3.772469 
1 1 1   13   10   35 o   65.955   2.1424  178.111   11.503  206.304   19.277  162.520   14.335   70.764   3.3514   62.895   2.8031 7.868141 4.369172 
1 1 1   13   10   36 o   15.378   5.6920   7.8509   9.4612   3.6866   19.158   9.1942   10.881   18.272   7.6539   16.528   6.1066 1.744232 9.791486 
1 1 1   13   10   37 o   52.111   2.3501  111.404   9.9570  113.502   16.723  110.252   12.393   52.293   3.9524   51.743   2.9505 0.5501671 4.932217 
1 1 1   13   10   38 o   43.675   2.6708   78.502   9.4628   71.867   15.767   82.237   11.830   41.337   4.7665   44.599   3.2770 -3.261845 5.784295 
1 1 1   13   10   39 o   13.628   5.2479   5.2596   8.2265   11.719   14.286   2.0546   10.062   18.690   6.9797   13.414   5.5775 5.276040 8.934437 
1 1 1   13   10   40 o   35.149   3.0522   51.155   8.6585   54.474   14.465   49.303   10.809   35.802   5.1005   34.323   3.9343 1.479298 6.441606 
1 1 1   13   10   41 o   77.266   1.8055  244.084   11.371  252.298   18.230  238.852   14.549   78.321   2.8602   76.318   2.3415 2.003479 3.696353 
1 1 1   13   10   42 o   10.835   4.7932  -2.4418   8.3509  -4.0381   12.641  -1.2059   11.123   13.167   5.8572   13.008   5.6486 0.1585999 8.137132 
1 1 1   13   10   43 o   58.992   2.2882  142.824   10.982  141.794   17.106  143.547   14.325   58.480   3.6059   58.998   2.9883 -0.5177689 4.683227 
1 1 1   13   10   44 o   73.081   2.2508  219.089   13.392  202.534   23.834  226.727   16.190   69.699   4.2147   74.246   2.6794 -4.547310 4.994318 
1 1 1   13   10   45 o   66.480   2.3439  181.482   12.682  167.669   22.868  187.616   15.240   63.277   4.4622   67.495   2.7759 -4.218143 5.255188 
1 1 1   13   10   46 o   73.079   2.0392  218.916   12.136  216.606   23.664  219.740   14.136   72.094   4.0429   73.143   2.3741 -1.048889 4.688391 
1 1 1   13   10   47 o   46.626   2.4986   89.548   9.4618   78.539   16.462   94.979   11.563   43.047   4.7713   47.919   2.9748 -4.872066 5.622700 
1 1 1   13   10   48 o   82.969   1.8655  281.856   12.617  285.041   22.630  280.419   15.198   82.950   3.3537   82.639   2.2583 0.3105698 4.043194 
1 1 1   13   10   49 o   20.852   4.9306   19.015   8.2481   3.6101   14.057   27.102   10.186   15.806   6.5839   24.903   5.1864 -9.096520 8.381293 
1 1 1   13   10   50 o   69.270   2.1823  197.101   12.307  200.182   18.478  194.645   16.500   69.474   3.2720   68.613   2.9571 0.8608093 4.410200 
1 1 1   13   10   51 o   88.270   2.1591  319.800   15.536  325.841   20.910  312.357   23.212   88.809   2.8922   86.780   3.2873 2.029335 4.378503 
1 1 1   13   10   52 o   50.191   2.6506  104.095   10.806  100.472   16.184  107.009   14.516   48.846   4.1025   50.624   3.5399 -1.778358 5.418593 
1 1 1   13   10   53 o   16.805   5.2357   12.048   7.9413   19.610   13.771   8.2804   9.7205   21.246   6.9258   15.457   5.7604 5.789511 9.008245 
1 1 1   13   10   54 o   33.879   3.0844   47.930   8.4248   47.798   14.571   47.997   10.326   32.958   5.6254   33.688   3.8280 -0.7298126 6.804262 
1 1 1   13   10   55 o   53.907   2.1590  119.638   9.4681  126.295   16.412  116.318   11.592   54.869   3.6908   53.005   2.6916 1.864422 4.568020 
1 1 1   13   10   56 o   15.238   5.1938   9.3774   7.7288  -0.6259   13.978   13.782   9.2756   14.469   6.3069   17.876   5.6708 -3.407484 8.481425 
1 1 1   13   10   57 o   24.760   4.0000   26.372   7.7981   27.702   14.072   25.783   9.3680   24.539   6.8002   24.182   4.9201 0.3576508 8.393506 
1 1 1   13   10   58 o   30.147   3.3514   38.336   8.0969   48.051   14.697   34.102   9.7021   32.867   5.6917   28.078   4.3821 4.789471 7.183140 
1 1 1   13   10   59 o   41.431   2.5203   71.172   8.4715   95.451   15.098   60.016   10.234   47.458   3.9382   37.778   3.3584 9.680386 5.175755 
1 1 1   13   10   60 o   8.7106   4.1178  -8.2869   7.7085 -11.8943   13.039  -6.3486   9.5576   11.528   5.4204   10.484   4.8306 1.043655 7.260561 
1 1 1   13   10   61 o   21.239   5.1594   20.257   8.8429   5.0135   17.549   25.445   10.238   17.196   7.2711   23.758   5.4082 -6.562098 9.061887 
1 1 1   13   10   62 o   24.403   4.6838   26.305   8.9783   26.038   17.963   26.394   10.366   23.594   7.9187   24.181   5.3961 -0.5869617 9.582452 
1 1 1   13   10   63 o   19.654   5.0335   17.371   8.0987   19.063   17.940   16.938   9.0761   21.167   7.8374   19.359   5.4963 1.808380 9.572540 
1 1 1   13   10   64 o   17.706   5.2477   14.006   8.1140 -26.6476   17.579   25.012   9.1466   11.769   5.7277   23.654   4.9048 -11.88505 7.540803 
1 1 1   13   10   65 o   14.652   5.0585   8.7834   7.3374   25.101   13.679   2.1919   8.6940   23.047   6.8093   12.330   5.1598 10.71781 8.543396 
1 1 1   13   10   66 o   12.564   4.9150   4.6775   7.3037   7.9298   13.817   3.4163   8.6041   16.480   6.6565   12.718   5.2094 3.762486 8.452686 
1 1 1   13   10   67 o   26.192   3.7243   29.589   7.7277   34.592   13.667   27.238   9.3692   27.150   6.2977   24.671   4.8318 2.479219 7.937695 
1 1 1   13   10   68 o   33.701   2.8975   47.772   7.8826   42.016   14.196   50.338   9.4780   30.132   5.9905   34.393   3.4262 -4.261099 6.901132 
1 1 1   13   10   69 o   17.431   5.0730   13.720   7.6417   13.253   16.371   13.850   8.6409   18.737   7.3501   17.542   5.4608 1.195845 9.156645 
1 1 1   13   10   70 o   19.893   4.5858   17.826   7.2838   3.8533   13.630   23.412   8.6175   15.086   6.3948   22.777   4.7934 -7.690763 7.991907 
1 1 1   13   10   71 o   63.178   1.9951  165.015   10.262  203.042   20.754  152.709   11.806   68.921   3.7077   60.585   2.3953 8.336136 4.414145 
1 1 1   13   10   72 o   14.119   5.0491   8.0185   7.3554  -6.6352   15.307   12.418   8.3872   13.367   6.1422   16.658   5.4032 -3.291760 8.180558 
1 1 1   13   10   73 o   30.709   3.0575   40.109   7.5521   62.223   13.791   30.638   9.0256   37.410   4.6206   26.226   4.3760 11.18444 6.363897 
1 1 1   13   10   74 o   16.765   5.9072   12.365   10.035   22.188   13.188  -1.1446   15.466   21.269   6.7635   14.414   6.4407 6.855208 9.339592 
1 1 1   13   10   75 o   31.710   3.9131   44.069   9.9003   51.712   14.406   37.228   13.629   33.338   5.4921   27.719   6.1885 5.619371 8.274093 
1 1 1   13   10   76 o   40.217   2.4718   67.889   8.0641   91.305   15.053   58.465   9.5501   45.568   4.0963   36.946   3.2026 8.621395 5.199640 
1 1 1   13   10   77 o   27.589   3.2728   32.919   7.2172   40.893   13.974   30.019   8.4282   28.933   6.1167   25.903   4.1303 3.030787 7.380584 
1 1 1   13   10   78 o   15.181   4.8452   10.527   6.7629   18.595   13.176   7.6403   7.8802   19.355   6.7728   13.854   5.1818 5.500746 8.527716 
1 1 1   13   10   79 o   18.237   4.7388   15.633   7.1078   29.060   12.732   9.5531   8.5671   23.871   6.4090   14.893   5.4325 8.978494 8.401599 
1 1 1   13   10   80 o   24.658   3.7517   27.084   7.3033   24.620   12.655   28.314   8.9428   21.763   6.5781   24.718   4.6078 -2.955122 8.031394 
1 1 1   13   10   81 o   25.807   4.9835   31.544   10.104   19.333   12.873   51.135   16.306   19.357   6.6994   31.551   6.5543 -12.19388 9.372395 
1 1 1   13   10   82 o   10.733   4.8849  -2.8674   9.3798  -4.0390   12.011  -1.0355   15.018   11.823   5.4356   13.683   6.2091 -1.860191 8.252203 
1 1 1   13   10   83 o   38.729   3.4575   66.052   10.801   66.765   14.109   65.043   16.787   37.826   4.6753   36.043   5.9189 1.782452 7.542660 
1 1 1   13   10   84 o   17.563   5.8504   15.672   9.8074   21.033   12.587   7.3889   15.646   19.695   6.6289   15.521   6.7197 4.173018 9.439081 
1 1 1   13   10   85 o   21.144   5.5437   22.739   9.6701   31.480   12.505   9.7364   15.252   24.329   6.2671   15.944   6.7619 8.384687 9.219529 
1 1 1   13   10   86 o   9.8971   4.6270  -5.6393   9.2702  -5.1905   11.869  -6.3413   14.845   11.337   5.2788   12.386   5.8113 -1.048592 7.850933 
1 1 1   13   10   87 o   15.636   5.6927   11.870   9.4011  -6.7354   12.195   39.122   14.759   11.178   5.2518   26.501   6.7993 -15.32284 8.591339 
1 1 1   13   10   88 o   14.456   5.7745   8.7437   10.276   14.959   12.358  -5.1852   18.500   17.026   6.4626   13.724   6.4543 3.301756 9.133572 
1 1 1   13   10   89 o   28.339   4.8707   38.989   10.846   47.201   13.097   21.064   19.349   30.649   5.4416   18.902   7.7849 11.74646 9.498249 
1 1 1   13   10   90 o   15.183   5.8640   10.894   10.293   6.6557   12.374   20.412   18.545   14.195   6.0577   18.630   7.6415 -4.435334 9.751345 
1 1 1   13   10   91 o   14.030   5.7170   7.9046   10.296   6.9266   12.385   10.093   18.525   14.235   6.0671   16.179   7.1491 -1.943608 9.376570 
1 1 1   13   10   92 o   13.961   5.7412   7.6384   10.502   4.7594   12.582   14.252   19.070   13.672   5.9710   17.064   7.4029 -3.392287 9.510856 
1 1 1   13   10   93 o   21.645   6.0480   25.639   11.081   27.029   13.425   22.669   19.630   21.390   6.8266   18.948   7.8263 2.441790 10.38523 
1 1 1   13   10   94 o   13.738   5.9045   5.9911   11.909   2.6186   15.180   11.390   19.206   13.826   6.2614   16.343   7.2475 -2.516973 9.577628 
1 1 1   13   10   95 o   9.7129   4.7130 -13.1971   11.666  -9.8280   15.224 -17.9889   18.156   11.709   5.6053   11.742   5.7379 -0.3348446E-01 8.021405 
1 1 1   13   10   96 o   18.810   7.2722   22.038   15.843   22.038   15.843   0.0000   0.0000   18.810   7.2722  ?   ?  0.000000 7.272230 
1 1 1   13   10   97 o   12.368   5.8637  -6.3245   15.850  -6.3245   15.850   0.0000   0.0000   12.368   5.8637  ?   ?  0.000000 5.863730 
1 1 1   13   10   98 o   15.471   7.1569   6.2140   21.282   6.2140   21.282   0.0000   0.0000   15.471   7.1569  ?   ?  0.000000 7.156917 
1 1 1   13   10   99 o   14.744   6.5841   6.9766   16.136   6.9766   16.136   0.0000   0.0000   14.744   6.5841  ?   ?  0.000000 6.584129 
1 1 1   13   10  100 o   12.406   5.9046  -6.9327   16.380  -6.9327   16.380   0.0000   0.0000   12.406   5.9046  ?   ?  0.000000 5.904586 
1 1 1   13   11  -96 o   21.376   8.6509   37.427   23.387   37.427   23.387   0.0000   0.0000   21.376   8.6509  ?   ?  0.000000 8.650918 
1 1 1   13   11  -95 o   11.807   5.8502 -25.6173   21.158 -25.6173   21.158   0.0000   0.0000   11.807   5.8502  ?   ?  0.000000 5.850243 
1 1 1   13   11  -94 o   14.418   6.5317   5.2771   16.536   5.2771   16.536   0.0000   0.0000   14.418   6.5317  ?   ?  0.000000 6.531695 
1 1 1   13   11  -93 o   20.424   7.6109   28.306   16.968   28.306   16.968   0.0000   0.0000   20.424   7.6109  ?   ?  0.000000 7.610864 
1 1 1   13   11  -92 o   10.840   5.3048 -17.6458   15.690 -17.6458   15.690   0.0000   0.0000   10.840   5.3048  ?   ?  0.000000 5.304777 
1 1 1   13   11  -91 o   14.033   6.3818   3.1540   15.971   3.1540   15.971   0.0000   0.0000   14.033   6.3818  ?   ?  0.000000 6.381828 
1 1 1   13   11  -90 o   19.100   7.4515   23.257   16.750   23.257   16.750   0.0000   0.0000   19.100   7.4515  ?   ?  0.000000 7.451513 
1 1 1   13   11  -89 o   13.780   6.3144   1.3112   16.022   1.3112   16.022   0.0000   0.0000   13.780   6.3144  ?   ?  0.000000 6.314385 
1 1 1   13   11  -88 o   10.964   5.0913  -3.9564   10.928   2.4125   12.901 -20.1351   20.562   13.136   5.8752   12.326   6.0408 0.8095903 8.426725 
1 1 1   13   11  -87 o   19.499   6.2473   21.224   11.235   26.458   13.264   7.9307   21.138   21.226   6.7866   16.081   7.3243 5.145472 9.985160 
1 1 1   13   11  -86 o   22.383   5.9358   26.968   11.005   16.804   12.836   55.167   21.381   17.471   6.5967   28.423   8.5414 -10.95182 10.79221 
1 1 1   13   11  -85 o   11.416   5.1677  -0.9833   10.325  -4.9978   12.056   10.065   20.000   11.332   5.2910   16.409   7.3289 -5.076474 9.039209 
1 1 1   13   11  -84 o   12.485   5.4330   2.8817   10.337  -0.6745   12.111   12.421   19.837   12.283   5.5746   16.937   7.4444 -4.654525 9.300247 
1 1 1   13   11  -83 o   19.084   5.9835   19.454   10.355   17.860   12.167   23.641   19.722   18.114   6.4920   19.603   7.9402 -1.488329 10.25637 
1 1 1   13   11  -82 o   21.486   5.8427   24.273   10.501   17.915   12.347   40.897   19.964   18.171   6.5365   24.816   8.3483 -6.644442 10.60278 
1 1 1   13   11  -81 o   12.840   5.4009   4.6473   9.6009   3.4766   12.180   6.5685   15.603   13.407   5.8647   15.131   6.6277 -1.723475 8.849878 
1 1 1   13   11  -80 o   15.259   5.7539   10.807   9.7588   7.3148   12.329   16.665   15.969   14.573   6.1244   17.903   7.1825 -3.330037 9.439104 
1 1 1   13   11  -79 o   16.610   5.8205   13.738   9.7331   13.603   12.289   13.964   15.943   16.708   6.4192   17.220   7.0767 -0.5120201 9.554391 
1 1 1   13   11  -78 o   29.267   4.6195   40.180   10.656   52.583   13.791   21.807   16.785   32.878   5.3280   19.739   7.5223 13.13983 9.218080 
1 1 1   13   11  -77 o   8.9247   4.3166 -12.3646   9.5860 -11.2338   12.132 -14.2439   15.640   10.536   5.0330   11.715   5.6277 -1.179570 7.549993 
1 1 1   13   11  -76 o   25.077   4.0924   28.584   8.0771   27.745   13.195   29.087   10.214   22.845   6.6712   24.508   5.2696 -1.663578 8.501391 
1 1 1   13   11  -75 o   37.498   2.8924   60.235   8.7728   54.522   14.156   63.797   11.178   33.837   5.3066   38.066   3.6470 -4.229359 6.438955 
1 1 1   13   11  -74 o   17.830   5.9820   15.491   10.251   29.885   13.406  -4.7735   15.907   23.962   6.6361   13.479   6.2181 10.48360 9.094151 
1 1 1   13   11  -73 o   21.953   4.6023   22.347   7.9721   11.280   13.581   28.166   9.8472   16.675   6.6459   24.395   5.1157 -7.719667 8.386762 
1 1 1   13   11  -72 o   14.493   5.0971   9.1091   7.4687 -13.1184   13.719   18.473   8.9040   11.238   5.3639   19.608   5.3997 -8.370187 7.611097 
1 1 1   13   11  -71 o   12.946   5.0052   5.8786   7.5049   4.0013   14.041   6.6294   8.8798   14.870   6.4012   13.803   5.4136 1.066815 8.383527 
1 1 1   13   11  -70 o   18.923   5.1392   16.817   8.1304   5.2764   13.572   23.277   10.154   15.115   6.3930   22.037   5.6322 -6.921150 8.520154 
1 1 1   13   11  -69 o   19.444   4.8504   17.497   7.6618   34.606   14.039   10.240   9.1434   26.447   6.5476   15.558   5.6213 10.88814 8.629548 
1 1 1   13   11  -68 o   13.698   4.9193   7.5703   6.9898   8.1403   11.597   7.2451   8.7596   15.458   6.1478   14.144   5.4233 1.313957 8.198032 
1 1 1   13   11  -67 o   25.340   3.8354   28.113   7.6749   25.734   14.053   29.125   9.1618   22.789   6.9411   25.445   4.5858 -2.656752 8.319162 
1 1 1   13   11  -66 o   12.268   4.7805   4.7115   6.8874   13.192   11.513  -0.0154   8.5951   17.485   6.3089   11.401   4.9579 6.083179 8.023955 
1 1 1   13   11  -65 o   30.880   3.1969   40.606   7.9310   34.636   14.464   43.172   9.4840   26.714   6.6644   31.603   3.7548 -4.888594 7.649361 
1 1 1   13   11  -64 o   16.558   5.1563   12.277   7.7035  -1.0702   17.083   15.684   8.6309   15.267   6.7991   18.488   5.3944 -3.220803 8.679171 
1 1 1   13   11  -63 f   9.6356   4.3226  -2.4325   7.0400   10.723   13.619  -7.2292   8.2239   17.194   6.7159   9.2516   4.3358 7.942476 7.993946 
1 1 1   13   11  -62 f   28.725   3.2940   35.155   7.5736   47.293   14.101   30.235   8.9785   32.224   5.5697   26.192   4.3584 6.032421 7.072280 
1 1 1   13   11  -61 o   37.976   2.6435   60.279   8.1322   59.322   15.077   60.672   9.6574   36.413   5.2295   37.903   3.1543 -1.490135 6.107106 
1 1 1   13   11  -60 o   41.171   2.5024   70.595   8.3584   69.833   15.472   70.908   9.9327   39.802   4.8700   41.078   2.9868 -1.275494 5.712912 
1 1 1   13   11  -59 o   17.930   5.0426   14.483   7.6768   10.324   15.993   15.729   8.7510   17.880   7.1828   18.624   5.4311 -0.7439404 9.005006 
1 1 1   13   11  -58 f   16.950   5.0558   12.790   7.5125   16.102   15.747   11.814   8.5480   19.686   7.3327   16.530   5.4604 3.155985 9.142398 
1 1 1   13   11  -57 o   48.440   2.2283   97.099   8.7751   80.693   14.533  106.513   11.008   43.330   4.1659   50.571   2.6800 -7.240791 4.953527 
1 1 1   13   11  -56 o   38.791   2.7363   62.806   8.5966   70.681   17.077   60.133   9.9492   39.895   5.3887   37.765   3.2640 2.130577 6.300103 
1 1 1   13   11  -55 o   16.135   5.3506   11.067   8.2054   18.558   15.781   8.2917   9.6060   20.688   7.3961   15.213   5.7147 5.475030 9.346692 
1 1 1   13   11  -54 o   23.774   5.3716   25.488   10.163   38.560   13.949   10.693   14.839   29.043   6.0869   17.848   6.9989 11.19485 9.275472 
1 1 1   13   11  -53 o   38.420   3.1640   61.943   9.8210   48.969   12.407   83.712   16.071   33.556   4.6616   44.080   4.5375 -10.52350 6.505342 
1 1 1   13   11  -52 o   13.290   5.2141   5.0347   8.2395  -0.6823   11.068   12.142   12.340   12.863   5.6092   17.711   6.5104 -4.848578 8.593485 
1 1 1   13   11  -51 o   48.295   2.1537   96.197   8.4571   88.591   13.017  101.752   11.125   45.895   3.5060   49.485   2.7690 -3.589630 4.467583 
1 1 1   13   11  -50 o   55.685   1.9862  127.578   9.0013  114.271   13.695  137.700   11.943   52.291   3.2287   57.682   2.5464 -5.391361 4.112003 
1 1 1   13   11  -49 o   26.414   3.5806   29.656   7.5111   53.018   12.326   15.856   9.4733   35.146   4.3983   18.942   5.6839 16.20430 7.186893 
1 1 1   13   11  -48 o   9.5378   4.3487  -4.3019   7.4766   2.6699   13.932  -7.1217   8.8606   15.297   6.4739   9.8592   4.5805 5.437704 7.930473 
1 1 1   13   11  -47 o   24.006   4.2777   24.946   8.0639   29.955   14.648   22.768   9.6594   25.544   6.8814   22.619   5.3274 2.925442 8.702546 
1 1 1   13   11  -46 o   55.275   2.1662  125.767   9.7413  148.332   17.373  115.419   11.765   59.538   3.5964   52.791   2.7434 6.747101 4.523297 
1 1 1   13   11  -45 o   95.151   1.7201  370.892   13.341  383.251   22.153  363.860   16.711   96.268   2.8261   94.100   2.1786 2.168243 3.568349 
1 1 1   13   11  -44 o   25.068   4.2253   27.020   8.3274   7.2645   14.559   36.625   10.152   16.996   6.8444   29.220   4.3983 -12.22401 8.135811 
1 1 1   13   11  -43 o   12.071   5.0984   1.0633   8.6129  -7.7121   14.123   6.2598   10.868   13.055   5.9618   15.152   5.9749 -2.096201 8.440535 
1 1 1   13   11  -42 o   69.787   1.9063  199.745   10.834  176.022   17.822  213.652   13.645   65.073   3.3714   72.069   2.3258 -6.995567 4.095767 
1 1 1   13   11  -41 o   50.063   2.3473  103.198   9.5524   97.029   16.209  106.480   11.824   48.010   4.1836   50.728   2.8711 -2.717979 5.074039 
1 1 1   13   11  -40 o   25.122   4.4856   27.186   8.8486   13.618   18.037   31.486   10.154   20.194   7.7722   26.992   4.7906 -6.798296 9.129997 
1 1 1   13   11  -39 o   11.308   4.9446  -1.4192   8.6502   22.597   18.582  -8.0633   9.7737   23.233   8.0486   10.360   4.8124 12.87243 9.377530 
1 1 1   13   11  -38 o   69.004   2.0852  195.353   11.715  163.011   22.754  207.020   13.666   62.262   4.5140   70.970   2.3656 -8.707615 5.096276 
1 1 1   13   11  -37 o   15.309   5.7049   7.8829   9.5339   35.471   32.919   5.3570   9.9608   28.986   10.637   14.468   5.7155 14.51778 12.07506 
1 1 1   13   11  -36 o   64.566   2.1707  171.072   11.408  191.692   23.021  164.359   13.135   67.740   4.1897   63.202   2.5547 4.537476 4.907129 
1 1 1   13   11  -35 o   28.815   4.5589   35.448   10.352   19.946   18.715   42.283   12.427   22.509   8.0534   31.390   5.0262 -8.880527 9.493166 
1 1 1   13   11  -34 o   43.589   3.0376   78.617   10.725   73.956   15.365   83.047   14.978   41.870   4.5763   44.516   4.1764 -2.646034 6.195570 
1 1 1   13   11  -33 o   25.860   4.8653   28.811   9.8796   39.463   14.513   19.612   13.487   30.004   6.1409   21.479   6.8410 8.524946 9.192935 
1 1 1   13   11  -32 o   51.968   3.0612  111.542   12.910  106.464   16.252  120.227   21.255   50.538   3.9770   53.415   4.9375 -2.877239 6.340004 
1 1 1   13   11  -31 o   13.321   5.5197   2.3034   9.8075 -16.6351   14.046   20.322   13.700   11.554   5.4902   21.843   6.8873 -10.28823 8.807749 
1 1 1   13   11  -30 o   64.283   2.2640  169.489   11.845  183.754   17.733  157.995   15.917   66.713   3.2707   61.875   3.1663 4.838570 4.552277 
1 1 1   13   11  -29 o   51.689   2.5941  109.867   10.895  123.357   16.693   99.857   14.380   54.516   3.7799   49.061   3.6214 5.454948 5.234709 
1 1 1   13   11  -28 o   48.712   2.7774   97.718   10.983  105.995   16.678   91.381   14.593   50.445   4.0911   46.874   3.8532 3.570496 5.620001 
1 1 1   13   11  -27 o   96.661   1.9480  382.128   15.349  390.467   22.428  374.781   21.051   97.485   2.8254   95.537   2.7059 1.948044 3.912103 
1 1 1   13   11  -26 o   39.572   3.0697   64.731   9.8245   66.686   16.007   63.549   12.444   39.705   5.0607   39.024   3.9670 0.6812210 6.430277 
1 1 1   13   11  -25 o   93.981   1.8047  361.003   13.826  357.230   22.217  363.387   17.662   93.230   2.9270   94.208   2.3000 -0.9780426 3.722532 
1 1 1   13   11  -24 o   48.539   2.6237   96.864   10.342   87.262   16.791  102.734   13.128   45.652   4.5736   49.881   3.2465 -4.228745 5.608725 
1 1 1   13   11  -23 o   72.223   2.2381  213.682   13.160  194.975   25.226  220.677   15.426   68.436   4.5478   73.334   2.5845 -4.898476 5.230915 
1 1 1   13   11  -22 o   51.456   2.6300  108.800   10.995   99.274   18.961  113.627   13.496   48.664   4.8440   52.493   3.1687 -3.828636 5.788328 
1 1 1   13   11  -21 o   66.812   2.2233  182.854   12.091  186.911   20.807  180.785   14.858   67.227   3.8125   66.344   2.7534 0.8824539 4.702762 
1 1 1   13   11  -20 o   27.518   5.9635   32.874   12.990   27.641   17.741   38.922   19.072   25.361   7.8129   29.667   7.7889 -4.305445 11.03211 
1 1 1   13   11  -19 o   42.644   4.0593   75.703   13.940   55.393   18.824  100.371   20.745   35.725   6.7104   48.835   5.2960 -13.11029 8.548496 
1 1 1   13   11  -18 o  116.458   2.3349  555.042   22.165  558.033   30.869  551.860   31.846  116.502   3.2537  115.817   3.3768 0.6853943 4.689307 
1 1 1   13   11  -17 o   56.167   2.6095  129.503   11.915  144.400   21.198  122.624   14.405   58.932   4.4456   54.542   3.2549 4.389355 5.509777 
1 1 1   13   11  -16 o   36.907   3.6820   56.605   10.929   91.353   19.501   40.692   13.197   46.609   5.2226   30.837   5.4493 15.77148 7.547852 
1 1 1   13   11  -15 o   54.727   3.2593  123.428   14.474   0.0000   0.0000  123.428   14.474  ?   ?    54.727   3.2593 0.000000 3.259275 
1 1 1   13   11  -14 o  116.436   1.8741  553.935   17.787  579.614   31.397  541.799   21.585  118.767   3.2462  115.081   2.3010 3.685623 3.978976 
1 1 1   13   11  -13 o  137.805   1.8551  775.850   20.839  743.235   35.661  792.763   25.680  134.544   3.2516  139.217   2.2629 -4.673767 3.961506 
1 1 1   13   11  -12 o   80.565   2.1489  265.573   14.100  250.746   24.367  273.037   17.288   77.948   3.8469   81.617   2.6019 -3.669525 4.644173 
1 1 1   13   11  -11 o   51.709   3.0391  110.032   12.753  112.488   20.568  108.497   16.255   51.888   4.9216   51.182   3.9263 0.7065773 6.295862 
1 1 1   13   11  -10 o   31.628   4.2602   41.983   10.704   30.236   18.484   47.911   13.131   26.481   7.9379   33.674   4.9295 -7.193491 9.344011 
1 1 1   13   11   -9 o   44.551   3.0828   81.788   11.126   69.180   19.116   88.248   13.683   40.312   5.9999   46.184   3.6645 -5.872368 7.030433 
1 1 1   13   11   -8 o   61.706   2.4339  156.039   12.218  132.778   21.028  167.896   15.013   56.502   4.6054   63.942   2.8878 -7.439953 5.435894 
1 1 1   13   11   -7 o  111.944   1.8513  511.898   16.893  555.232   30.137  492.042   20.400  116.288   3.1822  109.688   2.2816 6.600922 3.915613 
1 1 1   13   11   -6 o  105.628   1.8830  455.789   16.213  502.656   28.928  434.325   19.576  110.637   3.2110  103.047   2.3305 7.589386 3.967584 
1 1 1   13   11   -5 f   43.579   3.1159   78.280   10.996   64.849   19.306   84.728   13.378   38.935   6.2980   45.255   3.6575 -6.319935 7.283019 
1 1 1   13   11   -4 o   65.955   2.2782  178.103   12.230  187.899   21.767  173.583   14.784   67.441   3.9772   65.038   2.7952 2.403725 4.861167 
1 1 1   13   11   -3 o   74.484   2.1380  226.965   12.967  212.541   22.536  234.104   15.855   71.768   3.8665   75.584   2.5771 -3.815338 4.646647 
1 1 1   13   11   -2 o   65.667   2.4895  176.701   13.302  232.618   29.785  162.770   14.867   74.817   4.9110   62.959   2.9046 11.85812 5.705683 
1 1 1   13   11   -1 o   35.183   3.9716   51.587   11.192   62.681   24.247   48.584   12.616   37.764   8.1182   33.984   4.6782 3.780418 9.369657 
1 1 1   13   11    0 o   29.183   4.7798   36.093   10.977   65.164   24.493   28.786   12.280   38.538   8.0566   25.786   5.9612 12.75132 10.02223 
1 1 1   13   11    1 o   77.665   2.2794  246.869   14.415  206.980   33.057  256.235   16.018   70.279   5.8225   79.094   2.4875 -8.815384 6.331647 
1 1 1   13   11    2 o   65.003   2.5323  173.183   13.392  159.832   30.833  176.287   14.868   61.571   6.2290   65.545   2.7891 -3.974171 6.824924 
1 1 1   13   11    3 o   79.855   2.2844  260.987   14.854  271.383   34.429  258.609   16.466   80.722   5.2609   79.450   2.5457 1.271896 5.844504 
1 1 1   13   11    4 o  127.684   1.8206  665.894   18.949  676.953   33.153  660.529   23.093  128.462   3.1660  127.101   2.2289 1.361710 3.871931 
1 1 1   13   11    5 f   83.483   2.0148  284.805   13.711  301.372   24.360  277.123   16.588   85.581   3.4993   82.258   2.4768 3.323479 4.287143 
1 1 1   13   11    6 o   35.281   3.7970   51.781   10.748   81.399   19.074   38.001   13.010   43.953   5.4396   29.781   5.5639 14.17272 7.781115 
1 1 1   13   11    7 o   92.880   1.9598  352.487   14.838  334.713   25.558  361.522   18.223   90.198   3.4827   93.977   2.3808 -3.778885 4.218692 
1 1 1   13   11    8 o   79.284   2.0896  257.113   13.493  236.463   23.346  267.471   16.534   75.717   3.7946   80.802   2.5133 -5.085136 4.551480 
1 1 1   13   11    9 o   20.787   5.9272   18.481   10.533   19.441   18.619   18.029   12.773   22.680   8.0415   20.881   6.6581 1.799150 10.44007 
1 1 1   13   11   10 o   78.389   2.1300  251.395   13.598  225.345   23.589  264.360   16.641   73.872   3.9314   80.322   2.5448 -6.450081 4.683180 
1 1 1   13   11   11 o   12.674   5.4911  -1.1978   10.464   1.7936   18.823  -2.5358   12.588   17.742   7.5177   13.586   5.9521 4.156451 9.588689 
1 1 1   13   11   12 o   68.609   2.3446  192.800   13.093  180.781   23.229  198.397   15.852   66.036   4.3394   69.526   2.8027 -3.489807 5.165818 
1 1 1   13   11   13 o   47.003   3.0863   91.024   11.760   70.241   20.861  100.703   14.237   40.444   6.5518   49.364   3.5621 -8.920429 7.457511 
1 1 1   13   11   14 o   66.791   2.3620  182.762   12.839  193.545   22.868  177.798   15.516   68.381   4.1217   65.790   2.9003 2.591370 5.039871 
1 1 1   13   11   15 o   60.397   2.5410  149.625   12.482  181.706   22.659  135.647   14.956   66.218   4.2197   57.391   3.2098 8.827976 5.301791 
1 1 1   13   11   16 o   96.717   2.1503  382.536   16.953  380.321   27.601  383.878   21.482   96.100   3.5294   96.750   2.7266 -0.6495590 4.459977 
1 1 1   13   11   17 o   59.882   2.5322  147.103   12.332  145.053   21.916  148.052   14.918   59.027   4.5909   59.986   3.0611 -0.9585075 5.517814 
1 1 1   13   11   18 o   64.344   2.6570  169.925   13.906  176.534   22.773  165.996   17.560   65.222   4.3075   63.452   3.4075 1.770008 5.492361 
1 1 1   13   11   19 o   38.904   4.5079   63.442   14.031   60.625   19.470   66.486   20.238   37.440   6.6218   39.271   6.5530 -1.830658 9.316108 
1 1 1   13   11   20 o   51.214   3.4948  108.411   14.503  117.067   20.380   99.531   20.642   52.920   4.7757   48.619   5.2939 4.301208 7.129725 
1 1 1   13   11   21 o   25.631   6.3876   28.699   13.297   29.444   18.310   27.868   19.343   26.075   7.9189   25.606   8.1966 0.4695835 11.39709 
1 1 1   13   11   22 o   81.503   1.8777  271.516   12.475  263.486   19.106  277.485   16.471   80.071   2.9321   82.274   2.4587 -2.202179 3.826598 
1 1 1   13   11   23 o   85.876   1.9708  301.542   13.796  281.339   23.619  312.004   16.997   82.587   3.5164   87.254   2.3919 -4.667145 4.252830 
1 1 1   13   11   24 o   11.150   4.9265  -2.5152   8.7946   4.1324   13.979  -6.8702   11.314   16.109   6.6238   11.729   5.3486 4.379073 8.513680 
1 1 1   13   11   25 o   30.953   3.7001   40.052   9.1511   26.379   14.410   49.293   11.847   24.576   6.9076   34.239   4.3422 -9.662897 8.158974 
1 1 1   13   11   26 o   18.669   5.3815   14.908   8.6372   17.779   13.937   13.118   11.005   20.898   6.9745   18.233   6.1981 2.665176 9.330584 
1 1 1   13   11   27 o   20.938   5.1532   19.008   8.7348   22.657   13.980   16.671   11.187   22.929   6.9102   19.901   6.2164 3.028038 9.294879 
1 1 1   13   11   28 o   75.056   2.0755  230.704   12.686  235.669   18.224  226.038   17.670   75.675   2.9601   74.117   2.9304 1.557686 4.165245 
1 1 1   13   11   29 o   75.910   1.8715  235.649   11.580  242.077   18.108  231.202   15.063   76.704   2.9014   75.058   2.4653 1.646233 3.807364 
1 1 1   13   11   30 o   95.270   1.7097  371.008   13.277  397.491   21.048  353.505   17.111   98.384   2.6269   92.895   2.2597 5.488388 3.465041 
1 1 1   13   11   31 o   29.683   3.6473   36.923   8.6396   61.686   14.109   22.067   10.928   38.227   4.6216   22.462   5.8951 15.76455 7.490768 
1 1 1   13   11   32 o   48.027   2.5795   94.941   10.061   86.847   14.936  101.666   13.614   45.592   4.0614   49.531   3.3923 -3.938370 5.291786 
1 1 1   13   11   33 o   24.956   5.0328   26.960   9.8842   39.489   13.709   13.393   14.265   30.115   5.7946   19.187   7.0082 10.92880 9.093523 
1 1 1   13   11   34 o   61.573   2.1408  155.513   10.729  162.499   16.052  149.872   14.424   62.713   3.1501   60.273   2.9446 2.439560 4.312077 
1 1 1   13   11   35 o   31.691   3.5462   42.031   9.0040   26.668   13.314   54.979   12.223   24.534   6.5392   36.119   4.2316 -11.58478 7.788944 
1 1 1   13   11   36 o   88.922   1.8061  323.555   13.092  356.115   24.085  309.901   15.597   92.850   3.1869   86.915   2.2033 5.935135 3.874401 
1 1 1   13   11   37 o   38.293   2.8976   60.733   8.9776   43.319   15.306   69.867   11.085   31.362   6.2069   40.983   3.3472 -9.621941 7.051907 
1 1 1   13   11   38 o   25.454   4.4864   27.841   8.9688   15.001   18.240   31.936   10.300   20.734   7.8557   27.210   4.8203 -6.475235 9.216690 
1 1 1   13   11   39 o   16.329   5.3518   10.958   8.2174   16.748   15.324   8.6213   9.7355   20.555   7.2946   15.685   5.7796 4.870736 9.306737 
1 1 1   13   11   40 o   46.659   2.4925   89.762   9.4455   96.117   16.673   86.758   11.462   47.750   4.3305   45.727   3.0933 2.022678 5.321839 
1 1 1   13   11   41 o   72.724   1.7805  216.562   10.555  199.178   15.960  230.075   14.071   69.444   2.8252   74.805   2.3104 -5.360687 3.649651 
1 1 1   13   11   42 o   62.141   1.9483  158.447   9.8565  161.037   15.430  156.661   12.811   62.347   3.0452   61.641   2.5552 0.7068939 3.975205 
1 1 1   13   11   43 o   54.002   2.1419  119.907   9.4101  124.339   14.530  116.705   12.350   54.677   3.2751   53.092   2.8642 1.584782 4.350841 
1 1 1   13   11   44 o   82.765   1.8564  280.780   12.524  288.694   17.831  273.073   17.596   83.650   2.6182   81.338   2.6575 2.311707 3.730563 
1 1 1   13   11   45 o   62.543   2.1347  160.867   10.867  162.774   15.797  159.154   14.973   62.603   3.1053   61.950   2.9737 0.6537590 4.299544 
1 1 1   13   11   46 o   49.921   2.6057  103.079   10.567  100.217   16.705  104.988   13.643   48.633   4.2566   50.143   3.3572 -1.509117 5.421214 
1 1 1   13   11   47 o   15.412   5.4993   9.0874   8.7205   11.351   14.114   7.6896   11.091   18.077   6.8959   15.700   6.0806 2.376813 9.193851 
1 1 1   13   11   48 o   11.545   4.9706  -0.0436   8.4679 -12.0113   13.564   7.5990   10.840   11.863   5.5624   15.546   6.0140 -3.682874 8.191944 
1 1 1   13   11   49 o   44.895   2.7033   83.651   9.8473  101.765   15.822   72.198   12.581   49.038   3.9926   41.340   3.7751 7.698109 5.494767 
1 1 1   13   11   50 o   18.191   5.5545   14.534   8.9920   22.807   14.956   9.8511   11.253   22.439   7.2098   16.535   6.1906 5.904398 9.502918 
1 1 1   13   11   51 o   19.475   5.3006   16.944   8.6380   19.859   13.947   15.129   11.002   21.130   6.9744   18.717   6.1954 2.412760 9.328761 
1 1 1   13   11   52 o   44.597   2.7225   82.695   9.8501   73.429   15.180   89.434   12.946   41.268   4.5901   46.107   3.4699 -4.839439 5.754061 
1 1 1   13   11   53 o   22.554   5.8371   23.176   10.813   27.579   17.912   20.651   13.564   24.237   7.8987   21.346   6.8668 2.891542 10.46625 
1 1 1   13   11   54 o   33.095   5.3815   48.708   14.020   52.800   18.031   42.453   22.293   33.707   6.7974   29.191   8.7098 4.515821 11.04837 
1 1 1   13   11   55 o   23.425   6.7620   25.674   13.628   42.861   17.882   1.8586   21.049   29.927   7.3778   17.650   7.7154 12.27694 10.67515 
1 1 1   13   11   56 o   41.837   3.3437   73.825   11.308   80.044   15.278   66.289   16.817   43.052   4.4160   38.550   5.5081 4.502094 7.059773 
1 1 1   13   11   57 o   12.975   5.2206   4.1911   8.4625   10.555   14.231   0.7094   10.526   17.514   6.8580   12.875   5.5424 4.638807 8.817608 
1 1 1   13   11   58 f   32.716   3.1866   45.235   8.3906   59.974   14.627   38.006   10.244   36.843   4.9991   29.490   4.3954 7.353865 6.656665 
1 1 1   13   11   59 o   31.414   3.3989   41.977   8.5652   46.955   16.507   40.143   10.020   31.581   6.6240   30.408   4.1505 1.173359 7.816923 
1 1 1   13   11   60 o   37.630   2.9155   59.474   8.8735   87.307   17.576   49.954   10.280   44.517   4.9259   34.131   3.7568 10.38524 6.194997 
1 1 1   13   11   61 o   37.188   2.9396   58.151   8.8385   66.329   16.791   55.016   10.395   38.341   5.5322   35.891   3.6018 2.449295 6.601380 
1 1 1   13   11   62 f   8.3710   3.9989  -9.4267   7.6592 -46.3830   15.630   2.2518   8.7864   9.0112   4.5447   12.348   5.1786 -3.336560 6.890023 
1 1 1   13   11   63 f   10.102   4.4910  -1.8260   7.4201  -0.7045   13.688  -2.2927   8.8301   13.953   6.1563   10.917   4.8733 3.036078 7.851711 
1 1 1   13   11   64 o   17.462   5.0736   13.846   7.6492   44.175   14.203   1.4557   9.0781   30.854   5.8616   12.200   5.1969 18.65387 7.833653 
1 1 1   13   11   65 o   38.283   2.7234   61.534   8.4431   49.386   15.221   66.933   10.147   32.538   5.9583   39.738   3.1586 -7.200340 6.743759 
1 1 1   13   11   66 o   22.799   4.2811   23.159   7.6641   26.648   14.262   21.742   9.0878   23.251   6.9733   21.687   5.2066 1.564028 8.702660 
1 1 1   13   11   67 o   32.235   3.1308   44.262   8.1230   34.858   14.835   48.289   9.7075   26.547   6.8198   33.447   3.6180 -6.900566 7.720068 
1 1 1   13   11   68 o   10.785   4.6261   0.7153   7.2839  -6.5527   14.003   3.4115   8.5286   12.668   5.8406   12.493   5.1591 0.1752739 7.792867 
1 1 1   13   11   69 o   15.234   5.3520   9.9810   8.2329   31.193   27.781   7.9388   8.6202   23.923   9.5150   14.365   5.4097 9.558869 10.94533 
1 1 1   13   11   70 o   17.280   5.1566   13.909   7.8137   7.0054   17.166   15.713   8.7755   16.683   7.1277   18.242   5.4698 -1.558655 8.984571 
1 1 1   13   11   71 o   14.027   5.0843   8.1158   7.4878   6.3094   16.787   8.5644   8.3662   16.317   7.0115   14.490   5.3545 1.827369 8.822192 
1 1 1   13   11   72 o   13.720   5.0578   7.6099   7.4570   7.9777   13.358   7.4434   8.9879   15.677   6.4636   14.129   5.4735 1.547621 8.469802 
1 1 1   13   11   73 o   17.640   5.0816   14.784   7.7037   14.598   13.600   14.872   9.3482   17.799   6.7739   17.593   5.7042 0.2060909 8.855769 
1 1 1   13   11   74 o   10.460   4.5424   0.3891   7.1950   6.9115   12.799  -2.6241   8.6996   15.043   6.2755   10.477   4.7428 4.566885 7.866148 
1 1 1   13   11   75 o   14.481   5.0249   9.3957   7.2444   2.3141   12.362   13.100   8.9406   13.547   5.9175   16.581   5.5867 -3.033683 8.138060 
1 1 1   13   11   76 o   9.5705   4.5360  -8.4741   9.4691 -10.6545   12.046  -4.9482   15.318   10.633   5.0613   13.096   6.0630 -2.463625 7.897904 
1 1 1   13   11   77 o   11.192   5.0144  -1.1328   9.4409   0.4156   12.184  -3.4588   14.934   12.868   5.7357   13.138   6.0480 -0.2699251 8.335226 
1 1 1   13   11   78 o   26.841   4.6915   34.027   9.8912   38.686   12.742   26.962   15.690   27.663   5.8347   21.631   7.3995 6.032412 9.423173 
1 1 1   13   11   79 o   25.031   5.0332   30.458   9.9134   17.516   12.536   52.065   16.197   18.204   6.5813   31.279   6.5623 -13.07531 9.293886 
1 1 1   13   11   80 o   11.737   5.1615   1.0795   9.5465  -0.2634   12.012   3.3824   15.730   12.464   5.6143   14.527   6.4930 -2.062275 8.583665 
1 1 1   13   11   81 o   13.773   5.5477   7.2978   9.5679   8.1617   12.219   5.9287   15.383   14.747   6.1401   14.931   6.5594 -0.1843138 8.984764 
1 1 1   13   11   82 o   16.288   5.9872   13.292   10.437   9.4599   12.354   22.847   19.507   15.142   6.2268   19.481   7.8946 -4.338636 10.05473 
1 1 1   13   11   83 o   17.608   6.0065   16.349   10.337   5.7232   12.195   43.469   19.483   13.957   5.9863   25.791   8.2230 -11.83419 10.17120 
1 1 1   13   11   84 o   20.382   5.9481   22.276   10.493   18.901   12.371   30.928   19.807   18.451   6.5535   21.481   8.1750 -3.029806 10.47756 
1 1 1   13   11   85 o   9.6871   4.6047  -8.0631   9.8991  -9.4836   11.641  -4.3538   18.811   10.345   4.9387   13.781   6.4896 -3.436020 8.155096 
1 1 1   13   11   86 o   16.044   6.0017   13.150   10.572   4.4131   12.387   36.588   20.288   13.523   5.9148   22.788   8.3523 -9.265325 10.23454 
1 1 1   13   11   87 o   18.538   6.5431   19.520   12.316   18.901   15.497   20.580   20.289   18.075   7.1326   18.473   7.8150 -0.3985233 10.58057 
1 1 1   13   11   88 o   12.650   5.6638   1.5933   12.024   9.3681   14.992 -12.4204   20.128   15.320   6.6049   13.002   6.2804 2.317966 9.114193 
1 1 1   13   11   89 o   21.038   6.6662   25.980   12.821   38.695   16.365   5.7759   20.629   24.791   7.4777   15.524   7.1323 9.267138 10.33369 
1 1 1   13   11   90 o   13.852   5.9874   6.1628   12.382   1.5303   15.772   13.606   19.992   13.708   6.2750   16.753   7.4136 -3.045124 9.712743 
1 1 1   13   11   91 o   13.366   5.8631   4.5627   12.250   9.3973   15.627  -3.1424   19.728   15.288   6.6660   13.922   6.5830 1.365963 9.368650 
1 1 1   13   11   92 o   22.462   6.6227   29.745   12.951   28.747   16.591   31.301   20.720   20.755   7.5615   20.606   8.2102 0.1484909 11.16169 
1 1 1   13   11   93 o   13.631   6.2076   2.5522   15.176   2.5522   15.176   0.0000   0.0000   13.631   6.2076  ?   ?  0.000000 6.207600 
1 1 1   13   11   94 o   12.547   5.8850  -3.2860   15.203  -3.2860   15.203   0.0000   0.0000   12.547   5.8850  ?   ?  0.000000 5.885026 
1 1 1   13   11   95 o   19.545   7.2829   24.954   15.537   24.954   15.537   0.0000   0.0000   19.545   7.2829  ?   ?  0.000000 7.282889 
1 1 1   13   11   96 o   12.525   5.8983  -4.1508   15.541  -4.1508   15.541   0.0000   0.0000   12.525   5.8983  ?   ?  0.000000 5.898283 
1 1 1   13   12  -92 o   19.980   8.2972   30.859   22.230   30.859   22.230   0.0000   0.0000   19.980   8.2972  ?   ?  0.000000 8.297218 
1 1 1   13   12  -91 o   16.075   7.3314   11.156   21.270   11.156   21.270   0.0000   0.0000   16.075   7.3314  ?   ?  0.000000 7.331402 
1 1 1   13   12  -90 o   28.703   8.9981   63.920   23.418   63.920   23.418   0.0000   0.0000   28.703   8.9981  ?   ?  0.000000 8.998110 
1 1 1   13   12  -89 o   19.708   8.1550   29.393   21.368   29.393   21.368   0.0000   0.0000   19.708   8.1550  ?   ?  0.000000 8.154986 
1 1 1   13   12  -88 o   18.318   7.9089   22.721   21.558   22.721   21.558   0.0000   0.0000   18.318   7.9089  ?   ?  0.000000 7.908902 
1 1 1   13   12  -87 o   20.490   7.3288   27.392   15.497   35.875   22.495   19.729   21.380   21.297   8.5313   17.807   7.7801 3.489958 11.54614 
1 1 1   13   12  -86 o   9.6602   4.7174 -15.2057   12.212  -5.6193   15.224 -32.5072   20.452   12.251   5.7900   11.120   5.5491 1.131403 8.019824 
1 1 1   13   12  -85 o   13.532   5.9510   4.7855   12.694   19.573   15.763 -22.4942   21.410   17.984   7.1624   12.237   6.0298 5.746925 9.362604 
1 1 1   13   12  -84 o   12.367   5.6569  -0.5828   12.783   0.1951   15.611  -2.1659   22.271   13.415   6.1783   14.632   6.9411 -1.217384 9.292475 
1 1 1   13   12  -83 o   16.510   6.4900   14.510   12.787   16.774   15.724   10.089   21.972   17.297   7.0587   16.392   7.4665 0.9051552 10.27493 
1 1 1   13   12  -82 o   17.510   6.5818   17.170   12.747   9.5720   15.650   32.142   21.969   15.466   6.7081   20.980   8.4219 -5.514198 10.76695 
1 1 1   13   12  -81 o   9.2691   4.5640 -18.8487   12.186 -15.0862   15.134 -25.7842   20.548   11.028   5.3551   11.819   5.8395 -0.7905483 7.923158 
1 1 1   13   12  -80 f   12.892   5.5695   4.0962   10.703   1.8520   12.366   10.801   21.373   12.873   5.7552   16.622   7.4879 -3.749545 9.444138 
1 1 1   13   12  -79 o   10.634   4.9541  -4.7746   10.479  -2.3212   12.415 -10.8533   19.542   12.009   5.5232   13.125   6.3011 -1.116056 8.379082 
1 1 1   13   12  -78 o   22.146   5.8614   26.018   10.745   14.863   12.354   60.672   21.774   16.877   6.4482   30.435   8.4682 -13.55826 10.64375 
1 1 1   13   12  -77 o   13.637   5.6836   6.3703   10.486   0.0087   12.235   23.964   20.347   12.506   5.6467   19.610   8.0194 -7.104127 9.807964 
1 1 1   13   12  -76 o   7.4175   3.7214 -24.5610   9.7827 -23.8699   11.262 -26.6857   19.748   8.3133   4.1437   11.649   5.7499 -3.335782 7.087432 
1 1 1   13   12  -75 o   24.938   5.5612   31.644   11.017   30.410   12.785   35.203   21.712   23.542   6.4654   22.622   8.5708 0.9195843 10.73594 
1 1 1   13   12  -74 o   25.509   5.1486   32.019   10.336   19.882   12.933   53.478   17.197   19.006   6.7055   31.071   6.9627 -12.06556 9.666536 
1 1 1   13   12  -73 o   12.742   5.4353   3.7282   9.9545  -2.9318   12.580   14.882   16.280   12.149   5.5773   17.489   7.1651 -5.339861 9.079922 
1 1 1   13   12  -72 o   22.176   4.7447   23.534   8.3175   13.545   12.419   31.659   11.201   16.778   6.4513   25.114   5.6127 -8.335318 8.551159 
1 1 1   13   12  -71 o   10.043   4.5527  -2.3822   8.0495 -10.8977   12.627   3.4477   10.448   10.826   5.1614   12.965   5.5504 -2.138803 7.579401 
1 1 1   13   12  -70 o   13.144   5.1319   6.4176   7.9500  -2.8503   12.251   13.159   10.449   12.196   5.5629   16.618   6.0085 -4.422915 8.188231 
1 1 1   13   12  -69 o   14.963   5.3078   10.095   8.1126   17.596   13.264   5.6126   10.254   18.647   6.7658   13.700   5.6573 4.947040 8.819379 
1 1 1   13   12  -68 o   38.312   2.9246   62.890   9.0646   61.916   14.640   63.495   11.544   36.326   5.0830   37.887   3.7885 -1.561371 6.339534 
1 1 1   13   12  -67 o   36.747   3.5003   58.945   10.358   50.357   27.977   60.309   11.151   27.373   9.8402   36.996   3.7492 -9.622953 10.53024 
1 1 1   13   12  -66 o   43.663   2.9361   81.326   10.390   70.655   20.517   85.006   12.049   37.075   7.0462   44.344   3.3582 -7.268761 7.805521 
1 1 1   13   12  -65 o   33.313   3.5529   48.358   9.4992   29.630   19.244   54.392   10.923   23.149   8.1783   35.139   3.8777 -11.98961 9.051084 
1 1 1   13   12  -64 o   13.683   5.3444   6.5519   8.6241   13.866   18.213   4.4381   9.7914   18.559   7.5881   13.345   5.5212 5.213690 9.384170 
1 1 1   13   12  -63 o   25.620   4.2115   29.365   8.4899   64.015   19.170   20.910   9.4692   35.905   6.7986   20.946   5.4829 14.95884 8.734047 
1 1 1   13   12  -62 o   21.052   4.9363   20.543   8.3230   25.965   18.442   19.156   9.3269   22.414   7.9973   20.092   5.5240 2.321999 9.719623 
1 1 1   13   12  -61 o   16.294   5.3488   11.963   8.2071   25.268   14.660   5.8905   9.9045   22.427   7.1311   14.032   5.6471 8.394918 9.096267 
1 1 1   13   12  -60 o   37.240   3.0553   58.863   9.1933   77.414   15.520   48.835   11.411   41.724   4.6415   33.251   4.3114 8.473595 6.334969 
1 1 1   13   12  -59 o   32.867   3.3184   46.181   8.7688   56.724   15.155   40.876   10.751   35.176   5.4626   30.333   4.4831 4.842981 7.066692 
1 1 1   13   12  -58 o   16.722   6.0851   11.706   10.740   7.4789   14.163   17.426   16.476   16.216   6.6676   19.856   7.4788 -3.639713 10.01939 
1 1 1   13   12  -57 o   21.705   5.9268   22.229   10.779   28.227   14.161   13.966   16.620   24.024   6.8801   18.858   7.4033 5.165951 10.10664 
1 1 1   13   12  -56 o   32.208   3.4465   44.361   8.9081   62.608   14.901   34.213   11.113   37.437   5.0085   27.455   5.1547 9.981997 7.187207 
1 1 1   13   12  -55 o   16.342   5.4704   11.626   8.5732   6.4948   14.058   14.665   10.818   16.011   6.6190   18.139   6.1452 -2.128176 9.031850 
1 1 1   13   12  -54 o   12.000   5.0227   2.1504   8.2404   3.2540   13.191   1.4441   10.553   14.776   6.2783   13.023   5.5768 1.752993 8.397483 
1 1 1   13   12  -53 o   26.197   4.0765   29.957   8.4219   34.480   12.492   26.189   11.403   27.317   5.7901   23.687   5.9220 3.630690 8.282284 
1 1 1   13   12  -52 o   45.647   2.4912   86.733   9.2345   89.996   13.538   83.895   12.628   45.964   3.6431   44.437   3.5149 1.527687 5.062314 
1 1 1   13   12  -51 o   9.2774   4.2638  -4.6621   7.3800   3.1841   11.707  -9.8368   9.5071   14.156   5.9598   9.6319   4.5591 4.524374 7.503613 
1 1 1   13   12  -50 o   27.482   3.5834   32.370   7.8365   30.891   12.440   33.343   10.090   25.790   6.0266   27.452   4.6765 -1.661875 7.628226 
1 1 1   13   12  -49 o   13.328   5.0829   5.9216   7.6670   13.531   12.091   0.8038   9.9156   18.018   6.4699   12.556   5.3918 5.462504 8.422066 
1 1 1   13   12  -48 o   69.582   2.0186  199.639   11.437  221.934   17.134  181.721   15.360   72.931   2.8878   65.997   2.8620 6.934158 4.065744 
1 1 1   13   12  -47 f   46.302   2.6034   89.179   9.7864  116.489   15.061   69.222   12.875   52.507   3.5396   40.222   3.9789 12.28483 5.325405 
1 1 1   13   12  -46 o   41.604   3.0289   72.530   10.202   62.524   17.938   77.314   12.403   37.085   6.1492   42.728   3.5943 -5.643089 7.122607 
1 1 1   13   12  -45 o   15.505   5.4762   9.6022   8.6277   13.400   16.701   8.2196   10.076   19.195   7.4542   15.368   5.8350 3.827811 9.466352 
1 1 1   13   12  -44 o   34.040   3.3572   48.913   9.1943   64.584   17.614   43.044   10.779   37.948   5.8846   31.564   4.3013 6.383472 7.289014 
1 1 1   13   12  -43 o   70.435   1.9672  204.146   11.283  195.649   18.930  208.830   14.053   68.302   3.4107   71.062   2.4296 -2.759468 4.187583 
1 1 1   13   12  -42 o   72.274   2.3254  215.669   13.682  170.396   23.836  237.914   16.708   62.998   4.6749   75.740   2.7106 -12.74190 5.403942 
1 1 1   13   12  -41 o   8.2960   4.0708 -18.0264   9.4306   19.991   33.770 -21.2419   9.8213   24.535   10.211   8.1389   4.0242 16.39625 10.97529 
1 1 1   13   12  -40 o   31.355   3.8335   41.861   9.5945   61.464   19.914   35.934   10.949   36.571   6.9337   28.647   4.8624 7.923725 8.468696 
1 1 1   13   12  -39 o   64.573   2.1384  171.723   11.240  189.175   20.821  164.545   13.353   67.029   3.8266   63.050   2.6037 3.979149 4.628411 
1 1 1   13   12  -38 o   23.583   4.6708   24.385   8.6612   21.707   15.152   25.686   10.556   22.070   7.2688   23.951   5.5200 -1.881090 9.127235 
1 1 1   13   12  -37 o   33.873   3.2757   48.150   8.9321   39.120   15.339   52.783   10.987   29.275   6.5875   35.281   3.8845 -6.006380 7.647502 
1 1 1   13   12  -36 o   33.117   3.6237   46.298   9.6227   58.325   15.535   38.810   12.257   36.529   5.3780   29.725   5.2505 6.804138 7.516064 
1 1 1   13   12  -35 o   25.666   4.2891   28.412   8.6570   39.299   14.950   22.919   10.619   29.482   6.4044   22.620   5.7479 6.861227 8.605471 
1 1 1   13   12  -34 f   38.667   2.8871   62.161   9.0344   77.286   15.682   54.647   11.053   42.543   4.5949   35.968   3.8286 6.574680 5.980885 
1 1 1   13   12  -33 o   29.411   4.0452   36.852   9.4415   61.693   20.436   30.111   10.646   36.886   7.0536   26.183   5.1714 10.70318 8.746222 
1 1 1   13   12  -32 o   62.923   2.2344  162.900   11.442  140.233   23.052  170.311   13.181   57.304   4.9846   64.258   2.5213 -6.954460 5.586006 
1 1 1   13   12  -31 o   17.151   5.5523   12.357   8.8590   0.6147   18.998   15.620   10.015   17.090   7.4017   18.995   5.8732 -1.904947 9.448796 
1 1 1   13   12  -30 o   15.361   5.3764   9.1279   8.3029  -1.0743   14.863   13.756   10.011   14.902   6.4994   18.090   5.9055 -3.187466 8.781695 
1 1 1   13   12  -29 o   33.601   3.3350   47.227   9.0140   54.267   15.789   43.822   10.979   35.253   5.6879   32.080   4.3073 3.173004 7.134784 
1 1 1   13   12  -28 o   53.060   2.3161  115.876   9.9932  114.452   16.616  116.683   12.508   52.258   3.9294   53.099   2.9009 -0.8402863 4.884179 
1 1 1   13   12  -27 o   84.334   2.0375  291.620   14.006  276.988   20.324  304.857   19.330   81.833   3.0521   85.969   2.7619 -4.135963 4.116243 
1 1 1   13   12  -26 o  122.539   1.9748  615.372   19.725  627.057   30.919  607.353   25.615  123.216   3.0784  121.500   2.5864 1.715340 4.020670 
1 1 1   13   12  -25 o   74.533   2.2726  228.231   13.791  217.102   20.936  236.762   18.330   72.271   3.5647   75.701   2.9762 -3.429123 4.643841 
1 1 1   13   12  -24 o   77.378   2.2588  245.906   14.232  258.276   21.952  236.936   18.692   78.916   3.4206   75.720   3.0346 3.196587 4.572658 
1 1 1   13   12  -23 o   92.207   2.0278  348.393   15.241  363.893   24.401  338.478   19.517   93.812   3.1956   90.679   2.6432 3.133301 4.147058 
1 1 1   13   12  -22 o   73.338   2.2281  220.800   13.304  232.180   21.402  213.633   16.985   74.808   3.5196   71.956   2.9017 2.851517 4.561539 
1 1 1   13   12  -21 o   88.455   2.0738  320.612   14.953  304.842   23.725  331.005   19.260   85.802   3.3989   89.692   2.6371 -3.889648 4.301988 
1 1 1   13   12  -20 o   66.732   2.3290  182.921   12.649  212.510   21.082  166.277   15.812   71.547   3.6266   63.437   3.0668 8.110458 4.749513 
1 1 1   13   12  -19 o   68.017   2.5409  190.280   14.063  178.182   28.862  194.046   16.104   64.734   5.5224   68.598   2.8863 -3.864449 6.231208 
1 1 1   13   12  -18 o   36.422   3.3259   55.210   9.7655   76.653   17.899   46.121   11.653   42.377   5.2969   32.981   4.4476 9.395496 6.916525 
1 1 1   13   12  -17 o   17.918   5.6163   13.516   9.1237   23.257   16.285   9.0597   11.015   23.282   7.5271   16.415   6.1290 6.866711 9.706803 
1 1 1   13   12  -16 o   58.383   2.3233  139.997   11.034  129.462   19.339  145.083   13.436   55.621   4.2989   59.337   2.7857 -3.716618 5.122513 
1 1 1   13   12  -15 o  124.009   1.7830  629.019   18.024  641.267   31.990  623.323   21.816  124.702   3.1496  123.341   2.1699 1.361168 3.824732 
1 1 1   13   12  -14 o  118.429   1.9331  574.006   18.661  580.497   30.163  569.980   23.753  118.664   3.1210  117.858   2.4724 0.8059769 3.981644 
1 1 1   13   12  -13 o   54.015   2.7049  120.157   11.872  108.428   18.759  127.992   15.333   50.809   4.5785   55.589   3.4000 -4.780308 5.702880 
1 1 1   13   12  -12 o   21.550   5.6845   20.285   10.128   19.305   15.973   20.944   13.097   21.793   7.4656   22.020   6.6995 -0.2268848 10.03091 
1 1 1   13   12  -11 o   38.946   3.4227   63.053   10.756   45.511   17.130   74.468   13.819   32.102   6.7603   42.190   4.0687 -10.08772 7.890218 
1 1 1   13   12  -10 o   31.773   3.7294   42.294   9.4755   43.169   16.501   41.863   11.574   31.279   6.6753   31.373   4.6676 -0.9445381E-01 8.145341 
1 1 1   13   12   -9 o   76.252   1.9977  238.128   12.406  244.795   21.506  234.803   15.188   76.952   3.4372   75.622   2.4672 1.330330 4.230989 
1 1 1   13   12   -8 o  104.356   1.8147  445.364   15.437  440.910   26.665  447.609   18.932  103.428   3.1665  104.530   2.2219 -1.102386 3.868287 
1 1 1   13   12   -7 f   31.216   3.8684   40.909   9.6330   28.601   17.101   46.630   11.659   25.508   7.6326   33.222   4.4144 -7.714098 8.817190 
1 1 1   13   12   -6 o   19.897   5.9240   16.979   10.321   33.457   23.952   13.221   11.438   27.748   9.1392   18.349   6.3164 9.399662 11.10954 
1 1 1   13   12   -5 o   68.245   2.3372  191.092   12.983  196.199   29.823  189.898   14.421   68.184   5.4100   67.976   2.6074 0.2082062 6.005594 
1 1 1   13   12   -4 f   89.751   2.0773  329.734   15.198  337.452   34.901  327.928   16.882   89.844   4.7827   89.428   2.3179 0.4167557 5.314769 
1 1 1   13   12   -3 o   67.968   2.1350  189.329   11.814  203.736   20.707  182.375   14.386   70.148   3.6336   66.606   2.6549 3.542458 4.500180 
1 1 1   13   12   -2 o   42.110   2.9489   73.248   10.058   54.087   17.298   83.035   12.363   35.281   6.2432   44.751   3.4149 -9.469505 7.116089 
1 1 1   13   12   -1 o   14.658   5.5097   6.8571   8.9321   16.513   15.964   2.4563   10.777   20.822   7.4393   13.925   5.7795 6.897424 9.420458 
1 1 1   13   12    0 o   45.966   2.7178   87.045   10.138   87.892   17.858   86.643   12.315   45.660   4.8732   45.738   3.3257 -0.7852554E-01 5.899840 
1 1 1   13   12    1 o   46.032   2.7354   87.308   10.218  102.284   17.965   80.146   12.423   49.404   4.5106   43.943   3.4969 5.460556 5.707387 
1 1 1   13   12    2 o   51.772   2.5149  110.190   10.582  125.546   18.748  103.011   12.819   54.859   4.2250   49.927   3.1660 4.932705 5.279639 
1 1 1   13   12    3 o   18.933   5.5622   15.352   9.1491  -0.8456   16.092   23.089   11.121   15.742   6.8149   22.973   5.9064 -7.231898 9.018181 
1 1 1   13   12    4 f   56.012   2.4141  128.857   10.996  166.364   19.954  112.496   13.178   63.296   3.8860   52.193   3.1116 11.10253 4.978281 
1 1 1   13   12    5 o   44.638   3.0938   82.377   11.188   87.877   24.302   80.898   12.603   44.942   6.8498   44.138   3.5322 0.8040047 7.706841 
1 1 1   13   12    6 o   81.236   2.1447  270.411   14.190  321.390   32.665  258.553   15.754   87.756   4.5822   79.371   2.4378 8.384659 5.190348 
1 1 1   13   12    7 f   74.559   2.2230  227.920   13.495  220.188   29.896  229.899   15.124   72.378   5.0999   74.828   2.4830 -2.450195 5.672256 
1 1 1   13   12    8 o   68.633   2.1129  193.052   11.806  222.549   21.101  179.608   14.245   73.339   3.5401   66.092   2.6495 7.246330 4.421776 
1 1 1   13   12    9 o   21.870   5.2496   20.828   9.2396   18.645   15.719   21.981   11.421   21.515   7.4049   22.416   6.0923 -0.9007702 9.588985 
1 1 1   13   12   10 o   13.811   5.4157   4.9606   8.8851  -8.0631   15.318   11.564   10.907   13.770   6.2573   17.462   6.1582 -3.692269 8.779341 
1 1 1   13   12   11 o   81.475   2.1442  272.066   14.228  267.010   22.420  275.475   18.410   80.367   3.4302   81.835   2.7638 -1.467613 4.405092 
1 1 1   13   12   12 o   38.331   3.5520   61.193   10.972   69.340   17.347   55.760   14.166   40.289   5.4193   36.213   4.9266 4.076263 7.323951 
1 1 1   13   12   13 o   64.511   2.6390  171.189   13.848  152.328   19.663  189.750   19.506   60.480   4.0111   67.679   3.5481 -7.199440 5.355221 
1 1 1   13   12   14 o   56.929   2.3903  133.157   11.068  152.782   19.785  124.218   13.353   60.556   4.0310   54.855   2.9976 5.701286 5.023395 
1 1 1   13   12   15 o   36.843   3.2683   56.410   9.7137   63.557   17.816   53.387   11.587   38.360   5.8854   35.646   4.0601 2.713398 7.149981 
1 1 1   13   12   16 o   50.692   2.5750  105.792   10.606   99.544   18.906  108.662   12.811   48.554   4.8413   51.268   3.0797 -2.713711 5.737840 
1 1 1   13   12   17 o   46.661   2.9858   90.012   11.297  102.239   18.854   83.163   14.111   49.231   4.7572   44.612   3.9201 4.618885 6.164309 
1 1 1   13   12   18 o   86.124   1.9270  303.638   13.528  365.258   25.160  278.577   16.045   94.013   3.2882   82.362   2.3925 11.65088 4.066457 
1 1 1   13   12   19 o   17.109   5.8583   11.580   9.8350   22.755   23.027   9.0863   10.877   24.217   8.8947   16.361   6.0942 7.855801 10.78215 
1 1 1   13   12   20 o   76.604   2.2104  240.799   13.788  223.388   22.774  250.875   17.324   73.285   3.8256   78.055   2.7270 -4.769875 4.698094 
1 1 1   13   12   21 o   35.397   3.6555   52.439   10.396   78.759   18.041   39.356   12.720   42.936   5.2649   30.128   5.3766 12.80781 7.525084 
1 1 1   13   12   22 o   43.400   3.0925   78.083   10.869   54.876   17.835   91.791   13.708   35.302   6.4350   46.936   3.6106 -11.63436 7.378746 
1 1 1   13   12   23 o   22.699   5.4230   22.636   9.8965   1.1468   16.310   35.158   12.450   16.202   6.9356   28.352   5.5859 -12.14990 8.905337 
1 1 1   13   12   24 o   75.064   2.4949  231.821   15.245  217.097   21.562  246.537   21.557   72.243   3.6736   77.092   3.4390 -4.848373 5.032106 
1 1 1   13   12   25 o   50.858   2.8409  106.911   11.731  119.764   18.677   98.539   15.075   53.361   4.3311   48.537   3.8415 4.824158 5.789289 
1 1 1   13   12   26 o   28.443   4.6399   34.762   10.387   34.366   16.409   35.028   13.417   27.538   7.2220   28.119   6.0344 -0.5806942 9.411262 
1 1 1   13   12   27 o   40.274   3.3931   67.659   11.036   90.182   17.902   53.855   14.015   46.037   4.8430   35.408   4.9944 10.62847 6.956923 
1 1 1   13   12   28 o   74.759   2.2405  229.691   13.638  237.204   21.638  224.740   17.566   75.517   3.5249   73.733   2.9285 1.784019 4.582698 
1 1 1   13   12   29 o   33.279   3.4545   46.422   9.2350   29.912   16.711   53.680   11.081   25.670   7.5108   35.693   3.8703 -10.02337 8.449353 
1 1 1   13   12   30 o   68.718   2.0672  193.915   11.566  196.770   21.482  192.749   13.725   68.591   3.8577   68.403   2.4656 0.1882858 4.578308 
1 1 1   13   12   31 o   65.712   2.2998  177.698   12.300  158.358   30.139  181.563   13.473   60.225   6.2291   66.367   2.4949 -6.142727 6.710137 
1 1 1   13   12   32 o   18.165   5.3757   14.361   8.5198   8.1277   15.572   17.025   10.178   17.636   7.0867   19.702   5.8869 -2.065474 9.212847 
1 1 1   13   12   33 o   37.134   2.9474   57.374   8.8484   80.465   15.682   46.588   10.718   43.485   4.4884   33.123   4.0538 10.36208 6.048044 
1 1 1   13   12   34 f   30.141   3.3551   38.196   8.1037   36.495   12.714   39.360   10.517   28.701   5.6354   30.286   4.3876 -1.584915 7.142074 
1 1 1   13   12   35 o   62.336   1.9405  159.607   9.8481  180.671   15.122  144.094   12.977   66.048   2.8152   59.009   2.7052 7.039520 3.904274 
1 1 1   13   12   36 o   18.251   5.3479   14.621   8.4671   7.9426   12.119   20.991   11.835   16.196   6.3326   21.623   6.3189 -5.426645 8.945968 
1 1 1   13   12   37 o   48.492   2.2733   97.005   8.9611   91.880   13.669  100.868   11.867   46.763   3.6138   49.244   2.9702 -2.480572 4.677783 
1 1 1   13   12   38 o   25.091   4.0393   27.088   7.9810   28.592   12.370   26.016   10.446   25.105   6.1043   24.131   5.4410 0.9744720 8.177212 
1 1 1   13   12   39 o   41.431   2.5789   71.178   8.6664   66.759   13.106   74.612   11.553   39.597   4.1206   42.165   3.3897 -2.568226 5.335690 
1 1 1   13   12   40 o   28.730   3.5811   35.035   8.2050   23.476   12.737   43.235   10.728   22.665   6.5355   31.720   4.2563 -9.054932 7.799263 
1 1 1   13   12   41 o   73.141   1.9327  219.948   11.513  192.000   18.992  236.184   14.476   67.686   3.4537   75.638   2.3507 -7.952019 4.177734 
1 1 1   13   12   42 o   37.663   3.1840   59.506   9.6838   79.354   19.845   53.303   11.094   42.192   5.9337   35.374   3.9129 6.818371 7.107688 
1 1 1   13   12   43 o   34.689   3.4476   50.829   9.6198   73.392   20.486   44.446   10.896   40.187   6.4736   32.116   4.2675 8.071411 7.753655 
1 1 1   13   12   44 o   36.111   3.4403   55.083   10.005   77.544   16.524   42.085   12.570   42.207   4.8935   30.826   5.1865 11.38082 7.130672 
1 1 1   13   12   45 o   16.046   5.5080   10.660   8.6953   29.486   17.421   4.4134   10.035   24.858   7.7562   13.885   5.6491 10.97335 9.595359 
1 1 1   13   12   46 o   55.700   2.5507  128.776   11.550  146.916   20.516  120.358   13.976   58.535   4.3305   53.560   3.2159 4.975166 5.393980 
1 1 1   13   12   47 f   59.470   2.4496  146.624   11.850  129.368   16.132  166.847   17.463   55.313   3.5973   62.951   3.4159 -7.638577 4.960759 
1 1 1   13   12   48 o   19.747   5.3132   17.680   8.7389   18.036   13.311   17.410   11.585   20.078   6.8166   19.643   6.3487 0.4357357 9.315148 
1 1 1   13   12   49 o   47.673   2.3861   94.301   9.2433  120.999   15.431   79.360   11.544   53.458   3.5614   43.374   3.2895 10.08434 4.848096 
1 1 1   13   12   50 o   25.424   4.1430   28.222   8.2909   19.166   14.058   33.051   10.266   20.536   7.0048   27.278   4.7919 -6.741989 8.486975 
1 1 1   13   12   51 o   39.522   2.8852   65.521   9.2311   76.304   15.722   59.847   11.404   41.737   4.7028   37.378   3.7954 4.359051 6.043310 
1 1 1   13   12   52 o   51.339   2.4243  109.533   10.117  123.480   18.469  103.554   12.092   53.466   4.2733   49.661   3.0011 3.804478 5.221849 
1 1 1   13   12   53 o   47.647   2.4653   94.473   9.5426  112.483   16.289   85.062   11.775   51.217   3.9315   44.869   3.2412 6.348560 5.095355 
1 1 1   13   12   54 o   54.513   2.2764  123.266   10.093  141.783   16.898  112.996   12.584   57.727   3.6091   51.861   2.9895 5.866383 4.686419 
1 1 1   13   12   55 o   67.069   1.9937  185.808   10.888  191.645   17.852  182.350   13.739   67.373   3.2603   66.161   2.5522 1.212051 4.140440 
1 1 1   13   12   56 o   31.342   3.4906   42.079   8.7666   47.187   15.002   39.430   10.803   31.831   6.0019   29.817   4.5919 2.014278 7.557030 
1 1 1   13   12   57 o   12.823   5.1032   4.6848   7.9961   8.2617   14.234   3.0356   9.6652   16.514   6.7248   13.024   5.4447 3.490064 8.652632 
1 1 1   13   12   58 o   15.960   5.7383   10.607   9.5145   19.409   13.978   3.0085   12.987   20.302   6.9831   14.504   6.1983 5.797971 9.337111 
1 1 1   13   12   59 o   23.685   5.0943   25.770   9.5434   24.330   14.142   26.974   12.932   22.250   6.9950   23.545   6.5166 -1.294138 9.560108 
1 1 1   13   12   60 o   16.984   5.1571   13.193   7.7657   25.938   14.465   8.0320   9.2047   22.811   7.0594   14.667   5.5750 8.144590 8.995346 
1 1 1   13   12   61 o   17.515   5.1647   14.185   7.8759   27.586   14.318   8.3710   9.4307   23.432   6.9776   14.846   5.6430 8.585847 8.973921 
1 1 1   13   12   62 o   12.434   5.2171   2.7909   8.9237   34.403   19.113  -6.0211   10.091   25.257   8.1537   10.648   4.9267 14.60808 9.526505 
1 1 1   13   12   63 o   25.750   4.3349   29.805   8.7760   35.742   19.241   28.246   9.8614   25.553   8.1745   24.645   5.0779 0.9085827 9.623288 
1 1 1   13   12   64 o   50.212   2.7356  106.494   11.155  101.452   21.758  108.292   12.992   46.194   5.9138   50.325   3.1833 -4.131203 6.716094 
1 1 1   13   12   65 o   30.122   4.0203   40.321   9.6253   52.975   19.659   36.331   11.039   31.398   7.7330   27.943   5.0313 3.454708 9.225741 
1 1 1   13   12   66 o   43.879   3.2283   82.884   11.466  100.514   21.161   75.557   13.642   45.821   5.7947   41.212   4.1160 4.609035 7.107735 
1 1 1   13   12   67 o   12.026   5.1955   1.5047   9.3143   17.559   17.816  -4.5338   10.926   19.140   7.6174   11.291   5.1888 7.849318 9.216710 
1 1 1   13   12   68 o   21.346   5.5720   22.429   9.7973  -6.1994   17.292   35.965   11.890   13.715   6.3809   27.214   5.5481 -13.49941 8.455643 
1 1 1   13   12   69 o   23.431   5.8223   27.468   11.071   9.0981   25.898   31.577   12.247   18.257   8.2316   24.968   6.0758 -6.711933 10.23108 
1 1 1   13   12   70 o   31.185   4.1762   44.168   10.349   45.542   18.020   43.492   12.642   28.386   7.6262   29.996   5.3675 -1.610443 9.325747 
1 1 1   13   12   71 o   16.884   5.4357   13.980   8.4981   6.5229   12.539   20.314   11.557   14.603   6.1591   19.679   6.3392 -5.076158 8.838520 
1 1 1   13   12   72 o   14.294   5.3300   8.9686   8.3244   10.337   12.610   7.9116   11.082   15.706   6.3537   14.549   5.9303 1.156309 8.691277 
1 1 1   13   12   73 o   10.423   4.9332  -8.3054   11.128 -21.8359   12.321   51.586   25.921   9.1369   4.5158   26.461   9.4767 -17.32446 10.49765 
1 1 1   13   12   74 o   13.223   6.0082  -0.3413   14.117   10.148   16.966 -23.9445   25.451   16.278   7.0221   13.661   6.7001 2.616913 9.705682 
1 1 1   13   12   75 o   10.909   5.1402  -7.2304   11.834  -7.2304   11.834   0.0000   0.0000   10.909   5.1402  ?   ?  0.000000 5.140165 
1 1 1   13   12   76 o   16.385   6.3837   13.288   12.280   13.288   12.280   0.0000   0.0000   16.385   6.3837  ?   ?  0.000000 6.383708 
1 1 1   13   12   77 o   10.777   5.0813  -7.1045   11.597  -7.1045   11.597   0.0000   0.0000   10.777   5.0813  ?   ?  0.000000 5.081297 
1 1 1   13   12   78 o   13.126   5.7970   2.8306   12.164   2.8306   12.164   0.0000   0.0000   13.126   5.7970  ?   ?  0.000000 5.797016 
1 1 1   13   12   79 o   22.685   6.4826   28.933   12.585   28.933   12.585   0.0000   0.0000   22.685   6.4826  ?   ?  0.000000 6.482592 
1 1 1   13   12   80 f   15.169   6.2055   10.292   12.189   9.0558   15.047   12.652   20.789   15.319   6.6108   16.890   7.5125 -1.570869 10.00703 
1 1 1   13   12   81 o   15.208   6.1809   10.643   11.997   5.6941   14.782   20.194   20.535   14.418   6.3779   18.327   7.8119 -3.908887 10.08482 
1 1 1   13   12   82 o   13.353   5.9057   3.6612   12.669   1.0274   16.090   7.9578   20.551   13.776   6.3182   15.915   7.2382 -2.138318 9.607828 
1 1 1   13   12   83 o   8.1857   4.1080 -28.1952   11.963 -28.2273   15.212 -28.1431   19.369   9.6560   4.8135   11.197   5.5564 -1.540637 7.351365 
1 1 1   13   12   84 o   10.191   4.9097 -11.2704   12.108   2.3745   15.342 -33.8030   19.715   13.752   6.2544   10.838   5.4146 2.914380 8.272517 
1 1 1   13   12   85 o   9.5718   4.6733 -15.0814   11.967 -18.1116   15.283 -10.2790   19.240   10.646   5.2152   12.871   6.1979 -2.225336 8.100084 
1 1 1   13   12   86 o   13.740   5.9551   6.0703   12.316   20.450   15.775 -16.3707   19.707   18.199   7.1918   12.305   6.0054 5.893960 9.369446 
1 1 1   13   12   87 o   13.656   5.9348   5.8969   12.300   4.2993   15.559   8.5593   20.085   14.071   6.3591   15.660   7.1351 -1.588389 9.557602 
1 1 1   13   12   88 o   19.069   6.5755   21.800   12.397   12.409   15.435   38.874   20.811   15.829   6.7607   22.451   8.4160 -6.621893 10.79520 
1 1 1   13   12   89 o   13.776   6.1637   4.8104   14.213   13.523   19.839  -4.3765   20.371   16.383   7.3095   13.709   6.5412 2.674632 9.809046 
1 1 1   13   12   90 o   11.991   5.8840 -18.3631   19.705 -18.3631   19.705   0.0000   0.0000   11.991   5.8840  ?   ?  0.000000 5.884049 
1 1 1   13   12   91 o   16.217   7.2834   12.620   20.050   12.620   20.050   0.0000   0.0000   16.217   7.2834  ?   ?  0.000000 7.283431 
1 1 1   13   12   92 o   18.587   7.9438   24.154   21.336   24.154   21.336   0.0000   0.0000   18.587   7.9438  ?   ?  0.000000 7.943823 
1 1 1   13   13    0 o   16.625   6.4635   7.6395   12.568 -11.0585   22.836   15.764   15.052   16.919   7.6693   20.422   7.2313 -3.502892 10.54088 
1 1 1   13   13    1 o   13.293   5.3592   3.8660   8.9371   17.366   16.236  -2.0023   10.705   20.847   7.4960   12.415   5.4624 8.431691 9.275146 
1 1 1   13   13    2 o   36.937   3.2880   56.993   9.7964   69.851   17.482   51.106   11.828   40.124   5.4886   34.667   4.2761 5.456573 6.957753 
1 1 1   13   13    3 o   8.9435   4.2765 -11.5121   8.8046   6.4666   16.050 -19.2510   10.530   17.356   7.1130   8.9143   4.3590 8.442084 8.342374 
1 1 1   13   13    4 o   54.052   2.7366  120.816   12.018  132.398   19.005  113.098   15.514   56.062   4.1891   51.988   3.6847 4.074451 5.579040 
1 1 1   13   13    5 o   95.197   2.0788  371.952   16.132  414.449   25.926  345.104   20.607   99.971   3.1855   91.410   2.7687 8.560936 4.220572 
1 1 1   13   13    6 o   49.502   3.1945  101.939   12.821  123.788   18.398   81.308   17.878   54.188   4.1978   43.473   5.1446 10.71521 6.639932 
1 1 1   13   13    7 o   48.984   2.8131   99.380   11.185  102.480   18.327   97.540   14.120   49.090   4.6349   48.278   3.6142 0.8117180 5.877470 
1 1 1   13   13    8 o   41.121   3.2606   70.543   10.840   61.320   17.485   76.301   13.816   37.334   5.9446   42.524   4.0339 -5.190704 7.184030 
1 1 1   13   13    9 o   53.297   2.6771  117.438   11.593  131.566   19.003  109.062   14.632   55.857   4.2045   51.086   3.5355 4.770523 5.493398 
1 1 1   13   13   10 o   79.067   2.1665  256.996   13.950  272.122   22.722  247.845   17.673   80.834   3.4563   77.422   2.8051 3.412148 4.451370 
1 1 1   13   13   11 o   58.023   2.5578  138.998   12.068  143.741   27.254  137.841   13.459   57.464   5.9023   57.684   2.8714 -0.2202339 6.563669 
1 1 1   13   13   12 o   59.699   2.4880  147.046   12.081  144.768   27.167  147.607   13.488   57.681   5.8592   59.724   2.7781 -2.042793 6.484440 
1 1 1   13   13   13 o   22.574   5.4521   22.655   9.9184   11.376   22.330   25.427   11.070   20.616   8.4123   23.851   5.7596 -3.235435 10.19508 
1 1 1   13   13   14 o   38.371   3.4322   61.706   10.622   61.707   23.949   61.706   11.852   36.186   8.2966   38.235   3.8552 -2.049126 9.148519 
1 1 1   13   13   15 o   14.418   5.4728   6.7629   8.8626   25.599   16.111  -1.4102   10.613   23.787   7.4644   12.489   5.4684 11.29779 9.253138 
1 1 1   13   13   16 o   69.693   2.2844  200.046   12.960  256.827   30.613  187.647   14.305   77.601   4.8641   67.390   2.6091 10.21151 5.519615 
1 1 1   13   13   17 o   34.755   3.6933   50.985   10.303   65.654   17.175   42.738   12.877   38.703   5.6071   31.241   5.2422 7.461943 7.675967 
1 1 1   13   13   18 o   44.995   2.8229   84.058   10.302   94.438   18.522   79.409   12.396   46.865   4.9217   43.505   3.5256 3.360432 6.054182 
1 1 1   13   13   19 f   20.100   5.4554   17.981   9.1650   18.463   16.768   17.775   10.945   21.164   7.6168   20.046   6.1293 1.118509 9.776770 
1 1 1   13   13   20 o   33.526   4.0579   47.878   10.864   82.678   17.946   27.746   13.650   43.688   5.1374   24.625   6.6466 19.06249 8.400597 
1 1 1   13   13   21 o   32.016   3.7265   43.443   9.5439   44.090   17.315   43.160   11.438   30.897   7.0335   31.614   4.5711 -0.7170963 8.388327 
1 1 1   13   13   22 o   17.009   5.6095   12.212   9.0226   36.873   16.773   2.1698   10.703   28.110   7.2669   13.563   5.7035 14.54775 9.237890 
1 1 1   13   13   23 o   41.379   3.2382   71.682   10.836  112.871   26.567   63.462   11.868   50.085   6.6732   38.722   3.8091 11.36331 7.683797 
1 1 1   13   13   24 o   37.510   3.4984   59.265   10.574   66.094   25.560   57.855   11.614   36.918   8.6464   36.907   3.9204 0.1126099E-01 9.493635 
1 1 1   13   13   25 o   63.550   2.3964  166.830   12.392  160.597   29.606  168.154   13.644   60.199   6.1183   63.715   2.6328 -3.515621 6.660682 
1 1 1   13   13   26 o   19.132   5.7660   16.267   9.7334   33.159   25.725   13.445   10.515   26.522   9.4473   17.858   6.0586 8.664103 11.22306 
1 1 1   13   13   27 o   16.388   5.5677   11.131   8.8805   19.295   16.077   7.5468   10.653   21.170   7.4755   15.386   5.9594 5.783945 9.560188 
1 1 1   13   13   28 o   25.157   4.4476   27.616   8.7869   28.270   14.826   27.262   10.910   24.618   7.0362   24.593   5.5715 0.2503395E-01 8.974913 
1 1 1   13   13   29 o   20.697   5.1730   19.201   8.7028   14.681   14.895   21.543   10.723   19.268   7.1402   21.766   5.8982 -2.498222 9.261259 
1 1 1   13   13   30 o   42.924   2.8287   76.796   9.8421   70.354   17.319   79.868   11.961   39.898   5.4691   43.569   3.3947 -3.670654 6.436982 
1 1 1   13   13   31 o   32.913   3.9903   46.394   10.487   51.313   16.955   43.346   13.347   33.446   6.4528   31.173   5.4509 2.273722 8.446934 
1 1 1   13   13   32 o   17.121   5.8559   12.333   9.8265   8.5823   16.221   14.507   12.351   17.648   7.1816   18.589   6.5532 -0.9415531 9.722129 
1 1 1   13   13   33 o   39.960   3.4155   67.399   11.019   65.420   18.186   68.547   13.850   38.023   6.0718   39.895   4.3282 -1.872402 7.456577 
1 1 1   13   13   34 o   45.461   3.0598   86.595   11.273   71.156   18.191   96.220   14.364   39.830   5.7709   47.625   3.7297 -7.794827 6.871212 
1 1 1   13   13   35 o   28.356   3.9660   34.675   8.9170   31.813   15.069   36.218   11.062   25.876   6.9833   28.592   4.9238 -2.716249 8.544602 
1 1 1   13   13   36 f   49.191   2.4900  100.488   9.9519  101.220   16.564  100.075   12.449   48.539   4.2286   48.822   3.1449 -0.2831650 5.269898 
1 1 1   13   13   37 o   15.433   5.5158   9.4888   8.7764   15.679   14.987   6.2583   10.827   19.424   7.1686   14.837   5.9271 4.586687 9.301528 
1 1 1   13   13   38 o   43.635   2.7374   79.506   9.6877   71.482   16.211   83.964   12.083   40.232   5.0543   44.586   3.3490 -4.353951 6.063133 
1 1 1   13   13   39 o   65.821   2.2506  179.314   12.058  178.734   18.351  179.754   15.995   65.035   3.4743   65.515   3.0031 -0.4797058 4.592319 
1 1 1   13   13   40 o   68.159   2.4152  192.783   13.397  194.994   18.585  190.391   19.331   67.984   3.3640   67.047   3.5497 0.9377136 4.890504 
1 1 1   13   13   41 o   12.700   5.2885   2.7611   9.0665   5.2820   14.585   1.1734   11.575   15.934   6.6767   13.488   5.8092 2.446031 8.850175 
1 1 1   13   13   42 f   21.037   5.1023   20.155   8.6586   30.459   14.733   14.718   10.702   25.099   6.9590   18.197   6.1122 6.901867 9.262094 
1 1 1   13   13   43 o   38.266   3.0674   61.762   9.4878   70.241   16.104   57.255   11.742   39.718   5.0910   36.397   4.0248 3.320435 6.489809 
1 1 1   13   13   44 o   16.897   5.4647   12.663   8.5828   24.085   15.210   7.3267   10.396   22.381   7.2776   14.959   5.8604 7.421877 9.343841 
1 1 1   13   13   45 o   38.554   3.0845   62.774   9.6127   78.958   16.994   55.159   11.657   42.112   5.0512   35.659   4.0839 6.452606 6.495599 
1 1 1   13   13   46 o   27.642   4.0499   33.367   8.8547   52.944   15.332   23.570   10.846   33.942   5.7464   22.413   5.8687 11.52842 8.213516 
1 1 1   13   13   47 o   38.845   2.9553   63.625   9.2878   67.263   15.996   61.775   11.408   38.660   5.2081   37.898   3.7415 0.7626762 6.412776 
1 1 1   13   13   48 o   14.870   5.3996   8.8388   8.4502   15.451   14.804   5.6431   10.292   18.970   7.1008   14.217   5.7441 4.752725 9.133263 
1 1 1   13   13   49 o   40.031   2.6990   67.272   8.7557   71.550   14.039   64.548   11.201   40.398   4.3306   38.784   3.5835 1.614468 5.621003 
1 1 1   13   13   50 o   24.871   4.1349   27.346   8.0888   26.737   12.955   27.735   10.355   23.428   6.5370   24.464   5.3427 -1.036007 8.442527 
1 1 1   13   13   51 o   25.655   4.0303   29.001   8.1508   28.761   12.809   29.164   10.566   24.326   6.3814   25.073   5.3339 -0.7463207 8.317041 
1 1 1   13   13   52 o   25.547   4.1367   28.935   8.3203   23.453   14.252   31.770   10.248   21.742   7.0427   26.366   4.9499 -4.624830 8.608187 
1 1 1   13   13   53 o   11.788   4.9366   2.3739   7.9664   10.398   14.073  -1.4101   9.6640   16.882   6.7528   11.544   5.1290 5.337642 8.479808 
1 1 1   13   13   54 o   32.097   3.8947   45.169   9.9816   39.408   17.625   47.889   12.111   27.375   7.6195   32.565   4.6981 -5.190454 8.951470 
1 1 1   13   13   55 o   15.244   5.7759   9.2537   9.8607  -4.6643   19.024   14.367   11.531   14.925   6.8543   17.702   6.3228 -2.776765 9.325190 
1 1 1   13   13   56 o   11.622   5.1345  -0.6237   9.5501 -17.4422   19.024   5.0426   11.042   13.025   6.2438   14.053   5.8428 -1.027373 8.551232 
1 1 1   13   13   57 f   7.4768   3.7269 -21.4980   9.1125 -32.5351   18.420 -17.9216   10.485   11.137   5.5076   8.7817   4.3058 2.355706 6.990956 
1 1 1   13   13   58 o   22.844   5.3398   25.012   9.7642   46.927   19.618   17.795   11.258   28.999   8.0265   18.988   6.2661 10.01125 10.18270 
1 1 1   13   13   59 o   13.188   5.4338   4.7814   9.4323   25.488   19.280  -1.7342   10.815   21.545   8.0955   11.894   5.3448 9.651319 9.700702 
1 1 1   13   13   60 o   14.738   5.6265   8.8886   9.4011   17.509   18.494   5.8848   10.917   19.110   7.7075   14.088   5.8292 5.022267 9.663588 
1 1 1   13   13   61 o   8.6523   4.1823 -11.8879   8.9646 -25.4360   17.789  -7.2760   10.379   11.400   5.5933   10.365   4.8619 1.034741 7.410997 
1 1 1   13   13   62 o   12.655   5.6558  -0.3112   11.931  -9.5328   16.904   8.8449   16.844   12.962   6.1186   16.448   7.0445 -3.485200 9.330716 
1 1 1   13   13   63 o   26.780   5.9708   36.245   12.701   23.487   17.923   49.115   18.002   20.470   7.7798   29.696   7.4501 -9.226219 10.77171 
1 1 1   13   13   64 o   18.498   5.6350   17.222   9.2615   13.038   17.294   18.905   10.967   17.360   7.2719   19.087   6.1775 -1.727291 9.541609 
1 1 1   13   13   65 f   33.168   3.7528   49.349   9.9683   46.931   18.627   50.320   11.800   28.133   7.8341   32.845   4.5277 -4.711752 9.048362 
1 1 1   13   13   66 o   17.913   5.7082   16.422   9.3893   8.3007   17.257   19.837   11.191   15.992   6.9885   19.293   6.2400 -3.300146 9.368929 
1 1 1   13   13   67 o   15.749   5.6837   12.102   9.3445   19.859   17.678   9.0941   11.008   18.797   7.5516   14.790   5.9529 4.007710 9.615861 
1 1 1   13   13   68 o   30.595   4.0408   43.054   9.8314   30.319   17.634   48.798   11.843   21.941   7.8210   32.010   4.6767 -10.06972 9.112608 
1 1 1   13   13   69 o   25.521   5.6057   33.370   11.342   24.811   27.122   35.184   12.487   19.710   8.6824   25.778   6.0473 -6.068359 10.58079 
1 1 1   13   13   70 o   35.448   4.9998   61.249   14.046   70.976   17.886   45.598   22.687   36.678   6.2035   25.066   8.8777 11.61138 10.83036 
1 1 1   13   13   71 o   13.603   5.9445   4.3405   12.485   5.1325   15.895   3.0647   20.175   14.707   6.5534   15.273   7.0304 -0.5661774 9.611161 
1 1 1   13   13   72 o   13.175   6.1344  -2.9689   16.031 -13.0416   24.962   4.1013   20.914   14.265   6.9153   15.527   7.1511 -1.262073 9.947847 
1 1 1   13   13   73 o   21.695   7.6678   30.404   16.918   8.2494   27.449   43.976   21.484   16.954   7.9379   24.644   8.6466 -7.690058 11.73773 
1 1 1   13   13   74 o   9.4606   4.7369 -32.1251   15.474 -20.8255   26.268 -38.1298   19.149   13.733   6.7499   10.392   5.2127 3.341089 8.528373 
1 1 1   13   13   75 o   13.452   6.2308  -0.8498   16.209   45.891   27.729 -25.1111   19.978   22.911   9.3647   11.664   5.7619 11.24759 10.99530 
1 1 1   13   13   76 o   23.404   7.8442   36.629   17.627   37.409   28.481   36.146   22.441   21.050   9.0896   21.789   8.5878 -0.7384548 12.50487 
1 1 1   13   13   77 o   15.639   6.8617   10.032   16.787 -13.3736   26.631   25.463   21.624   14.310   6.9833   19.239   8.0996 -4.928657 10.69439 
1 1 1   13   13   78 o   12.706   6.1878 -15.2766   20.613   0.0000   0.0000 -15.2766   20.613  ?   ?    12.706   6.1878 0.000000 6.187838 
1 1 1   13   13   79 o   16.058   7.3391   9.6458   21.458   0.0000   0.0000   9.6458   21.458  ?   ?    16.058   7.3391 0.000000 7.339062 
1 1 1   13   13   80 o   23.883   8.8094   45.730   22.628   0.0000   0.0000   45.730   22.628  ?   ?    23.883   8.8094 0.000000 8.809427 
1 1 1   13   13   81 o   21.879   8.5388   37.987   22.001   0.0000   0.0000   37.987   22.001  ?   ?    21.879   8.5388 0.000000 8.538781 
1 1 1   13   13   82 o   13.636   6.5115  -4.8804   20.263   0.0000   0.0000  -4.8804   20.263  ?   ?    13.636   6.5115 0.000000 6.511490 
1 1 1   13   13   83 o   14.488   6.8438   0.5989   21.219   0.0000   0.0000   0.5989   21.219  ?   ?    14.488   6.8438 0.000000 6.843847 
1 1 1   14    0 -122 o   9.0360   6.3216 -10.6139   17.312 -10.6139   17.312 -10.6139   17.312   9.0360   6.3216   9.0360   6.3216 0.000000 0.000000 
1 1 1   14    0 -121 o   9.9756   6.8190  -3.9021   17.426  -3.9021   17.426  -3.9021   17.426   9.9756   6.8190   9.9756   6.8190 0.000000 0.000000 
1 1 1   14    0 -120 f   6.9367   4.9814 -18.5117   13.509 -18.5117   13.509 -18.5117   13.509   6.9367   4.9814   6.9367   4.9814 0.000000 0.000000 
1 1 1   14    0 -119 o   17.156   9.3343   24.673   18.442   24.673   18.442   24.673   18.442   17.156   9.3343   17.156   9.3343 0.000000 0.000000 
1 1 1   14    0 -118 o   9.2829   6.2847  -2.7279   14.078  -2.7279   14.078  -2.7279   14.078   9.2829   6.2847   9.2829   6.2847 0.000000 0.000000 
1 1 1   14    0 -117 o   10.700   6.9099   3.9765   14.055   3.9765   14.055   3.9765   14.055   10.700   6.9099   10.700   6.9099 0.000000 0.000000 
1 1 1   14    0 -116 o   15.249   8.1804   17.712   13.974   17.712   13.974   17.712   13.974   15.249   8.1804   15.249   8.1804 0.000000 0.000000 
1 1 1   14    0 -115 o   12.032   7.3528   8.8993   13.695   8.8993   13.695   8.8993   13.695   12.032   7.3528   12.032   7.3528 0.000000 0.000000 
1 1 1   14    0 -114 o   9.1274   6.1663  -2.7842   13.411  -2.7842   13.411  -2.7842   13.411   9.1274   6.1663   9.1274   6.1663 0.000000 0.000000 
1 1 1   14    0 -113 o   10.545   6.7859   3.6075   13.399   3.6075   13.399   3.6075   13.399   10.545   6.7859   10.545   6.7859 0.000000 0.000000 
1 1 1   14    0 -112 o   20.709   8.2582   27.694   13.489   27.694   13.489   27.694   13.489   20.709   8.2582   20.709   8.2582 0.000000 0.000000 
1 1 1   14    0 -111 o   23.216   8.0771   32.305   13.806   32.305   13.806   32.305   13.806   23.216   8.0771   23.216   8.0771 0.000000 0.000000 
1 1 1   14    0 -110 o   8.3363   5.8258 -10.7755   14.590 -10.7755   14.590 -10.7755   14.590   8.3363   5.8258   8.3363   5.8258 0.000000 0.000000 
1 1 1   14    0 -109 o   11.387   7.2871   4.7045   15.187   4.7045   15.187   4.7045   15.187   11.387   7.2871   11.387   7.2871 0.000000 0.000000 
1 1 1   14    0 -108 o   9.7694   6.5224  -1.6321   14.210  -1.6321   14.210  -1.6321   14.210   9.7694   6.5224   9.7694   6.5224 0.000000 0.000000 
1 1 1   14    0 -107 o   12.036   7.1948   8.4689   12.527   8.4689   12.527   8.4689   12.527   12.036   7.1948   12.036   7.1948 0.000000 0.000000 
1 1 1   14    0 -106 o   16.811   8.1747   19.407   13.143   19.407   13.143   19.407   13.143   16.811   8.1747   16.811   8.1747 0.000000 0.000000 
1 1 1   14    0 -105 f   37.786   4.8808   63.805   14.344   63.805   14.344   63.805   14.344   37.786   4.8808   37.786   4.8808 0.000000 0.000000 
1 1 1   14    0 -104 o   28.428   6.5584   39.920   13.227   39.920   13.227   39.920   13.227   28.428   6.5584   28.428   6.5584 0.000000 0.000000 
1 1 1   14    0 -103 o   8.2176   5.6054  -5.5468   11.640  -5.5468   11.640  -5.5468   11.640   8.2176   5.6054   8.2176   5.6054 0.000000 0.000000 
1 1 1   14    0 -102 o   9.6876   6.3421  -0.1839   12.419  -0.1839   12.419  -0.1839   12.419   9.6876   6.3421   9.6876   6.3421 0.000000 0.000000 
1 1 1   14    0 -101 o   16.770   8.0594   18.464   12.727   18.464   12.727   18.464   12.727   16.770   8.0594   16.770   8.0594 0.000000 0.000000 
1 1 1   14    0 -100 f   74.481   2.9385  230.100   17.777  230.100   17.777  230.100   17.777   74.481   2.9385   74.481   2.9385 0.000000 0.000000 
1 1 1   14    0  -99 o   14.180   7.6137   12.957   12.115   12.957   12.115   12.957   12.115   14.180   7.6137   14.180   7.6137 0.000000 0.000000 
1 1 1   14    0  -98 o   12.026   7.0770   7.8508   11.778   7.8508   11.778   7.8508   11.778   12.026   7.0770   12.026   7.0770 0.000000 0.000000 
1 1 1   14    0  -97 o   30.975   5.5913   44.016   12.752   44.016   12.752   44.016   12.752   30.975   5.5913   30.975   5.5913 0.000000 0.000000 
1 1 1   14    0  -96 o   39.864   5.6125   70.785   17.199   70.785   17.199   70.785   17.199   39.864   5.6125   39.864   5.6125 0.000000 0.000000 
1 1 1   14    0  -95 o   10.836   6.8735   2.7522   13.157   2.7522   13.157   2.7522   13.157   10.836   6.8735   10.836   6.8735 0.000000 0.000000 
1 1 1   14    0  -94 o   24.152   7.9980   31.808   13.998   31.808   13.998   31.808   13.998   24.152   7.9980   24.152   7.9980 0.000000 0.000000 
1 1 1   14    0  -93 o   34.395   5.8075   53.593   14.889   53.593   14.889   53.593   14.889   34.395   5.8075   34.395   5.8075 0.000000 0.000000 
1 1 1   14    0  -92 o   14.603   7.6251   13.475   11.877   13.475   11.877   13.475   11.877   14.603   7.6251   14.603   7.6251 0.000000 0.000000 
1 1 1   14    0  -91 o   7.6706   5.3036  -8.4574   11.266  -8.4574   11.266  -8.4574   11.266   7.6706   5.3036   7.6706   5.3036 0.000000 0.000000 
1 1 1   14    0  -90 o   63.534   3.0960  167.063   15.947  167.063   15.947  167.063   15.947   63.534   3.0960   63.534   3.0960 0.000000 0.000000 
1 1 1   14    0  -89 o   8.0618   5.5273  -7.2811   11.641  -7.2811   11.641  -7.2811   11.641   8.0618   5.5273   8.0618   5.5273 0.000000 0.000000 
1 1 1   14    0  -88 o   43.081   4.0184   78.488   13.813   78.488   13.813   78.488   13.813   43.081   4.0184   43.081   4.0184 0.000000 0.000000 
1 1 1   14    0  -87 o   75.537   2.8156  234.800   17.282  234.800   17.282  234.800   17.282   75.537   2.8156   75.537   2.8156 0.000000 0.000000 
1 1 1   14    0  -86 o   42.133   4.1376   75.185   13.874   75.185   13.874   75.185   13.874   42.133   4.1376   42.133   4.1376 0.000000 0.000000 
1 1 1   14    0  -85 o   44.128   3.9754   82.002   14.020   82.002   14.020   82.002   14.020   44.128   3.9754   44.128   3.9754 0.000000 0.000000 
1 1 1   14    0  -84 o   15.127   8.6484   12.818   16.808   12.818   16.808   12.818   16.808   15.127   8.6484   15.127   8.6484 0.000000 0.000000 
1 1 1   14    0  -83 o  115.772   3.2052  550.349   30.195  550.349   30.195  550.349   30.195  115.772   3.2052  115.772   3.2052 0.000000 0.000000 
1 1 1   14    0  -82 o   39.842   6.0637   69.991   18.343   69.991   18.343   69.991   18.343   39.842   6.0637   39.842   6.0637 0.000000 0.000000 
1 1 1   14    0  -81 o   13.802   8.3870   7.7479   17.598   7.7479   17.598   7.7479   17.598   13.802   8.3870   13.802   8.3870 0.000000 0.000000 
1 1 1   14    0  -80 o   52.907   4.8290  117.909   20.406  117.909   20.406  117.909   20.406   52.907   4.8290   52.907   4.8290 0.000000 0.000000 
1 1 1   14    0  -79 o   54.483   1.8730  121.566   8.2960  121.566   8.2960  121.566   8.2960   54.483   1.8730   54.483   1.8730 0.000000 0.000000 
1 1 1   14    0  -78 o   68.840   1.8683  193.798   10.466  193.798   10.466  193.798   10.466   68.840   1.8683   68.840   1.8683 0.000000 0.000000 
1 1 1   14    0  -77 o   16.138   6.7271   15.095   8.8409   15.095   8.8409   15.095   8.8409   16.138   6.7271   16.138   6.7271 0.000000 0.000000 
1 1 1   14    0  -76 o   9.7521   6.0294   2.8918   9.4610   2.8918   9.4610   2.8918   9.4610   9.7521   6.0294   9.7521   6.0294 0.000000 0.000000 
1 1 1   14    0  -75 o   46.122   3.0655   88.059   11.407   88.059   11.407   88.059   11.407   46.122   3.0655   46.122   3.0655 0.000000 0.000000 
1 1 1   14    0  -74 o   10.308   6.0391   5.1391   8.5120   5.1391   8.5120   5.1391   8.5120   10.308   6.0391   10.308   6.0391 0.000000 0.000000 
1 1 1   14    0  -73 o   9.5328   5.9095   2.6072   9.1472   2.6072   9.1472   2.6072   9.1472   9.5328   5.9095   9.5328   5.9095 0.000000 0.000000 
1 1 1   14    0  -72 o   72.156   3.1355  213.863   18.363  213.863   18.363  213.863   18.363   72.156   3.1355   72.156   3.1355 0.000000 0.000000 
1 1 1   14    0  -71 o  105.081   2.6882  451.605   22.993  451.605   22.993  451.605   22.993  105.081   2.6882  105.081   2.6882 0.000000 0.000000 
1 1 1   14    0  -70 o  192.236   3.2518  1510.60   50.923  1510.60   50.923  1510.60   50.923  192.236   3.2518  192.236   3.2518 0.000000 0.000000 
1 1 1   14    0  -69 o   53.991   2.8134  119.948   12.305  119.948   12.305  119.948   12.305   53.991   2.8134   53.991   2.8134 0.000000 0.000000 
1 1 1   14    0  -68 o   39.333   3.3917   64.578   10.681   64.578   10.681   64.578   10.681   39.333   3.3917   39.333   3.3917 0.000000 0.000000 
1 1 1   14    0  -67 o   50.561   2.8663  105.337   11.726  105.337   11.726  105.337   11.726   50.561   2.8663   50.561   2.8663 0.000000 0.000000 
1 1 1   14    0  -66 o   28.503   4.6307   35.721   9.9073   35.721   9.9073   35.721   9.9073   28.503   4.6307   28.503   4.6307 0.000000 0.000000 
1 1 1   14    0  -65 o   86.944   2.1745  308.894   15.389  308.894   15.389  308.894   15.389   86.944   2.1745   86.944   2.1745 0.000000 0.000000 
1 1 1   14    0  -64 o   86.818   2.4392  308.191   17.232  308.191   17.232  308.191   17.232   86.818   2.4392   86.818   2.4392 0.000000 0.000000 
1 1 1   14    0  -63 o  155.804   2.4138  990.885   30.639  990.885   30.639  990.885   30.639  155.804   2.4138  155.804   2.4138 0.000000 0.000000 
1 1 1   14    0  -62 o   16.956   7.0951   16.601   9.8265   16.601   9.8265   16.601   9.8265   16.956   7.0951   16.956   7.0951 0.000000 0.000000 
1 1 1   14    0  -61 o   17.035   6.9894   16.616   9.5801   16.616   9.5801   16.616   9.5801   17.035   6.9894   17.035   6.9894 0.000000 0.000000 
1 1 1   14    0  -60 o   11.141   6.4341   6.2946   9.4426   6.2946   9.4426   6.2946   9.4426   11.141   6.4341   11.141   6.4341 0.000000 0.000000 
1 1 1   14    0  -59 o  108.661   2.2854  482.155   20.222  482.155   20.222  482.155   20.222  108.661   2.2854  108.661   2.2854 0.000000 0.000000 
1 1 1   14    0  -58 o  112.083   2.7031  513.306   24.664  513.306   24.664  513.306   24.664  112.083   2.7031  112.083   2.7031 0.000000 0.000000 
1 1 1   14    0  -57 o  160.271   2.4441  1048.28   31.914  1048.28   31.914  1048.28   31.914  160.271   2.4441  160.271   2.4441 0.000000 0.000000 
1 1 1   14    0  -56 o  304.113   3.3599  3774.91   83.268  3774.91   83.268  3774.91   83.268  304.113   3.3599  304.113   3.3599 0.000000 0.000000 
1 1 1   14    0  -55 o  218.852   2.4598  1953.98   43.869  1953.98   43.869  1953.98   43.869  218.852   2.4598  218.852   2.4598 0.000000 0.000000 
1 1 1   14    0  -54 o   44.756   3.5642   83.279   12.808   83.279   12.808   83.279   12.808   44.756   3.5642   44.756   3.5642 0.000000 0.000000 
1 1 1   14    0  -53 o   9.5991   6.1996  -0.2567   11.319  -0.2567   11.319  -0.2567   11.319   9.5991   6.1996   9.5991   6.1996 0.000000 0.000000 
1 1 1   14    0  -52 o   78.351   2.4212  251.050   15.430  251.050   15.430  251.050   15.430   78.351   2.4212   78.351   2.4212 0.000000 0.000000 
1 1 1   14    0  -51 o  145.012   2.6007  858.385   30.720  858.385   30.720  858.385   30.720  145.012   2.6007  145.012   2.6007 0.000000 0.000000 
1 1 1   14    0  -50 o  116.655   2.1065  555.388   20.016  555.388   20.016  555.388   20.016  116.655   2.1065  116.655   2.1065 0.000000 0.000000 
1 1 1   14    0  -49 o   16.361   7.3669   15.851   10.524   15.851   10.524   15.851   10.524   16.361   7.3669   16.361   7.3669 0.000000 0.000000 
1 1 1   14    0  -48 o  247.081   2.5476  2490.25   51.297  2490.25   51.297  2490.25   51.297  247.081   2.5476  247.081   2.5476 0.000000 0.000000 
1 1 1   14    0  -47 o  181.878   2.2168  1349.34   32.854  1349.34   32.854  1349.34   32.854  181.878   2.2168  181.878   2.2168 0.000000 0.000000 
1 1 1   14    0  -46 o  112.146   2.1098  513.309   19.272  513.309   19.272  513.309   19.272  112.146   2.1098  112.146   2.1098 0.000000 0.000000 
1 1 1   14    0  -45 o  360.644   3.2988  5306.61   96.961  5306.61   96.961  5306.61   96.961  360.644   3.2988  360.644   3.2988 0.000000 0.000000 
1 1 1   14    0  -44 o   83.356   2.2276  283.896   15.112  283.896   15.112  283.896   15.112   83.356   2.2276   83.356   2.2276 0.000000 0.000000 
1 1 1   14    0  -43 o  110.858   1.8145  501.409   16.387  501.409   16.387  501.409   16.387  110.858   1.8145  110.858   1.8145 0.000000 0.000000 
1 1 1   14    0  -42 o  353.951   3.2266  5111.05   93.076  5111.05   93.076  5111.05   93.076  353.951   3.2266  353.951   3.2266 0.000000 0.000000 
1 1 1   14    0  -41 f   51.597   2.3905  109.246   10.005  109.246   10.005  109.246   10.005   51.597   2.3905   51.597   2.3905 0.000000 0.000000 
1 1 1   14    0  -40 o  150.156   1.8244  919.557   22.323  919.557   22.323  919.557   22.323  150.156   1.8244  150.156   1.8244 0.000000 0.000000 
1 1 1   14    0  -39 o  215.540   2.0749  1894.53   36.448  1894.53   36.448  1894.53   36.448  215.540   2.0749  215.540   2.0749 0.000000 0.000000 
1 1 1   14    0  -38 o   52.144   2.3655  111.542   10.007  111.542   10.007  111.542   10.007   52.144   2.3655   52.144   2.3655 0.000000 0.000000 
1 1 1   14    0  -37 o   62.024   2.1360  157.396   10.770  157.396   10.770  157.396   10.770   62.024   2.1360   62.024   2.1360 0.000000 0.000000 
1 1 1   14    0  -36 o   10.614   6.1698   5.5448   8.7711   5.5448   8.7711   5.5448   8.7711   10.614   6.1698   10.614   6.1698 0.000000 0.000000 
1 1 1   14    0  -35 o  303.408   3.3363  3755.82   82.491  3755.82   82.491  3755.82   82.491  303.408   3.3363  303.408   3.3363 0.000000 0.000000 
1 1 1   14    0  -34 o  104.383   2.3697  444.916   20.140  444.916   20.140  444.916   20.140  104.383   2.3697  104.383   2.3697 0.000000 0.000000 
1 1 1   14    0  -33 o  348.669   3.6942  4960.43  104.969  4960.43  104.969  4960.43  104.969  348.669   3.6942  348.669   3.6942 0.000000 0.000000 
1 1 1   14    0  -32 o   48.698   2.9373   97.755   11.562   97.755   11.562   97.755   11.562   48.698   2.9373   48.698   2.9373 0.000000 0.000000 
1 1 1   14    0  -31 o   81.180   2.2059  269.266   14.573  269.266   14.573  269.266   14.573   81.180   2.2059   81.180   2.2059 0.000000 0.000000 
1 1 1   14    0  -30 o  251.007   2.2662  2569.25   46.360  2569.25   46.360  2569.25   46.360  251.007   2.2662  251.007   2.2662 0.000000 0.000000 
1 1 1   14    0  -29 o  264.938   2.3524  2862.38   50.794  2862.38   50.794  2862.38   50.794  264.938   2.3524  264.938   2.3524 0.000000 0.000000 
1 1 1   14    0  -28 o  303.346   2.5724  3752.55   63.598  3752.55   63.598  3752.55   63.598  303.346   2.5724  303.346   2.5724 0.000000 0.000000 
1 1 1   14    0  -27 o  176.691   1.9130  1273.12   27.545  1273.12   27.545  1273.12   27.545  176.691   1.9130  176.691   1.9130 0.000000 0.000000 
1 1 1   14    0  -26 o   32.733   3.4907   45.166   9.0475   45.166   9.0475   45.166   9.0475   32.733   3.4907   32.733   3.4907 0.000000 0.000000 
1 1 1   14    0  -25 o  163.438   1.8674  1089.32   24.871  1089.32   24.871  1089.32   24.871  163.438   1.8674  163.438   1.8674 0.000000 0.000000 
1 1 1   14    0  -24 o   73.724   1.9751  222.042   11.850  222.042   11.850  222.042   11.850   73.724   1.9751   73.724   1.9751 0.000000 0.000000 
1 1 1   14    0  -23 o  278.289   2.4209  3158.04   54.907  3158.04   54.907  3158.04   54.907  278.289   2.4209  278.289   2.4209 0.000000 0.000000 
1 1 1   14    0  -22 o   30.374   3.8225   39.374   9.0579   39.374   9.0579   39.374   9.0579   30.374   3.8225   30.374   3.8225 0.000000 0.000000 
1 1 1   14    0  -21 o  221.892   2.1149  2007.69   38.245  2007.69   38.245  2007.69   38.245  221.892   2.1149  221.892   2.1149 0.000000 0.000000 
1 1 1   14    0  -20 o   75.537   2.2078  233.199   13.568  233.199   13.568  233.199   13.568   75.537   2.2078   75.537   2.2078 0.000000 0.000000 
1 1 1   14    0  -19 o  284.948   2.7490  3311.33   63.839  3311.33   63.839  3311.33   63.839  284.948   2.7490  284.948   2.7490 0.000000 0.000000 
1 1 1   14    0  -18 o   19.994   7.0617   21.440   10.455   21.440   10.455   21.440   10.455   19.994   7.0617   19.994   7.0617 0.000000 0.000000 
1 1 1   14    0  -17 o  244.958   2.8371  2447.41   56.634  2447.41   56.634  2447.41   56.634  244.958   2.8371  244.958   2.8371 0.000000 0.000000 
1 1 1   14    0  -16 o   74.716   2.4207  228.297   14.708  228.297   14.708  228.297   14.708   74.716   2.4207   74.716   2.4207 0.000000 0.000000 
1 1 1   14    0  -15 o   35.396   3.9654   52.989   11.073   52.989   11.073   52.989   11.073   35.396   3.9654   35.396   3.9654 0.000000 0.000000 
1 1 1   14    0  -14 o  219.983   2.6712  1973.78   47.884  1973.78   47.884  1973.78   47.884  219.983   2.6712  219.983   2.6712 0.000000 0.000000 
1 1 1   14    0  -13 o  319.572   3.4150  4165.67   88.937  4165.67   88.937  4165.67   88.937  319.572   3.4150  319.572   3.4150 0.000000 0.000000 
1 1 1   14    0  -12 o  350.504   3.6812  5011.38  105.151  5011.38  105.151  5011.38  105.151  350.504   3.6812  350.504   3.6812 0.000000 0.000000 
1 1 1   14    0  -11 o  241.900   3.4832  2387.50   68.651  2387.50   68.651  2387.50   68.651  241.900   3.4832  241.900   3.4832 0.000000 0.000000 
1 1 1   14    0  -10 o   10.247   6.6979  -1.7986   13.771  -1.7986   13.771  -1.7986   13.771   10.247   6.6979   10.247   6.6979 0.000000 0.000000 
1 1 1   14    0   -9 o  399.891   5.0270  6526.62  163.808  6526.62  163.808  6526.62  163.808  399.891   5.0270  399.891   5.0270 0.000000 0.000000 
1 1 1   14    0   -8 o  324.164   4.2530  4287.83  112.338  4287.83  112.338  4287.83  112.338  324.164   4.2530  324.164   4.2530 0.000000 0.000000 
1 1 1   14    0   -7 o  179.939   2.9306  1321.08   42.960  1321.08   42.960  1321.08   42.960  179.939   2.9306  179.939   2.9306 0.000000 0.000000 
1 1 1   14    0   -6 o   18.266   7.3555   18.902   10.667   18.902   10.667   18.902   10.667   18.266   7.3555   18.266   7.3555 0.000000 0.000000 
1 1 1   14    0   -5 o  182.379   2.4508  1356.70   36.421  1356.70   36.421  1356.70   36.421  182.379   2.4508  182.379   2.4508 0.000000 0.000000 
1 1 1   14    0   -4 o  390.442   4.0145  6218.64  127.738  6218.64  127.738  6218.64  127.738  390.442   4.0145  390.442   4.0145 0.000000 0.000000 
1 1 1   14    0   -3 o   11.901   7.1170   5.9699   12.268   5.9699   12.268   5.9699   12.268   11.901   7.1170   11.901   7.1170 0.000000 0.000000 
1 1 1   14    0   -2 o  487.838   4.8653  9710.33  193.429  9710.33  193.429  9710.33  193.429  487.838   4.8653  487.838   4.8653 0.000000 0.000000 
1 1 1   14    0   -1 o  431.634   4.3717  7600.66  153.781  7600.66  153.781  7600.66  153.781  431.634   4.3717  431.634   4.3717 0.000000 0.000000 
1 1 1   14    0    0 o  110.450   2.7103  498.223   24.368  498.223   24.368  498.223   24.368  110.450   2.7103  110.450   2.7103 0.000000 0.000000 
1 1 1   14    0    1 o   11.827   7.0932   5.7727   12.253   5.7727   12.253   5.7727   12.253   11.827   7.0932   11.827   7.0932 0.000000 0.000000 
1 1 1   14    0    2 o   13.762   7.2548   11.167   10.829   11.167   10.829   11.167   10.829   13.762   7.2548   13.762   7.2548 0.000000 0.000000 
1 1 1   14    0    3 o  156.624   2.3539  1000.69   30.037  1000.69   30.037  1000.69   30.037  156.624   2.3539  156.624   2.3539 0.000000 0.000000 
1 1 1   14    0    4 o  230.517   2.7651  2167.27   51.940  2167.27   51.940  2167.27   51.940  230.517   2.7651  230.517   2.7651 0.000000 0.000000 
1 1 1   14    0    5 o  293.853   3.9817  3523.25   95.336  3523.25   95.336  3523.25   95.336  293.853   3.9817  293.853   3.9817 0.000000 0.000000 
1 1 1   14    0    6 o  316.702   4.2000  4092.63  108.383  4092.63  108.383  4092.63  108.383  316.702   4.2000  316.702   4.2000 0.000000 0.000000 
1 1 1   14    0    7 o   64.217   2.7298  169.031   14.231  169.031   14.231  169.031   14.231   64.217   2.7298   64.217   2.7298 0.000000 0.000000 
1 1 1   14    0    8 o  134.754   2.3020  740.889   25.269  740.889   25.269  740.889   25.269  134.754   2.3020  134.754   2.3020 0.000000 0.000000 
1 1 1   14    0    9 o  263.820   3.0034  2838.78   64.570  2838.78   64.570  2838.78   64.570  263.820   3.0034  263.820   3.0034 0.000000 0.000000 
1 1 1   14    0   10 o  105.732   2.3145  456.377   19.927  456.377   19.927  456.377   19.927  105.732   2.3145  105.732   2.3145 0.000000 0.000000 
1 1 1   14    0   11 o  212.507   3.2346  1842.56   56.001  1842.56   56.001  1842.56   56.001  212.507   3.2346  212.507   3.2346 0.000000 0.000000 
1 1 1   14    0   12 o  137.787   2.8147  774.989   31.584  774.989   31.584  774.989   31.584  137.787   2.8147  137.787   2.8147 0.000000 0.000000 
1 1 1   14    0   13 o   35.739   5.2911   55.418   14.423   55.418   14.423   55.418   14.423   35.739   5.2911   35.739   5.2911 0.000000 0.000000 
1 1 1   14    0   14 o   43.802   4.2969   80.483   14.979   80.483   14.979   80.483   14.979   43.802   4.2969   43.802   4.2969 0.000000 0.000000 
1 1 1   14    0   15 o  110.973   2.7721  503.018   25.041  503.018   25.041  503.018   25.041  110.973   2.7721  110.973   2.7721 0.000000 0.000000 
1 1 1   14    0   16 o   70.248   3.0748  202.356   17.530  202.356   17.530  202.356   17.530   70.248   3.0748   70.248   3.0748 0.000000 0.000000 
1 1 1   14    0   17 o   65.359   3.1825  175.415   16.863  175.415   16.863  175.415   16.863   65.359   3.1825   65.359   3.1825 0.000000 0.000000 
1 1 1   14    0   18 o  187.821   3.0525  1439.49   46.706  1439.49   46.706  1439.49   46.706  187.821   3.0525  187.821   3.0525 0.000000 0.000000 
1 1 1   14    0   19 o  201.555   3.1635  1657.69   51.947  1657.69   51.947  1657.69   51.947  201.555   3.1635  201.555   3.1635 0.000000 0.000000 
1 1 1   14    0   20 o  409.963   5.1385  6861.32  171.659  6861.32  171.659  6861.32  171.659  409.963   5.1385  409.963   5.1385 0.000000 0.000000 
1 1 1   14    0   21 o  334.324   4.3586  4561.81  118.737  4561.81  118.737  4561.81  118.737  334.324   4.3586  334.324   4.3586 0.000000 0.000000 
1 1 1   14    0   22 o   52.906   3.6692  115.788   15.646  115.788   15.646  115.788   15.646   52.906   3.6692   52.906   3.6692 0.000000 0.000000 
1 1 1   14    0   23 o   66.125   2.7263  179.184   14.639  179.184   14.639  179.184   14.639   66.125   2.7263   66.125   2.7263 0.000000 0.000000 
1 1 1   14    0   24 o  134.930   2.3161  742.886   25.458  742.886   25.458  742.886   25.458  134.930   2.3161  134.930   2.3161 0.000000 0.000000 
1 1 1   14    0   25 o   25.107   6.3099   30.112   11.169   30.112   11.169   30.112   11.169   25.107   6.3099   25.107   6.3099 0.000000 0.000000 
1 1 1   14    0   26 o   96.759   2.3664  382.371   18.639  382.371   18.639  382.371   18.639   96.759   2.3664   96.759   2.3664 0.000000 0.000000 
1 1 1   14    0   27 o  245.018   2.8828  2448.88   57.560  2448.88   57.560  2448.88   57.560  245.018   2.8828  245.018   2.8828 0.000000 0.000000 
1 1 1   14    0   28 o   54.622   3.6908  123.344   16.258  123.344   16.258  123.344   16.258   54.622   3.6908   54.622   3.6908 0.000000 0.000000 
1 1 1   14    0   29 o  137.779   2.3365  774.590   26.225  774.590   26.225  774.590   26.225  137.779   2.3365  137.779   2.3365 0.000000 0.000000 
1 1 1   14    0   30 o  102.827   2.3523  431.750   19.694  431.750   19.694  431.750   19.694  102.827   2.3523  102.827   2.3523 0.000000 0.000000 
1 1 1   14    0   31 o  375.039   3.9084  5739.43  119.455  5739.43  119.455  5739.43  119.455  375.039   3.9084  375.039   3.9084 0.000000 0.000000 
1 1 1   14    0   32 o  278.601   3.1386  3166.49   71.256  3166.49   71.256  3166.49   71.256  278.601   3.1386  278.601   3.1386 0.000000 0.000000 
1 1 1   14    0   33 o  540.497   5.3513 11929.78  235.716 11929.78  235.716 11929.78  235.716  540.497   5.3513  540.497   5.3513 0.000000 0.000000 
1 1 1   14    0   34 o  269.033   3.7809  2954.18   82.879  2954.18   82.879  2954.18   82.879  269.033   3.7809  269.033   3.7809 0.000000 0.000000 
1 1 1   14    0   35 o   57.311   3.9408  135.880   18.207  135.880   18.207  135.880   18.207   57.311   3.9408   57.311   3.9408 0.000000 0.000000 
1 1 1   14    0   36 o   67.642   3.6216  188.230   19.837  188.230   19.837  188.230   19.837   67.642   3.6216   67.642   3.6216 0.000000 0.000000 
1 1 1   14    0   37 o  221.631   3.3814  2004.85   61.057  2004.85   61.057  2004.85   61.057  221.631   3.3814  221.631   3.3814 0.000000 0.000000 
1 1 1   14    0   38 o   56.956   3.0428  133.423   14.034  133.423   14.034  133.423   14.034   56.956   3.0428   56.956   3.0428 0.000000 0.000000 
1 1 1   14    0   39 o  212.835   2.6795  1847.99   46.471  1847.99   46.471  1847.99   46.471  212.835   2.6795  212.835   2.6795 0.000000 0.000000 
1 1 1   14    0   40 o  207.439   2.6458  1755.49   44.723  1755.49   44.723  1755.49   44.723  207.439   2.6458  207.439   2.6458 0.000000 0.000000 
1 1 1   14    0   41 f   20.836   7.4272   23.396   11.501   23.396   11.501   23.396   11.501   20.836   7.4272   20.836   7.4272 0.000000 0.000000 
1 1 1   14    0   42 o  210.765   3.2904  1813.19   56.500  1813.19   56.500  1813.19   56.500  210.765   3.2904  210.765   3.2904 0.000000 0.000000 
1 1 1   14    0   43 o  370.838   3.8798  5612.73  117.253  5612.73  117.253  5612.73  117.253  370.838   3.8798  370.838   3.8798 0.000000 0.000000 
1 1 1   14    0   44 o   79.153   2.6051  256.305   16.767  256.305   16.767  256.305   16.767   79.153   2.6051   79.153   2.6051 0.000000 0.000000 
1 1 1   14    0   45 o  120.285   2.3773  590.628   23.289  590.628   23.289  590.628   23.289  120.285   2.3773  120.285   2.3773 0.000000 0.000000 
1 1 1   14    0   46 o   28.217   6.3356   37.022   12.720   37.022   12.720   37.022   12.720   28.217   6.3356   28.217   6.3356 0.000000 0.000000 
1 1 1   14    0   47 o  165.507   2.4678  1117.71   33.278  1117.71   33.278  1117.71   33.278  165.507   2.4678  165.507   2.4678 0.000000 0.000000 
1 1 1   14    0   48 o  280.025   3.1691  3199.69   72.318  3199.69   72.318  3199.69   72.318  280.025   3.1691  280.025   3.1691 0.000000 0.000000 
1 1 1   14    0   49 o  248.868   2.9435  2527.14   59.693  2527.14   59.693  2527.14   59.693  248.868   2.9435  248.868   2.9435 0.000000 0.000000 
1 1 1   14    0   50 o  134.588   2.4241  739.354   26.575  739.354   26.575  739.354   26.575  134.588   2.4241  134.588   2.4241 0.000000 0.000000 
1 1 1   14    0   51 o  297.715   3.3143  3617.21   80.409  3617.21   80.409  3617.21   80.409  297.715   3.3143  297.715   3.3143 0.000000 0.000000 
1 1 1   14    0   52 o  158.325   2.5191  1023.00   32.492  1023.00   32.492  1023.00   32.492  158.325   2.5191  158.325   2.5191 0.000000 0.000000 
1 1 1   14    0   53 o  252.678   3.0175  2605.48   62.132  2605.48   62.132  2605.48   62.132  252.678   3.0175  252.678   3.0175 0.000000 0.000000 
1 1 1   14    0   54 o  355.706   3.7978  5165.73  110.091  5165.73  110.091  5165.73  110.091  355.706   3.7978  355.706   3.7978 0.000000 0.000000 
1 1 1   14    0   55 o  214.384   3.4226  1876.74   59.777  1876.74   59.777  1876.74   59.777  214.384   3.4226  214.384   3.4226 0.000000 0.000000 
1 1 1   14    0   57 o   12.261   7.7569   2.3745   16.629   2.3745   16.629   2.3745   16.629   12.261   7.7569   12.261   7.7569 0.000000 0.000000 
1 1 1   14    0   58 o  133.762   2.5260  730.518   27.520  730.518   27.520  730.518   27.520  133.762   2.5260  133.762   2.5260 0.000000 0.000000 
1 1 1   14    0   59 o   55.220   3.4579  125.899   15.423  125.899   15.423  125.899   15.423   55.220   3.4579   55.220   3.4579 0.000000 0.000000 
1 1 1   14    0   60 o   17.794   8.2331   18.952   13.174   18.952   13.174   18.952   13.174   17.794   8.2331   17.794   8.2331 0.000000 0.000000 
1 1 1   14    0   61 o  101.521   3.0578  421.700   25.252  421.700   25.252  421.700   25.252  101.521   3.0578  101.521   3.0578 0.000000 0.000000 
1 1 1   14    0   62 o  175.148   3.1351  1253.13   44.728  1253.13   44.728  1253.13   44.728  175.148   3.1351  175.148   3.1351 0.000000 0.000000 
1 1 1   14    0   63 o  198.440   2.6785  1607.42   43.310  1607.42   43.310  1607.42   43.310  198.440   2.6785  198.440   2.6785 0.000000 0.000000 
1 1 1   14    0   64 o  114.019   2.5000  531.097   23.210  531.097   23.210  531.097   23.210  114.019   2.5000  114.019   2.5000 0.000000 0.000000 
1 1 1   14    0   65 o   44.277   4.1487   82.186   14.654   82.186   14.654   82.186   14.654   44.277   4.1487   44.277   4.1487 0.000000 0.000000 
1 1 1   14    0   66 o  112.517   2.4816  517.253   22.736  517.253   22.736  517.253   22.736  112.517   2.4816  112.517   2.4816 0.000000 0.000000 
1 1 1   14    0   67 o   32.494   5.8484   47.196   14.000   47.196   14.000   47.196   14.000   32.494   5.8484   32.494   5.8484 0.000000 0.000000 
1 1 1   14    0   68 o   68.571   2.9673  193.019   16.515  193.019   16.515  193.019   16.515   68.571   2.9673   68.571   2.9673 0.000000 0.000000 
1 1 1   14    0   69 o   51.572   4.8630  111.726   20.001  111.726   20.001  111.726   20.001   51.572   4.8630   51.572   4.8630 0.000000 0.000000 
1 1 1   14    0   70 o   10.139   6.5920  -0.9162   13.088  -0.9162   13.088  -0.9162   13.088   10.139   6.5920   10.139   6.5920 0.000000 0.000000 
1 1 1   14    0   71 o  120.941   2.4618  597.643   24.247  597.643   24.247  597.643   24.247  120.941   2.4618  120.941   2.4618 0.000000 0.000000 
1 1 1   14    0   72 o  218.807   3.4252  1957.81   61.058  1957.81   61.058  1957.81   61.058  218.807   3.4252  218.807   3.4252 0.000000 0.000000 
1 1 1   14    0   73 o   19.578   7.8972   21.920   12.290   21.920   12.290   21.920   12.290   19.578   7.8972   19.578   7.8972 0.000000 0.000000 
1 1 1   14    0   74 o   43.037   3.9202   77.634   13.477   77.634   13.477   77.634   13.477   43.037   3.9202   43.037   3.9202 0.000000 0.000000 
1 1 1   14    0   76 o   18.172   7.5820   19.181   11.228   19.181   11.228   19.181   11.228   18.172   7.5820   18.172   7.5820 0.000000 0.000000 
1 1 1   14    0   77 o   82.002   2.6125  275.484   17.423  275.484   17.423  275.484   17.423   82.002   2.6125   82.002   2.6125 0.000000 0.000000 
1 1 1   14    0   78 o   7.0295   4.8895  -8.9315   9.9522  -8.9315   9.9522  -8.9315   9.9522   7.0295   4.8895   7.0295   4.8895 0.000000 0.000000 
1 1 1   14    0   79 o   54.140   2.6132  120.594   11.471  120.594   11.471  120.594   11.471   54.140   2.6132   54.140   2.6132 0.000000 0.000000 
1 1 1   14    0   80 o  189.796   2.0293  1471.04   31.387  1471.04   31.387  1471.04   31.387  189.796   2.0293  189.796   2.0293 0.000000 0.000000 
1 1 1   14    0   81 o   66.243   2.2012  179.807   11.856  179.807   11.856  179.807   11.856   66.243   2.2012   66.243   2.2012 0.000000 0.000000 
1 1 1   14    0   82 o   30.749   4.0845   40.797   9.7339   40.797   9.7339   40.797   9.7339   30.749   4.0845   30.749   4.0845 0.000000 0.000000 
1 1 1   14    0   83 o   8.3289   5.3612   0.2059   8.3719   0.2059   8.3719   0.2059   8.3719   8.3289   5.3612   8.3289   5.3612 0.000000 0.000000 
1 1 1   14    0   84 o   80.095   1.9614  262.487   12.788  262.487   12.788  262.487   12.788   80.095   1.9614   80.095   1.9614 0.000000 0.000000 
1 1 1   14    0   85 o   9.8292   5.8536   4.4188   8.2330   4.4188   8.2330   4.4188   8.2330   9.8292   5.8536   9.8292   5.8536 0.000000 0.000000 
1 1 1   14    0   86 o   18.926   6.0299   18.696   8.1909   18.696   8.1909   18.696   8.1909   18.926   6.0299   18.926   6.0299 0.000000 0.000000 
1 1 1   14    0   87 o   54.616   2.2979  122.665   10.189  122.665   10.189  122.665   10.189   54.616   2.2979   54.616   2.2979 0.000000 0.000000 
1 1 1   14    0   88 o   51.059   2.3265  107.347   9.6369  107.347   9.6369  107.347   9.6369   51.059   2.3265   51.059   2.3265 0.000000 0.000000 
1 1 1   14    0   89 o   8.0297   5.1424   0.5900   7.5789   0.5900   7.5789   0.5900   7.5789   8.0297   5.1424   8.0297   5.1424 0.000000 0.000000 
1 1 1   14    0   90 o   35.457   3.6043   53.368   10.151   53.368   10.151   53.368   10.151   35.457   3.6043   35.457   3.6043 0.000000 0.000000 
1 1 1   14    0   91 o   38.248   3.3054   61.536   10.121   61.536   10.121   61.536   10.121   38.248   3.3054   38.248   3.3054 0.000000 0.000000 
1 1 1   14    0   92 o   39.038   3.2668   64.043   10.222   64.043   10.222   64.043   10.222   39.038   3.2668   39.038   3.2668 0.000000 0.000000 
1 1 1   14    0   93 o   13.304   6.4001   11.019   8.0284   11.019   8.0284   11.019   8.0284   13.304   6.4001   13.304   6.4001 0.000000 0.000000 
1 1 1   14    0   94 o   84.032   2.0348  289.648   13.920  289.648   13.920  289.648   13.920   84.032   2.0348   84.032   2.0348 0.000000 0.000000 
1 1 1   14    0   95 o   75.175   2.1142  232.102   12.932  232.102   12.932  232.102   12.932   75.175   2.1142   75.175   2.1142 0.000000 0.000000 
1 1 1   14    0   96 o   35.758   2.8478   53.613   8.1761   53.613   8.1761   53.613   8.1761   35.758   2.8478   35.758   2.8478 0.000000 0.000000 
1 1 1   14    0   97 o   5.7050   3.9812  -6.2346   6.7459  -6.2346   6.7459  -6.2346   6.7459   5.7050   3.9812   5.7050   3.9812 0.000000 0.000000 
1 1 1   14    0   98 o   52.465   2.1758  113.482   9.2685  113.482   9.2685  113.482   9.2685   52.465   2.1758   52.465   2.1758 0.000000 0.000000 
1 1 1   14    0   99 o   27.148   3.6574   32.155   7.6809   32.155   7.6809   32.155   7.6809   27.148   3.6574   27.148   3.6574 0.000000 0.000000 
1 1 1   14    0  100 f   13.599   6.0990   11.385   7.2122   11.385   7.2122   11.385   7.2122   13.599   6.0990   13.599   6.0990 0.000000 0.000000 
1 1 1   14    0  101 o   18.330   5.5522   17.501   7.2366   17.501   7.2366   17.501   7.2366   18.330   5.5522   18.330   5.5522 0.000000 0.000000 
1 1 1   14    0  102 o   11.975   6.0455   9.1539   7.3084   9.1539   7.3084   9.1539   7.3084   11.975   6.0455   11.975   6.0455 0.000000 0.000000 
1 1 1   14    0  103 o   38.591   2.6846   62.381   8.3496   62.381   8.3496   62.381   8.3496   38.591   2.6846   38.591   2.6846 0.000000 0.000000 
1 1 1   14    0  104 o   58.113   2.5337  140.208   11.950  140.208   11.950  140.208   11.950   58.113   2.5337   58.113   2.5337 0.000000 0.000000 
1 1 1   14    0  105 f   38.853   2.9447   63.715   9.1999   63.715   9.1999   63.715   9.1999   38.853   2.9447   38.853   2.9447 0.000000 0.000000 
1 1 1   14    0  106 o   6.1427   4.2608  -5.6619   7.4201  -5.6619   7.4201  -5.6619   7.4201   6.1427   4.2608   6.1427   4.2608 0.000000 0.000000 
1 1 1   14    0  107 o   8.6172   5.8293  -3.8452   12.062  -3.8452   12.062  -3.8452   12.062   8.6172   5.8293   8.6172   5.8293 0.000000 0.000000 
1 1 1   14    0  108 o   8.0287   5.5293  -6.6555   11.954  -6.6555   11.954  -6.6555   11.954   8.0287   5.5293   8.0287   5.5293 0.000000 0.000000 
1 1 1   14    0  109 o   10.673   6.7051   4.8074   12.189   4.8074   12.189   4.8074   12.189   10.673   6.7051   10.673   6.7051 0.000000 0.000000 
1 1 1   14    0  110 o   9.0807   6.0759  -1.7874   12.451  -1.7874   12.451  -1.7874   12.451   9.0807   6.0759   9.0807   6.0759 0.000000 0.000000 
1 1 1   14    0  111 o   14.283   7.7902   14.770   12.878   14.770   12.878   14.770   12.878   14.283   7.7902   14.283   7.7902 0.000000 0.000000 
1 1 1   14    0  112 o   10.754   6.8413   4.5473   13.147   4.5473   13.147   4.5473   13.147   10.754   6.8413   10.754   6.8413 0.000000 0.000000 
1 1 1   14    0  113 o   18.807   8.2859   24.270   13.315   24.270   13.315   24.270   13.315   18.807   8.2859   18.807   8.2859 0.000000 0.000000 
1 1 1   14    0  114 o   7.5791   5.3183 -10.3681   12.525 -10.3681   12.525 -10.3681   12.525   7.5791   5.3183   7.5791   5.3183 0.000000 0.000000 
1 1 1   14    0  115 o   20.799   8.2193   28.077   13.405   28.077   13.405   28.077   13.405   20.799   8.2193   20.799   8.2193 0.000000 0.000000 
1 1 1   14    0  116 o   10.507   6.7358   4.0835   13.046   4.0835   13.046   4.0835   13.046   10.507   6.7358   10.507   6.7358 0.000000 0.000000 
1 1 1   14    0  117 o   10.508   6.8029   3.4966   13.740   3.4966   13.740   3.4966   13.740   10.508   6.8029   10.508   6.8029 0.000000 0.000000 
1 1 1   14    0  118 o   8.3340   5.8742 -13.0510   15.814 -13.0510   15.814 -13.0510   15.814   8.3340   5.8742   8.3340   5.8742 0.000000 0.000000 
1 1 1   14    0  119 o   16.325   9.7467   23.440   22.934   23.440   22.934   23.440   22.934   16.325   9.7467   16.325   9.7467 0.000000 0.000000 
1 1 1   14    0  120 f   12.266   7.7600   8.7382   16.644   8.7382   16.644   8.7382   16.644   12.266   7.7600   12.266   7.7600 0.000000 0.000000 
1 1 1   14    0  121 o   13.649   8.2948   13.872   17.218   13.872   17.218   13.872   17.218   13.649   8.2948   13.649   8.2948 0.000000 0.000000 
1 1 1   14    0  122 o   9.5410   6.5851  -6.4635   17.180  -6.4635   17.180  -6.4635   17.180   9.5410   6.5851   9.5410   6.5851 0.000000 0.000000 
1 1 1   14    1 -121 o   12.242   5.5866  -1.0536   12.373   2.0446   17.812  -3.9428   17.201   14.502   6.6497   13.354   6.2623 1.147909 9.134262 
1 1 1   14    1 -120 o   17.812   6.5471   17.682   12.480   18.441   17.734   16.937   17.565   17.967   7.4316   17.577   7.3434 0.3899956 10.44766 
1 1 1   14    1 -119 f   12.175   5.7121  -5.2281   14.338 -27.8089   16.952   51.529   26.876   10.437   5.1828   24.804   9.5024 -14.36618 10.82388 
1 1 1   14    1 -118 o   10.012   4.8600 -14.2523   12.432   3.7991   17.169 -34.1498   18.026   14.699   6.6578   10.342   5.1687 4.356722 8.428644 
1 1 1   14    1 -117 o   19.213   6.7763   21.079   13.207   36.265   18.487   5.2514   18.874   23.504   8.0324   15.408   6.9795 8.096105 10.64109 
1 1 1   14    1 -116 o   15.313   6.0440   10.779   11.129   6.2186   13.815   19.208   18.784   14.506   6.2970   18.439   7.6396 -3.933259 9.900301 
1 1 1   14    1 -115 o   28.343   4.6153   38.262   10.296   33.064   14.470   43.594   14.654   23.967   6.9824   28.373   6.4789 -4.405191 9.525244 
1 1 1   14    1 -114 o   18.850   6.0648   18.885   10.580   29.544   15.824   10.267   14.228   22.177   7.4321   15.783   6.6027 6.393404 9.941399 
1 1 1   14    1 -113 o   12.622   5.4015   3.5630   9.8880   17.042   14.097  -9.4928   13.874   17.919   6.8776   11.485   5.4571 6.433478 8.779554 
1 1 1   14    1 -112 o   14.442   5.6670   8.7421   9.7346   8.0215   13.483   9.5269   14.070   15.102   6.3789   15.653   6.5582 -0.5514612 9.148821 
1 1 1   14    1 -111 o   11.656   5.1286   0.7805   9.4381   6.9155   12.867  -6.3648   13.886   14.700   6.2215   12.090   5.6558 2.610121 8.408028 
1 1 1   14    1 -110 o   17.621   5.8218   15.669   9.7170   27.863   13.524   2.6568   13.970   22.516   6.7991   13.991   6.1941 8.525300 9.197506 
1 1 1   14    1 -109 o   24.389   5.0330   28.681   9.6739   24.825   13.507   32.743   13.862   21.290   6.8526   24.615   6.7211 -3.324142 9.598516 
1 1 1   14    1 -108 o   18.073   5.6995   16.305   9.3822   17.585   13.041   14.931   13.509   18.500   6.7091   17.550   6.7334 0.9501781 9.505342 
1 1 1   14    1 -107 o   16.349   5.8813   12.514   9.9958   9.0423   15.119   15.209   13.323   16.146   6.7836   17.759   6.7172 -1.612825 9.546606 
1 1 1   14    1 -106 o   36.073   3.6477   57.170   10.579   56.755   15.883   57.501   14.182   34.058   5.9369   35.020   5.1192 -0.9616013 7.839176 
1 1 1   14    1 -105 f   23.632   5.5139   26.948   10.427   16.506   14.382   38.516   15.138   18.613   6.9924   27.324   6.8187 -8.710535 9.766694 
1 1 1   14    1 -104 o   18.570   5.7794   16.587   9.6792   10.987   13.020   23.507   14.472   16.606   6.5424   21.379   7.1063 -4.773487 9.659328 
1 1 1   14    1 -103 o   13.187   5.4351   4.3335   9.4403  -0.4413   12.660   10.313   14.168   13.255   5.8808   16.765   6.7516 -3.510422 8.953650 
1 1 1   14    1 -102 o   19.394   5.5363   17.770   9.1841   29.398   13.221   6.9272   12.767   24.391   6.5232   15.413   6.3332 8.978333 9.091822 
1 1 1   14    1 -101 o   17.738   5.4749   14.508   8.7067   19.749   12.285   9.2181   12.342   20.296   6.5355   16.119   6.3638 4.177197 9.122019 
1 1 1   14    1 -100 o   9.3322   4.3974  -8.1585   8.6619 -23.3357   12.274   6.9002   12.226   9.2791   4.5711   15.381   6.2438 -6.101738 7.738215 
1 1 1   14    1  -99 o   27.346   4.2096   32.833   9.0831   31.336   12.729   34.386   12.965   25.748   6.1495   27.065   6.0311 -1.317381 8.613379 
1 1 1   14    1  -98 f   43.318   3.2173   79.278   11.279   74.190   13.708   89.946   19.850   41.440   4.1121   44.670   5.5721 -3.229427 6.925181 
1 1 1   14    1  -97 o   14.174   5.4297   6.8064   8.7750   4.9156   12.071   8.9255   12.779   14.860   6.1374   16.443   6.4805 -1.582355 8.925515 
1 1 1   14    1  -96 o   50.599   2.5351  106.425   10.423  106.737   14.632  106.103   14.850   50.181   3.6011   49.995   3.6696 0.1866417 5.141328 
1 1 1   14    1  -95 o   26.265   4.3669   30.178   9.0214   24.838   12.661   35.686   12.858   23.063   6.4721   27.949   5.8325 -4.885839 8.712423 
1 1 1   14    1  -94 o   11.888   5.1831  -0.6204   9.4453 -23.8034   15.574   12.869   11.880   11.137   5.4137   17.785   6.4098 -6.647405 8.390092 
1 1 1   14    1  -93 o   41.563   2.8398   72.078   9.5634   70.158   13.464   74.033   13.586   40.484   4.1381   41.636   4.0544 -1.151581 5.793257 
1 1 1   14    1  -92 o   35.230   3.4496   52.402   9.7795   57.658   13.338   46.291   14.381   36.510   4.5824   32.160   5.6943 4.350063 7.309123 
1 1 1   14    1  -91 o   30.752   3.8653   40.330   9.4757   32.761   12.669   49.938   14.275   26.900   5.9371   33.634   5.3887 -6.733913 8.017965 
1 1 1   14    1  -90 o   65.801   2.4252  178.781   12.986  181.715   18.606  175.995   18.133   65.894   3.4762   64.863   3.4419 1.031418 4.891895 
1 1 1   14    1  -89 f   34.155   3.6058   49.204   9.8878   43.040   15.097   53.834   13.085   30.938   6.2027   35.367   4.6513 -4.429203 7.752898 
1 1 1   14    1  -88 o   36.200   3.4255   54.976   9.9879   39.775   14.742   67.875   13.579   29.733   6.2796   39.976   4.2314 -10.24231 7.572228 
1 1 1   14    1  -87 o   23.708   4.7740   24.543   8.9064   28.220   12.353   20.562   12.853   25.079   6.1016   21.563   6.6514 3.515392 9.026127 
1 1 1   14    1  -86 o   32.185   2.1000   42.684   5.4794   43.203   13.101   42.573   6.0324   31.514   5.2871   32.105   2.3207 -0.5911865 5.773959 
1 1 1   14    1  -85 o  105.010   1.3963  450.682   11.953  476.464   22.110  440.037   14.208  107.638   2.5199  103.699   1.6808 3.939308 3.029020 
1 1 1   14    1  -84 o   42.844   1.9591   75.346   6.8237   94.676   14.386   69.734   7.7512   47.624   3.7356   41.155   2.3199 6.469418 4.397346 
1 1 1   14    1  -83 o   53.615   1.7523  117.721   7.6478  119.889   15.320  117.002   8.8263   53.723   3.5176   53.407   2.0311 0.3158722 4.061913 
1 1 1   14    1  -82 o   42.266   2.1644   73.381   7.4321   85.290   18.372   71.051   8.1267   44.827   5.1195   41.549   2.4098 3.278316 5.658349 
1 1 1   14    1  -81 o   45.256   2.1444   84.056   7.8882   64.914   18.690   88.205   8.7012   38.751   6.1197   46.336   2.3110 -7.585274 6.541535 
1 1 1   14    1  -80 o   65.815   2.0050  177.384   10.744  172.104   21.544  179.132   12.396   64.335   4.1299   66.089   2.3045 -1.753670 4.729363 
1 1 1   14    1  -79 o  100.960   2.0892  417.020   17.193  440.648   27.739  402.281   21.909  103.437   3.2941   98.993   2.7177 4.444824 4.270459 
1 1 1   14    1  -78 o   45.485   3.3630   85.542   12.381  126.700   20.195   60.759   15.671   55.123   4.5345   37.866   5.2154 17.25703 6.911022 
1 1 1   14    1  -77 o   57.999   1.9878  137.668   9.3840  140.843   16.495  136.148   11.410   58.419   3.4796   57.618   2.4349 0.8011971 4.246974 
1 1 1   14    1  -76 o   93.048   1.4655  353.407   11.116  336.393   15.187  373.038   16.314   90.715   2.0538   95.523   2.0951 -4.807671 2.933858 
1 1 1   14    1  -75 o   45.668   2.0175   85.391   7.4919   98.150   10.138   70.036   11.121   48.904   2.5519   41.171   3.3424 7.732468 4.205174 
1 1 1   14    1  -74 o   41.353   2.3544   70.156   7.9038   50.552   10.351   97.574   12.241   34.885   3.6961   48.691   3.1002 -13.80624 4.824174 
1 1 1   14    1  -73 o   87.023   1.7106  309.160   12.135  316.612   16.802  301.035   17.544   87.971   2.3451   85.754   2.5125 2.216949 3.436887 
1 1 1   14    1  -72 o   59.833   2.1356  146.441   10.399  143.148   13.894  150.634   15.681   59.065   2.8946   60.551   3.1883 -1.485901 4.306218 
1 1 1   14    1  -71 o  116.550   1.7975  554.520   17.077  545.465   22.041  568.122   27.013  115.531   2.3404  117.836   2.8123 -2.304871 3.658729 
1 1 1   14    1  -70 o  114.026   1.9297  530.834   17.937  558.670   24.979  501.204   25.772  116.893   2.6215  110.648   2.8597 6.244728 3.879502 
1 1 1   14    1  -69 o   77.041   1.8864  242.280   11.847  264.298   19.238  228.831   15.036   80.323   2.9432   74.790   2.4697 5.532845 3.842119 
1 1 1   14    1  -68 o  100.098   1.4836  408.740   12.106  398.473   16.893  419.578   17.356   98.788   2.0979  101.370   2.1004 -2.582092 2.968628 
1 1 1   14    1  -67 o   50.379   1.9597  103.756   8.0325  105.946   11.464  101.644   11.258   50.833   2.7771   49.786   2.7852 1.046661 3.933187 
1 1 1   14    1  -66 f   44.971   2.2936   82.802   8.3800   95.315   11.720   69.716   11.986   48.186   2.9988   41.102   3.6143 7.083805 4.696350 
1 1 1   14    1  -65 f   71.273   1.6688  207.247   9.6957  211.040   13.658  203.394   13.766   71.850   2.3351   70.529   2.3980 1.320824 3.347040 
1 1 1   14    1  -64 o  104.885   1.5016  448.709   12.838  436.827   17.897  461.305   18.426  103.447   2.1224  106.306   2.1264 -2.858536 3.004329 
1 1 1   14    1  -63 o  105.254   1.5861  451.893   13.609  444.725   20.318  457.725   18.327  104.363   2.3884  105.897   2.1231 -1.534615 3.195572 
1 1 1   14    1  -62 o   67.379   1.7330  185.326   9.5104  178.484   13.613  191.848   13.292   66.063   2.5326   68.508   2.3838 -2.444992 3.478072 
1 1 1   14    1  -61 o  105.011   1.5074  449.738   12.903  452.792   18.310  446.725   18.186  105.332   2.1325  104.624   2.1324 0.7080383 3.015790 
1 1 1   14    1  -60 o   85.003   1.5855  294.700   10.986  284.825   15.538  304.571   15.535   83.505   2.2849   86.359   2.2086 -2.854256 3.177828 
1 1 1   14    1  -59 o   91.066   1.5563  338.222   11.553  351.546   16.686  325.955   16.011   92.812   2.2056   89.371   2.1977 3.441528 3.113601 
1 1 1   14    1  -58 o   47.037   2.1782   90.475   8.3291   77.299   11.778  103.657   11.780   43.359   3.3585   50.295   2.8855 -6.936512 4.427855 
1 1 1   14    1  -57 o  105.842   1.5044  456.837   12.980  459.491   18.370  454.191   18.342  106.121   2.1236  105.507   2.1328 0.6143875 3.009676 
1 1 1   14    1  -56 o   24.171   3.9269   24.504   7.4718   13.580   10.467   35.853   10.669   18.519   6.0383   29.235   4.6310 -10.71614 7.609684 
1 1 1   14    1  -55 o  129.219   1.5783  680.919   16.625  672.632   22.209  691.483   25.074  128.403   2.1219  130.174   2.3630 -1.771667 3.175856 
1 1 1   14    1  -54 o   97.344   1.7432  386.452   13.832  373.610   19.338  399.908   19.794   95.650   2.4823   98.994   2.4530 -3.343834 3.489818 
1 1 1   14    1  -53 o  294.012   2.3245  3526.94   55.709  3395.36   76.706  3673.81   81.041  288.326   3.2637  299.906   3.3150 -11.58008 4.651990 
1 1 1   14    1  -52 o  138.860   1.7576  786.357   19.895  803.238   28.362  770.003   27.915  140.302   2.4799  137.367   2.4930 2.934158 3.516379 
1 1 1   14    1  -51 o   56.285   2.7773  129.623   12.703  120.113   16.126  145.173   20.621   54.092   3.6792   59.424   4.2859 -5.331848 5.648497 
1 1 1   14    1  -50 o  232.023   1.7791  2195.46   33.648  2233.16   47.923  2158.81   47.255  233.937   2.5131  230.009   2.5204 3.927750 3.559193 
1 1 1   14    1  -49 f  154.779   1.6958  976.910   21.396  945.209   32.940  1000.05   28.141  152.189   2.6552  156.573   2.2049 -4.383621 3.451343 
1 1 1   14    1  -48 o  123.913   1.5148  626.056   15.301  600.353   21.212  653.937   22.092  121.318   2.1450  126.617   2.1405 -5.298576 3.030294 
1 1 1   14    1  -47 o  128.989   1.3853  678.349   14.565  692.987   22.464  667.730   19.132  130.345   2.1142  127.960   1.8342 2.385269 2.798995 
1 1 1   14    1  -46 o  165.181   1.4230  1112.43   19.160  1095.96   28.912  1125.32   25.586  163.918   2.1638  166.114   1.8895 -2.196396 2.872702 
1 1 1   14    1  -45 o   96.466   1.4032  379.395   11.034  381.739   17.123  377.731   14.430   96.742   2.1713   96.243   1.8393 0.4988403 2.845647 
1 1 1   14    1  -44 o  143.658   1.4619  841.414   17.120  848.397   24.820  835.076   23.644  144.226   2.1112  143.094   2.0270 1.132843 2.926777 
1 1 1   14    1  -43 o  186.454   1.4746  1417.42   22.412  1448.79   34.236  1393.89   29.648  188.467   2.2285  184.876   1.9673 3.590240 2.972642 
1 1 1   14    1  -42 o  109.936   1.4793  492.750   13.257  515.367   18.951  471.074   18.552  112.413   2.0681  107.472   2.1177 4.940773 2.959995 
1 1 1   14    1  -41 o  177.655   1.5501  1286.81   22.448  1302.98   31.949  1271.04   31.548  178.736   2.1929  176.531   2.1924 2.204620 3.100821 
1 1 1   14    1  -40 o  156.980   1.4992  1004.69   19.183  987.815   26.891  1022.18   27.374  155.630   2.1197  158.314   2.1212 -2.684174 2.998789 
1 1 1   14    1  -39 o  174.206   1.5173  1237.31   21.546  1244.94   30.172  1229.36   30.779  174.716   2.1185  173.616   2.1749 1.099686 3.036139 
1 1 1   14    1  -38 o   31.625   2.4317   41.038   6.2206   32.139   8.9828   49.237   8.6229   27.753   4.0934   34.597   3.0901 -6.843586 5.128768 
1 1 1   14    1  -37 o  189.367   1.5486  1462.04   23.905  1438.15   34.207  1484.84   33.420  187.781   2.2347  190.809   2.1487 -3.028610 3.100109 
1 1 1   14    1  -36 o   98.168   1.3710  392.879   10.971  408.397   16.974  381.745   14.377  100.072   2.0808   96.758   1.8229 3.313896 2.766321 
1 1 1   14    1  -35 o   72.992   1.5596  217.217   9.2794  203.839   13.807  228.237   12.532   70.652   2.4009   74.783   2.0577 -4.131081 3.162019 
1 1 1   14    1  -34 o  322.794   2.1253  4249.27   55.922  4217.59   79.189  4280.78   78.983  321.492   3.0217  323.896   2.9915 -2.403107 4.252054 
1 1 1   14    1  -33 o   19.585   4.0254   16.242   6.2115   14.490   8.7379   18.032   8.8317   18.645   5.4242   20.604   5.2455 -1.959660 7.545714 
1 1 1   14    1  -32 o  161.914   1.5413  1068.83   20.342  1038.82   27.000  1108.22   30.937  159.606   2.0753  164.840   2.3024 -5.234421 3.099606 
1 1 1   14    1  -31 o  133.609   1.4742  727.767   16.055  710.596   21.540  749.230   24.083  132.008   2.0018  135.543   2.1797 -3.534729 2.959440 
1 1 1   14    1  -30 f  251.382   1.8991  2576.72   38.915  2615.11   52.412  2529.54   58.095  253.204   2.5394  249.001   2.8622 4.204025 3.826313 
1 1 1   14    1  -29 o   40.398   2.2842   66.770   7.4912   67.489   10.457   66.011   10.737   40.543   3.1899   40.082   3.3158 0.4612122 4.601075 
1 1 1   14    1  -28 f  248.394   1.8861  2515.77   38.190  2508.32   50.787  2525.47   57.935  247.986   2.5124  248.805   2.8566 -0.8196106 3.804229 
1 1 1   14    1  -27 o   88.446   1.3675  318.902   9.8590  315.970   13.616  322.134   14.294   88.030   1.8975   88.883   1.9729 -0.8531265 2.737311 
1 1 1   14    1  -26 o   42.687   2.1060   74.486   7.3057   74.950   10.904   74.108   9.8413   42.743   3.1517   42.526   2.8555 0.2168999 4.252882 
1 1 1   14    1  -25 o  219.944   1.6517  1972.26   29.613  1997.88   42.621  1948.35   41.176  221.332   2.3623  218.574   2.3110 2.757645 3.304760 
1 1 1   14    1  -24 o  112.997   1.3934  520.517   12.834  529.460   18.679  512.520   17.664  113.950   2.0110  112.115   1.9328 1.835770 2.789238 
1 1 1   14    1  -23 o  125.652   1.3955  643.638   14.293  638.480   20.597  648.430   19.851  125.133   2.0193  126.107   1.9311 -0.9737473 2.794045 
1 1 1   14    1  -22 o  128.202   1.4015  670.016   14.646  662.424   21.172  676.983   20.282  127.458   2.0378  128.854   1.9310 -1.396049 2.807342 
1 1 1   14    1  -21 o  199.475   1.5772  1622.19   25.645  1627.96   36.739  1616.70   35.815  199.802   2.2557  199.112   2.2066 0.6901245 3.155556 
1 1 1   14    1  -20 o  156.573   1.4448  999.394   18.441  981.285   26.373  1016.72   25.794  155.130   2.0856  157.908   2.0039 -2.778717 2.892304 
1 1 1   14    1  -19 o  131.162   1.4057  701.315   15.030  686.542   21.562  715.276   20.961  129.759   2.0386  132.449   1.9414 -2.690277 2.815125 
1 1 1   14    1  -18 o  186.730   1.6481  1421.53   25.087  1415.82   39.296  1425.46   32.593  186.317   2.5874  186.970   2.1385 -0.6534729 3.356770 
1 1 1   14    1  -17 o  202.751   1.7070  1675.95   28.212  1684.02   44.131  1670.38   36.687  203.195   2.6644  202.393   2.2237 0.8024902 3.470404 
1 1 1   14    1  -16 o  160.691   1.5698  1052.68   20.563  1088.21   32.875  1029.84   26.354  163.351   2.4690  158.925   2.0344 4.425781 3.199111 
1 1 1   14    1  -15 f  300.332   2.3411  3678.27   57.315  3717.83   82.183  3640.81   79.972  301.858   3.3400  298.721   3.2843 3.137665 4.684213 
1 1 1   14    1  -14 o  134.746   1.6597  740.205   18.230  736.937   22.600  746.294   30.845  134.438   2.0623  135.265   2.7974 -0.8273010 3.475425 
1 1 1   14    1  -13 f  312.372   2.3983  3979.15   61.067  4020.84   75.585  3900.79  103.627  313.960   2.9534  309.116   4.1126 4.843750 5.063195 
1 1 1   14    1  -12 o  110.754   1.6525  500.074   14.919  496.103   18.594  507.251   24.996  110.305   2.0680  111.520   2.7497 -1.215126 3.440514 
1 1 1   14    1  -11 o  205.096   1.7100  1714.90   28.589  1721.80   38.385  1706.30   42.841  205.486   2.2916  204.546   2.5694 0.9398346 3.442899 
1 1 1   14    1  -10 o  207.575   1.7163  1756.61   29.041  1722.70   38.502  1801.37   44.233  205.540   2.2980  210.167   2.5819 -4.627457 3.456468 
1 1 1   14    1   -9 o  199.496   1.7975  1622.57   29.231  1608.69   41.315  1636.48   41.364  198.611   2.5519  200.320   2.5331 -1.709198 3.595714 
1 1 1   14    1   -8 o  232.472   1.9502  2203.42   36.956  2184.43   52.130  2222.61   52.397  231.428   2.7634  233.442   2.7535 -2.014252 3.901050 
1 1 1   14    1   -7 o  265.589   2.1219  2876.08   45.937  2850.55   64.758  2901.93   65.173  264.353   3.0052  266.726   2.9976 -2.372406 4.244579 
1 1 1   14    1   -6 o  195.889   1.7858  1564.40   28.515  1588.31   40.868  1541.72   39.805  197.351   2.5404  194.437   2.5115 2.914536 3.572292 
1 1 1   14    1   -5 o   87.670   2.1059  313.389   15.050  307.596   21.630  318.826   20.954   86.784   3.0624   88.364   2.9130 -1.580399 4.226582 
1 1 1   14    1   -4 o  150.411   1.6362  922.286   20.061  919.009   28.579  925.468   28.165  150.125   2.3354  150.653   2.2935 -0.5279846 3.273274 
1 1 1   14    1   -3 o   25.984   4.0616   28.216   8.3212   31.877   11.259   23.810   12.353   27.482   5.2167   23.712   6.2887 3.769657 8.170806 
1 1 1   14    1   -2 o  105.636   1.6087  454.910   13.852  484.373   20.143  428.473   19.080  108.991   2.2672  102.508   2.2834 6.482224 3.217791 
1 1 1   14    1   -1 o   85.632   1.6870  298.944   11.776  289.550   16.717  308.197   16.591   84.230   2.4373   86.906   2.3441 -2.676277 3.381595 
1 1 1   14    1    0 o  174.335   1.7176  1239.04   24.409  1209.71   34.301  1269.14   34.742  172.236   2.4431  176.417   2.4159 -4.180786 3.435907 
1 1 1   14    1    1 o  250.391   2.2390  2556.43   45.699  2559.66   72.202  2554.26   59.026  250.467   3.5364  250.248   2.8936 0.2188721 4.569360 
1 1 1   14    1    2 o  219.096   1.9015  1957.09   33.961  1942.94   48.027  1971.24   48.029  218.267   2.6993  219.852   2.6800 -1.585342 3.803787 
1 1 1   14    1    3 o  126.763   1.7820  655.104   18.413  675.143   30.268  643.331   23.200  128.658   2.8861  125.608   2.2658 3.050041 3.669294 
1 1 1   14    1    4 o   99.007   1.6435  399.612   13.264  402.107   19.024  397.251   18.503   99.303   2.3501   98.703   2.2998 0.6003723 3.288197 
1 1 1   14    1    5 o  312.121   2.3873  3972.58   60.739  3939.41   85.541  4006.30   86.258  310.737   3.3771  313.364   3.3769 -2.627075 4.775796 
1 1 1   14    1    6 o   96.554   1.8301  380.079   14.404  409.633   24.245  363.958   17.906  100.169   2.9726   94.475   2.3252 5.693634 3.773982 
1 1 1   14    1    7 o   63.209   1.9243  163.048   9.9036  167.630   14.348  158.878   13.687   64.051   2.7546   62.356   2.6991 1.694256 3.856507 
1 1 1   14    1    8 o  179.174   2.1466  1309.00   31.351  1302.06   36.050  1330.53   63.509  178.686   2.4750  180.527   4.3158 -1.840393 4.975103 
1 1 1   14    1    9 o  150.985   2.0199  929.473   24.859  939.781   35.759  919.831   34.583  151.790   2.8901  150.173   2.8251 1.617157 4.041510 
1 1 1   14    1   10 o   73.424   2.1764  220.015   13.012  232.659   19.220  209.318   17.679   75.455   3.1317   71.569   3.0372 3.885880 4.362572 
1 1 1   14    1   11 o   20.768   5.5356   18.244   9.5409  -5.7155   13.961   39.242   13.069   13.773   6.1392   30.531   5.4514 -16.75814 8.210200 
1 1 1   14    1   12 o  270.312   2.6444  2980.04   58.267  2933.79   81.865  3027.52   82.950  268.117   3.7457  272.367   3.7362 -4.250153 5.290510 
1 1 1   14    1   13 f  195.234   1.8105  1554.00   28.812  1510.51   40.389  1599.08   41.115  192.451   2.5746  198.014   2.5472 -5.563171 3.621692 
1 1 1   14    1   14 o  235.480   2.1746  2261.06   41.741  2354.58   67.906  2204.27   52.918  240.215   3.4680  232.469   2.7926 7.746033 4.452551 
1 1 1   14    1   15 f  125.005   1.6369  637.049   16.680  657.667   24.151  618.244   23.064  126.994   2.3330  123.130   2.2979 3.864075 3.274665 
1 1 1   14    1   16 o  275.896   2.1978  3103.89   49.428  3150.49   70.813  3059.60   69.025  277.891   3.1261  273.856   3.0921 4.034882 4.396971 
1 1 1   14    1   17 o  227.698   1.9580  2113.94   36.341  2163.36   52.408  2068.18   50.437  230.298   2.7917  225.178   2.7478 5.120438 3.917161 
1 1 1   14    1   18 o   45.854   2.4646   85.998   9.1783   96.138   13.605   77.529   12.434   48.414   3.4705   43.443   3.5419 4.970875 4.958766 
1 1 1   14    1   19 o   78.968   1.8024  254.245   11.602  241.611   16.709  266.007   16.122   76.919   2.6689   80.725   2.4530 -3.805763 3.624895 
1 1 1   14    1   20 o   51.096   2.2399  106.670   9.3066  125.967   13.626   89.796   12.742   55.485   3.0242   46.790   3.3631 8.694904 4.522834 
1 1 1   14    1   21 o   60.996   2.2123  151.916   10.981  162.284   14.735  138.964   16.470   63.007   2.8765   58.250   3.4845 4.757740 4.518438 
1 1 1   14    1   22 o  258.632   2.3128  2727.87   48.759  2693.95   62.614  2780.14   77.719  256.969   2.9892  260.985   3.6532 -4.016083 4.720292 
1 1 1   14    1   23 o  201.270   2.0208  1651.82   33.154  1641.02   42.844  1667.94   52.345  200.581   2.6204  202.183   3.1761 -1.602600 4.117505 
1 1 1   14    1   24 o  298.278   2.5452  3628.81   61.885  3648.25   80.294  3600.37   97.124  299.003   3.2944  296.948   4.0125 2.055237 5.191603 
1 1 1   14    1   25 o  232.164   2.1724  2198.00   41.112  2198.60   53.250  2197.11   64.689  232.154   2.8139  232.025   3.4202 0.1285095 4.428978 
1 1 1   14    1   26 o  203.497   1.8578  1688.46   30.816  1708.67   44.009  1669.02   43.165  204.670   2.6379  202.282   2.6178 2.387787 3.716351 
1 1 1   14    1   27 o  115.284   1.8284  541.891   17.182  529.818   22.122  560.250   27.279  113.977   2.3810  117.188   2.8557 -3.210815 3.718123 
1 1 1   14    1   28 f   88.475   1.8715  319.171   13.497  286.720   20.897  342.395   17.679   83.772   3.0654   91.595   2.3698 -7.823471 3.874649 
1 1 1   14    1   29 o  200.872   2.0271  1645.35   33.192  1587.31   51.906  1685.50   43.172  197.223   3.2287  203.275   2.6054 -6.052917 4.148816 
1 1 1   14    1   30 f  135.825   2.4254  752.452   26.854  721.597   46.936  767.468   32.743  132.836   4.3405  137.151   2.9287 -4.315384 5.236121 
1 1 1   14    1   31 o  540.680   5.3668 11957.46  236.535 12088.38  414.282 11894.13  288.112  541.650   9.3830  538.772   6.5602 2.877502 11.44890 
1 1 1   14    1   32 o  102.578   2.5041  429.198   20.938  407.022   37.142  439.528   25.350   99.695   4.5827  103.744   3.0008 -4.048363 5.477738 
1 1 1   14    1   33 o  187.641   2.2079  1435.93   33.771  1350.91   46.049  1534.88   49.677  181.945   3.1049  193.936   3.1424 -11.99110 4.417536 
1 1 1   14    1   34 o  153.012   1.8519  954.670   23.098  1003.66   37.454  924.606   29.341  156.836   2.9297  150.561   2.3907 6.274979 3.781350 
1 1 1   14    1   35 o  315.050   2.4247  4048.58   62.269  3987.16   87.362  4112.02   88.778  312.529   3.4292  317.384   3.4315 -4.855377 4.851264 
1 1 1   14    1   36 o  139.548   1.6818  793.992   19.131  796.785   27.437  791.349   26.690  139.765   2.4083  139.290   2.3506 0.4750366 3.365315 
1 1 1   14    1   37 o  253.834   2.0956  2627.64   43.361  2682.61   62.390  2576.27   60.308  256.397   2.9851  251.267   2.9444 5.129242 4.192941 
1 1 1   14    1   38 o  229.619   1.9784  2150.09   37.030  2148.58   52.590  2151.58   52.151  229.474   2.8115  229.637   2.7860 -0.1622925 3.958060 
1 1 1   14    1   39 o  119.482   1.6718  582.087   16.282  573.657   23.255  590.194   22.805  118.589   2.4057  120.289   2.3258 -1.700401 3.346110 
1 1 1   14    1   40 o  237.610   2.0181  2302.45   39.089  2342.80   56.089  2264.35   54.505  239.610   2.8717  235.568   2.8385 4.042313 4.037745 
1 1 1   14    1   41 o  173.108   1.7606  1221.91   24.843  1265.02   36.065  1182.97   34.271  176.094   2.5125  170.290   2.4689 5.803574 3.522513 
1 1 1   14    1   42 o  135.909   1.6782  753.156   18.592  749.196   26.668  756.900   25.932  135.520   2.4141  136.219   2.3354 -0.6988068 3.358876 
1 1 1   14    1   43 o  119.863   1.6852  585.818   16.465  616.672   24.138  558.971   22.517  122.951   2.4085  117.059   2.3598 5.891319 3.371839 
1 1 1   14    1   44 o  203.609   1.8770  1690.60   31.153  1758.60   45.370  1629.94   42.852  207.604   2.6810  199.870   2.6302 7.733932 3.755772 
1 1 1   14    1   45 o   85.463   1.8111  297.847   12.617  304.435   18.389  291.987   17.342   86.339   2.6159   84.560   2.5188 1.778999 3.631403 
1 1 1   14    1   46 o   67.995   2.0582  188.739   11.395  193.138   16.783  184.977   15.520   68.722   3.0032   67.264   2.8370 1.457756 4.131295 
1 1 1   14    1   47 o  100.520   1.7815  412.042   14.598  403.514   21.305  419.588   20.041   99.407   2.6316  101.412   2.4243 -2.005035 3.578066 
1 1 1   14    1   48 o  112.843   1.8909  519.308   17.393  515.749   27.582  521.657   22.411  112.361   3.0142  113.075   2.4314 -0.7134705 3.872634 
1 1 1   14    1   49 f  110.913   1.7911  501.679   16.193  478.018   23.109  524.505   22.698  108.230   2.6194  113.379   2.4560 -5.149017 3.590686 
1 1 1   14    1   50 o  355.196   2.6853  5149.08   77.749  5054.48  108.974  5247.17  110.960  351.679   3.8014  358.320   3.7989 -6.641235 5.374218 
1 1 1   14    1   51 o  150.831   2.5070  928.351   30.823  915.001   52.822  935.243   37.955  149.501   4.3391  151.344   3.0766 -1.843018 5.319097 
1 1 1   14    1   52 o  198.938   2.6722  1615.24   43.333  1567.92   73.486  1640.47   53.654  195.738   4.6056  200.416   3.2842 -4.677567 5.656693 
1 1 1   14    1   53 o   64.631   3.0584  170.946   16.067  196.610   26.956  156.804   20.010   69.132   4.8136   61.802   3.9934 7.330143 6.254435 
1 1 1   14    1   54 o   22.967   5.7076   22.493   10.639   34.222   16.383   13.942   13.989   28.284   7.1138   19.718   6.9722 8.566164 9.960835 
1 1 1   14    1   55 o  147.790   1.9101  890.923   23.012  919.825   36.943  872.599   29.415  150.079   3.0198  146.224   2.4678 3.855682 3.899902 
1 1 1   14    1   56 o   91.673   1.9958  342.834   14.914  365.888   23.999  328.328   19.037   94.593   3.1167   89.646   2.6079 4.946426 4.063856 
1 1 1   14    1   57 o  136.142   1.8823  756.065   20.889  767.226   33.237  748.778   26.856  137.056   2.9750  135.446   2.4324 1.610168 3.842793 
1 1 1   14    1   58 o  149.860   2.1126  916.362   25.807  1008.95   38.653  841.890   34.666  157.156   3.0173  143.563   2.9623 13.59306 4.228343 
1 1 1   14    1   59 o   63.231   2.6528  163.547   13.643  164.745   19.543  162.408   19.055   63.343   3.8024   62.899   3.7332 0.4441986 5.328747 
1 1 1   14    1   60 o  117.668   1.8882  564.869   18.110  543.089   28.567  579.505   23.418  115.246   3.0436  119.145   2.4112 -3.899139 3.882952 
1 1 1   14    1   61 o  190.228   2.0179  1476.61   31.290  1462.24   49.310  1486.30   40.485  189.131   3.1984  190.776   2.6034 -1.644989 4.124019 
1 1 1   14    1   62 o   90.399   1.9779  333.465   14.575  306.716   22.921  351.623   18.885   86.549   3.2547   92.761   2.4998 -6.211960 4.103894 
1 1 1   14    1   63 o   42.966   3.0334   75.834   10.556   68.270   16.794   80.775   13.572   40.426   5.2179   44.255   3.7989 -3.829399 6.454322 
1 1 1   14    1   64 o   98.827   1.9148  398.563   15.425  392.271   24.612  402.633   19.796   97.898   3.0880   99.291   2.4459 -1.393311 3.939291 
1 1 1   14    1   65 f   46.392   2.8431   88.300   10.700   95.611   17.348   83.811   13.594   48.058   4.4800   45.083   3.7325 2.975224 5.831140 
1 1 1   14    1   66 f   38.605   3.3079   61.434   10.309   57.857   17.020   63.507   12.957   37.011   5.8344   39.137   4.1232 -2.126423 7.144343 
1 1 1   14    1   67 o  139.332   1.8665  792.319   21.199  780.901   33.764  799.748   27.236  138.177   2.9976  139.924   2.3879 -1.746857 3.832514 
1 1 1   14    1   68 o  113.081   2.1214  522.140   19.555  518.204   27.894  525.944   27.422  112.503   3.0444  113.353   2.9703 -0.8500290 4.253385 
1 1 1   14    1   69 o   92.782   2.4096  351.982   18.209  403.354   29.355  319.855   23.214   99.131   3.6390   88.330   3.2295 10.80098 4.865403 
1 1 1   14    1   70 o  102.370   2.3133  428.177   19.303  430.099   30.064  426.828   25.179  102.357   3.6089  102.075   3.0295 0.2821350 4.711884 
1 1 1   14    1   71 o  156.412   2.2640  999.623   28.865  1043.44   44.262  967.193   38.077  159.551   3.4033  153.699   3.0391 5.852402 4.562729 
1 1 1   14    1   72 o   25.121   5.5884   27.138   11.148   21.263   15.279   33.827   16.302   22.737   7.2855   27.915   7.1375 -5.177565 10.19911 
1 1 1   14    1   73 o   80.758   2.0440  266.606   13.445  286.331   20.818  252.492   17.610   83.543   3.0621   78.494   2.7566 5.048935 4.120094 
1 1 1   14    1   74 o   56.315   2.3364  129.902   10.702  130.952   14.928  128.791   15.351   56.410   3.2602   55.921   3.3836 0.4896240 4.698682 
1 1 1   14    1   75 o   11.042   4.8805  -2.5961   8.6383   10.287   12.660 -13.8176   11.816   17.684   6.5772   10.712   5.0741 6.972090 8.307011 
1 1 1   14    1   76 o   84.473   1.6247  291.368   11.187  284.205   16.728  297.164   15.048   83.292   2.4665   85.220   2.1679 -1.928329 3.283823 
1 1 1   14    1   77 o  112.215   1.6556  514.276   15.144  492.443   22.515  532.315   20.465  109.659   2.5188  114.076   2.2008 -4.417000 3.344803 
1 1 1   14    1   78 o   50.648   2.1019  105.104   8.6592  102.097   15.457  106.480   10.453   49.610   3.8524   50.920   2.5263 -1.310261 4.606902 
1 1 1   14    1   79 o   54.041   2.0150  119.618   8.8608  132.552   15.600  113.458   10.766   56.645   3.3941   52.556   2.5204 4.088905 4.227547 
1 1 1   14    1   80 o  101.929   1.4991  424.357   12.456  435.392   21.543  418.815   15.267  103.034   2.5650  101.205   1.8506 1.829224 3.162857 
1 1 1   14    1   81 o   27.941   3.2414   32.580   7.2458   31.906   13.306   32.865   8.6389   26.946   6.1886   27.921   3.9020 -0.9754639 7.316095 
1 1 1   14    1   82 o   24.191   4.0238   24.896   7.6561   13.215   12.826   31.362   9.5426   18.693   6.6694   27.104   4.4753 -8.411022 8.031746 
1 1 1   14    1   83 o   31.126   3.0706   40.313   7.6894   46.264   12.968   37.086   9.5492   32.857   4.9993   29.610   4.0633 3.246891 6.442329 
1 1 1   14    1   84 o   75.579   1.8178  233.822   11.199  263.117   20.317  221.036   13.422   79.776   3.1303   73.366   2.2470 6.410538 3.853289 
1 1 1   14    1   85 o   21.159   4.3644   19.384   7.2774   16.895   12.110   20.791   9.1048   19.957   6.4940   21.756   5.2041 -1.798466 8.321936 
1 1 1   14    1   86 o   8.4932   3.9899  -7.1128   7.0359   2.0838   12.803 -11.0919   8.4216   14.725   6.2177   8.7435   4.1813 5.981320 7.492819 
1 1 1   14    1   87 o   52.453   1.8333  112.898   7.8268  121.156   12.616  107.732   9.9791   54.079   2.8723   51.113   2.4018 2.965668 3.744185 
1 1 1   14    1   88 o   24.992   3.1637   26.297   6.3009   24.979   10.044   27.152   8.0910   23.736   5.3227   25.146   4.0875 -1.410271 6.711082 
1 1 1   14    1   89 f   36.902   2.0946   56.135   6.2750   57.820   9.9291   55.015   8.0968   37.145   3.3140   36.383   2.7505 0.7622795 4.306746 
1 1 1   14    1   90 o   67.952   1.4570  188.997   8.0705  206.153   12.831  177.768   10.381   70.735   2.2282   65.768   1.9385 4.967720 2.953371 
1 1 1   14    1   91 o   40.019   1.9773   65.976   6.4302   67.429   10.560   65.120   8.1065   40.099   3.2587   39.626   2.5227 0.4723396 4.121058 
1 1 1   14    1   92 o   74.050   1.4158  224.505   8.5459  233.950   13.546  218.259   11.015   75.317   2.2087   72.871   1.8558 2.445183 2.884852 
1 1 1   14    1   93 o   68.376   1.6075  191.727   8.9597  183.381   12.575  200.335   12.770   66.611   2.3194   69.653   2.2520 -3.041832 3.232838 
1 1 1   14    1   94 o   34.607   2.1270   49.547   5.9712   55.446   9.7285   45.981   7.5635   36.242   3.3302   33.144   2.8265 3.098316 4.367991 
1 1 1   14    1   95 o   15.747   4.0548   10.930   5.2361   20.416   8.7611   5.6582   6.5309   21.271   5.1157   12.700   4.7238 8.570792 6.963127 
1 1 1   14    1   96 o   29.297   2.3608   35.730   5.5901   37.320   9.2919   34.829   6.9982   29.403   3.9789   28.728   3.0343 0.6751270 5.003850 
1 1 1   14    1   97 o   40.907   1.8485   69.009   6.1480   63.914   9.8886   72.220   7.8496   38.936   3.1423   41.713   2.3177 -2.776707 3.904587 
1 1 1   14    1   98 f   8.4653   3.6949  -0.6316   4.8116   7.3946   8.0903  -5.0243   5.9852   14.141   5.2580   8.0343   3.7434 6.106325 6.454448 
1 1 1   14    1   99 o   10.189   3.9898   2.9101   4.8164  -0.0018   8.3914   4.3407   5.8818   11.325   4.9119   11.604   4.4454 -0.2791376 6.624786 
1 1 1   14    1  100 o   24.950   2.8074   26.365   5.6106   28.470   9.0439   25.048   7.1536   25.218   4.5678   23.951   3.7901 1.266832 5.935458 
1 1 1   14    1  101 o   15.424   4.2159   10.684   5.4509   9.8536   9.7019   11.067   6.5891   15.612   5.7667   15.683   4.7479 -0.7129288E-01 7.469733 
1 1 1   14    1  102 o   27.877   3.0938   33.243   6.9122   20.057   10.470   43.429   9.2024   20.440   5.9351   31.640   3.6339 -11.20001 6.959214 
1 1 1   14    1  103 o   16.062   4.3830   11.775   5.8973   6.2679   9.5846   15.130   7.4811   13.964   5.5772   18.018   4.9447 -4.053836 7.453520 
1 1 1   14    1  104 o   14.748   3.8518   9.8112   4.6801   7.8512   8.6484   10.623   5.5654   14.230   5.4052   15.262   4.2939 -1.031540 6.903160 
1 1 1   14    1  105 f   32.955   2.9356   46.445   7.8036   44.241   9.7524   50.369   13.011   31.630   3.8625   32.959   4.9994 -1.329378 6.317701 
1 1 1   14    1  106 o   18.129   4.8916   15.599   7.3946   19.740   9.2872   8.4273   12.222   20.094   5.5072   15.354   6.2392 4.740115 8.322105 
1 1 1   14    1  107 o   14.525   5.5172   8.7668   9.0109   30.578   12.916 -11.9177   12.578   24.259   6.4289   10.717   5.1210 13.54186 8.219236 
1 1 1   14    1  108 o   44.064   2.8074   83.122   10.031   76.678   14.285   89.391   14.090   40.990   4.3412   44.729   3.9035 -3.738907 5.838109 
1 1 1   14    1  109 o   10.190   4.6879  -3.9167   8.9517  -8.6634   13.219   0.1037   12.166   11.466   5.4117   12.758   5.7057 -1.292027 7.863969 
1 1 1   14    1  110 o   36.624   3.3547   58.924   9.9038   40.086   13.914   78.268   14.100   27.726   6.3002   41.394   4.2384 -13.66834 7.593218 
1 1 1   14    1  111 o   10.214   4.7026  -3.8478   9.0314 -12.3748   13.090   3.8996   12.477   10.763   5.1645   13.753   5.9771 -2.989970 7.899178 
1 1 1   14    1  112 o   27.982   4.3224   36.415   9.5420   39.906   13.770   33.189   13.235   27.515   6.2786   24.793   6.4782 2.721727 9.021473 
1 1 1   14    1  113 o   17.022   5.7003   14.727   9.3089   18.016   13.343   11.608   12.993   18.268   6.7600   16.020   6.4607 2.247236 9.350880 
1 1 1   14    1  114 o   8.7216   4.2631 -14.9417   10.043  -3.8365   15.882 -22.3413   12.964   13.154   6.1185   9.3662   4.6297 3.788061 7.672671 
1 1 1   14    1  115 o   8.6548   4.2817 -20.3564   11.175 -14.5396   16.299 -25.5167   15.352   11.707   5.6541   10.107   5.0035 1.599902 7.550025 
1 1 1   14    1  116 o   17.357   6.3374   15.995   11.663   6.6287   17.091   24.157   15.955   15.354   6.8216   20.020   7.3952 -4.665858 10.06092 
1 1 1   14    1  117 o   29.374   5.2237   42.898   12.050   58.244   17.663   29.539   16.480   32.206   6.9334   21.732   7.5766 10.47370 10.27021 
1 1 1   14    1  118 o   18.742   6.3883   19.561   11.692   31.925   16.953   8.3436   16.148   22.338   7.6899   15.423   6.7495 6.914607 10.23180 
1 1 1   14    1  119 f   15.300   6.3790   10.158   13.215   1.5375   22.976   14.420   16.154   15.458   7.2453   16.840   7.0393 -1.381956 10.10184 
1 1 1   14    1  120 o   11.538   5.2873  -2.0702   11.236  -5.0809   15.803   1.0076   15.978   12.713   5.9746   13.815   6.3210 -1.101668 8.697726 
1 1 1   14    1  121 o   14.461   6.9350  -7.8353   23.530  -7.8353   23.530   0.0000   0.0000   14.461   6.9350  ?   ?  0.000000 6.934964 
1 1 1   14    2 -119 f   13.023   5.8108   2.2563   12.540   9.1504   17.772  -4.5793   17.696   15.797   6.9904   13.367   6.2946 2.430096 9.406847 
1 1 1   14    2 -118 o   17.514   6.9237   17.099   14.626   27.819   18.248  -2.1592   24.459   20.520   7.8378   15.229   7.2387 5.291243 10.66909 
1 1 1   14    2 -117 o   14.168   6.0898   6.5866   12.672  -0.8245   17.854   14.110   17.989   13.993   6.5015   16.910   7.2621 -2.917037 9.747123 
1 1 1   14    2 -116 o   12.290   5.6181  -1.2599   12.583   14.954   17.819 -17.3893   17.772   17.172   7.2967   11.796   5.7450 5.376141 9.286885 
1 1 1   14    2 -115 o   18.452   6.6495   19.071   12.784   30.247   18.051   7.8244   18.108   21.573   7.8830   15.729   7.0027 5.843865 10.54422 
1 1 1   14    2 -114 o   21.993   6.6350   27.381   12.884   40.969   18.570   14.770   17.890   25.195   8.0275   17.278   7.3252 7.917356 10.86740 
1 1 1   14    2 -113 o   12.676   5.8799  -3.5393   14.513  -3.6505   23.659  -3.4722   18.376   15.198   7.1931   13.930   6.5130 1.267937 9.703613 
1 1 1   14    2 -112 o   21.458   6.7607   26.032   13.204   30.668   18.492   21.210   18.860   21.931   7.9841   19.123   7.7579 2.807554 11.13243 
1 1 1   14    2 -111 o   18.841   6.1431   18.903   10.834   12.293   13.793   29.546   17.504   16.336   6.6319   21.833   7.7911 -5.496763 10.23145 
1 1 1   14    2 -110 f   24.773   6.2700   32.629   12.671   34.708   14.313   25.095   27.245   24.979   6.8331   20.216   8.8085 4.763264 11.14808 
1 1 1   14    2 -109 o   32.762   5.0245   51.516   12.991   53.317   14.588   44.617   28.554   32.684   5.6819   24.235   9.6439 8.448355 11.19328 
1 1 1   14    2 -108 o   21.540   6.4762   24.945   12.290   30.582   13.849   4.0617   26.656   23.571   6.8205   17.177   7.9680 6.394136 10.48854 
1 1 1   14    2 -107 o   14.557   6.0579   7.0865   11.885   9.5796   13.334  -2.5512   26.218   15.685   6.4616   16.338   7.6836 -0.6529856 10.03938 
1 1 1   14    2 -106 o   12.048   5.3166   0.5545   10.212   3.7686   12.925  -4.7859   16.661   14.004   6.0849   13.552   6.2908 0.4524870 8.752137 
1 1 1   14    2 -105 o   47.464   3.0608   97.001   11.779   90.814   14.900  107.312   19.235   44.977   4.1094   47.895   5.0004 -2.918873 6.472342 
1 1 1   14    2 -104 o   33.950   4.4879   52.537   12.116   38.697   16.221   70.002   18.222   26.783   7.2528   37.649   6.1496 -10.86670 9.508984 
1 1 1   14    2 -103 o   25.089   5.6318   30.499   11.234   34.253   15.009   25.717   16.942   25.547   7.0009   21.853   7.6775 3.693634 10.39024 
1 1 1   14    2 -102 o   12.150   5.3857  -0.6324   10.593  -1.9377   14.330   0.9399   15.728   13.558   6.1173   14.712   6.5396 -1.154168 8.954796 
1 1 1   14    2 -101 o   16.615   5.9296   12.305   10.139   13.184   13.201   11.040   15.833   17.492   6.6698   17.361   7.0838 0.1304188 9.729698 
1 1 1   14    2 -100 o   13.946   6.0239   2.2468   12.518   2.2468   12.518   0.0000   0.0000   13.946   6.0239  ?   ?  0.000000 6.023937 
1 1 1   14    2  -99 o   22.964   5.8060   25.074   10.873   17.951   12.902   42.531   20.198   19.527   6.7090   28.242   8.2555 -8.715298 10.63784 
1 1 1   14    2  -98 o   34.309   4.0778   51.363   11.182   48.077   13.412   58.854   20.248   32.513   5.2387   34.352   7.4461 -1.839230 9.104280 
1 1 1   14    2  -97 o   17.671   5.7818   14.050   9.5930   3.0185   12.640   29.033   14.731   14.418   6.1369   24.342   7.0315 -9.923205 9.332928 
1 1 1   14    2  -96 o   35.751   3.5823   54.624   10.299   43.095   13.493   70.713   15.940   30.712   5.5961   39.897   5.0116 -9.185774 7.512132 
1 1 1   14    2  -95 o   29.845   4.1089   38.687   9.7311   42.196   12.708   33.712   15.131   30.616   5.2827   26.471   6.9318 4.145277 8.715328 
1 1 1   14    2  -94 o   67.967   2.3055  191.261   12.755  182.577   16.611  203.736   19.910   65.992   3.0966   69.434   3.5293 -3.441544 4.695152 
1 1 1   14    2  -93 o   42.985   2.9948   77.444   10.428   89.840   13.821   61.062   15.888   45.979   3.7193   36.988   5.4314 8.991879 6.582851 
1 1 1   14    2  -92 o   41.497   1.9097   70.986   6.4426   66.557   13.826   72.215   7.2815   39.241   4.3979   41.794   2.1445 -2.553013 4.892880 
1 1 1   14    2  -91 o   31.123   2.4733   40.311   6.2232   57.114   16.963   37.698   6.6897   35.491   6.0822   30.013   2.7654 5.477591 6.681396 
1 1 1   14    2  -90 o   41.741   1.9469   71.786   6.6060   68.092   13.810   72.882   7.5225   39.817   4.3243   41.995   2.2052 -2.177681 4.854169 
1 1 1   14    2  -89 o   16.974   4.0250   12.622   5.4840   10.986   12.237   13.033   6.1346   17.251   6.4562   17.202   4.3677 0.4919815E-01 7.794835 
1 1 1   14    2  -88 o   48.826   1.8593   97.998   7.3867   78.066   14.344  105.191   8.6171   42.827   4.1613   50.532   2.0965 -7.704540 4.659584 
1 1 1   14    2  -87 o   22.662   4.4059   22.385   7.8458   27.273   12.796   19.441   9.9320   24.476   6.3572   20.842   5.6884 3.634565 8.530609 
1 1 1   14    2  -86 o   55.388   2.1765  126.311   9.8076  123.729   15.100  128.195   12.899   54.416   3.4215   55.599   2.8557 -1.183010 4.456600 
1 1 1   14    2  -85 o   50.362   1.9278  104.186   7.8994  110.060   16.999  102.568   8.9211   51.075   4.1180   49.911   2.1981 1.163506 4.667892 
1 1 1   14    2  -84 o   59.418   2.0222  145.001   9.7800   0.0000   0.0000  145.001   9.7800  ?   ?    59.418   2.0222 0.000000 2.022173 
1 1 1   14    2  -83 o   76.208   1.7871  237.830   11.101  224.871   20.503  243.205   13.204   73.564   3.4287   76.966   2.1067 -3.402168 4.024140 
1 1 1   14    2  -82 o   92.660   1.6162  351.190   12.207  338.478   19.670  359.153   15.568   90.651   2.6648   93.605   2.0403 -2.953621 3.356172 
1 1 1   14    2  -81 f   97.344   1.6132  387.500   12.800  420.142   21.369  369.232   15.986  101.063   2.5960   94.921   2.0660 6.141502 3.317827 
1 1 1   14    2  -80 f   46.851   2.3180   90.246   8.8251  101.202   19.180   87.304   9.9398   48.926   4.8740   46.015   2.6613 2.910927 5.553292 
1 1 1   14    2  -79 o   23.690   3.9962   23.874   7.4428   38.779   17.237   20.458   8.2516   29.464   7.2316   21.730   4.7879 7.733927 8.672929 
1 1 1   14    2  -78 o   62.606   2.0107  160.564   10.248  188.560   21.395  152.228   11.674   67.392   3.9116   60.899   2.3562 6.492031 4.566378 
1 1 1   14    2  -77 o   55.571   2.1532  126.596   9.7355   83.877   19.546  140.690   11.227   44.431   5.5152   58.555   2.3570 -14.12442 5.997776 
1 1 1   14    2  -76 o   19.055   4.7589   15.669   7.3694   21.804   17.469   14.341   8.1280   23.122   7.8093   18.307   5.2024 4.815344 9.383536 
1 1 1   14    2  -75 o   71.514   2.0638  209.319   12.018  204.782   30.173  210.174   13.102   69.910   5.3350   71.632   2.2467 -1.722794 5.788754 
1 1 1   14    2  -74 o   18.670   3.8897   14.890   5.7273   10.201   7.5395   21.286   8.8067   15.870   5.1209   22.224   4.9844 -6.354395 7.146206 
1 1 1   14    2  -73 o   17.409   4.1800   12.997   5.8567   9.1325   7.6499   18.469   9.1039   15.321   5.1678   20.698   5.3554 -5.376764 7.442190 
1 1 1   14    2  -72 o   68.239   2.0364  190.467   11.315  177.869   19.465  196.896   13.906   65.680   3.6500   69.326   2.4646 -3.645317 4.404180 
1 1 1   14    2  -71 o   52.292   1.9114  111.843   8.1338  103.241   10.970  122.345   12.122   50.149   2.6934   54.599   2.7323 -4.449837 3.836673 
1 1 1   14    2  -70 o   28.082   3.2050   32.738   7.2054   38.626   10.142   26.736   10.239   30.355   4.2122   24.976   5.1984 5.378788 6.690785 
1 1 1   14    2  -69 o   67.527   2.3336  186.597   12.826  199.853   22.574  180.278   15.585   69.623   3.9943   66.300   2.8908 3.323181 4.930654 
1 1 1   14    2  -68 o   23.699   4.5953   23.899   8.5569   17.392   18.199   25.746   9.6953   22.016   7.9338   24.548   5.0149 -2.532145 9.385811 
1 1 1   14    2  -67 o   74.808   1.8368  228.443   11.200  220.868   14.852  238.430   17.054   73.468   2.4836   76.302   2.7465 -2.834908 3.702896 
1 1 1   14    2  -66 o   77.901   1.7447  247.673   11.079  252.872   14.330  239.947   17.468   78.649   2.2374   76.545   2.8043 2.104416 3.587544 
1 1 1   14    2  -65 o   52.116   2.0843  111.078   8.8369  110.260   11.625  112.197   13.600   51.857   2.7601   52.258   3.2081 -0.4006805 4.232058 
1 1 1   14    2  -64 o   13.982   4.9916   6.8780   7.1856  -6.8457   9.7376   23.285   10.647   10.740   4.9218   23.297   5.6626 -12.55634 7.502659 
1 1 1   14    2  -63 o  175.120   1.9182  1251.66   27.383  1277.52   36.293  1217.48   41.722  176.831   2.5178  172.546   2.9664 4.285736 3.890872 
1 1 1   14    2  -62 o   74.152   1.8633  224.532   11.254  201.663   14.302  261.705   18.234   70.216   2.5028   79.968   2.8016 -9.751541 3.756735 
1 1 1   14    2  -61 o   85.349   1.7812  297.226   12.392  316.848   16.069  268.423   19.468   88.065   2.2402   80.977   2.9542 7.088142 3.707590 
1 1 1   14    2  -60 o  250.106   2.0927  2553.19   42.665  2531.10   52.406  2596.62   73.473  248.928   2.5827  251.875   3.5785 -2.947083 4.413186 
1 1 1   14    2  -59 o  160.583   1.7336  1051.99   22.693  1031.69   28.088  1090.16   38.508  158.984   2.1674  163.334   2.8923 -4.349976 3.614256 
1 1 1   14    2  -58 f  113.060   1.5716  521.365   14.484  498.686   19.206  551.269   22.054  110.539   2.1315  116.206   2.3282 -5.666672 3.156599 
1 1 1   14    2  -57 o  182.683   1.6722  1361.29   24.901  1357.80   33.251  1365.74   37.575  182.392   2.2365  182.889   2.5204 -0.4976807 3.369635 
1 1 1   14    2  -56 o  116.215   1.5667  550.841   14.842  543.697   19.969  559.659   22.184  115.427   2.1223  117.094   2.3242 -1.667587 3.147403 
1 1 1   14    2  -55 o   40.982   2.5080   68.822   8.3382   66.420   11.472   71.512   12.140   40.148   3.5418   41.661   3.6104 -1.513657 5.057563 
1 1 1   14    2  -54 o   37.567   2.7499   57.935   8.3626   48.575   11.812   67.341   11.841   34.172   4.3382   40.420   3.6324 -6.247459 5.658161 
1 1 1   14    2  -53 o  114.357   1.5828  533.321   14.754  524.820   19.969  543.542   21.895  113.412   2.1600  115.407   2.3274 -1.994926 3.175318 
1 1 1   14    2  -52 o   15.093   5.2517   8.3425   7.9157   11.919   11.266   4.8557   11.124   18.002   6.2652   15.131   6.0199 2.871516 8.688672 
1 1 1   14    2  -51 o   49.827   2.7460  101.661   11.110  101.244   13.304  102.621   20.195   49.673   3.3046   49.791   5.0452 -0.1181068 6.031123 
1 1 1   14    2  -50 o  205.979   1.7863  1730.38   29.993  1731.26   39.909  1729.23   45.464  205.980   2.3769  205.822   2.7098 0.1572418 3.604543 
1 1 1   14    2  -49 o  154.516   1.7641  973.692   22.220  960.266   31.247  987.425   31.603  153.399   2.4989  155.554   2.4924 -2.154648 3.529335 
1 1 1   14    2  -48 o   93.980   1.8795  360.225   14.398  360.441   20.586  360.018   20.146   93.936   2.6912   93.885   2.6350 0.5094910E-01 3.766452 
1 1 1   14    2  -47 o   80.386   2.1357  263.789   13.982  334.112   26.807  237.507   16.388   90.351   3.6473   76.240   2.6410 14.11117 4.503035 
1 1 1   14    2  -46 o   62.801   2.1969  161.089   11.229  131.450   22.419  171.015   12.974   56.449   4.9212   64.692   2.4648 -8.242523 5.503959 
1 1 1   14    2  -45 o  146.750   1.5004  878.103   17.949  886.518   26.269  870.735   24.581  147.417   2.1860  146.106   2.0640 1.311188 3.006429 
1 1 1   14    2  -44 o  120.047   1.4764  587.597   14.448  598.131   21.281  578.590   19.678  121.092   2.1559  119.103   2.0269 1.988655 2.959105 
1 1 1   14    2  -43 o   53.913   1.9440  118.697   8.5294  132.980   13.331  108.799   11.098   57.007   2.8782   51.567   2.6491 5.439705 3.911748 
1 1 1   14    2  -42 o  102.006   1.4723  424.245   12.242  439.808   18.534  412.201   16.304  103.837   2.1897  100.532   1.9896 3.304581 2.958609 
1 1 1   14    2  -41 o  108.185   1.4451  477.193   12.744  496.374   19.091  461.777   17.115  110.316   2.1230  106.408   1.9732 3.908424 2.898414 
1 1 1   14    2  -40 o  153.370   1.4711  959.048   18.392  964.838   26.859  953.936   25.236  153.802   2.1424  152.937   2.0243 0.8652802 2.947442 
1 1 1   14    2  -39 o  180.447   1.6538  1327.67   24.326  1371.43   39.549  1301.05   30.852  183.334   2.6464  178.603   2.1191 4.730530 3.390307 
1 1 1   14    2  -38 o   78.472   1.6648  251.083   10.649  253.339   18.492  249.964   13.026   78.737   2.8860   78.261   2.0436 0.4753876 3.536267 
1 1 1   14    2  -37 o   20.987   4.7263   18.728   7.8907   24.122   18.206   17.480   8.7558   24.589   7.9595   20.290   5.2531 4.298952 9.536705 
1 1 1   14    2  -36 o  108.257   1.6697  477.861   14.734  467.655   29.065  481.391   17.094  106.976   3.3371  108.649   1.9301 -1.672379 3.855093 
1 1 1   14    2  -35 o   93.502   1.3662  356.427   10.413  345.117   14.330  369.078   15.156   91.995   1.9109   95.134   1.9544 -3.138870 2.733379 
1 1 1   14    2  -34 o   94.464   1.3592  363.791   10.466  357.759   14.457  370.434   15.172   93.665   1.8935   95.309   1.9528 -1.643250 2.720107 
1 1 1   14    2  -33 o  147.925   1.3595  892.076   16.392  884.832   22.344  900.520   24.123  147.306   1.8608  148.600   1.9915 -1.294739 2.725538 
1 1 1   14    2  -32 o  294.526   1.8767  3537.25   45.056  3538.15   60.778  3536.16   67.133  294.503   2.5317  294.391   2.7975 0.1119690 3.773045 
1 1 1   14    2  -31 o  262.471   1.8378  2809.12   39.320  2830.58   56.254  2788.62   54.982  263.409   2.6199  261.452   2.5799 1.956360 3.676913 
1 1 1   14    2  -30 o   81.237   1.4834  269.058   9.8232  272.390   14.572  266.282   13.299   81.695   2.1903   80.807   2.0190 0.8881226 2.978842 
1 1 1   14    2  -29 o  180.312   1.5113  1325.53   22.214  1356.02   32.296  1298.17   30.602  182.344   2.1728  178.416   2.1041 3.928177 3.024664 
1 1 1   14    2  -28 o  135.737   1.4100  751.134   15.601  745.114   22.527  756.683   21.627  135.172   2.0445  136.221   1.9476 -1.048859 2.823705 
1 1 1   14    2  -27 o   14.742   4.8106   8.5384   6.6429   11.475   10.279   6.4323   8.7047   17.506   5.9893   14.545   5.4449 2.961163 8.094375 
1 1 1   14    2  -26 o  243.487   2.0295  2417.62   40.281  2341.40   56.833  2494.56   57.100  239.550   2.9105  247.268   2.8329 -7.718018 4.061580 
1 1 1   14    2  -25 o  114.806   1.7499  537.411   16.376  581.217   28.257  515.257   20.095  119.352   2.9044  112.402   2.1932 6.950180 3.639447 
1 1 1   14    2  -24 o  160.942   1.8374  1056.16   24.105  989.659   38.646  1098.51   30.840  155.735   3.0443  164.117   2.3053 -8.381958 3.818647 
1 1 1   14    2  -23 o  217.395   1.9067  1927.09   33.788  1948.61   59.664  1916.93   40.996  218.502   3.3498  216.798   2.3198 1.704453 4.074628 
1 1 1   14    2  -22 o  198.585   1.6784  1607.86   27.170  1543.67   40.966  1658.28   36.303  194.534   2.5834  201.648   2.2086 -7.114243 3.398796 
1 1 1   14    2  -21 f   99.926   1.4955  407.081   12.182  378.799   18.859  427.327   15.957   96.372   2.4007  102.372   1.9122 -6.000198 3.069194 
1 1 1   14    2  -20 o  201.375   1.5903  1653.29   26.104  1648.27   37.406  1658.05   36.447  201.037   2.2826  201.636   2.2175 -0.5989838 3.182355 
1 1 1   14    2  -19 o  204.024   1.7234  1697.16   28.661  1673.51   37.907  1728.71   43.793  202.570   2.2957  205.866   2.6097 -3.295288 3.475691 
1 1 1   14    2  -18 o  324.324   2.2868  4289.75   60.457  4290.55   80.196  4288.69   92.017  324.279   3.0339  324.154   3.4824 0.1256104 4.618610 
1 1 1   14    2  -17 o  141.223   1.6627  813.122   19.141  826.318   24.024  790.184   31.673  142.352   2.0704  139.176   2.7919 3.175583 3.475754 
1 1 1   14    2  -16 o   68.815   1.7840  193.210   9.9989  181.191   13.482  207.902   14.906   66.605   2.4875   71.348   2.5672 -4.742569 3.574703 
1 1 1   14    2  -15 f  114.338   1.5461  532.974   14.410  536.696   19.509  528.506   21.375  114.724   2.0861  113.839   2.3035 0.8849258 3.107739 
1 1 1   14    2  -14 o   41.647   2.2448   70.940   7.5927   79.131   11.695   64.972   9.9825   43.913   3.2911   39.784   3.1027 4.128841 4.523060 
1 1 1   14    2  -13 o  229.983   1.7055  2156.46   31.973  2153.16   45.741  2159.60   44.711  229.768   2.4422  230.115   2.3836 -0.3470764 3.412585 
1 1 1   14    2  -12 o  151.102   1.6309  930.844   20.088  884.258   33.822  956.233   24.969  147.229   2.8182  153.137   2.0002 -5.908524 3.455848 
1 1 1   14    2  -11 o   17.378   4.7127   12.744   6.8428   11.308   10.496   13.805   9.0241   17.509   6.0498   18.331   5.5578 -0.8216057 8.215244 
1 1 1   14    2  -10 o  170.270   1.4970  1181.93   20.778  1171.75   29.750  1191.62   29.032  169.513   2.1530  170.947   2.0835 -1.434219 2.996065 
1 1 1   14    2   -9 o   91.835   1.4799  343.814   11.078  328.095   16.273  357.392   15.124   89.697   2.2256   93.622   1.9818 -3.924515 2.980074 
1 1 1   14    2   -8 o  270.709   1.8838  2988.00   41.570  2946.91   58.658  3029.45   58.921  268.788   2.6772  272.528   2.6523 -3.740021 3.768567 
1 1 1   14    2   -7 o  219.735   1.7790  1968.58   31.864  1967.69   42.707  1969.70   47.856  219.655   2.3852  219.750   2.6716 -0.9513855E-01 3.581450 
1 1 1   14    2   -6 o   95.367   1.6767  370.792   13.034  396.523   17.112  335.237   20.116   98.611   2.1289   90.615   2.7264 7.995415 3.459090 
1 1 1   14    2   -5 o  242.622   1.8809  2400.12   37.199  2440.31   50.255  2351.43   55.324  244.608   2.5204  240.090   2.8268 4.517319 3.787282 
1 1 1   14    2   -4 o  125.115   1.6063  638.182   16.382  642.931   23.876  633.957   22.518  125.560   2.3328  124.684   2.2156 0.8758011 3.217236 
1 1 1   14    2   -3 o   64.515   1.8782  169.849   9.8666  169.794   14.658  169.895   13.342   64.457   2.7964   64.491   2.5429 -0.3452301E-01 3.779716 
1 1 1   14    2   -2 o  137.774   1.6345  773.869   18.356  766.366   26.411  780.879   25.530  137.083   2.3636  138.379   2.2633 -1.295364 3.272459 
1 1 1   14    2   -1 o  277.790   2.2016  3146.77   49.854  3129.56   70.591  3163.90   70.418  276.957   3.1268  278.474   3.1021 -1.517853 4.404553 
1 1 1   14    2    0 o   78.875   1.7429  253.644   11.206  240.122   16.232  265.959   15.490   76.684   2.6004   80.722   2.3566 -4.037483 3.509408 
1 1 1   14    2    1 o  268.891   2.6218  2949.02   57.467  2841.76   79.301  3067.66   83.396  263.861   3.6869  274.143   3.7319 -10.28223 5.246005 
1 1 1   14    2    2 o  142.924   1.9736  832.911   22.994  786.746   31.983  882.298   33.080  138.876   2.8252  147.071   2.7593 -8.194748 3.949173 
1 1 1   14    2    3 o   95.058   1.8125  368.412   14.044  361.375   18.699  377.519   21.273   94.100   2.4398   96.166   2.7164 -2.065605 3.651239 
1 1 1   14    2    4 o  117.472   1.7820  562.635   17.064  542.502   22.389  590.537   26.358  115.336   2.3814  120.324   2.6873 -4.987823 3.590672 
1 1 1   14    2    5 o  171.496   2.9235  1199.82   40.868   0.0000   0.0000  1199.82   40.868  ?   ?   171.496   2.9235 0.000000 2.923458 
1 1 1   14    2    6 o   85.837   2.3574  300.707   16.479   0.0000   0.0000  300.707   16.479  ?   ?    85.837   2.3574 0.000000 2.357397 
1 1 1   14    2    7 o  193.643   2.2177  1529.13   35.006  1461.82   71.183  1550.60   40.204  189.165   4.6164  194.982   2.5295 -5.817551 5.263983 
1 1 1   14    2    8 o  255.621   2.2859  2664.69   47.631  2667.79   75.833  2662.67   61.213  255.657   3.6388  255.476   2.9394 0.1811066 4.677728 
1 1 1   14    2    9 o  207.502   1.8627  1755.57   31.507  1750.43   44.919  1760.54   44.204  207.158   2.6601  207.757   2.6101 -0.5998535 3.726780 
1 1 1   14    2   10 o  271.029   2.1708  2995.47   47.959  3052.55   69.109  2942.46   66.607  273.525   3.0996  268.553   3.0427 4.972351 4.343416 
1 1 1   14    2   11 o  336.185   2.7779  4610.37   76.125  4620.80   98.623  4594.99  119.735  336.467   3.5958  335.409   4.3794 1.057587 5.666479 
1 1 1   14    2   12 o  117.692   1.6447  564.721   15.779  571.894   22.842  558.175   21.822  118.418   2.3664  116.992   2.2882 1.426514 3.291764 
1 1 1   14    2   13 o  108.825   1.9747  482.897   17.517  478.007   25.398  487.333   24.193  108.207   2.8820  109.302   2.7153 -1.094963 3.959655 
1 1 1   14    2   14 o  248.584   2.0612  2519.78   41.767  2525.32   59.445  2514.38   58.698  248.796   2.9311  248.259   2.9006 0.5373077 4.123700 
1 1 1   14    2   15 f  223.430   1.9444  2035.53   35.412  2043.54   50.518  2027.79   49.654  223.819   2.7689  222.958   2.7321 0.8614044 3.889896 
1 1 1   14    2   16 o  249.366   2.0732  2535.69   42.141  2406.96   58.010  2679.54   61.322  242.894   2.9299  256.278   2.9354 -13.38411 4.147386 
1 1 1   14    2   17 o  295.663   2.5293  3565.51   60.959  3629.19   97.999  3525.31   77.854  298.121   4.0327  293.921   3.2495 4.200195 5.178956 
1 1 1   14    2   18 o  275.178   2.2014  3088.01   49.381  3115.80   70.655  3061.47   69.043  276.332   3.1367  273.917   3.0922 2.415344 4.404593 
1 1 1   14    2   19 o  212.500   1.9017  1841.23   32.942  1907.79   48.079  1782.35   45.224  216.257   2.7274  209.032   2.6541 7.225739 3.805689 
1 1 1   14    2   20 o  337.703   2.5480  4651.71   70.140  4758.38  101.298  4553.48   97.213  341.415   3.6398  333.993   3.5707 7.421661 5.098840 
1 1 1   14    2   21 f   96.449   1.7031  379.275   13.390  380.091   19.657  378.568   18.289   96.501   2.5010   96.344   2.3288 0.1564484 3.417325 
1 1 1   14    2   22 o  116.543   1.6557  553.763   15.729  590.533   23.366  523.292   21.270  120.328   2.3822  113.273   2.3036 7.054970 3.313842 
1 1 1   14    2   23 o   31.917   3.3333   42.029   8.5448   31.929   12.869   49.994   11.428   27.405   5.9328   34.746   4.1145 -7.340221 7.219958 
1 1 1   14    2   24 o  185.489   1.9766  1403.00   29.887  1459.08   49.317  1370.45   37.572  189.085   3.1997  183.297   2.5146 5.787796 4.069557 
1 1 1   14    2   25 o  177.694   2.2091  1287.73   31.998  1345.28   46.778  1237.12   43.865  181.562   3.1607  174.115   3.0906 7.446564 4.420616 
1 1 1   14    2   26 o  176.679   2.5648  1273.35   36.938  1287.97   45.975  1246.72   62.040  177.650   3.1748  174.681   4.3570 2.969009 5.391019 
1 1 1   14    2   27 o  141.032   2.4671  811.312   28.363  841.492   35.701  759.666   46.702  143.601   3.0499  136.301   4.2085 7.299942 5.197388 
1 1 1   14    2   28 o  162.790   2.1489  1080.75   28.515  1084.07   33.038  1071.07   56.463  163.022   2.4862  161.855   4.2833 1.167007 4.952594 
1 1 1   14    2   29 o   60.232   2.3184  148.187   11.361  155.515   15.531  139.751   16.664   61.653   3.1003   58.403   3.5166 3.250652 4.688075 
1 1 1   14    2   30 o   65.755   2.0019  176.484   10.718  179.951   15.936  173.622   14.482   66.342   2.9543   65.178   2.7319 1.164246 4.023858 
1 1 1   14    2   31 o  254.043   2.0969  2631.99   43.423  2569.49   60.867  2696.77   61.968  250.932   2.9757  257.074   2.9571 -6.142090 4.195173 
1 1 1   14    2   32 o   43.774   2.6065   78.448   9.2585   74.764   13.955   81.345   12.374   42.588   4.0692   44.506   3.4375 -1.918587 5.326787 
1 1 1   14    2   33 o   72.924   1.9150  217.005   11.373  206.912   16.784  225.576   15.466   71.149   2.9000   74.316   2.5568 -3.167107 3.866168 
1 1 1   14    2   34 o  305.327   2.3716  3802.69   59.026  3764.31   83.281  3841.44   83.672  303.657   3.3645  306.754   3.3462 -3.097778 4.745227 
1 1 1   14    2   35 o  145.199   1.6978  859.638   20.095  840.746   28.865  877.406   27.992  143.560   2.4666  146.663   2.3414 -3.103043 3.400900 
1 1 1   14    2   36 o   33.044   3.3583   45.035   8.9202   38.292   13.703   49.993   11.751   30.074   5.8000   34.721   4.2397 -4.646814 7.184402 
1 1 1   14    2   37 o   87.351   1.9102  311.160   13.601  302.688   21.905  316.476   17.351   86.057   3.1279   88.046   2.4199 -1.989349 3.954686 
1 1 1   14    2   38 o  132.743   1.8317  718.548   19.819  727.102   31.970  713.209   25.259  133.476   2.9383  132.227   2.3435 1.249054 3.758411 
1 1 1   14    2   39 o  227.456   2.1630  2110.19   40.104  2096.56   63.498  2119.24   51.726  226.592   3.4378  227.887   2.7846 -1.295624 4.424060 
1 1 1   14    2   40 o  160.484   1.8909  1050.32   24.737  1045.17   39.522  1053.64   31.718  160.018   3.0300  160.708   2.4212 -0.6900330 3.878525 
1 1 1   14    2   41 o  116.110   1.8557  549.790   17.564  551.868   28.346  548.496   22.377  116.238   2.9942  115.953   2.3675 0.2852249 3.817064 
1 1 1   14    2   42 o  232.671   2.1958  2208.24   41.646  2210.24   66.263  2206.94   53.541  232.631   3.4944  232.540   2.8246 0.9057617E-01 4.493219 
1 1 1   14    2   43 o  166.559   1.9401  1131.43   26.341  1108.68   41.869  1146.32   33.888  164.790   3.1169  167.617   2.4803 -2.826309 3.983342 
1 1 1   14    2   44 o   99.119   1.9596  400.696   15.832  415.352   25.874  391.924   20.018  100.811   3.1525   97.974   2.5085 2.836784 4.028768 
1 1 1   14    2   45 o  254.971   2.3400  2652.34   48.634  2671.00   77.637  2640.28   62.393  255.669   3.7253  254.307   3.0098 1.361588 4.789236 
1 1 1   14    2   46 o   74.038   2.7675  224.054   16.673  201.042   28.660  235.826   20.499   69.881   5.0657   75.914   3.3206 -6.033310 6.057089 
1 1 1   14    2   47 o  126.714   2.4684  655.187   25.496  571.399   42.555  702.106   31.844  118.098   4.4283  131.137   2.9790 -13.03914 5.337094 
1 1 1   14    2   48 o  128.707   2.4633  675.957   25.843  635.798   44.745  696.059   31.657  124.586   4.4130  130.571   2.9743 -5.985397 5.321731 
1 1 1   14    2   49 o   68.274   2.8841  190.638   16.015  154.946   27.769  208.427   19.604   61.212   5.6282   71.351   3.3802 -10.13891 6.565245 
1 1 1   14    2   50 o   63.893   2.3926  166.816   12.439  175.619   20.516  161.699   15.643   65.428   3.8640   62.852   3.0625 2.576290 4.930421 
1 1 1   14    2   51 o  103.822   1.9499  439.681   16.502  442.518   26.909  437.971   20.891  104.037   3.1768  103.593   2.4740 0.4434509 4.026465 
1 1 1   14    2   52 o  148.640   1.8903  901.218   22.904  913.464   36.858  893.514   29.233  149.551   3.0234  147.964   2.4237 1.587097 3.874965 
1 1 1   14    2   53 o  111.688   1.8860  508.844   17.170  509.783   27.864  508.269   21.801  111.671   3.0640  111.595   2.3966 0.7577515E-01 3.889932 
1 1 1   14    2   54 o   62.241   2.3419  158.330   11.861  144.453   19.331  166.707   15.020   59.278   4.0245   63.823   2.8945 -4.544407 4.957347 
1 1 1   14    2   55 o  209.028   2.3567  1783.42   40.156  1750.94   56.132  1817.47   57.470  206.965   3.3272  210.857   3.3436 -3.892334 4.716980 
1 1 1   14    2   56 o  131.491   2.1272  705.567   22.800  678.710   31.695  734.371   32.823  128.883   3.0168  134.065   3.0035 -5.182205 4.257053 
1 1 1   14    2   57 o   62.587   2.3309  160.120   11.871  174.212   19.854  152.277   14.810   65.141   3.7549   60.974   2.9889 4.166939 4.799208 
1 1 1   14    2   58 f   84.941   2.0208  294.420   13.992  294.367   22.997  294.452   17.631   84.780   3.3342   84.877   2.5512 -0.9703827E-01 4.198235 
1 1 1   14    2   59 o  106.859   1.8799  465.914   16.375  450.463   26.668  475.266   20.747  104.924   3.1215  107.892   2.3590 -2.967346 3.912634 
1 1 1   14    2   60 o  158.921   1.9033  1030.60   24.656  1046.27   40.144  1021.10   31.244  159.971   3.0785  158.129   2.4239 1.842010 3.918263 
1 1 1   14    2   61 o   36.569   3.4363   55.204   10.123   94.558   17.640   35.881   12.361   47.777   4.5858   29.068   5.4160 18.70939 7.096635 
1 1 1   14    2   62 o  201.995   2.0622  1665.58   33.956  1737.06   55.525  1622.88   42.916  206.033   3.3061  199.290   2.6418 6.743195 4.231944 
1 1 1   14    2   63 o   88.149   1.9721  317.159   14.170  346.325   23.956  301.462   17.575   91.947   3.2011   85.863   2.5137 6.083176 4.070141 
1 1 1   14    2   64 o   68.010   2.4888  189.233   13.774  176.266   20.400  200.097   18.673   65.462   3.8400   69.842   3.2892 -4.380112 5.056106 
1 1 1   14    2   65 o   24.298   6.2149   25.376   12.357   39.219   25.689   21.208   14.095   30.423   9.4066   22.581   6.9654 7.842316 11.70474 
1 1 1   14    2   66 o   49.821   3.3616  102.122   13.572   82.566   25.335  109.992   16.073   43.944   7.3307   51.641   3.8458 -7.696987 8.278214 
1 1 1   14    2   67 o   25.595   4.9060   27.881   9.8635   24.950   20.129   28.807   11.315   24.993   8.3824   25.924   5.5237 -0.9305496 10.03870 
1 1 1   14    2   68 o   20.649   5.2050   18.289   8.7568   12.290   14.508   21.727   10.983   19.143   7.0551   22.490   5.9137 -3.346643 9.205785 
1 1 1   14    2   69 o   85.911   1.9110  301.393   13.383  304.281   20.958  299.404   17.391   86.152   2.9888   85.533   2.4969 0.6185608 3.894589 
1 1 1   14    2   70 o  138.455   1.9867  783.031   22.422  782.766   39.601  783.156   27.201  138.062   3.5217  138.394   2.4112 -0.3315887 4.268075 
1 1 1   14    2   71 o   8.1382   3.9971 -18.6144   9.1595 -19.8999   15.081 -17.8630   11.530   11.747   5.6114   9.8785   4.7672 1.868069 7.362972 
1 1 1   14    2   72 o   57.147   2.5214  133.906   11.716   86.118   18.010  168.969   15.427   45.353   4.9520   64.139   2.9586 -18.78641 5.768527 
1 1 1   14    2   73 o   70.475   2.0971  203.228   12.034  211.036   19.460  198.393   15.313   71.604   3.3432   69.540   2.7066 2.063629 4.301478 
1 1 1   14    2   74 o   14.639   5.6794   5.8236   9.6879   7.4059   14.351   4.4989   13.131   17.321   6.8549   15.856   6.4582 1.465247 9.417926 
1 1 1   14    2   75 o   12.589   5.0416   3.3121   7.8538   5.8200   11.172   0.8615   11.043   15.347   6.0560   13.616   5.7632 1.731256 8.359976 
1 1 1   14    2   76 o  103.940   1.5956  441.286   13.519  460.748   18.903  420.906   19.343  106.107   2.1855  101.385   2.3406 4.721695 3.202257 
1 1 1   14    2   77 o   10.454   4.3993   0.6560   6.3745  -1.6226   10.786   1.8792   7.9023   12.702   5.5382   12.018   4.9649 0.6835127 7.437876 
1 1 1   14    2   78 o   78.686   1.6849  253.070   10.807  250.219   14.962  256.180   15.627   78.101   2.3529   79.010   2.4292 -0.9088669 3.381914 
1 1 1   14    2   79 o   93.651   1.6322  358.496   12.460  360.567   19.289  357.013   16.322   93.699   2.5277   93.359   2.1448 0.3395691 3.315082 
1 1 1   14    2   80 f   39.273   2.4018   63.523   7.6522   56.496   11.330   69.415   10.376   36.722   3.8419   40.916   3.1350 -4.193726 4.958647 
1 1 1   14    2   81 f   56.799   1.7538  132.131   8.1102  127.866   14.294  134.156   9.8490   55.568   3.1688   57.170   2.1171 -1.601578 3.810977 
1 1 1   14    2   82 o   30.059   2.6872   37.478   6.5150   37.913   11.840   37.289   7.8025   29.602   5.0901   29.862   3.2582 -0.2596302 6.043619 
1 1 1   14    2   83 o   50.144   1.9145  103.187   7.8109  119.322   13.493   95.055   9.5791   53.641   3.0992   48.017   2.4555 5.623234 3.953988 
1 1 1   14    2   84 o   30.158   2.6514   37.766   6.4519   50.535   10.909   30.897   8.0013   34.579   3.9406   26.995   3.7362 7.583517 5.430189 
1 1 1   14    2   85 o   45.003   1.9381   83.229   7.0931   91.629   11.539   78.127   8.9926   46.952   3.0312   43.468   2.5491 3.484215 3.960564 
1 1 1   14    2   86 o   25.473   2.8990   27.182   5.9126   40.710   10.372   20.670   7.1964   30.842   4.2374   21.833   4.1961 9.009678 5.963411 
1 1 1   14    2   87 o   9.0191   3.9075  -0.5023   5.2983 -10.5181   9.3139   4.2895   6.4423   9.4682   4.4907   12.041   4.6422 -2.573147 6.458830 
1 1 1   14    2   88 o   41.538   1.9083   70.997   6.4443   77.078   11.070   67.880   7.9259   42.929   3.1860   40.499   2.4118 2.430916 3.995939 
1 1 1   14    2   89 o   49.500   1.6884  100.603   6.8026  102.078   11.337   99.773   8.5036   49.539   2.8190   49.189   2.1258 0.3502502 3.530673 
1 1 1   14    2   90 o   32.484   2.2376   43.704   5.8887   55.849   10.414   37.995   7.1397   36.328   3.5625   30.096   2.9481 6.232489 4.624135 
1 1 1   14    2   91 o   12.641   4.2161   6.5124   5.0931   14.307   9.2887   3.1615   6.0902   18.005   5.6701   11.215   4.4568 6.789351 7.212061 
1 1 1   14    2   92 o   20.808   3.1815   18.483   5.2252   11.755   9.4600   21.437   6.2681   16.729   5.7450   22.324   3.5644 -5.594397 6.760879 
1 1 1   14    2   93 o   33.493   2.0580   46.404   5.5917   54.035   10.306   43.220   6.6568   35.643   3.5962   32.190   2.5580 3.453190 4.413145 
1 1 1   14    2   94 o   19.752   3.1885   16.724   4.9589   23.104   9.6916   14.461   5.7717   22.521   5.3575   18.109   4.0153 4.411987 6.695142 
1 1 1   14    2   95 o   24.203   3.1179   24.918   6.0086   29.713   9.6773   21.909   7.6650   25.815   4.7745   22.233   4.3852 3.582205 6.482786 
1 1 1   14    2   96 o   8.3288   3.8180  -3.6350   5.8661  -0.9670   9.1412  -5.5029   7.6488   11.509   5.0563   9.2463   4.2819 2.262983 6.625731 
1 1 1   14    2   97 o   8.4558   3.6496  -0.1550   4.5875  -9.5608   8.7618   3.3972   5.3845   9.1338   4.3389   10.812   4.2230 -1.678595 6.054713 
1 1 1   14    2   98 o   7.2159   3.3278  -3.2285   4.5503  -7.8220   10.431  -2.1490   5.0568   10.554   4.9254   8.0721   3.6387 2.481447 6.123741 
1 1 1   14    2   99 o   24.290   2.5201   24.866   4.9173   30.609   10.761   23.351   5.5283   25.700   5.3123   23.382   2.9672 2.317831 6.084832 
1 1 1   14    2  100 o   22.002   3.1203   20.863   5.4393   13.601   9.6608   24.233   6.5815   17.242   5.8074   23.573   3.5340 -6.330280 6.798161 
1 1 1   14    2  101 o   10.409   4.5291  -0.0072   7.1815  -4.5964   9.0643   7.7308   11.770   10.309   4.7333   15.239   6.1478 -4.929532 7.758863 
1 1 1   14    2  102 o   15.897   5.0565   11.631   7.3704   15.775   9.2655   4.4898   12.163   18.160   5.6549   14.280   6.0464 3.880294 8.278706 
1 1 1   14    2  103 o   28.576   3.6136   35.864   8.2295   38.083   10.520   32.365   13.211   28.829   4.6336   25.289   6.4032 3.539757 7.903857 
1 1 1   14    2  104 o   9.6321   4.5251  -7.1112   9.0516  -8.8230   12.893  -5.4475   12.710   11.444   5.3841   11.982   5.5386 -0.5376902 7.724235 
1 1 1   14    2  105 o   19.031   5.6073   17.960   9.2865   2.6991   13.378   32.154   12.902   13.982   6.1305   24.970   6.3308 -10.98740 8.812629 
1 1 1   14    2  106 o   28.434   4.2479   37.020   9.5445   37.981   13.891   36.161   13.137   26.997   6.4084   26.525   6.1894 0.4724903 8.909358 
1 1 1   14    2  107 o   28.430   4.7479   38.124   10.615   17.365   17.037   51.297   13.572   18.480   7.4171   32.545   5.2979 -14.06501 9.114902 
1 1 1   14    2  108 o   17.871   5.9677   16.285   10.203   32.015   17.336   7.9489   12.621   23.120   7.7795   14.975   6.2381 8.145182 9.971660 
1 1 1   14    2  109 o   27.370   5.3993   37.006   11.618   32.509   24.460   38.316   13.202   22.024   8.8706   27.193   6.1058 -5.169184 10.76885 
1 1 1   14    2  110 f   30.829   4.7694   45.217   11.599   69.129   24.307   38.167   13.198   32.596   8.9000   27.024   6.1325 5.571682 10.80817 
1 1 1   14    2  111 o   14.560   5.9510   8.2698   11.197   28.163   22.723   1.8902   12.868   20.791   8.4852   13.270   5.9059 7.520720 10.33816 
1 1 1   14    2  112 o   24.356   5.9319   31.049   11.666   17.093   16.820   43.988   16.195   17.966   7.3122   27.766   7.1216 -9.800098 10.20717 
1 1 1   14    2  113 o   11.358   5.2369  -3.4455   11.259   4.8596   16.624 -10.4839   15.304   14.936   6.6757   11.859   5.6617 3.077348 8.753301 
1 1 1   14    2  114 o   12.731   5.6236   2.1879   11.454 -16.5648   16.729   18.734   15.714   11.578   5.6241   18.255   7.1890 -6.677150 9.127540 
1 1 1   14    2  115 o   21.330   6.2883   25.115   11.676   11.429   17.044   37.218   16.028   16.334   7.0423   24.796   7.3822 -8.461815 10.20249 
1 1 1   14    2  116 o   12.152   5.4541   0.4887   11.223   12.322   16.213 -10.3981   15.551   16.367   6.9576   11.863   5.6755 4.504026 8.978796 
1 1 1   14    2  117 o   24.436   6.1941   32.664   12.352   16.708   17.791   47.514   17.163   17.516   7.3591   28.066   7.3985 -10.54934 10.43522 
1 1 1   14    2  118 o   10.922   5.1314  -5.9634   11.644   19.331   16.858 -29.0388   16.101   18.167   7.3474   9.9871   4.9743 8.179906 8.872851 
1 1 1   14    2  119 f   15.078   6.7314   6.4583   16.853   27.233   24.226 -13.0236   23.460   19.801   8.4638   13.849   6.7115 5.952098 10.80187 
1 1 1   14    3 -117 o   11.178   5.2507  -5.8350   12.182   3.9734   16.940 -16.3400   17.532   14.573   6.6058   11.771   5.7267 2.802507 8.742491 
1 1 1   14    3 -116 o   14.478   6.1321   7.9623   12.516 -15.2632   17.484   32.368   17.923   11.870   5.7620   21.983   7.8793 -10.11277 9.761364 
1 1 1   14    3 -115 o   13.185   5.8336   3.2163   12.373  -3.8420   17.199   10.790   17.815   13.313   6.2491   16.119   7.0706 -2.805396 9.436398 
1 1 1   14    3 -114 o   14.244   6.1003   6.8192   12.629   14.317   17.784  -0.8081   17.937   16.980   7.2546   14.045   6.5225 2.934516 9.755603 
1 1 1   14    3 -113 f   16.031   6.4267   12.458   12.775   10.627   18.591   14.096   17.585   16.341   7.1936   16.990   7.2350 -0.6493988 10.20264 
1 1 1   14    3 -112 o   12.021   5.6453  -5.9806   14.065  -2.1742   23.799  -8.0235   17.435   15.293   7.2312   12.900   6.1260 2.392534 9.477211 
1 1 1   14    3 -111 o   17.459   6.6759   16.223   13.249   37.669   18.901  -4.4910   18.576   23.978   8.1230   13.807   6.4851 10.17152 10.39421 
1 1 1   14    3 -110 o   26.452   6.2442   37.372   13.246   55.296   19.085   20.711   18.400   30.468   7.6861   18.942   7.6707 11.52587 10.85886 
1 1 1   14    3 -109 o   16.655   6.5212   13.696   12.867  -2.9672   18.645   28.848   17.779   14.142   6.5951   21.489   7.8279 -7.347474 10.23577 
1 1 1   14    3 -108 o   20.837   6.7268   24.238   13.009   29.322   18.641   19.410   18.163   21.626   7.9924   18.762   7.6126 2.863726 11.03770 
1 1 1   14    3 -107 f   31.562   5.3819   48.978   13.350   51.250   19.073   46.796   18.692   29.404   7.8218   27.923   7.8738 1.481777 11.09859 
1 1 1   14    3 -106 o   28.746   5.0760   39.878   11.460   30.519   14.554   55.145   18.589   23.265   7.0592   31.274   7.4067 -8.009676 10.23189 
1 1 1   14    3 -105 o   14.404   5.8664   7.6075   10.834   6.0844   13.662   10.188   17.784   14.749   6.3311   16.697   7.1961 -1.948522 9.584682 
1 1 1   14    3 -104 o   14.686   5.8323   8.5497   10.423   5.5949   13.241   13.364   16.901   14.560   6.2411   17.430   7.2362 -2.870006 9.555844 
1 1 1   14    3 -103 o   17.393   6.0698   14.879   10.578   26.998   13.649  -3.3482   16.738   22.369   6.8459   13.882   6.3950 8.487309 9.368121 
1 1 1   14    3 -102 o   17.339   6.4162   14.237   12.020   17.917   13.514   0.3007   26.299   18.849   6.8307   17.151   7.9417 1.697468 10.47512 
1 1 1   14    3 -101 o   35.840   5.1160   59.956   14.523   49.680   16.709   91.707   29.369   31.122   6.7785   39.138   9.3369 -8.015144 11.53797 
1 1 1   14    3 -100 o   31.170   5.6348   46.406   13.790   46.987   15.834   44.579   28.063   30.599   6.5461   26.351   9.7939 4.248169 11.78012 
1 1 1   14    3  -99 o   30.237   5.6352   43.430   13.379   45.764   15.592   36.915   26.050   30.367   6.4955   24.916   9.3996 5.450607 11.42559 
1 1 1   14    3  -98 o   53.981   3.1575  124.114   13.833  127.018   15.781  114.482   28.741   54.274   3.5872   47.188   7.7401 7.086212 8.530894 
1 1 1   14    3  -97 o   25.850   4.9780   30.616   10.109   19.215   13.136   47.171   15.830   20.002   6.7719   31.202   6.4376 -11.20030 9.343500 
1 1 1   14    3  -96 o   27.781   2.7051   32.575   6.0485   50.333   13.156   27.816   6.8110   33.392   4.9859   25.409   3.3716 7.983646 6.018843 
1 1 1   14    3  -95 o   21.252   4.7391   20.486   8.0007   31.710   13.176   13.931   10.069   25.730   6.3272   17.628   5.9289 8.101273 8.670975 
1 1 1   14    3  -94 o   47.065   2.5343   92.380   9.6870   90.049   14.654   94.188   12.910   45.722   3.9712   47.111   3.3844 -1.389091 5.217717 
1 1 1   14    3  -93 o   11.256   4.4308   3.5266   5.9669  -1.7612   12.741   5.0123   6.7533   13.287   5.8970   12.420   4.7620 0.8667765 7.579652 
1 1 1   14    3  -92 o   62.632   1.7209  161.357   8.7775  151.763   16.003  165.486   10.497   60.017   3.2836   63.313   2.0367 -3.295216 3.863927 
1 1 1   14    3  -91 o   22.580   3.5674   21.966   6.3481   11.415   12.817   25.396   7.3074   17.382   6.5852   24.222   3.8281 -6.839916 7.617009 
1 1 1   14    3  -90 o   40.842   2.1916   69.036   7.2695   78.516   13.961   65.510   8.5148   42.808   4.0490   39.642   2.6502 3.166321 4.839269 
1 1 1   14    3  -89 o   39.954   2.3928   66.234   7.7574   89.315   17.877   60.879   8.6103   45.222   4.9294   38.179   2.7859 7.043018 5.662142 
1 1 1   14    3  -88 o   40.792   2.2479   68.846   7.4458   42.836   13.203   80.976   9.0164   30.975   5.4267   44.169   2.5146 -13.19418 5.980980 
1 1 1   14    3  -87 f   50.480   2.1328  105.124   8.7566   89.367   14.158  114.887   11.144   45.922   3.8166   52.622   2.6060 -6.700134 4.621435 
1 1 1   14    3  -86 o   70.241   1.8481  202.719   10.572  193.029   16.966  208.871   13.518   68.063   3.0658   71.131   2.3345 -3.067619 3.853485 
1 1 1   14    3  -85 o   54.274   2.0535  121.259   9.0684  123.505   14.924  119.944   11.418   54.318   3.3873   53.815   2.6107 0.5030022 4.276671 
1 1 1   14    3  -84 o   21.511   4.0475   20.030   6.8367  -2.6085   12.471   29.758   8.1747   13.202   5.8482   26.374   3.9216 -13.17160 7.041318 
1 1 1   14    3  -83 o   17.339   4.6887   13.174   6.7847   18.772   12.610   10.893   8.0491   20.683   6.6177   16.155   5.2968 4.527826 8.476452 
1 1 1   14    3  -82 o   54.923   2.0244  123.975   9.0477  130.247   15.293  120.598   11.223   55.893   3.3722   54.036   2.5551 1.856331 4.230869 
1 1 1   14    3  -81 o   24.011   3.7012   24.529   7.0117   40.760   13.120   18.039   8.2959   30.500   5.4783   20.245   5.0453 10.25515 7.447571 
1 1 1   14    3  -80 o   39.054   2.6393   63.079   8.3528   64.915   16.604   62.457   9.6648   38.761   5.4016   38.757   3.0846 0.4005432E-02 6.220273 
1 1 1   14    3  -79 o   51.562   2.1909  109.266   9.1874   79.952   16.675  122.044   11.009   43.374   4.7963   54.435   2.4877 -11.06126 5.403002 
1 1 1   14    3  -78 o   56.017   2.1551  128.841   9.8221  132.627   18.124  127.267   11.687   56.347   3.9713   55.583   2.5866 0.7633286 4.739392 
1 1 1   14    3  -77 o   36.908   2.7424   56.317   8.1917   44.753   15.789   60.576   9.5822   31.900   6.2955   38.213   3.1029 -6.312191 7.018659 
1 1 1   14    3  -76 o   71.801   1.9864  211.185   11.615  242.480   22.892  200.336   13.478   76.481   3.6827   69.855   2.3704 6.626045 4.379673 
1 1 1   14    3  -75 o   44.217   2.5566   80.477   9.1753   98.606   19.035   74.991   10.472   48.372   4.8949   42.590   3.0364 5.782024 5.760170 
1 1 1   14    3  -74 o   13.457   5.1048   5.5017   7.7079   4.3028   17.058   5.8093   8.6403   17.482   7.2649   14.070   5.3884 3.412789 9.045048 
1 1 1   14    3  -73 o   22.668   3.5916   21.678   6.4155   28.365   9.0446   14.907   9.1013   25.809   4.4605   18.726   5.5598 7.082329 7.127892 
1 1 1   14    3  -72 o   87.097   1.6541  309.866   11.744  309.439   16.602  310.293   16.614   86.909   2.3456   87.029   2.3440 -0.1203690 3.316091 
1 1 1   14    3  -71 o   53.586   2.0921  117.600   9.1209  106.393   12.025  132.780   13.996   50.847   2.9135   56.800   3.0338 -5.953159 4.206235 
1 1 1   14    3  -70 o   12.955   4.7647   5.5614   6.6114   9.3873   9.1738   1.4269   9.5367   15.987   5.6468   12.921   5.4055 3.065095 7.817021 
1 1 1   14    3  -69 o   97.955   1.8534  391.965   14.799  384.067   23.112  397.453   19.266   96.753   2.9339   98.562   2.3979 -1.809166 3.789174 
1 1 1   14    3  -68 o   65.335   2.1916  174.692   11.655  214.477   19.972  154.144   14.353   72.204   3.4028   61.274   2.8817 10.93070 4.459116 
1 1 1   14    3  -67 o   38.008   2.5486   59.363   7.8506   57.142   10.488   62.192   11.839   37.150   3.5048   38.720   3.7998 -1.570297 5.169340 
1 1 1   14    3  -66 o   49.920   2.0787  101.982   8.4404   99.149   11.217  105.680   12.815   49.137   2.8121   50.693   3.1164 -1.555595 4.197615 
1 1 1   14    3  -65 o   55.008   2.0136  123.748   9.0138  115.575   12.394  132.924   13.133   53.062   2.8762   56.921   2.8394 -3.858891 4.041616 
1 1 1   14    3  -64 f   35.924   2.7146   53.084   7.8903   32.376   10.744   77.330   11.626   27.616   4.9547   43.318   3.3176 -15.70237 5.962878 
1 1 1   14    3  -63 o  122.593   1.6565  613.313   16.553  616.677   23.474  609.986   23.347  122.851   2.3441  122.183   2.3441 0.6682358 3.315052 
1 1 1   14    3  -62 o   40.760   3.2962   68.472   10.859   60.208   11.864  111.132   26.954   38.118   3.8718   51.339   6.5929 -13.22034 7.645760 
1 1 1   14    3  -61 o  107.451   1.9019  471.282   16.659  473.272   18.390  462.173   39.335  107.661   2.0954  105.936   4.5658 1.724922 5.023708 
1 1 1   14    3  -60 o  114.324   1.9064  533.463   17.766  544.402   19.763  487.402   40.556  115.473   2.0996  108.811   4.5827 6.661324 5.040796 
1 1 1   14    3  -59 o   46.236   2.6093   87.633   9.7944   88.082   11.413   86.377   19.081   46.308   3.0402   45.508   5.2393 0.7997246 6.057444 
1 1 1   14    3  -58 o  105.022   1.7879  450.068   15.306  457.779   18.447  433.030   27.421  105.892   2.1372  102.822   3.2758 3.069672 3.911300 
1 1 1   14    3  -57 o   75.839   1.7212  234.662   10.640  235.019   14.435  234.238   15.746   75.828   2.3381   75.680   2.5561 0.1473312 3.464169 
1 1 1   14    3  -56 o   62.364   1.7201  158.791   8.7358  157.035   13.195  160.162   11.656   61.946   2.6189   62.591   2.2885 -0.6445122 3.477938 
1 1 1   14    3  -55 o   66.201   1.6671  178.893   8.9890  155.905   13.313  198.152   12.186   61.723   2.6523   69.642   2.1492 -7.919468 3.413738 
1 1 1   14    3  -54 o  199.948   1.6071  1630.73   26.194  1626.01   37.640  1635.15   36.476  199.576   2.3137  200.147   2.2357 -0.5709381 3.217397 
1 1 1   14    3  -53 o  144.077   1.5456  846.640   18.153  832.455   24.824  862.943   26.612  142.821   2.1323  145.402   2.2453 -2.581375 3.096478 
1 1 1   14    3  -52 o  155.307   1.5735  983.762   19.921  980.539   27.226  987.476   29.225  155.005   2.1547  155.538   2.3050 -0.5327911 3.155333 
1 1 1   14    3  -51 o   28.376   3.3444   33.369   7.5874   35.612   11.724   31.752   9.9524   29.033   5.1422   27.467   4.6082 1.566544 6.904920 
1 1 1   14    3  -50 o  131.770   1.5318  708.115   16.454  691.083   22.530  727.580   24.086  130.139   2.1238  133.525   2.2129 -3.385468 3.067167 
1 1 1   14    3  -49 o   49.326   2.4080   99.544   9.6531  102.111   12.526   95.791   15.147   49.899   3.0948   48.235   3.8852 1.663918 4.967181 
1 1 1   14    3  -48 o  129.635   1.7001  685.403   17.965  689.164   22.554  678.875   29.715  129.965   2.1289  128.939   2.8272 1.026306 3.539084 
1 1 1   14    3  -47 o  162.022   1.5213  1070.49   20.092  1049.11   28.832  1090.67   28.013  160.350   2.2058  163.503   2.1018 -3.153091 3.046871 
1 1 1   14    3  -46 o  327.952   2.1774  4388.05   58.209  4394.45   82.885  4381.81   81.767  328.019   3.0999  327.555   3.0624 0.4638977 4.357422 
1 1 1   14    3  -45 o   77.069   1.7194  242.233   10.802  250.332   16.301  235.894   14.423   78.276   2.5582   75.999   2.3309 2.277229 3.460865 
1 1 1   14    3  -44 o   57.727   2.2561  136.165   10.596  111.255   18.835  147.698   12.816   51.950   4.4920   60.100   2.6224 -8.150055 5.201412 
1 1 1   14    3  -43 o  167.833   1.8329  1148.81   25.076  1075.76   44.990  1181.73   30.203  162.279   3.4011  170.198   2.1770 -7.919662 4.038188 
1 1 1   14    3  -42 o  134.184   2.1103  734.490   23.082   0.0000   0.0000  734.490   23.082  ?   ?   134.184   2.1103 0.000000 2.110279 
1 1 1   14    3  -41 o  157.877   1.8061  1016.53   23.243  986.083   42.812  1029.25   27.676  155.371   3.3804  158.841   2.1375 -3.470245 3.999484 
1 1 1   14    3  -40 o  191.758   1.7511  1499.56   27.371  1440.24   42.940  1540.17   35.523  187.841   2.8044  194.301   2.2428 -6.459549 3.590954 
1 1 1   14    3  -39 o   57.122   2.1848  133.302   10.154  129.476   18.404  134.976   12.175   56.133   4.0494   57.452   2.6065 -1.319256 4.815724 
1 1 1   14    3  -38 o  181.806   1.5814  1347.77   23.436  1370.77   34.502  1328.07   31.933  183.304   2.3091  180.436   2.1711 2.867722 3.169460 
1 1 1   14    3  -37 o   90.709   1.5396  335.492   11.384  348.878   17.542  325.755   14.962   92.446   2.3297   89.368   2.0539 3.078285 3.105799 
1 1 1   14    3  -36 o  102.881   1.5702  431.576   13.168  413.679   21.444  442.409   16.684  100.654   2.6158  104.151   1.9651 -3.498001 3.271719 
1 1 1   14    3  -35 o  260.163   1.9732  2760.44   41.845  2848.60   66.493  2702.64   53.844  264.159   3.0880  257.366   2.5666 6.793030 4.015308 
1 1 1   14    3  -34 o  180.974   1.6523  1335.46   24.374  1378.87   39.126  1307.94   31.159  183.830   2.6111  179.072   2.1346 4.757462 3.372579 
1 1 1   14    3  -33 o   55.356   1.9960  125.134   8.9919  114.273   15.330  130.831   11.102   52.775   3.5849   56.579   2.4128 -3.804157 4.321214 
1 1 1   14    3  -32 f  187.664   1.6669  1436.02   25.499  1451.95   40.317  1425.40   32.919  188.641   2.6219  186.941   2.1603 1.700470 3.397225 
1 1 1   14    3  -31 o   32.871   2.7252   44.391   7.2365   44.950   10.967   43.960   9.6303   32.902   4.1837   32.601   3.6886 0.3019333 5.577579 
1 1 1   14    3  -30 o  166.272   1.4913  1127.18   20.212  1099.22   28.748  1154.52   28.423  164.167   2.1482  168.249   2.0725 -4.082870 2.984966 
1 1 1   14    3  -29 o  203.399   1.6074  1686.84   26.650  1675.56   38.101  1697.65   37.290  202.676   2.3062  204.012   2.2423 -1.336212 3.216642 
1 1 1   14    3  -28 o  367.585   2.3560  5511.66   70.593  5535.52  100.700  5488.60   98.989  368.223   3.3549  366.667   3.3119 1.555908 4.714269 
1 1 1   14    3  -27 o   37.002   2.4640   56.100   7.3894   54.624   11.518   57.132   9.6334   36.355   3.9501   37.275   3.2014 -0.9203796 5.084497 
1 1 1   14    3  -26 o   47.594   2.0256   92.546   7.8407  101.509   12.189   86.221   10.240   49.781   3.0180   45.887   2.7504 3.894573 4.083256 
1 1 1   14    3  -25 o  137.909   1.4251  775.387   16.021  768.257   23.249  781.833   22.108  137.251   2.0781  138.463   1.9587 -1.212189 2.855688 
1 1 1   14    3  -24 o  151.852   1.4506  940.100   17.956  915.679   25.670  963.497   25.126  149.842   2.1017  153.709   2.0053 -3.867020 2.904875 
1 1 1   14    3  -23 o  110.058   1.4171  493.824   12.713  500.601   18.690  487.988   17.344  110.793   2.0695  109.392   1.9450 1.400795 2.840086 
1 1 1   14    3  -22 o   96.250   1.5786  377.711   12.386  363.788   16.572  395.331   18.643   94.446   2.1525   98.450   2.3231 -4.004288 3.167014 
1 1 1   14    3  -21 o  204.155   1.8701  1699.55   31.121  1659.07   37.911  1783.18   54.496  201.684   2.3060  209.021   3.1984 -7.337021 3.943059 
1 1 1   14    3  -20 o   47.198   2.4366   91.107   9.3426   91.201   11.966   90.960   14.952   47.169   3.1299   47.028   3.9363 0.1408081 5.029040 
1 1 1   14    3  -19 o   45.505   2.2006   84.648   8.1385   89.614   11.720   80.024   11.310   46.759   3.0924   44.168   3.1622 2.590511 4.422912 
1 1 1   14    3  -18 o  134.983   1.5243  742.850   16.772  747.734   23.019  737.322   24.488  135.408   2.0855  134.456   2.2343 0.9518127 3.056331 
1 1 1   14    3  -17 o  108.159   1.5009  476.941   13.233  491.543   21.111  467.490   16.983  109.778   2.3591  107.071   1.9458 2.706985 3.058046 
1 1 1   14    3  -16 o   40.788   2.3301   68.077   7.7151   67.853   12.648   68.210   9.7363   40.579   3.8705   40.780   2.9489 -0.2010307 4.865842 
1 1 1   14    3  -15 o  213.180   1.8676  1853.10   32.453  1832.50   55.601  1863.74   39.968  211.896   3.2190  213.767   2.2937 -1.870575 3.952593 
1 1 1   14    3  -14 o   98.721   1.5191  397.333   12.224  378.039   19.037  410.872   15.946   96.241   2.4286  100.379   1.9489 -4.137924 3.113873 
1 1 1   14    3  -13 o  132.742   1.5044  718.375   16.278  698.058   25.283  732.760   21.275  130.823   2.3709  134.051   1.9469 -3.228210 3.067868 
1 1 1   14    3  -12 o  115.689   1.4264  545.636   13.452  545.180   19.781  546.029   18.347  115.623   2.0988  115.717   1.9450 -0.9455872E-01 2.861497 
1 1 1   14    3  -11 o   65.857   1.6865  176.953   9.0460  181.366   13.811  173.638   11.971   66.631   2.5475   65.211   2.2555 1.420540 3.402498 
1 1 1   14    3  -10 o  307.274   2.0582  3850.28   51.552  3843.06   73.331  3857.34   72.487  306.901   2.9312  307.475   2.8921 -0.5742493 4.117810 
1 1 1   14    3   -9 o  174.345   1.6242  1239.29   23.082  1232.33   31.102  1247.82   34.440  173.831   2.1949  174.909   2.4155 -1.078049 3.263795 
1 1 1   14    3   -8 o   34.306   2.6929   48.307   7.4703   63.980   11.773   37.743   9.6656   39.413   3.7079   30.133   4.0364 9.279699 5.480975 
1 1 1   14    3   -7 o  157.043   1.4848  1005.46   19.007  1019.91   27.681  992.560   26.145  158.144   2.1473  156.013   2.0558 2.131424 2.972748 
1 1 1   14    3   -6 o   40.703   2.5525   67.844   8.4264   78.149   12.094   58.122   11.747   43.623   3.4287   37.527   3.8968 6.095695 5.190465 
1 1 1   14    3   -5 o  183.785   1.6626  1377.13   24.908  1359.15   33.277  1400.04   37.563  182.556   2.2362  185.268   2.4873 -2.712189 3.344695 
1 1 1   14    3   -4 o  165.703   1.6115  1119.46   21.767  1126.04   29.408  1111.49   32.373  166.168   2.1711  165.080   2.4057 1.087967 3.240552 
1 1 1   14    3   -3 o  272.655   2.0331  3031.48   45.187  3042.54   60.426  3017.45   68.061  273.097   2.7144  271.934   3.0704 1.162872 4.098226 
1 1 1   14    3   -2 o   93.599   1.4923  357.165   11.386  356.981   17.009  357.315   15.326   93.559   2.2303   93.608   2.0085 -0.4915619E-01 3.001379 
1 1 1   14    3   -1 o  231.705   1.7208  2188.96   32.501  2190.89   46.630  2187.13   45.324  231.763   2.4682  231.569   2.4011 0.1945496 3.443472 
1 1 1   14    3    0 o   22.444   4.2390   21.253   7.4714   28.144   13.583   18.264   8.9464   25.715   6.4827   20.737   5.2795 4.977659 8.360513 
1 1 1   14    3    1 o   62.536   2.2645  159.701   11.525  156.437   23.196  160.771   13.280   61.698   4.6463   62.726   2.6028 -1.027565 5.325704 
1 1 1   14    3    2 o   27.120   4.0770   30.705   8.7344   12.171   15.227   39.793   10.663   19.530   7.2226   30.909   4.3524 -11.37903 8.432631 
1 1 1   14    3    3 o  250.914   2.2684  2567.63   46.395  2606.24   75.077  2543.78   59.012  252.666   3.6452  249.696   2.8993 2.970749 4.657616 
1 1 1   14    3    4 o  112.528   1.6500  516.266   15.135  508.968   22.223  522.579   20.670  111.707   2.4405  113.198   2.2401 -1.490387 3.312694 
1 1 1   14    3    5 o  251.320   2.0737  2575.68   42.482  2580.28   60.741  2571.27   59.438  251.474   2.9632  251.040   2.9046 0.4344025 4.149334 
1 1 1   14    3    6 o  105.709   1.5652  455.573   13.487  464.048   18.831  446.648   19.325  106.672   2.1656  104.650   2.2654 2.021889 3.134036 
1 1 1   14    3    7 o   16.604   5.4983   10.700   8.6657   14.227   16.599   9.3786   10.160   20.707   7.5604   16.516   5.9309 4.191172 9.609096 
1 1 1   14    3    8 o  139.625   1.6667  794.847   18.969  789.216   27.691  799.826   26.038  139.102   2.4421  140.040   2.2809 -0.9385834 3.341664 
1 1 1   14    3    9 o  112.388   1.6524  514.983   15.138  507.820   22.174  521.236   20.717  111.581   2.4379  113.051   2.2481 -1.470619 3.316238 
1 1 1   14    3   10 o  125.995   1.6485  647.237   16.931  627.490   24.583  665.054   23.351  124.033   2.4315  127.699   2.2433 -3.665688 3.308245 
1 1 1   14    3   11 o   27.183   3.8650   30.776   8.3232   28.257   13.108   32.478   10.774   25.756   6.2970   27.774   4.9398 -2.017273 8.003380 
1 1 1   14    3   12 o   84.091   1.7673  288.324   12.115  269.143   17.786  304.924   16.546   81.180   2.6915   86.433   2.3506 -5.252762 3.573495 
1 1 1   14    3   13 o  105.262   1.8450  451.792   15.831  459.164   21.276  442.648   23.695  106.099   2.4601  104.124   2.7943 1.974846 3.722872 
1 1 1   14    3   14 o  128.353   2.4124  671.968   25.240  671.968   25.240   0.0000   0.0000  128.353   2.4124  ?   ?  0.000000 2.412363 
1 1 1   14    3   15 o  125.923   1.6545  646.507   16.983  661.365   24.886  633.556   23.234  127.337   2.3976  124.635   2.2869 2.701630 3.313363 
1 1 1   14    3   16 o  138.688   1.6697  784.228   18.876  758.134   27.005  809.154   26.394  136.333   2.4300  140.851   2.2989 -4.518494 3.345138 
1 1 1   14    3   17 o   32.522   3.2950   43.610   8.6146   29.351   12.939   54.963   11.545   26.247   6.1551   36.473   3.9460 -10.22589 7.311355 
1 1 1   14    3   18 o  252.414   2.2956  2598.60   47.232  2533.05   74.707  2642.25   60.962  249.071   3.6796  254.467   2.9389 -5.396164 4.709239 
1 1 1   14    3   19 o  184.155   2.1973  1383.11   32.984  1383.56   70.216  1382.98   37.363  183.912   4.6875  184.129   2.4894 -0.2174530 5.307516 
1 1 1   14    3   20 o  163.079   2.1629  1084.62   28.752  1023.66   41.016  1143.52   40.316  158.371   3.1772  167.402   2.9545 -9.030746 4.338595 
1 1 1   14    3   21 o  141.644   2.1049  818.213   24.303  812.919   35.945  822.671   32.985  141.133   3.1244  141.993   2.8498 -0.8600769 4.228853 
1 1 1   14    3   22 o   58.481   2.4188  139.742   11.506  145.650   15.629  132.751   17.001   59.650   3.2262   56.899   3.6852 2.750568 4.897914 
1 1 1   14    3   23 o   31.412   3.8248   40.891   9.5920   47.774   13.231   33.265   13.926   33.826   4.9444   27.946   6.2682 5.880589 7.983579 
1 1 1   14    3   24 o   72.877   1.8817  216.718   11.169  208.495   16.725  223.336   15.005   71.423   2.8786   73.950   2.4928 -2.527069 3.807895 
1 1 1   14    3   25 o   98.617   1.7167  396.546   13.800  395.330   20.312  397.589   18.806   98.408   2.5343   98.729   2.3368 -0.3201370 3.447206 
1 1 1   14    3   26 o  223.496   2.1312  2037.20   38.826  2031.44   61.496  2041.03   50.067  223.067   3.3820  223.656   2.7462 -0.5891418 4.356541 
1 1 1   14    3   27 o  250.618   2.2767  2561.92   46.511  2603.14   74.683  2535.80   59.447  252.477   3.6288  249.275   2.9256 3.201981 4.661255 
1 1 1   14    3   28 o  420.208   3.3330  7208.69  114.167  7353.19  183.545  7117.50  145.806  423.857   5.3124  417.315   4.2862 6.541748 6.825895 
1 1 1   14    3   29 o  165.945   2.1338  1123.14   28.864  1121.89   41.171  1124.35   40.477  165.793   3.0464  165.979   2.9917 -0.1856842 4.269763 
1 1 1   14    3   30 o   83.122   2.2149  282.017   14.994  290.655   22.098  274.648   20.411   84.319   3.2210   81.973   3.0600 2.345657 4.442813 
1 1 1   14    3   31 o  120.811   2.0578  595.256   20.265  621.820   29.488  571.480   27.897  123.435   2.9307  118.335   2.8921 5.099770 4.117365 
1 1 1   14    3   32 f   59.299   2.6114  143.748   12.592  150.888   18.412  137.475   17.258   60.663   3.7416   57.900   3.6757 2.763309 5.245005 
1 1 1   14    3   33 o  153.013   2.1024  954.930   26.223  947.135   37.059  962.746   37.110  152.332   2.9844  153.584   2.9642 -1.251740 4.206381 
1 1 1   14    3   34 o   90.365   1.9058  333.015   14.038  319.833   22.602  341.294   17.912   88.458   3.1396   91.434   2.4054 -2.975914 3.955097 
1 1 1   14    3   35 o   36.167   3.3793   53.879   9.8473   54.052   16.486   53.783   12.279   35.861   5.8403   36.022   4.2641 -0.1611710 7.231355 
1 1 1   14    3   36 o  127.410   1.8385  662.008   19.094  639.520   30.431  676.610   24.521  125.168   2.9826  128.785   2.3358 -3.616348 3.788386 
1 1 1   14    3   37 o  311.153   2.6411  3950.80   66.987  3920.35  105.912  3971.10   86.482  309.664   4.1958  311.826   3.4023 -2.162415 5.401937 
1 1 1   14    3   38 o  140.969   1.8805  810.455   21.609  783.331   34.406  828.125   27.769  138.519   3.0471  142.470   2.3911 -3.950989 3.873302 
1 1 1   14    3   39 o  109.875   1.9159  492.375   17.160  480.998   27.915  499.286   21.755  108.489   3.1599  110.621   2.4126 -2.132202 3.975659 
1 1 1   14    3   40 o   46.699   3.0100   89.402   11.397   73.187   19.008   98.503   14.241   41.866   5.7192   48.971   3.5925 -7.104340 6.753906 
1 1 1   14    3   41 o  223.461   2.7882  2038.31   50.789  2010.22   88.126  2052.28   62.148  221.570   4.8793  224.143   3.4015 -2.572327 5.947876 
1 1 1   14    3   42 o   40.936   4.4909   69.384   14.740   71.981   26.005   68.154   17.892   41.077   8.0543   40.395   5.5829 0.6823807 9.800007 
1 1 1   14    3   43 o  234.722   2.8724  2249.14   54.959  2250.09   96.309  2248.68   66.926  234.378   5.0410  234.606   3.4996 -0.2283173 6.136663 
1 1 1   14    3   44 o  104.548   2.4564  446.029   20.934  430.626   37.436  453.037   25.250  102.485   4.4922  105.297   2.9447 -2.812706 5.371289 
1 1 1   14    3   45 o  141.199   1.9120  813.207   22.007  810.357   35.764  814.944   27.918  140.863   3.1147  141.317   2.4235 -0.4542847 3.946475 
1 1 1   14    3   46 o   30.121   4.4198   37.915   10.530   32.204   17.716   41.035   13.093   27.526   7.6308   31.204   5.3392 -3.678234 9.313245 
1 1 1   14    3   47 o   59.931   2.4310  146.823   11.851  115.038   19.652  164.991   14.857   52.802   4.6120   63.501   2.8778 -10.69827 5.436168 
1 1 1   14    3   48 o   32.120   3.8998   42.813   10.002   51.384   16.988   38.265   12.374   34.839   6.2095   30.119   5.2295 4.720531 8.118256 
1 1 1   14    3   49 o  113.870   1.8722  528.937   17.378  543.649   28.652  520.375   21.858  115.321   3.0506  112.915   2.3748 2.405304 3.865987 
1 1 1   14    3   50 o   70.787   2.1481  204.657   12.380  217.899   20.863  197.459   15.381   72.917   3.5204   69.485   2.7208 3.432426 4.449294 
1 1 1   14    3   51 o   96.902   1.9184  383.092   15.154  380.437   24.873  384.660   19.109   96.431   3.1686   97.072   2.4150 -0.6407089 3.984012 
1 1 1   14    3   52 o  190.447   2.0236  1479.97   31.415  1524.53   50.796  1452.38   39.978  193.123   3.2267  188.593   2.6005 4.529739 4.144207 
1 1 1   14    3   53 o  162.625   1.9259  1079.07   25.531  1100.35   41.302  1065.91   32.480  164.082   3.0879  161.575   2.4660 2.507523 3.951808 
1 1 1   14    3   54 o  155.143   1.8986  982.075   24.011  976.220   38.671  985.748   30.631  154.544   3.0697  155.380   2.4184 -0.8361816 3.907909 
1 1 1   14    3   55 o   19.178   5.6630   15.372   9.4633  -2.8200   16.792   23.839   11.456   15.892   6.9201   23.599   5.9557 -7.706954 9.130135 
1 1 1   14    3   56 o   94.571   1.9083  364.961   14.711  364.529   24.455  365.207   18.416   94.360   3.1839   94.540   2.3916 -0.1800690 3.982132 
1 1 1   14    3   57 o  102.714   1.8722  430.522   15.675  445.270   26.188  422.289   19.567  104.303   3.0835  101.690   2.3606 2.613457 3.883321 
1 1 1   14    3   58 o   96.302   1.8900  378.479   14.836  364.270   24.733  386.466   18.543   94.305   3.2221   97.279   2.3385 -2.974007 3.981255 
1 1 1   14    3   59 o   89.909   2.1740  330.058   15.933  295.026   23.545  359.656   21.641   84.824   3.4121   93.752   2.8351 -8.927528 4.436228 
1 1 1   14    3   60 o   48.796   3.3185   97.910   13.121   72.515   26.810  105.908   15.046   40.931   8.3193   50.711   3.6646 -9.780098 9.090654 
1 1 1   14    3   61 o   58.650   2.9360  141.046   13.992  160.109   28.934  135.227   15.985   61.989   5.7931   57.360   3.4345 4.629356 6.734710 
1 1 1   14    3   62 o  115.451   2.0554  544.251   19.343  590.987   43.195  532.528   21.634  119.826   4.4299  114.172   2.3246 5.654518 5.002774 
1 1 1   14    3   63 o   89.194   1.9364  324.808   14.079  326.950   24.369  323.735   17.250   89.273   3.3547   88.976   2.3804 0.2965088 4.113453 
1 1 1   14    3   64 f   71.529   2.0626  209.130   12.013  214.694   21.146  206.479   14.598   72.264   3.6011   71.022   2.5256 1.241783 4.398472 
1 1 1   14    3   65 o   64.238   2.1353  168.762   11.165  163.159   18.258  172.110   14.112   62.966   3.5719   64.809   2.6770 -1.843399 4.463683 
1 1 1   14    3   66 o   54.326   2.3917  120.891   10.565  116.625   17.779  123.220   13.136   53.089   4.1411   54.776   2.9529 -1.687016 5.086105 
1 1 1   14    3   67 o   57.905   2.3375  137.313   11.011  131.135   18.267  140.838   13.799   56.324   4.0048   58.571   2.8993 -2.247131 4.944118 
1 1 1   14    3   68 o   53.865   2.4963  118.965   10.931  132.971   18.317  111.217   13.623   56.703   3.9883   51.971   3.2316 4.732292 5.133165 
1 1 1   14    3   69 o  122.429   1.8106  612.237   18.069  635.712   28.062  595.610   23.617  124.574   2.7634  120.655   2.4013 3.918472 3.660987 
1 1 1   14    3   70 o   92.267   2.0423  348.006   15.360  359.631   29.446  343.660   18.004   93.359   3.8777   91.604   2.4132 1.754875 4.567296 
1 1 1   14    3   71 o   75.359   1.9708  232.297   12.096  237.793   19.592  228.912   15.376   76.030   3.1682   74.720   2.5282 1.309631 4.053321 
1 1 1   14    3   72 o   31.072   3.4743   40.214   8.6495   21.725   15.076   49.286   10.561   22.728   7.2319   34.366   3.8352 -11.63744 8.185921 
1 1 1   14    3   73 o   49.442   2.3730  100.349   9.5360   97.307   16.088  101.997   11.840   48.338   4.1224   49.755   2.9323 -1.417267 5.058889 
1 1 1   14    3   74 o   41.709   2.6438   71.649   8.9424   76.014   15.243   69.359   11.042   42.570   4.4587   40.906   3.3407 1.663944 5.571354 
1 1 1   14    3   75 o   12.310   4.8587   3.6711   7.1923   5.8775   10.791   1.9075   9.6476   15.126   5.9571   13.093   5.4541 2.032367 8.076787 
1 1 1   14    3   76 o   47.881   2.9104   94.642   11.305   97.818   12.146   74.036   30.935   48.644   3.0789   39.930   9.6190 8.713593 10.09970 
1 1 1   14    3   77 o   67.103   2.2645  184.847   12.369  196.975   16.226  168.025   19.110   69.119   2.8863   63.589   3.7027 5.530296 4.694733 
1 1 1   14    3   78 o   77.240   2.1045  244.718   13.238  240.744   17.179  250.529   20.773   76.435   2.7617   77.800   3.2829 -1.365517 4.290031 
1 1 1   14    3   79 o   44.944   2.1261   83.019   7.7669   78.004   13.112   85.729   9.6401   43.177   3.7631   45.579   2.6055 -2.401875 4.577100 
1 1 1   14    3   80 o   37.627   2.2856   58.358   6.9773   59.020   11.404   57.961   8.8207   37.482   3.7844   37.367   2.9190 0.1145821 4.779358 
1 1 1   14    3   81 o   44.439   2.0870   81.222   7.5388   88.674   13.141   77.566   9.2040   46.063   3.5267   43.312   2.6192 2.750954 4.392899 
1 1 1   14    3   82 o   26.797   2.8346   29.986   6.0982   26.332   10.833   31.682   7.3782   24.330   5.5811   27.421   3.3718 -3.090847 6.520574 
1 1 1   14    3   83 o   30.215   2.5434   37.903   6.2063   40.938   10.955   36.469   7.5314   30.846   4.4885   29.480   3.1846 1.366093 5.503494 
1 1 1   14    3   84 o   24.454   2.9802   25.133   5.8181   29.190   10.430   23.301   7.0099   25.710   5.1566   23.308   3.8220 2.402275 6.418545 
1 1 1   14    3   85 o   38.787   2.0422   62.004   6.4340   64.987   11.215   60.540   7.8552   39.286   3.5400   38.210   2.5363 1.075531 4.354855 
1 1 1   14    3   86 o   12.609   4.3987   6.1490   5.5549   12.892   10.064   3.1945   6.6616   17.505   5.9273   11.616   4.6463 5.889184 7.531293 
1 1 1   14    3   87 f   32.030   2.4076   42.598   6.2400   57.512   11.876   36.910   7.3339   36.689   4.0378   29.623   3.0822 7.065668 5.079716 
1 1 1   14    3   88 o   36.445   2.0745   54.870   6.1375   60.601   10.854   52.176   7.4414   37.834   3.5613   35.402   2.5967 2.431644 4.407468 
1 1 1   14    3   89 o   33.725   2.1735   47.098   5.9432   43.989   10.500   48.564   7.2092   31.940   4.1295   34.130   2.6111 -2.190256 4.885756 
1 1 1   14    3   90 o   40.352   2.1701   67.376   7.1120   67.937   11.190   66.997   9.2118   40.064   3.4603   40.025   2.8419 0.3906250E-01 4.477778 
1 1 1   14    3   91 o   37.693   2.3996   59.044   7.3346   62.173   10.869   56.428   9.9383   38.267   3.5241   36.502   3.3784 1.764973 4.881916 
1 1 1   14    3   92 o   24.554   2.6810   25.357   5.2790   24.510   10.106   25.675   6.1907   23.142   5.4482   24.564   3.1653 -1.422213 6.300970 
1 1 1   14    3   93 o   11.175   4.0015   4.6821   4.6213   3.5726   9.5629   5.0202   5.2786   13.232   5.4635   11.705   4.2650 1.527290 6.931129 
1 1 1   14    3   94 o   8.2079   3.5386  -0.1427   4.3032   3.0392   11.714  -0.6391   4.6267   14.043   5.9395   8.2860   3.6198 5.757403 6.955630 
1 1 1   14    3   95 o   12.637   5.2438   3.1017   8.8692   6.4700   13.866   0.7691   11.538   15.848   6.5647   13.252   5.7537 2.596605 8.729230 
1 1 1   14    3   96 o   28.893   4.2783   36.907   9.7723   29.581   15.093   42.194   12.823   24.315   7.1444   30.283   5.3923 -5.967546 8.950961 
1 1 1   14    3   97 o   29.057   3.7059   36.738   8.5781   30.542   11.841   43.582   12.445   25.316   5.8546   30.862   5.1265 -5.546816 7.781811 
1 1 1   14    3   98 o   16.222   5.3169   11.956   8.1107   21.426   11.143   1.2840   11.829   20.966   6.1326   13.349   5.8104 7.616804 8.448059 
1 1 1   14    3   99 o   18.448   5.0884   16.018   7.8996   8.0494   10.082   28.687   12.713   14.784   5.7774   23.959   6.3914 -9.175089 8.615564 
1 1 1   14    3  100 o   12.226   4.9975   3.8886   7.8972   12.585   10.262  -8.7421   12.367   16.643   5.9624   11.277   5.2952 5.365850 7.974312 
1 1 1   14    3  101 o   13.014   5.0914   5.9252   7.8381   19.034   10.222 -12.7807   12.211   19.619   5.9081   10.473   5.0154 9.145991 7.749857 
1 1 1   14    3  102 o   12.261   5.0161   4.1396   7.9652  -0.1814   10.247   10.737   12.661   11.962   5.2998   16.169   6.4259 -4.207553 8.329465 
1 1 1   14    3  103 o   28.495   3.6909   36.134   8.3719   34.976   10.809   37.869   13.236   27.064   5.0861   27.331   6.0963 -0.2678471 7.939371 
1 1 1   14    3  104 o   12.603   5.0229   5.4348   7.7579   4.0094   9.8741   7.7339   12.540   12.917   5.4577   14.971   6.2257 -2.053477 8.279257 
1 1 1   14    3  105 o   19.201   5.2375   18.249   8.4229   22.281   11.111   12.802   12.915   20.618   6.1483   16.612   6.5248 4.005959 8.965167 
1 1 1   14    3  106 o   14.224   5.3429   8.8009   8.3966   17.629   11.198  -2.5359   12.690   18.387   6.2522   12.327   5.6375 6.060910 8.418462 
1 1 1   14    3  107 f   22.741   5.6884   26.401   10.517   17.602   16.581   32.324   13.604   18.314   7.3286   24.297   6.6679 -5.983273 9.908030 
1 1 1   14    3  108 o   16.914   6.1704   14.501   11.053   14.289   16.021   14.693   15.270   17.230   7.0887   17.271   6.9899 -0.4044533E-01 9.955327 
1 1 1   14    3  109 o   42.663   3.6635   81.608   12.617   85.656   18.116   77.795   17.583   41.517   5.4872   39.363   5.6408 2.154812 7.869400 
1 1 1   14    3  110 o   9.0353   4.4404 -18.0243   11.359 -15.5896   16.809 -20.0705   15.409   11.776   5.7007   10.703   5.2419 1.073478 7.744414 
1 1 1   14    3  111 o   17.617   6.2912   16.557   11.415   27.410   16.719   7.0793   15.624   21.038   7.6012   15.158   6.6362 5.879915 10.09046 
1 1 1   14    3  112 o   9.8659   4.7436 -11.1231   11.170 -16.3915   16.100  -6.2342   15.510   11.344   5.5118   12.516   5.8936 -1.172776 8.069310 
1 1 1   14    3  113 f   28.318   5.5700   41.018   12.399   48.849   18.256   34.313   16.893   28.136   7.7255   23.265   7.6758 4.870956 10.89040 
1 1 1   14    3  114 o   16.502   6.3095   14.166   11.834   3.6469   17.229   23.559   16.282   14.643   6.6471   19.551   7.4186 -4.907353 9.960886 
1 1 1   14    3  115 o   20.071   6.4570   22.973   11.993   16.898   17.427   28.438   16.530   17.509   7.3148   21.048   7.5642 -3.539135 10.52251 
1 1 1   14    3  116 o   14.605   6.3128   7.4286   13.764   1.8567   16.854   18.584   23.848   14.150   6.4810   18.092   8.0467 -3.942142 10.33207 
1 1 1   14    3  117 o   22.249   7.7826   32.625   17.396   32.625   17.396   0.0000   0.0000   22.249   7.7826  ?   ?  0.000000 7.782583 
1 1 1   14    4 -115 o   12.144   5.7215  -5.8473   14.652   14.263   18.643 -38.3356   23.696   16.920   7.3301   11.784   5.8947 5.135403 9.406248 
1 1 1   14    4 -114 o   16.070   6.7300   12.418   14.807   16.619   18.771   5.4973   24.091   17.426   7.4495   16.049   7.4884 1.377689 10.56272 
1 1 1   14    4 -113 o   12.497   5.6872  -0.1215   12.710   0.0323   18.213  -0.2675   17.747   14.150   6.5716   13.986   6.4925 0.1640062 9.237850 
1 1 1   14    4 -112 o   13.200   5.8878   2.5996   12.863   15.936   18.619  -9.5776   17.791   17.355   7.4191   12.690   6.0711 4.664702 9.586520 
1 1 1   14    4 -111 o   15.475   6.3484   10.830   12.802  -5.8740   18.215   27.136   17.996   13.374   6.3245   20.473   7.7921 -7.098748 10.03578 
1 1 1   14    4 -110 o   11.490   5.3838  -5.6155   12.667 -20.7099   17.944   9.3795   17.884   11.522   5.6460   15.974   7.0429 -4.451284 9.026582 
1 1 1   14    4 -109 o   11.812   5.4971  -4.4470   12.844   0.0591   18.572  -8.5779   17.782   14.464   6.6890   12.947   6.1590 1.516989 9.092605 
1 1 1   14    4 -108 o   11.022   5.2330  -8.7699   12.712 -19.2050   17.917   1.8074   18.038   11.739   5.7284   14.679   6.7163 -2.940316 8.827453 
1 1 1   14    4 -107 o   22.516   6.6203   28.351   12.956   23.282   18.444   33.290   18.204   19.644   7.7720   22.802   7.9623 -3.157967 11.12663 
1 1 1   14    4 -106 o   29.006   5.8497   43.194   13.353   43.358   19.150   43.039   18.630   26.130   8.1286   26.241   7.9916 -0.1111393 11.39910 
1 1 1   14    4 -105 o   14.614   6.1421   7.3386   12.401   22.616   17.782  -7.1272   17.303   19.698   7.6797   13.176   6.2105 6.522550 9.876660 
1 1 1   14    4 -104 o   14.576   6.3403   5.3097   14.065   16.895   17.102 -18.9041   24.724   18.157   7.3795   14.042   6.8245 4.115142 10.05142 
1 1 1   14    4 -103 o   44.021   3.8173   86.863   13.563   79.752   18.924   94.372   19.447   39.656   6.0451   43.782   5.5755 -4.125652 8.223708 
1 1 1   14    4 -102 o   21.997   6.4194   25.798   12.221   15.504   16.757   37.497   17.864   17.910   7.2951   25.054   7.8595 -7.144569 10.72338 
1 1 1   14    4 -101 o   22.810   5.7575   26.261   10.705   38.334   13.515   5.9369   17.535   27.300   6.2133   15.831   6.9772 11.46931 9.342722 
1 1 1   14    4 -100 o   13.760   5.6918   5.6792   10.403   7.7988   13.346   2.3967   16.608   15.334   6.4033   14.969   6.6827 0.3652506 9.255325 
1 1 1   14    4  -99 o   12.131   5.3392   0.3679   10.237  -3.9771   13.315   6.6487   16.008   12.549   5.7524   15.884   6.8364 -3.335291 8.934597 
1 1 1   14    4  -98 o   15.296   5.8970   9.4320   10.396   8.3206   13.316   11.167   16.637   15.700   6.4613   17.302   7.1809 -1.602316 9.659899 
1 1 1   14    4  -97 o   19.596   6.0752   18.871   10.707   15.265   13.663   24.610   17.237   18.171   6.8176   21.589   7.7283 -3.417828 10.30565 
1 1 1   14    4  -96 o   18.913   6.2313   17.254   11.135   19.214   15.578   15.206   15.922   19.868   7.3126   18.589   7.2612 1.278896 10.30532 
1 1 1   14    4  -95 o   15.836   5.0936   11.339   7.4634   12.185   15.001   11.061   8.6038   17.617   6.9967   15.838   5.4772 1.778919 8.885530 
1 1 1   14    4  -94 o   62.340   2.0364  161.100   10.334  142.109   16.685  172.918   13.163   57.548   3.5745   64.307   2.5160 -6.758850 4.371210 
1 1 1   14    4  -93 o   21.485   3.9245   20.381   6.6201   9.1052   12.744   24.549   7.7474   16.238   6.4488   23.512   4.1964 -7.273981 7.693967 
1 1 1   14    4  -92 o   19.339   4.5421   16.892   7.0374   21.499   12.765   14.881   8.4349   21.202   6.6429   18.023   5.3527 3.179811 8.531116 
1 1 1   14    4  -91 o   41.495   2.4530   71.755   8.2602   69.899   13.996   72.747   10.232   40.027   4.3600   41.539   3.0430 -1.511829 5.316883 
1 1 1   14    4  -90 o   9.0198   4.1599  -4.8132   7.1121  -9.2725   12.391  -2.6223   8.6852   11.496   5.3662   10.750   4.8135 0.7458477 7.208710 
1 1 1   14    4  -89 o   12.142   4.9990   2.8360   7.9749   8.6114   12.372  -1.2699   10.431   16.198   6.3788   12.217   5.3831 3.980947 8.346663 
1 1 1   14    4  -88 o   34.776   2.9862   50.840   8.3831   45.156   13.340   54.550   10.777   31.724   5.3487   35.723   3.7570 -3.998989 6.536342 
1 1 1   14    4  -87 o   33.309   2.9283   46.580   7.8700   56.055   13.537   41.743   9.6728   35.769   4.7609   31.171   3.8914 4.597889 6.148890 
1 1 1   14    4  -86 o   14.426   5.1416   8.1248   7.6208   12.748   16.526   6.8764   8.5884   18.894   7.3927   14.193   5.3874 4.700843 9.147483 
1 1 1   14    4  -85 o   22.861   4.1440   22.788   7.4381   12.897   12.929   27.682   9.0939   18.078   6.6605   25.077   4.6188 -6.999002 8.105307 
1 1 1   14    4  -84 o   20.651   4.4378   18.800   7.2479   31.083   12.864   13.088   8.7729   26.029   6.1595   17.342   5.5167 8.687313 8.268781 
1 1 1   14    4  -83 o   17.375   4.9442   13.326   7.3360   3.3141   12.755   18.275   8.9678   14.868   6.2376   20.185   5.3606 -5.317279 8.224639 
1 1 1   14    4  -82 o   39.278   2.5669   63.994   8.1736   51.563   13.461   71.256   10.287   34.417   4.9392   41.303   3.0777 -6.885284 5.819621 
1 1 1   14    4  -81 o   18.277   4.7889   14.736   7.2192   13.045   12.595   15.563   8.8099   18.238   6.5964   18.768   5.4426 -0.5300312 8.551857 
1 1 1   14    4  -80 o   36.825   2.8652   56.435   8.5330   37.405   15.383   64.892   10.255   28.609   6.7129   39.400   3.2212 -10.79135 7.445730 
1 1 1   14    4  -79 o   71.312   1.8655  208.667   10.835  199.253   17.032  215.066   14.043   69.306   3.0220   72.244   2.3879 -2.937752 3.851588 
1 1 1   14    4  -78 o   28.174   3.4643   33.450   7.7890   17.780   13.091   42.038   9.6911   20.402   6.7580   31.520   3.8518 -11.11768 7.778612 
1 1 1   14    4  -77 o   50.331   2.2294  104.226   9.1241   81.917   14.794  117.920   11.591   44.073   4.1676   53.435   2.6695 -9.362743 4.949224 
1 1 1   14    4  -76 o   47.229   2.3342   91.829   8.9583   63.471   14.820  108.156   11.245   38.566   4.8192   51.180   2.7051 -12.61453 5.526495 
1 1 1   14    4  -75 o   84.105   1.8923  289.668   12.974  287.963   22.334  290.537   15.938   83.397   3.2919   84.097   2.3272 -0.7007446 4.031408 
1 1 1   14    4  -74 o   47.950   3.5756   95.688   13.875   97.741   17.563   92.278   22.632   48.170   4.5258   46.162   6.1688 2.007545 7.650979 
1 1 1   14    4  -73 o   21.521   5.8935   20.262   10.640   20.468   15.357   20.072   14.756   22.087   7.3198   21.836   7.1725 0.2512112 10.24815 
1 1 1   14    4  -72 o   59.352   2.0853  144.414   10.073  143.772   12.008  145.936   18.503   59.146   2.4963   59.253   3.8518 -0.1077461 4.589988 
1 1 1   14    4  -71 o   96.784   1.7334  382.921   13.675  373.853   16.337  404.151   24.997   95.566   2.0972   99.061   3.0994 -3.495735 3.742248 
1 1 1   14    4  -70 o   41.619   2.7689   71.401   9.3400   74.434   11.397   65.198   16.299   42.394   3.3246   39.186   5.2333 3.207561 6.199987 
1 1 1   14    4  -69 o   21.366   4.9567   19.733   8.4655   20.667   18.193   19.475   9.5640   22.867   7.9614   21.196   5.4916 1.671345 9.671704 
1 1 1   14    4  -68 o   62.077   2.3115  157.945   11.676  171.608   22.328  152.801   13.698   64.283   4.2855   60.983   2.7628 3.300175 5.098866 
1 1 1   14    4  -67 o   13.313   4.9744   5.6193   7.2581   11.534   10.220  -0.3994   10.310   17.330   5.9705   12.801   5.4975 4.528649 8.116021 
1 1 1   14    4  -66 f   59.833   2.0367  146.509   9.9193  147.919   14.102  145.127   13.955   59.998   2.8919   59.428   2.8894 0.5699081 4.088043 
1 1 1   14    4  -65 f  136.684   1.7216  762.943   19.182  764.274   27.412  761.667   26.851  136.663   2.4607  136.440   2.4143 0.2230225 3.447292 
1 1 1   14    4  -64 o   72.820   1.9400  216.780   11.505  222.928   16.230  210.571   16.311   73.741   2.7047   71.651   2.7982 2.090553 3.891676 
1 1 1   14    4  -63 o   35.559   2.7933   52.084   8.0318   52.763   10.715   51.214   12.135   35.644   3.7436   34.997   4.3470 0.6470833 5.736788 
1 1 1   14    4  -62 o  106.446   1.6922  462.532   14.683  447.978   20.638  477.452   20.895  104.672   2.4188  108.067   2.3720 -3.395042 3.387788 
1 1 1   14    4  -61 o   47.504   2.2300   92.411   8.6108  100.467   11.597   82.512   12.855   49.459   2.8890   44.709   3.5567 4.749283 4.582193 
1 1 1   14    4  -60 o   37.247   2.6411   57.019   7.9667   63.425   10.701   49.054   11.932   39.195   3.3825   34.263   4.3716 4.932056 5.527418 
1 1 1   14    4  -59 o   36.794   2.8063   55.700   8.3534   52.534   11.516   59.215   12.135   35.542   4.0470   37.769   4.0024 -2.226982 5.691872 
1 1 1   14    4  -58 o   33.828   2.6370   47.065   7.2140   41.634   11.410   50.681   9.3112   31.496   4.5782   35.026   3.3001 -3.529728 5.643638 
1 1 1   14    4  -57 o  130.286   1.5181  692.509   16.122  681.520   24.982  700.353   21.106  129.157   2.3729  130.977   1.9768 -1.820114 3.088436 
1 1 1   14    4  -56 o  131.492   1.6253  705.451   17.421  710.722   25.622  700.919   23.757  131.901   2.3830  131.007   2.2246 0.8934326 3.260007 
1 1 1   14    4  -55 o  134.515   1.5281  738.152   16.756  747.549   23.207  727.920   24.217  135.314   2.1040  133.512   2.2252 1.802017 3.062420 
1 1 1   14    4  -54 o   36.887   2.5701   55.863   7.6794   48.780   11.249   62.044   10.509   34.245   4.1120   38.791   3.3566 -4.545677 5.308030 
1 1 1   14    4  -53 o   54.617   1.8627  121.876   8.2810  117.199   12.533  125.500   11.032   53.466   2.8864   55.376   2.4501 -1.910431 3.786058 
1 1 1   14    4  -52 o   76.944   1.6639  241.533   10.436  240.854   14.872  242.193   14.649   76.760   2.3797   76.978   2.3373 -0.2173080 3.335550 
1 1 1   14    4  -51 o   32.013   2.8946   42.224   7.4720   33.745   11.693   48.076   9.7139   28.198   5.2812   34.092   3.5473 -5.893873 6.361936 
1 1 1   14    4  -50 o   69.215   1.6848  195.430   9.5055  189.133   14.339  200.367   12.696   67.999   2.5916   70.025   2.2271 -2.025131 3.417054 
1 1 1   14    4  -49 o   77.150   1.6184  242.787   10.178  254.851   15.548  233.740   13.464   78.968   2.4182   75.643   2.1859 3.325294 3.259709 
1 1 1   14    4  -48 o  129.504   1.5988  684.069   16.878  673.846   22.672  696.776   25.278  128.493   2.1646  130.642   2.3737 -2.149704 3.212472 
1 1 1   14    4  -47 o   98.735   1.5095  397.584   12.149  392.844   18.003  401.548   16.463   98.106   2.2512   99.200   2.0359 -1.093987 3.035282 
1 1 1   14    4  -46 f  188.765   1.7183  1453.46   26.440  1460.18   35.528  1445.13   39.584  189.139   2.3044  188.127   2.5812 1.012680 3.460199 
1 1 1   14    4  -45 o  161.805   1.8024  1067.99   23.773  1085.93   35.304  1053.11   32.155  163.076   2.6558  160.615   2.4560 2.461288 3.617384 
1 1 1   14    4  -44 o  191.090   1.7192  1489.39   26.779  1558.47   43.846  1448.29   33.820  195.357   2.7533  188.390   2.2023 6.966965 3.525761 
1 1 1   14    4  -43 o  196.762   1.7422  1579.11   27.944  1583.21   44.636  1576.47   35.835  196.904   2.7810  196.550   2.2367 0.3539886 3.568802 
1 1 1   14    4  -42 o  169.975   1.7877  1178.43   24.769  1177.54   37.294  1179.13   33.132  169.830   2.6940  169.975   2.3913 -0.1451569 3.602180 
1 1 1   14    4  -41 o  105.985   1.7617  458.139   15.220  479.395   24.461  444.712   19.442  108.324   2.7724  104.395   2.2846 3.928886 3.592503 
1 1 1   14    4  -40 f  133.393   1.7144  725.690   18.641  692.426   27.462  754.114   25.386  130.247   2.5866  135.946   2.2908 -5.699371 3.455205 
1 1 1   14    4  -39 o  160.384   1.7671  1049.09   23.103  998.009   33.323  1096.36   32.058  156.369   2.6143  163.912   2.3993 -7.542740 3.548469 
1 1 1   14    4  -38 o  119.095   1.8545  578.498   18.003  541.990   29.509  600.142   22.722  115.158   3.1466  121.280   2.2984 -6.122505 3.896590 
1 1 1   14    4  -37 o  156.307   1.9141  996.502   24.389  1058.33   41.577  964.068   30.114  160.981   3.1684  153.710   2.4034 7.271011 3.976855 
1 1 1   14    4  -36 o   95.512   1.8658  372.064   14.526  363.303   26.278  375.919   17.432   94.242   3.4264   95.991   2.2278 -1.749481 4.086968 
1 1 1   14    4  -35 o  163.061   1.8002  1084.39   23.928  1046.11   42.220  1102.50   29.043  160.043   3.2363  164.393   2.1673 -4.350601 3.894961 
1 1 1   14    4  -34 o  108.570   1.6565  480.687   14.660  484.072   24.053  478.686   18.491  108.903   2.7096  108.327   2.0941 0.5762024 3.424469 
1 1 1   14    4  -33 o  142.589   1.6250  829.087   18.887  847.173   30.645  818.009   23.984  144.079   2.6093  141.611   2.0777 2.467896 3.335477 
1 1 1   14    4  -32 o  217.448   1.8228  1928.36   32.309  1913.08   50.582  1938.88   41.993  216.486   2.8663  217.995   2.3632 -1.508423 3.714880 
1 1 1   14    4  -31 o  135.279   1.6110  746.230   17.765  710.677   28.367  769.172   22.787  131.964   2.6371  137.323   2.0357 -5.358841 3.331395 
1 1 1   14    4  -30 o  173.203   1.6613  1223.29   23.455  1147.38   36.104  1278.73   30.853  167.679   2.6414  177.055   2.1377 -9.376633 3.398089 
1 1 1   14    4  -29 o  125.451   1.6709  641.750   17.086  592.093   30.579  664.292   20.603  120.386   3.1187  127.622   1.9804 -7.236435 3.694369 
1 1 1   14    4  -28 o   85.996   1.6510  301.556   11.574  303.110   19.373  300.694   14.432   86.137   2.7627   85.862   2.0620 0.2750778 3.447419 
1 1 1   14    4  -27 o  108.414   1.5722  479.248   13.894  492.182   22.880  471.691   17.488  109.829   2.5556  107.542   1.9950 2.287323 3.242084 
1 1 1   14    4  -26 o  131.995   1.5762  710.403   16.960  669.073   22.353  766.466   26.035  128.076   2.1411  137.071   2.3301 -8.995316 3.164418 
1 1 1   14    4  -25 o   81.173   1.7286  268.687   11.438  252.485   15.298  289.228   17.225   78.634   2.3894   84.158   2.5137 -5.524330 3.468102 
1 1 1   14    4  -24 o   70.693   1.8125  203.926   10.436  204.757   14.203  202.950   15.385   70.801   2.4648   70.473   2.6831 0.3278427 3.643354 
1 1 1   14    4  -23 f   96.858   1.4795  382.501   11.681  359.613   17.119  402.441   15.979   93.894   2.2367   99.337   1.9733 -5.442818 2.982732 
1 1 1   14    4  -22 o  133.045   1.4445  721.687   15.666  723.453   22.916  720.137   21.465  133.183   2.1109  132.883   1.9817 0.3000031 2.895300 
1 1 1   14    4  -21 o  123.603   1.4396  622.881   14.505  607.270   21.042  637.017   20.022  122.021   2.1155  124.980   1.9654 -2.958893 2.887562 
1 1 1   14    4  -20 o   78.732   1.5641  252.741   10.038  248.294   15.020  256.331   13.494   77.981   2.3657   79.250   2.0907 -1.268486 3.157145 
1 1 1   14    4  -19 o   94.683   1.4756  365.505   11.388  346.466   16.694  382.079   15.576   92.164   2.2221   96.793   1.9741 -4.628632 2.972319 
1 1 1   14    4  -18 o   68.613   1.7366  192.085   9.7051  175.993   15.359  202.781   12.522   65.607   2.8789   70.477   2.1823 -4.869240 3.612499 
1 1 1   14    4  -17 o   43.420   2.2203   77.098   7.8325   82.354   12.164   73.375   10.237   44.788   3.3562   42.296   2.9884 2.491596 4.493894 
1 1 1   14    4  -16 o  181.310   1.7958  1340.48   26.541  1310.90   32.582  1398.84   45.757  179.275   2.2295  185.131   3.0321 -5.856567 3.763558 
1 1 1   14    4  -15 o  143.454   1.6979  839.109   19.855  825.768   24.704  863.450   33.369  142.291   2.1299  145.465   2.8142 -3.173447 3.529282 
1 1 1   14    4  -14 o  224.104   1.9681  2048.13   35.953  2064.87   44.697  2017.45   60.512  224.984   2.4372  222.299   3.3394 2.684128 4.134175 
1 1 1   14    4  -13 o   90.619   1.7889  334.848   13.214  321.738   16.701  356.793   21.608   88.783   2.3097   93.464   2.8394 -4.681435 3.660208 
1 1 1   14    4  -12 o  336.307   2.5518  4614.19   69.955  4603.81   85.883  4634.67  120.588  335.846   3.1371  336.736   4.3932 -0.8895569 5.398287 
1 1 1   14    4  -11 o  104.094   1.4818  441.769   12.573  440.878   18.571  442.524   17.084  103.969   2.1913  104.169   2.0119 -0.1996460 2.974815 
1 1 1   14    4  -10 o  102.506   1.4712  428.393   12.293  423.169   18.190  432.785   16.678  101.860   2.1907  103.017   1.9861 -1.157211 2.957026 
1 1 1   14    4   -9 o  180.089   1.5458  1322.30   22.692  1291.48   32.412  1351.93   31.779  177.945   2.2345  182.066   2.1413 -4.121780 3.094870 
1 1 1   14    4   -8 o   53.001   2.0106  114.723   8.6708  111.047   14.102  116.957   10.995   52.049   3.3413   53.484   2.5291 -1.435242 4.190547 
1 1 1   14    4   -7 o  138.746   1.5344  784.862   17.353  804.157   27.312  771.800   22.472  140.408   2.3863  137.570   2.0039 2.837280 3.116150 
1 1 1   14    4   -6 o  152.860   1.5654  952.682   19.505  922.653   30.103  974.412   25.608  150.394   2.4555  154.575   2.0323 -4.181747 3.187483 
1 1 1   14    4   -5 o  238.131   2.0185  2312.53   39.181  2236.66   67.653  2350.82   48.061  234.051   3.5460  240.061   2.4560 -6.009979 4.313534 
1 1 1   14    4   -4 o  407.450   2.9616  6774.77   98.364  6772.40  171.012  6775.95  120.247  406.866   5.1563  407.361   3.6212 -0.4944458 6.300865 
1 1 1   14    4   -3 o   32.007   3.3071   42.262   8.5042   50.970   16.662   39.194   9.8893   34.771   6.1008   30.712   4.0488 4.059126 7.322073 
1 1 1   14    4   -2 o  178.398   1.7648  1297.71   25.663  1323.75   45.939  1285.89   30.941  180.094   3.1293  177.566   2.1377 2.528564 3.789725 
1 1 1   14    4   -1 o  243.673   1.7827  2421.12   35.409  2402.07   50.541  2439.48   49.624  242.655   2.5551  244.543   2.4894 -1.888229 3.567366 
1 1 1   14    4    0 o  112.121   1.4670  512.522   13.408  537.772   20.313  493.029   17.848  114.829   2.1701  109.954   1.9914 4.874916 2.945338 
1 1 1   14    4    1 o  141.949   1.5592  821.526   18.041  809.624   28.104  829.869   23.529  140.882   2.4472  142.652   2.0235 -1.769638 3.175456 
1 1 1   14    4    2 o  366.426   2.3608  5476.72   70.515  5462.90  100.138  5490.32   99.313  365.816   3.3581  366.739   3.3221 -0.9230042 4.723703 
1 1 1   14    4    3 o  169.710   1.5307  1174.25   21.175  1183.33   30.985  1166.30   29.006  170.332   2.2316  169.109   2.1042 1.223358 3.067201 
1 1 1   14    4    4 o   87.373   1.5630  311.250   11.132  328.841   17.140  298.418   14.639   89.758   2.3446   85.541   2.0995 4.217094 3.147256 
1 1 1   14    4    5 o  178.344   1.5509  1296.80   22.547  1311.79   33.021  1283.70   30.860  179.338   2.2588  177.414   2.1339 1.923431 3.107373 
1 1 1   14    4    6 o  190.496   1.6854  1479.63   26.171  1488.05   41.050  1473.86   33.969  190.981   2.6369  190.098   2.1921 0.8832703 3.429096 
1 1 1   14    4    7 o  136.121   1.5597  755.456   17.307  731.134   27.116  772.174   22.481  133.876   2.4847  137.604   2.0043 -3.727310 3.192347 
1 1 1   14    4    8 o  219.435   1.9426  1963.60   34.747  1986.27   62.404  1953.41   41.832  220.567   3.4708  218.838   2.3450 1.729218 4.188792 
1 1 1   14    4    9 o  153.418   1.8739  959.792   23.434  1001.71   39.883  937.689   28.961  156.661   3.1232  151.619   2.3433 5.042282 3.904489 
1 1 1   14    4   10 o   43.568   2.8535   77.786   10.078   54.819   19.164   86.566   11.849   35.976   6.7837   45.943   3.1836 -9.966873 7.493596 
1 1 1   14    4   11 o  170.496   1.7782  1185.32   24.713  1165.91   36.208  1202.25   33.815  169.048   2.6276  171.676   2.4163 -2.627655 3.569707 
1 1 1   14    4   12 o   80.320   1.8832  263.078   12.330  255.948   19.380  267.927   15.982   79.135   3.0099   81.007   2.4230 -1.871902 3.863973 
1 1 1   14    4   13 o  167.430   1.9253  1143.16   26.277  1175.91   44.303  1125.39   32.637  169.728   3.2022  166.097   2.4105 3.630875 4.008049 
1 1 1   14    4   14 o  182.174   1.9813  1353.41   29.423  1337.59   38.770  1374.91   45.182  181.065   2.6268  183.544   3.0199 -2.478485 4.002460 
1 1 1   14    4   15 o  105.113   1.7104  450.511   14.655  477.405   22.059  429.259   19.609  108.177   2.5015  102.584   2.3450 5.593857 3.428785 
1 1 1   14    4   16 o   85.911   2.3007  301.277   16.098  262.277   23.832  334.002   21.831   80.055   3.6617   90.417   2.9660 -10.36230 4.712234 
1 1 1   14    4   17 o  114.577   1.8829  535.346   17.585  522.552   23.173  552.720   27.004  113.176   2.5118  116.381   2.8465 -3.205170 3.796245 
1 1 1   14    4   18 o  309.324   2.9290  3904.83   73.852  3886.68  104.259  3923.11  104.628  308.401   4.1473  309.844   4.1425 -1.442841 5.861775 
1 1 1   14    4   19 o  147.447   1.8385  886.552   22.097  889.269   35.487  884.832   28.240  147.612   2.9493  147.279   2.3522 0.3327179 3.772415 
1 1 1   14    4   20 o  119.578   1.8037  583.083   17.581  592.674   28.499  577.190   22.338  120.509   2.9012  118.953   2.3038 1.555649 3.704633 
1 1 1   14    4   21 o  115.196   1.8247  541.138   17.134  533.825   27.563  545.743   21.873  114.328   2.9601  115.666   2.3199 -1.338524 3.760899 
1 1 1   14    4   22 o  186.038   2.1853  1411.68   33.139  1427.44   66.930  1406.56   38.142  186.857   4.3942  185.677   2.5201 1.180435 5.065517 
1 1 1   14    4   23 f  160.379   1.8817  1048.94   24.600  1051.43   39.456  1047.35   31.465  160.498   3.0158  160.229   2.4091 0.2691498 3.859891 
1 1 1   14    4   24 o   45.028   2.7925   83.057   10.199   97.943   17.544   75.457   12.535   48.740   4.4652   42.830   3.6245 5.910336 5.751104 
1 1 1   14    4   25 o   87.340   2.1987  311.354   15.641  335.863   22.683  289.134   21.597   90.655   3.0739   84.098   3.1561 6.556984 4.405672 
1 1 1   14    4   26 o  135.226   1.8424  745.711   20.309  713.449   32.402  766.586   26.064  132.206   3.0067  137.082   2.3325 -4.876083 3.805386 
1 1 1   14    4   27 o  193.401   2.0126  1525.54   31.729  1511.96   50.468  1534.41   40.802  192.436   3.2173  193.919   2.5812 -1.483643 4.124762 
1 1 1   14    4   28 o  245.232   2.2625  2453.26   45.227  2391.33   70.959  2495.63   58.693  241.954   3.5978  247.269   2.9119 -5.315063 4.628590 
1 1 1   14    4   29 o  221.014   2.1463  1992.50   38.668  1996.43   61.718  1989.96   49.612  221.093   3.4245  220.815   2.7563 0.2784271 4.395939 
1 1 1   14    4   30 o   93.804   1.9595  358.879   14.983  347.345   24.648  365.640   18.870   92.169   3.2859   94.634   2.4483 -2.465073 4.097689 
1 1 1   14    4   31 o   19.732   5.8198   16.207   9.9995   15.676   17.075   16.484   12.336   21.315   7.6843   20.320   6.5498 0.9956837 10.09696 
1 1 1   14    4   32 o  200.398   2.0740  1638.11   33.879  1685.07   55.291  1609.88   42.869  203.120   3.3394  198.613   2.6479 4.506927 4.261786 
1 1 1   14    4   33 o   89.828   2.3247  329.434   17.008  309.032   24.373  348.796   23.744   86.909   3.4473   92.367   3.1583 -5.457542 4.675293 
1 1 1   14    4   34 o   71.041   2.6133  206.249   15.108  190.727   21.883  220.387   20.883   68.189   3.9538   73.363   3.5022 -5.173744 5.281865 
1 1 1   14    4   35 o   69.186   3.2076  195.911   18.040  209.118   23.261  175.980   28.577   71.404   4.0126   65.299   5.4175 6.104630 6.741705 
1 1 1   14    4   36 o  199.691   3.3096  1628.79   53.874  1622.70   76.888  1634.67   75.509  199.091   4.7377  199.843   4.6352 -0.7521210 6.628075 
1 1 1   14    4   37 o  145.901   2.4652  868.661   29.319  867.583   52.466  869.150   35.354  145.549   4.4273  145.902   2.9726 -0.3536072 5.332686 
1 1 1   14    4   38 o   68.694   2.9101  193.006   16.259  203.249   30.478  188.932   19.222   70.210   5.3660   67.912   3.4839 2.298187 6.397798 
1 1 1   14    4   39 o  229.445   2.4617  2148.41   46.041  2077.82   91.494  2172.35   53.278  225.199   4.9841  230.672   2.8335 -5.472748 5.733250 
1 1 1   14    4   40 f  229.801   2.2008  2154.60   41.226  2186.36   66.562  2134.83   52.510  231.297   3.5304  228.667   2.8171 2.629700 4.516595 
1 1 1   14    4   41 o   85.665   2.0366  299.382   14.221  298.983   23.522  299.612   17.854   85.471   3.3828   85.637   2.5605 -0.1653748 4.242607 
1 1 1   14    4   42 o  146.162   1.8790  871.439   22.387  865.812   36.068  874.965   28.552  145.592   3.0392  146.420   2.3922 -0.8279724 3.867714 
1 1 1   14    4   43 o   66.155   2.2246  178.789   11.979  152.795   19.530  194.469   15.168   60.985   3.9498   68.961   2.7035 -7.975380 4.786417 
1 1 1   14    4   44 o   66.565   2.4898  181.130   13.486  157.432   30.668  186.810   15.015   61.549   6.1970   67.582   2.7312 -6.033268 6.772150 
1 1 1   14    4   45 o  101.855   1.9011  423.243   15.785  407.851   25.618  432.663   20.041   99.853   3.1513  102.954   2.3880 -3.100990 3.953881 
1 1 1   14    4   46 f   69.987   2.1624  200.084   12.322  199.002   20.730  200.675   15.322   69.651   3.6641   70.048   2.6884 -0.3962936 4.544550 
1 1 1   14    4   47 o   39.146   3.1729   63.042   10.038   63.110   17.035   63.006   12.424   38.801   5.5433   39.033   3.9595 -0.2328262 6.812137 
1 1 1   14    4   48 o  110.544   1.8788  498.573   16.930  490.353   27.772  503.434   21.356  109.486   3.1150  111.049   2.3593 -1.562561 3.907617 
1 1 1   14    4   49 o   39.649   3.8044   64.938   12.145   57.286   17.706   71.737   16.690   36.807   6.1158   41.496   5.0373 -4.689106 7.923178 
1 1 1   14    4   50 o   77.373   2.0942  244.514   13.196  242.706   22.367  245.480   16.344   76.930   3.5766   77.482   2.5913 -0.5521927 4.416711 
1 1 1   14    4   51 o   85.491   2.0049  298.281   13.972  288.059   23.313  304.011   17.454   83.838   3.4185   86.242   2.4853 -2.403862 4.226492 
1 1 1   14    4   52 o  129.943   1.8649  689.031   19.754  673.532   32.092  698.485   25.065  128.341   3.0676  130.785   2.3511 -2.444168 3.864943 
1 1 1   14    4   53 o   38.216   3.2420   60.176   10.004   62.609   17.371   58.968   12.237   38.567   5.6969   37.713   4.0436 0.8544312 6.986094 
1 1 1   14    4   54 o   92.731   2.1759  351.101   16.448  330.022   24.420  368.603   22.252   89.733   3.3444   94.907   2.8796 -5.173660 4.413279 
1 1 1   14    4   55 o  104.376   2.3849  445.012   20.291  451.766   38.979  442.501   23.764  104.756   4.5758  103.999   2.8058 0.7570877 5.367539 
1 1 1   14    4   56 o   98.184   2.3939  393.815   19.159  399.136   36.927  391.855   22.412   98.430   4.6152   97.856   2.8126 0.5740814 5.404718 
1 1 1   14    4   57 o   45.365   2.9953   84.558   11.014   65.483   26.878   88.408   12.075   38.738   8.7226   46.363   3.2150 -7.624901 9.296203 
1 1 1   14    4   58 o   31.972   3.6565   42.446   9.3584   39.414   17.659   43.631   11.035   30.158   7.2692   32.310   4.2964 -2.152323 8.443978 
1 1 1   14    4   59 o   16.467   5.4918   10.606   8.6414   31.577   16.238   2.3205   10.207   27.036   7.2285   13.677   5.6457 13.35892 9.171948 
1 1 1   14    4   60 o   66.557   2.1559  181.152   11.681  177.277   20.215  183.094   14.313   65.612   3.7958   66.859   2.6313 -1.247795 4.618650 
1 1 1   14    4   61 o   21.078   5.2154   19.082   8.9116   33.767   17.028   13.542   10.458   27.894   7.3769   18.406   6.0378 9.488092 9.532793 
1 1 1   14    4   62 o   70.288   2.0904  202.019   11.964  183.403   19.676  212.939   15.070   66.744   3.6301   72.106   2.5680 -5.361534 4.446640 
1 1 1   14    4   63 o   75.934   2.0204  235.732   12.495  259.921   20.395  221.196   15.810   79.567   3.1507   73.473   2.6440 6.094368 4.113104 
1 1 1   14    4   64 o  118.726   1.8181  575.685   17.595  582.286   27.461  571.088   22.917  119.232   2.8255  118.165   2.3793 1.067360 3.693789 
1 1 1   14    4   65 f  108.730   1.8306  482.911   16.225  500.553   25.859  471.456   20.836  110.482   2.8738  107.350   2.3811 3.132072 3.732058 
1 1 1   14    4   66 f   68.458   2.1021  191.782   11.716  217.654   19.398  176.923   14.701   72.728   3.2805   65.653   2.7531 7.075539 4.282633 
1 1 1   14    4   67 o   82.830   2.0078  280.474   13.556  273.082   23.574  284.126   16.570   81.392   3.5618   83.271   2.4437 -1.879684 4.319532 
1 1 1   14    4   68 o   39.859   2.9024   65.524   9.3656   40.962   15.832   78.747   11.616   30.641   6.5379   43.647   3.2891 -13.00606 7.318604 
1 1 1   14    4   69 o   72.826   1.9543  217.024   11.591  203.986   18.555  225.369   14.844   70.357   3.2441   74.129   2.4599 -3.772430 4.071300 
1 1 1   14    4   70 o   55.343   2.4097  125.733   10.845  148.523   22.489  118.828   12.379   59.601   4.6661   53.724   2.8368 5.877174 5.460768 
1 1 1   14    4   71 o   81.468   1.8585  271.434   12.342  232.905   19.581  296.832   15.898   75.146   3.2040   85.088   2.2942 -9.941582 3.940716 
1 1 1   14    4   72 o   52.040   2.4614  111.330   10.412   91.201   19.828  118.993   12.234   46.326   5.3487   53.738   2.8026 -7.411339 6.038510 
1 1 1   14    4   73 o   29.297   3.7569   36.094   8.7657   17.559   17.673   42.142   10.095   21.514   7.8092   31.630   4.0050 -10.11579 8.776296 
1 1 1   14    4   74 o   18.247   6.4949   12.693   12.157   14.866   16.492   10.108   17.989   20.264   7.5125   19.265   7.6585 0.9986172 10.72799 
1 1 1   14    4   75 o   11.906   5.1733  -0.9974   9.3437  -0.4188   11.134  -2.3752   17.181   13.169   5.6847   15.783   6.9329 -2.614292 8.965569 
1 1 1   14    4   76 o   64.896   2.3036  173.150   12.167  173.300   14.089  172.711   24.129   64.827   2.6718   63.967   4.6595 0.8599205 5.371152 
1 1 1   14    4   77 o   47.537   2.1912   92.965   8.4679   98.212   12.709   88.777   11.355   48.603   3.2262   46.255   3.0283 2.348907 4.424826 
1 1 1   14    4   78 o   30.976   3.3375   40.250   8.2943   46.097   11.411   33.701   12.078   32.863   4.3677   27.632   5.5549 5.231207 7.066352 
1 1 1   14    4   79 o   33.008   2.8602   45.363   7.6200   45.425   11.689   45.317   10.049   32.529   4.5311   32.720   3.8406 -0.1903954 5.939786 
1 1 1   14    4   80 o   41.077   2.0684   69.488   6.9034   63.237   11.807   72.734   8.5095   38.706   3.7907   41.929   2.5011 -3.222878 4.541462 
1 1 1   14    4   81 o   44.042   1.9851   79.824   7.1086   83.721   12.296   77.867   8.7121   44.701   3.3999   43.383   2.4738 1.317749 4.204667 
1 1 1   14    4   82 o   32.134   2.5427   42.903   6.6061   61.656   12.844   36.157   7.7031   37.996   4.2179   29.290   3.2827 8.705673 5.344780 
1 1 1   14    4   83 o   33.134   2.5599   45.648   6.8604   48.454   14.890   44.891   7.7298   32.920   5.7581   32.758   2.9255 0.1620522 6.458706 
1 1 1   14    4   84 o   21.631   3.5549   20.093   6.0506   26.255   11.932   17.960   7.0202   23.927   6.1001   20.188   4.3912 3.738605 7.516273 
1 1 1   14    4   85 o   39.364   2.1118   64.016   6.7514   59.709   12.935   65.628   7.9150   37.213   4.3459   39.765   2.4538 -2.551449 4.990805 
1 1 1   14    4   86 o   13.428   4.4924   7.4111   5.7818   10.027   11.453   6.5165   6.6980   16.522   6.2326   13.238   4.8072 3.284046 7.871114 
1 1 1   14    4   87 o   58.829   1.9647  142.656   9.4084  127.976   13.259  157.546   13.353   55.325   2.9506   61.538   2.6682 -6.213139 3.978135 
1 1 1   14    4   88 o   53.275   2.0180  117.137   8.7477  116.599   12.860  117.601   11.934   52.756   3.0028   53.091   2.7672 -0.3350258 4.083359 
1 1 1   14    4   89 o   8.0437   3.5745  -1.4287   4.6959  -8.1794   10.263   0.3587   5.2811   10.464   4.8843   9.3006   3.9629 1.163287 6.289736 
1 1 1   14    4   90 o   25.385   2.5889   27.055   5.2820   35.865   13.066   25.334   5.7750   27.792   5.9471   24.447   2.9581 3.345119 6.642137 
1 1 1   14    4   91 o   54.958   1.5432  124.130   6.9065  111.560   14.884  127.579   7.7967   51.168   3.5914   55.661   1.7205 -4.493038 3.982248 
1 1 1   14    4   92 o   37.076   2.9003   57.948   8.6958   54.306   11.207   63.459   13.785   35.391   3.9522   37.934   4.5485 -2.543736 6.025671 
1 1 1   14    4   93 o   39.338   2.7434   65.079   8.7420   56.322   11.386   77.652   13.644   35.994   3.9453   42.280   4.0067 -6.285763 5.623108 
1 1 1   14    4   94 o   47.257   2.4313   93.331   9.3343   94.265   12.330   92.077   14.286   47.051   3.2346   46.104   3.8360 0.9472504 5.017755 
1 1 1   14    4   95 o   35.937   3.0233   54.965   8.7742   53.266   11.430   57.403   13.691   34.764   4.1130   35.612   4.8418 -0.8475227 6.352928 
1 1 1   14    4   96 o   30.040   3.5989   39.339   8.6373   42.169   11.141   35.076   13.674   30.504   4.6255   26.590   6.3887 3.913834 7.887372 
1 1 1   14    4   97 o   46.006   2.5330   89.119   9.4625   82.392   12.133   99.561   15.118   43.647   3.4380   47.591   3.9320 -3.943623 5.223028 
1 1 1   14    4   98 o   27.559   3.9286   33.831   8.5759   30.230   11.005   39.400   13.684   25.020   5.5422   28.196   6.1290 -3.176785 8.263246 
1 1 1   14    4   99 o   41.509   2.7052   73.209   9.1033   67.582   11.668   81.960   14.552   39.195   3.6958   42.715   4.2351 -3.520378 5.620902 
1 1 1   14    4  100 o   21.435   5.1212   22.190   8.8255   4.9827   11.825   43.829   13.260   14.041   5.9543   29.931   5.6417 -15.89065 8.202592 
1 1 1   14    4  101 o   32.185   3.6694   46.066   9.4552   43.322   12.665   49.522   14.212   29.835   5.4068   31.643   5.7201 -1.808666 7.871081 
1 1 1   14    4  102 o   17.867   5.5061   15.944   8.8105   10.606   11.772   22.741   13.284   15.682   6.2077   20.415   6.8090 -4.733274 9.214040 
1 1 1   14    4  103 o   13.960   5.3819   8.0714   8.6592  -9.1284   11.722   28.731   12.847   10.616   5.0358   23.050   6.5373 -12.43410 8.252056 
1 1 1   14    4  104 o   11.123   4.9778  -0.7687   9.2759  -1.6810   11.820   0.6940   14.967   12.109   5.5001   13.811   6.2397 -1.702508 8.317751 
1 1 1   14    4  105 o   50.486   2.7103  109.326   11.113  107.890   14.216  111.582   17.819   49.274   3.5635   48.917   4.5199 0.3569908 5.755724 
1 1 1   14    4  106 o   15.657   6.0992   11.402   11.209  -2.5379   16.372   23.700   15.378   13.544   6.2694   20.126   7.2875 -6.582751 9.613150 
1 1 1   14    4  107 o   11.205   5.1734  -3.7419   11.044  -3.3039   16.124  -4.1290   15.158   13.290   6.1760   12.820   5.9678 0.4703312 8.588205 
1 1 1   14    4  108 o   20.278   6.4443   22.828   11.974   32.983   17.932   14.657   16.085   22.678   7.9035   17.140   7.0824 5.538021 10.61258 
1 1 1   14    4  109 o   21.007   6.2827   24.295   11.589   25.580   17.237   23.236   15.656   20.270   7.6463   19.700   7.3165 0.5700512 10.58287 
1 1 1   14    4  110 o   14.758   5.9929   9.3305   11.268   10.836   16.788   8.0964   15.200   16.124   6.9707   15.201   6.6019 0.9234304 9.600788 
1 1 1   14    4  111 o   13.920   5.8688   6.7513   11.379   0.3930   16.693   12.271   15.552   13.934   6.4071   16.263   6.8591 -2.328323 9.386121 
1 1 1   14    4  112 o   22.887   6.7691   30.522   13.512   20.604   17.114   46.935   22.017   18.522   7.4339   25.289   8.7608 -6.766802 11.48978 
1 1 1   14    4  113 o   12.898   5.8311   1.1119   13.097   4.5436   16.807  -4.1945   20.899   14.614   6.6062   14.181   6.7264 0.4322481 9.427959 
1 1 1   14    4  114 o   21.893   7.8551   32.199   17.818   32.199   17.818   0.0000   0.0000   21.893   7.8551  ?   ?  0.000000 7.855147 
1 1 1   14    4  115 o   12.866   6.0685  -5.3636   16.571  -5.3636   16.571   0.0000   0.0000   12.866   6.0685  ?   ?  0.000000 6.068531 
1 1 1   14    5 -113 o   17.460   7.3145   17.008   17.499   25.424   25.159   9.1224   24.354   19.245   8.4234   16.578   7.6643 2.666906 11.38839 
1 1 1   14    5 -112 o   14.557   6.4538   6.1633   15.218   13.744   19.126  -6.9193   25.125   16.770   7.3421   14.703   7.0807 2.067122 10.20011 
1 1 1   14    5 -111 o   23.410   7.2453   33.958   15.236   37.175   19.353   28.712   24.709   22.957   8.1922   19.808   8.5088 3.149744 11.81152 
1 1 1   14    5 -110 o   15.682   6.6639   10.926   14.864   1.9562   18.453   27.501   25.084   14.517   6.6972   19.649   8.5074 -5.131615 10.82724 
1 1 1   14    5 -109 o   13.901   6.2292   3.4887   14.578  -3.0337   17.971   16.038   24.927   13.660   6.4043   17.771   8.0385 -4.111328 10.27773 
1 1 1   14    5 -108 o   10.819   5.1669  -9.6956   12.768   8.7420   18.200 -27.5624   17.916   15.825   7.0346   10.829   5.3686 4.996460 8.849137 
1 1 1   14    5 -107 o   13.232   5.8749   2.7434   12.657   7.5725   18.091  -1.8858   17.713   15.626   6.9753   13.855   6.4502 1.770845 9.500546 
1 1 1   14    5 -106 o   16.113   6.5176   12.392   13.267   32.839   18.929  -7.3502   18.600   22.242   8.0807   13.357   6.3383 8.884855 10.26993 
1 1 1   14    5 -105 o   28.050   5.9830   41.206   13.263   52.247   18.912   30.521   18.605   29.281   7.7885   21.685   7.9899 7.596180 11.15788 
1 1 1   14    5 -104 o   12.045   5.5523  -3.0565   12.646  -6.0241   17.945  -0.1289   17.824   13.422   6.3261   14.315   6.5961 -0.8928328 9.139410 
1 1 1   14    5 -103 o   14.889   6.2004   8.4258   12.465   2.8751   17.397   14.281   17.867   14.808   6.7050   17.341   7.3349 -2.533380 9.937671 
1 1 1   14    5 -102 o   14.620   6.1213   7.5143   12.244   2.0802   16.800   13.672   17.884   14.572   6.5945   17.298   7.3284 -2.725741 9.858685 
1 1 1   14    5 -101 o   14.181   6.0438   5.8142   12.289  -0.8498   17.086   12.955   17.686   14.170   6.5034   17.180   7.2837 -3.009933 9.764516 
1 1 1   14    5 -100 o   14.074   6.0104   5.4174   12.196  -8.9773   16.963   20.821   17.547   12.861   6.0884   19.336   7.6022 -6.474786 9.739727 
1 1 1   14    5  -99 o   11.718   5.3930  -3.8382   11.863 -13.8320   16.179   7.7833   17.447   11.939   5.7323   16.098   7.0310 -4.159096 9.071598 
1 1 1   14    5  -98 o   22.648   6.3674   26.997   12.242   29.269   17.599   24.867   17.042   22.324   7.8264   20.900   7.6558 1.424797 10.94823 
1 1 1   14    5  -97 o   22.410   6.5518   26.451   12.721   33.720   17.772   18.815   18.216   24.104   7.8685   19.249   7.6885 4.855375 11.00124 
1 1 1   14    5  -96 o   17.452   6.1453   14.643   10.859   35.121   13.765 -19.0992   17.669   26.146   6.4892   12.095   5.8527 14.05038 8.738652 
1 1 1   14    5  -95 f   30.583   4.7260   43.021   11.403   51.580   14.657   29.898   18.148   32.744   5.6982   23.140   7.9568 9.603430 9.786682 
1 1 1   14    5  -94 o   18.495   5.5729   16.447   9.0931   18.526   13.739   14.827   12.130   19.373   6.9037   17.816   6.4693 1.557106 9.461131 
1 1 1   14    5  -93 o   20.698   4.3812   19.533   7.1611   22.917   13.333   18.161   8.4896   21.298   6.8038   19.588   5.2220 1.709564 8.576735 
1 1 1   14    5  -92 o   18.365   5.1572   15.775   8.0362   13.202   15.786   16.675   9.3366   18.074   7.1776   18.757   5.6460 -0.6831055 9.132092 
1 1 1   14    5  -91 o   11.408   4.8352   1.5703   7.7914  -0.7584   14.827   2.4586   9.1578   14.225   6.3347   12.473   5.2623 1.751933 8.235250 
1 1 1   14    5  -90 o   19.003   5.1078   16.693   8.0815   2.9857   15.444   21.861   9.4836   15.407   6.6730   21.634   5.3960 -6.227597 8.581739 
1 1 1   14    5  -89 o   16.434   5.1264   12.131   7.6109   19.626   12.839   8.0706   9.4503   20.363   6.6904   14.837   5.6467 5.526175 8.754807 
1 1 1   14    5  -88 o   23.337   4.2688   24.115   7.8216   23.416   13.230   24.490   9.6980   22.097   6.7355   23.098   5.2678 -1.001507 8.550858 
1 1 1   14    5  -87 o   14.593   5.1001   8.7190   7.4699  -9.9759   12.471   19.180   9.3286   11.400   5.3417   20.399   5.4899 -8.998574 7.659828 
1 1 1   14    5  -86 o   52.509   3.5810  117.084   15.236  117.084   15.236   0.0000   0.0000   52.509   3.5810  ?   ?  0.000000 3.580952 
1 1 1   14    5  -85 o   11.206   4.9896  -2.2764   9.1948   5.0056   12.236 -11.7218   13.936   14.976   6.1816   11.944   5.6122 3.032323 8.349198 
1 1 1   14    5  -84 o   27.649   5.8873   35.109   12.862   34.335   16.870   36.185   19.876   26.592   7.4740   26.961   8.2631 -0.3691826 11.14180 
1 1 1   14    5  -83 o   43.364   3.9473   80.340   13.800   80.340   13.800   0.0000   0.0000   43.364   3.9473  ?   ?  0.000000 3.947289 
1 1 1   14    5  -82 o   18.132   5.9564   14.379   10.177   13.678   14.749   15.017   14.060   18.774   7.0749   19.097   6.9603 -0.3228970 9.924746 
1 1 1   14    5  -81 o   11.674   4.9452   1.1207   8.1419   2.7178   12.249  -0.1434   10.898   14.405   6.0820   12.888   5.5937 1.516714 8.263207 
1 1 1   14    5  -80 o   33.020   3.4229   46.066   9.0797   45.548   13.484   46.496   12.282   32.056   5.3485   32.662   4.7522 -0.6061249 7.154707 
1 1 1   14    5  -79 o   10.023   4.4660  -2.3360   7.3812  -5.2915   12.213  -0.6354   9.2645   12.380   5.6105   11.832   5.1463 0.5475788 7.613228 
1 1 1   14    5  -78 o   41.566   2.6178   71.669   8.8248   60.702   14.169   78.620   11.280   37.489   4.7424   43.356   3.2145 -5.866283 5.729227 
1 1 1   14    5  -77 o   32.968   3.2002   45.571   8.4922   54.788   13.597   39.676   10.874   35.601   4.8080   30.310   4.5409 5.291498 6.613355 
1 1 1   14    5  -76 o   9.7490   4.4267  -4.0559   7.6475  -9.1648   12.550  -1.0382   9.6452   11.827   5.4798   12.001   5.2348 -0.1733494 7.578282 
1 1 1   14    5  -75 o   9.1414   4.2550  -6.5854   7.7022  -6.3112   12.721  -6.7441   9.6778   12.533   5.6980   10.543   4.8589 1.990018 7.488462 
1 1 1   14    5  -74 o   33.284   3.1061   46.232   8.3298   37.280   13.102   52.306   10.792   29.038   5.7386   35.220   3.8201 -6.181622 6.893806 
1 1 1   14    5  -73 o   15.206   5.2345   9.0889   7.8549   18.264   12.877   3.6518   9.9127   20.633   6.6953   13.755   5.6079 6.877951 8.733574 
1 1 1   14    5  -72 o   10.548   4.6260  -1.5089   7.6227  -2.7296   12.374  -0.7625   9.6767   13.240   5.8470   12.175   5.2778 1.064114 7.876696 
1 1 1   14    5  -71 o   23.669   3.9124   23.872   7.2851   24.071   9.9616   23.644   10.682   23.426   5.3362   23.151   5.6990 0.2753239 7.807339 
1 1 1   14    5  -70 o   43.415   2.6199   77.748   9.2285   82.759   14.786   74.550   11.812   44.415   4.1314   42.323   3.4537 2.092762 5.384832 
1 1 1   14    5  -69 o   52.089   2.4451  111.584   10.353  106.223   18.163  114.164   12.601   50.291   4.4774   52.583   2.9516 -2.291508 5.362714 
1 1 1   14    5  -68 o   23.184   4.0237   22.895   7.3285   21.006   10.484   24.700   10.248   21.918   5.7845   23.798   5.4064 -1.880064 7.917706 
1 1 1   14    5  -67 o   31.762   3.0399   41.866   7.7744   30.116   10.934   53.879   11.056   26.381   5.2693   35.899   3.8376 -9.517826 6.518650 
1 1 1   14    5  -66 o   37.660   2.5671   58.427   7.8334   64.259   10.677   51.627   11.528   39.360   3.3598   35.086   4.1086 4.274071 5.307403 
1 1 1   14    5  -65 o   77.141   1.7045  243.149   10.718  251.105   14.621  233.907   15.758   78.279   2.2938   75.497   2.5643 2.782036 3.440511 
1 1 1   14    5  -64 f   49.294   2.1961   99.621   8.8022  105.796   11.826   91.952   13.180   50.698   2.8734   47.147   3.4534 3.551453 4.492490 
1 1 1   14    5  -63 o   23.587   3.6867   23.442   6.8563   22.467   10.460   24.177   9.0788   22.759   5.6614   23.725   4.8581 -0.9660854 7.460006 
1 1 1   14    5  -62 f   20.637   5.0433   18.370   8.4108   22.505   11.907   14.253   11.882   22.806   6.2300   19.018   6.4405 3.787500 8.960633 
1 1 1   14    5  -61 o   83.221   2.0237  283.068   13.729  253.538   20.631  306.534   18.391   78.525   3.2301   86.482   2.6119 -7.956848 4.153942 
1 1 1   14    5  -60 o  140.020   1.5831  800.373   18.069  798.249   28.362  801.824   23.441  139.667   2.4911  140.070   2.0531 -0.4024506 3.228133 
1 1 1   14    5  -59 f   67.599   1.8333  186.764   10.093  204.865   16.293  175.493   12.857   70.669   2.8341   65.458   2.4137 5.210342 3.722603 
1 1 1   14    5  -58 o   31.782   3.0070   41.747   7.6977   39.276   12.557   43.235   9.7431   30.388   5.2598   32.223   3.7812 -1.834990 6.477886 
1 1 1   14    5  -57 o   44.100   2.3430   79.723   8.3923   79.231   13.592   80.026   10.669   43.750   3.8506   44.105   2.9851 -0.3551979 4.872142 
1 1 1   14    5  -56 o  192.568   1.7034  1513.66   26.738  1498.22   41.634  1524.49   34.882  191.374   2.6689  193.155   2.2154 -1.780914 3.468585 
1 1 1   14    5  -55 o   42.943   2.4766   75.635   8.6323   70.585   13.225   79.384   11.394   41.267   3.9808   43.907   3.2057 -2.639561 5.111101 
1 1 1   14    5  -54 o   85.748   1.6187  300.048   11.314  303.035   18.045  298.113   14.524   86.054   2.5753   85.436   2.0854 0.6181488 3.313801 
1 1 1   14    5  -53 o   27.272   3.6450   31.026   7.9004   29.385   14.146   31.770   9.5243   26.098   6.6356   27.465   4.4028 -1.367393 7.963434 
1 1 1   14    5  -52 o   33.942   2.8055   47.433   7.6930   48.444   12.505   46.817   9.7583   34.016   4.6298   33.607   3.6192 0.4092827 5.876524 
1 1 1   14    5  -51 o   50.594   2.2321  104.745   9.1829  112.001   14.083   99.378   12.112   52.197   3.3271   49.193   3.0353 3.004753 4.503660 
1 1 1   14    5  -50 o   84.770   1.7232  293.226   11.907  287.525   17.598  298.039   16.170   83.841   2.5780   85.390   2.3253 -1.548805 3.471792 
1 1 1   14    5  -49 o  164.867   1.7202  1109.10   23.118  1173.51   34.532  1056.79   31.120  169.478   2.4996  160.848   2.3735 8.629822 3.446949 
1 1 1   14    5  -48 o   84.514   1.8463  291.488   12.719  282.004   20.830  297.127   16.061   82.976   3.0850   85.265   2.3130 -2.289291 3.855793 
1 1 1   14    5  -47 o   47.302   2.6653   91.715   10.235   95.038   16.967   89.814   12.833   47.925   4.3919   46.724   3.3926 1.200832 5.549604 
1 1 1   14    5  -46 o   18.163   5.1556   13.914   7.9869   33.512   15.117   6.3247   9.4070   27.908   6.7250   14.799   5.6334 13.10923 8.772706 
1 1 1   14    5  -45 o   70.795   1.7153  204.472   9.8989  191.852   14.940  214.349   13.217   68.475   2.6817   72.425   2.2414 -3.950111 3.495070 
1 1 1   14    5  -44 o   60.499   1.9913  149.529   9.8068  155.924   16.375  145.953   12.246   61.661   3.2695   59.728   2.5209 1.932739 4.128499 
1 1 1   14    5  -43 o  215.938   1.9663  1902.76   34.611  1878.94   49.060  1926.36   48.835  214.450   2.8065  217.148   2.7589 -2.697784 3.935486 
1 1 1   14    5  -42 o  145.630   1.7615  865.197   20.911  862.486   30.141  867.713   29.036  145.329   2.5443  145.779   2.4435 -0.4507141 3.527613 
1 1 1   14    5  -41 o   82.660   1.7096  278.717   11.519  275.015   18.952  280.885   14.506   81.999   2.8396   82.933   2.1476 -0.9336090 3.560314 
1 1 1   14    5  -40 o   75.115   1.7666  230.165   10.817  249.456   18.185  219.603   13.456   78.091   2.8616   73.316   2.2542 4.774910 3.642793 
1 1 1   14    5  -39 o   55.231   2.1086  124.661   9.4756  119.900   16.388  127.052   11.614   54.006   3.7459   55.723   2.5637 -1.717827 4.539150 
1 1 1   14    5  -38 o  121.510   1.7415  602.257   17.250  617.850   34.324  596.988   19.952  122.883   3.4301  120.960   2.0235 1.922630 3.982454 
1 1 1   14    5  -37 o   84.165   1.7173  288.931   11.782  296.557   19.703  284.686   14.700   85.165   2.8421   83.498   2.1615 1.667419 3.570662 
1 1 1   14    5  -36 o  157.663   1.6232  1013.80   20.862  1052.09   33.727  990.063   26.550  160.534   2.5773  155.773   2.0909 4.760483 3.318812 
1 1 1   14    5  -35 o   56.974   2.1045  132.621   9.7572  135.609   16.614  131.048   12.055   57.485   3.5630   56.597   2.6201 0.8885498 4.422672 
1 1 1   14    5  -34 o   70.891   1.8806  205.137   10.857  205.354   18.280  205.019   13.496   70.829   3.1743   70.840   2.3403 -0.1189423E-01 3.943753 
1 1 1   14    5  -33 o  170.803   1.7799  1189.89   24.781  1198.76   44.550  1185.91   29.820  171.303   3.1904  170.490   2.1457 0.8136749 3.844830 
1 1 1   14    5  -32 o   17.347   5.5220   12.100   8.7888   10.656   17.756   12.568   10.115   19.922   7.6997   17.943   5.9402 1.978458 9.724819 
1 1 1   14    5  -31 o   98.278   2.0554  394.014   16.466  399.277   27.021  390.906   20.767   98.802   3.3600   97.829   2.6065 0.9730835 4.252424 
1 1 1   14    5  -30 o   82.042   2.4564  274.922   16.409  262.156   24.331  285.573   22.225   79.998   3.7415   83.550   3.2696 -3.552010 4.968803 
1 1 1   14    5  -29 o  110.466   2.0727  497.783   18.664  483.149   25.091  515.908   27.926  108.752   2.8328  112.361   3.0518 -3.608521 4.163928 
1 1 1   14    5  -28 o   92.686   2.2721  350.498   17.167  346.161   23.536  355.427   25.093   92.014   3.1426   93.223   3.3074 -1.209290 4.562305 
1 1 1   14    5  -27 o   96.410   1.9521  379.122   15.341  364.106   23.665  390.007   20.148   94.377   3.0802   97.726   2.5314 -3.348274 3.986927 
1 1 1   14    5  -26 o  115.011   2.0532  539.578   19.249  555.302   26.887  523.044   27.570  116.631   2.8281  113.142   2.9920 3.488411 4.117075 
1 1 1   14    5  -25 o  106.018   2.0611  458.492   17.812  448.533   24.569  469.527   25.861  104.778   2.8793  107.197   2.9625 -2.418449 4.131179 
1 1 1   14    5  -24 o  194.273   2.1001  1539.59   33.257  1497.02   43.674  1598.35   51.309  191.503   2.7977  197.834   3.1817 -6.330673 4.236786 
1 1 1   14    5  -23 o  157.590   1.8286  1012.85   23.490  980.529   34.064  1042.16   32.434  154.997   2.6961  159.810   2.4898 -4.813171 3.669909 
1 1 1   14    5  -22 o  295.174   2.3636  3554.88   56.870  3425.69   79.532  3690.06   81.351  289.602   3.3690  300.578   3.3203 -10.97647 4.730151 
1 1 1   14    5  -21 o  124.637   1.6054  633.447   16.311  617.304   25.570  644.521   21.179  122.993   2.5504  125.702   2.0669 -2.708488 3.282809 
1 1 1   14    5  -20 o   55.194   2.0737  124.438   9.3133  122.460   14.294  125.896   12.277   54.668   3.2220   55.473   2.7233 -0.8059464 4.218711 
1 1 1   14    5  -19 o   42.364   2.4662   73.475   8.4795   77.637   13.298   70.624   11.008   43.424   3.7951   41.457   3.2841 1.966633 5.018765 
1 1 1   14    5  -18 o   34.341   2.9264   48.488   8.1139   34.329   12.736   58.160   10.527   28.441   5.6924   37.575   3.4762 -9.133900 6.669894 
1 1 1   14    5  -17 o  147.861   1.5080  891.431   18.176  867.493   26.338  913.197   25.115  145.828   2.2157  149.629   2.0591 -3.801041 3.024728 
1 1 1   14    5  -16 o  145.834   1.4962  867.158   17.786  891.628   26.217  846.292   24.209  147.845   2.1754  144.044   2.0618 3.801605 2.997211 
1 1 1   14    5  -15 o   25.634   4.0558   27.512   8.1932   21.011   11.930   33.316   11.272   22.330   6.2883   28.097   5.1098 -5.766745 8.102632 
1 1 1   14    5  -14 o  163.234   1.5223  1086.42   20.255  1074.97   29.265  1096.96   28.063  162.334   2.2116  163.993   2.0993 -1.659225 3.049268 
1 1 1   14    5  -13 o   56.145   1.9544  128.716   8.9310  117.427   13.628  137.215   11.824   53.539   3.1363   57.937   2.5096 -4.397659 4.016777 
1 1 1   14    5  -12 o   63.200   1.8203  163.024   9.3682  157.941   14.240  166.903   12.439   62.145   2.8184   63.917   2.3917 -1.771774 3.696416 
1 1 1   14    5  -11 o   93.060   1.5381  353.106   11.668  351.023   17.501  354.773   15.654   92.761   2.3145   93.264   2.0591 -0.5030060 3.097913 
1 1 1   14    5  -10 o   84.077   1.8556  288.281   12.718  289.190   19.954  287.659   16.504   84.124   2.9143   83.935   2.4147 0.1885834 3.784719 
1 1 1   14    5   -9 o   31.016   3.6552   39.838   9.0642   44.010   15.015   37.446   11.370   32.266   5.9272   29.877   4.8334 2.388836 7.648086 
1 1 1   14    5   -8 o  143.616   1.7352  841.062   20.313  856.059   30.426  829.002   27.284  144.846   2.5769  142.553   2.3480 2.294037 3.486213 
1 1 1   14    5   -7 o   65.032   2.1217  172.683   11.232  155.269   17.576  184.706   14.604   61.559   3.5173   67.226   2.6703 -5.667389 4.416070 
1 1 1   14    5   -6 o  194.894   1.6079  1548.78   25.545  1559.93   37.055  1538.68   35.263  195.548   2.3246  194.219   2.2274 1.329041 3.219479 
1 1 1   14    5   -5 o  130.298   1.4783  692.211   15.701  685.041   23.053  698.414   21.443  129.594   2.1823  130.861   2.0102 -1.266647 2.967032 
1 1 1   14    5   -4 o  185.276   1.5821  1399.66   23.894  1451.08   35.277  1356.07   32.478  188.606   2.2945  182.334   2.1852 6.272202 3.168607 
1 1 1   14    5   -3 o  149.151   1.5047  907.021   18.295  922.601   27.073  893.928   24.819  150.394   2.2083  148.046   2.0566 2.347626 3.017663 
1 1 1   14    5   -2 o  221.686   1.7072  2003.97   30.850  1974.08   44.020  2032.82   43.246  219.970   2.4550  223.226   2.3766 -3.256134 3.416948 
1 1 1   14    5   -1 o   75.109   1.6835  230.033   10.307  232.443   15.672  228.197   13.683   75.435   2.5523   74.761   2.2477 0.6742096 3.400954 
1 1 1   14    5    0 o   99.413   1.5143  402.954   12.271  419.719   18.594  390.017   16.334  101.437   2.2487   97.789   2.0491 3.648216 3.042313 
1 1 1   14    5    1 o   87.843   1.7659  314.658   12.644  315.890   23.349  314.147   15.041   87.900   3.2643   87.762   2.1025 0.1378174 3.882823 
1 1 1   14    5    2 o   85.448   1.7093  297.724   11.906  290.893   20.008  301.470   14.814   84.373   2.9135   85.972   2.1138 -1.599518 3.599540 
1 1 1   14    5    3 o   42.146   2.6009   72.752   8.8918   79.189   15.704   69.715   10.788   43.783   4.4625   41.196   3.2384 2.586479 5.513723 
1 1 1   14    5    4 o  169.854   1.6564  1176.40   22.934  1135.14   36.161  1204.16   29.662  166.789   2.6597  171.822   2.1178 -5.032715 3.399883 
1 1 1   14    5    5 o   69.314   1.9569  196.095   11.046  210.873   21.210  190.595   12.939   71.760   3.6378   68.314   2.3269 3.445953 4.318348 
1 1 1   14    5    6 o   34.799   2.9478   49.779   8.2832   67.998   13.781   39.474   10.364   40.568   4.2294   30.788   4.2424 9.779825 5.990522 
1 1 1   14    5    7 o   47.817   2.2917   93.487   8.9065   87.933   14.408   96.922   11.331   46.232   3.8582   48.647   2.8701 -2.415421 4.808703 
1 1 1   14    5    8 o   41.189   2.7311   69.535   9.1180   57.629   13.957   78.399   12.043   37.242   4.7021   43.684   3.4091 -6.442085 5.807889 
1 1 1   14    5    9 o   19.393   5.2617   15.904   8.5274   17.308   16.966   15.429   9.8637   21.856   7.6827   19.317   5.8006 2.538637 9.626587 
1 1 1   14    5   10 o   66.352   2.0624  179.740   11.141  181.100   16.391  178.573   15.189   66.538   3.0299   66.087   2.8261 0.4512024 4.143366 
1 1 1   14    5   11 o  152.196   1.7426  944.580   21.619  902.953   30.646  985.823   30.504  148.763   2.5272  155.447   2.4073 -6.684433 3.490266 
1 1 1   14    5   12 o   46.949   2.8181   90.280   10.735  120.653   17.599   72.281   13.548   54.187   4.0127   41.864   4.0193 12.32315 5.679536 
1 1 1   14    5   13 o  112.126   1.8682  512.720   17.075  497.898   26.840  522.797   22.132  110.402   2.9852  113.201   2.3984 -2.798660 3.829337 
1 1 1   14    5   14 o  132.457   1.6879  715.439   18.225  729.307   31.747  708.622   22.258  133.670   2.9136  131.808   2.0716 1.861343 3.574976 
1 1 1   14    5   15 o   97.294   1.8919  386.056   15.004  371.814   23.972  395.229   19.239   95.383   3.0872   98.425   2.3980 -3.041161 3.909094 
1 1 1   14    5   16 o  205.818   1.7626  1727.48   29.571  1759.12   46.167  1705.47   38.508  207.615   2.7280  204.463   2.3105 3.152176 3.574899 
1 1 1   14    5   17 o   70.448   1.8939  202.552   10.866  179.197   17.349  217.627   13.939   66.168   3.2263   72.999   2.3455 -6.831116 3.988820 
1 1 1   14    5   18 o   15.280   5.3793   8.3680   8.3202   8.9825   13.599   8.0003   10.519   17.761   6.7703   16.063   5.9910 1.698057 9.040388 
1 1 1   14    5   19 o  181.385   2.2177  1342.14   32.790  1338.30   46.485  1345.94   46.259  181.043   3.1499  181.561   3.1256 -0.5183716 4.437493 
1 1 1   14    5   20 o  136.980   1.8880  765.259   21.082  764.891   33.895  765.492   26.923  136.876   3.0379  136.973   2.4113 -0.9696960E-01 3.878547 
1 1 1   14    5   21 o   34.611   3.8322   49.553   10.631   51.840   17.599   48.239   13.340   34.993   6.4059   33.972   4.9636 1.020939 8.103891 
1 1 1   14    5   22 o  116.990   1.9211  558.224   18.321  574.118   29.806  548.572   23.226  118.538   3.0873  115.948   2.4574 2.589775 3.945907 
1 1 1   14    5   23 o  114.149   1.9290  531.450   17.949  560.573   29.369  514.088   22.676  117.130   3.0787  112.243   2.4784 4.886879 3.952316 
1 1 1   14    5   24 o   9.4434   4.5495 -16.0224   10.396 -17.8834   17.470 -15.0020   12.936   13.470   6.3149   11.298   5.3388 2.172256 8.269285 
1 1 1   14    5   25 o   99.891   2.2692  407.107   18.477  386.960   37.651  413.497   21.206   97.101   4.7714  100.623   2.5875 -3.521988 5.427819 
1 1 1   14    5   26 o   35.301   4.3593   51.749   12.278   54.565   20.125   50.080   15.495   35.788   7.1490   34.492   5.7109 1.295547 9.149997 
1 1 1   14    5   27 o   76.980   2.3674  242.022   14.838  391.140   26.150  171.220   18.019   97.803   3.2848   64.648   3.4317 33.15447 4.750379 
1 1 1   14    5   28 o   27.610   6.0933   32.516   13.346   5.6760   20.736   51.495   17.437   19.747   8.0880   34.871   6.3690 -15.12370 10.29462 
1 1 1   14    5   29 o  193.068   2.3204  1520.90   36.518  1604.57   54.438  1452.45   49.239  198.188   3.3697  188.581   3.2032 9.607407 4.649210 
1 1 1   14    5   30 o  253.479   2.6190  2622.45   54.114  2629.38   77.931  2616.01   75.200  253.620   3.7696  252.998   3.6464 0.6217499 5.244598 
1 1 1   14    5   31 o  192.001   2.6206  1504.69   41.015  1482.90   71.953  1515.17   49.920  190.310   4.6382  192.602   3.1796 -2.292358 5.623427 
1 1 1   14    5   32 o   71.927   2.5022  211.401   14.648  199.240   30.726  214.978   16.664   69.480   5.4693   72.508   2.8248 -3.028664 6.155700 
1 1 1   14    5   33 o   97.669   2.1765  389.208   17.328  420.947   37.088  380.345   19.598  101.298   4.5029   96.502   2.4935 4.795471 5.147152 
1 1 1   14    5   34 o   63.864   2.3688  166.680   12.310  178.619   21.339  160.725   15.071   65.960   3.9875   62.664   2.9588 3.295635 4.965319 
1 1 1   14    5   35 o   50.594   2.7057  104.810   11.118   87.600   18.590  114.394   13.873   45.950   5.0462   52.814   3.2380 -6.863750 5.995715 
1 1 1   14    5   36 o  140.846   1.8781  809.242   21.563  846.673   35.717  787.774   27.049  143.965   3.0436  138.928   2.3885 5.036484 3.868859 
1 1 1   14    5   37 o   98.919   2.2316  399.316   17.994  415.180   26.049  384.838   24.886  100.749   3.1759   96.997   3.1517 3.752342 4.474267 
1 1 1   14    5   38 o  116.569   2.1640  554.519   20.563  575.546   29.812  535.439   28.399  118.643   3.0852  114.436   3.0471 4.206841 4.336288 
1 1 1   14    5   39 o  190.439   2.2851  1480.28   35.473  1537.34   51.151  1427.41   49.236  193.935   3.2357  186.873   3.2322 7.061371 4.573478 
1 1 1   14    5   40 o   73.177   2.5283  218.907   15.059  244.630   22.064  196.478   20.603   77.259   3.5127   69.204   3.6654 8.055809 5.076832 
1 1 1   14    5   41 o   38.816   3.3819   62.074   10.594   81.214   18.077   52.063   13.074   44.183   5.1135   35.331   4.6524 8.852013 6.913245 
1 1 1   14    5   42 o  184.616   1.9964  1390.80   30.044  1422.53   48.887  1371.54   38.086  186.533   3.2151  183.264   2.5495 3.268646 4.103280 
1 1 1   14    5   43 o   73.266   2.1755  219.294   12.978  236.502   22.078  210.208   16.043   75.942   3.5765   71.680   2.7508 4.262268 4.512064 
1 1 1   14    5   44 o  102.339   1.9231  427.369   16.043  429.649   26.379  426.031   20.210  102.460   3.1622  102.143   2.4273 0.3172302 3.986368 
1 1 1   14    5   45 o   41.240   3.2099   69.972   10.706   87.812   18.504   60.995   13.126   45.958   5.0208   38.336   4.2729 7.622051 6.592923 
1 1 1   14    5   46 o   94.415   2.2716  363.972   17.482  351.129   24.937  376.385   24.516   92.583   3.3097   95.882   3.1410 -3.299583 4.562824 
1 1 1   14    5   47 o   99.709   1.9129  405.740   15.548  424.126   25.747  395.186   19.506  101.786   3.1068   98.363   2.4327 3.422386 3.945917 
1 1 1   14    5   48 o   45.673   2.8541   85.612   10.573   92.164   18.007   82.164   13.061   47.121   4.7529   44.645   3.6201 2.475712 5.974553 
1 1 1   14    5   49 o   47.077   3.6437   91.329   13.874   75.750   26.702   97.091   16.238   41.914   8.1085   48.472   4.1496 -6.558174 9.108566 
1 1 1   14    5   50 o   21.653   6.4833   19.654   12.336   64.514   25.543   6.0084   14.087   38.545   8.3698   16.898   6.7573 21.64717 10.75709 
1 1 1   14    5   51 o   50.061   3.3859  103.087   13.736   85.038   26.815  109.507   15.993   44.554   7.6594   51.538   3.8343 -6.983665 8.565531 
1 1 1   14    5   52 o  140.803   2.3659  809.990   27.155   0.0000   0.0000  809.990   27.155  ?   ?   140.803   2.3659 0.000000 2.365891 
1 1 1   14    5   53 o  106.443   1.8777  462.522   16.292  483.835   27.357  450.809   20.281  108.678   3.0913  105.038   2.3686 3.639862 3.894389 
1 1 1   14    5   54 o   51.072   2.5370  106.895   10.529  112.503   18.021  103.988   12.974   52.144   4.2774   50.292   3.1809 1.851280 5.330482 
1 1 1   14    5   55 o   37.446   3.2417   57.870   9.7978   51.542   16.878   61.087   12.033   34.742   6.1867   38.377   3.9005 -3.635582 7.313627 
1 1 1   14    5   56 o  112.419   1.8742  516.031   17.174  512.663   28.533  517.944   21.506  111.826   3.1333  112.569   2.3437 -0.7436447 3.912908 
1 1 1   14    5   57 o   36.801   3.3426   55.982   9.9179   59.554   17.508   54.294   12.035   37.437   5.9349   36.096   4.1667 1.340847 7.251509 
1 1 1   14    5   58 o  105.437   1.9268  454.066   16.560  446.442   27.675  458.319   20.669  104.292   3.2594  105.868   2.3951 -1.576553 4.044749 
1 1 1   14    5   59 f   95.984   1.9766  376.387   15.465  417.796   26.874  355.882   18.911  100.866   3.2728   93.235   2.4905 7.630753 4.112648 
1 1 1   14    5   60 o   55.947   2.4792  128.331   11.278  165.660   19.452  109.426   13.843   63.351   3.7840   51.528   3.3133 11.82269 5.029545 
1 1 1   14    5   61 o   19.221   5.5835   15.705   9.2650   3.1412   15.860   22.213   11.415   16.761   6.9884   22.666   6.0610 -5.905327 9.250535 
1 1 1   14    5   62 f   43.386   2.8162   77.482   9.9058   68.029   16.750   82.566   12.284   40.136   5.2450   44.695   3.3972 -4.559914 6.249105 
1 1 1   14    5   63 o  112.658   1.7821  518.552   16.365  501.050   25.146  531.410   21.554  110.508   2.7938  113.949   2.3205 -3.440308 3.631823 
1 1 1   14    5   64 f  106.903   1.7662  466.971   15.391  477.132   24.046  459.919   20.031  107.834   2.7379  105.995   2.3184 1.838249 3.587599 
1 1 1   14    5   65 o   25.930   4.1390   28.472   8.4547   19.763   14.261   33.192   10.499   21.772   7.0445   27.888   4.7908 -6.116707 8.519152 
1 1 1   14    5   66 o   29.793   3.5430   37.098   8.4360   33.483   14.310   39.023   10.444   27.600   6.4733   30.386   4.3395 -2.786144 7.793234 
1 1 1   14    5   67 o   31.264   3.6544   40.897   9.1377   19.960   18.299   47.852   10.547   22.545   7.9740   33.794   3.9002 -11.24863 8.876691 
1 1 1   14    5   68 o   46.635   2.7075   89.632   10.248   78.496   22.174   92.656   11.557   42.465   6.6218   47.357   3.0093 -4.892239 7.273520 
1 1 1   14    5   69 o   59.745   2.5650  146.843   12.463  141.268   24.569  148.775   14.462   57.740   5.2784   60.044   2.9638 -2.304363 6.053571 
1 1 1   14    5   70 o   31.438   3.6378   41.457   9.1505   44.045   16.238   40.253   11.077   31.535   6.5318   30.727   4.5606 0.8077736 7.966378 
1 1 1   14    5   71 o   32.642   3.9788   44.946   10.368   58.822   24.584   41.943   11.435   35.657   8.5655   31.336   4.6149 4.321623 9.729597 
1 1 1   14    5   72 o   48.388   2.4868   96.506   9.7760   99.633   17.484   95.083   11.791   48.579   4.4653   47.899   3.0356 0.6802483 5.399415 
1 1 1   14    5   73 o  117.699   1.8286  567.450   17.544  552.448   29.130  575.989   21.977  115.554   3.0954  118.418   2.2767 -2.863434 3.842524 
1 1 1   14    5   74 o   56.726   2.5975  132.847   11.979  121.815   16.008  146.886   18.059   53.973   3.6601   59.249   3.7585 -5.276234 5.246187 
1 1 1   14    5   75 o   29.455   4.3121   37.181   10.047   38.474   13.911   35.772   14.525   29.359   6.0151   28.125   6.4705 1.234333 8.834555 
1 1 1   14    5   76 o   16.606   5.9895   10.512   10.375   8.3378   13.094   14.181   17.007   16.718   6.5688   19.849   7.5701 -3.131182 10.02274 
1 1 1   14    5   77 o   50.397   2.2480  104.731   9.2117  114.313   15.462   99.459   11.469   52.171   3.6591   48.925   2.8887 3.245911 4.661886 
1 1 1   14    5   78 o   20.265   4.7182   18.144   7.6480   16.258   13.445   19.046   9.2988   19.663   6.8444   20.630   5.4493 -0.9677391 8.748705 
1 1 1   14    5   79 o   41.608   2.5653   71.816   8.6584   58.225   14.498   79.350   10.795   36.547   4.9971   43.587   3.0577 -7.039906 5.858387 
1 1 1   14    5   80 o   42.939   2.7729   76.760   9.6536   73.555   14.992   79.031   12.618   41.320   4.5248   43.262   3.6109 -1.941360 5.789005 
1 1 1   14    5   81 o   24.077   4.5013   25.459   8.5097   20.324   13.857   28.567   10.782   21.199   6.9499   25.191   5.4123 -3.992222 8.808683 
1 1 1   14    5   82 o   47.679   2.1323   93.887   8.2663   82.468   15.107   98.767   9.8758   43.806   4.2856   48.788   2.4915 -4.982674 4.957195 
1 1 1   14    5   83 o   15.262   4.7612   10.094   6.5650 -21.8070   12.768   21.560   7.6544   9.8457   4.8113   22.101   4.4034 -12.25546 6.522191 
1 1 1   14    5   84 o   24.025   3.1949   24.560   6.1018   13.932   13.579   27.249   6.8303   18.503   6.8245   25.257   3.4041 -6.754040 7.626357 
1 1 1   14    5   85 o   39.045   2.9110   63.940   9.1985   37.650   27.451   67.265   9.7629   27.022   9.7430   40.012   3.0155 -12.98963 10.19903 
1 1 1   14    5   86 o  102.149   1.6248  428.582   13.529  361.981   28.127  448.630   15.432   92.290   3.7466  104.413   1.8131 -12.12262 4.162275 
1 1 1   14    5   87 o   43.756   2.0331   79.194   7.2317  101.383   20.358   75.989   7.7362   47.607   5.3378   42.798   2.2252 4.808941 5.782989 
1 1 1   14    5   88 o   48.197   1.7590   95.750   6.8990  111.395   15.521   91.897   7.7017   51.004   3.7597   47.136   2.0091 3.868492 4.262802 
1 1 1   14    5   89 o   65.006   2.2503  175.450   11.906  153.135   16.664  198.721   17.017   60.007   3.4209   68.670   3.0477 -8.662769 4.581616 
1 1 1   14    5   90 o   19.451   5.8535   17.804   10.036   15.132   15.588   19.696   13.117   18.879   7.2357   20.303   6.7659 -1.424072 9.906242 
1 1 1   14    5   91 o   25.647   4.7038   29.814   9.4713   23.888   13.392   35.745   13.397   21.970   6.7915   27.228   6.1783 -5.258400 9.181256 
1 1 1   14    5   92 o   32.947   3.7426   47.314   9.8734   38.742   13.966   55.879   13.961   28.219   6.2374   34.973   5.0426 -6.753372 8.020771 
1 1 1   14    5   93 o   15.963   5.6556   11.269   9.2082   11.394   13.256   11.152   12.800   16.847   6.6124   16.662   6.5100 0.1853657 9.279256 
1 1 1   14    5   94 o   26.126   4.7009   31.390   9.6433   29.614   13.766   33.100   13.513   23.992   6.7541   25.608   6.4718 -1.615871 9.354244 
1 1 1   14    5   95 f   54.514   3.0672  127.177   13.575   81.836   18.005  186.888   20.662   41.637   5.4347   65.174   3.9072 -23.53789 6.693416 
1 1 1   14    5   96 o   27.210   4.8329   34.547   10.327   10.852   15.498   53.470   13.849   16.849   6.9560   33.649   5.2181 -16.80009 8.695635 
1 1 1   14    5   97 o   21.006   5.6767   22.027   9.9492   29.853   15.433   16.462   13.015   23.184   7.3097   18.174   6.6849 5.010620 9.905539 
1 1 1   14    5   98 o   21.002   5.2375   21.635   8.9355   22.247   12.086   20.897   13.271   20.503   6.4692   19.766   6.8038 0.7375927 9.388393 
1 1 1   14    5   99 o   22.090   5.0481   23.737   8.8909   21.389   11.987   26.608   13.256   20.028   6.4565   22.057   6.7458 -2.028379 9.337669 
1 1 1   14    5  100 o   9.9868   4.6426  -5.0566   9.1236 -16.4063   11.439   14.790   15.126   9.3539   4.5673   17.429   6.9910 -8.075127 8.350739 
1 1 1   14    5  101 o   20.017   5.6151   20.473   9.5318   20.117   12.196   21.033   15.280   19.302   6.5250   19.389   7.2229 -0.8650208E-01 9.733701 
1 1 1   14    5  102 o   16.385   5.7378   13.362   9.4576   13.272   11.805   13.522   15.803   16.485   6.3021   17.009   7.0233 -0.5236511 9.436261 
1 1 1   14    5  103 o   10.213   4.7350  -4.4664   9.3934  -7.2210   11.882   0.1238   15.338   10.946   5.1554   13.697   6.2386 -2.750795 8.093155 
1 1 1   14    5  104 o   17.065   5.9053   15.080   10.002  -1.6876   12.677   42.728   16.279   12.339   5.6399   27.106   7.2333 -14.76758 9.172191 
1 1 1   14    5  105 o   23.417   5.5980   28.247   10.541   33.743   13.628   20.062   16.630   24.560   6.6465   18.687   7.3841 5.873440 9.934811 
1 1 1   14    5  106 o   10.967   5.1259  -5.4140   11.366   21.041   16.575 -28.8961   15.616   18.902   7.4013   9.8633   4.9104 9.039021 8.882083 
1 1 1   14    5  107 o   14.415   5.9714   8.1959   11.474   8.5118   16.869   7.9240   15.651   15.599   6.8603   15.237   6.6569 0.3624735 9.559212 
1 1 1   14    5  108 o   17.484   6.6546   16.808   13.125   5.0261   17.014   34.127   20.628   14.861   6.6889   22.008   8.3505 -7.146708 10.69914 
1 1 1   14    5  109 o   16.267   6.5366   13.384   13.248   14.408   17.086   11.841   20.981   16.875   7.1567   16.725   7.4855 0.1504459 10.35623 
1 1 1   14    5  110 o   13.819   6.0416   5.2571   12.911   3.2965   16.361   8.4934   21.020   14.269   6.4773   16.070   7.3132 -1.800745 9.769255 
1 1 1   14    5  111 o   27.032   7.6059   46.004   17.461   46.004   17.461   0.0000   0.0000   27.032   7.6059  ?   ?  0.000000 7.605871 
1 1 1   14    5  112 o   15.738   6.8620   10.346   16.558   10.346   16.558   0.0000   0.0000   15.738   6.8620  ?   ?  0.000000 6.861968 
1 1 1   14    6 -110 f   16.687   7.7014   10.315   24.438   10.315   24.438   0.0000   0.0000   16.687   7.7014  ?   ?  0.000000 7.701378 
1 1 1   14    6 -109 o   18.277   7.5804   20.673   18.522   20.673   18.522   0.0000   0.0000   18.277   7.5804  ?   ?  0.000000 7.580411 
1 1 1   14    6 -108 o   22.107   8.1793   34.954   19.532   34.954   19.532   0.0000   0.0000   22.107   8.1793  ?   ?  0.000000 8.179276 
1 1 1   14    6 -107 o   13.553   6.3623  -3.0127   17.837  -3.0127   17.837   0.0000   0.0000   13.553   6.3623  ?   ?  0.000000 6.362284 
1 1 1   14    6 -106 f   26.727   7.0398   42.067   15.548   43.288   19.305   39.812   26.230   25.212   8.1989   22.086   9.0766 3.126051 12.23137 
1 1 1   14    6 -105 o   12.341   5.7810  -4.7640   14.593  -1.9603   17.884 -10.3502   25.244   13.821   6.4499   14.516   7.0169 -0.6948433 9.530946 
1 1 1   14    6 -104 o   11.322   5.4423 -11.8326   14.681   3.7453   18.343 -39.6026   24.490   14.929   6.8085   11.994   5.9988 2.934485 9.074210 
1 1 1   14    6 -103 o   18.575   6.7978   19.588   13.431   27.509   18.854   11.427   19.137   20.564   7.9380   16.601   7.3036 3.963552 10.78678 
1 1 1   14    6 -102 f   19.939   6.8033   22.833   13.262   27.512   18.542   17.933   18.975   20.709   7.9028   18.106   7.6029 2.603027 10.96618 
1 1 1   14    6 -101 o   13.517   5.9295   3.7165   12.529   12.868   17.525  -5.8521   17.920   16.830   7.1965   13.413   6.3218 3.417345 9.578813 
1 1 1   14    6 -100 o   16.572   6.4766   13.582   12.672  -9.2248   17.119   41.221   18.846   12.724   6.0504   25.398   8.0863 -12.67401 10.09928 
1 1 1   14    6  -99 o   12.004   5.4814  -2.1159   11.937 -12.6797   16.225   10.348   17.624   11.978   5.7480   16.442   7.1250 -4.464773 9.154564 
1 1 1   14    6  -98 o   16.343   6.4178   12.608   12.493   16.783   17.271   8.0254   18.093   18.068   7.3886   16.096   7.0910 1.971638 10.24075 
1 1 1   14    6  -97 o   12.486   5.6259  -0.4895   12.074   4.2852   16.875  -5.4975   17.282   15.098   6.7385   13.468   6.3031 1.630780 9.226969 
1 1 1   14    6  -96 o   39.392   4.2109   70.916   13.312   88.242   18.375   51.779   19.311   42.554   5.4202   29.670   7.8603 12.88335 9.547883 
1 1 1   14    6  -95 o   14.276   6.0203   6.0235   11.978  -2.7480   16.854   14.974   17.025   13.916   6.4129   17.845   7.3209 -3.929269 9.732491 
1 1 1   14    6  -94 o   10.463   4.9902 -10.8967   11.824 -23.5122   16.368   2.8708   17.099   10.959   5.3745   15.159   6.7732 -4.200324 8.646475 
1 1 1   14    6  -93 o   26.800   5.7867   35.434   12.271   38.751   16.823   31.663   17.938   26.475   7.4714   23.496   7.9135 2.978888 10.88326 
1 1 1   14    6  -92 o   26.261   4.6550   31.865   9.6001   38.800   16.861   28.538   11.678   26.677   7.4628   23.915   6.0007 2.762098 9.576112 
1 1 1   14    6  -91 o   28.687   4.1944   36.970   9.5183   26.471   16.433   42.271   11.676   22.193   7.5733   30.219   4.9084 -8.026804 9.024779 
1 1 1   14    6  -90 o   8.2519   3.9714 -10.2883   7.8736  -0.9984   13.238 -15.3739   9.7944   13.306   5.9513   8.7159   4.2493 4.589936 7.312651 
1 1 1   14    6  -89 o   19.395   5.1247   17.682   8.2222   4.0279   13.057   26.654   10.584   14.572   6.2208   23.624   5.5850 -9.052011 8.360054 
1 1 1   14    6  -88 o   19.507   5.1211   17.770   8.2451   13.152   13.121   20.783   10.599   17.585   6.6626   20.772   5.9534 -3.186848 8.934985 
1 1 1   14    6  -87 o   13.974   5.3014   7.1808   8.3135   8.4658   14.934   6.6037   10.008   16.622   6.8419   14.367   5.7119 2.255609 8.912729 
1 1 1   14    6  -86 f   27.040   4.1610   32.237   8.8777   26.037   15.533   35.245   10.819   22.865   7.3476   27.893   4.9392 -5.027313 8.853420 
1 1 1   14    6  -85 o   30.557   4.0041   40.678   9.7338   50.340   21.344   38.140   10.937   31.123   8.2720   29.200   4.7589 1.923254 9.543233 
1 1 1   14    6  -84 o   11.439   4.9682  -0.0773   8.6098 -17.1510   15.255   7.9040   10.430   11.706   5.6058   15.169   5.8907 -3.463171 8.131704 
1 1 1   14    6  -83 o   36.331   3.0225   55.646   8.8702   56.600   13.755   54.967   11.606   35.752   4.8441   35.638   4.0679 0.1140518 6.325648 
1 1 1   14    6  -82 f   66.875   2.0446  184.666   11.133  173.266   16.551  194.084   15.045   64.193   3.1729   68.229   2.7105 -4.035583 4.172994 
1 1 1   14    6  -81 o   72.269   2.1452  215.807   12.623  210.918   21.699  218.307   15.519   70.436   3.7933   72.439   2.6326 -2.002724 4.617349 
1 1 1   14    6  -80 o   24.900   4.2813   27.164   8.3766   10.469   12.650   40.200   11.179   16.995   6.5170   30.222   4.6895 -13.22761 8.028880 
1 1 1   14    6  -79 o   38.869   3.0564   63.445   9.6060   64.202   13.755   62.723   13.421   38.476   4.4686   38.056   4.4079 0.4202652 6.276756 
1 1 1   14    6  -78 f   18.047   5.4629   14.509   8.7235   12.265   12.520   16.627   12.162   17.704   6.5487   19.415   6.5157 -1.710934 9.238008 
1 1 1   14    6  -77 o   15.282   5.4597   9.1448   8.5979   5.5238   12.500   12.397   11.845   15.369   6.2854   17.624   6.3939 -2.254351 8.965928 
1 1 1   14    6  -76 f   31.505   3.3653   41.931   8.5087   39.948   13.115   43.373   11.181   29.862   5.5933   31.644   4.4582 -1.781933 7.152668 
1 1 1   14    6  -75 o   29.448   3.6214   36.843   8.5102   26.930   13.142   44.001   11.168   24.181   6.5197   31.929   4.4085 -7.748373 7.870238 
1 1 1   14    6  -74 o   19.475   5.4629   16.907   9.0223   13.343   13.218   20.016   12.345   18.469   6.7462   21.115   6.5196 -2.645794 9.381718 
1 1 1   14    6  -73 o   81.841   2.0454  275.228   13.645  272.984   18.827  277.711   19.806   81.148   2.8506   81.787   2.9757 -0.6387634 4.120757 
1 1 1   14    6  -72 o   9.5937   4.4852  -7.8627   8.7116  -9.2958   12.528  -6.5208   12.122   11.782   5.4646   12.114   5.5287 -0.3314514 7.773508 
1 1 1   14    6  -71 o   34.352   3.4611   49.573   9.5596   36.353   13.261   63.876   13.794   28.547   5.8939   38.689   4.4550 -10.14165 7.388180 
1 1 1   14    6  -70 o   36.181   2.6881   54.278   7.8713   66.144   10.824   40.962   11.467   39.777   3.3700   30.826   4.7129 8.951183 5.793840 
1 1 1   14    6  -69 o   61.313   1.8955  154.219   9.4624  157.539   12.784  150.196   14.072   61.811   2.5426   60.254   2.8734 1.556942 3.836863 
1 1 1   14    6  -68 o   16.126   4.9848   11.012   7.2145   6.3503   9.7050   16.769   10.786   14.694   5.6888   19.699   6.0960 -5.005685 8.338146 
1 1 1   14    6  -67 o   61.537   1.6600  155.035   8.3190  158.880   12.706  152.150   11.006   62.117   2.5146   60.853   2.2225 1.263756 3.355963 
1 1 1   14    6  -66 o   50.231   1.8799  103.448   7.6836  104.374   11.895  102.785   10.065   50.248   2.9166   49.960   2.4793 0.2876625 3.827955 
1 1 1   14    6  -65 o   35.356   2.4185   51.544   6.9284   42.865   10.731   57.749   9.0730   31.825   4.2420   37.321   3.0078 -5.496439 5.200140 
1 1 1   14    6  -64 o   30.971   3.1288   39.913   7.7907   37.404   10.361   43.177   11.818   29.668   4.4189   31.841   4.6938 -2.172977 6.446563 
1 1 1   14    6  -63 o   66.744   1.9653  182.466   10.681  181.190   14.956  183.794   15.258   66.348   2.7715   66.816   2.8077 -0.4672928 3.945177 
1 1 1   14    6  -62 o   81.730   1.6163  272.960   10.768  263.982   16.971  279.010   13.932   80.169   2.6005   82.536   2.0724 -2.367859 3.325251 
1 1 1   14    6  -61 o   89.374   1.5205  326.262   11.078  300.848   16.329  347.929   15.078   85.665   2.3406   92.221   2.0057 -6.555527 3.082435 
1 1 1   14    6  -60 o   35.023   2.7017   50.604   7.6532   54.691   12.360   48.063   9.7464   36.103   4.2833   33.970   3.5732 2.132839 5.578039 
1 1 1   14    6  -59 o   31.758   2.9386   41.745   7.5210   36.469   11.602   45.570   9.8778   29.215   5.0544   33.046   3.7321 -3.830835 6.282993 
1 1 1   14    6  -58 o  106.821   1.5146  465.908   13.188  483.366   19.654  451.607   17.787  108.693   2.2182  105.086   2.0765 3.606476 3.038468 
1 1 1   14    6  -57 o  164.486   1.6465  1104.93   22.077  1085.98   29.995  1127.34   32.610  162.924   2.2586  165.954   2.4106 -3.029617 3.303372 
1 1 1   14    6  -56 o  121.386   1.5327  601.537   15.166  584.132   22.086  617.066   20.861  119.500   2.2673  122.857   2.0831 -3.357124 3.078932 
1 1 1   14    6  -55 o   38.811   2.7230   61.996   8.5601   72.277   13.187   54.509   11.253   41.719   3.9238   36.189   3.8750 5.529858 5.514663 
1 1 1   14    6  -54 o   8.0205   3.8684 -11.7266   7.5666 -29.9465   11.879   0.7115   9.8152   8.6035   4.2831   12.869   5.4395 -4.265675 6.923425 
1 1 1   14    6  -53 o   34.606   2.8756   49.384   8.0386   48.314   12.382   50.163   10.568   33.921   4.5964   34.733   3.7944 -0.8122330 5.960266 
1 1 1   14    6  -52 o   95.966   1.5560  375.869   12.172  372.720   18.079  378.478   16.462   95.483   2.3229   96.245   2.0983 -0.7617264 3.130240 
1 1 1   14    6  -51 o   58.984   2.0957  142.314   10.060  131.130   18.163  147.264   12.083   56.343   3.9802   59.960   2.4776 -3.616058 4.688283 
1 1 1   14    6  -50 o   25.483   4.1677   27.380   8.3582   31.013   15.896   25.991   9.8263   26.766   7.1499   24.653   5.0595 2.113419 8.758997 
1 1 1   14    6  -49 o   92.288   1.6961  347.629   12.760  315.931   21.665  364.464   15.788   87.791   3.0319   94.465   2.0504 -6.674034 3.660140 
1 1 1   14    6  -48 o   49.433   2.2063  100.024   8.8680   98.144   14.665  101.107   11.134   48.773   3.7167   49.641   2.7625 -0.8678246 4.630939 
1 1 1   14    6  -47 o   78.578   1.7099  251.992   10.952  272.650   17.994  239.835   13.804   81.609   2.7087   76.593   2.2132 5.016045 3.497908 
1 1 1   14    6  -46 o   55.347   2.2597  125.339   10.173  135.622   15.552  117.648   13.450   57.449   3.3353   53.525   3.0959 3.923683 4.550699 
1 1 1   14    6  -45 o  182.204   1.9444  1355.24   28.879  1401.66   47.332  1327.71   36.450  185.060   3.1377  180.253   2.4808 4.807312 3.999877 
1 1 1   14    6  -44 o   26.485   4.3100   29.533   8.9854   24.318   15.230   32.317   11.129   24.031   7.2058   27.579   5.1393 -3.548307 8.850765 
1 1 1   14    6  -43 o  105.828   1.8222  457.069   15.720  424.253   25.044  478.402   20.193  101.796   3.0215  108.228   2.2889 -6.432114 3.790554 
1 1 1   14    6  -42 o   27.031   4.1405   30.656   8.8331   43.223   15.209   24.259   10.851   31.825   6.0844   23.779   5.6767 8.045450 8.321347 
1 1 1   14    6  -41 o   64.777   1.9136  171.405   10.093  174.025   16.719  169.902   12.661   65.145   3.1578   64.449   2.4142 0.6962585 3.974950 
1 1 1   14    6  -40 o  141.655   1.9777  819.018   22.836  824.912   29.603  810.355   35.887  142.096   2.5558  140.753   3.1279 1.343124 4.039241 
1 1 1   14    6  -39 o  148.638   1.9924  901.733   24.140  881.522   31.061  932.560   38.360  146.891   2.5941  151.004   3.1164 -4.112885 4.054801 
1 1 1   14    6  -38 o   40.052   3.1759   66.015   10.284   28.145   14.892  100.540   14.219   25.643   6.9515   49.435   3.5523 -23.79143 7.806567 
1 1 1   14    6  -37 o   66.335   2.1046  179.786   11.366  200.197   17.763  165.636   14.790   69.903   3.1252   63.600   2.8601 6.303684 4.236372 
1 1 1   14    6  -36 o  200.306   2.0794  1637.55   33.951  1684.59   45.690  1579.54   50.734  203.055   2.7604  196.547   3.1666 6.508423 4.200866 
1 1 1   14    6  -35 o   56.732   3.3050  132.064   15.218  142.197   24.594  125.777   19.372   58.596   5.2031   55.223   4.3382 3.372791 6.774319 
1 1 1   14    6  -34 o  157.545   1.9953  1012.84   25.624  994.794   33.148  1039.62   40.391  156.069   2.6056  159.478   3.1071 -3.408722 4.054973 
1 1 1   14    6  -33 o   38.535   3.2982   61.158   10.261   52.690   15.132   68.366   13.961   35.407   5.4147   40.625   4.2801 -5.218517 6.902010 
1 1 1   14    6  -32 o   70.036   1.8735  200.261   10.686  207.826   18.014  196.154   13.273   71.241   3.1095   69.278   2.3539 1.962517 3.899983 
1 1 1   14    6  -31 o   31.025   3.4697   39.850   8.6245   35.542   15.120   41.928   10.500   28.791   6.5858   31.729   4.1599 -2.938515 7.789612 
1 1 1   14    6  -30 o  164.587   1.6529  1104.91   22.175  1071.48   34.820  1127.72   28.762  161.983   2.6371  166.236   2.1226 -4.253067 3.385171 
1 1 1   14    6  -29 o  198.781   1.8768  1612.01   30.411  1546.12   52.966  1644.42   37.144  194.475   3.3412  200.725   2.2701 -6.249466 4.039418 
1 1 1   14    6  -28 o   44.859   2.5547   82.422   9.3032   70.958   16.417   87.846   11.291   41.299   4.9767   46.274   3.0098 -4.974640 5.816035 
1 1 1   14    6  -27 o  151.528   1.6431  936.469   20.295  869.171   32.012  981.695   26.242  145.898   2.6917  155.112   2.0755 -9.214844 3.398952 
1 1 1   14    6  -26 o  149.629   1.7434  913.205   21.264  936.129   39.156  903.616   25.323  151.363   3.1735  148.817   2.0875 2.545746 3.798534 
1 1 1   14    6  -25 o   20.777   5.2751   18.395   8.9486   2.3581   18.090   23.590   10.297   17.775   7.4411   23.507   5.4758 -5.731695 9.238751 
1 1 1   14    6  -24 o   69.639   2.0880  198.041   11.840  192.869   23.259  199.850   13.755   68.521   4.1842   69.934   2.4165 -1.412560 4.831847 
1 1 1   14    6  -23 o   92.037   1.7725  345.503   13.298  338.749   22.217  349.274   16.600   91.022   2.9985   92.520   2.2011 -1.497665 3.719607 
1 1 1   14    6  -22 o   86.967   1.8041  308.485   12.790  356.528   22.291  284.907   15.616   93.391   2.9317   83.527   2.2957 9.864700 3.723583 
1 1 1   14    6  -21 o  226.814   1.8847  2098.42   34.845  2054.88   54.273  2128.95   45.451  224.317   2.9681  228.397   2.4412 -4.079895 3.843105 
1 1 1   14    6  -20 o  159.753   1.6946  1040.83   22.067  969.002   34.639  1089.89   28.628  154.062   2.7582  163.444   2.1488 -9.381393 3.496452 
1 1 1   14    6  -19 o  113.722   1.7109  527.439   15.860  555.333   26.571  512.001   19.767  116.629   2.7949  112.024   2.1647 4.604874 3.535146 
1 1 1   14    6  -18 o  201.945   1.9549  1663.52   32.180  1639.46   46.775  1685.14   44.341  200.387   2.8636  203.181   2.6773 -2.794388 3.920196 
1 1 1   14    6  -17 o  100.645   1.9071  413.165   15.646  412.849   24.473  413.385   20.348  100.506   2.9905  100.645   2.4802 -0.1389008 3.885184 
1 1 1   14    6  -16 o   59.770   2.2844  145.972   11.110  139.250   16.055  152.148   15.389   58.284   3.3939   60.959   3.1072 -2.674831 4.601449 
1 1 1   14    6  -15 o  126.544   1.8725  653.130   19.315  630.993   29.470  669.800   25.573  124.318   2.9081  128.116   2.4487 -3.798050 3.801760 
1 1 1   14    6  -14 o  240.679   2.3408  2363.58   45.924  2378.54   76.768  2355.24   57.309  241.199   3.9045  240.179   2.9272 1.020615 4.879926 
1 1 1   14    6  -13 o  115.233   2.0731  541.680   19.473  626.780   35.068  503.739   23.415  123.808   3.4782  111.097   2.5856 12.71075 4.333953 
1 1 1   14    6  -12 o  204.917   2.2094  1713.14   36.905  1616.02   61.012  1769.18   46.345  198.836   3.7643  208.187   2.7309 -9.350998 4.650611 
1 1 1   14    6  -11 o  117.343   2.1130  561.718   20.211  531.788   27.796  595.292   29.440  114.083   2.9916  120.744   2.9911 -6.660927 4.230433 
1 1 1   14    6  -10 o   83.758   2.1516  286.388   14.678  333.073   24.040  258.642   18.533   90.242   3.2735   79.543   2.8630 10.69875 4.348897 
1 1 1   14    6   -9 o   87.403   2.1389  311.648   15.239  567.404   36.905  259.077   16.732  117.749   3.8501   79.632   2.5810 38.11682 4.635164 
1 1 1   14    6   -8 o  121.925   1.7535  606.269   17.428  616.188   29.139  600.745   21.746  122.851   2.9098  121.347   2.1985 1.504303 3.646932 
1 1 1   14    6   -7 o   7.6043   3.8015 -26.8862   9.7862 -38.9024   17.508 -21.4264   11.802   10.948   5.4056   9.5960   4.6754 1.351587 7.146994 
1 1 1   14    6   -6 f  131.781   1.7387  708.239   18.677  660.732   30.432  736.946   23.656  127.212   2.9347  134.403   2.1593 -7.190689 3.643495 
1 1 1   14    6   -5 o  258.849   2.0412  2733.17   43.070  2825.56   68.942  2674.02   55.158  263.022   3.2155  255.959   2.6436 7.063202 4.162744 
1 1 1   14    6   -4 o  118.712   1.7626  574.740   17.056  552.602   23.674  598.633   24.594  116.367   2.4958  121.117   2.4911 -4.749931 3.526232 
1 1 1   14    6   -3 o  125.832   1.7435  645.734   17.883  630.120   24.731  662.841   25.888  124.265   2.4416  127.447   2.4920 -3.182373 3.488704 
1 1 1   14    6   -2 o   48.578   2.8315   96.660   11.164   83.196   16.226  108.760   15.383   44.867   4.4973   51.455   3.6920 -6.588627 5.818662 
1 1 1   14    6   -1 o   77.934   2.0490  247.929   13.006  228.287   18.755  266.122   18.051   74.706   3.0866   80.697   2.7481 -5.991280 4.132653 
1 1 1   14    6    0 o   81.359   1.8850  269.978   12.501  288.089   20.615  259.445   15.721   83.943   3.0177   79.701   2.4227 4.242027 3.869881 
1 1 1   14    6    1 o   91.605   1.8055  342.241   13.482  341.366   21.921  342.773   17.098   91.391   2.9463   91.658   2.2884 -0.2670975 3.730656 
1 1 1   14    6    2 o   52.772   2.4726  113.893   10.607  101.333   17.468  121.228   13.350   49.577   4.3669   54.404   3.0221 -4.827236 5.310662 
1 1 1   14    6    3 o   84.515   1.8819  291.329   12.965  292.913   21.070  290.363   16.447   84.640   3.0589   84.322   2.3953 0.3176346 3.885091 
1 1 1   14    6    4 o  234.828   2.0875  2249.52   39.958  2372.06   58.892  2144.97   54.395  241.026   2.9975  229.211   2.9113 11.81557 4.178559 
1 1 1   14    6    5 o  140.398   2.0070  804.048   22.969  797.064   30.496  813.205   34.918  139.742   2.6772  141.120   3.0354 -1.378479 4.047393 
1 1 1   14    6    6 f   57.359   2.6946  134.586   12.564  133.163   18.438  135.820   17.166   56.928   3.9989   57.531   3.6796 -0.6032600 5.434197 
1 1 1   14    6    7 o  132.976   1.8930  721.223   20.519  718.867   29.216  723.517   28.824  132.708   2.7008  133.140   2.6559 -0.4318237 3.787827 
1 1 1   14    6    8 o   49.010   2.8006   98.373   11.142   84.611   18.053  106.840   14.161   45.179   4.9850   51.024   3.4244 -5.845676 6.047869 
1 1 1   14    6    9 o  115.535   1.8962  544.445   17.858  505.509   31.444  562.982   21.697  111.178   3.4739  117.467   2.2659 -6.289673 4.147604 
1 1 1   14    6   10 o  164.695   1.8620  1106.31   24.997  1045.46   35.723  1164.69   34.991  160.036   2.7384  168.934   2.5410 -8.897293 3.735654 
1 1 1   14    6   11 o  154.219   2.0396  970.179   25.640  968.992   33.916  971.761   39.168  154.076   2.7004  154.258   3.1149 -0.1821899 4.122516 
1 1 1   14    6   12 o   92.223   1.8939  346.898   14.238  362.591   23.039  337.202   18.109   94.186   3.0047   90.870   2.4471 3.316063 3.875075 
1 1 1   14    6   13 o   83.424   2.1138  284.095   14.363  290.651   21.895  279.142   19.029   84.299   3.1920   82.642   2.8289 1.656883 4.265183 
1 1 1   14    6   14 o   8.4665   4.1608 -20.6529   9.9698  -7.9926   16.880 -27.4348   12.355   14.881   6.6831   9.2072   4.5452 5.673807 8.082266 
1 1 1   14    6   15 o   12.287   5.4215  -3.2427   10.616   9.2212   16.453 -12.1326   13.895   18.990   7.3918   12.395   5.7507 6.595646 9.365375 
1 1 1   14    6   16 o  127.877   1.8417  666.957   19.198  635.697   27.567  696.398   26.752  124.794   2.7099  130.630   2.5124 -5.836113 3.695349 
1 1 1   14    6   17 o  124.092   1.8097  628.048   18.306  612.866   31.462  635.819   22.508  122.457   3.1545  124.836   2.2119 -2.379326 3.852698 
1 1 1   14    6   18 o   56.056   2.5161  128.501   11.468  121.241   19.879  132.122   14.039   54.235   4.5381   56.799   3.0433 -2.563503 5.464094 
1 1 1   14    6   19 o  159.659   1.8073  1039.68   23.522  1039.65   40.856  1039.69   28.767  159.543   3.1415  159.632   2.2108 -0.8845520E-01 3.841470 
1 1 1   14    6   20 o   80.849   2.1885  266.885   14.410  271.667   23.371  263.952   18.303   81.455   3.5283   80.357   2.7985 1.098038 4.503330 
1 1 1   14    6   21 o  104.112   1.8742  442.132   15.905  468.925   24.030  421.240   21.219  107.137   2.7538  101.556   2.5652 5.580910 3.763494 
1 1 1   14    6   22 o  112.085   2.0270  512.516   18.520  487.779   24.506  545.454   28.278  109.269   2.7535  115.527   3.0054 -6.258133 4.076055 
1 1 1   14    6   23 o   57.189   2.4792  133.742   11.530  117.974   17.524  145.780   15.311   53.548   4.0446   59.654   3.1600 -6.105652 5.132722 
1 1 1   14    6   24 o   65.718   2.1751  176.413   11.636  167.409   20.567  180.652   14.111   63.848   3.9714   66.471   2.6094 -2.623695 4.751885 
1 1 1   14    6   25 o  111.205   1.9257  504.483   17.456  547.615   40.464  494.620   19.349  115.575   4.3025  110.100   2.1560 5.474800 4.812492 
1 1 1   14    6   26 o  130.329   1.9010  692.920   20.195  653.221   45.626  702.593   22.522  126.210   4.4418  131.223   2.1055 -5.012253 4.915587 
1 1 1   14    6   27 o   54.064   2.6848  119.643   11.795   87.094   27.106  127.245   13.100   45.304   7.6096   55.741   2.8931 -10.43671 8.140953 
1 1 1   14    6   28 o   64.298   2.3696  168.974   12.398  172.374   28.834  168.202   13.733   64.544   5.5337   64.129   2.6327 0.4146957 6.128020 
1 1 1   14    6   29 o   91.329   2.0517  340.341   15.274  381.716   25.198  316.306   19.205   96.589   3.2048   87.969   2.6814 8.620377 4.178601 
1 1 1   14    6   30 o  130.653   1.8838  696.426   20.063  734.119   33.331  675.011   25.123  134.036   3.0507  128.590   2.3968 5.445755 3.879611 
1 1 1   14    6   31 o   99.696   1.9486  405.535   15.836  413.472   26.095  400.909   19.924  100.526   3.1885   99.093   2.4665 1.432365 4.031178 
1 1 1   14    6   32 o  122.565   1.9039  612.910   19.022  622.561   31.186  607.192   24.004  123.381   3.1033  121.953   2.4146 1.427231 3.932051 
1 1 1   14    6   33 o  136.637   1.8933  761.736   21.087  800.672   35.018  739.585   26.413  139.965   3.0693  134.592   2.4075 5.373184 3.900824 
1 1 1   14    6   34 o  138.723   1.9038  785.201   21.528  785.275   34.971  785.156   27.317  138.605   3.0953  138.673   2.4166 -0.6799316E-01 3.926908 
1 1 1   14    6   35 o   49.562   2.8001  100.678   11.266   83.192   18.903  110.312   14.031   44.682   5.2927   51.829   3.3388 -7.146839 6.257784 
1 1 1   14    6   36 o   91.398   1.9988  340.905   14.891  354.075   24.819  333.497   18.614   92.989   3.2794   90.329   2.5305 2.659592 4.142236 
1 1 1   14    6   37 o   58.698   2.4723  140.959   11.803  145.876   20.113  138.376   14.577   59.512   4.1725   58.095   3.0892 1.416672 5.191586 
1 1 1   14    6   38 o   84.220   2.0461  289.502   14.047  285.258   23.106  291.990   17.691   83.426   3.4049   84.507   2.5711 -1.080849 4.266623 
1 1 1   14    6   39 o  160.689   1.9371  1053.79   25.373  1061.52   41.153  1049.05   32.228  161.104   3.1337  160.260   2.4670 0.8436584 3.988277 
1 1 1   14    6   40 o  178.782   1.9889  1304.62   28.985  1321.02   47.103  1294.63   36.771  179.692   3.2157  178.016   2.5340 1.676025 4.094169 
1 1 1   14    6   41 o   59.928   4.0199  147.919   19.524   0.0000   0.0000  147.919   19.524  ?   ?    59.928   4.0199 0.000000 4.019889 
1 1 1   14    6   42 o  152.541   2.5073  950.696   31.176  984.022   55.189  935.076   37.782  154.743   4.3797  151.191   3.0657 3.552353 5.346010 
1 1 1   14    6   43 o   79.384   3.5360  258.629   22.824  251.683   32.051  265.774   32.509   78.024   5.0668   80.202   4.9974 -2.178322 7.116639 
1 1 1   14    6   44 o   96.226   3.3092  379.529   25.919  417.623   36.795  342.012   36.515  100.711   4.4934   91.020   4.9400 9.691040 6.677888 
1 1 1   14    6   45 o   82.175   2.6359  276.314   17.634  266.876   32.675  280.193   20.946   80.340   5.0144   82.686   3.1132 -2.345314 5.902186 
1 1 1   14    6   46 o  127.064   1.8769  659.057   19.440  678.880   32.099  647.576   24.429  128.796   3.0574  125.893   2.3805 2.902832 3.874892 
1 1 1   14    6   47 o   14.127   5.5779   4.6459   9.4824   23.452   16.611  -4.4453   11.549   23.850   7.5914   12.527   5.5839 11.32320 9.423912 
1 1 1   14    6   48 o   28.470   4.2948   34.050   9.6571   42.197   16.863   30.075   11.780   31.253   6.8121   26.478   5.6313 4.774557 8.838318 
1 1 1   14    6   49 o   63.770   2.2683  166.376   11.772  164.939   20.233  167.111   14.474   63.251   3.9438   63.849   2.7878 -0.5979462 4.829636 
1 1 1   14    6   50 o   85.912   1.9971  301.448   13.986  320.222   23.682  291.393   17.332   88.330   3.2949   84.378   2.5227 3.951851 4.149691 
1 1 1   14    6   51 o   89.282   2.0057  325.596   14.597  346.266   24.882  314.749   18.025   91.838   3.3292   87.691   2.5242 4.147369 4.177963 
1 1 1   14    6   52 o   71.842   2.2099  211.141   12.926  176.247   21.922  229.738   16.004   65.316   4.1387   74.886   2.6258 -9.570595 4.901397 
1 1 1   14    6   53 o   26.466   4.7840   29.793   9.9410   24.618   17.652   32.196   12.030   24.357   7.8334   27.378   5.5802 -3.020741 9.617718 
1 1 1   14    6   54 o   26.607   4.8159   30.139   10.061   18.186   17.979   35.588   12.139   22.131   7.8962   28.850   5.3591 -6.719744 9.543064 
1 1 1   14    6   55 o  159.882   1.9674  1044.54   25.641  1077.56   42.694  1025.90   32.069  162.036   3.2324  158.328   2.4848 3.707428 4.077072 
1 1 1   14    6   56 o   73.781   2.1887  222.811   13.149  217.254   22.804  225.578   16.094   72.528   3.8712   74.163   2.6665 -1.634483 4.700698 
1 1 1   14    6   57 o   70.119   2.1716  201.284   12.397  214.368   21.756  194.993   15.086   72.062   3.7163   68.931   2.6900 3.130081 4.587718 
1 1 1   14    6   58 o   15.676   5.5743   8.9435   8.9528  -5.6143   16.754   14.762   10.592   15.094   6.7269   18.932   6.0659 -3.837464 9.057998 
1 1 1   14    6   59 o   26.984   4.2977   30.838   9.1366   17.922   16.774   36.286   10.895   21.620   7.6357   29.217   4.7364 -7.597391 8.985395 
1 1 1   14    6   60 o   18.472   5.2173   14.627   8.1998   41.959   14.573   1.9658   9.9187   31.126   5.9609   13.301   5.5346 17.82410 8.134177 
1 1 1   14    6   61 o   59.476   2.3356  145.127   11.301  160.100   21.987  139.751   13.175   61.976   4.3804   58.282   2.7812 3.694546 5.188735 
1 1 1   14    6   62 o   40.070   2.9378   66.346   9.5290   61.206   19.097   68.050   10.996   37.505   6.4810   40.500   3.3609 -2.994389 7.300578 
1 1 1   14    6   63 o   19.801   5.5387   16.985   9.2881   12.522   17.827   18.648   10.882   20.014   7.7205   20.761   6.0570 -0.7466698 9.812915 
1 1 1   14    6   64 o   72.156   2.1099  213.447   12.396  213.271   18.925  213.580   16.406   71.843   3.2399   72.019   2.7999 -0.1762466 4.282122 
1 1 1   14    6   65 o   77.306   2.0640  244.998   12.995  233.213   19.192  254.975   17.658   75.134   3.1405   78.687   2.7573 -3.552750 4.179152 
1 1 1   14    6   66 o   83.572   1.8789  285.960   12.800  275.193   20.309  293.055   16.487   81.624   3.0578   84.449   2.3974 -2.825142 3.885580 
1 1 1   14    6   67 o   37.581   2.9172   58.570   8.8666   64.529   15.244   55.524   10.900   38.873   4.9210   36.385   3.7277 2.487652 6.173502 
1 1 1   14    6   68 o   52.652   2.3423  114.114   10.028  104.043   16.402  120.125   12.672   49.771   4.0786   53.886   2.8956 -4.115501 5.001911 
1 1 1   14    6   69 o   53.217   2.3043  116.591   9.9722  101.487   16.095  126.003   12.705   49.123   4.0556   55.189   2.8336 -6.066078 4.947418 
1 1 1   14    6   70 o   48.805   2.3943   98.234   9.4961   95.693   15.837   99.661   11.866   47.626   4.1198   49.002   2.9849 -1.375175 5.087414 
1 1 1   14    6   71 o   81.711   2.0237  274.091   13.479  243.645   24.736  286.951   16.076   76.154   3.9987   83.464   2.3653 -7.310013 4.645886 
1 1 1   14    6   72 o   34.776   3.1012   50.549   8.6992   40.577   14.621   56.013   10.823   30.038   6.1777   36.439   3.6948 -6.401184 7.198353 
1 1 1   14    6   73 o   31.267   3.3386   41.143   8.3775   16.694   13.811   55.374   10.537   19.934   6.9370   36.232   3.6160 -16.29805 7.822888 
1 1 1   14    6   74 o   15.804   5.7929   9.2755   9.7597   4.1673   13.453   14.952   14.181   15.471   6.4422   19.301   6.9968 -3.829784 9.510834 
1 1 1   14    6   75 o   38.824   3.4109   63.429   10.685   55.271   14.606   72.821   15.671   35.490   5.2035   41.032   4.7744 -5.542553 7.061935 
1 1 1   14    6   76 f   35.612   4.2267   54.448   12.031   54.448   12.031   0.0000   0.0000   35.612   4.2267  ?   ?  0.000000 4.226731 
1 1 1   14    6   77 o   25.977   3.8710   29.039   7.9470   35.306   11.379   23.073   11.104   28.186   5.1419   22.445   5.9668 5.741142 7.876667 
1 1 1   14    6   78 f   38.295   2.7349   61.185   8.4811   69.632   12.060   52.920   11.930   40.495   3.6940   35.020   4.2670 5.474422 5.643844 
1 1 1   14    6   79 o   43.996   2.3207   80.219   8.2931   80.518   12.495   79.983   11.087   43.603   3.5460   43.634   3.1381 -0.3139496E-01 4.735231 
1 1 1   14    6   80 o   56.199   2.1253  130.487   9.7183  116.025   15.850  139.198   12.302   52.245   3.7467   57.847   2.6156 -5.602104 4.569388 
1 1 1   14    6   81 o   11.402   4.7435   1.9805   7.2840   8.4732   13.353  -0.7697   8.6908   16.504   6.5859   11.330   4.9551 5.174150 8.241770 
1 1 1   14    6   82 f   15.988   5.1989   11.108   7.7620   17.218   13.450   8.0569   9.5046   19.655   6.8452   14.977   5.6715 4.677648 8.889503 
1 1 1   14    6   83 o   33.848   2.2949   47.653   6.2944   36.201   11.622   52.406   7.4875   28.291   5.2325   35.400   2.6132 -7.109652 5.848773 
1 1 1   14    6   84 o   54.955   1.9162  124.688   8.5706  127.294   13.447  122.904   11.122   55.014   3.0100   54.307   2.5194 0.7073936 3.925247 
1 1 1   14    6   85 o  107.909   1.4687  478.060   12.919  495.120   22.528  469.701   15.769  109.037   2.5346  106.759   1.8121 2.278305 3.115749 
1 1 1   14    6   86 f   11.150   4.0879   4.5374   4.8604   17.976   10.929   1.2240   5.4267   19.543   6.1499   9.7412   4.0765 9.801481 7.378279 
1 1 1   14    6   87 o   48.674   1.6714   97.703   6.6216   87.668   14.518  100.339   7.4406   44.873   4.0115   49.260   1.8563 -4.387356 4.420153 
1 1 1   14    6   88 o   18.599   5.4605   16.261   8.8200   18.800   11.037   11.774   14.672   19.768   6.1743   17.447   6.9227 2.320686 9.276102 
1 1 1   14    6   89 o   10.442   4.7383  -3.2811   8.7441  -0.7314   10.873  -7.9503   14.713   12.324   5.4599   12.645   5.8840 -0.3202457 8.026998 
1 1 1   14    6   90 o   38.435   3.1640   63.364   9.8252   73.746   12.212   44.309   16.544   41.131   3.6813   29.348   7.0118 11.78301 7.919394 
1 1 1   14    6   91 o   20.034   5.8301   19.716   10.093   19.628   12.737   19.864   16.547   19.757   6.6682   19.903   7.4952 -0.1458111 10.03214 
1 1 1   14    6   92 o   11.415   4.9995   0.2613   8.8755   7.6418   11.943  -8.8423   13.264   15.041   6.1467   11.641   5.4719 3.399724 8.229371 
1 1 1   14    6   93 o   19.327   5.4994   18.341   9.0767   12.786   12.323   24.928   13.419   16.821   6.4369   21.693   6.8129 -4.872202 9.372828 
1 1 1   14    6   94 o   10.596   4.8577  -3.7305   9.4971 -10.2088   11.531   9.9332   16.746   10.424   4.9590   16.651   7.0744 -6.227514 8.639393 
1 1 1   14    6   95 o   8.7110   4.2160 -12.0660   9.1817 -19.6509   11.647   0.3894   14.924   9.0908   4.4734   13.861   6.2495 -4.770554 7.685510 
1 1 1   14    6   96 o   28.824   4.4101   38.594   10.033   21.786   12.570   68.096   16.654   20.063   6.6214   37.038   5.6985 -16.97535 8.735858 
1 1 1   14    6   97 o   43.772   3.0840   83.322   10.933   75.256   13.693   97.511   18.161   40.525   4.2062   45.159   5.0182 -4.633484 6.547855 
1 1 1   14    6   98 o   11.841   5.1815   1.4245   9.5151   1.5110   11.874   1.2692   15.906   12.861   5.7012   14.180   6.4170 -1.319509 8.583790 
1 1 1   14    6   99 o   15.639   5.7533   11.758   9.6405   11.533   12.239   12.126   15.648   15.883   6.3160   16.568   6.9272 -0.6856289 9.374311 
1 1 1   14    6  100 o   10.472   4.8100  -3.2443   9.3722  -2.4534   11.787  -4.6039   15.454   11.826   5.4179   12.854   5.9977 -1.027523 8.082445 
1 1 1   14    6  101 o   14.582   5.7268   9.3387   9.9488   10.879   12.831   7.0173   15.753   15.630   6.3773   15.171   6.6522 0.4589119 9.215314 
1 1 1   14    6  102 f   24.303   5.3680   29.897   10.350   43.256   13.433   10.379   16.237   28.796   5.9206   16.013   6.8883 12.78277 9.083086 
1 1 1   14    6  103 o   15.131   6.0350   10.398   11.207   8.2676   13.142   16.075   21.458   14.831   6.2828   17.763   7.7768 -2.931540 9.997558 
1 1 1   14    6  104 o   24.493   5.8135   31.652   11.432   36.620   13.572   19.518   21.210   25.652   6.4873   18.353   7.8836 7.299200 10.20961 
1 1 1   14    6  105 o   26.983   6.3852   40.124   13.824   59.589   18.095   12.835   21.425   32.133   7.0980   16.983   7.5853 15.14997 10.38834 
1 1 1   14    6  106 f   14.569   6.2807   7.4597   13.555  -6.6967   17.495   28.724   21.441   12.966   6.1512   20.267   8.2534 -7.301127 10.29346 
1 1 1   14    6  107 o   16.115   6.7966   12.500   15.269   0.7859   22.077   23.241   21.141   15.052   7.0699   18.893   7.9842 -3.841109 10.66445 
1 1 1   14    6  110 f   16.014   7.5410   4.3907   25.402   4.3907   25.402   0.0000   0.0000   16.014   7.5410  ?   ?  0.000000 7.541036 
1 1 1   14    7 -107 o   13.553   6.4104  -4.2124   18.728  -4.2124   18.728   0.0000   0.0000   13.553   6.4104  ?   ?  0.000000 6.410422 
1 1 1   14    7 -106 o   15.266   6.8757   7.4343   18.012   7.4343   18.012   0.0000   0.0000   15.266   6.8757  ?   ?  0.000000 6.875680 
1 1 1   14    7 -105 o   11.838   5.7537 -14.9183   17.581 -14.9183   17.581   0.0000   0.0000   11.838   5.7537  ?   ?  0.000000 5.753704 
1 1 1   14    7 -104 o   13.047   6.2046  -6.6110   18.016  -6.6110   18.016   0.0000   0.0000   13.047   6.2046  ?   ?  0.000000 6.204636 
1 1 1   14    7 -103 f   14.153   6.5885  -0.2128   18.474  -0.2128   18.474   0.0000   0.0000   14.153   6.5885  ?   ?  0.000000 6.588466 
1 1 1   14    7 -102 o   10.825   5.3637 -26.6090   17.786 -26.6090   17.786   0.0000   0.0000   10.825   5.3637  ?   ?  0.000000 5.363748 
1 1 1   14    7 -101 f   9.7332   4.9024 -41.2705   17.857 -41.2705   17.857   0.0000   0.0000   9.7332   4.9024  ?   ?  0.000000 4.902387 
1 1 1   14    7 -100 o   16.732   7.2545   12.852   18.291   12.852   18.291   0.0000   0.0000   16.732   7.2545  ?   ?  0.000000 7.254518 
1 1 1   14    7  -99 f   17.037   6.8083   15.147   14.291   24.248   18.073  -0.0379   23.345   19.704   7.7246   15.443   7.2589 4.260631 10.60009 
1 1 1   14    7  -98 o   21.939   6.9095   28.031   13.793   20.996   18.044   37.919   21.393   18.852   7.6097   23.181   8.5629 -4.329113 11.45559 
1 1 1   14    7  -97 o   17.192   6.5189   15.505   12.566   19.177   17.088   11.180   18.544   18.442   7.4192   16.595   7.2482 1.847517 10.37211 
1 1 1   14    7  -96 o   13.595   5.9355   3.9323   12.424   2.8594   17.102   5.1312   18.078   14.708   6.6550   15.374   6.9095 -0.6664143 9.593241 
1 1 1   14    7  -95 o   14.092   6.0362   5.6581   12.370   7.2761   16.776   3.7297   18.314   15.601   6.8518   15.236   6.8910 0.3650646 9.717663 
1 1 1   14    7  -94 o   22.389   6.4749   27.313   12.485   21.825   17.262   33.332   18.078   19.493   7.5759   23.123   7.9418 -3.630081 10.97573 
1 1 1   14    7  -93 o   13.381   5.8419   3.1707   12.034  -3.7110   16.443   11.108   17.659   13.483   6.2558   16.759   7.1961 -3.275813 9.535177 
1 1 1   14    7  -92 f   16.714   6.3979   13.416   12.177   7.5953   16.451   20.471   18.111   15.798   6.8645   19.307   7.6813 -3.508924 10.30167 
1 1 1   14    7  -91 o   16.228   5.8037   12.581   9.7183   0.4583   15.908   19.798   12.275   14.224   6.4288   19.378   6.5462 -5.154023 9.175122 
1 1 1   14    7  -90 o   9.4835   4.4996  -8.5847   9.3666 -10.2500   15.519  -7.6304   11.748   12.299   5.8226   11.005   5.1655 1.293682 7.783665 
1 1 1   14    7  -89 f   9.8856   4.6322  -6.8190   9.3803   0.9658   15.625 -11.2056   11.729   14.447   6.4635   10.421   4.9700 4.026210 8.153431 
1 1 1   14    7  -88 o   50.061   2.8460  106.687   11.566  100.593   18.924  110.321   14.613   46.536   5.0706   50.288   3.5883 -3.751675 6.211844 
1 1 1   14    7  -87 o   10.485   4.8254  -4.7127   9.4968   20.293   16.053 -18.1752   11.779   20.029   7.4143   9.4840   4.6317 10.54530 8.742125 
1 1 1   14    7  -86 o   29.048   4.3452   37.963   9.9730   32.611   16.761   40.897   12.409   24.645   7.5942   29.487   5.3599 -4.841938 9.295192 
1 1 1   14    7  -85 o   19.483   5.2917   17.950   8.6197   30.424   13.168   8.5972   11.402   24.716   6.4636   15.439   6.1101 9.276997 8.894457 
1 1 1   14    7  -84 o   57.656   2.2783  138.553   10.687  136.497   15.788  140.292   14.518   56.429   3.4488   57.473   3.1105 -1.044064 4.644268 
1 1 1   14    7  -83 o   37.942   3.0821   61.168   9.4503   74.264   14.047   50.340   12.773   41.107   4.2535   33.430   4.8270 7.677509 6.433683 
1 1 1   14    7  -82 o   59.531   2.4085  147.709   11.664  164.265   16.122  129.529   16.895   62.274   3.1866   54.841   3.8028 7.433113 4.961437 
1 1 1   14    7  -81 o   32.169   3.8578   44.845   9.9145   38.448   16.430   48.508   12.434   27.843   7.1895   32.986   4.7617 -5.143686 8.623376 
1 1 1   14    7  -80 o   26.483   4.5664   31.211   9.5018   26.838   15.533   33.826   12.011   23.381   7.3281   27.048   5.6309 -3.667036 9.241655 
1 1 1   14    7  -79 o   19.729   5.5601   17.937   9.3233   18.532   15.407   17.593   11.711   20.303   7.3019   19.569   6.3874 0.7348022 9.701358 
1 1 1   14    7  -78 o   68.521   2.5133  195.201   14.014  173.725   29.925  201.234   15.861   61.851   6.0112   69.404   2.8094 -7.552921 6.635318 
1 1 1   14    7  -77 o   40.173   2.9671   67.776   9.6479   61.566   14.388   72.851   13.005   37.386   4.8341   41.219   3.9178 -3.832130 6.222349 
1 1 1   14    7  -76 o   86.172   1.8697  305.597   13.133  292.953   19.201  316.710   18.002   83.817   2.8143   87.341   2.5313 -3.523582 3.785214 
1 1 1   14    7  -75 f   9.2084   4.3133  -7.2851   8.1207  -2.2477   12.527 -10.9365   10.665   13.139   5.8386   10.206   4.8303 2.933179 7.577712 
1 1 1   14    7  -74 o   19.557   5.1552   17.250   8.3331   7.4889   12.471   25.125   11.201   15.944   6.3638   23.372   5.8840 -7.428748 8.667140 
1 1 1   14    7  -73 o   53.484   2.5745  118.762   11.191  121.218   15.427  116.034   16.260   53.599   3.5510   52.285   3.8419 1.314213 5.231601 
1 1 1   14    7  -72 o   23.145   5.0912   23.962   9.3439   11.737   12.749   38.152   13.735   17.619   6.5907   28.939   6.0188 -11.32014 8.925448 
1 1 1   14    7  -71 o   17.314   5.6079   12.930   9.0366   10.956   12.270   15.270   13.359   17.227   6.4613   19.160   6.8096 -1.932522 9.387169 
1 1 1   14    7  -70 o   36.015   2.5570   53.862   7.4579   59.457   13.418   51.361   8.9713   37.153   4.5238   34.987   3.1803 2.165546 5.529826 
1 1 1   14    7  -69 o   15.515   4.8189   10.306   6.7331   20.249   12.945   6.6186   7.8834   21.263   6.6933   13.875   5.1843 7.387245 8.466211 
1 1 1   14    7  -68 o   38.102   2.2927   59.989   7.0879   55.897   11.120   62.789   9.1987   36.338   3.8107   38.820   2.9285 -2.482365 4.805973 
1 1 1   14    7  -67 o   55.036   1.9728  124.502   8.8360  108.398   15.346  132.489   10.807   50.790   3.7327   56.678   2.3442 -5.888058 4.407772 
1 1 1   14    7  -66 o   21.271   4.6171   19.813   7.7752   37.781   10.559  -1.4721   11.492   29.618   4.5160   12.986   5.6881 16.63265 7.262846 
1 1 1   14    7  -65 f   50.802   2.0114  106.061   8.3131  119.552   12.185   94.314   11.370   53.742   2.7911   47.676   2.9400 6.066673 4.053852 
1 1 1   14    7  -64 o   34.382   2.6891   49.011   7.4767   37.241   10.760   60.002   10.397   29.416   4.6409   37.883   3.4031 -8.467346 5.754905 
1 1 1   14    7  -63 o   55.665   1.9316  127.137   8.7515  111.939   12.453  141.969   12.302   51.994   2.9503   58.677   2.5783 -6.683609 3.918097 
1 1 1   14    7  -62 o   66.529   1.7839  181.327   9.6657  179.720   13.863  182.848   13.484   66.049   2.5798   66.647   2.4863 -0.5984421 3.582896 
1 1 1   14    7  -61 o   91.474   1.5859  342.171   11.826  339.195   16.534  345.288   16.920   90.929   2.2307   91.733   2.2628 -0.8043747 3.177479 
1 1 1   14    7  -60 o   51.318   2.1476  108.136   8.9638  123.221   14.115   97.941   11.604   54.551   3.1882   48.674   2.9383 5.876972 4.335696 
1 1 1   14    7  -59 o   20.369   4.2662   17.885   6.8563   24.138   10.871   13.754   8.8352   23.441   5.7367   17.995   5.5080 5.445621 7.952826 
1 1 1   14    7  -58 o   21.917   4.1414   20.570   7.1277   12.883   11.986   24.775   8.8656   18.326   6.4561   23.974   4.7047 -5.648327 7.988474 
1 1 1   14    7  -57 o   57.496   1.9226  135.404   8.9980  133.242   14.785  136.675   11.340   56.785   3.2071   57.683   2.4170 -0.8980446 4.015928 
1 1 1   14    7  -56 o   57.253   1.9461  134.247   9.0690  146.058   14.629  126.874   11.558   59.522   3.0251   55.557   2.5590 3.964359 3.962274 
1 1 1   14    7  -55 o   73.669   1.8022  221.859   10.822  217.141   15.041  226.923   15.583   72.730   2.5410   74.345   2.5752 -1.614952 3.617778 
1 1 1   14    7  -54 f   79.028   1.9506  255.395   12.566  231.866   19.527  272.023   16.416   75.024   3.2004   81.441   2.4757 -6.417381 4.046237 
1 1 1   14    7  -53 o   60.665   2.2551  150.835   11.132  133.776   17.716  161.966   14.311   56.818   3.8478   62.773   2.8038 -5.955288 4.760930 
1 1 1   14    7  -52 o   15.949   5.5982   9.4765   9.0064 -14.7977   13.089   31.305   12.412   11.323   5.3566   26.862   5.8357 -15.53871 7.921439 
1 1 1   14    7  -51 o   65.077   2.1356  173.389   11.314  171.622   17.030  174.785   15.136   64.555   3.2467   65.224   2.8538 -0.6697922 4.322684 
1 1 1   14    7  -50 o  136.613   1.7851  762.401   19.879  721.601   28.699  800.030   27.562  132.724   2.6527  139.810   2.4184 -7.086136 3.589640 
1 1 1   14    7  -49 o  116.843   2.0623  558.057   19.642  542.834   35.349  564.858   23.626  114.784   3.7831  117.479   2.4671 -2.695335 4.516463 
1 1 1   14    7  -48 o   47.643   2.5193   93.152   9.7491   69.515   16.252  106.439   12.185   40.677   5.0070   50.875   2.9509 -10.19802 5.811833 
1 1 1   14    7  -47 o   16.584   5.3468   11.122   8.2205   7.0248   13.954   13.300   10.173   17.078   6.7590   18.188   5.9544 -1.110453 9.007668 
1 1 1   14    7  -46 o   73.449   1.8644  220.471   11.154  195.208   17.993  236.237   14.214   68.922   3.2114   75.979   2.2976 -7.057053 3.948739 
1 1 1   14    7  -45 o   74.403   1.9807  226.284   12.002  230.520   18.286  223.078   15.908   74.956   2.9988   73.788   2.6492 1.167641 4.001358 
1 1 1   14    7  -44 o   73.439   1.8195  220.214   10.892  226.102   18.177  216.915   13.605   74.238   3.0100   72.812   2.2951 1.425743 3.785230 
1 1 1   14    7  -43 o  140.761   1.6038  808.646   18.402  783.227   28.943  825.895   23.842  138.385   2.5658  142.193   2.0570 -3.807114 3.288524 
1 1 1   14    7  -42 o   81.799   1.7416  273.130   11.613  279.589   19.193  269.399   14.586   82.605   2.8546   81.171   2.2064 1.434242 3.607916 
1 1 1   14    7  -41 o   67.613   1.8854  186.792   10.381  183.640   17.251  188.581   12.998   66.886   3.1731   67.889   2.3523 -1.003494 3.949912 
1 1 1   14    7  -40 o  136.985   1.7661  765.939   19.721  762.355   28.217  769.361   27.573  136.558   2.5349  137.195   2.4655 -0.6372223 3.536156 
1 1 1   14    7  -39 o   19.205   5.9827   15.200   10.370   22.555   13.622   5.0622   15.991   23.078   6.7889   17.447   7.1191 5.630463 9.837206 
1 1 1   14    7  -38 o  178.036   2.0229  1294.21   29.357  1346.30   39.025  1226.31   44.555  181.468   2.6382  173.078   3.1581 8.390366 4.115060 
1 1 1   14    7  -37 o   23.564   4.8037   23.670   8.9138   25.902   13.903   22.112   11.615   24.580   6.7388   22.727   6.1301 1.853209 9.109877 
1 1 1   14    7  -36 o  138.716   1.8538  785.388   20.962  751.516   33.208  807.823   27.027  135.533   3.0058  140.621   2.3578 -5.087646 3.820238 
1 1 1   14    7  -35 o   92.159   1.7550  346.600   13.184  364.019   23.552  338.650   15.911   94.275   3.0688   91.068   2.1434 3.207321 3.743219 
1 1 1   14    7  -34 o   86.127   1.8013  302.724   12.646  324.801   22.885  293.019   15.173   89.037   3.1581   84.680   2.2000 4.357391 3.848900 
1 1 1   14    7  -33 o   93.584   1.7681  357.388   13.488  364.763   24.112  354.030   16.272   94.368   3.1389   93.116   2.1438 1.252235 3.801097 
1 1 1   14    7  -32 o  162.561   1.9403  1078.62   25.712  1071.70   61.991  1080.05   28.257  161.402   4.7168  162.645   2.1313 -1.243301 5.175996 
1 1 1   14    7  -31 o   79.556   1.8024  258.272   11.689  256.859   19.491  259.066   14.607   79.193   3.0248   79.619   2.2529 -0.4256287 3.771594 
1 1 1   14    7  -30 o  114.336   1.6405  533.331   15.289  531.717   25.090  534.284   19.283  114.067   2.6984  114.405   2.0677 -0.3375473 3.399515 
1 1 1   14    7  -29 o  105.402   1.6737  453.245   14.380  411.338   23.443  478.527   18.208  100.274   2.8710  108.274   2.0631 -8.000046 3.535416 
1 1 1   14    7  -28 o   87.513   1.8798  312.525   13.409  281.971   25.527  324.169   15.759   82.886   3.7882   89.111   2.1695 -6.224686 4.365477 
1 1 1   14    7  -27 o  236.704   2.0560  2286.84   39.670  2258.18   69.868  2300.48   48.191  234.857   3.6496  237.330   2.4910 -2.472488 4.418644 
1 1 1   14    7  -26 o   35.268   3.1856   51.276   9.0597   53.754   15.753   50.051   11.074   35.719   5.5938   34.729   3.9841 0.9900932 6.867537 
1 1 1   14    7  -25 o  144.217   1.6350  848.424   19.221  852.111   30.907  846.099   24.545  144.432   2.6252  143.980   2.0913 0.4520264 3.356362 
1 1 1   14    7  -24 o   10.727   4.7624  -3.0058   8.3153   6.5522   15.024  -7.2265   9.9839   17.520   6.9876   10.837   4.9727 6.682724 8.576348 
1 1 1   14    7  -23 o  174.177   1.6926  1237.58   24.032  1253.17   38.522  1227.65   30.750  175.150   2.6981  173.426   2.1752 1.724152 3.465697 
1 1 1   14    7  -22 o  123.019   1.7868  617.405   17.918  604.664   26.823  627.672   24.077  121.666   2.7046  123.990   2.3822 -2.324089 3.604153 
1 1 1   14    7  -21 o   76.645   1.8646  239.676   11.649  245.650   19.766  236.497   14.420   77.457   3.1370   76.077   2.3280 1.380081 3.906413 
1 1 1   14    7  -20 o   38.403   3.4397   60.798   10.654   18.302   36.141   64.842   11.149   27.415   10.869   39.664   3.4837 -12.24951 11.41365 
1 1 1   14    7  -19 o  151.943   1.9625  942.013   24.307  858.924   62.943  956.576   26.351  144.466   5.3542  153.099   2.1115 -8.632874 5.755516 
1 1 1   14    7  -18 o  249.286   2.3291  2536.79   47.328  2572.99  115.656  2529.51   51.870  250.092   5.6732  248.888   2.5567 1.203644 6.222709 
1 1 1   14    7  -17 o  115.959   1.6547  548.474   15.641  522.541   25.441  564.232   19.832  113.106   2.7594  117.587   2.0690 -4.481560 3.448943 
1 1 1   14    7  -16 o   50.552   2.4228  104.565   9.9545   94.935   17.391  109.258   12.140   47.918   4.5051   51.634   2.8960 -3.715885 5.355631 
1 1 1   14    7  -15 o  138.465   1.6430  782.016   18.545  786.921   30.395  779.107   23.406  138.812   2.6862  138.177   2.0781 0.6352997 3.396151 
1 1 1   14    7  -14 o   17.805   5.4520   13.041   8.6553   13.856   16.347   12.724   10.203   20.414   7.4948   18.026   5.9660 2.388309 9.579447 
1 1 1   14    7  -13 o  142.792   1.6512  831.643   19.219  803.091   31.072  849.336   24.459  140.232   2.7182  144.272   2.0798 -4.040710 3.422621 
1 1 1   14    7  -12 o   69.442   1.9929  196.911   11.269  216.606   19.766  187.426   13.717   72.716   3.3437   67.711   2.4894 5.004875 4.168630 
1 1 1   14    7  -11 o   80.174   1.8690  262.228   12.214  277.410   21.029  254.498   15.005   82.334   3.1391   78.929   2.3347 3.405197 3.912120 
1 1 1   14    7  -10 o   98.133   1.6257  392.765   13.004  376.589   19.537  405.634   17.426   96.013   2.4984   99.702   2.1441 -3.688896 3.292277 
1 1 1   14    7   -9 o  149.868   1.5617  916.008   19.079  893.219   27.911  935.994   26.138  147.936   2.3146  151.454   2.1172 -3.517990 3.136830 
1 1 1   14    7   -8 o  125.276   1.5557  640.047   15.886  669.518   23.947  616.885   21.230  128.081   2.2937  122.955   2.1182 5.125153 3.122148 
1 1 1   14    7   -7 o  148.174   1.5552  895.399   18.784  904.057   27.778  888.104   25.497  148.834   2.2896  147.529   2.1202 1.304901 3.120516 
1 1 1   14    7   -6 f   48.391   2.4290   95.824   9.5508   99.357   15.066   93.450   12.349   49.140   3.7904   47.716   3.1934 1.424068 4.956344 
1 1 1   14    7   -5 o  170.942   1.5955  1191.75   22.232  1158.97   32.089  1222.00   30.830  168.513   2.3361  173.049   2.1856 -4.536880 3.199046 
1 1 1   14    7   -4 o   75.695   1.8075  233.723   11.153  240.729   17.112  228.550   14.705   76.732   2.7402   74.790   2.4152 1.941719 3.652654 
1 1 1   14    7   -3 o   48.741   2.3916   97.198   9.4731   96.608   14.586   97.628   12.458   48.460   3.7208   48.781   3.1500 -0.3202133 4.875130 
1 1 1   14    7   -2 f   47.151   2.6651   91.061   10.201   84.448   14.981   96.779   13.930   45.240   4.1072   48.524   3.5462 -3.284481 5.426337 
1 1 1   14    7   -1 f   74.299   2.1440  225.440   12.972  214.289   16.802  241.893   20.409   72.380   2.8533   76.868   3.2647 -4.487175 4.335869 
1 1 1   14    7    0 o   98.139   2.0204  392.945   16.162  386.966   21.609  400.536   24.350   97.311   2.7269   98.974   3.0217 -1.663460 4.070206 
1 1 1   14    7    1 f  102.739   2.0174  430.643   16.895  445.286   22.719  412.524   25.271  104.397   2.6719  100.438   3.0904 3.958595 4.085257 
1 1 1   14    7    2 f  188.760   2.0429  1453.72   31.434  1474.33   41.486  1425.94   48.167  190.022   2.6783  186.812   3.1631 3.210449 4.144715 
1 1 1   14    7    3 o  124.933   1.9377  636.751   19.733  682.646   26.905  583.316   29.031  129.312   2.5524  119.499   2.9803 9.813011 3.923881 
1 1 1   14    7    4 o   62.284   2.5275  158.622   12.806  170.033   17.401  145.142   18.913   64.415   3.3253   59.432   3.9260 4.983116 5.145004 
1 1 1   14    7    5 o  167.397   1.9708  1143.22   26.892  1149.70   35.356  1134.32   41.422  167.811   2.5847  166.630   3.0496 1.181473 3.997582 
1 1 1   14    7    6 f  138.296   1.7462  780.125   19.686  785.903   28.741  775.020   27.018  138.747   2.5413  137.795   2.4054 0.9522552 3.499118 
1 1 1   14    7    7 o  103.274   1.7858  435.058   15.034  427.406   22.031  441.726   20.566  102.279   2.6447  104.027   2.4253 -1.748566 3.588398 
1 1 1   14    7    8 o   72.534   1.9171  214.783   11.325  201.542   17.962  223.520   14.591   70.160   3.1487   73.960   2.4235 -3.799118 3.973339 
1 1 1   14    7    9 o  221.799   1.8417  2006.81   33.297  1998.59   51.364  2012.78   43.731  221.208   2.8485  222.058   2.4159 -0.8492279 3.735079 
1 1 1   14    7   10 o  182.300   2.0253  1355.95   30.096  1414.04   49.726  1322.38   37.806  186.001   3.2797  179.969   2.5771 6.032715 4.171056 
1 1 1   14    7   11 o   91.355   1.8973  340.472   14.128  323.114   20.593  355.909   19.420   88.898   2.8454   93.332   2.5550 -4.434334 3.824208 
1 1 1   14    7   12 o  199.690   1.9048  1626.82   31.005  1641.51   44.589  1613.07   43.143  200.487   2.7284  198.753   2.6629 1.734726 3.812499 
1 1 1   14    7   13 o   26.407   4.7686   29.461   9.8870   48.529   15.091   15.123   13.087   33.916   5.6578   19.891   6.7588 14.02495 8.814320 
1 1 1   14    7   14 o  138.188   1.7632  778.963   19.861  722.113   28.054  836.086   28.121  132.984   2.5880  143.112   2.4106 -10.12775 3.536751 
1 1 1   14    7   15 o   54.910   2.2956  123.284   10.253  103.013   16.260  136.661   13.209   50.002   4.0233   57.774   2.8133 -7.771835 4.909384 
1 1 1   14    7   16 o  122.695   1.7678  614.109   17.681  611.970   25.708  616.030   24.356  122.421   2.5762  122.839   2.4324 -0.4179001 3.543054 
1 1 1   14    7   17 o  192.313   1.7406  1508.69   27.287  1553.99   42.887  1477.88   35.369  195.061   2.6972  190.280   2.2803 4.780746 3.531991 
1 1 1   14    7   18 o  123.882   1.6365  625.974   16.525  628.577   26.204  624.255   21.294  124.066   2.5910  123.679   2.1121 0.3869019 3.342827 
1 1 1   14    7   19 o  162.560   1.8068  1078.07   23.942  1068.26   42.860  1082.52   28.865  161.645   3.2528  162.860   2.1743 -1.214157 3.912577 
1 1 1   14    7   20 o   54.138   2.5311  119.945   11.139  128.382   21.732  116.938   12.973   55.727   4.8317   53.410   2.9917 2.316509 5.682916 
1 1 1   14    7   21 o   97.039   1.8648  384.200   14.751  405.839   27.609  375.555   17.451   99.555   3.4072   95.920   2.2319 3.635666 4.073084 
1 1 1   14    7   22 o   69.229   2.2913  195.860   12.912  205.805   29.957  193.591   14.310   70.575   5.2449   68.803   2.5559 1.771301 5.834478 
1 1 1   14    7   23 o  177.978   1.8155  1292.36   26.339  1264.09   45.564  1306.55   32.278  175.834   3.1789  178.908   2.2133 -3.073486 3.873531 
1 1 1   14    7   24 o   46.498   2.6975   88.616   10.180   93.042   18.408   86.665   12.219   47.364   4.8355   45.918   3.2863 1.445965 5.846506 
1 1 1   14    7   25 o   71.407   2.2764  208.380   13.233  197.462   21.204  215.345   16.937   69.346   3.7653   72.536   2.8701 -3.189896 4.734432 
1 1 1   14    7   26 o   63.012   2.2943  162.321   11.765  159.612   17.909  164.378   15.604   62.352   3.5380   63.339   3.0310 -0.9871483 4.658855 
1 1 1   14    7   27 o   54.285   2.3160  120.543   10.225  139.188   16.961  109.899   12.815   58.203   3.5926   51.757   3.0510 6.445690 4.713307 
1 1 1   14    7   28 o   41.288   3.0034   70.059   10.039   79.092   18.016   65.991   12.090   43.554   5.1756   39.968   3.7549 3.586044 6.394216 
1 1 1   14    7   29 o   44.189   2.8191   80.130   10.102   76.457   18.188   81.769   12.147   42.777   5.3315   44.576   3.3680 -1.799099 6.306259 
1 1 1   14    7   30 o  113.783   1.9209  528.378   17.816  471.780   40.760  541.746   19.809  107.062   4.6818  115.197   2.1095 -8.135422 5.135067 
1 1 1   14    7   31 o   17.931   5.6407   13.108   9.1950   19.727   17.820   10.706   10.734   22.788   7.8824   17.243   6.1066 5.544950 9.971104 
1 1 1   14    7   32 o   11.455   5.0003  -1.7735   8.8140   17.106   16.512  -9.2963   10.423   21.529   7.5782   10.678   4.9634 10.85043 9.058945 
1 1 1   14    7   33 o   44.311   2.7616   80.574   9.9252  103.399   18.452   71.281   11.774   49.958   4.5820   41.574   3.5068 8.383858 5.769976 
1 1 1   14    7   34 o   83.138   2.1016  282.387   14.231  273.795   33.610  284.264   15.708   81.386   5.0917   83.393   2.3131 -2.006844 5.592462 
1 1 1   14    7   35 o   29.641   4.3494   36.833   10.196 -24.0889   24.023   50.220   11.261   15.738   7.3869   34.756   4.0506 -19.01754 8.424586 
1 1 1   14    7   36 o   71.337   2.4780  208.196   14.388  250.545   31.311  196.861   16.199   77.852   4.9597   69.320   2.8730 8.531586 5.731755 
1 1 1   14    7   37 o  153.271   2.1461  959.366   26.813  972.138   54.981  955.380   30.713  153.743   4.3916  152.904   2.4642 0.8390198 5.035712 
1 1 1   14    7   38 o  103.312   1.9568  435.753   16.479  401.918   26.455  457.206   21.065   99.014   3.2823  105.774   2.4432 -6.759926 4.091778 
1 1 1   14    7   39 o   12.559   5.6213  -5.0421   11.833 -10.7082   16.307   1.2592   17.197   13.971   6.3900   16.993   7.1923 -3.022237 9.620863 
1 1 1   14    7   40 o   54.990   2.4079  123.820   10.767  150.279   20.317  113.488   12.697   60.337   4.1563   52.575   2.9747 7.761356 5.111156 
1 1 1   14    7   41 o   53.237   2.4196  116.083   10.473  124.623   19.786  112.759   12.343   54.854   4.4636   52.411   2.9005 2.442257 5.323173 
1 1 1   14    7   42 o   70.399   2.0573  202.599   11.793  196.610   21.384  205.217   14.137   69.098   3.8113   70.809   2.4530 -1.710472 4.532443 
1 1 1   14    7   43 o   33.671   3.4621   46.980   9.3672   49.351   17.834   46.076   11.008   33.841   6.7020   33.221   4.1556 0.6197815 7.885787 
1 1 1   14    7   44 o   55.867   2.5253  127.908   11.470  150.805   20.150  116.932   13.951   60.413   4.1164   53.316   3.2252 7.097183 5.229411 
1 1 1   14    7   45 o   29.598   5.2995   37.322   12.317   30.009   17.842   43.980   17.024   26.427   7.7684   31.867   6.7631 -5.439981 10.29983 
1 1 1   14    7   46 o   15.239   6.1984   4.0487   12.076   0.1855   18.137   7.1255   16.186   17.107   7.3180   18.062   7.2363 -0.9554462 10.29165 
1 1 1   14    7   47 o   18.170   6.4998   11.921   12.190   6.8210   17.801   16.425   16.728   18.618   7.5429   21.208   7.6108 -2.589933 10.71534 
1 1 1   14    7   48 o   53.762   2.7263  118.671   11.909  113.596   21.029  121.067   14.449   52.141   5.0092   54.214   3.2850 -2.073345 5.990225 
1 1 1   14    7   49 o   98.646   2.0308  397.731   16.330  398.442   27.907  397.360   20.137   98.404   3.4845   98.495   2.5101 -0.9056854E-01 4.294477 
1 1 1   14    7   50 o   82.133   2.1468  276.037   14.360  265.038   24.340  281.910   17.786   80.154   3.7355   82.919   2.6347 -2.764946 4.571193 
1 1 1   14    7   51 o   94.616   1.9894  365.960   15.343  373.667   25.746  361.715   19.107   95.298   3.3194   93.953   2.4971 1.345367 4.153765 
1 1 1   14    7   52 o   72.813   2.1798  217.091   12.923  193.532   21.812  229.834   16.042   68.383   3.9296   74.843   2.6336 -6.460030 4.730452 
1 1 1   14    7   53 o  133.926   1.8934  733.198   20.670  737.743   33.821  730.489   26.114  134.008   3.0961  133.558   2.3987 0.4497223 3.916596 
1 1 1   14    7   54 f   54.275   2.3876  120.891   10.537  108.244   16.974  128.821   13.441   51.000   4.1180   55.930   2.9588 -4.930431 5.070680 
1 1 1   14    7   55 o   18.194   5.3516   14.101   8.4648   14.633   14.001   13.795   10.627   19.656   6.9728   18.436   6.0882 1.219772 9.256668 
1 1 1   14    7   56 o   38.694   3.6393   62.340   11.344   59.757   19.672   63.626   13.885   36.955   6.7801   38.894   4.4603 -1.938019 8.115703 
1 1 1   14    7   57 o   75.241   2.3261  232.255   14.249  219.535   23.784  239.378   17.797   72.673   4.0306   76.258   2.8681 -3.584946 4.946927 
1 1 1   14    7   58 o   52.223   2.7998  112.428   11.875   92.819   20.973  121.682   14.407   46.612   5.6340   54.225   3.2747 -7.613110 6.516510 
1 1 1   14    7   59 o   23.212   4.9237   23.382   9.0273   12.549   14.001   31.088   11.810   18.771   6.9286   26.671   5.6101 -7.900400 8.915091 
1 1 1   14    7   60 o   25.702   4.2551   28.207   8.6031   33.561   14.492   25.293   10.691   27.453   6.5647   23.998   5.5722 3.454950 8.610733 
1 1 1   14    7   61 o   52.486   2.3112  113.283   9.8638  126.925   16.488  105.680   12.309   55.196   3.6858   50.535   3.0017 4.660606 4.753411 
1 1 1   14    7   62 o   72.797   1.9793  217.327   11.734  196.160   18.391  231.861   15.239   68.782   3.2896   75.059   2.4942 -6.276596 4.128255 
1 1 1   14    7   63 o   31.969   3.4033   42.819   8.7329   55.483   15.035   36.371   10.728   35.821   5.3096   29.074   4.6859 6.747002 7.081661 
1 1 1   14    7   64 o   76.415   1.9287  239.530   12.004  224.571   18.772  249.879   15.614   73.601   3.1361   77.894   2.4622 -4.292427 3.987205 
1 1 1   14    7   65 f   57.265   2.2359  134.967   10.417  131.275   16.659  137.337   13.348   56.017   3.6685   57.592   2.8522 -1.575188 4.646828 
1 1 1   14    7   66 o   48.284   2.4417   96.256   9.5790   85.938   15.761  102.300   12.062   44.985   4.3525   49.622   2.9961 -4.637589 5.283996 
1 1 1   14    7   67 o   39.296   2.8387   64.195   9.0314   46.576   14.448   75.496   11.571   32.457   5.6669   42.467   3.3701 -10.00988 6.593313 
1 1 1   14    7   68 o   58.597   2.1109  141.345   10.066  131.423   15.940  147.926   12.983   56.011   3.5090   59.771   2.6713 -3.759926 4.410084 
1 1 1   14    7   69 o   12.163   4.8969   3.3218   7.4511   0.4176   12.512   4.9178   9.2750   13.976   6.0297   13.791   5.4936 0.1849651 8.157037 
1 1 1   14    7   70 o   21.334   4.6442   20.084   7.8467   23.609   13.030   18.078   9.8290   22.706   6.6288   20.073   5.7265 2.632677 8.759749 
1 1 1   14    7   71 o   15.297   5.6632   8.5460   9.3665   19.406   17.324   4.0603   11.134   21.362   7.7349   14.331   5.9042 7.031100 9.730746 
1 1 1   14    7   72 o   13.280   5.2170   5.0427   8.2584  -0.1562   12.691   8.8608   10.876   13.829   6.0189   15.932   6.0591 -2.102798 8.540470 
1 1 1   14    7   73 o   20.100   4.8606   18.071   7.8754   19.067   13.395   17.545   9.7357   20.599   6.8366   19.695   5.7243 0.9039364 8.916677 
1 1 1   14    7   74 o   8.7709   4.1675  -9.2621   8.0927  -8.1232   16.881  -9.6019   9.2214   14.074   6.4610   9.5163   4.5002 4.557717 7.873763 
1 1 1   14    7   75 f   11.946   5.3698  -3.5382   10.926 -11.8673   16.696   2.6999   14.449   13.322   6.2222   15.283   6.5347 -1.960506 9.023184 
1 1 1   14    7   76 o   15.146   5.9407   7.2924   10.694   11.652   13.128  -1.3034   18.435   17.535   6.6597   15.943   7.0837 1.591743 9.722690 
1 1 1   14    7   77 o   39.827   2.4927   66.045   8.0519   71.696   12.352   61.869   10.618   40.978   3.7391   38.175   3.4492 2.802322 5.087032 
1 1 1   14    7   78 o   43.454   2.3919   78.492   8.4399   59.334   12.808   93.194   11.220   36.926   4.3378   47.134   2.9349 -10.20758 5.237396 
1 1 1   14    7   79 o   50.952   2.1493  107.511   8.9066   94.760   13.374  117.675   11.940   47.213   3.4999   53.036   2.7714 -5.823193 4.464249 
1 1 1   14    7   80 o   15.293   4.9414   10.210   7.0188   16.262   11.205   6.3016   9.0045   18.875   6.2522   13.973   5.4600 4.901983 8.300666 
1 1 1   14    7   81 o   14.403   4.8931   8.7679   6.8590 -13.9721   11.063   22.968   8.7420   9.8439   4.7298   22.459   4.9122 -12.61521 6.819148 
1 1 1   14    7   82 o   14.871   4.8046   9.7041   6.6357   7.2106   11.160   11.068   8.2529   15.061   6.0173   15.896   5.3676 -0.8347149 8.063450 
1 1 1   14    7   83 o   33.223   2.6856   46.507   7.2110   51.218   12.003   43.846   9.0202   33.964   4.4418   31.878   3.5303 2.085913 5.673877 
1 1 1   14    7   84 o   11.774   4.4571   4.8463   5.8690   4.0657   11.060   5.1522   6.9243   13.856   5.8106   12.423   4.8064 1.433234 7.540836 
1 1 1   14    7   85 o   34.233   2.2467   49.004   6.2348   43.043   13.659   50.573   7.0074   30.060   5.7844   34.678   2.4956 -4.617632 6.299809 
1 1 1   14    7   86 o   12.688   3.8219   7.1217   4.2771  -5.4874   12.506   8.7919   4.5515   12.003   5.5287   13.982   3.8646 -1.979467 6.745529 
1 1 1   14    7   87 o   30.066   4.3791   40.869   10.417   30.742   13.079   58.447   17.230   24.624   6.4427   34.318   6.3946 -9.693359 9.077422 
1 1 1   14    7   88 o   32.120   4.0864   46.173   10.457   41.634   13.053   54.308   17.475   29.334   5.6638   32.506   6.8132 -3.171679 8.859937 
1 1 1   14    7   89 f   12.852   5.4253   3.5647   9.7434   8.5495   12.059  -5.8112   16.538   15.304   6.2052   13.502   6.2676 1.802447 8.819678 
1 1 1   14    7   90 o   14.666   5.8214   8.2980   10.379   6.7489   11.842   13.432   21.559   14.564   6.0526   18.289   7.9028 -3.725101 9.954307 
1 1 1   14    7   91 o   10.437   4.8800  -6.3876   10.317   0.9052   11.925 -28.0805   20.568   12.874   5.7099   12.071   5.9407 0.8027563 8.239841 
1 1 1   14    7   92 f   13.158   5.6167   4.0182   10.643   8.7080   12.153 -11.4163   22.047   15.089   6.1872   14.187   6.7793 0.9013844 9.178257 
1 1 1   14    7   93 o   20.124   6.5829   22.062   12.436   22.963   14.659   19.749   23.489   20.156   7.1362   19.216   8.2757 0.9403954 10.92766 
1 1 1   14    7   94 o   28.053   5.2180   38.596   11.493   35.121   13.007   50.975   24.550   25.744   6.2594   26.683   9.2507 -0.9392204 11.16942 
1 1 1   14    7   95 o   9.8584   4.6789  -8.3429   10.143  -0.8675   13.150 -19.3240   15.938   12.766   5.7997   11.047   5.3936 1.718263 7.920093 
1 1 1   14    7   96 o   16.093   6.0878   12.677   10.944   21.510   14.554   1.1816   16.603   19.394   7.0797   14.257   6.4926 5.137612 9.606030 
1 1 1   14    7   97 o   15.691   6.0857   11.747   11.121   21.178   15.220   0.9435   16.289   19.120   7.1910   14.058   6.4133 5.062143 9.635401 
1 1 1   14    7   98 o   26.508   6.1014   37.426   12.910   38.662   15.573   34.708   23.087   25.648   7.1709   21.943   8.6909 3.705095 11.26743 
1 1 1   14    7   99 f   18.971   6.2248   19.753   11.116   20.917   12.756   16.080   22.657   19.181   6.6673   17.850   7.8960 1.331240 10.33440 
1 1 1   14    7  100 o   10.200   4.8427  -8.0895   10.886 -13.7092   12.546   9.0342   21.901   10.136   4.9109   16.465   7.4820 -6.329011 8.949697 
1 1 1   14    7  101 f   16.214   6.1682   13.551   11.273   15.207   13.075   8.7529   22.254   16.881   6.5842   16.380   7.4816 0.5006313 9.966222 
1 1 1   14    7  102 o   12.332   5.4652   1.9242   10.903  -4.6166   12.934   17.987   20.268   11.708   5.4711   17.841   7.6857 -6.132846 9.434110 
1 1 1   14    7  103 f   24.377   6.5783   33.997   13.372   32.765   16.888   36.069   21.894   22.348   7.6760   21.963   8.5331 0.3850155 11.47757 
1 1 1   14    7  104 o   12.414   5.6397   0.1795   12.431 -14.4800   15.744   24.455   20.260   11.280   5.4738   19.133   7.9311 -7.852938 9.636677 
1 1 1   14    7  105 o   16.876   7.7611   12.448   24.507   12.448   24.507   0.0000   0.0000   16.876   7.7611  ?   ?  0.000000 7.761125 
1 1 1   14    7  106 o   24.299   9.4128   51.811   26.581   51.811   26.581   0.0000   0.0000   24.299   9.4128  ?   ?  0.000000 9.412771 
1 1 1   14    7  107 o   14.321   6.9039  -7.8970   24.030  -7.8970   24.030   0.0000   0.0000   14.321   6.9039  ?   ?  0.000000 6.903917 
1 1 1   14    8 -104 o   15.497   7.3680   1.1111   25.371   1.1111   25.371   0.0000   0.0000   15.497   7.3680  ?   ?  0.000000 7.368000 
1 1 1   14    8 -103 o   14.870   6.3480   9.2565   13.596   9.2565   13.596   0.0000   0.0000   14.870   6.3480  ?   ?  0.000000 6.348030 
1 1 1   14    8 -102 o   13.687   6.0307   5.0834   13.094   5.0834   13.094   0.0000   0.0000   13.687   6.0307  ?   ?  0.000000 6.030711 
1 1 1   14    8 -101 f   12.720   5.7449   1.3923   12.674   1.3923   12.674   0.0000   0.0000   12.720   5.7449  ?   ?  0.000000 5.744857 
1 1 1   14    8 -100 o   15.025   6.3161   9.8372   13.118   9.8372   13.118   0.0000   0.0000   15.025   6.3161  ?   ?  0.000000 6.316053 
1 1 1   14    8  -99 o   21.482   6.8700   27.652   13.591   27.652   13.591   0.0000   0.0000   21.482   6.8700  ?   ?  0.000000 6.870015 
1 1 1   14    8  -98 o   15.186   6.3345   10.123   13.040   10.123   13.040   0.0000   0.0000   15.186   6.3345  ?   ?  0.000000 6.334512 
1 1 1   14    8  -97 o   29.636   6.0336   46.773   14.080   46.773   14.080   0.0000   0.0000   29.636   6.0336  ?   ?  0.000000 6.033588 
1 1 1   14    8  -96 o   29.465   5.9776   45.863   13.866   45.863   13.866   0.0000   0.0000   29.465   5.9776  ?   ?  0.000000 5.977604 
1 1 1   14    8  -95 o   17.962   6.7036   17.961   13.174   17.961   13.174   0.0000   0.0000   17.962   6.7036  ?   ?  0.000000 6.703608 
1 1 1   14    8  -94 o   19.011   6.6500   20.446   12.702   20.446   12.702   0.0000   0.0000   19.011   6.6500  ?   ?  0.000000 6.650027 
1 1 1   14    8  -93 o   10.712   5.1040  -9.4685   12.307  -9.4685   12.307   0.0000   0.0000   10.712   5.1040  ?   ?  0.000000 5.104002 
1 1 1   14    8  -92 o   24.333   6.0550   31.362   11.962   25.785   13.190   57.187   28.384   21.317   6.7625   26.539   9.8523 -5.221857 11.94989 
1 1 1   14    8  -91 o   21.620   7.0939   27.123   14.436   27.936   16.926   24.956   27.652   21.377   7.6577   20.005   8.7913 1.372097 11.65875 
1 1 1   14    8  -90 o   12.018   5.3184   0.8872   10.288   5.1399   16.392  -1.8766   13.215   15.068   6.6881   12.590   5.7559 2.477964 8.823923 
1 1 1   14    8  -89 o   40.703   3.5122   73.472   11.539   43.059   17.573   96.527   15.300   26.987   7.6431   46.005   4.1237 -19.01797 8.684566 
1 1 1   14    8  -88 o   11.403   5.1564  -1.6578   10.247   10.888   16.391  -9.7067   13.129   16.542   7.0124   11.197   5.3167 5.345442 8.800046 
1 1 1   14    8  -87 o   12.422   5.3779   2.2656   10.022   11.386   16.104  -3.4980   12.802   16.757   7.0182   12.238   5.6213 4.518327 8.991913 
1 1 1   14    8  -86 o   14.538   5.7844   8.0885   10.272  -0.0323   16.853   12.889   12.956   14.511   6.5819   16.817   6.5556 -2.305741 9.289687 
1 1 1   14    8  -85 o   21.215   5.7626   22.454   10.222   22.496   16.220   22.426   13.165   20.453   7.4726   20.647   6.7742 -0.1935329 10.08612 
1 1 1   14    8  -84 o   10.297   4.8290  -7.3906   10.233 -12.7139   15.374  -3.1570   13.711   11.981   5.7073   12.900   5.8844 -0.9185524 8.197545 
1 1 1   14    8  -83 f   13.887   5.5576   6.4818   9.5364   12.785   15.139   2.3354   12.279   17.466   6.9981   13.638   5.9282 3.828568 9.171534 
1 1 1   14    8  -82 o   25.342   5.0112   29.996   9.9848   21.941   16.130   35.000   12.714   20.675   7.4665   26.739   5.9827 -6.064730 9.567770 
1 1 1   14    8  -81 o   11.977   5.1656   1.1983   9.1774 -16.5473   14.194   13.947   12.031   11.032   5.3153   17.559   6.4324 -6.526234 8.344324 
1 1 1   14    8  -80 o   38.986   3.3805   65.334   10.637   70.444   17.321   62.241   13.478   38.818   5.6388   37.304   4.5247 1.513557 7.229790 
1 1 1   14    8  -79 o   16.893   5.5051   13.028   8.7007   10.116   12.710   15.596   11.936   16.450   6.4693   18.392   6.4455 -1.941917 9.132144 
1 1 1   14    8  -78 f   36.146   3.2332   55.733   9.4259   53.183   13.778   57.977   12.924   34.226   5.0932   36.161   4.4802 -1.934963 6.783302 
1 1 1   14    8  -77 o   29.543   3.9043   38.031   9.1724   30.675   13.366   44.580   12.611   25.156   6.4788   31.353   5.1101 -6.196594 8.251513 
1 1 1   14    8  -76 o   24.279   4.7249   26.539   9.0145   13.855   13.175   37.704   12.361   18.122   6.7151   28.629   5.4966 -10.50739 8.677865 
1 1 1   14    8  -75 o   19.695   5.7997   18.006   9.9370   17.085   17.002   18.483   12.246   19.974   7.5805   19.941   6.5332 0.3333473E-01 10.00734 
1 1 1   14    8  -74 o   17.456   5.7358   13.543   9.4365   32.828   15.277   1.6472   11.999   25.968   7.0415   13.794   5.9275 12.17382 9.204251 
1 1 1   14    8  -73 o   13.036   5.1162   5.0897   7.9353  -8.7292   15.190   10.277   9.3062   13.062   6.0438   15.887   5.6796 -2.825323 8.293682 
1 1 1   14    8  -72 o   56.577   2.2562  132.581   10.384  113.955   17.855  142.102   12.765   51.371   4.3034   58.382   2.6896 -7.011791 5.074785 
1 1 1   14    8  -71 f   31.722   3.3839   42.762   8.6153   21.884   15.447   52.188   10.380   21.706   7.3434   34.945   3.7000 -13.23874 8.222876 
1 1 1   14    8  -70 o   18.300   4.9548   15.056   7.5711   7.3563   12.568   19.441   9.4853   15.892   6.3733   20.630   5.5287 -4.737412 8.437168 
1 1 1   14    8  -69 o   24.288   5.2005   26.569   9.9855   41.705   13.214   6.4186   15.246   30.424   5.5320   16.624   6.8846 13.80018 8.831798 
1 1 1   14    8  -68 o   20.353   5.6731   18.833   9.7630   16.852   12.828   21.559   15.051   19.599   6.6911   21.720   7.2478 -2.121498 9.864155 
1 1 1   14    8  -67 o   41.812   2.8524   72.966   9.6636   70.703   14.386   74.827   13.045   40.497   4.4302   41.944   3.8585 -1.446728 5.874904 
1 1 1   14    8  -66 o   26.020   3.4602   28.807   7.1574   40.676   10.819   19.569   9.5447   30.620   4.4660   20.814   5.5315 9.805346 7.109380 
1 1 1   14    8  -65 o   27.064   3.3742   31.031   7.2826   18.281   10.795   41.680   9.8656   20.177   6.0705   31.221   3.9659 -11.04410 7.251173 
1 1 1   14    8  -64 o   25.930   3.4412   28.534   7.0944   43.908   11.335   18.635   9.0961   31.885   4.4850   20.400   5.3900 11.48505 7.011982 
1 1 1   14    8  -63 o   19.434   4.3791   16.576   6.7705   31.149   10.852   7.2876   8.6635   26.532   5.2035   14.519   5.4327 12.01340 7.522624 
1 1 1   14    8  -62 o   19.648   4.5187   16.962   7.0859   10.488   10.459   22.456   9.6341   16.592   6.0096   22.442   5.3435 -5.850069 8.041677 
1 1 1   14    8  -61 o   42.148   2.2418   73.275   7.6745   74.154   12.037   72.672   9.9620   42.031   3.5462   41.795   2.9429 0.2358437 4.608285 
1 1 1   14    8  -60 o   36.309   2.5361   54.591   7.4591   76.497   11.874   40.312   9.5868   42.755   3.4358   30.817   3.9038 11.93838 5.200456 
1 1 1   14    8  -59 o   47.083   2.1946   91.264   8.3996   92.889   13.949   90.340   10.521   47.086   3.6631   46.703   2.7761 0.3828545 4.596180 
1 1 1   14    8  -58 o  121.586   1.5008  604.653   14.874  592.688   22.051  614.643   20.149  120.113   2.2521  122.412   2.0192 -2.299049 3.024801 
1 1 1   14    8  -57 o   44.184   2.3901   80.471   8.5764   77.156   15.637   81.897   10.257   42.633   4.5709   44.472   2.8442 -1.839272 5.383544 
1 1 1   14    8  -56 o   92.806   1.6736  352.428   12.661  315.418   21.148  373.105   15.807   87.378   2.9734   95.400   2.0326 -8.021896 3.601785 
1 1 1   14    8  -55 o   76.732   2.0086  241.432   12.552  252.077   18.552  232.445   17.047   78.146   2.9174   75.077   2.7903 3.068375 4.037004 
1 1 1   14    8  -54 o   81.403   1.8118  271.209   12.022  256.675   18.558  281.720   15.782   78.888   2.8908   82.818   2.3400 -3.930923 3.719163 
1 1 1   14    8  -53 o  105.222   1.6963  452.810   14.549  459.441   22.272  447.874   19.216  105.749   2.5838  104.509   2.2556 1.240776 3.429809 
1 1 1   14    8  -52 o  131.512   1.8220  707.594   19.532  681.013   32.257  722.982   24.543  128.569   3.0779  132.797   2.2673 -4.227982 3.822810 
1 1 1   14    8  -51 o   61.913   2.1512  157.203   10.840  142.076   18.899  164.619   13.233   58.409   3.9935   63.276   2.5710 -4.866375 4.749524 
1 1 1   14    8  -50 o   75.753   1.8455  234.710   11.396  218.814   21.099  241.258   13.541   72.711   3.5707   76.722   2.1674 -4.010727 4.177068 
1 1 1   14    8  -49 o   13.165   4.9788   5.3280   7.3187   12.499   13.484   2.3331   8.7140   18.671   6.8146   12.694   5.2258 5.976912 8.587654 
1 1 1   14    8  -48 o   29.569   3.3035   36.429   7.8265   47.096   13.973   31.553   9.4477   33.170   5.3497   27.253   4.4028 5.917007 6.928523 
1 1 1   14    8  -47 f   40.639   2.5451   67.957   8.3887   74.303   14.956   65.044   10.133   42.115   4.4223   39.651   3.1611 2.464058 5.435964 
1 1 1   14    8  -46 o   42.121   2.5435   72.967   8.6924   64.531   15.189   77.075   10.600   39.119   4.8685   43.216   3.0281 -4.097118 5.733399 
1 1 1   14    8  -45 o   38.729   2.7823   61.828   8.7252   40.462   14.685   73.486   10.848   30.545   6.1115   42.173   3.1789 -11.62757 6.888808 
1 1 1   14    8  -44 o   23.034   5.3463   22.961   9.8443   20.248   14.191   25.477   13.668   22.008   7.0180   24.203   6.6997 -2.195698 9.702538 
1 1 1   14    8  -43 o   46.373   3.2463   88.759   12.194   79.853   15.566  102.901   19.616   43.730   4.4278   49.569   4.9196 -5.839420 6.618762 
1 1 1   14    8  -42 o   83.983   1.8118  288.144   12.403  282.123   20.749  291.491   15.472   82.861   3.0773   84.385   2.2512 -1.524414 3.812872 
1 1 1   14    8  -41 o  130.143   1.7696  691.805   18.773  763.526   34.713  662.157   22.319  136.413   3.1218  127.258   2.1515 9.154427 3.791370 
1 1 1   14    8  -40 o   59.551   2.2222  145.211   10.768  155.850   18.660  139.900   13.185   61.443   3.7435   58.374   2.7790 3.069057 4.662224 
1 1 1   14    8  -39 o   28.228   3.9816   33.428   8.9075   17.596   15.295   41.553   10.957   21.255   7.3048   31.446   4.3946 -10.19082 8.524794 
1 1 1   14    8  -38 o   55.763   2.2500  127.331   10.206  140.077   17.524  120.788   12.555   58.266   3.7088   54.231   2.8502 4.034870 4.677516 
1 1 1   14    8  -37 o   44.108   2.6476   79.903   9.4754   80.545   16.436   79.583   11.597   43.938   4.6599   43.932   3.2615 0.5668640E-02 5.687888 
1 1 1   14    8  -36 o  152.385   1.6768  947.952   20.829  923.419   33.299  963.721   26.697  150.205   2.7196  153.572   2.1326 -3.366776 3.456070 
1 1 1   14    8  -35 o  157.026   1.6573  1006.49   21.214  1005.97   33.790  1006.83   27.254  156.802   2.6437  156.975   2.1299 -0.1726074 3.394924 
1 1 1   14    8  -34 o   92.193   1.7251  346.975   12.964  362.306   21.300  337.954   16.339   94.048   2.7814   90.941   2.2041 3.106598 3.548839 
1 1 1   14    8  -33 o   43.445   3.0525   77.677   10.741   61.976   15.429   92.445   14.963   38.426   5.0477   47.279   3.9177 -8.853077 6.389622 
1 1 1   14    8  -32 o   50.349   2.5373  103.918   10.380  126.069   16.403   89.125   13.405   55.311   3.6587   46.479   3.5654 8.831539 5.108628 
1 1 1   14    8  -31 o   70.375   2.2252  202.551   12.749  181.318   22.050  213.214   15.625   66.301   4.0999   72.153   2.6612 -5.852226 4.887896 
1 1 1   14    8  -30 o   41.692   2.9530   71.494   9.9709   74.690   15.794   69.375   12.857   42.342   4.6524   40.927   3.9011 1.415737 6.071459 
1 1 1   14    8  -29 o  110.534   1.8176  498.733   16.377  502.319   32.026  497.464   19.057  110.633   3.5559  110.363   2.1184 0.2703171 4.139036 
1 1 1   14    8  -28 o   68.066   1.9771  189.324   10.958  146.142   17.768  215.831   13.921   59.585   3.6760   72.640   2.3541 -13.05529 4.365165 
1 1 1   14    8  -27 o   78.702   1.8469  252.835   11.848  239.212   19.547  260.749   14.897   76.378   3.1463   79.859   2.2909 -3.480751 3.891942 
1 1 1   14    8  -26 o   70.620   2.1401  203.855   12.305  149.937   25.432  220.336   14.061   60.072   5.2463   73.399   2.3531 -13.32789 5.749841 
1 1 1   14    8  -25 o   98.748   2.1783  398.246   17.534  385.129   38.906  401.589   19.642   96.576   4.9587   99.137   2.4306 -2.561737 5.522365 
1 1 1   14    8  -24 o  107.452   1.9308  471.327   16.912  448.168   41.011  476.072   18.564  104.239   4.8398  107.976   2.1091 -3.736839 5.279368 
1 1 1   14    8  -23 o  163.700   1.7722  1093.64   23.648  997.660   39.893  1145.64   29.364  156.136   3.1344  167.495   2.1506 -11.35971 3.801287 
1 1 1   14    8  -22 o   85.926   1.8520  301.344   12.972  310.500   23.062  297.107   15.689   87.033   3.2564   85.260   2.2594 1.772751 3.963428 
1 1 1   14    8  -21 o   78.008   1.9219  248.388   12.221  230.199   21.526  257.039   14.845   74.882   3.5366   79.296   2.2991 -4.414253 4.218264 
1 1 1   14    8  -20 o   72.542   1.9387  214.957   11.454  194.080   18.946  226.983   14.379   68.765   3.3904   74.505   2.3707 -5.739883 4.137043 
1 1 1   14    8  -19 o   20.368   5.2864   17.729   8.8523   23.697   15.069   14.584   10.939   23.764   7.1770   19.054   6.1699 4.710222 9.464487 
1 1 1   14    8  -18 o   80.583   1.8587  265.020   12.209  250.132   20.250  273.525   15.304   78.121   3.1866   81.805   2.2973 -3.683800 3.928344 
1 1 1   14    8  -17 o  170.811   1.7040  1190.49   23.726  1163.54   37.488  1208.50   30.644  168.721   2.7257  172.037   2.1852 -3.316193 3.493533 
1 1 1   14    8  -16 o  102.686   1.7204  430.245   14.400  443.318   24.134  423.018   17.945  104.094   2.8469  101.787   2.1628 2.307495 3.575295 
1 1 1   14    8  -15 f  149.426   1.6804  910.995   20.468  914.371   33.202  908.925   25.996  149.574   2.7232  149.207   2.1373 0.3666840 3.461780 
1 1 1   14    8  -14 o   70.791   2.3357  204.883   13.459  216.734   24.117  199.522   16.221   72.585   4.0926   69.804   2.8567 2.780998 4.991034 
1 1 1   14    8  -13 o  174.754   1.8423  1246.23   26.243  1265.32   48.214  1238.20   31.284  175.834   3.3638  174.144   2.2038 1.690063 4.021467 
1 1 1   14    8  -12 o   28.378   4.2590   33.754   9.5482   34.969   19.199   33.355   11.006   28.545   7.9552   28.073   4.9925 0.4727020 9.392035 
1 1 1   14    8  -11 o   18.069   5.7038   13.279   9.3942 -16.4628   18.412   23.746   10.923   14.140   6.5807   23.537   5.7444 -9.396939 8.735225 
1 1 1   14    8  -10 o   57.278   2.2785  134.171   10.617  139.012   18.472  131.783   12.974   58.114   3.9225   56.714   2.8151 1.399677 4.828110 
1 1 1   14    8   -9 o   71.248   1.9955  207.345   11.578  235.540   20.105  193.356   14.162   75.810   3.2611   68.754   2.5312 7.055969 4.128192 
1 1 1   14    8   -8 o   25.377   4.6449   27.258   9.2545   15.707   16.181   32.873   11.282   20.962   7.4897   27.838   5.1617 -6.876286 9.096065 
1 1 1   14    8   -7 o   61.620   2.4164  155.307   12.114  171.734   19.026  144.107   15.709   64.666   3.6239   59.264   3.2645 5.401314 4.877460 
1 1 1   14    8   -6 f   47.802   2.8790   93.734   11.166   88.588   17.039   97.607   14.783   46.234   4.5814   48.677   3.7547 -2.443214 5.923475 
1 1 1   14    8   -5 o   46.778   3.0945   89.863   11.733  102.334   19.109   82.316   14.865   49.691   4.7764   44.623   4.1337 5.068172 6.316771 
1 1 1   14    8   -4 o  118.665   1.7591  574.522   17.015  617.550   31.173  556.263   20.308  122.852   3.1154  116.735   2.1341 6.116524 3.776276 
1 1 1   14    8   -3 o  100.207   1.6850  409.658   13.764  396.834   21.372  418.745   17.992   98.520   2.6637  101.280   2.1793 -2.760078 3.441630 
1 1 1   14    8   -2 o  121.159   1.7605  598.919   17.388  622.456   25.710  579.079   23.604  123.445   2.5550  119.078   2.4318 4.366570 3.527247 
1 1 1   14    8   -1 o   91.006   1.7461  337.904   12.953  368.351   20.526  317.755   16.698   94.917   2.6555   88.186   2.3249 6.731354 3.529458 
1 1 1   14    8    0 o  145.719   1.7722  866.355   21.050  827.349   29.734  905.550   29.805  142.318   2.5630  148.906   2.4555 -6.587570 3.549467 
1 1 1   14    8    1 o   61.459   2.2634  154.421   11.320  152.843   16.645  155.778   15.440   61.030   3.3587   61.648   3.0822 -0.6174927 4.558630 
1 1 1   14    8    2 o   97.693   1.8319  389.427   14.588  356.377   20.853  421.105   20.416   93.350   2.7434  101.542   2.4665 -8.192085 3.689171 
1 1 1   14    8    3 o   15.799   5.7291   8.4988   9.5089  -8.6159   14.094   22.797   12.882   13.164   5.9900   23.171   6.5377 -10.00697 8.866884 
1 1 1   14    8    4 o  146.758   1.7672  878.758   21.141  899.946   30.672  859.582   29.179  148.434   2.5350  145.075   2.4674 3.358673 3.537556 
1 1 1   14    8    5 o  189.769   1.7319  1469.27   26.790  1492.53   41.741  1452.97   34.936  191.129   2.6792  188.644   2.2719 2.485107 3.512753 
1 1 1   14    8    6 f   38.803   3.0049   61.923   9.4305   71.807   15.439   56.040   11.911   41.570   4.6350   36.760   4.0415 4.809643 6.149580 
1 1 1   14    8    7 o  154.712   1.6435  976.474   20.727  960.957   32.036  987.646   27.182  153.376   2.5624  155.544   2.1439 -2.167969 3.340939 
1 1 1   14    8    8 o   72.633   2.1110  215.533   12.486  227.449   18.283  205.121   17.091   74.525   3.0158   70.772   2.9693 3.753334 4.232231 
1 1 1   14    8    9 o   25.453   4.9008   27.509   9.7992   17.492   14.569   35.784   13.242   21.191   7.1316   28.959   5.8120 -7.768225 9.199941 
1 1 1   14    8   10 o  119.234   1.7878  580.095   17.376  583.146   24.917  577.207   24.243  119.477   2.5584  118.873   2.5019 0.6039581 3.578411 
1 1 1   14    8   11 o  150.709   1.9515  926.992   23.974  986.307   39.636  892.771   30.106  155.291   3.1311  147.837   2.4982 7.453247 4.005631 
1 1 1   14    8   12 o   86.583   1.7783  305.891   12.551  310.382   20.127  303.034   16.054   87.094   2.8389   86.115   2.2890 0.9783783 3.646755 
1 1 1   14    8   13 o   10.353   4.7650  -7.0435   9.2618  -5.1168   18.795  -7.6614   10.644   16.366   7.2178   11.188   5.1341 5.178200 8.857521 
1 1 1   14    8   14 o   66.105   2.1962  178.620   11.818  180.457   22.841  177.948   13.810   66.185   4.2563   65.945   2.5741 0.2394638 4.974143 
1 1 1   14    8   15 f   86.705   2.0952  306.909   14.808  315.587   25.364  302.421   18.239   87.716   3.5546   85.991   2.6051 1.725281 4.407022 
1 1 1   14    8   16 o  125.836   1.9346  646.300   19.844  669.761   33.469  633.582   24.642  127.901   3.2128  124.541   2.4274 3.359451 4.026641 
1 1 1   14    8   17 o  142.867   1.9286  833.086   22.460  817.705   29.708  853.607   34.315  141.463   2.5763  144.484   2.9136 -3.020920 3.889291 
1 1 1   14    8   18 o   74.324   2.0409  225.679   12.353  225.346   18.426  225.951   16.648   74.160   3.0546   74.297   2.7537 -0.1364517 4.112592 
1 1 1   14    8   19 o   53.909   2.4959  118.993   10.938  123.791   16.662  115.359   14.500   54.833   3.7503   52.976   3.3754 1.857201 5.045600 
1 1 1   14    8   20 o   31.461   3.9256   41.206   9.8489   35.929   15.207   45.019   12.926   28.880   6.6037   32.707   5.0075 -3.826715 8.287605 
1 1 1   14    8   21 o  150.800   1.7839  928.046   21.929  931.620   31.864  924.831   30.226  150.983   2.5890  150.451   2.4646 0.5320435 3.574529 
1 1 1   14    8   22 o  177.663   1.8439  1288.27   26.704  1300.71   38.707  1276.97   36.889  178.384   2.6620  176.768   2.5601 1.615723 3.693257 
1 1 1   14    8   23 o  149.441   1.7875  911.431   21.775  889.195   31.424  931.970   30.201  147.495   2.6137  151.027   2.4532 -3.531448 3.584620 
1 1 1   14    8   24 o  147.071   1.7792  882.751   21.329  890.729   31.168  875.724   29.252  147.624   2.5901  146.396   2.4512 1.227112 3.566127 
1 1 1   14    8   25 o  211.471   2.1422  1826.25   36.926  1872.58   60.497  1798.74   46.618  213.794   3.4714  209.744   2.7266 4.050278 4.414187 
1 1 1   14    8   26 o   34.867   3.8607   50.471   10.789   62.753   19.719   45.222   12.890   38.376   6.5378   32.773   4.9816 5.603214 8.219480 
1 1 1   14    8   27 o  146.032   1.9307  870.607   22.982  925.459   52.752  857.757   25.533  150.002   4.3187  144.919   2.1614 5.083099 4.829421 
1 1 1   14    8   28 o  103.591   2.1589  438.306   18.230  486.668   38.601  424.423   20.682  108.715   4.3648  101.901   2.4899 6.812965 5.024999 
1 1 1   14    8   29 o  128.117   1.7465  669.945   18.240  678.292   32.402  666.073   22.068  128.717   3.0882  127.703   2.1199 1.014320 3.745794 
1 1 1   14    8   30 o   46.069   2.7048   87.101   10.113   80.941   18.252   89.830   12.148   43.988   5.1900   46.723   3.2090 -2.735409 6.101946 
1 1 1   14    8   31 o   89.682   2.0214  328.469   14.777  349.119   24.567  316.761   18.498   92.251   3.2721   87.976   2.5822 4.275146 4.168296 
1 1 1   14    8   32 o   75.129   2.0640  230.719   12.628  238.148   19.145  224.997   16.802   76.195   3.0888   74.102   2.7866 2.092331 4.160045 
1 1 1   14    8   33 o  154.215   2.1512  971.635   27.043  938.504   54.176  982.630   31.209  150.921   4.4084  155.026   2.4697 -4.104355 5.053059 
1 1 1   14    8   34 o   28.083   4.1807   33.132   9.2790   27.461   16.726   35.653   11.152   25.370   7.5382   29.009   4.8899 -3.639614 8.985343 
1 1 1   14    8   35 o   94.621   1.8343  365.583   14.148  353.141   25.242  371.282   17.083   92.738   3.3446   95.317   2.1987 -2.579071 4.002578 
1 1 1   14    8   36 o   72.047   2.3509  212.449   13.788  242.419   22.400  194.167   17.495   76.760   3.5900   68.760   3.1296 7.999313 4.762594 
1 1 1   14    8   37 o   46.637   2.8399   89.392   10.745   93.097   20.175   87.925   12.695   47.112   5.3480   46.167   3.3971 0.9440575 6.335764 
1 1 1   14    8   38 o   24.427   5.1750   25.619   9.9832   51.230   19.444   16.451   11.634   34.320   7.1814   19.988   6.3521 14.33179 9.587534 
1 1 1   14    8   39 o  118.179   1.8261  570.435   17.592  628.141   32.271  546.037   20.984  123.701   3.2031  115.564   2.2275 8.136299 3.901468 
1 1 1   14    8   40 o   12.024   5.2712  -2.1752   9.8879  -7.5066   18.674  -0.0980   11.656   15.712   7.0449   13.714   5.8667 1.997622 9.167767 
1 1 1   14    8   41 o   34.966   3.7444   50.868   10.506  105.889   20.802   32.027   12.173   50.265   5.1496   27.251   5.6651 23.01449 7.655811 
1 1 1   14    8   42 o   33.510   3.9022   46.870   10.460   47.231   20.442   46.742   12.174   32.716   7.7795   33.312   4.6067 -0.5957565 9.041163 
1 1 1   14    8   43 o   62.292   2.2764  158.975   11.539  180.071   21.705  150.664   13.624   65.943   4.0576   60.564   2.7670 5.379169 4.911255 
1 1 1   14    8   44 o  110.307   1.7953  497.167   16.142  525.615   29.664  485.199   19.241  113.060   3.2220  108.909   2.1673 4.151131 3.883113 
1 1 1   14    8   45 o   84.875   1.9164  294.481   13.259  300.772   24.395  291.844   15.795   85.408   3.5115   84.408   2.2978 0.9997406 4.196500 
1 1 1   14    8   46 o   74.212   1.9787  225.372   11.959  219.244   21.920  227.968   14.270   72.831   3.7044   74.578   2.3503 -1.746574 4.387085 
1 1 1   14    8   47 f   47.611   2.5186   93.163   9.7398   76.360   17.285  100.980   11.790   42.519   5.0881   49.502   2.9349 -6.983082 5.873881 
1 1 1   14    8   48 o   33.390   3.3648   46.366   9.0336   51.656   16.703   44.179   10.740   34.530   6.1603   32.412   4.1607 2.118092 7.433760 
1 1 1   14    8   49 o   34.616   4.0567   50.266   11.230   66.787   16.533   36.117   15.301   39.634   5.2462   28.610   6.6823 11.02424 8.495641 
1 1 1   14    8   50 o   28.103   5.4527   34.212   12.040   37.105   20.931   32.781   14.719   28.776   8.4020   27.222   6.6834 1.553507 10.73595 
1 1 1   14    8   51 o   21.206   6.1796   19.512   11.333   19.362   17.666   19.617   14.773   22.155   7.8350   21.688   7.1789 0.4669724 10.62659 
1 1 1   14    8   52 o   28.093   4.2057   33.492   9.3354   32.396   17.783   33.908   10.968   26.911   7.7108   28.065   4.9766 -1.154140 9.177278 
1 1 1   14    8   53 o   39.788   2.6655   65.356   8.5952   79.110   15.159   58.839   10.435   43.366   4.3470   37.578   3.4448 5.787682 5.546449 
1 1 1   14    8   54 o   54.641   2.1674  122.605   9.6348  127.852   16.584  119.931   11.838   55.412   3.6925   53.930   2.7014 1.482849 4.575173 
1 1 1   14    8   55 o   79.273   1.7874  257.223   11.550  254.090   19.251  258.986   14.437   78.423   3.0170   79.418   2.2323 -0.9947891 3.753047 
1 1 1   14    8   56 o   46.603   2.4146   89.480   9.1413  108.893   16.335   80.628   11.030   50.983   3.9617   44.077   3.0895 6.905392 5.023983 
1 1 1   14    8   57 o   59.735   2.2458  146.721   10.916  142.831   17.463  149.216   13.985   58.505   3.6804   60.077   2.8640 -1.572044 4.663472 
1 1 1   14    8   58 o   56.995   2.1230  133.514   9.8461  116.060   16.945  142.410   12.098   52.574   3.9836   58.764   2.5316 -6.189747 4.719937 
1 1 1   14    8   59 o   62.292   2.0060  159.366   10.173  170.517   17.859  154.011   12.377   63.971   3.4374   61.109   2.4899 2.862301 4.244458 
1 1 1   14    8   60 o   38.629   2.7921   61.952   8.7324   73.063   16.123   57.339   10.388   41.236   4.8917   36.963   3.4890 4.272320 6.008479 
1 1 1   14    8   61 o   18.492   5.0329   15.073   7.7877   25.579   14.755   11.016   9.1688   23.704   7.0892   16.487   5.6560 7.216749 9.069030 
1 1 1   14    8   62 o   35.493   2.9352   52.533   8.4163   41.790   15.284   57.208   10.083   30.374   6.3763   36.914   3.3887 -6.539196 7.220776 
1 1 1   14    8   63 o   30.382   3.3249   38.884   8.1001   30.059   14.550   42.848   9.7508   25.517   6.8516   31.743   3.8467 -6.226601 7.857607 
1 1 1   14    8   64 o   58.115   2.3875  139.524   11.286  109.726   16.427  166.160   15.531   50.901   3.9911   63.178   3.0246 -12.27636 5.007693 
1 1 1   14    8   65 o   57.034   2.4822  134.616   11.512  135.532   16.705  133.788   15.888   56.744   3.6305   56.454   3.4693 0.2900925 5.021586 
1 1 1   14    8   66 o   27.379   4.3149   32.525   9.3115   20.830   13.874   42.110   12.561   21.449   6.9487   30.861   5.1762 -9.412493 8.664738 
1 1 1   14    8   67 o   39.448   3.3913   65.619   10.799   87.106   19.435   56.021   12.989   44.386   5.4886   35.955   4.5323 8.430168 7.117993 
1 1 1   14    8   68 o   25.193   4.5172   27.889   8.9357   42.533   18.230   23.258   10.252   29.724   7.5196   22.597   5.5954 7.127575 9.373026 
1 1 1   14    8   69 o   28.426   3.9827   34.869   8.9757   50.489   18.218   29.862   10.314   32.661   7.0496   25.835   5.0789 6.825779 8.688663 
1 1 1   14    8   70 o   25.566   4.0814   28.434   8.2200   50.480   14.217   17.363   10.075   33.578   5.3754   19.529   5.8618 14.04884 7.953332 
1 1 1   14    8   71 f   39.776   3.0270   66.495   9.7409   70.760   19.047   64.984   11.335   39.311   6.1452   39.078   3.5989 0.2331886 7.121453 
1 1 1   14    8   72 o   8.6214   4.0890  -8.5149   7.7210 -23.0746   13.687  -1.7197   9.3507   10.170   4.9722   11.450   5.0684 -1.280187 7.100087 
1 1 1   14    8   73 o   13.921   5.2349   6.9238   8.0651   11.836   14.323   4.6434   9.7593   17.835   6.9094   13.721   5.5753 4.114398 8.878327 
1 1 1   14    8   74 o   26.872   3.9678   31.420   8.4301   15.999   14.301   39.632   10.436   19.231   7.0183   30.040   4.3917 -10.80832 8.279078 
1 1 1   14    8   75 o   48.587   2.4398   98.303   9.6322   81.236   15.880  108.237   12.115   43.000   4.6020   50.748   2.9413 -7.748444 5.461662 
1 1 1   14    8   76 o   20.147   5.9099   19.022   10.335   15.119   11.711   32.776   21.982   18.385   6.3883   25.100   8.7506 -6.715260 10.83433 
1 1 1   14    8   77 o   42.427   3.0003   76.057   10.310   78.703   12.827   71.227   17.328   42.766   3.7162   39.446   5.5417 3.320465 6.672423 
1 1 1   14    8   78 f   22.386   4.2334   22.383   7.4421   42.681   12.065   9.9179   9.4549   30.662   4.9994   15.568   5.7025 15.09375 7.583748 
1 1 1   14    8   79 o   11.573   4.7075   3.2128   6.9661   13.192   11.419  -2.7019   8.7914   17.323   6.2788   10.673   4.8055 6.650673 7.906769 
1 1 1   14    8   80 o   20.685   4.5553   19.567   7.4727   23.007   13.545   18.062   8.9596   21.444   6.8584   19.528   5.4315 1.915550 8.748693 
1 1 1   14    8   81 o   32.602   2.9491   45.323   7.7528   28.104   13.842   53.193   9.3583   23.465   6.8272   35.147   3.3052 -11.68238 7.585218 
1 1 1   14    8   82 o   18.251   4.6139   15.475   6.8666   8.5744   13.059   18.112   8.0728   15.788   6.4366   19.579   5.0313 -3.790694 8.169700 
1 1 1   14    8   83 f   33.218   2.8105   47.036   7.5389   30.713   13.397   54.600   9.1199   24.463   6.5770   35.596   3.1764 -11.13247 7.303867 
1 1 1   14    8   84 o   15.177   6.1221   8.3562   11.670   8.0991   13.806   8.9997   21.842   15.687   6.5286   17.747   7.8056 -2.060764 10.17598 
1 1 1   14    8   85 o   17.341   6.4638   14.243   12.240   18.930   14.485   2.5359   22.892   19.214   7.0550   16.710   7.6151 2.504932 10.38084 
1 1 1   14    8   86 o   26.536   5.9708   35.520   12.602   31.543   14.794   46.040   24.061   23.964   7.0816   26.392   9.1577 -2.428062 11.57640 
1 1 1   14    8   87 o   12.233   5.6726  -5.0534   13.493  -5.0534   13.493   0.0000   0.0000   12.233   5.6726  ?   ?  0.000000 5.672552 
1 1 1   14    8   88 o   17.990   6.2150   16.734   11.077   5.2798   12.424   61.148   24.464   14.114   6.0476   30.215   9.1488 -16.10081 10.96695 
1 1 1   14    8   89 o   41.496   3.6796   76.936   12.317   79.025   13.988   69.725   25.992   41.534   4.1887   31.895   9.3765 9.638517 10.26961 
1 1 1   14    8   90 o   16.636   6.1556   13.834   11.063   15.023   12.468   9.4317   23.993   17.168   6.4970   17.269   7.8411 -0.1011791 10.18305 
1 1 1   14    8   91 o   16.337   6.1184   13.200   10.993   17.243   12.397  -1.6821   23.786   17.972   6.5379   15.580   7.3243 2.391853 9.817878 
1 1 1   14    8   92 o   14.172   6.0477   6.2124   12.333   6.2124   12.333   0.0000   0.0000   14.172   6.0477  ?   ?  0.000000 6.047676 
1 1 1   14    8   93 o   12.337   5.5896  -0.5508   12.115  -0.5508   12.115   0.0000   0.0000   12.337   5.5896  ?   ?  0.000000 5.589640 
1 1 1   14    8   94 o   13.036   5.9660  -0.7309   14.244  -0.7309   14.244   0.0000   0.0000   13.036   5.9660  ?   ?  0.000000 5.965980 
1 1 1   14    8   95 o   27.775   6.0422   40.945   13.290   40.945   13.290   0.0000   0.0000   27.775   6.0422  ?   ?  0.000000 6.042229 
1 1 1   14    8   96 o   19.045   6.7343   20.918   13.050   20.918   13.050   0.0000   0.0000   19.045   6.7343  ?   ?  0.000000 6.734269 
1 1 1   14    8   97 o   13.061   5.8835   1.5335   13.195   1.5335   13.195   0.0000   0.0000   13.061   5.8835  ?   ?  0.000000 5.883514 
1 1 1   14    8   98 o   14.788   6.2683   8.7081   13.095   19.680   15.899 -14.4311   23.089   18.215   7.2130   13.551   6.5880 4.664174 9.768813 
1 1 1   14    8   99 o   20.876   6.7778   25.902   13.196   30.291   16.311   17.586   22.450   21.617   7.5376   17.745   7.8543 3.872242 10.88596 
1 1 1   14    8  100 o   10.456   5.0146 -10.0954   12.302  -5.8167   14.877 -19.3476   21.877   12.157   5.7390   12.685   6.2196 -0.5281086 8.462870 
1 1 1   14    8  101 f   18.213   6.6708   19.531   12.938   16.324   15.631   26.511   23.057   17.038   7.0050   19.266   8.2466 -2.227476 10.82017 
1 1 1   14    8  102 o   13.101   6.0983  -1.5470   15.822  -1.5470   15.822   0.0000   0.0000   13.101   6.0983  ?   ?  0.000000 6.098260 
1 1 1   14    8  103 o   12.753   5.9629  -2.8955   15.407  -2.8955   15.407   0.0000   0.0000   12.753   5.9629  ?   ?  0.000000 5.962933 
1 1 1   14    9 -100 o   14.954   7.1252  -1.0360   23.991  -1.0360   23.991   0.0000   0.0000   14.954   7.1252  ?   ?  0.000000 7.125165 
1 1 1   14    9  -99 o   16.026   7.5038   7.3209   24.537   7.3209   24.537   0.0000   0.0000   16.026   7.5038  ?   ?  0.000000 7.503758 
1 1 1   14    9  -98 o   21.386   6.8786   28.113   13.611   28.113   13.611   0.0000   0.0000   21.386   6.8786  ?   ?  0.000000 6.878606 
1 1 1   14    9  -97 o   28.650   6.1094   44.911   13.832   44.911   13.832   0.0000   0.0000   28.650   6.1094  ?   ?  0.000000 6.109448 
1 1 1   14    9  -96 o   19.301   6.8123   22.478   13.350   22.478   13.350   0.0000   0.0000   19.301   6.8123  ?   ?  0.000000 6.812304 
1 1 1   14    9  -95 o   17.095   6.7287   16.315   13.760   16.315   13.760   0.0000   0.0000   17.095   6.7287  ?   ?  0.000000 6.728702 
1 1 1   14    9  -94 o   19.385   6.9096   22.599   13.763   22.599   13.763   0.0000   0.0000   19.385   6.9096  ?   ?  0.000000 6.909556 
1 1 1   14    9  -93 o   21.161   6.9213   26.848   13.747   26.848   13.747   0.0000   0.0000   21.161   6.9213  ?   ?  0.000000 6.921314 
1 1 1   14    9  -92 o   10.656   5.1111 -10.6797   12.789 -10.6797   12.789   0.0000   0.0000   10.656   5.1111  ?   ?  0.000000 5.111061 
1 1 1   14    9  -91 o   18.117   6.7375   18.549   13.285   18.549   13.285   0.0000   0.0000   18.117   6.7375  ?   ?  0.000000 6.737532 
1 1 1   14    9  -90 o   23.229   6.6094   30.630   13.111   30.630   13.111   0.0000   0.0000   23.229   6.6094  ?   ?  0.000000 6.609415 
1 1 1   14    9  -89 o   11.970   5.5475  -3.6359   12.876  -3.6359   12.876   0.0000   0.0000   11.970   5.5475  ?   ?  0.000000 5.547487 
1 1 1   14    9  -88 o   14.606   6.1676   7.6393   12.598   7.6393   12.598   0.0000   0.0000   14.606   6.1676  ?   ?  0.000000 6.167598 
1 1 1   14    9  -87 o   23.734   6.4397   30.852   12.773   30.852   12.773   0.0000   0.0000   23.734   6.4397  ?   ?  0.000000 6.439744 
1 1 1   14    9  -86 o   12.715   5.5987   2.0822   11.267   5.6641   12.286 -16.8637   28.255   14.039   6.0148   14.893   7.2513 -0.8537998 9.421164 
1 1 1   14    9  -85 o   19.175   5.8288   19.162   9.9166   11.391   12.143   34.723   17.183   15.836   6.2931   23.828   7.7343 -7.992070 9.971076 
1 1 1   14    9  -84 o   10.226   4.7443  -4.7633   9.4543  -4.0538   11.960  -5.9450   15.436   11.653   5.3815   12.737   5.9598 -1.084326 8.029962 
1 1 1   14    9  -83 o   23.873   5.2915   28.089   10.026   23.032   12.748   36.290   16.236   20.570   6.6605   25.072   7.4212 -4.501371 9.971772 
1 1 1   14    9  -82 o   11.331   4.9666   0.6062   8.7735   3.7082   11.918  -3.0635   12.963   13.608   5.8779   12.411   5.6842 1.196927 8.176816 
1 1 1   14    9  -81 o   16.572   5.6467   13.197   9.1352   13.927   12.485   12.356   13.402   17.161   6.4999   16.739   6.6243 0.4218979 9.280612 
1 1 1   14    9  -80 f   11.962   5.1274   2.0409   8.9365   3.8335   12.521   0.1798   12.758   14.014   6.0388   13.177   5.8716 0.8362932 8.422762 
1 1 1   14    9  -79 o   13.613   5.4571   6.2016   9.2109  -3.3537   13.103   15.537   12.951   12.594   5.7479   17.994   6.6598 -5.399920 8.797209 
1 1 1   14    9  -78 o   12.627   5.3733   2.7256   9.6874  -4.4956   15.097   7.7804   12.631   13.277   6.1006   15.336   6.3002 -2.059133 8.769805 
1 1 1   14    9  -77 o   28.743   4.6161   37.695   10.449   42.955   16.806   34.380   13.342   28.644   7.2055   26.246   6.3134 2.397417 9.580064 
1 1 1   14    9  -76 o   17.824   4.9502   14.848   7.4479   12.256   15.557   15.619   8.4833   17.611   7.0809   18.168   5.3610 -0.5564442 8.881412 
1 1 1   14    9  -75 o   18.557   4.9518   16.038   7.6295   8.1970   15.515   18.538   8.7621   16.551   6.9071   19.811   5.3158 -3.259880 8.715847 
1 1 1   14    9  -74 o   17.660   4.9598   14.417   7.4322   2.8559   14.940   18.220   8.5675   15.073   6.5457   19.721   5.2407 -4.647388 8.385207 
1 1 1   14    9  -73 o   36.404   2.7124   55.814   7.9911   33.158   14.116   66.499   9.6942   25.943   6.6458   39.602   3.0259 -13.65840 7.302272 
1 1 1   14    9  -72 o   17.783   4.8529   14.464   7.2295  -7.2604   13.231   23.711   8.6322   12.214   5.6476   22.833   4.7909 -10.61932 7.405933 
1 1 1   14    9  -71 o   29.528   4.0216   38.074   9.4285   39.521   13.848   36.824   12.873   28.956   6.0619   28.072   5.8169 0.8840160 8.401347 
1 1 1   14    9  -70 o   11.991   4.8325   3.5927   7.2643   0.1920   12.953   5.1531   8.7740   13.798   6.0414   13.394   5.3406 0.4034815 8.063539 
1 1 1   14    9  -69 f   33.265   2.9743   46.706   7.9801   32.393   13.468   54.450   9.9065   26.088   6.3856   35.736   3.4433 -9.648371 7.254806 
1 1 1   14    9  -68 o   10.886   4.6403   0.7833   7.2457   5.7046   12.603  -1.6463   8.8556   15.267   6.2849   11.135   4.9305 4.132330 7.988130 
1 1 1   14    9  -67 o   17.343   4.9445   13.531   7.3301   7.4932   12.493   16.700   9.0518   15.829   6.3520   19.114   5.5089 -3.285805 8.408122 
1 1 1   14    9  -66 o   11.415   4.7899   1.6580   7.5231  -1.3220   14.702   2.7152   8.7565   14.351   6.3539   12.528   5.2055 1.822950 8.213960 
1 1 1   14    9  -65 o   19.695   5.1629   17.602   8.3883   37.041   15.577   9.6638   9.9549   27.842   6.8991   15.839   5.8429 12.00291 9.040905 
1 1 1   14    9  -64 o   35.048   2.7481   51.388   7.7884   54.616   12.775   49.479   9.8257   35.390   4.5321   34.080   3.5909 1.310528 5.782249 
1 1 1   14    9  -63 o   21.067   4.4462   19.658   7.3953   13.251   12.419   23.179   9.2055   18.021   6.5455   22.686   5.1020 -4.665373 8.299037 
1 1 1   14    9  -62 o   51.387   2.0209  108.902   8.4488  108.109   13.018  109.479   11.105   50.773   3.1612   51.303   2.6646 -0.5300941 4.134428 
1 1 1   14    9  -61 o   10.632   4.6205  -0.5411   7.4559 -16.7015   12.804   7.7496   9.1711   10.589   5.0880   14.833   5.5813 -4.244142 7.552388 
1 1 1   14    9  -60 o   30.242   3.3688   38.696   8.1639   25.016   13.503   46.578   10.249   23.222   6.7391   33.027   3.8811 -9.804827 7.776821 
1 1 1   14    9  -59 o   45.967   2.3277   87.378   8.6936  104.451   13.670   75.785   11.265   49.883   3.3820   42.496   3.2772 7.386978 4.709316 
1 1 1   14    9  -58 o   57.573   2.1658  136.645   10.146   99.705   21.014  147.875   11.586   47.677   5.5083   59.825   2.3806 -12.14830 6.000667 
1 1 1   14    9  -57 f   9.8655   4.3727  -1.9059   6.9816 -23.6982   13.037   6.8572   8.2670   9.8370   4.8186   14.146   5.3041 -4.308885 7.166025 
1 1 1   14    9  -56 o   41.929   2.4142   72.717   8.2165   76.505   14.701   70.996   9.9086   42.349   4.3191   41.275   2.9648 1.074268 5.238740 
1 1 1   14    9  -55 o   18.799   4.8437   15.604   7.4686   6.9385   13.847   19.159   8.8694   16.521   6.6671   20.752   5.2423 -4.231516 8.481271 
1 1 1   14    9  -54 o   76.223   1.7617  238.141   10.946  234.847   18.276  239.983   13.668   75.241   2.9858   76.366   2.1980 -1.125526 3.707587 
1 1 1   14    9  -53 o   50.070   2.2045  103.240   8.9756  100.805   15.662  104.430   10.952   48.919   3.9615   50.234   2.6844 -1.314999 4.785370 
1 1 1   14    9  -52 o   75.841   1.7640  235.644   10.905  230.745   18.426  238.285   13.529   74.615   3.0358   76.131   2.1823 -1.516159 3.738847 
1 1 1   14    9  -51 o   55.138   2.0584  124.909   9.2351  122.527   15.839  126.136   11.367   54.162   3.6080   55.296   2.5286 -1.134052 4.405871 
1 1 1   14    9  -50 o   18.042   4.9412   14.200   7.4793   5.6806   13.641   17.862   8.9434   16.192   6.5872   20.145   5.3548 -3.952719 8.489105 
1 1 1   14    9  -49 o   61.446   2.4320  155.438   12.158  153.073   16.353  158.359   18.178   60.717   3.3167   61.647   3.6336 -0.9298630 4.919690 
1 1 1   14    9  -48 o   68.431   2.1245  192.231   11.837  214.301   17.247  172.581   16.274   72.023   2.9439   64.572   3.1009 7.451065 4.275746 
1 1 1   14    9  -47 o   94.929   1.8715  368.991   14.482  360.901   20.850  376.532   20.129   93.599   2.7357   95.661   2.5838 -2.061768 3.762988 
1 1 1   14    9  -46 o   58.668   2.0220  141.171   9.6555  142.775   16.459  140.328   11.923   58.649   3.4581   58.393   2.5107 0.2560272 4.273389 
1 1 1   14    9  -45 o   45.761   2.5480   86.274   9.4672  110.769   18.699   77.830   10.978   51.325   4.5154   43.336   3.1288 7.988190 5.493488 
1 1 1   14    9  -44 o   47.979   2.6131   94.832   10.181   97.891   19.144   93.626   12.022   48.102   4.9531   47.565   3.1180 0.5375595 5.852768 
1 1 1   14    9  -43 o   30.611   3.8011   39.360   9.2809   50.015   17.880   35.431   10.858   33.667   6.7503   28.764   4.8000 4.902590 8.282900 
1 1 1   14    9  -42 o   50.714   2.6101  105.850   10.754  112.468   16.139  100.565   14.421   51.994   3.8349   49.207   3.6207 2.787601 5.274106 
1 1 1   14    9  -41 o   9.6600   4.4534  -6.1301   8.1394   0.0523   13.918  -9.3437   10.034   14.887   6.3903   10.314   4.8193 4.572982 8.003903 
1 1 1   14    9  -40 o   40.716   2.6536   68.311   8.7594   62.354   15.088   71.340   10.758   38.372   4.9380   41.512   3.2040 -3.140232 5.886420 
1 1 1   14    9  -39 o  101.060   1.6585  417.322   13.663  387.264   21.960  436.304   17.452   97.091   2.7776  103.259   2.0734 -6.167900 3.466100 
1 1 1   14    9  -38 o  109.988   1.7645  494.427   15.820  470.603   23.844  513.160   21.144  107.064   2.7344  111.940   2.3172 -4.876328 3.584162 
1 1 1   14    9  -37 o   61.855   2.0547  156.674   10.345  165.604   17.711  152.050   12.746   63.330   3.4438   60.852   2.5753 2.478348 4.300269 
1 1 1   14    9  -36 o   42.797   2.6504   75.368   9.2008  111.538   16.281   58.397   11.152   51.849   3.8804   37.464   3.7002 14.38574 5.361788 
1 1 1   14    9  -35 o   38.638   2.8984   61.596   9.0621   79.370   16.214   53.522   10.928   43.519   4.6422   35.836   3.7989 7.682537 5.998464 
1 1 1   14    9  -34 o   50.706   2.5790  105.602   10.624  110.061   20.805  104.028   12.357   51.225   5.0479   50.252   3.0308 0.9732895 5.887928 
1 1 1   14    9  -33 o  126.763   1.6975  656.355   17.541  631.500   28.150  672.131   22.427  124.112   2.7825  128.194   2.1462 -4.081833 3.514000 
1 1 1   14    9  -32 o  107.437   1.7709  471.533   15.509  449.599   25.254  484.814   19.651  104.651   2.9633  108.869   2.2143 -4.217842 3.699254 
1 1 1   14    9  -31 o   94.944   1.9990  368.445   15.471  348.957   31.155  374.824   17.824   91.872   4.1711   95.721   2.2843 -3.848419 4.755618 
1 1 1   14    9  -30 o   67.066   2.7242  184.556   14.862  190.018   26.661  182.094   17.901   67.563   4.8737   66.510   3.3124 1.052841 5.892766 
1 1 1   14    9  -29 o   37.784   3.6232   59.218   11.023   74.508   24.101   55.174   12.395   41.443   7.4060   36.333   4.2664 5.109962 8.546980 
1 1 1   14    9  -28 o   41.787   3.2172   72.061   10.874   81.586   17.097   65.590   14.092   44.157   4.8285   39.625   4.4389 4.531914 6.558814 
1 1 1   14    9  -27 o  107.885   1.7500  475.296   15.390  470.569   25.020  478.172   19.519  107.135   2.8675  108.148   2.2141 -1.012810 3.622850 
1 1 1   14    9  -26 o   61.242   2.4567  153.674   12.239  144.469   18.798  160.446   16.125   59.131   3.9221   62.470   3.1770 -3.338207 5.047416 
1 1 1   14    9  -25 o   88.254   2.2474  318.620   16.155  293.171   29.379  329.650   19.341   84.242   4.2924   89.707   2.6479 -5.465050 5.043437 
1 1 1   14    9  -24 o   67.806   2.2857  188.172   12.615  206.507   19.396  174.730   16.608   70.868   3.3673   65.215   3.1333 5.653076 4.599586 
1 1 1   14    9  -23 o  138.205   1.8296  779.993   20.612  764.471   30.330  793.316   28.098  136.664   2.7226  139.270   2.4751 -2.605698 3.679450 
1 1 1   14    9  -22 o   45.885   2.6938   86.455   10.031   99.436   16.951   79.458   12.444   48.958   4.2908   43.864   3.5095 5.093849 5.543254 
1 1 1   14    9  -21 o   71.160   1.9626  206.983   11.374  204.766   18.856  208.251   14.260   70.594   3.2858   71.320   2.4564 -0.7256012 4.102520 
1 1 1   14    9  -20 o   32.437   3.5814   43.695   9.3120   46.031   15.489   42.372   11.653   32.798   6.0149   31.736   4.6420 1.062878 7.597818 
1 1 1   14    9  -19 o  117.621   1.6777  564.711   16.085  578.473   26.202  556.387   20.377  118.903   2.7034  116.695   2.1421 2.207367 3.449210 
1 1 1   14    9  -18 o   27.989   4.1047   32.875   9.0868   27.256   15.230   35.981   11.323   25.180   7.1098   29.138   4.9437 -3.958244 8.659630 
1 1 1   14    9  -17 o   85.606   1.8220  299.198   12.714  278.339   20.536  312.163   16.190   82.383   3.0634   87.370   2.2752 -4.986794 3.815921 
1 1 1   14    9  -16 o   72.442   1.9571  214.459   11.546  238.044   19.454  201.633   14.346   76.168   3.1400   70.178   2.5119 5.989479 4.021088 
1 1 1   14    9  -15 o  125.426   1.6752  642.087   17.128  623.458   27.574  653.791   21.855  123.447   2.7402  126.510   2.1193 -3.063278 3.464120 
1 1 1   14    9  -14 o  116.904   2.0621  558.187   19.650  547.107   26.060  572.788   29.916  115.640   2.7646  118.224   3.1070 -2.583900 4.158895 
1 1 1   14    9  -13 o   38.380   3.8679   61.078   11.936   57.712   15.993   65.310   17.933   36.978   5.4708   39.314   5.7674 -2.335896 7.949323 
1 1 1   14    9  -12 o   15.891   6.1461   6.8659   11.319   3.7067   15.323   10.661   16.794   16.750   6.9161   19.418   7.4926 -2.667465 10.19661 
1 1 1   14    9  -11 o  184.505   2.2861  1390.96   34.382  1396.62   48.490  1385.24   48.759  184.652   3.2215  183.889   3.2529 0.7628937 4.578118 
1 1 1   14    9  -10 o   44.096   3.1346   80.018   11.194   83.447   18.200   77.933   14.196   44.696   5.0858   43.372   4.0627 1.324081 6.509274 
1 1 1   14    9   -9 o  103.293   1.9696  435.659   16.584  433.781   26.660  436.844   21.180  102.869   3.1831  103.374   2.5136 -0.5043030 4.055896 
1 1 1   14    9   -8 o   51.083   2.7561  107.043   11.434  127.616   24.388  101.247   12.945   55.307   5.4817   49.618   3.2179 5.689587 6.356400 
1 1 1   14    9   -7 o   55.821   2.5437  127.645   11.544  151.180   25.609  121.643   12.933   60.294   5.2633   54.445   2.9248 5.849007 6.021389 
1 1 1   14    9   -6 o   70.531   2.2260  203.420   12.782  198.523   27.066  204.826   14.501   69.254   4.8247   70.742   2.5187 -1.487389 5.442544 
1 1 1   14    9   -5 o   12.615   5.4646  -1.3140   10.359  -5.7701   20.093   0.2993   12.090   16.804   7.4345   14.126   6.0067 2.677644 9.557805 
1 1 1   14    9   -4 o   56.653   2.3727  131.381   10.933  142.539   19.597  126.339   13.174   58.767   4.1168   55.490   2.9228 3.277195 5.048874 
1 1 1   14    9   -3 o   92.669   1.8500  350.560   13.975  334.335   24.713  358.188   16.944   90.274   3.3642   93.640   2.2198 -3.365593 4.030581 
1 1 1   14    9   -2 o   26.368   4.6355   29.434   9.5998   65.838   17.915   14.771   11.370   39.504   5.7304   19.220   6.2949 20.28409 8.512570 
1 1 1   14    9   -1 o   65.942   2.1805  177.807   11.705  157.676   20.523  187.511   14.249   61.829   4.0952   67.675   2.5877 -5.846413 4.844265 
1 1 1   14    9    0 o  155.568   1.7836  987.823   22.618  968.659   39.455  997.204   27.603  153.815   3.1468  156.251   2.1672 -2.435562 3.820889 
1 1 1   14    9    1 o   89.281   1.8833  325.407   13.706  336.436   24.366  320.302   16.577   90.569   3.3060   88.513   2.2995 2.056061 4.027038 
1 1 1   14    9    2 o  134.064   1.7607  733.580   19.242  699.769   33.439  750.317   23.527  130.736   3.1378  135.540   2.1294 -4.804184 3.792147 
1 1 1   14    9    3 o   23.933   5.0719   24.496   9.5870   48.782   17.934   14.780   11.344   33.672   6.7689   19.218   6.2874 14.45423 9.238440 
1 1 1   14    9    4 o  116.204   1.6508  551.053   15.637  537.260   24.234  560.892   20.468  114.635   2.5935  117.186   2.1427 -2.551659 3.364129 
1 1 1   14    9    5 o   57.272   2.2540  134.208   10.502  126.827   16.632  139.103   13.544   55.487   3.6983   58.241   2.8616 -2.753860 4.676109 
1 1 1   14    9    6 o   29.458   3.8992   36.226   9.1334   29.999   14.655   40.180   11.679   26.356   6.7822   30.881   4.7950 -4.524952 8.306054 
1 1 1   14    9    7 o   85.010   1.9520  295.070   13.527  311.819   25.373  288.420   15.988   87.134   3.5799   83.982   2.3378 3.152130 4.275644 
1 1 1   14    9    8 o   51.026   2.5863  106.722   10.722  117.555   20.921  102.863   12.487   53.192   4.8794   50.033   3.0766 3.159649 5.768317 
1 1 1   14    9    9 o   61.342   2.3003  153.962   11.482  143.461   21.748  158.020   13.519   58.866   4.5679   62.104   2.6769 -3.237576 5.294475 
1 1 1   14    9   10 o   18.275   5.4043   14.012   8.6132   2.1200   14.227   20.893   10.822   15.779   6.6018   22.076   5.9006 -6.296526 8.854407 
1 1 1   14    9   11 o   33.345   3.3674   46.019   9.0276   62.858   14.856   36.160   11.367   38.771   4.8031   29.226   4.9479 9.545389 6.895802 
1 1 1   14    9   12 o   37.827   3.2027   59.022   9.7828   62.201   17.877   57.664   11.688   38.318   5.9137   37.277   3.9044 1.040878 7.086308 
1 1 1   14    9   13 o   15.100   5.4811   7.8012   8.7060   6.4476   14.606   8.5472   10.843   17.230   6.8838   16.337   6.0847 0.8927288 9.187519 
1 1 1   14    9   14 o  157.661   1.8117  1014.76   23.284  979.347   32.808  1050.69   33.049  154.752   2.6008  160.304   2.5292 -5.552582 3.627798 
1 1 1   14    9   15 o  185.189   2.0536  1400.73   31.001  1438.62   50.154  1377.31   39.437  187.367   3.2838  183.508   2.6364 3.859192 4.211167 
1 1 1   14    9   16 o   37.576   3.7607   58.527   11.364   84.544   19.282   44.681   14.067   44.910   5.3738   32.429   5.5189 12.48104 7.702987 
1 1 1   14    9   17 o   39.074   3.6524   63.192   11.499   61.355   18.909   64.270   14.484   37.927   6.3399   39.233   4.6174 -1.305725 7.843132 
1 1 1   14    9   18 o   71.281   2.2642  207.853   13.139  207.934   21.979  207.808   16.391   71.057   3.8085   71.200   2.8297 -0.1429443 4.744729 
1 1 1   14    9   19 o   80.246   1.8591  262.942   12.161  239.258   19.138  278.979   15.749   76.363   3.0809   82.580   2.3419 -6.216652 3.869932 
1 1 1   14    9   20 o  168.084   1.6866  1153.26   23.108  1091.49   35.020  1200.90   30.753  163.340   2.6302  171.427   2.2008 -8.087509 3.429483 
1 1 1   14    9   21 o  157.297   1.6706  1009.99   21.420  1034.30   33.521  993.222   27.847  159.007   2.5862  155.899   2.1913 3.108261 3.389710 
1 1 1   14    9   22 o   71.496   1.9961  208.965   11.622  234.792   18.713  192.748   14.828   75.642   3.0411   68.582   2.6574 7.060745 4.038579 
1 1 1   14    9   23 o  100.444   1.7224  411.903   14.103  399.450   22.136  420.411   18.297   98.746   2.7527  101.420   2.2132 -2.674294 3.532079 
1 1 1   14    9   24 o   53.066   2.4492  115.417   10.566  134.236   17.374  104.372   13.310   57.034   3.7580   50.345   3.2607 6.688995 4.975460 
1 1 1   14    9   25 o   52.503   2.6936  113.130   11.489  130.916   17.609   99.946   15.161   56.295   3.8607   49.162   3.8129 7.132996 5.426179 
1 1 1   14    9   26 o   96.642   1.9372  381.543   15.261  401.264   22.747  365.401   20.580   98.941   2.8233   94.440   2.6760 4.501038 3.890000 
1 1 1   14    9   27 o  109.840   2.0217  492.995   18.101  519.171   29.606  477.369   22.875  112.447   3.2333  107.994   2.5985 4.452972 4.148063 
1 1 1   14    9   28 o   97.196   1.8023  385.853   14.279  379.820   22.805  389.743   18.313   96.227   2.9107   97.620   2.3014 -1.392883 3.710632 
1 1 1   14    9   29 o   62.469   2.2996  159.824   11.690  154.451   19.359  162.908   14.665   61.127   3.9056   62.986   2.8639 -1.858135 4.843104 
1 1 1   14    9   30 o   61.254   2.3264  153.710   11.595  125.382   19.047  170.389   14.615   54.957   4.2856   64.425   2.7895 -9.468124 5.113495 
1 1 1   14    9   31 o   44.005   3.1987   79.907   11.395  111.745   18.534   60.557   14.449   51.820   4.4302   37.956   4.7755 13.86390 6.514018 
1 1 1   14    9   32 o   21.357   5.9836   19.629   10.831   22.636   16.726   17.457   14.213   23.380   7.6336   20.901   7.0441 2.479404 10.38709 
1 1 1   14    9   33 o   34.780   3.5354   50.266   9.8841   53.886   18.560   48.833   11.678   35.232   6.7074   34.120   4.2935 1.112064 7.963889 
1 1 1   14    9   34 o   78.578   2.0023  252.606   12.815  261.551   23.380  248.766   15.321   79.624   3.6116   77.911   2.4153 1.712616 4.344826 
1 1 1   14    9   35 o   66.871   2.1721  183.138   11.824  174.615   21.430  186.869   14.177   64.899   4.0713   67.482   2.5821 -2.583061 4.821078 
1 1 1   14    9   36 o   72.426   2.1088  214.767   12.437  210.986   23.893  216.173   14.566   71.331   4.1268   72.603   2.4647 -1.272659 4.806806 
1 1 1   14    9   37 o   65.832   2.3175  177.669   12.417  170.626   20.557  181.714   15.580   64.157   3.9500   66.473   2.8822 -2.316544 4.889732 
1 1 1   14    9   38 o   30.289   4.0424   38.574   9.7318   57.529   16.921   29.205   11.896   36.597   5.8705   25.902   5.7810 10.69489 8.239107 
1 1 1   14    9   39 o   64.670   2.2736  171.482   11.967  166.389   19.979  174.332   14.944   63.337   3.8885   65.101   2.8228 -1.764095 4.805076 
1 1 1   14    9   40 o   63.473   2.2949  165.250   11.854  183.313   20.082  155.591   14.686   66.522   3.7182   61.461   2.9398 5.060741 4.739986 
1 1 1   14    9   41 o   11.802   5.2151  -2.6771   9.8579  -4.3123   15.287  -1.5131   12.898   14.547   6.4577   13.939   6.0672 0.6081600 8.860779 
1 1 1   14    9   42 o  122.662   2.0821  616.041   20.818  593.353   30.249  636.457   28.695  120.014   3.0946  124.439   2.8289 -4.424950 4.192772 
1 1 1   14    9   43 o   81.050   2.2709  269.468   14.988  240.216   21.677  296.262   20.747   76.182   3.5001   84.785   3.0066 -8.603500 4.614159 
1 1 1   14    9   44 o   58.758   2.9390  142.456   14.032  154.038   25.457  137.402   16.817   60.332   5.2279   57.526   3.6045 2.805412 6.350072 
1 1 1   14    9   45 o   19.686   5.8919   16.703   10.189   11.501   19.945   18.541   11.853   20.307   8.0668   20.752   6.3848 -0.4451141 10.28780 
1 1 1   14    9   46 o   95.555   2.1648  374.342   16.862  402.501   35.211  365.962   19.208   98.086   4.4151   94.355   2.4996 3.731567 5.073575 
1 1 1   14    9   47 o   80.426   2.0570  265.276   13.474  241.972   21.731  279.833   17.175   76.358   3.5006   82.465   2.5580 -6.107048 4.335607 
1 1 1   14    9   48 o   52.954   2.4502  115.479   10.548  113.748   16.382  116.705   13.786   52.153   3.8814   53.043   3.2032 -0.8902435 5.032488 
1 1 1   14    9   49 o  109.935   1.8106  494.912   16.225  480.525   24.318  506.457   21.783  107.952   2.7658  111.009   2.4073 -3.056854 3.666674 
1 1 1   14    9   50 o   39.542   3.0431   64.981   9.7333   75.191   15.431   58.236   12.543   42.070   4.5733   37.085   4.2244 4.985123 6.225871 
1 1 1   14    9   51 o   26.190   4.3754   29.502   9.0117   40.269   14.193   22.230   11.665   30.130   5.9897   22.326   6.1929 7.804451 8.615580 
1 1 1   14    9   52 o   19.587   5.3030   16.918   8.6729   2.6788   14.033   25.719   11.032   15.439   6.5139   24.026   5.7163 -8.587026 8.666437 
1 1 1   14    9   53 o   18.194   5.8780   14.114   9.9317   3.2553   13.941   25.306   14.153   15.529   6.5185   23.637   6.9109 -8.108629 9.500049 
1 1 1   14    9   54 o   34.599   3.9143   50.734   10.846   47.941   14.743   54.029   16.012   32.942   5.6963   34.958   5.8239 -2.015820 8.146482 
1 1 1   14    9   55 o   55.674   2.3910  127.938   10.825  134.609   17.037  123.421   14.019   56.616   3.7122   54.420   3.1741 2.195904 4.884162 
1 1 1   14    9   56 o   30.309   3.7639   39.032   9.0993   70.291   15.194   21.552   11.362   40.412   4.7000   21.842   6.1318 18.56981 7.725900 
1 1 1   14    9   57 f   49.868   2.3425  102.724   9.4954  105.863   16.195  101.080   11.722   49.996   4.0074   49.281   2.9312 0.7146683 4.964941 
1 1 1   14    9   58 o   58.546   2.2417  141.411   10.678  123.246   21.194  147.591   12.362   53.426   4.9218   59.710   2.5457 -6.283768 5.541210 
1 1 1   14    9   59 o   29.012   3.9108   36.042   9.0133   36.008   14.615   36.063   11.450   27.928   6.5360   28.564   5.1052 -0.6353321 8.293513 
1 1 1   14    9   60 o   29.872   4.0692   38.379   9.6514   49.161   18.188   34.153   11.387   32.382   7.0876   27.693   5.2360 4.688850 8.811931 
1 1 1   14    9   61 o   46.015   3.2745   88.960   12.202   0.0000   0.0000   88.960   12.202  ?   ?    46.015   3.2745 0.000000 3.274467 
1 1 1   14    9   62 o   19.436   5.1043   16.998   8.1892   22.015   17.315   15.553   9.2945   22.077   7.7611   18.629   5.6389 3.447958 9.593281 
1 1 1   14    9   63 o   16.712   5.1274   12.311   7.6506   1.6357   13.437   17.432   9.3064   14.584   6.2700   19.597   5.5661 -5.012389 8.384172 
1 1 1   14    9   64 o   16.097   5.1446   11.275   7.6224   14.250   13.391   9.8485   9.2707   18.576   6.7894   15.741   5.6638 2.835167 8.841637 
1 1 1   14    9   65 o   33.059   3.0885   46.102   8.2264   43.218   14.189   47.562   10.097   30.711   5.8820   33.308   3.7858 -2.596478 6.994969 
1 1 1   14    9   66 o   28.920   3.5089   35.756   8.1028   39.096   14.223   34.152   9.8593   28.960   6.2112   27.853   4.4956 1.107233 7.667395 
1 1 1   14    9   67 o   28.446   3.5935   34.717   8.1469   33.238   14.058   35.465   9.9968   26.443   6.5550   28.386   4.4679 -1.943401 7.932823 
1 1 1   14    9   68 o   31.938   3.2034   43.264   8.2273   36.851   14.542   46.283   9.9777   27.844   6.5221   32.790   3.8034 -4.946396 7.550111 
1 1 1   14    9   69 f   36.929   2.8542   57.335   8.5253   65.068   15.137   53.743   10.317   38.235   4.9746   35.418   3.6246 2.817238 6.155021 
1 1 1   14    9   70 o   19.415   4.9422   17.209   7.8407   36.186   14.139   8.7805   9.4223   27.520   6.4207   15.166   5.6674 12.35414 8.564202 
1 1 1   14    9   71 o   18.946   5.2238   16.542   8.3276   34.634   17.446   11.203   9.4769   26.106   7.6839   16.241   5.7391 9.865078 9.590601 
1 1 1   14    9   72 o   37.618   2.9541   59.831   8.9859   80.588   17.743   52.671   10.421   42.160   5.2783   34.916   3.7186 7.243641 6.456619 
1 1 1   14    9   73 o   20.054   5.0021   18.598   8.1492   8.2212   15.702   22.423   9.5336   16.779   6.9711   21.879   5.3830 -5.100159 8.807607 
1 1 1   14    9   74 o   29.723   3.7790   38.565   8.9493   32.864   21.978   39.698   9.7984   24.541   8.7332   29.983   4.1177 -5.442078 9.655242 
1 1 1   14    9   75 o   15.935   5.2104   11.497   7.7912   31.330   15.494   4.7837   9.0138   24.622   7.2396   13.183   5.3576 11.43902 9.006430 
1 1 1   14    9   76 o   8.8961   4.1376  -5.2716   7.2612 -21.3124   15.493  -0.7563   8.2198   11.048   5.3770   10.815   4.7712 0.2333431 7.188644 
1 1 1   14    9   77 o   12.866   5.5133   2.3839   10.327   9.7743   13.674  -7.4260   15.754   16.327   6.6123   13.094   6.0916 3.233205 8.990548 
1 1 1   14    9   78 o   12.700   4.8967   5.7945   7.1686  -1.6885   12.979   9.0795   8.5993   12.952   5.8346   14.695   5.4289 -1.743477 7.969684 
1 1 1   14    9   79 o   33.185   2.9922   47.305   8.0072   34.998   13.417   54.114   9.9791   26.253   6.3415   35.169   3.5285 -8.916494 7.257074 
1 1 1   14    9   80 f   14.639   4.9847   9.7152   7.1186   12.689   12.400   8.2533   8.6940   16.787   6.4485   14.248   5.4176 2.539409 8.422245 
1 1 1   14    9   81 o   13.659   5.5182   6.3247   9.4976  -3.2515   12.370   20.078   14.824   12.181   5.5689   19.510   7.1414 -7.329123 9.056068 
1 1 1   14    9   82 o   15.054   5.6373   10.062   9.3323   2.3767   11.937   22.146   14.967   13.255   5.8019   20.081   7.2001 -6.825441 9.246753 
1 1 1   14    9   83 o   15.382   5.7007   10.922   9.4954  -3.0154   12.232   32.055   15.063   12.039   5.5167   23.769   7.1749 -11.72982 9.050625 
1 1 1   14    9   84 o   18.869   5.7386   18.318   9.6107   16.378   12.606   21.012   14.852   17.756   6.5706   19.398   7.1402 -1.642502 9.703361 
1 1 1   14    9   85 o   18.201   5.7592   17.109   9.5722   17.920   12.402   15.914   15.055   18.288   6.5543   17.617   7.0053 0.6708755 9.593371 
1 1 1   14    9   86 o   9.9391   4.6599  -6.0561   9.5151   4.6029   12.386 -21.4056   14.863   13.779   5.9719   10.345   5.0832 3.433708 7.842403 
1 1 1   14    9   87 o   11.194   5.0609  -1.3319   9.8659   0.2456   11.827  -4.9415   17.890   12.449   5.5923   13.591   6.3777 -1.141967 8.482316 
1 1 1   14    9   88 o   15.117   5.8713   10.526   10.362   5.8727   12.583   20.330   18.265   14.104   6.0656   18.756   7.6251 -4.651976 9.743383 
1 1 1   14    9   89 o   12.231   5.3611   2.1722   10.224  -3.2058   12.287   14.277   18.433   11.812   5.4547   17.168   7.3616 -5.356736 9.162264 
1 1 1   14    9   90 o   11.399   5.1706  -1.1890   10.403   6.2280   12.585 -17.1904   18.484   14.101   6.0651   12.067   5.8728 2.034364 8.442466 
1 1 1   14    9   91 o   13.946   5.8022   7.2557   10.900   2.8528   13.088   17.221   19.690   13.369   5.9525   17.784   7.6167 -4.415397 9.666734 
1 1 1   14    9   92 o   17.148   6.5479   16.001   12.735   25.542   16.352   1.2993   20.300   20.122   7.4766   14.880   6.9198 5.242291 10.18742 
1 1 1   14    9   93 o   30.017   5.5264   46.297   13.024   56.936   16.660   29.577   20.886   31.960   6.6129   20.517   8.2199 11.44358 10.54978 
1 1 1   14    9   94 o   14.047   6.0168   6.8283   12.288   18.983   15.648 -12.7242   19.848   17.951   7.1406   12.843   6.2116 5.108318 9.464285 
1 1 1   14    9   95 o   21.453   7.1026   28.485   14.461   48.679   21.164   10.802   19.804   25.860   8.5936   16.210   7.2626 9.650087 11.25149 
1 1 1   14    9   96 o   12.230   5.5379   0.4232   11.868  -7.4604   15.042   13.425   19.317   11.937   5.6749   16.593   7.3175 -4.655075 9.260149 
1 1 1   14    9   97 o   25.713   6.1633   36.679   12.750   42.320   16.270   27.700   20.526   25.996   7.3513   19.698   8.0548 6.298176 10.90514 
1 1 1   14    9   98 o   19.832   7.4298   26.018   16.214   26.018   16.214   0.0000   0.0000   19.832   7.4298  ?   ?  0.000000 7.429779 
1 1 1   14    9   99 o   13.262   6.1611  -0.7091   16.028  -0.7091   16.028   0.0000   0.0000   13.262   6.1611  ?   ?  0.000000 6.161058 
1 1 1   14    9  100 o   16.852   7.1011   15.749   16.645   15.749   16.645   0.0000   0.0000   16.852   7.1011  ?   ?  0.000000 7.101113 
1 1 1   14   10  -94 f   17.909   8.0225   20.828   24.157   20.828   24.157   0.0000   0.0000   17.909   8.0225  ?   ?  0.000000 8.022493 
1 1 1   14   10  -93 o   13.808   6.6430  -7.1810   21.984  -7.1810   21.984   0.0000   0.0000   13.808   6.6430  ?   ?  0.000000 6.643015 
1 1 1   14   10  -92 o   16.238   7.4980   9.6687   23.208   9.6687   23.208   0.0000   0.0000   16.238   7.4980  ?   ?  0.000000 7.497985 
1 1 1   14   10  -91 o   18.837   7.4193   22.666   16.739   22.666   16.739   0.0000   0.0000   18.837   7.4193  ?   ?  0.000000 7.419251 
1 1 1   14   10  -90 o   13.360   6.2044  -1.0349   16.233  -1.0349   16.233   0.0000   0.0000   13.360   6.2044  ?   ?  0.000000 6.204400 
1 1 1   14   10  -89 o   12.068   5.5632  -1.9781   12.698  -1.9781   12.698   0.0000   0.0000   12.068   5.5632  ?   ?  0.000000 5.563245 
1 1 1   14   10  -88 o   17.919   6.7752   18.452   13.552   18.452   13.552   0.0000   0.0000   17.919   6.7752  ?   ?  0.000000 6.775206 
1 1 1   14   10  -87 o   9.0867   4.4417 -15.1164   10.904 -25.4066   12.860   11.209   20.569   8.9014   4.4354   16.539   7.4063 -7.637474 8.632855 
1 1 1   14   10  -86 o   35.069   4.2449   57.702   11.888   59.174   13.975   53.851   22.613   34.553   5.1162   27.247   8.8745 7.305399 10.24366 
1 1 1   14   10  -85 o   16.294   6.1080   13.672   10.962   16.326   13.012   7.1842   20.343   17.327   6.6183   15.905   7.2211 1.421899 9.795243 
1 1 1   14   10  -84 o   11.477   5.1836  -0.7877   10.319   2.5121   12.193  -9.1186   19.374   13.042   5.7797   13.326   6.3642 -0.2836027 8.596986 
1 1 1   14   10  -83 o   20.151   6.0428   21.879   10.710   21.275   12.605   23.444   20.308   19.435   6.6328   19.479   7.9939 -0.4372787E-01 10.38735 
1 1 1   14   10  -82 f   8.1197   4.0314 -20.4765   10.244 -31.8640   12.244   6.0995   18.705   8.0913   4.0733   15.633   7.0268 -7.541924 8.122082 
1 1 1   14   10  -81 o   17.501   6.0579   16.030   10.526   22.318   12.490   0.6170   19.555   20.007   6.6000   14.915   6.8856 5.092140 9.537902 
1 1 1   14   10  -80 o   11.266   5.0771  -1.1087   9.8372  -2.8409   12.502   1.7077   15.941   12.084   5.5521   14.214   6.4289 -2.129868 8.494473 
1 1 1   14   10  -79 o   14.248   5.6444   8.2642   9.7395  -1.2301   12.288   24.307   15.973   12.376   5.6164   20.398   7.4213 -8.021972 9.306940 
1 1 1   14   10  -78 o   31.950   4.1918   46.846   10.654   39.474   13.659   58.298   17.025   27.491   6.2388   33.292   6.5068 -5.801796 9.014527 
1 1 1   14   10  -77 o   37.268   3.5347   61.391   10.610   68.408   13.674   50.778   16.817   38.529   4.4346   30.736   6.8839 7.793703 8.188630 
1 1 1   14   10  -76 o   12.841   5.4386   3.6814   9.8444  -9.6593   12.716   23.637   15.552   11.112   5.2636   20.686   7.3479 -9.574423 9.038651 
1 1 1   14   10  -75 o   22.019   4.4077   22.472   7.6350   35.273   12.782   15.371   9.5200   26.448   6.0592   17.683   5.7581 8.764402 8.358816 
1 1 1   14   10  -74 o   12.746   5.3778   3.4751   9.5647  -1.9147   12.143   12.285   15.525   12.443   5.6212   17.226   7.0198 -4.782109 8.993072 
1 1 1   14   10  -73 o   28.480   4.2236   36.635   9.5088   47.935   13.765   26.320   13.151   31.621   5.5421   22.491   6.6846 9.129599 8.683242 
1 1 1   14   10  -72 o   11.816   4.8954   3.1363   7.7125  -8.0375   15.889   6.5804   8.8214   13.001   6.0713   13.685   5.3872 -0.6846848 8.116798 
1 1 1   14   10  -71 o   22.047   4.7072   22.502   8.2022   48.132   16.882   14.581   9.3843   30.706   6.9118   17.545   5.7172 13.16117 8.969909 
1 1 1   14   10  -70 o   11.585   4.8991   1.9689   7.9686   9.8981   16.287  -0.5265   9.1369   17.135   7.1077   11.435   5.0381 5.700376 8.712195 
1 1 1   14   10  -69 o   42.300   2.6995   75.449   9.2596   62.951   18.577   79.580   10.681   35.831   6.6038   43.250   3.0491 -7.419468 7.273724 
1 1 1   14   10  -68 o   7.8686   3.8219 -12.0298   7.7212  -0.7580   16.681 -15.1035   8.7106   14.919   6.6761   8.0856   3.9561 6.833241 7.760182 
1 1 1   14   10  -67 o   10.249   4.5838  -2.0918   7.8516  -5.1932   13.189  -0.3891   9.7719   12.560   5.7452   11.925   5.2337 0.6345139 7.771694 
1 1 1   14   10  -66 o   52.134   2.1649  112.859   9.1800   99.799   15.619  119.751   11.347   47.938   4.0346   53.483   2.6105 -5.545387 4.805475 
1 1 1   14   10  -65 o   25.113   3.9600   27.650   7.8381   14.015   14.173   33.657   9.4076   18.325   6.9289   27.583   4.3263 -9.257629 8.168633 
1 1 1   14   10  -64 o   13.465   5.0304   6.6426   7.4221  -6.0855   13.601   12.040   8.8571   12.687   5.8151   16.552   5.5605 -3.865179 8.045796 
1 1 1   14   10  -63 o   24.852   3.8779   26.926   7.5994   47.056   13.883   18.315   9.0806   32.111   5.5018   19.912   5.4409 12.19920 7.737797 
1 1 1   14   10  -62 o   11.311   4.7464   1.6889   7.3875  -6.1170   11.193   7.7141   9.8336   11.429   5.2519   14.901   5.7378 -3.472266 7.778434 
1 1 1   14   10  -61 o   41.944   2.4831   73.290   8.4519   49.152   14.960   84.606   10.243   32.727   5.8212   44.943   2.8101 -12.21571 6.464008 
1 1 1   14   10  -60 o   24.182   3.9855   25.513   7.5826   33.226   14.498   22.609   8.8964   26.352   6.7272   22.347   5.0081 4.005211 8.386641 
1 1 1   14   10  -59 o   39.009   2.6770   63.592   8.4608   60.137   15.556   65.044   10.082   36.618   5.3713   39.259   3.1777 -2.640888 6.240943 
1 1 1   14   10  -58 o   10.266   4.5556  -1.8386   7.6012  -6.1002   16.208  -0.6371   8.6063   14.066   6.4092   11.316   4.9403 2.749678 8.092218 
1 1 1   14   10  -57 o   92.636   1.9154  353.268   14.463  330.885   24.183  365.733   18.047   88.691   3.3510   93.987   2.3574 -5.296265 4.097152 
1 1 1   14   10  -56 o   50.125   2.3255  104.083   9.4758  114.709   18.443  100.271   11.045   51.569   4.4304   49.030   2.7749 2.539291 5.227644 
1 1 1   14   10  -55 o   15.723   5.1933   10.507   7.7324   20.581   15.583   7.2160   8.9062   21.366   7.3719   14.469   5.4876 6.896576 9.190190 
1 1 1   14   10  -54 o   14.106   5.3060   6.9223   8.2874   16.954   15.667   3.0244   9.7655   20.117   7.3450   13.254   5.5013 6.862984 9.176804 
1 1 1   14   10  -53 o   11.573   5.1465  -2.4460   9.7511 -14.4930   13.230   11.880   14.428   11.180   5.3169   18.131   6.9581 -6.950600 8.756936 
1 1 1   14   10  -52 o   52.748   3.6328  117.334   15.525  117.334   15.525   0.0000   0.0000   52.748   3.6328  ?   ?  0.000000 3.632812 
1 1 1   14   10  -51 o   39.926   2.6271   66.235   8.5024   73.786   14.730   62.461   10.412   41.454   4.4276   38.538   3.3477 2.915974 5.550760 
1 1 1   14   10  -50 o   54.085   2.1304  120.562   9.3738  137.788   16.358  112.139   11.438   57.290   3.5197   51.980   2.7089 5.310387 4.441413 
1 1 1   14   10  -49 o   35.671   2.8601   53.061   8.2468   64.557   14.793   47.877   9.9335   38.633   4.8008   33.619   3.6851 5.013580 6.052083 
1 1 1   14   10  -48 o   42.617   2.5196   75.214   8.7138   92.752   15.785   67.527   10.450   46.723   4.1891   40.169   3.2185 6.554359 5.282688 
1 1 1   14   10  -47 o   16.857   5.1527   12.295   7.7353   21.326   14.732   8.8579   9.0891   21.913   7.1647   15.416   5.5997 6.496092 9.093404 
1 1 1   14   10  -46 o   48.685   2.3368   97.804   9.2469  119.654   16.671   88.094   11.113   53.321   3.8618   46.022   2.9783 7.298748 4.876864 
1 1 1   14   10  -45 o   81.574   1.7975  272.777   11.952  234.258   19.648  295.406   15.059   75.056   3.2189   84.747   2.1817 -9.691628 3.888595 
1 1 1   14   10  -44 o   76.379   1.8460  239.161   11.493  249.518   19.373  233.536   14.277   77.561   3.0703   75.312   2.3285 2.249352 3.853397 
1 1 1   14   10  -43 o  106.371   1.6829  463.304   14.592  488.886   24.178  448.648   18.300  108.826   2.7277  104.522   2.1479 4.303123 3.471848 
1 1 1   14   10  -42 o   15.519   5.2919   9.6146   8.0237   33.488   14.564  -0.7893   9.6143   27.228   6.6257   12.098   5.2524 15.13008 8.455005 
1 1 1   14   10  -41 o   27.345   4.1077   31.890   8.8733   45.715   14.220   23.075   11.355   32.330   5.5986   22.764   6.0259 9.565546 8.225334 
1 1 1   14   10  -40 o   9.4744   4.3470  -5.1326   7.6266 -17.9157   13.394   1.0002   9.2774   10.903   5.2299   12.479   5.2822 -1.575865 7.433267 
1 1 1   14   10  -39 o   30.213   3.6385   38.414   8.7807   41.952   17.547   37.232   10.142   30.432   7.1890   29.544   4.3405 0.8875198 8.397697 
1 1 1   14   10  -38 o   42.009   2.7790   72.994   9.4627   39.965   18.633   84.472   10.985   29.601   7.6630   45.152   3.0015 -15.55066 8.229880 
1 1 1   14   10  -37 o   55.832   2.5104  128.353   11.396   91.235   32.571  133.531   12.165   44.203   9.3328   56.921   2.6288 -12.71774 9.695949 
1 1 1   14   10  -36 o   10.531   4.7516  -4.1289   8.6461 -18.1285   18.857  -0.4021   9.7291   13.821   6.5050   12.343   5.3211 1.477636 8.404106 
1 1 1   14   10  -35 o   87.607   1.8862  314.169   13.470  318.681   26.404  312.582   15.661   87.620   3.7052   87.290   2.2028 0.3306656 4.310590 
1 1 1   14   10  -34 o   16.683   5.2810   11.606   8.0479   22.473   13.798   6.0020   9.9080   22.697   6.8704   14.714   5.7337 7.982712 8.948610 
1 1 1   14   10  -33 o   47.955   2.4941   94.647   9.7159  100.565   15.592   90.889   12.423   49.093   3.9289   46.826   3.2753 2.266670 5.115037 
1 1 1   14   10  -32 o   40.287   3.1475   67.269   10.254   71.770   15.121   63.437   13.953   41.254   4.5733   38.779   4.4972 2.475266 6.414038 
1 1 1   14   10  -31 o   29.564   3.8083   36.740   8.9645   31.522   14.271   40.141   11.521   26.688   6.5978   30.678   4.7614 -3.990076 8.136432 
1 1 1   14   10  -30 o   78.849   2.1451  254.792   13.775  272.678   19.338  236.368   19.627   81.384   2.9197   75.691   3.1881 5.693298 4.323061 
1 1 1   14   10  -29 o   43.903   3.0847   79.687   10.969   80.612   15.580   78.777   15.446   43.836   4.4206   43.325   4.4361 0.5109406 6.262585 
1 1 1   14   10  -28 o   42.442   2.9438   74.382   10.121   81.092   15.404   69.284   13.427   43.999   4.3517   40.702   4.1027 3.297192 5.980767 
1 1 1   14   10  -27 o   36.935   3.9509   57.032   11.710   79.264   15.451   27.026   17.951   43.488   4.4200   25.033   7.8822 18.45527 9.036922 
1 1 1   14   10  -26 o   61.614   2.3554  155.743   11.808  160.406   17.748  152.039   15.818   62.287   3.5097   60.707   3.2078 1.579533 4.754791 
1 1 1   14   10  -25 o   58.717   2.4272  141.497   11.592  126.218   17.205  154.197   15.687   55.155   3.8511   61.157   3.1575 -6.001766 4.980036 
1 1 1   14   10  -24 o   51.443   2.6594  108.813   11.114  118.491   16.919  101.467   14.741   53.424   3.9121   49.470   3.6819 3.954029 5.372264 
1 1 1   14   10  -23 f   42.008   2.8848   72.772   9.8183   69.593   16.158   74.633   12.363   40.607   4.9859   42.407   3.6106 -1.800282 6.155957 
1 1 1   14   10  -22 o   46.407   2.9591   88.774   11.136   75.583   22.991   92.817   12.728   41.711   7.0103   47.390   3.3158 -5.678699 7.754964 
1 1 1   14   10  -21 o   97.209   1.7838  386.151   14.135  386.959   22.829  385.648   18.000   97.062   2.8886   97.066   2.2750 -0.3677368E-02 3.676913 
1 1 1   14   10  -20 o   58.724   2.5702  141.568   12.273  145.462   18.105  138.257   16.695   59.286   3.7658   57.841   3.5581 1.445129 5.180839 
1 1 1   14   10  -19 o   32.244   4.7917   44.030   12.212   62.080   16.133   19.806   18.689   38.260   5.3162   22.726   8.0566 15.53395 9.652502 
1 1 1   14   10  -18 o   41.943   3.8608   73.126   13.052   73.074   17.074   73.199   20.245   41.619   5.1421   41.348   6.1972 0.2705269 8.052730 
1 1 1   14   10  -17 o   37.189   3.6975   57.503   11.060   51.082   16.590   62.640   14.840   34.433   6.1356   38.577   4.8243 -4.143806 7.805086 
1 1 1   14   10  -16 o   18.946   5.7446   15.119   9.6406   9.1616   16.264   18.346   11.970   18.622   7.3197   20.855   6.4163 -2.233885 9.733797 
1 1 1   14   10  -15 o   39.408   3.2795   64.233   10.439   82.056   17.775   54.848   12.898   44.188   5.0240   36.153   4.4719 8.034393 6.725907 
1 1 1   14   10  -14 o   73.448   2.2090  220.859   13.210  236.077   23.376  213.718   16.012   75.613   3.8049   72.165   2.7269 3.447372 4.681183 
1 1 1   14   10  -13 o   40.723   3.3849   68.608   11.135   98.244   20.355   55.954   13.301   48.349   5.2489   36.506   4.5697 11.84353 6.959391 
1 1 1   14   10  -12 o  133.140   1.8532  724.259   20.112  753.681   35.305  710.123   24.471  135.490   3.1967  131.752   2.2786 3.737656 3.925645 
1 1 1   14   10  -11 o  136.678   1.8402  763.213   20.502  749.716   35.750  769.827   25.027  135.124   3.2457  137.191   2.2379 -2.067123 3.942428 
1 1 1   14   10  -10 o   69.748   2.2862  199.211   12.980  140.791   22.324  229.049   15.955   58.131   4.7526   74.740   2.6228 -16.60896 5.428304 
1 1 1   14   10   -9 o   62.411   2.4418  159.653   12.399  165.148   21.794  157.023   15.076   63.121   4.2606   61.805   3.0014 1.315426 5.211652 
1 1 1   14   10   -8 o   34.232   4.3077   49.099   11.755   6.4638   18.939   75.815   14.992   18.938   7.7398   42.635   4.3758 -23.69757 8.891140 
1 1 1   14   10   -7 o   10.986   5.0264  -6.7073   10.100 -27.8665   17.871   3.2239   12.243   12.208   5.9021   15.034   6.1923 -2.825668 8.554488 
1 1 1   14   10   -6 o   63.901   2.3855  167.298   12.404  181.959   22.098  160.554   14.988   66.316   4.1081   62.511   2.9496 3.804398 5.057356 
1 1 1   14   10   -5 o   79.534   2.1195  258.777   13.729  247.242   24.210  264.246   16.668   77.408   3.8490   80.304   2.5496 -2.896271 4.616824 
1 1 1   14   10   -4 o   59.695   2.4846  146.089   12.064  146.402   21.768  145.951   14.493   59.360   4.5329   59.589   2.9934 -0.2281265 5.432097 
1 1 1   14   10   -3 o   33.963   3.8643   48.076   10.508   72.902   19.369   37.720   12.509   41.428   5.9023   29.707   5.3632 11.72167 7.975010 
1 1 1   14   10   -2 o   25.928   5.0653   28.787   10.322   35.820   19.027   25.854   12.287   28.601   7.9002   24.413   6.1718 4.188011 10.02518 
1 1 1   14   10   -1 o   19.241   6.1090   15.257   10.762   14.707   23.356   15.406   12.127   22.593   8.8034   19.604   6.5047 2.989010 10.94585 
1 1 1   14   10    0 o   86.719   2.4301  307.947   17.161   0.0000   0.0000  307.947   17.161  ?   ?    86.719   2.4301 0.000000 2.430112 
1 1 1   14   10    1 o   71.250   2.6552  208.160   15.394   0.0000   0.0000  208.160   15.394  ?   ?    71.250   2.6552 0.000000 2.655233 
1 1 1   14   10    2 o   91.053   2.1726  338.967   16.126  315.200   40.170  343.533   17.607   86.828   5.7071   91.608   2.3598 -4.780434 6.175737 
1 1 1   14   10    3 o   51.803   3.0331  110.418   12.752  154.652   32.972  102.638   13.828   60.320   6.8256   49.873   3.4222 10.44679 7.635474 
1 1 1   14   10    4 o   14.077   5.6863   3.7777   10.083 -20.7626   18.491   14.162   12.029   13.446   6.3627   19.039   6.4797 -5.593106 9.081312 
1 1 1   14   10    5 o   92.025   1.9747  346.063   14.813  367.258   26.957  336.894   17.730   94.471   3.5066   90.709   2.3999 3.762001 4.249191 
1 1 1   14   10    6 o   22.075   5.7871   21.048   10.539   19.427   19.828   21.687   12.442   22.960   8.2801   22.476   6.4527 0.4833641 10.49750 
1 1 1   14   10    7 o   42.017   3.3588   72.957   11.408   57.956   20.876   79.344   13.622   36.467   7.2780   43.736   3.8606 -7.268997 8.238503 
1 1 1   14   10    8 o  193.332   1.9467  1527.36   30.678  1486.16   53.132  1547.97   37.574  190.189   3.4272  194.510   2.3698 -4.321304 4.166703 
1 1 1   14   10    9 o   26.711   5.1860   30.585   10.885   25.204   20.410   32.723   12.867   24.937   8.4411   27.501   5.9154 -2.564560 10.30744 
1 1 1   14   10   10 o   40.597   3.4440   68.205   11.290   73.445   20.723   65.993   13.463   41.438   6.3361   39.778   4.2161 1.660152 7.610622 
1 1 1   14   10   11 o   62.657   2.5610  161.019   13.053  132.026   19.114  186.351   17.867   56.417   4.1862   67.287   3.2673 -10.87000 5.310344 
1 1 1   14   10   12 o   60.233   2.4976  148.779   12.236  202.421   19.023  110.917   15.982   70.116   3.3378   51.762   3.8145 18.35438 5.068673 
1 1 1   14   10   13 o   83.732   2.0991  286.842   14.316  311.642   26.130  276.206   17.113   86.937   3.6956   82.087   2.5606 4.849960 4.496032 
1 1 1   14   10   14 o   79.341   1.9880  257.475   12.847  296.141   20.755  233.456   16.358   84.907   3.0035   75.440   2.6643 9.467041 4.014865 
1 1 1   14   10   15 o   69.594   2.1578  198.277   12.226  203.777   19.579  194.761   15.654   70.320   3.4259   68.871   2.7942 1.449402 4.420883 
1 1 1   14   10   16 o   32.185   3.8537   43.280   9.9096   31.268   16.071   50.650   12.587   26.719   7.2122   34.697   4.5608 -7.978107 8.533274 
1 1 1   14   10   17 o   61.078   2.2651  152.856   11.258  154.810   17.946  151.588   14.456   61.221   3.6122   60.716   2.9294 0.5043068 4.650764 
1 1 1   14   10   18 o  100.344   2.1080  411.809   17.242  412.434   22.843  410.980   26.287  100.249   2.7981   99.959   3.2303 0.2908096 4.273674 
1 1 1   14   10   19 o   50.839   2.7498  106.278   11.353  111.848   16.606  101.390   15.556   51.919   3.9535   49.432   3.8920 2.486954 5.547785 
1 1 1   14   10   20 o   77.055   2.0972  243.038   13.161  262.875   19.296  225.784   17.996   79.972   2.9652   74.103   2.9853 5.868782 4.207700 
1 1 1   14   10   21 o   71.709   2.1853  210.603   12.759  214.779   18.280  206.635   17.816   72.239   3.1117   70.858   3.0920 1.380951 4.386654 
1 1 1   14   10   22 o   65.611   2.2674  176.419   12.108  204.062   17.690  152.050   16.609   70.410   3.0896   60.698   3.3700 9.711437 4.571954 
1 1 1   14   10   23 f   21.678   5.5919   20.397   9.9461   28.069   14.681   13.889   13.522   25.310   6.9193   19.265   6.8507 6.044638 9.736935 
1 1 1   14   10   24 o   38.483   3.1508   61.280   9.7973   69.371   17.110   57.333   11.951   40.437   5.3195   37.036   4.0230 3.401436 6.669519 
1 1 1   14   10   25 o   49.436   2.4489  100.385   9.8379  112.259   15.612   92.565   12.670   52.036   3.7048   47.313   3.3060 4.722706 4.965400 
1 1 1   14   10   26 o   65.388   2.0421  175.102   10.871  205.016   17.270  155.471   13.991   70.567   3.0093   61.478   2.7991 9.089119 4.109813 
1 1 1   14   10   27 o   61.291   2.0810  153.909   10.382  149.352   16.267  157.041   13.485   60.130   3.3318   61.806   2.6831 -1.675858 4.277835 
1 1 1   14   10   28 o  121.737   1.6446  605.607   16.320  614.083   25.282  599.553   21.369  122.365   2.5347  121.010   2.1663 1.354958 3.334286 
1 1 1   14   10   29 o   26.435   4.5515   29.846   9.4541   41.346   13.689   19.357   13.073   30.921   5.6384   21.356   6.7269 9.565378 8.777390 
1 1 1   14   10   30 o   34.316   3.2075   48.914   8.8681   52.114   14.324   46.926   11.293   34.928   5.1884   33.368   4.2479 1.559654 6.705525 
1 1 1   14   10   31 o   44.056   2.7694   80.064   9.8953   84.810   14.609   76.040   13.451   45.059   4.0195   42.676   3.9100 2.383007 5.607573 
1 1 1   14   10   32 o   51.029   2.4903  107.108   10.328  101.323   15.458  111.772   13.880   49.307   3.8772   51.956   3.2943 -2.649235 5.087695 
1 1 1   14   10   33 o   66.530   2.0889  181.477   11.314  203.090   16.908  163.953   15.225   70.177   2.9623   63.039   2.9713 7.138653 4.195709 
1 1 1   14   10   34 o   27.553   4.5926   32.495   9.9520   32.559   13.745   32.423   14.428   27.121   6.3328   27.006   6.6090 0.1154003 9.153300 
1 1 1   14   10   35 o   62.158   2.0360  158.436   10.302  151.762   16.275  162.897   13.307   60.531   3.3111   62.909   2.6007 -2.377724 4.210330 
1 1 1   14   10   36 o   54.181   2.1810  120.559   9.6129  146.007   16.029  106.264   12.013   59.349   3.3265   50.707   2.9187 8.642006 4.425452 
1 1 1   14   10   37 o   23.444   4.7631   23.843   8.7917   27.933   16.805   22.301   10.316   25.033   7.5832   22.498   5.6372 2.534742 9.448971 
1 1 1   14   10   38 o   29.389   4.0712   36.631   9.4916   50.317   22.041   33.515   10.517   33.036   8.2187   27.881   4.8005 5.154606 9.517956 
1 1 1   14   10   39 o   33.097   3.6411   45.998   9.6610   74.933   22.635   39.552   10.683   41.006   7.0242   30.439   4.4359 10.56723 8.307590 
1 1 1   14   10   40 o   80.037   1.8685  262.426   12.190  265.264   21.652  261.109   14.750   79.960   3.3292   79.707   2.2726 0.2533112 4.030887 
1 1 1   14   10   41 o   29.114   3.7686   35.836   8.7341   39.192   15.669   34.323   10.520   29.505   6.6720   28.195   4.7456 1.309847 8.187566 
1 1 1   14   10   42 o   10.584   4.7127  -2.6819   8.2036  -8.6869   14.743   0.0111   9.8732   13.200   6.0516   12.502   5.3746 0.6978083 8.093726 
1 1 1   14   10   43 o   30.231   3.6409   38.567   8.7916   31.817   15.884   41.548   10.556   26.381   7.1911   31.205   4.2610 -4.824196 8.358743 
1 1 1   14   10   44 o   45.161   2.5094   84.273   9.2015   91.844   15.846   80.421   11.302   46.592   4.2180   43.933   3.1775 2.659153 5.280888 
1 1 1   14   10   45 o   29.881   3.6703   37.780   8.7524   52.633   14.928   30.001   10.804   34.671   5.4627   26.078   5.2641 8.592991 7.586316 
1 1 1   14   10   46 o   48.831   2.4383   98.492   9.6748  116.620   16.790   89.482   11.838   52.601   3.9446   46.329   3.1534 6.272541 5.050085 
1 1 1   14   10   47 o   64.162   2.0989  169.393   10.963  181.877   20.366  164.299   13.008   65.782   3.8144   63.052   2.5362 2.730133 4.580554 
1 1 1   14   10   48 o   37.096   2.9884   57.436   8.9601   48.146   15.260   62.324   11.069   32.831   5.9198   38.464   3.5712 -5.632641 6.913555 
1 1 1   14   10   49 o   20.551   4.9751   18.773   8.2442   8.1210   13.957   24.482   10.217   16.873   6.7330   23.366   5.4627 -6.493223 8.670323 
1 1 1   14   10   50 o   15.326   5.5287   8.9470   8.8408   5.7771   13.788   11.160   11.521   16.061   6.5886   17.126   6.2913 -1.064947 9.109830 
1 1 1   14   10   51 o   17.952   5.1922   14.276   8.0278   0.4749   13.491   21.841   9.9887   14.425   6.2424   21.995   5.5671 -7.569999 8.364246 
1 1 1   14   10   52 o   20.133   5.3442   18.224   8.9157   0.3932   18.234   23.826   10.221   16.424   7.1802   22.961   5.5276 -6.537170 9.061419 
1 1 1   14   10   53 o   13.056   5.4334   2.7140   9.5615   12.253   17.356  -1.4424   11.457   19.054   7.5392   12.840   5.6500 6.213992 9.421336 
1 1 1   14   10   54 o   59.771   2.5440  148.197   12.367  136.674   21.764  153.691   15.029   56.159   4.8003   60.642   3.0500 -4.482418 5.687304 
1 1 1   14   10   55 o   12.807   5.2356   3.4337   8.6691   2.0589   13.664   4.3598   11.215   14.818   6.3456   14.390   5.9267 0.4277840 8.682919 
1 1 1   14   10   56 o   20.955   5.4727   20.004   9.4482   26.245   13.969   14.742   12.827   23.578   6.8579   18.688   6.6695 4.890142 9.566275 
1 1 1   14   10   57 o   17.503   5.6497   13.506   9.1766   12.058   13.529   14.740   12.488   17.803   6.7609   18.587   6.5862 -0.7841854 9.438681 
1 1 1   14   10   58 o   10.062   4.6579  -6.3521   9.0390  -3.7344   13.906  -8.2671   11.894   13.461   6.0540   11.443   5.3130 2.018795 8.054796 
1 1 1   14   10   59 o   19.207   4.9812   16.702   7.8638   7.1838   14.012   21.078   9.5012   16.293   6.6580   21.442   5.4310 -5.148512 8.592084 
1 1 1   14   10   60 o   9.4063   4.3704  -6.1610   8.0692  -9.6552   15.618  -4.8887   9.4244   13.107   6.0866   10.648   4.8655 2.458606 7.792243 
1 1 1   14   10   61 o   21.816   4.9102   21.529   8.5205   4.3874   16.312   27.961   9.9918   16.303   6.9562   24.848   5.1039 -8.545469 8.627789 
1 1 1   14   10   62 o   14.290   5.3125   7.6191   8.2582   11.840   15.645   5.9889   9.7230   18.110   7.1603   14.175   5.6319 3.934330 9.109757 
1 1 1   14   10   63 o   11.551   4.9391   0.9277   8.2546  -7.0391   15.760   3.9396   9.6902   13.565   6.2329   13.380   5.5097 0.1851702 8.318998 
1 1 1   14   10   64 o   25.417   4.2191   28.508   8.4350   43.803   15.070   21.530   10.179   30.414   6.2867   21.440   5.7189 8.974009 8.498764 
1 1 1   14   10   65 o   60.100   2.0772  149.607   10.161  171.605   17.469  138.359   12.492   63.548   3.3846   57.493   2.6727 6.055050 4.312650 
1 1 1   14   10   66 o   14.867   5.2893   9.1479   8.0618   20.562   14.052   3.5478   9.8428   20.691   7.0039   13.232   5.5102 7.458097 8.911633 
1 1 1   14   10   67 o   25.997   4.3837   30.194   8.9595   34.439   14.563   27.609   11.365   26.378   6.7465   24.072   5.8500 2.305849 8.929577 
1 1 1   14   10   68 o   39.459   3.1882   66.427   10.168   65.570   18.688   66.787   12.118   36.842   6.4579   39.178   3.8439 -2.336082 7.515337 
1 1 1   14   10   69 o   16.387   5.6052   12.086   9.0030 -14.8328   16.939   22.684   10.628   12.589   5.9951   21.662   5.8729 -9.073530 8.392389 
1 1 1   14   10   70 o   14.468   5.4805   8.1388   8.8766   29.177   17.658   1.0248   10.268   23.352   7.8514   12.492   5.4257 10.86012 9.543723 
1 1 1   14   10   71 o   12.685   5.4692   1.8156   10.281 -70.4300   26.888   14.187   11.127   11.640   5.8813   17.476   6.2144 -5.836810 8.556179 
1 1 1   14   10   72 o   13.859   5.5093   6.5765   9.3098   5.6286   17.801   6.9334   10.923   16.284   7.1071   14.546   5.9028 1.737781 9.238720 
1 1 1   14   10   73 o   19.276   5.6760   18.229   9.5179   6.6908   17.845   22.816   11.252   16.430   7.1442   21.272   6.1455 -4.842134 9.423726 
1 1 1   14   10   74 o   13.490   5.4213   6.0509   9.1140   4.3137   16.845   6.7698   10.837   15.549   6.8462   14.347   5.8581 1.201887 9.010451 
1 1 1   14   10   75 o   12.307   5.0624   4.0974   8.1686   14.719   12.238  -4.4371   10.970   17.481   6.4732   11.267   5.1855 6.214610 8.294044 
1 1 1   14   10   76 o   34.714   3.5530   53.162   9.9122   37.146   15.674   63.835   12.796   25.968   7.1695   37.464   4.2659 -11.49630 8.342662 
1 1 1   14   10   77 o   27.594   5.3403   37.187   11.578   42.595   13.166   18.744   24.314   29.219   5.7326   19.345   8.3758 9.874468 10.14971 
1 1 1   14   10   78 o   17.144   6.1686   14.796   10.997   15.837   12.338   10.773   24.258   17.599   6.5025   17.726   7.9819 -0.1268463 10.29535 
1 1 1   14   10   79 o   11.604   5.2537  -1.5002   10.678  -7.6455   11.865   24.679   24.489   10.903   5.1402   20.118   8.5516 -9.215761 9.977558 
1 1 1   14   10   80 o   12.090   5.4136   0.0498   10.986 -14.0498   12.079   67.515   26.423   9.9618   4.8248   30.603   9.5527 -20.64085 10.70195 
1 1 1   14   10   81 o   25.521   5.9973   34.186   12.264   34.186   12.264   0.0000   0.0000   25.521   5.9973  ?   ?  0.000000 5.997308 
1 1 1   14   10   82 f   14.625   6.0458   8.3124   11.727   8.3124   11.727   0.0000   0.0000   14.625   6.0458  ?   ?  0.000000 6.045785 
1 1 1   14   10   83 o   26.149   6.0943   36.349   12.749   36.349   12.749   0.0000   0.0000   26.149   6.0943  ?   ?  0.000000 6.094286 
1 1 1   14   10   84 o   21.002   6.6618   25.235   12.801   25.235   12.801   0.0000   0.0000   21.002   6.6618  ?   ?  0.000000 6.661773 
1 1 1   14   10   85 o   14.731   6.1846   8.5388   12.552   8.5388   12.552   0.0000   0.0000   14.731   6.1846  ?   ?  0.000000 6.184564 
1 1 1   14   10   86 o   19.243   7.2949   22.566   15.735   22.566   15.735   0.0000   0.0000   19.243   7.2949  ?   ?  0.000000 7.294940 
1 1 1   14   10   87 o   20.972   7.3537   27.582   15.538   27.582   15.538   0.0000   0.0000   20.972   7.3537  ?   ?  0.000000 7.353728 
1 1 1   14   10   88 o   15.598   6.6791   10.483   15.135   10.483   15.135   0.0000   0.0000   15.598   6.6791  ?   ?  0.000000 6.679139 
1 1 1   14   10   89 o   18.719   7.1557   21.409   15.219   21.409   15.219   0.0000   0.0000   18.719   7.1557  ?   ?  0.000000 7.155746 
1 1 1   14   10   90 o   24.796   7.4633   39.014   16.315   39.014   16.315   0.0000   0.0000   24.796   7.4633  ?   ?  0.000000 7.463307 
1 1 1   14   10   91 o   17.310   7.0834   17.256   15.888   17.256   15.888   0.0000   0.0000   17.310   7.0834  ?   ?  0.000000 7.083361 
1 1 1   14   10   92 o   22.109   7.5346   32.419   16.265   32.419   16.265   0.0000   0.0000   22.109   7.5346  ?   ?  0.000000 7.534641 
1 1 1   14   10   93 o   16.074   6.8599   13.107   15.870   13.107   15.870   0.0000   0.0000   16.074   6.8599  ?   ?  0.000000 6.859921 
1 1 1   14   10   94 f   16.952   6.9349   16.653   15.222   16.653   15.222   0.0000   0.0000   16.952   6.9349  ?   ?  0.000000 6.934921 
1 1 1   14   10   95 o   9.5490   4.7604 -26.9321   14.886 -26.9321   14.886   0.0000   0.0000   9.5490   4.7604  ?   ?  0.000000 4.760353 
1 1 1   14   10   96 o   11.320   5.6078 -25.4066   19.409 -25.4066   19.409   0.0000   0.0000   11.320   5.6078  ?   ?  0.000000 5.607802 
1 1 1   14   11  -91 o   10.464   5.2579 -38.2101   19.910 -38.2101   19.910   0.0000   0.0000   10.464   5.2579  ?   ?  0.000000 5.257877 
1 1 1   14   11  -90 o   15.023   7.0541   3.5519   21.947   3.5519   21.947   0.0000   0.0000   15.023   7.0541  ?   ?  0.000000 7.054098 
1 1 1   14   11  -85 o   18.339   7.9407   21.822   21.856   0.0000   0.0000   21.822   21.856  ?   ?    18.339   7.9407 0.000000 7.940655 
1 1 1   14   11  -84 o   20.611   7.6298   28.299   17.000   30.768   25.891   26.427   22.539   19.956   8.6418   19.354   8.2144 0.6022987 11.92301 
1 1 1   14   11  -83 o   23.130   7.8500   35.958   17.653   16.036   28.604   48.213   22.435   17.765   8.2454   25.161   8.8353 -7.395704 12.08509 
1 1 1   14   11  -82 o   13.257   6.1871  -2.4987   16.460 -37.7506   27.142   18.009   20.702   12.680   6.3379   17.790   7.7155 -5.109073 9.984841 
1 1 1   14   11  -81 o   14.046   6.4001   2.2917   16.162 -13.5963   25.782   12.577   20.744   14.250   6.9356   16.781   7.4816 -2.531263 10.20180 
1 1 1   14   11  -80 o   24.695   6.5894   34.601   13.510   47.012   17.498   16.281   21.260   27.635   7.5533   17.594   7.7207 10.04158 10.80101 
1 1 1   14   11  -79 o   10.761   5.1313  -9.3065   12.490   1.6608   15.797 -27.6008   20.402   13.919   6.3365   11.678   5.7787 2.241012 8.575785 
1 1 1   14   11  -78 o   13.404   5.6467   5.7608   10.519  -5.8022   12.159   40.180   20.977   11.243   5.2702   23.897   8.5290 -12.65322 10.02587 
1 1 1   14   11  -77 o   12.631   5.5240   2.7348   10.801  -3.4929   12.657   19.420   20.718   11.925   5.5173   18.510   7.8667 -6.585578 9.608630 
1 1 1   14   11  -76 o   15.355   5.9425   11.055   10.586   17.158   12.464  -4.7528   20.059   17.815   6.5437   14.176   6.6835 3.638720 9.353539 
1 1 1   14   11  -75 o   15.018   5.9401   9.9877   10.771   2.4305   12.683   29.545   20.402   13.283   5.8902   21.210   8.2383 -7.926641 10.12735 
1 1 1   14   11  -74 o   22.237   5.7454   25.628   10.488   22.500   13.598   30.220   16.478   19.938   6.8862   22.283   7.5840 -2.345417 10.24391 
1 1 1   14   11  -73 o   30.388   4.3264   42.912   10.414   37.554   13.109   52.083   17.148   26.775   6.1375   30.652   7.0153 -3.876356 9.321174 
1 1 1   14   11  -72 o   19.922   5.0636   19.510   8.2392   19.575   12.755   19.463   10.793   19.070   6.6644   19.264   6.1179 -0.1935463 9.046741 
1 1 1   14   11  -71 o   16.531   5.3407   13.345   8.1990 -14.3943   12.353   35.190   10.962   10.145   4.9051   26.948   5.1784 -16.80318 7.132703 
1 1 1   14   11  -70 o   24.536   4.3224   27.781   8.3294   21.869   12.416   32.619   11.232   20.324   6.5726   25.740   5.5189 -5.415684 8.582386 
1 1 1   14   11  -69 o   30.392   3.6209   40.876   8.7942   40.684   13.533   41.016   11.570   28.473   6.0195   29.457   4.9968 -0.9841766 7.823234 
1 1 1   14   11  -68 o   9.8133   4.5533  -5.2177   8.7123  -9.2338   15.819  -3.4692   10.438   12.642   5.9526   11.226   5.1260 1.416384 7.855499 
1 1 1   14   11  -67 o   31.696   3.8221   44.562   9.6760   11.582   17.424   59.268   11.635   17.443   7.3024   36.486   3.9763 -19.04350 8.314805 
1 1 1   14   11  -66 o   12.484   5.2065   3.5402   8.8069  -3.1505   17.301   5.8804   10.232   14.343   6.5682   13.907   5.6869 0.4365511 8.688025 
1 1 1   14   11  -65 o   30.806   3.9269   42.052   9.6373   50.244   18.916   39.181   11.200   30.599   7.6145   29.106   4.8941 1.492832 9.051676 
1 1 1   14   11  -64 f   41.787   3.3781   75.292   11.409   49.209   30.240   79.620   12.319   27.447   10.173   42.851   3.5589 -15.40438 10.77767 
1 1 1   14   11  -63 o   15.352   5.4997   10.127   8.7306 -18.8029   26.659   13.602   9.2401   15.486   7.4148   17.126   5.6779 -1.639909 9.339072 
1 1 1   14   11  -62 o   39.136   3.1140   65.315   9.8523   31.276   28.664   69.875   10.491   23.864   9.6059   40.431   3.2097 -16.56675 10.12794 
1 1 1   14   11  -61 f   13.206   5.1145   5.9587   7.8461   9.0606   17.769   5.2074   8.7449   17.477   7.3492   13.271   5.3182 4.205959 9.071599 
1 1 1   14   11  -60 o   11.358   4.8392   1.2738   7.8740  -2.0604   17.911   2.0725   8.7665   15.177   6.8441   12.145   5.1375 3.031718 8.557744 
1 1 1   14   11  -59 o   36.498   2.8757   56.258   8.4867   62.544   15.166   53.392   10.240   37.158   5.1450   35.196   3.6208 1.961758 6.291314 
1 1 1   14   11  -58 f   9.6435   4.5362  -8.2247   9.1466   21.776   13.975 -30.7048   12.097   21.233   6.9804   8.4071   4.2064 12.82566 8.149790 
1 1 1   14   11  -57 o   17.902   5.8790   14.541   9.9141   14.685   16.266   14.456   12.505   18.983   7.3607   18.209   6.5746 0.7745399 9.869427 
1 1 1   14   11  -56 o   8.4663   4.1173 -14.4322   9.0374 -15.1073   13.946 -13.9435   11.866   11.312   5.4015   10.340   4.9498 0.9715357 7.326446 
1 1 1   14   11  -55 o   12.979   5.0691   5.2400   7.7585   15.620   14.032   0.6691   9.3114   18.994   6.9487   12.089   5.2085 6.905152 8.684061 
1 1 1   14   11  -54 o   10.781   4.6669  -0.0422   7.5450 -10.5822   13.869   4.3881   8.9919   12.038   5.6380   13.231   5.3607 -1.193472 7.779745 
1 1 1   14   11  -53 o   27.920   3.6345   33.533   8.0756   50.160   14.399   25.904   9.7540   33.252   5.5048   23.866   5.1641 9.385998 7.547879 
1 1 1   14   11  -52 f   19.408   4.8667   17.045   7.6845   22.250   13.658   14.633   9.2954   21.697   6.8810   18.021   5.6718 3.675411 8.917263 
1 1 1   14   11  -51 o   24.549   4.4927   26.689   8.6590   55.997   14.480   10.373   10.804   35.421   5.1671   16.351   6.0768 19.06979 7.976618 
1 1 1   14   11  -50 f   43.578   2.7420   79.360   9.6908   86.424   15.416   74.745   12.460   44.715   4.2818   41.872   3.6883 2.843586 5.651317 
1 1 1   14   11  -49 o   32.912   3.4217   46.027   9.0460   38.495   14.816   50.504   11.422   28.626   6.4983   34.159   4.1898 -5.532413 7.731897 
1 1 1   14   11  -48 o   45.112   2.9048   85.166   10.625   83.433   15.864   86.576   14.308   43.865   4.5004   45.002   3.9403 -1.136456 5.981601 
1 1 1   14   11  -47 o   42.046   3.2448   74.454   11.035   94.531   18.119   62.615   13.913   46.536   4.8474   37.926   4.5940 8.609764 6.678505 
1 1 1   14   11  -46 o   11.197   5.0223  -3.1578   9.5005   6.9033   15.969  -8.6697   11.820   17.036   7.0497   11.365   5.2835 5.670929 8.809905 
1 1 1   14   11  -45 o   53.621   2.5765  119.380   11.229  128.658   19.450  114.742   13.752   54.734   4.3965   52.287   3.2424 2.446209 5.462811 
1 1 1   14   11  -44 o   82.645   2.0717  281.429   13.946  312.327   23.845  265.365   17.193   86.288   3.3967   79.980   2.6408 6.307968 4.302474 
1 1 1   14   11  -43 o   41.285   3.0959   71.389   10.343   77.387   18.332   68.589   12.527   41.839   5.5089   40.159   3.8748 1.679573 6.735143 
1 1 1   14   11  -42 o   31.815   3.7109   43.055   9.4434   23.783   20.038   48.558   10.707   23.151   8.3271   33.712   3.9724 -10.56183 9.226062 
1 1 1   14   11  -41 o   16.519   5.6969   11.195   9.3056   40.056   29.135   7.9165   9.8200   28.479   10.063   15.208   5.7635 13.27156 11.59642 
1 1 1   14   11  -40 o   38.940   3.1107   63.457   9.7917   75.937   20.381   59.712   11.165   41.110   6.2808   37.566   3.6938 3.544827 7.286460 
1 1 1   14   11  -39 o   59.543   2.3087  146.326   11.184  133.412   17.101  155.980   14.785   56.277   3.7492   61.232   2.9710 -4.954769 4.783626 
1 1 1   14   11  -38 o   8.8189   4.1867  -9.4005   8.1329 -10.2495   13.915  -8.9599   10.023   12.354   5.7399   10.256   4.8002 2.098186 7.482539 
1 1 1   14   11  -37 o   12.808   5.1546   3.7519   8.2525   8.3508   14.123   1.3677   10.169   17.046   6.7827   13.024   5.5223 4.022079 8.746438 
1 1 1   14   11  -36 o   11.386   4.8927   0.0426   8.1748   8.7803   13.899  -4.5788   10.108   17.125   6.7558   11.318   5.1192 5.807238 8.476266 
1 1 1   14   11  -35 o   36.182   3.2988   54.854   9.6226   73.417   14.892   41.547   12.608   41.465   4.4766   30.801   5.2072 10.66390 6.866937 
1 1 1   14   11  -34 o   60.401   2.1151  150.071   10.398  130.519   16.910  161.958   13.185   55.774   3.7410   62.608   2.5891 -6.834465 4.549518 
1 1 1   14   11  -33 o   44.258   2.5872   81.032   9.2931   87.360   15.627   77.570   11.559   45.399   4.2730   43.094   3.3160 2.304283 5.408772 
1 1 1   14   11  -32 o   46.640   2.6882   90.028   10.177   94.964   19.873   88.273   11.848   46.920   5.2881   46.043   3.1762 0.8763161 6.168694 
1 1 1   14   11  -31 o   12.495   5.2088   1.9466   8.8090   16.210   17.402  -2.9677   10.214   20.701   7.7088   11.846   5.2676 8.855530 9.336629 
1 1 1   14   11  -30 o   65.793   2.5624  178.537   13.716   0.0000   0.0000  178.537   13.716  ?   ?    65.793   2.5624 0.000000 2.562367 
1 1 1   14   11  -29 o   15.859   5.4320   10.015   8.4561   18.428   14.678   5.8355   10.345   20.962   7.1573   14.764   5.8272 6.198156 9.229508 
1 1 1   14   11  -28 o   58.814   2.1705  142.181   10.388  167.782   17.561  128.400   12.884   63.519   3.4040   55.717   2.8463 7.802017 4.437192 
1 1 1   14   11  -27 o   71.055   2.2166  207.473   12.823  227.840   18.995  190.421   17.380   74.160   3.1494   67.784   3.1542 6.375832 4.457305 
1 1 1   14   11  -26 o   89.826   1.9782  330.718   14.485  346.025   21.243  317.418   19.802   91.562   2.8497   87.721   2.7728 3.840775 3.976049 
1 1 1   14   11  -25 o   89.577   1.9968  328.879   14.580  348.121   21.317  311.964   19.986   91.851   2.8505   86.956   2.8234 4.895279 4.012089 
1 1 1   14   11  -24 o   55.988   2.5269  129.137   11.503  129.801   16.756  128.545   15.819   55.792   3.7053   55.585   3.5091 0.2070503 5.103257 
1 1 1   14   11  -23 o   46.594   2.8988   89.816   10.955   88.900   16.115   90.604   14.938   45.931   4.3563   46.497   3.9795 -0.5663300 5.900279 
1 1 1   14   11  -22 f   34.021   3.3775   48.327   9.2429   39.806   15.159   53.370   11.661   29.945   6.4042   35.578   4.0956 -5.633083 7.601799 
1 1 1   14   11  -21 o   40.722   3.0817   68.784   10.154   54.340   15.569   79.474   13.394   35.439   5.5732   43.598   3.8069 -8.159069 6.749313 
1 1 1   14   11  -20 o   44.263   2.8633   81.000   10.276   75.124   15.883   85.229   13.475   42.112   4.7075   45.202   3.6892 -3.090359 5.980856 
1 1 1   14   11  -19 o   13.723   5.6835   2.6439   10.391   47.121   20.608 -12.5194   12.033   32.188   7.9113   10.990   5.1799 21.19810 9.456227 
1 1 1   14   11  -18 o   51.156   2.5999  107.804   10.806   95.179   16.655  116.984   14.201   47.601   4.3400   53.129   3.2954 -5.527508 5.449299 
1 1 1   14   11  -17 o   28.330   4.2166   34.080   9.4413   34.421   14.660   33.838   12.342   27.834   6.5679   27.836   5.6327 -0.2174377E-02 8.652429 
1 1 1   14   11  -16 o   52.233   2.4708  112.239   10.490  125.443   18.643  106.122   12.689   54.761   4.2089   50.654   3.0879 4.106918 5.220116 
1 1 1   14   11  -15 o   72.016   2.0228  212.540   11.863  195.099   20.605  221.187   14.509   68.553   3.7011   73.379   2.4290 -4.826317 4.426945 
1 1 1   14   11  -14 o   77.900   1.9679  248.577   12.486  230.669   22.011  257.073   15.161   74.589   3.6311   79.136   2.3529 -4.547455 4.326817 
1 1 1   14   11  -13 o   48.591   2.5933   97.225   10.234  123.779   18.334   85.206   12.335   54.432   4.1638   45.316   3.3633 9.115940 5.352447 
1 1 1   14   11  -12 o   36.500   3.8881   55.797   11.390   71.261   17.054   43.343   15.305   40.897   5.2355   31.460   6.1886 9.437023 8.106114 
1 1 1   14   11  -11 o   34.210   3.9403   49.114   10.788   44.296   16.895   52.430   14.017   31.645   6.7553   35.053   5.0514 -3.408718 8.435034 
1 1 1   14   11  -10 o  117.449   1.9465  564.521   18.635  592.483   29.957  546.870   23.802  119.923   3.0670  115.437   2.5295 4.486397 3.975489 
1 1 1   14   11   -9 o   73.379   2.0168  220.576   12.052  252.784   21.445  205.707   14.571   78.210   3.3717   70.757   2.5303 7.452721 4.215592 
1 1 1   14   11   -8 o   27.274   4.2754   31.601   9.1930   38.939   16.215   28.124   11.160   29.630   6.8503   25.395   5.5468 4.235577 8.814443 
1 1 1   14   11   -7 f   41.200   3.3192   70.423   11.053   72.209   26.231   70.037   12.188   40.032   8.3106   41.003   3.6858 -0.9703751 9.091238 
1 1 1   14   11   -6 o   40.384   3.3544   67.697   10.943   40.599   26.116   73.467   12.051   30.077   9.5123   42.036   3.5502 -11.95894 10.15318 
1 1 1   14   11   -5 o   71.751   2.2745  211.164   13.286  232.237   31.561  206.625   14.647   74.259   5.2478   70.920   2.5378 3.339584 5.829194 
1 1 1   14   11   -4 o   69.682   2.3061  199.202   13.081  221.748   30.812  194.245   14.447   72.562   5.2446   68.751   2.5825 3.811142 5.845939 
1 1 1   14   11   -3 o   44.208   2.8296   80.631   10.143   90.072   18.023   76.253   12.271   46.217   4.8563   42.837   3.5459 3.380157 6.013132 
1 1 1   14   11   -2 o   75.741   1.9922  234.929   12.289  231.696   21.518  236.494   14.971   74.837   3.5373   75.907   2.4226 -1.070061 4.287379 
1 1 1   14   11   -1 o   65.111   2.1798  173.824   11.553  178.187   20.387  171.760   14.022   65.521   3.8338   64.628   2.6674 0.8934326 4.670434 
1 1 1   14   11    0 o   47.366   2.6906   92.408   10.346  102.562   18.382   87.701   12.516   49.426   4.6159   46.003   3.3608 3.422905 5.709775 
1 1 1   14   11    1 o   72.414   2.0471  214.809   12.072  225.430   21.356  209.822   14.634   73.810   3.5600   71.475   2.5156 2.334961 4.359138 
1 1 1   14   11    2 o   37.429   3.2391   58.130   9.7855   58.956   17.494   57.754   11.805   36.929   6.0184   37.145   3.9598 -0.2159500 7.204216 
1 1 1   14   11    3 o   88.678   1.8897  321.689   13.660  320.496   24.083  322.255   16.585   88.104   3.3595   88.649   2.2971 -0.5456848 4.069788 
1 1 1   14   11    4 o   19.172   5.5370   15.817   9.1354  -5.1295   16.211   25.565   11.059   14.835   6.6137   24.177   5.7041 -9.342771 8.733737 
1 1 1   14   11    5 o  104.567   1.9637  447.438   16.738  481.008   37.576  439.128   18.695  107.527   4.2957  103.535   2.2152 3.992325 4.833179 
1 1 1   14   11    6 o   30.001   4.3167   38.114   10.253   22.140   21.705   42.702   11.633   23.912   8.6579   31.702   4.6387 -7.789845 9.822270 
1 1 1   14   11    7 f   67.429   2.3087  186.565   12.671  204.624   28.069  181.943   14.200   69.791   4.9663   66.522   2.6239 3.269402 5.616831 
1 1 1   14   11    8 o   34.649   3.7552   50.214   10.437   50.773   22.820   50.066   11.736   33.445   8.3865   34.470   4.2679 -1.025078 9.410023 
1 1 1   14   11    9 o   97.786   1.8348  391.133   14.626  411.874   25.819  381.332   17.748   99.940   3.1733   96.465   2.2571 3.475761 3.894083 
1 1 1   14   11   10 o   68.296   2.1093  191.197   11.729  184.092   20.720  194.548   14.227   66.575   3.8343   68.804   2.5411 -2.228401 4.599864 
1 1 1   14   11   11 o   61.050   2.5003  153.197   12.416  196.563   20.767  129.068   15.490   68.833   3.7149   55.817   3.4209 13.01588 5.050064 
1 1 1   14   11   12 o   50.620   2.8203  105.674   11.592  100.932   18.540  108.717   14.852   48.959   4.7034   51.165   3.5838 -2.205322 5.913163 
1 1 1   14   11   13 o   59.158   2.5437  143.931   12.238  137.939   19.882  147.585   15.527   57.440   4.2771   59.750   3.1996 -2.310440 5.341463 
1 1 1   14   11   14 o   80.468   1.9822  265.090   13.002  273.649   23.082  261.111   15.736   81.307   3.4908   79.739   2.4238 1.567924 4.249826 
1 1 1   14   11   15 o   25.747   4.5543   28.426   9.2089   46.457   17.296   21.292   10.879   32.380   6.7710   22.034   5.9281 10.34652 8.999326 
1 1 1   14   11   16 o   24.856   4.7647   26.654   9.3026   15.230   17.136   31.428   11.077   20.594   7.6533   26.915   5.2372 -6.321690 9.273746 
1 1 1   14   11   17 o   30.133   3.9316   38.285   9.4270   45.790   17.588   35.260   11.166   32.065   6.9313   28.620   4.9665 3.445353 8.526937 
1 1 1   14   11   18 o   62.276   2.2083  159.198   11.192  172.621   20.625  153.594   13.325   64.360   3.9503   61.065   2.6835 3.294907 4.775588 
1 1 1   14   11   19 o   30.574   4.3063   39.673   10.435   51.870   17.700   33.175   12.919   34.277   6.5741   27.454   5.9454 6.822475 8.863794 
1 1 1   14   11   20 o   12.672   5.4998  -0.9665   10.535   12.182   21.690  -5.0257   12.052   20.982   8.3867   12.531   5.6358 8.451179 10.10442 
1 1 1   14   11   21 o   38.168   3.1125   60.494   9.5998   59.921   13.937   61.012   13.242   37.565   4.6506   38.002   4.3533 -0.4377861 6.370183 
1 1 1   14   11   22 f   38.113   3.1456   60.363   9.6856   42.761   13.954   76.730   13.455   31.308   5.6765   42.797   3.8996 -11.48922 6.886936 
1 1 1   14   11   23 o   36.682   3.2726   56.051   9.6826   52.178   14.049   59.556   13.364   34.849   5.0960   37.486   4.4608 -2.636360 6.772641 
1 1 1   14   11   24 o   28.522   4.1345   34.585   9.3328   22.128   13.530   45.894   12.891   22.430   6.8062   32.663   5.0004 -10.23297 8.445636 
1 1 1   14   11   25 o   32.625   3.6818   44.736   9.6206   63.355   14.058   28.336   13.194   38.623   4.5527   25.176   6.4125 13.44711 7.864256 
1 1 1   14   11   26 o   76.132   1.8483  237.401   11.470  257.467   18.227  224.244   14.759   78.973   2.8361   73.814   2.4564 5.159187 3.751957 
1 1 1   14   11   27 o   68.649   2.1214  193.537   11.857  219.905   17.253  169.939   16.322   72.942   2.9075   64.033   3.1365 8.909302 4.276819 
1 1 1   14   11   28 o   27.379   4.3222   32.110   9.3266   35.795   13.644   28.877   12.778   28.368   6.0831   25.404   6.2210 2.963190 8.700829 
1 1 1   14   11   29 o   53.211   2.4867  116.757   10.756   97.611   15.071  136.631   15.356   48.238   3.8652   57.326   3.3000 -9.088303 5.082315 
1 1 1   14   11   30 o   41.468   2.8810   71.342   9.6779   84.886   17.919   65.764   11.499   44.499   5.0279   39.608   3.6010 4.891464 6.184448 
1 1 1   14   11   31 o   91.530   1.8557  343.386   13.845  345.189   25.018  342.590   16.623   91.123   3.3740   91.309   2.2333 -0.1863174 4.046198 
1 1 1   14   11   32 o   36.235   3.2316   54.866   9.4452   47.734   17.524   57.786   11.213   32.450   6.8408   37.035   3.7668 -4.585133 7.809274 
1 1 1   14   11   33 o   92.019   1.8422  347.155   13.818  359.138   25.374  342.103   16.475   92.905   3.3560   91.227   2.2155 1.677643 4.021320 
1 1 1   14   11   34 o   39.231   2.8027   63.927   8.9039   83.011   14.955   53.447   11.082   44.254   4.1957   35.537   3.8891 8.716827 5.720981 
1 1 1   14   11   35 o   22.128   4.7647   21.522   8.3400   32.013   13.689   15.328   10.517   26.546   6.4009   18.839   6.0454 7.707357 8.804437 
1 1 1   14   11   36 o   25.555   4.1195   28.102   8.2897   38.373   13.496   21.880   10.505   29.296   5.8565   22.071   5.7738 7.225143 8.224067 
1 1 1   14   11   37 o   21.815   5.1361   21.158   8.9810   8.8846   13.052   32.194   12.377   16.837   6.5752   26.765   5.8377 -9.927305 8.792726 
1 1 1   14   11   38 o   42.558   2.5927   75.090   8.9516   85.368   14.630   68.939   11.318   44.865   4.0437   40.501   3.4612 4.363239 5.322727 
1 1 1   14   11   39 o   10.350   4.6310  -2.8339   8.0243   0.3151   12.985  -4.7795   10.207   14.171   6.1283   11.304   5.1254 2.867014 7.989111 
1 1 1   14   11   40 o   45.408   2.4500   85.355   9.0347   92.769   14.014   80.083   11.819   46.894   3.6960   43.687   3.3442 3.206821 4.984383 
1 1 1   14   11   41 o   40.019   2.6883   66.594   8.7189   79.803   13.586   57.344   11.369   43.380   3.8830   36.733   3.8542 6.647182 5.471075 
1 1 1   14   11   42 o   19.063   5.3620   16.253   8.6796  -1.8929   15.285   24.888   10.545   14.684   6.4910   23.462   5.5928 -8.778309 8.568158 
1 1 1   14   11   43 o   43.550   2.8474   79.077   10.053   66.476   21.228   82.720   11.414   37.755   7.1597   44.427   3.1726 -6.672684 7.831160 
1 1 1   14   11   44 o   15.353   5.5486   9.0873   8.9092   16.271   18.740   6.9894   10.127   20.550   7.9187   14.902   5.7996 5.647624 9.815377 
1 1 1   14   11   45 o   21.420   5.5286   20.846   9.7185   39.661   24.513   17.338   10.586   28.047   9.2459   19.609   6.0342 8.437977 11.04074 
1 1 1   14   11   46 o   12.338   5.5162  -3.0630   11.361 -34.9005   21.971   8.5571   13.273   12.873   6.2953   16.595   6.5844 -3.721229 9.109575 
1 1 1   14   11   47 o   34.512   3.6536   50.747   10.123   69.241   17.657   41.693   12.354   39.282   5.6788   30.607   5.1333 8.674747 7.655028 
1 1 1   14   11   48 o   9.9591   4.6358  -7.1806   9.1444 -24.7090   15.916   1.4569   11.173   11.168   5.4387   13.428   5.7439 -2.259575 7.910237 
1 1 1   14   11   49 o   52.406   2.4070  113.971   10.255  141.157   19.004  102.803   12.181   57.402   4.0883   49.506   3.0330 7.896164 5.090458 
1 1 1   14   11   50 f   24.071   4.7282   25.850   8.9462   50.127   16.327   15.434   10.695   32.833   6.3300   18.580   6.1062 14.25325 8.795148 
1 1 1   14   11   51 o   17.336   5.3233   13.453   8.2441   21.267   13.874   9.1890   10.250   21.320   6.9519   15.697   5.9017 5.623257 9.119156 
1 1 1   14   11   52 f   54.515   2.2782  123.218   10.101  116.166   16.739  127.257   12.668   52.035   3.9766   55.152   2.8272 -3.116966 4.879183 
1 1 1   14   11   53 o   66.942   2.0170  185.081   10.994  187.400   18.367  183.786   13.724   66.566   3.3962   66.453   2.5382 0.1122589 4.239872 
1 1 1   14   11   54 o   28.261   3.8889   34.630   8.7216   44.377   14.679   29.311   10.843   30.885   6.0469   25.278   5.4247 5.606840 8.123565 
1 1 1   14   11   55 o   26.544   4.1772   30.926   8.7399   37.698   14.730   27.247   10.858   28.068   6.5570   24.241   5.6065 3.827393 8.627102 
1 1 1   14   11   56 o   25.628   4.2980   29.029   8.6611   26.496   14.452   30.448   10.819   23.289   7.0276   25.764   5.3275 -2.475130 8.818719 
1 1 1   14   11   57 o   26.184   4.1676   30.197   8.5974   39.431   14.698   25.395   10.600   28.685   6.4438   23.304   5.6412 5.381701 8.564215 
1 1 1   14   11   58 f   18.695   5.2536   16.140   8.3361   34.184   14.604   7.4188   10.153   26.420   6.7555   14.798   5.7931 11.62167 8.899303 
1 1 1   14   11   59 o   26.208   4.1063   30.297   8.4847   15.830   14.753   37.447   10.372   18.976   7.0915   28.963   4.5423 -9.987471 8.421524 
1 1 1   14   11   60 o   20.944   5.5829   20.731   9.7042   25.346   14.628   17.103   12.969   22.508   7.1191   19.156   6.7183 3.352270 9.788605 
1 1 1   14   11   61 f   26.902   4.6651   32.747   9.8596   35.557   15.059   30.639   13.044   26.619   6.8879   24.995   6.3810 1.623703 9.389380 
1 1 1   14   11   62 o   29.427   3.9747   38.156   9.2908   79.582   19.629   26.197   10.547   40.901   6.0715   23.459   5.5944 17.44245 8.255940 
1 1 1   14   11   63 o   65.860   2.3547  181.292   12.621  171.091   22.752  185.826   15.169   61.936   4.5380   66.331   2.8119 -4.394787 5.338499 
1 1 1   14   11   64 f   29.041   4.3167   37.884   9.9083   44.692   18.902   35.304   11.635   28.709   7.8521   27.321   5.4157 1.387680 9.538620 
1 1 1   14   11   65 o   44.083   2.9903   82.939   10.682   72.783   20.057   86.960   12.620   38.093   6.7040   44.788   3.4842 -6.694801 7.555366 
1 1 1   14   11   66 o   15.101   5.6222   9.6608   9.2553   8.8923   18.037   9.9355   10.783   17.019   7.2895   15.571   6.0051 1.447576 9.444473 
1 1 1   14   11   67 o   39.888   3.1917   68.677   10.291   57.816   19.508   72.865   12.114   32.776   7.4688   40.719   3.6896 -7.943436 8.330420 
1 1 1   14   11   68 o   12.195   5.1839   2.6531   8.9992   9.8080   17.698   0.1579   10.451   16.965   7.2424   12.144   5.3678 4.821331 9.014783 
1 1 1   14   11   69 o   30.042   4.0164   40.647   9.5895   54.933   18.656   35.516   11.179   31.771   7.3496   27.191   5.2337 4.579918 9.022615 
1 1 1   14   11   70 o   30.590   3.9231   42.075   9.5572   43.131   18.394   41.685   11.186   27.236   7.8542   29.820   4.7617 -2.583914 9.184902 
1 1 1   14   11   71 o   11.874   5.1905   1.2336   9.5261   18.258   27.029  -1.1810   10.179   19.434   8.6093   11.530   5.1829 7.904671 10.04897 
1 1 1   14   11   72 o   20.101   5.3559   20.226   8.9335   32.387   17.456   15.911   10.399   23.130   7.8063   17.642   6.0242 5.488384 9.860489 
1 1 1   14   11   73 o   13.230   5.3061   6.4289   8.7126   8.8918   16.522   5.4802   10.254   15.956   6.9066   13.396   5.6048 2.560179 8.894651 
1 1 1   14   11   74 o   12.801   5.4100   4.3854   9.7060   1.7257   12.313   8.7513   15.775   13.023   5.7877   15.700   6.7720 -2.676996 8.908288 
1 1 1   14   11   75 o   11.096   5.0791  -2.6663   10.330   6.2687   12.171 -25.6847   19.535   14.137   6.0196   11.688   5.7594 2.449234 8.331077 
1 1 1   14   11   76 o   18.755   6.0358   18.837   10.479   15.321   12.234   28.521   20.305   17.114   6.4448   20.844   8.1829 -3.729959 10.41608 
1 1 1   14   11   77 o   17.385   6.0045   15.947   10.339   11.987   12.177   26.174   19.570   15.868   6.3033   20.205   8.0021 -4.336305 10.18650 
1 1 1   14   11   78 o   10.895   5.0121  -3.0701   10.231   2.7252   12.246 -16.4698   18.621   13.112   5.8024   12.217   5.9343 0.8948812 8.299664 
1 1 1   14   11   79 o   14.866   6.0935   9.4701   11.782   8.1012   14.647   11.980   19.831   15.046   6.5078   16.713   7.3905 -1.666704 9.847323 
1 1 1   14   11   80 o   12.366   5.5447   0.9885   11.567   13.724   14.190 -24.2298   19.969   16.456   6.7095   11.796   5.8148 4.660128 8.878568 
1 1 1   14   11   81 o   18.282   6.4685   18.929   12.042   20.206   14.958   16.576   20.300   18.457   7.0845   17.530   7.6212 0.9273243 10.40540 
1 1 1   14   11   82 o   17.511   6.5111   17.172   12.406   34.050   15.698 -10.9104   20.248   23.296   7.3756   13.181   6.3501 10.11451 9.732637 
1 1 1   14   11   83 o   15.131   6.2068   10.538   12.236   15.793   15.500   1.8479   19.932   16.993   6.9798   14.749   6.8584 2.243279 9.785450 
1 1 1   14   11   84 o   10.644   5.0663  -8.1922   12.062  -5.8258   15.202 -12.2149   19.820   12.257   5.7906   12.835   6.2076 -0.5781956 8.489192 
1 1 1   14   11   85 o   11.258   5.2793  -4.9525   12.224  -1.5441   15.205 -11.1830   20.558   12.934   6.0059   13.110   6.3360 -0.1760464 8.730147 
1 1 1   14   11   86 o   10.230   4.9141 -10.1844   11.926 -15.6909   14.629   0.7249   20.592   10.644   5.1902   14.570   6.8387 -3.926368 8.585252 
1 1 1   14   11   87 o   12.468   5.6382   1.1750   12.253   16.655   15.350 -26.0109   20.342   17.006   6.9611   11.559   5.7288 5.446842 9.015373 
1 1 1   14   11   88 o   12.475   5.6355   1.4085   12.205   1.0928   15.193   1.9829   20.494   13.302   6.1151   14.620   6.8495 -1.318044 9.182096 
1 1 1   14   11   89 o   12.639   5.6819   2.2361   12.235   3.7652   15.197  -0.5809   20.627   13.772   6.2481   14.232   6.7302 -0.4601336 9.183384 
1 1 1   14   11   90 o   21.602   7.4402   31.314   15.870   22.287   20.768   43.983   24.605   18.143   7.7973   22.420   8.9421 -4.277092 11.86417 
1 1 1   14   11   91 o   17.360   7.6100   18.429   20.606   18.429   20.606   0.0000   0.0000   17.360   7.6100  ?   ?  0.000000 7.610043 
1 1 1   14   12  -86 o   18.157   7.7347   22.655   20.110   22.655   20.110   0.0000   0.0000   18.157   7.7347  ?   ?  0.000000 7.734661 
1 1 1   14   12  -85 o   12.382   6.0178 -12.7436   19.227 -12.7436   19.227   0.0000   0.0000   12.382   6.0178  ?   ?  0.000000 6.017816 
1 1 1   14   12  -84 o   16.080   7.1841   12.791   19.232   12.791   19.232   0.0000   0.0000   16.080   7.1841  ?   ?  0.000000 7.184051 
1 1 1   14   12  -83 o   14.309   6.3658   6.6707   14.937 -14.9586   19.716   35.809   22.884   12.314   6.0091   20.865   8.5152 -8.550549 10.42199 
1 1 1   14   12  -82 o   22.310   7.2305   32.165   15.021   36.134   20.317   27.379   22.308   21.709   8.2753   19.156   8.1528 2.553686 11.61676 
1 1 1   14   12  -81 o   13.091   5.9906   1.0947   14.358  -5.2488   19.597   8.4466   21.097   13.479   6.4271   15.718   7.2183 -2.239457 9.664977 
1 1 1   14   12  -80 o   12.674   5.8671  -1.1959   14.341   0.1601   19.154  -2.9255   21.633   14.152   6.6274   14.252   6.7837 -0.1000662 9.483700 
1 1 1   14   12  -79 o   10.374   5.0810 -17.4748   14.484 -43.0923   19.776   12.169   21.274   10.169   5.1267   16.446   7.4337 -6.276505 9.030097 
1 1 1   14   12  -78 o   12.853   5.9387  -1.0019   14.592 -17.1222   19.820   18.076   21.562   12.288   6.0025   17.621   7.7525 -5.333240 9.804700 
1 1 1   14   12  -77 o   24.422   8.4490   43.481   20.474   43.481   20.474   0.0000   0.0000   24.422   8.4490  ?   ?  0.000000 8.448967 
1 1 1   14   12  -76 o   15.686   7.1442   7.4529   20.109   7.4529   20.109   0.0000   0.0000   15.686   7.1442  ?   ?  0.000000 7.144157 
1 1 1   14   12  -75 o   14.297   6.4267   4.4477   15.650   4.4477   15.650   0.0000   0.0000   14.297   6.4267  ?   ?  0.000000 6.426663 
1 1 1   14   12  -74 o   13.341   6.0886   0.7634   14.700   0.7634   14.700   0.0000   0.0000   13.341   6.0886  ?   ?  0.000000 6.088604 
1 1 1   14   12  -73 o   14.224   6.4215   3.4124   15.817   3.4124   15.817   0.0000   0.0000   14.224   6.4215  ?   ?  0.000000 6.421513 
1 1 1   14   12  -72 o   12.739   5.9131  -2.9391   14.717  -2.9391   14.717   0.0000   0.0000   12.739   5.9131  ?   ?  0.000000 5.913107 
1 1 1   14   12  -71 o   16.053   6.3765   12.586   12.461   12.586   12.461   0.0000   0.0000   16.053   6.3765  ?   ?  0.000000 6.376479 
1 1 1   14   12  -70 o   13.602   5.9440   4.2568   12.485   4.2568   12.485   0.0000   0.0000   13.602   5.9440  ?   ?  0.000000 5.943996 
1 1 1   14   12  -69 o   14.414   6.1280   7.0360   12.579   7.0360   12.579   0.0000   0.0000   14.414   6.1280  ?   ?  0.000000 6.127968 
1 1 1   14   12  -68 o   16.066   5.6642   12.894   9.2272  -5.3683   12.592   34.072   13.560   11.583   5.4077   24.809   6.5931 -13.22668 8.527179 
1 1 1   14   12  -67 o   22.270   5.2944   24.895   9.4695   3.6477   16.004   36.341   11.746   14.599   6.5356   26.813   5.5569 -12.21496 8.578609 
1 1 1   14   12  -66 o   62.495   2.4120  165.678   12.264  180.014   21.850  159.084   14.818   62.535   4.3128   60.580   3.0102 1.955055 5.259420 
1 1 1   14   12  -65 o   15.016   5.7906   9.9072   10.026 -18.8896   27.212   14.431   10.785   14.691   7.1447   16.979   6.1090 -2.287715 9.400300 
1 1 1   14   12  -64 o   10.200   4.7527  -5.6221   9.6485 -31.3534   27.075  -1.8792   10.326   13.719   6.7643   11.427   5.1709 2.291883 8.514328 
1 1 1   14   12  -63 o   12.289   5.2854   2.4062   9.5555 -10.2619   27.734   4.1126   10.179   15.901   7.5997   13.095   5.5375 2.805614 9.403139 
1 1 1   14   12  -62 o   14.435   6.3157   3.6342   14.133   30.903   28.443  -5.3052   16.286   22.164   9.3078   13.389   6.2167 8.774977 11.19292 
1 1 1   14   12  -61 o   15.808   6.6291   8.3919   14.395   21.629   28.526   3.8691   16.674   20.636   9.0020   15.332   6.7785 5.303832 11.26875 
1 1 1   14   12  -60 o   11.648   5.1522  -0.2337   9.6447   21.010   28.642  -2.9506   10.243   20.705   9.0265   11.259   5.1165 9.446472 10.37579 
1 1 1   14   12  -59 o   20.719   5.8043   21.281   10.192   2.2190   29.296   23.906   10.871   18.126   8.3892   21.880   5.9428 -3.753590 10.28081 
1 1 1   14   12  -58 o   33.131   4.1550   49.110   10.975   25.701   31.573   52.327   11.705   22.070   9.5502   34.102   4.3065 -12.03236 10.47625 
1 1 1   14   12  -57 o   29.464   4.0444   38.655   9.4574   48.888   17.369   34.343   11.275   30.748   7.0767   26.945   5.3224 3.802626 8.854850 
1 1 1   14   12  -56 o   22.825   5.3335   24.752   9.7438   15.816   22.257   26.871   10.838   19.636   8.2392   23.583   5.7011 -3.946547 10.01937 
1 1 1   14   12  -55 o   28.412   4.4194   36.334   9.9028   39.807   18.591   34.959   11.701   27.109   7.9192   27.209   5.4655 -0.1003666 9.622099 
1 1 1   14   12  -54 o   18.680   5.1596   16.357   8.1161   23.454   14.228   12.934   9.8814   21.572   7.0403   16.908   5.8686 4.664494 9.165513 
1 1 1   14   12  -53 o   43.665   2.5757   80.065   9.1270   94.162   15.830   73.044   11.171   46.244   4.2467   41.284   3.3482 4.959961 5.407826 
1 1 1   14   12  -52 o   29.369   3.5918   37.390   8.4199   44.204   14.821   34.142   10.231   30.343   6.2018   27.461   4.7420 2.882637 7.807017 
1 1 1   14   12  -51 o   25.486   4.1236   28.739   8.2742   30.488   14.557   27.904   10.057   24.718   6.9410   24.579   5.1829 0.1389694 8.662527 
1 1 1   14   12  -50 o   9.9591   4.4925  -2.8522   7.7242 -11.6904   14.342   0.7587   9.1672   11.986   5.6511   11.965   5.1616 0.2129841E-01 7.653575 
1 1 1   14   12  -49 o   15.887   5.2996   11.086   8.0471   6.0728   14.583   13.280   9.6493   15.937   6.6769   17.227   5.8039 -1.290188 8.846822 
1 1 1   14   12  -48 o   9.1064   4.2689  -6.9748   7.9804  -5.6377   14.563  -7.5487   9.5403   13.220   6.0436   10.056   4.6990 3.164045 7.655413 
1 1 1   14   12  -47 o   18.600   5.4114   15.920   8.6966   22.101   18.858   14.251   9.8010   21.706   8.0358   17.772   5.8458 3.934328 9.937192 
1 1 1   14   12  -46 o   21.232   5.1337   20.664   8.7864  -7.1703   18.720   28.529   9.9505   14.789   6.7947   25.070   5.0440 -10.28117 8.462229 
1 1 1   14   12  -45 o   12.088   5.0042   2.7141   8.0511   8.3184   14.456   0.1943   9.6936   16.673   6.7817   12.162   5.2771 4.511285 8.592980 
1 1 1   14   12  -44 o   23.739   4.8058   25.355   8.9800   26.624   19.178   24.999   10.163   23.339   8.1708   23.294   5.4497 0.4530525E-01 9.821508 
1 1 1   14   12  -43 o   17.163   5.3604   13.193   8.3188   17.381   14.664   11.205   10.102   19.799   7.1232   16.479   5.9143 3.319630 9.258470 
1 1 1   14   12  -42 o   12.768   5.1567   4.0541   8.2908  -9.8013   14.394   10.933   10.142   12.463   5.8064   16.382   5.9201 -3.918345 8.292277 
1 1 1   14   12  -41 f   39.404   3.0981   65.456   9.8710   87.980   15.744   50.866   12.671   45.039   4.3420   33.970   4.7018 11.06913 6.400035 
1 1 1   14   12  -40 o   63.978   2.4576  170.012   12.793  177.671   17.839  161.903   18.356   64.866   3.3856   61.729   3.6645 3.136818 4.989060 
1 1 1   14   12  -39 o   34.713   3.4989   51.285   9.7657   47.346   15.154   54.083   12.771   32.080   6.0160   35.156   4.5642 -3.076366 7.551452 
1 1 1   14   12  -38 o   11.009   4.9313  -2.8392   9.1254  -9.0995   14.269   1.4934   11.870   12.582   5.8342   13.766   5.9051 -1.183429 8.301154 
1 1 1   14   12  -37 o   8.7254   4.1793 -10.9198   8.4867   5.7930   14.336 -19.9374   10.530   16.068   6.6670   8.7206   4.2837 7.347405 7.924625 
1 1 1   14   12  -36 o   36.427   3.1710   55.919   9.3222   52.571   15.388   57.861   11.717   34.096   5.7401   36.722   3.9778 -2.625946 6.983619 
1 1 1   14   12  -35 o   64.646   2.1115  172.490   11.112  163.133   17.995  178.258   14.127   62.148   3.5671   65.483   2.6521 -3.335178 4.444956 
1 1 1   14   12  -34 o   56.395   2.3737  131.714   10.888  165.878   19.717  116.726   13.059   62.491   3.8899   52.811   3.0465 9.679821 4.940934 
1 1 1   14   12  -33 o   40.926   3.4251   70.710   11.322   84.900   18.276   61.873   14.422   43.934   5.2041   37.638   4.8106 6.295822 7.086952 
1 1 1   14   12  -32 o   46.933   3.0558   92.181   11.627   94.433   18.558   90.725   14.918   46.537   4.9688   46.132   4.0068 0.4054146 6.383034 
1 1 1   14   12  -31 o   12.556   5.3963   0.5303   9.9472 -11.9590   15.554   9.1732   12.939   12.834   5.9978   16.751   6.5451 -3.917014 8.877630 
1 1 1   14   12  -30 o   27.784   4.1736   33.367   9.1605   13.000   16.485   42.466   11.018   19.073   7.4061   31.299   4.4434 -12.22571 8.636768 
1 1 1   14   12  -29 o   39.751   3.0011   66.078   9.6527   84.308   17.711   58.375   11.513   43.991   5.0292   37.036   3.8707 6.955860 6.346209 
1 1 1   14   12  -28 o   69.968   1.9773  201.435   11.266  204.803   18.524  199.458   14.193   69.990   3.2557   69.423   2.5122 0.5671921 4.112287 
1 1 1   14   12  -27 o   29.375   3.8382   36.857   8.9709   31.233   14.661   40.223   11.342   25.902   6.8425   30.366   4.7367 -4.463654 8.322044 
1 1 1   14   12  -26 o   35.204   3.2513   52.076   9.2248   68.294   15.600   43.355   11.439   39.646   4.9335   31.627   4.5694 8.019083 6.724494 
1 1 1   14   12  -25 f   14.870   5.6373   7.4714   9.3965 -15.4244   18.225   15.761   10.966   13.649   6.4149   19.011   6.1793 -5.362120 8.907041 
1 1 1   14   12  -24 o   35.248   3.5480   52.448   10.055   58.391   19.502   50.296   11.736   35.620   6.9665   34.237   4.2996 1.382328 8.186525 
1 1 1   14   12  -23 o   57.071   2.4646  134.651   11.439  143.009   22.003  131.555   13.391   57.764   4.7138   56.247   2.9307 1.517815 5.550536 
1 1 1   14   12  -22 o   30.931   3.7103   40.595   9.1683   30.655   15.168   46.318   11.509   25.716   7.0339   32.814   4.4146 -7.097525 8.304508 
1 1 1   14   12  -21 o   40.617   2.8835   68.678   9.4850   62.969   15.811   71.887   11.855   37.983   5.2465   41.341   3.5524 -3.358280 6.336030 
1 1 1   14   12  -20 o   40.010   3.3206   67.074   10.732   69.044   16.097   65.497   14.400   39.903   5.0627   39.048   4.6130 0.8548584 6.849147 
1 1 1   14   12  -19 o   44.541   2.7945   82.374   10.095   87.786   18.328   80.017   12.095   45.069   5.0772   43.696   3.4230 1.372688 6.123293 
1 1 1   14   12  -18 o   51.479   2.5521  109.597   10.676  105.515   19.171  111.433   12.854   49.612   4.8004   51.747   3.0610 -2.134426 5.693247 
1 1 1   14   12  -17 f   89.851   1.8959  331.247   13.886  338.211   24.782  328.060   16.766   90.081   3.3809   89.247   2.3065 0.8343887 4.092747 
1 1 1   14   12  -16 o   55.492   2.3905  127.046   10.788  132.707   19.309  124.478   13.007   55.991   4.2627   54.762   2.9244 1.228783 5.169448 
1 1 1   14   12  -15 o   40.605   3.5893   69.258   11.758   71.246   25.974   68.746   13.186   38.801   8.4520   40.284   4.0715 -1.482727 9.381556 
1 1 1   14   12  -14 o   54.954   2.4249  124.606   10.836  120.740   19.426  126.352   13.055   53.301   4.5135   55.190   2.9123 -1.889523 5.371461 
1 1 1   14   12  -13 o   11.942   5.2375  -1.5472   9.7710   24.775   23.832  -6.8661   10.713   24.399   9.0333   11.194   5.1418 13.20503 10.39417 
1 1 1   14   12  -12 o   66.606   2.3684  182.798   12.838  179.669   29.788  183.512   14.227   64.368   5.7373   66.654   2.6237 -2.285919 6.308788 
1 1 1   14   12  -11 f   12.752   5.3987   1.2090   9.6946   23.355   23.665  -3.2571   10.627   24.019   8.9806   12.014   5.3556 12.00556 10.45629 
1 1 1   14   12  -10 o   28.596   4.1373   34.936   9.3640   29.874   16.933   37.167   11.239   25.531   7.5842   29.264   4.8834 -3.733046 9.020465 
1 1 1   14   12   -9 o   39.129   3.1462   63.829   9.9506   36.636   16.978   78.055   12.281   28.214   7.3204   43.180   3.5196 -14.96579 8.122524 
1 1 1   14   12   -8 o   64.691   2.3400  172.345   12.319  191.191   20.146  161.090   15.569   67.642   3.6675   62.306   3.0750 5.336277 4.786034 
1 1 1   14   12   -7 o   28.692   4.4361   35.369   10.041   52.078   16.266   25.082   12.763   34.305   6.0371   23.603   6.4509 10.70244 8.835197 
1 1 1   14   12   -6 o   75.606   2.2123  235.056   13.619  240.231   21.492  231.584   17.605   75.942   3.4811   74.810   2.8925 1.131874 4.526003 
1 1 1   14   12   -5 o   14.481   5.8427   4.7545   10.632   7.0679   15.266   2.5757   14.815   17.213   6.9808   15.771   6.6753 1.442080 9.658743 
1 1 1   14   12   -4 o   25.204   5.6356   28.201   11.287   20.715   16.006   35.607   15.920   21.995   7.4747   27.937   7.0046 -5.941488 10.24380 
1 1 1   14   12   -3 o   35.347   4.1297   52.982   11.675   40.778   16.523   65.151   16.499   29.954   6.9080   38.768   5.3644 -8.814322 8.746300 
1 1 1   14   12   -2 o   19.641   5.5042   16.992   9.1638   21.603   16.053   14.763   11.161   22.340   7.4858   18.758   6.2409 3.581924 9.746034 
1 1 1   14   12   -1 o   70.573   2.1059  204.638   12.101  200.887   20.927  206.522   14.833   69.339   3.7160   70.758   2.5760 -1.418655 4.521568 
1 1 1   14   12    0 o   37.162   3.2703   57.680   9.8056   72.935   17.380   50.556   11.876   41.078   5.3149   34.457   4.3233 6.621601 6.851190 
1 1 1   14   12    1 o   12.788   5.2834   2.5163   8.9502   6.7111   15.987   0.6014   10.802   17.394   7.1103   13.214   5.6499 4.180444 9.081679 
1 1 1   14   12    2 o   36.079   3.3129   54.429   9.6345   35.273   16.962   63.553   11.706   27.714   7.3782   38.881   3.7396 -11.16718 8.271751 
1 1 1   14   12    3 o   37.765   3.2217   59.517   9.8232   56.902   17.449   60.731   11.886   35.838   6.1972   37.949   3.8975 -2.111305 7.320904 
1 1 1   14   12    4 o   64.967   2.4382  173.939   12.890  181.405   20.193  168.806   16.745   65.849   3.7779   63.735   3.2336 2.113579 4.972764 
1 1 1   14   12    5 o   32.184   4.1657   44.071   10.672   43.273   16.693   44.622   13.879   30.905   6.8102   31.901   5.5382 -0.9962120 8.777802 
1 1 1   14   12    6 o   63.907   2.4551  168.356   12.766  181.279   20.204  159.768   16.471   65.818   3.7817   61.982   3.2715 3.835266 5.000388 
1 1 1   14   12    7 o   94.646   1.9016  367.292   14.671  395.697   25.601  353.401   17.903   97.645   3.2208   92.656   2.3723 4.988960 4.000117 
1 1 1   14   12    8 o   42.330   3.1761   74.653   10.879  101.981   18.287   59.684   13.535   48.955   4.6380   37.387   4.5337 11.56765 6.485814 
1 1 1   14   12    9 o   43.458   3.1142   78.612   10.959   72.013   17.893   82.573   13.863   40.683   5.5394   44.296   3.8785 -3.613640 6.762249 
1 1 1   14   12   10 o   45.075   3.0522   84.484   11.148  112.965   18.640   68.622   13.910   51.601   4.4757   40.194   4.3131 11.40751 6.215651 
1 1 1   14   12   11 f   15.195   5.7528   7.6427   9.7773  -0.5514   16.289   12.257   12.224   15.634   6.8116   17.913   6.4958 -2.279154 9.412444 
1 1 1   14   12   12 o   33.822   4.2440   48.753   11.444   57.727   23.458   45.950   13.109   34.971   8.3456   32.507   5.1161 2.463383 9.788993 
1 1 1   14   12   13 o   42.499   3.1289   75.264   10.764   63.809   23.825   78.202   12.065   36.901   8.1396   43.224   3.4530 -6.322968 8.841715 
1 1 1   14   12   14 o   76.657   2.1770  241.709   13.589  241.919   30.521  241.657   15.177   75.240   5.0048   76.561   2.4349 -1.320625 5.565688 
1 1 1   14   12   15 o   55.325   2.4513  126.345   11.027  141.075   20.763  120.557   13.015   57.656   4.4523   53.879   2.9748 3.776432 5.354661 
1 1 1   14   12   16 o   13.490   5.5015   3.6475   9.5439  -8.4920   21.960   6.4742   10.597   16.457   7.4839   15.047   5.9102 1.409968 9.536180 
1 1 1   14   12   17 f   36.976   3.2200   57.203   9.6087   86.145   18.220   46.052   11.309   44.661   5.0959   32.792   4.3371 11.86937 6.691649 
1 1 1   14   12   18 o   51.426   2.5366  109.351   10.601  128.502   19.822  101.680   12.545   54.967   4.4622   49.399   3.1316 5.567768 5.451493 
1 1 1   14   12   19 o   32.427   3.7581   44.550   9.7498   43.643   18.007   44.926   11.597   30.648   7.3106   32.296   4.5293 -1.648886 8.599995 
1 1 1   14   12   20 o   71.120   2.2931  208.477   13.276  214.436   22.144  205.134   16.588   71.432   3.8169   70.312   2.9004 1.120323 4.793858 
1 1 1   14   12   21 o   63.057   2.5081  164.335   12.866  188.251   21.465  150.923   16.073   66.822   3.9584   60.123   3.2922 6.699093 5.148570 
1 1 1   14   12   22 o   18.303   5.6163   14.678   9.1786   1.0048   17.167   20.152   10.862   16.249   7.0366   21.158   6.0144 -4.909479 9.256700 
1 1 1   14   12   23 o   24.890   4.8010   27.221   9.3875   27.209   17.715   27.226   11.070   24.285   7.8506   24.611   5.6390 -0.3259048 9.665941 
1 1 1   14   12   24 o   32.579   4.0114   45.311   10.428   45.922   26.635   45.200   11.333   30.338   9.6078   32.392   4.4063 -2.053255 10.57002 
1 1 1   14   12   25 f   61.669   2.4847  157.288   12.465  172.900   30.583  154.178   13.650   62.487   6.0809   60.954   2.7544 1.533356 6.675644 
1 1 1   14   12   26 o   56.584   2.5914  132.661   11.921  110.860   29.365  136.963   13.044   48.797   7.6323   57.420   2.7953 -8.623234 8.128066 
1 1 1   14   12   27 o   33.532   3.4861   47.517   9.3899   35.228   17.120   52.804   11.230   27.274   7.4783   35.183   3.9857 -7.908934 8.474137 
1 1 1   14   12   28 o   70.074   2.0651  202.217   11.783  217.285   21.165  195.450   14.185   71.882   3.6239   68.711   2.5369 3.171089 4.423625 
1 1 1   14   12   29 o   27.296   4.2768   32.289   9.2036   28.855   16.449   33.854   11.105   24.747   7.5038   27.634   5.1181 -2.887312 9.083065 
1 1 1   14   12   30 o   16.160   5.5482   10.774   8.8228  -1.0940   16.285   15.706   10.497   15.284   6.7304   18.862   6.0381 -3.577615 9.042013 
1 1 1   14   12   31 o   21.790   4.7817   21.110   8.2594   19.389   12.879   22.312   10.765   20.732   6.6930   22.106   5.8744 -1.373425 8.905338 
1 1 1   14   12   32 o   38.300   3.4777   62.006   10.739   67.908   17.614   58.514   13.549   38.984   5.7124   36.699   4.6321 2.285664 7.354393 
1 1 1   14   12   33 o   27.057   4.8348   32.364   10.272   53.287   17.175   20.711   12.817   34.030   6.4270   21.253   6.6561 12.77656 9.252566 
1 1 1   14   12   34 o   14.386   5.6652   6.1580   9.7581  -7.0456   16.383   13.417   12.148   14.050   6.4180   18.052   6.4849 -4.002151 9.123840 
1 1 1   14   12   35 o   40.264   3.4209   68.538   11.122   77.396   18.370   63.412   13.974   41.659   5.5475   38.184   4.5808 3.474789 7.194305 
1 1 1   14   12   36 o   22.275   4.7101   22.120   8.2846   10.234   12.818   30.647   10.857   16.979   6.5475   26.071   5.2897 -9.092237 8.417304 
1 1 1   14   12   37 o   59.762   2.1350  147.559   10.384  169.063   16.651  133.873   13.283   63.432   3.2309   56.601   2.8886 6.830135 4.333865 
1 1 1   14   12   38 o   23.760   4.4240   24.922   8.2532   31.566   12.898   20.316   10.739   26.023   6.1742   20.969   5.9870 5.053123 8.600306 
1 1 1   14   12   39 o   18.447   5.4805   15.404   8.8412   27.514   12.841   4.4882   12.191   24.156   6.4142   14.782   6.1420 9.374022 8.880723 
1 1 1   14   12   40 o   12.184   5.1220   1.9737   8.6268   5.6964   12.578  -1.3325   11.854   15.297   6.2859   12.964   5.7242 2.332074 8.501741 
1 1 1   14   12   41 f   15.057   5.5028   8.8070   8.7966   4.3765   12.679   12.918   12.214   14.919   6.2364   17.713   6.4826 -2.794976 8.995340 
1 1 1   14   12   42 o   19.316   5.1771   17.018   8.3165   21.372   13.172   14.133   10.724   21.302   6.7578   17.927   6.1179 3.375347 9.115733 
1 1 1   14   12   43 o   12.581   5.2198   2.9082   8.7862   17.008   13.150  -8.4637   11.809   19.459   6.7689   11.310   5.2659 8.149343 8.575996 
1 1 1   14   12   44 o   21.592   4.9148   21.142   8.4556   11.469   13.372   27.586   10.915   17.399   6.6932   24.424   5.6017 -7.025112 8.728016 
1 1 1   14   12   45 o   22.775   4.9375   23.522   8.9018   37.343   16.144   17.484   10.671   27.601   7.1264   19.442   6.0709 8.159599 9.361650 
1 1 1   14   12   46 o   24.806   4.6460   27.544   9.0493   48.484   15.604   16.932   11.108   32.164   6.1760   19.173   6.2181 12.99162 8.764050 
1 1 1   14   12   47 o   40.317   2.9222   68.475   9.5386   73.937   16.699   65.830   11.621   40.575   5.1659   39.157   3.6841 1.417927 6.345051 
1 1 1   14   12   48 o   28.678   3.9316   35.848   8.9491   28.104   15.699   39.575   10.892   23.757   7.3549   29.800   4.6345 -6.043123 8.693269 
1 1 1   14   12   49 o   46.387   2.6373   90.137   9.9312   91.607   16.848   89.355   12.294   45.544   4.6011   45.829   3.3134 -0.2853966 5.669952 
1 1 1   14   12   50 o   47.729   2.5333   95.272   9.8208  113.752   16.861   85.783   12.082   51.167   4.0763   44.871   3.3268 6.295700 5.261549 
1 1 1   14   12   51 o   58.591   2.3243  142.985   11.079  153.587   20.552  138.641   13.154   59.243   4.2848   57.404   2.8198 1.838406 5.129367 
1 1 1   14   12   52 o   24.567   4.4352   27.125   8.5553   54.632   14.737   13.143   10.507   34.392   5.4374   17.174   6.0452 17.21762 8.130743 
1 1 1   14   12   53 o   34.372   3.2153   50.557   8.9042   78.949   15.508   36.595   10.875   42.051   4.5992   28.325   4.8867 13.72631 6.710640 
1 1 1   14   12   54 o   29.965   4.0279   39.640   9.5895   39.452   14.885   39.774   12.538   28.193   6.5951   29.119   5.4834 -0.9257374 8.576863 
1 1 1   14   12   55 o   27.386   4.8856   34.476   10.506   33.685   19.223   34.813   12.546   24.763   8.1888   26.860   5.8924 -2.097281 10.08842 
1 1 1   14   12   56 o   29.707   4.5839   40.047   10.744   39.281   19.292   40.391   12.935   26.607   8.1382   29.101   5.6567 -2.493927 9.911009 
1 1 1   14   12   57 o   12.504   5.3786   1.8749   9.8991   4.6261   19.172   0.8747   11.559   16.515   7.2864   12.995   5.6981 3.519846 9.249858 
1 1 1   14   12   58 o   22.525   5.6964   24.819   10.464   23.682   19.922   25.253   12.297   21.133   8.1591   22.275   6.4213 -1.141920 10.38288 
1 1 1   14   12   59 o   10.312   4.7773  -5.3997   9.5349   8.3927   18.299 -10.5397   11.171   16.901   7.2919   10.255   4.8793 6.646447 8.773801 
1 1 1   14   12   60 o   27.115   4.7113   34.154   10.035   17.881   18.388   41.058   11.976   19.176   7.7024   29.422   5.1829 -10.24667 9.283779 
1 1 1   14   12   61 o   20.264   5.6804   20.445   9.7582   20.669   17.758   20.348   11.680   19.822   7.6895   19.882   6.3697 -0.6014633E-01 9.985090 
1 1 1   14   12   62 o   26.223   4.7269   32.239   9.7325   18.784   17.116   38.667   11.831   19.126   7.5117   28.301   5.3238 -9.174942 9.206970 
1 1 1   14   12   63 o   18.243   6.3957   16.964   11.753   27.964   16.527   5.7117   16.716   22.072   7.5929   15.596   6.8450 6.475827 10.22287 
1 1 1   14   12   64 o   23.818   6.1094   29.432   11.918   40.146   17.231   19.606   16.502   26.315   7.6057   19.107   7.4125 7.207640 10.62029 
1 1 1   14   12   65 o   14.271   5.5280   8.5358   9.1675   0.9556   16.810   11.745   10.937   14.459   6.5644   15.892   6.0683 -1.432817 8.939549 
1 1 1   14   12   66 o   34.807   3.5729   54.055   9.9934   53.543   17.943   54.285   12.032   30.768   7.2703   34.124   4.4301 -3.356688 8.513672 
1 1 1   14   12   67 o   18.532   5.6951   17.802   9.4335   23.723   17.353   15.318   11.239   19.923   7.6348   17.199   6.2297 2.724607 9.853944 
1 1 1   14   12   68 o   8.7932   4.2358 -10.3963   9.0059 -34.7683   16.604  -0.2371   10.720   9.8177   4.9145   11.859   5.3259 -2.041273 7.246844 
1 1 1   14   12   69 o   13.005   5.4816   4.9895   9.9216   36.200   16.766 -11.8308   12.308   24.200   7.6173   10.343   4.9746 13.85739 9.097808 
1 1 1   14   12   70 o   15.128   6.3192   9.2946   13.004   4.7467   16.268   17.346   21.644   14.743   6.5954   18.083   7.8654 -3.340249 10.26469 
1 1 1   14   12   71 o   19.915   7.5418   24.528   16.807   32.495   28.215   20.146   20.924   20.796   9.0135   18.579   7.9013 2.216805 11.98640 
1 1 1   14   12   72 o   14.844   6.6393   5.4186   16.475   7.0993   26.870   4.4061   20.855   16.825   7.8695   15.550   7.1542 1.274797 10.63536 
1 1 1   14   12   73 o   14.697   6.5967   5.0489   16.420 -16.2808   26.559   18.244   20.890   14.231   6.9510   17.989   7.7763 -3.758774 10.43010 
1 1 1   14   12   74 o   21.166   6.6323   26.051   12.724   16.555   15.846   43.291   21.350   17.316   7.0786   24.304   8.6117 -6.987339 11.14753 
1 1 1   14   12   75 o   14.579   6.1339   8.5753   12.389   2.0510   15.461   20.276   20.706   13.770   6.2688   18.240   7.8112 -4.469779 10.01565 
1 1 1   14   12   76 o   23.947   6.4293   32.515   12.813   33.316   15.825   30.991   21.831   22.881   7.4220   20.587   8.3485 2.293278 11.17070 
1 1 1   14   12   77 o   18.090   6.6704   19.086   12.971   18.082   16.391   20.770   21.219   17.592   7.1963   18.224   7.8573 -0.6316948 10.65476 
1 1 1   14   12   78 o   13.213   5.8344   3.9394   12.317  -2.4047   15.186   16.137   21.056   12.789   5.9600   17.229   7.6171 -4.440153 9.671732 
1 1 1   14   12   79 o   12.487   5.7862  -1.7411   13.997  -8.7788   18.653   7.3299   21.177   12.846   6.1643   15.642   7.2011 -2.795542 9.479152 
1 1 1   14   12   80 o   17.031   6.8560   16.700   14.603   5.3071   19.458   31.392   22.096   15.010   6.9076   20.264   8.3298 -5.253852 10.82128 
1 1 1   14   12   81 o   18.045   6.9501   19.962   14.431   16.207   19.184   24.858   21.903   16.970   7.3929   18.765   8.0350 -1.794781 10.91856 
1 1 1   14   12   82 o   20.251   7.0622   26.241   14.319   25.077   19.308   27.664   21.343   18.928   7.7841   19.320   8.0848 -0.3922977 11.22303 
1 1 1   14   12   83 o   9.9965   4.9164 -18.4403   14.007 -33.9264   19.486  -1.8866   20.147   10.611   5.3134   13.943   6.6107 -3.332160 8.481404 
1 1 1   14   12   84 o   12.401   5.7711  -1.6922   14.156 -17.9282   19.406   16.777   20.697   11.895   5.8375   16.918   7.5119 -5.022370 9.513414 
1 1 1   14   12   85 o   14.814   6.8794   4.8125   19.950   4.8125   19.950   0.0000   0.0000   14.814   6.8794  ?   ?  0.000000 6.879387 
1 1 1   14   12   86 o   18.174   7.8506   23.018   21.261   23.018   21.261   0.0000   0.0000   18.174   7.8506  ?   ?  0.000000 7.850582 
1 1 1   14   13  -81 o   15.276   7.0523   7.5424   20.513   7.5424   20.513   0.0000   0.0000   15.276   7.0523  ?   ?  0.000000 7.052321 
1 1 1   14   13  -80 o   12.504   6.0553 -10.6223   19.011 -10.6223   19.011   0.0000   0.0000   12.504   6.0553  ?   ?  0.000000 6.055305 
1 1 1   14   13  -79 o   13.831   6.2592   4.6984   15.134 -20.4193   19.586   41.921   23.843   11.671   5.7541   21.795   8.7650 -10.12391 10.48497 
1 1 1   14   13  -78 o   16.857   6.9036   17.154   15.106   1.1030   19.696   40.084   23.542   14.146   6.6548   21.439   8.6783 -7.293094 10.93619 
1 1 1   14   13  -77 o   9.3953   4.6640 -22.6782   13.692 -30.0537   17.761 -11.8762   21.494   10.303   5.1460   13.029   6.3394 -2.726681 8.165144 
1 1 1   14   13  -76 o   13.021   6.0132   0.3610   14.932 -17.9565   19.748   24.819   22.819   12.009   5.8923   18.472   8.0547 -6.463153 9.979847 
1 1 1   14   13  -75 o   14.124   6.3321   5.5500   15.080   9.8108   20.093   0.0548   22.819   15.733   7.1560   14.723   6.9962 1.010000 10.00776 
1 1 1   14   13  -74 o   11.995   5.6633  -5.1781   14.497   2.8573   19.016 -16.3300   22.403   14.462   6.7160   12.923   6.3273 1.539313 9.227095 
1 1 1   14   13  -73 o   11.042   5.3524 -13.1295   14.943 -36.6684   19.876   17.470   22.662   10.590   5.3120   17.335   7.7677 -6.745273 9.410295 
1 1 1   14   13  -72 o   15.047   6.5570   9.1589   15.101   0.2112   20.406   19.992   22.453   14.430   6.7840   17.867   7.8839 -3.436714 10.40089 
1 1 1   14   13  -71 o   21.700   7.3684   30.523   15.553   35.711   20.855   24.023   23.346   21.754   8.3613   18.692   8.1490 3.062763 11.67552 
1 1 1   14   13  -70 o   18.400   7.2017   20.899   15.687   35.877   20.844   1.3309   23.823   21.896   8.3732   15.283   7.2291 6.612254 11.06215 
1 1 1   14   13  -69 o   13.222   6.4155 -13.0760   21.615   0.0000   0.0000 -13.0760   21.615  ?   ?    13.222   6.4155 0.000000 6.415477 
1 1 1   14   13  -68 f   28.625   9.2676   63.456   24.681   0.0000   0.0000   63.456   24.681  ?   ?    28.625   9.2676 0.000000 9.267569 
1 1 1   14   13  -67 o   18.425   8.0703   21.095   23.132   0.0000   0.0000   21.095   23.132  ?   ?    18.425   8.0703 0.000000 8.070298 
1 1 1   14   13  -66 o   20.819   8.4045   31.307   22.012   0.0000   0.0000   31.307   22.012  ?   ?    20.819   8.4045 0.000000 8.404516 
1 1 1   14   13  -65 o   20.305   7.6782   26.549   17.406   7.2735   27.787   38.997   22.329   16.867   7.9253   22.894   8.6876 -6.027534 11.75949 
1 1 1   14   13  -64 o   10.721   5.0660  -7.2269   11.645 -57.5244   27.324   3.9365   12.873   11.713   5.9196   13.570   5.9794 -1.856617 8.413986 
1 1 1   14   13  -63 o   22.208   6.4578   27.680   12.388   28.072   28.294   27.587   13.779   19.979   8.8314   21.664   6.9161 -1.685688 11.21727 
1 1 1   14   13  -62 o   12.904   5.6787   2.7992   11.575 -16.9900   26.848   7.3175   12.829   14.364   7.0099   14.501   6.1775 -0.1371889 9.343465 
1 1 1   14   13  -61 o   22.376   5.9508   26.652   11.041   54.217   28.115   21.626   12.006   25.589   9.7395   19.695   6.4696 5.894463 11.69242 
1 1 1   14   13  -60 o   12.774   5.5056   3.6177   10.411 -11.1827   27.901   6.0119   11.222   15.236   7.3679   13.768   5.8178 1.467094 9.387887 
1 1 1   14   13  -59 o   12.714   5.5273   2.9398   10.677  -8.4404   28.245   4.8372   11.533   15.655   7.5310   13.561   5.8190 2.093752 9.517133 
1 1 1   14   13  -58 o   18.282   6.1550   17.601   10.852   34.875   28.684   14.715   11.723   21.900   9.2799   17.031   6.3301 4.869102 11.23324 
1 1 1   14   13  -57 o   17.580   6.1364   15.865   10.812   44.148   28.416   11.077   11.691   24.087   9.6089   15.736   6.1996 8.351432 11.43526 
1 1 1   14   13  -56 o   9.6052   4.6562 -14.2615   11.315   0.0000   0.0000 -14.2615   11.315  ?   ?    9.6052   4.6562 0.000000 4.656210 
1 1 1   14   13  -55 f   30.042   4.8302   42.594   11.428  -0.5962   28.265   51.034   12.494   17.024   7.9974   32.959   4.7907 -15.93442 9.322539 
1 1 1   14   13  -54 o   44.219   3.0353   84.358   10.875   68.286   17.958   93.664   13.665   36.757   6.2149   46.027   3.6725 -9.269562 7.218901 
1 1 1   14   13  -53 o   14.770   5.6705   9.0824   9.5847   19.267   16.579   3.9694   11.747   19.261   7.4413   13.700   5.8756 5.560991 9.481304 
1 1 1   14   13  -52 o   26.149   5.4864   33.298   11.321  -6.0392   28.823   40.474   12.310   16.805   7.9497   28.962   5.4134 -12.15664 9.617819 
1 1 1   14   13  -51 o   9.9123   4.7059  -9.4209   10.276 -10.5302   27.578  -9.2420   11.073   16.121   7.6694   10.400   4.9219 5.721181 9.112877 
1 1 1   14   13  -50 o   17.519   5.7891   14.825   9.6081   6.0759   17.221   18.779   11.577   16.104   7.0101   19.315   6.3536 -3.211012 9.460938 
1 1 1   14   13  -49 o   11.725   5.1579   0.0365   9.5421   9.7783   17.701  -3.9542   11.329   17.155   7.2803   11.653   5.3282 5.502036 9.021767 
1 1 1   14   13  -48 o   14.210   5.6483   7.0200   9.7842   3.4776   17.964   8.5142   11.667   15.901   7.0325   15.340   6.1442 0.5614443 9.338542 
1 1 1   14   13  -47 o   8.7530   4.2034 -10.7383   8.7104  -4.3046   13.551 -15.2683   11.371   12.722   5.8211   9.6779   4.6858 3.044178 7.472723 
1 1 1   14   13  -46 o   21.797   5.2198   22.482   9.1518   25.713   13.997   20.069   12.096   22.372   6.9477   20.118   6.4857 2.254230 9.504466 
1 1 1   14   13  -45 o   12.048   5.1415   1.8130   8.9146   1.5136   13.602   2.0385   11.803   14.115   6.1854   13.500   5.8404 0.6156368 8.507071 
1 1 1   14   13  -44 o   39.808   3.1337   67.650   10.087   72.269   15.535   64.283   13.263   39.932   4.8734   38.018   4.3583 1.914127 6.537964 
1 1 1   14   13  -43 o   34.694   3.2641   51.605   9.1226   53.398   15.307   50.618   11.361   33.645   5.7900   33.821   4.2119 -0.1761818 7.159844 
1 1 1   14   13  -42 o   24.521   4.8005   27.471   9.2519   22.643   14.396   30.869   12.076   21.342   7.0876   25.360   5.9456 -4.018032 9.251142 
1 1 1   14   13  -41 o   12.707   5.1628   4.1646   8.3680  -4.5238   14.258   8.7292   10.335   13.190   6.0108   15.286   5.8832 -2.095208 8.410769 
1 1 1   14   13  -40 o   9.6825   4.4850  -5.6518   8.3993 -18.9102   14.185   1.5062   10.423   10.824   5.2391   12.837   5.5205 -2.013045 7.610777 
1 1 1   14   13  -39 o   29.327   4.3471   38.122   10.078   57.203   15.485   24.103   13.273   35.204   5.5824   22.179   6.7438 13.02543 8.754498 
1 1 1   14   13  -38 o   24.596   5.0959   27.745   9.8807   27.116   14.904   28.238   13.198   23.340   7.1558   24.067   6.5525 -0.7272892 9.702550 
1 1 1   14   13  -37 o   27.673   5.2161   35.036   11.335   53.703   15.567   13.972   16.536   33.994   5.8276   18.764   7.3791 15.22945 9.402771 
1 1 1   14   13  -36 o   15.337   5.4504   9.7579   8.5579   8.4585   14.800   10.411   10.489   16.722   6.8390   16.131   5.9892 0.5914364 9.090782 
1 1 1   14   13  -35 o   17.196   5.5014   13.330   8.7147   8.5281   14.426   16.090   10.935   16.652   6.7741   18.729   6.1755 -2.077053 9.166555 
1 1 1   14   13  -34 o   25.001   4.9552   28.314   9.7414   62.759   15.590   6.2516   12.477   37.287   5.2764   15.311   6.2726 21.97693 8.196730 
1 1 1   14   13  -33 o   14.583   5.6020   7.4451   9.3582   19.608   15.036  -0.2455   11.956   20.569   7.2323   13.218   5.7956 7.350568 9.267947 
1 1 1   14   13  -32 o   29.005   4.2971   36.961   9.8528   38.454   15.281   35.899   12.890   28.241   6.7332   27.757   5.8801 0.4831905 8.939326 
1 1 1   14   13  -31 o   12.536   5.2087   2.8574   8.7670   22.910   15.258  -7.0269   10.712   21.885   7.2973   10.940   5.0665 10.94494 8.883651 
1 1 1   14   13  -30 o   17.491   5.4906   13.773   8.7165 -14.0637   14.618   29.131   10.858   11.851   5.6222   25.182   5.4483 -13.33093 7.828965 
1 1 1   14   13  -29 o   28.997   3.9669   36.505   9.1311   53.270   15.656   27.862   11.241   34.043   5.8525   24.495   5.7320 9.547630 8.191936 
1 1 1   14   13  -28 o   41.137   2.9327   71.126   9.7695   81.260   16.567   65.723   12.097   42.932   4.8170   39.114   3.8436 3.818714 6.162493 
1 1 1   14   13  -27 o   13.534   5.3768   5.2695   8.8615   2.3100   14.814   6.9185   11.058   15.218   6.5632   15.079   6.0011 0.1387062 8.893196 
1 1 1   14   13  -26 o   37.730   3.1514   60.123   9.6038   39.660   15.752   72.230   12.116   28.766   6.8216   41.140   3.6509 -12.37411 7.737146 
1 1 1   14   13  -25 o   40.036   2.9730   67.374   9.6333   91.670   16.315   54.371   11.936   45.946   4.4103   35.394   4.2201 10.55271 6.104124 
1 1 1   14   13  -24 o   9.4644   4.4389  -7.7526   8.6473  -9.6624   14.616  -6.7240   10.726   12.628   5.8723   11.054   5.1018 1.574334 7.778960 
1 1 1   14   13  -23 o   43.708   2.8229   79.951   10.004   84.695   16.621   77.256   12.527   44.004   4.7067   42.595   3.6428 1.408600 5.951760 
1 1 1   14   13  -22 o   72.809   2.1021  218.947   12.463  228.750   22.159  214.411   15.072   73.408   3.7153   71.812   2.5790 1.596428 4.522665 
1 1 1   14   13  -21 o   18.831   5.6605   16.077   9.3893   29.204   17.188   10.494   11.210   24.508   7.7125   16.557   6.1828 7.951784 9.884760 
1 1 1   14   13  -20 o   22.165   5.6171   22.556   10.160   25.565   22.760   21.807   11.354   23.547   8.8066   21.670   6.1456 1.877127 10.73898 
1 1 1   14   13  -19 o   38.257   3.5629   62.198   10.983   53.811   24.004   64.419   12.352   32.393   8.8440   38.754   3.9659 -6.361576 9.692541 
1 1 1   14   13  -18 o   18.043   6.5476   13.383   12.423   0.0000   0.0000   13.383   12.423  ?   ?    18.043   6.5476 0.000000 6.547590 
1 1 1   14   13  -17 o   37.989   3.5430   61.263   10.845   63.541   25.654   60.768   11.967   35.289   8.9164   37.651   3.9582 -2.361893 9.755492 
1 1 1   14   13  -16 o   34.560   4.6003   52.135   12.638   59.382   25.257   49.714   14.597   34.070   8.9720   33.235   5.5860 0.8351936 10.56885 
1 1 1   14   13  -15 o   31.165   3.8947   41.711   9.6786   54.102   17.390   36.150   11.650   34.193   6.4763   28.420   5.2209 5.772047 8.318687 
1 1 1   14   13  -14 o   18.465   5.6506   15.273   9.2991  -6.8244   16.509   25.542   11.254   14.136   6.4518   23.563   5.8789 -9.426383 8.728549 
1 1 1   14   13  -13 o   22.251   5.2358   22.374   9.3371   43.442   16.941   13.182   11.190   30.290   7.0014   17.742   6.2391 12.54833 9.377976 
1 1 1   14   13  -12 f   10.931   4.9864  -5.0839   9.8456  -4.7998   22.539  -5.1510   10.945   16.923   7.6503   11.597   5.2776 5.326241 9.294105 
1 1 1   14   13  -11 o   37.764   3.2874   60.122   10.019   85.817   18.282   49.092   11.978   44.177   5.1747   33.613   4.4832 10.56354 6.846643 
1 1 1   14   13  -10 o   16.936   5.7568   12.139   9.4942  -5.7062   16.801   20.510   11.508   14.507   6.5769   21.144   6.2451 -6.636757 9.069571 
1 1 1   14   13   -9 f   26.954   4.5571   31.856   9.6560   55.568   17.460   21.410   11.589   34.793   6.3919   21.575   6.2381 13.21759 8.931413 
1 1 1   14   13   -8 o   18.435   5.9303   15.004   10.117   16.437   16.742   14.181   12.697   20.145   7.5493   18.505   6.6318 1.640368 10.04853 
1 1 1   14   13   -7 o   13.543   5.6116   3.3054   10.137   11.254   16.499  -1.5143   12.848   18.484   7.3388   13.538   5.9693 4.945405 9.459929 
1 1 1   14   13   -6 o   42.885   3.2369   77.284   11.232   70.980   17.995   81.307   14.376   39.871   5.6987   43.611   4.0918 -3.739193 7.015534 
1 1 1   14   13   -5 o   28.510   4.7143   35.684   10.573   42.671   16.975   31.255   13.515   30.075   7.0480   25.942   6.4252 4.133085 9.537143 
1 1 1   14   13   -4 o   72.596   2.6187  218.650   15.471  228.377   21.892  208.945   21.867   73.583   3.6613   70.262   3.8324 3.320511 5.300210 
1 1 1   14   13   -3 o   66.106   2.7234  181.603   14.644  179.922   20.690  183.290   20.728   65.137   3.9149   65.765   3.8838 -0.6287308 5.514566 
1 1 1   14   13   -2 o   8.8473   4.3089 -16.7148   9.9986 -36.2752   15.609  -3.1051   13.020   9.8773   4.9161   13.257   5.9177 -3.379409 7.693275 
1 1 1   14   13   -1 o   29.073   4.7611   37.112   10.893   29.039   16.772   43.002   14.326   24.722   7.5929   30.792   5.9225 -6.070221 9.629556 
1 1 1   14   13    0 o   59.529   2.3638  146.604   11.448  150.709   20.024  144.611   13.953   59.452   4.1581   58.896   2.9153 0.5555992 5.078259 
1 1 1   14   13    1 o   10.441   4.7778  -5.2356   9.1324  -8.0402   15.949  -3.8676   11.139   13.704   6.2870   12.040   5.4162 1.663917 8.298331 
1 1 1   14   13    2 o   27.457   4.9703   33.384   10.715   7.8604   16.418   52.320   14.141   17.511   7.1872   34.410   5.2040 -16.89828 8.873418 
1 1 1   14   13    3 o   76.453   2.2739  241.425   14.155  264.177   22.296  226.062   18.321   79.298   3.4576   73.584   3.0612 5.714470 4.617993 
1 1 1   14   13    4 o   56.726   2.6732  133.710   12.326  144.503   19.302  126.279   16.017   58.243   4.0916   54.693   3.6129 3.550499 5.458414 
1 1 1   14   13    5 o   28.800   4.2208   35.910   9.6148   55.925   16.663   25.920   11.772   35.143   6.0341   23.736   6.0632 11.40651 8.554080 
1 1 1   14   13    6 o   30.140   4.3473   39.407   10.372   38.249   16.353   40.186   13.416   28.422   7.0841   29.823   5.7266 -1.401434 9.109218 
1 1 1   14   13    7 o   50.056   2.8188  104.430   11.455  113.286   18.488   98.911   14.594   51.311   4.4646   48.310   3.7350 3.000671 5.820959 
1 1 1   14   13    8 o   16.401   5.8896   10.697   10.019   26.257   16.080   0.8221   12.810   23.611   7.4635   14.116   6.0957 9.494878 9.636441 
1 1 1   14   13    9 f   52.533   2.7741  114.936   11.837  115.728   19.144  114.446   15.062   51.777   4.5832   52.058   3.5710 -0.2812920 5.810103 
1 1 1   14   13   10 o   37.140   3.6527   58.599   10.916   63.593   17.726   55.548   13.854   37.501   6.0011   35.587   4.9062 1.913658 7.751383 
1 1 1   14   13   11 o   57.993   2.5630  139.607   12.086  140.502   19.753  139.071   15.280   57.277   4.2614   57.556   3.2702 -0.2786484 5.371558 
1 1 1   14   13   12 f   10.523   4.9194  -8.7697   10.477  -8.2150   20.768  -8.9590   12.134   15.705   7.1936   11.493   5.3467 4.211699 8.962957 
1 1 1   14   13   13 o   19.391   5.5675   17.019   9.2621   15.233   16.307   17.870   11.253   19.611   7.4283   19.866   6.2390 -0.2549324 9.700776 
1 1 1   14   13   14 o   50.886   2.5875  107.633   10.698  118.167   19.221  102.907   12.876   52.288   4.5550   49.495   3.2087 2.793285 5.571743 
1 1 1   14   13   15 o   12.918   5.3349   3.1144   9.1201 -17.9908   15.867   13.528   11.145   12.018   5.7449   17.867   6.2307 -5.849883 8.474982 
1 1 1   14   13   16 o   20.604   5.8556   19.447   10.296   25.781   25.356   18.196   11.267   23.988   9.2196   19.994   6.2375 3.994442 11.13135 
1 1 1   14   13   17 o   42.549   3.8146   77.196   13.090  100.596   28.551   70.968   14.730   45.594   7.9722   40.412   4.5504 5.182095 9.179432 
1 1 1   14   13   18 o   28.026   4.7361   34.707   10.434   71.188   27.280   28.454   11.293   37.249   9.0703   24.924   5.6849 12.32523 10.70457 
1 1 1   14   13   19 o   36.953   3.5699   58.071   10.620   48.475   23.053   60.656   11.965   30.781   8.7663   37.596   3.9637 -6.814695 9.620792 
1 1 1   14   13   20 o   74.509   2.2362  229.598   13.566  249.429   30.284  224.620   15.174   75.584   4.9424   73.544   2.5349 2.040115 5.554564 
1 1 1   14   13   21 o   25.242   5.6151   29.180   11.255   44.421   23.208   24.492   12.870   29.328   8.9172   22.803   6.5680 6.525021 11.07495 
1 1 1   14   13   22 o   38.704   3.1940   63.210   9.9874   94.125   18.583   50.653   11.843   46.224   5.0120   34.115   4.3582 12.10854 6.641818 
1 1 1   14   13   23 o   14.567   5.5286   7.4728   9.0436  -5.5695   16.555   13.020   10.797   14.305   6.5025   17.496   6.1303 -3.190235 8.936617 
1 1 1   14   13   24 o   14.020   5.4885   6.1320   9.1129  -0.0835   16.670   8.7813   10.883   15.452   6.8068   15.746   6.0431 -0.2938042 9.102338 
1 1 1   14   13   25 o   40.126   3.0607   67.799   9.9358   64.150   17.982   69.403   11.921   37.326   6.1219   40.324   3.6667 -2.997978 7.136007 
1 1 1   14   13   26 o   39.429   3.0981   65.550   9.8775   67.821   17.826   64.544   11.866   38.556   5.8558   38.802   3.8002 -0.2457352 6.980813 
1 1 1   14   13   27 o   10.211   4.6804  -4.9840   8.8136  -5.5568   15.775  -4.7240   10.627   13.908   6.3319   11.425   5.1997 2.483272 8.193272 
1 1 1   14   13   28 o   62.131   2.4655  160.518   12.462  144.916   20.257  170.018   15.807   57.848   4.3272   63.609   3.0575 -5.761173 5.298431 
1 1 1   14   13   29 o   35.547   3.3738   53.750   9.6589   65.666   17.784   48.764   11.503   37.784   5.9723   33.401   4.3265 4.382595 7.374815 
1 1 1   14   13   30 o   32.676   3.6656   45.847   9.5954   37.381   17.367   49.567   11.512   27.404   7.5391   33.688   4.2894 -6.283827 8.673941 
1 1 1   14   13   31 o   25.760   4.4027   29.363   8.9132   47.276   15.163   19.906   11.018   31.870   6.0582   20.614   6.1163 11.25559 8.608828 
1 1 1   14   13   32 o   22.163   5.4075   22.683   9.6812   21.324   15.209   23.610   12.553   21.249   7.2847   22.234   6.5107 -0.9856834 9.770186 
1 1 1   14   13   33 o   13.475   5.4577   4.7012   9.3163   10.344   14.633   0.8546   12.081   17.315   6.8993   13.572   5.8900 3.743553 9.071528 
1 1 1   14   13   34 o   18.973   5.6544   16.633   9.3998   30.657   14.689   6.9069   12.232   25.019   6.9530   15.431   6.2523 9.587830 9.350745 
1 1 1   14   13   35 o   43.905   2.7562   80.883   9.8146   67.802   16.065   88.674   12.397   38.787   5.2128   45.670   3.3534 -6.883129 6.198284 
1 1 1   14   13   36 o   18.564   5.4884   15.912   8.8844   12.987   14.858   17.540   11.085   18.137   7.0342   19.388   6.2047 -1.251314 9.379656 
1 1 1   14   13   37 o   12.625   5.2054   3.4122   8.6635   6.8380   14.608   1.5534   10.760   16.165   6.7206   13.067   5.6142 3.097441 8.757020 
1 1 1   14   13   38 o   12.946   5.4338   2.9065   9.6854 -16.2632   14.384   18.808   13.100   11.316   5.4255   19.960   6.7626 -8.644244 8.669982 
1 1 1   14   13   39 o   10.706   4.9915  -7.6712   10.670 -12.4623   14.575  -2.1373   15.664   11.967   5.6588   14.343   6.4400 -2.375650 8.572944 
1 1 1   14   13   40 o   30.180   4.2764   40.290   10.226   55.344   15.598   28.941   13.543   34.457   5.7562   24.238   6.6533 10.21834 8.797751 
1 1 1   14   13   41 o   24.687   4.7320   27.692   9.1762   11.723   15.206   36.838   11.508   17.628   7.0301   28.301   5.1791 -10.67284 8.731882 
1 1 1   14   13   42 o   20.106   5.3513   19.018   8.9244   29.566   15.000   13.238   11.103   24.114   7.1321   17.280   6.2007 6.833918 9.450679 
1 1 1   14   13   43 o   22.646   5.2269   24.012   9.4530   35.057   14.699   16.223   12.344   26.439   6.7867   18.634   6.5529 7.804567 9.433961 
1 1 1   14   13   44 o   33.757   3.4369   49.199   9.3255   51.406   13.205   47.005   13.171   33.538   4.9813   31.860   5.2547 1.678003 7.240507 
1 1 1   14   13   45 o   34.064   3.4143   50.130   9.3529   59.851   13.217   40.380   13.237   36.498   4.5404   29.062   5.7910 7.436802 7.358751 
1 1 1   14   13   46 o   28.567   4.1079   36.351   9.2910   40.782   13.148   31.932   13.131   29.199   5.7288   25.307   6.3707 3.892057 8.567639 
1 1 1   14   13   47 o   27.373   4.3009   33.758   9.2804   21.332   13.351   45.375   12.909   20.530   6.8256   31.125   5.2765 -10.59465 8.627254 
1 1 1   14   13   48 o   19.584   5.7375   18.715   9.7464   22.909   15.492   15.968   12.539   20.970   7.3436   18.273   6.5853 2.697163 9.863774 
1 1 1   14   13   49 o   14.834   5.8551   8.2342   10.445 -17.2015   19.584   18.346   12.348   13.123   6.3021   19.165   6.5641 -6.041945 9.099693 
1 1 1   14   13   50 o   27.317   5.0813   35.197   10.898   12.081   20.209   44.677   12.942   18.089   7.7311   30.611   5.3830 -12.52148 9.420554 
1 1 1   14   13   51 o   9.3480   4.4903 -11.5344   9.9538 -43.5496   17.920   2.7521   11.970   9.9391   4.9934   13.527   5.8668 -3.587798 7.704159 
1 1 1   14   13   52 o   19.556   5.9340   19.255   10.284   21.163   18.611   18.416   12.339   19.994   7.8388   18.990   6.5596 1.004576 10.22130 
1 1 1   14   13   53 o   10.433   4.9006  -7.4536   10.610 -42.8487   22.982   2.1340   11.961   11.791   5.8837   13.279   5.8101 -1.488140 8.268930 
1 1 1   14   13   54 o   30.210   4.4291   42.050   10.583   43.668   17.860   41.175   13.138   27.659   7.6594   28.753   5.8056 -1.094425 9.611029 
1 1 1   14   13   55 f   15.074   5.7982   9.7879   10.034  -0.9359   16.945   15.580   12.453   14.285   6.5261   17.653   6.5309 -3.367523 9.232711 
1 1 1   14   13   56 o   19.129   5.8662   18.790   10.016   27.522   16.936   14.093   12.421   21.631   7.6693   17.007   6.4733 4.623869 10.03604 
1 1 1   14   13   57 o   14.536   5.6625   8.9457   9.6609   4.6876   16.325   11.241   11.985   15.049   6.6774   15.842   6.2659 -0.7930145 9.156934 
1 1 1   14   13   58 o   15.640   5.8115   11.650   9.8800  -0.7317   16.284   18.864   12.429   13.891   6.3654   18.683   6.5750 -4.791388 9.151449 
1 1 1   14   13   59 o   15.507   5.7831   11.504   9.8006 -15.3576   16.596   25.887   12.144   11.745   5.6804   21.725   6.4153 -9.979759 8.568709 
1 1 1   14   13   60 o   16.976   5.8541   14.883   9.8263  -5.9593   17.072   25.208   12.016   13.150   6.1894   21.374   6.3986 -8.224216 8.902258 
1 1 1   14   13   61 o   12.985   5.4216   5.3115   9.5659 -13.9386   16.448   15.151   11.759   11.795   5.6925   17.011   6.3365 -5.216376 8.517920 
1 1 1   14   13   62 o   13.714   5.9176   5.2275   12.055   21.539   26.635   1.0248   13.520   18.990   8.4713   13.152   5.9372 5.838121 10.34470 
1 1 1   14   13   63 o   15.808   6.2946   12.024   12.172 -19.0502   27.030   19.928   13.632   14.186   6.9469   18.651   6.8448 -4.464417 9.752524 
1 1 1   14   13   64 o   9.2696   4.5311 -15.6761   11.346 -24.2759   26.621 -13.7671   12.543   13.635   6.7199   10.122   4.9058 3.513043 8.320063 
1 1 1   14   13   65 o   12.951   5.7251   2.8314   11.891  -4.2222   27.138   4.5076   13.229   15.496   7.4358   13.782   6.0677 1.714052 9.597297 
1 1 1   14   13   66 o   20.549   7.5595   27.161   16.644   1.9981   26.034   44.556   21.645   15.929   7.5413   24.608   8.6753 -8.678700 11.49489 
1 1 1   14   13   67 o   16.561   7.0713   13.636   16.879   10.251   26.807   15.859   21.726   16.950   7.9059   17.397   7.7120 -0.4465046 11.04435 
1 1 1   14   13   68 f   19.041   8.0822   24.463   21.821   0.0000   0.0000   24.463   21.821  ?   ?    19.041   8.0822 0.000000 8.082239 
1 1 1   14   13   69 o   14.458   6.8035  -0.7912   20.611   0.0000   0.0000  -0.7912   20.611  ?   ?    14.458   6.8035 0.000000 6.803463 
1 1 1   14   13   70 o   16.939   7.7154   13.510   23.458   0.0000   0.0000   13.510   23.458  ?   ?    16.939   7.7154 0.000000 7.715392 
1 1 1   14   13   71 o   15.811   7.3015   7.5522   22.012   0.0000   0.0000   7.5522   22.012  ?   ?    15.811   7.3015 0.000000 7.301531 
1 1 1   14   13   72 o   12.964   6.3084 -13.8189   21.300   0.0000   0.0000 -13.8189   21.300  ?   ?    12.964   6.3084 0.000000 6.308426 
1 1 1   14   13   73 o   11.137   5.3625 -10.8232   14.393   21.019   20.451 -42.0742   20.260   18.001   7.7370   10.355   5.2165 7.646219 9.331310 
1 1 1   14   13   74 o   9.8631   4.8704 -20.7386   14.221 -12.3327   19.566 -30.1534   20.706   12.599   6.1110   11.301   5.6305 1.298166 8.309489 
1 1 1   14   13   75 o   16.850   6.8280   16.499   14.591   30.649   19.876  -0.0371   21.486   20.271   8.0527   14.479   6.8537 5.791410 10.57446 
1 1 1   14   13   76 o   16.372   6.7585   15.085   14.628  -3.0362   19.682   37.450   21.865   13.670   6.4965   21.471   8.4724 -7.800761 10.67647 
1 1 1   14   13   77 o   14.517   6.3203   8.5311   14.004  -3.9151   18.272   26.248   21.801   13.188   6.2651   18.759   8.0239 -5.570957 10.18010 
1 1 1   14   13   78 o   8.9632   4.4878 -28.0950   13.886  -5.5855   19.025 -53.7605   20.315   13.108   6.2728   9.6148   4.8853 3.493073 7.950725 
1 1 1   14   13   79 o   22.354   7.1623   32.626   14.767   34.659   19.235   29.708   23.044   21.281   8.0661   19.248   8.2417 2.033091 11.53200 
1 1 1   14   13   80 o   17.365   7.5603   19.569   20.035   19.569   20.035   0.0000   0.0000   17.365   7.5603  ?   ?  0.000000 7.560284 
1 1 1   14   13   81 o   17.700   7.5398   20.734   19.109   20.734   19.109   0.0000   0.0000   17.700   7.5398  ?   ?  0.000000 7.539830 
1 1 1   14   14    0 o   68.898   3.1331  196.975   17.550  207.134   31.617  192.451   21.099   69.307   5.6453   67.803   3.8332 1.503586 6.823663 
1 1 1   14   14    1 o   60.210   2.4125  150.804   11.817  161.877   20.993  145.669   14.297   61.123   4.2397   58.857   2.9897 2.266113 5.187820 
1 1 1   14   14    2 o   47.085   2.8003   92.984   10.699  112.669   19.329   84.288   12.847   50.569   4.7444   44.426   3.5778 6.142712 5.942243 
1 1 1   14   14    3 o   10.622   4.8455  -4.4964   9.2983   17.532   17.048 -13.8239   11.094   20.096   7.5991   9.9022   4.7523 10.19414 8.962708 
1 1 1   14   14    4 o   20.939   5.5355   20.366   9.5901   24.797   17.674   18.516   11.417   22.571   7.8477   19.910   6.2884 2.660734 10.05641 
1 1 1   14   14    5 o   24.992   4.8496   28.170   9.5232   40.350   17.458   23.010   11.362   28.440   7.4450   22.047   6.1108 6.392637 9.631709 
1 1 1   14   14    6 o   27.555   4.4948   33.681   9.7481   58.074   17.643   22.963   11.695   35.085   6.4051   21.983   6.2383 13.10234 8.941021 
1 1 1   14   14    7 o   32.237   3.8610   44.978   9.9444   85.752   18.342   28.002   11.835   43.683   5.2564   24.359   6.0003 19.32455 7.977043 
1 1 1   14   14    8 o   39.801   3.5084   67.658   11.266   85.458   26.945   63.887   12.402   40.884   8.3672   38.396   4.0222 2.487911 9.283761 
1 1 1   14   14    9 o   56.615   3.0456  135.034   14.003  143.721   28.362  132.234   16.103   55.507   6.3845   55.689   3.5661 -0.1826134 7.312893 
1 1 1   14   14   10 o   45.955   3.5564   90.188   13.219  157.318   28.378   71.585   14.938   58.451   6.0430   40.276   4.6345 18.17477 7.615521 
1 1 1   14   14   11 o   23.837   6.1310   27.007   11.980   31.573   25.328   25.691   13.597   24.748   9.2830   23.001   6.7872 1.747257 11.49958 
1 1 1   14   14   12 o   39.565   3.2507   66.478   10.392   66.728   18.178   66.357   12.665   37.845   6.1000   39.116   4.0297 -1.270851 7.310802 
1 1 1   14   14   13 o   22.275   5.8322   23.363   10.712   28.153   17.000   20.208   13.796   23.714   7.6925   20.659   6.9398 3.055231 10.36032 
1 1 1   14   14   14 o   45.702   2.8583   87.827   10.595  106.810   19.194   79.508   12.706   49.056   4.8638   43.058   3.6547 5.998638 6.083849 
1 1 1   14   14   15 o   13.707   5.4859   5.4354   9.2925   19.396   16.863  -0.6531   11.136   20.575   7.6020   12.654   5.5692 7.920712 9.423725 
1 1 1   14   14   16 o   39.063   3.2407   64.865   10.226   74.918   18.647   60.542   12.229   40.263   5.8528   37.282   4.0912 2.981182 7.140957 
1 1 1   14   14   17 o   11.116   4.9799  -2.4895   9.3095 -33.5259   16.929   10.965   11.146   10.601   5.2491   16.507   6.1650 -5.905673 8.096991 
1 1 1   14   14   18 o   32.146   3.8568   44.865   9.9046   48.387   18.308   43.408   11.777   31.119   7.3376   31.113   4.7977 0.6158829E-02 8.766883 
1 1 1   14   14   19 o   34.476   3.7121   51.337   10.268   90.152   19.197   35.780   12.153   44.531   5.3986   27.752   5.5660 16.77910 7.754018 
1 1 1   14   14   20 o   24.630   5.0566   27.792   9.8119   33.051   18.264   25.658   11.633   25.247   7.9508   23.147   6.0860 2.100031 10.01271 
1 1 1   14   14   21 o   65.683   2.4924  180.106   13.321  185.939   22.271  176.857   16.622   65.339   4.2038   64.621   3.1651 0.7174454 5.262118 
1 1 1   14   14   22 o   18.226   6.3475   15.089   11.565   13.499   17.711   16.271   15.270   18.768   7.5522   19.178   7.2048 -0.4093647 10.43768 
1 1 1   14   14   23 o   17.666   6.0257   14.161   10.403   4.9191   17.576   19.145   12.907   16.544   7.1420   20.021   6.7123 -3.477657 9.801234 
1 1 1   14   14   24 o   13.617   5.9596   0.6418   12.591   0.0000   0.0000   0.6418   12.591  ?   ?    13.617   5.9596 0.000000 5.959635 
1 1 1   14   14   25 o   21.840   6.4924   23.330   12.405   35.109   19.689   15.578   15.973   25.614   8.2762   18.989   7.3126 6.625549 11.04399 
1 1 1   14   14   26 o   26.601   5.7283   33.487   12.054   29.601   18.795   36.201   15.710   23.739   8.0993   26.754   7.0905 -3.014730 10.76443 
1 1 1   14   14   27 o   26.585   5.8564   33.715   12.348   54.150   19.799   20.707   15.796   32.375   7.6285   20.619   7.3963 11.75574 10.62539 
1 1 1   14   14   28 o   29.639   4.2706   39.086   10.021   39.784   15.348   38.568   13.229   28.240   6.7578   28.413   5.9048 -0.1730614 8.974118 
1 1 1   14   14   29 o   47.879   2.8020   96.809   10.888  102.162   16.373   92.566   14.579   48.158   4.2132   46.057   3.9205 2.100842 5.755093 
1 1 1   14   14   30 o   33.574   3.4590   48.723   9.3311   19.554   15.099   66.746   11.869   20.035   7.2256   39.146   3.7659 -19.11068 8.148102 
1 1 1   14   14   31 o   20.915   5.2418   20.670   8.9182   42.307   14.861   8.4926   11.149   29.302   6.4013   15.312   6.0474 13.99003 8.806107 
1 1 1   14   14   32 o   8.6323   4.1584 -11.4020   8.6810 -27.8866   14.364  -1.9154   10.896   9.7805   4.8415   12.009   5.3832 -2.228601 7.240102 
1 1 1   14   14   33 o   19.746   5.7443   18.889   9.7998   27.185   14.538   11.980   13.267   22.883   7.0764   17.005   6.6325 5.878160 9.698748 
1 1 1   14   14   34 o   21.474   5.5743   22.282   9.8418   27.763   14.823   17.961   13.161   23.022   7.1501   19.163   6.7640 3.859203 9.842489 
1 1 1   14   14   35 o   17.415   6.0468   14.274   10.491   11.903   14.449   16.919   15.258   17.139   6.8469   18.882   7.1777 -1.742571 9.919633 
1 1 1   14   14   36 o   33.599   3.7670   49.697   10.140   77.780   15.498   28.681   13.407   41.331   4.6826   23.585   6.6747 17.74607 8.153410 
1 1 1   14   14   37 o   17.368   5.7653   14.439   9.5262   19.968   14.210   9.9254   12.838   19.787   7.0242   16.054   6.4402 3.733477 9.529698 
1 1 1   14   14   38 o   37.825   3.4304   62.290   10.462   49.330   15.678   72.692   14.047   31.334   6.3559   40.121   4.3653 -8.787317 7.710556 
1 1 1   14   14   39 o   13.522   5.4717   5.8929   9.3551  -2.3600   13.990   12.568   12.582   13.150   5.9774   16.810   6.4857 -3.660325 8.820065 
1 1 1   14   14   40 o   17.755   5.7633   15.464   9.5414 -14.3814   13.857   42.375   13.158   10.995   5.2856   29.436   5.6894 -18.44132 7.765765 
1 1 1   14   14   41 o   13.885   5.7202   5.9794   10.451  -3.6614   17.655   11.180   12.967   14.184   6.5461   16.304   6.4954 -2.120698 9.221807 
1 1 1   14   14   42 o   13.009   5.5452   3.5028   10.348   23.186   17.197  -7.6690   12.956   20.479   7.6560   11.585   5.4333 8.894693 9.388032 
1 1 1   14   14   43 o   25.378   5.4398   31.588   10.915  -4.1389   17.162   55.855   14.144   13.850   6.4139   34.132   5.2519 -20.28180 8.289782 
1 1 1   14   14   44 o   15.031   6.1842   8.2057   12.194   3.4248   16.950   13.333   17.554   15.138   6.7550   17.524   7.3326 -2.386675 9.969785 
1 1 1   14   14   45 o   26.740   5.7809   35.975   12.233   12.085   16.546   64.773   18.167   16.986   7.1140   35.221   6.5692 -18.23470 9.683187 
1 1 1   14   14   46 o   16.091   6.0564   12.208   10.800   2.9886   15.987   19.948   14.648   14.662   6.5502   19.153   7.0838 -4.490775 9.648100 
1 1 1   14   14   47 o   19.523   5.9028   19.834   10.189  -7.5608   16.128   38.031   13.144   12.740   6.0024   27.047   6.1070 -14.30641 8.562966 
1 1 1   14   14   48 o   21.056   5.8587   23.138   10.422   1.9295   16.573   37.012   13.404   14.473   6.5498   26.370   6.3186 -11.89611 9.100801 
1 1 1   14   14   49 o   9.5422   4.5551  -9.2442   9.9005 -19.3945   15.871  -2.7776   12.668   10.988   5.3684   12.147   5.5839 -1.158985 7.745893 
1 1 1   14   14   50 o   21.727   5.7719   24.714   10.395   18.035   16.889   28.787   13.189   18.147   7.3488   22.588   6.6893 -4.441193 9.937362 
1 1 1   14   14   51 o   15.732   5.8552   12.191   10.037   22.695   16.116   5.5358   12.828   19.496   7.3847   14.057   6.0850 5.439536 9.568762 
1 1 1   14   14   52 o   22.882   6.2163   28.571   11.893   57.678   28.230   22.290   13.114   26.241   9.8091   19.696   6.7641 6.544783 11.91517 
1 1 1   14   14   53 o   20.548   6.4294   23.746   11.962   57.871   27.731   15.945   13.259   26.312   9.7439   17.225   6.6546 9.087393 11.79950 
1 1 1   14   14   54 o   20.776   6.4172   24.344   11.959   45.370   27.585   19.478   13.272   23.247   9.4000   18.462   6.7572 4.785454 11.57666 
1 1 1   14   14   55 o   17.400   6.9882   16.602   15.134   0.0000   0.0000   16.602   15.134  ?   ?    17.400   6.9882 0.000000 6.988198 
1 1 1   14   14   56 o   19.522   7.1621   23.166   14.923   0.0000   0.0000   23.166   14.923  ?   ?    19.522   7.1621 0.000000 7.162109 
1 1 1   14   14   57 o   18.813   7.0994   21.266   14.863   0.0000   0.0000   21.266   14.863  ?   ?    18.813   7.0994 0.000000 7.099358 
1 1 1   14   14   58 o   14.362   6.3122   6.2281   14.261   0.0000   0.0000   6.2281   14.261  ?   ?    14.362   6.3122 0.000000 6.312244 
1 1 1   14   14   59 o   10.381   5.0581 -15.4998   13.817   0.0000   0.0000 -15.4998   13.817  ?   ?    10.381   5.0581 0.000000 5.058059 
1 1 1   14   14   60 o   12.866   5.9240  -0.5577   14.339   0.0000   0.0000  -0.5577   14.339  ?   ?    12.866   5.9240 0.000000 5.923995 
1 1 1   14   14   61 o   12.202   5.7106  -3.8003   14.182   0.0000   0.0000  -3.8003   14.182  ?   ?    12.202   5.7106 0.000000 5.710599 
1 1 1   14   14   62 o   25.276   9.1371   52.510   24.162   0.0000   0.0000   52.510   24.162  ?   ?    25.276   9.1371 0.000000 9.137079 
1 1 1   14   14   63 o   21.856   8.9171   40.787   25.086   0.0000   0.0000   40.787   25.086  ?   ?    21.856   8.9171 0.000000 8.917122 
1 1 1   14   14   64 o   12.854   6.2942 -16.8786   22.181   0.0000   0.0000 -16.8786   22.181  ?   ?    12.854   6.2942 0.000000 6.294157 
1 1 1   14   14   65 o   16.339   7.5427   11.211   23.463   0.0000   0.0000   11.211   23.463  ?   ?    16.339   7.5427 0.000000 7.542678 
1 1 1   14   14   66 o   13.991   6.7800  -8.3000   23.942   0.0000   0.0000  -8.3000   23.942  ?   ?    13.991   6.7800 0.000000 6.780026 
1 1 1   14   14   67 o   16.806   7.6701   15.106   23.332   0.0000   0.0000   15.106   23.332  ?   ?    16.806   7.6701 0.000000 7.670073 
1 1 1   14   14   68 o   15.207   7.1677   4.3214   23.045   0.0000   0.0000   4.3214   23.045  ?   ?    15.207   7.1677 0.000000 7.167716 
1 1 1   14   14   69 o   11.356   5.6921 -35.7911   22.639   0.0000   0.0000 -35.7911   22.639  ?   ?    11.356   5.6921 0.000000 5.692099 
1 1 1   14   14   70 o   15.465   7.2558   7.0941   23.141   0.0000   0.0000   7.0941   23.141  ?   ?    15.465   7.2558 0.000000 7.255808 
1 1 1   14   14   71 o   23.898   9.0383   51.263   24.120   0.0000   0.0000   51.263   24.120  ?   ?    23.898   9.0383 0.000000 9.038304 
1 1 1   14   14   72 o   17.803   7.0537   20.684   15.212   2.8943   20.495   42.505   22.699   14.453   6.7961   22.109   8.6602 -7.655849 11.00845 
1 1 1   14   14   73 o   13.269   6.3608  -5.1272   19.750  -5.1272   19.750   0.0000   0.0000   13.269   6.3608  ?   ?  0.000000 6.360763 
1 1 1   14   14   74 o   16.268   7.3167   14.361   20.314   14.361   20.314   0.0000   0.0000   16.268   7.3167  ?   ?  0.000000 7.316668 
1 1 1   15    0 -120 o   10.506   7.3603 -11.4796   23.714 -11.4796   23.714 -11.4796   23.714   10.506   7.3603   10.506   7.3603 0.000000 0.000000 
1 1 1   15    0 -119 o   14.774   9.5724   16.558   27.275   16.558   27.275   16.558   27.275   14.774   9.5724   14.774   9.5724 0.000000 0.000000 
1 1 1   15    0 -118 o   21.657   11.523   45.859   27.527   45.859   27.527   45.859   27.527   21.657   11.523   21.657   11.523 0.000000 0.000000 
1 1 1   15    0 -117 o   9.5430   6.8745 -30.8951   26.641 -30.8951   26.641 -30.8951   26.641   9.5430   6.8745   9.5430   6.8745 0.000000 0.000000 
1 1 1   15    0 -116 o   9.2238   6.5967 -23.3156   22.702 -23.3156   22.702 -23.3156   22.702   9.2238   6.5967   9.2238   6.5967 0.000000 0.000000 
1 1 1   15    0 -115 o   12.999   8.1294   10.975   17.700   10.975   17.700   10.975   17.700   12.999   8.1294   12.999   8.1294 0.000000 0.000000 
1 1 1   15    0 -114 f   17.413   9.4518   25.400   18.865   25.400   18.865   25.400   18.865   17.413   9.4518   17.413   9.4518 0.000000 0.000000 
1 1 1   15    0 -113 o   7.8156   5.5187 -12.9124   14.160 -12.9124   14.160 -12.9124   14.160   7.8156   5.5187   7.8156   5.5187 0.000000 0.000000 
1 1 1   15    0 -112 o   13.290   7.8357   12.604   14.486   12.604   14.486   12.604   14.486   13.290   7.8357   13.290   7.8357 0.000000 0.000000 
1 1 1   15    0 -111 o   25.089   8.0620   36.952   14.545   36.952   14.545   36.952   14.545   25.089   8.0620   25.089   8.0620 0.000000 0.000000 
1 1 1   15    0 -110 o   18.302   8.5015   23.972   14.055   23.972   14.055   23.972   14.055   18.302   8.5015   18.302   8.5015 0.000000 0.000000 
1 1 1   15    0 -109 o   25.345   8.0426   37.230   14.617   37.230   14.617   37.230   14.617   25.345   8.0426   25.345   8.0426 0.000000 0.000000 
1 1 1   15    0 -108 o   22.088   8.3666   30.771   14.134   30.771   14.134   30.771   14.134   22.088   8.3666   22.088   8.3666 0.000000 0.000000 
1 1 1   15    0 -107 o   12.670   8.0243   8.1948   17.851   8.1948   17.851   8.1948   17.851   12.670   8.0243   12.670   8.0243 0.000000 0.000000 
1 1 1   15    0 -106 o   16.823   8.3975   20.495   14.020   20.495   14.020   20.495   14.020   16.823   8.3975   16.823   8.3975 0.000000 0.000000 
1 1 1   15    0 -105 o   12.844   7.5726   10.653   13.530   10.653   13.530   10.653   13.530   12.844   7.5726   12.844   7.5726 0.000000 0.000000 
1 1 1   15    0 -104 o   40.111   4.5193   71.242   14.295   71.242   14.295   71.242   14.295   40.111   4.5193   40.111   4.5193 0.000000 0.000000 
1 1 1   15    0 -103 o   14.270   7.8545   14.048   13.218   14.048   13.218   14.048   13.218   14.270   7.8545   14.270   7.8545 0.000000 0.000000 
1 1 1   15    0 -102 o   19.604   8.7487   25.689   14.839   25.689   14.839   25.689   14.839   19.604   8.7487   19.604   8.7487 0.000000 0.000000 
1 1 1   15    0 -101 o   11.417   7.2636   4.2123   14.820   4.2123   14.820   4.2123   14.820   11.417   7.2636   11.417   7.2636 0.000000 0.000000 
1 1 1   15    0 -100 o   18.798   8.2176   22.726   13.102   22.726   13.102   22.726   13.102   18.798   8.2176   18.798   8.2176 0.000000 0.000000 
1 1 1   15    0  -99 o   17.784   8.1768   20.682   12.984   20.682   12.984   20.682   12.984   17.784   8.1768   17.784   8.1768 0.000000 0.000000 
1 1 1   15    0  -98 o   8.0500   5.5271  -6.8236   11.736  -6.8236   11.736  -6.8236   11.736   8.0500   5.5271   8.0500   5.5271 0.000000 0.000000 
1 1 1   15    0  -97 o   23.033   7.6331   29.303   12.743   29.303   12.743   29.303   12.743   23.033   7.6331   23.033   7.6331 0.000000 0.000000 
1 1 1   15    0  -96 o   14.073   8.4828   10.709   17.702   10.709   17.702   10.709   17.702   14.073   8.4828   14.073   8.4828 0.000000 0.000000 
1 1 1   15    0  -95 o   31.719   5.7470   46.401   13.414   46.401   13.414   46.401   13.414   31.719   5.7470   31.719   5.7470 0.000000 0.000000 
1 1 1   15    0  -94 o   22.984   7.7241   29.131   12.921   29.131   12.921   29.131   12.921   22.984   7.7241   22.984   7.7241 0.000000 0.000000 
1 1 1   15    0  -93 o   15.943   7.8031   16.396   12.004   16.396   12.004   16.396   12.004   15.943   7.8031   15.943   7.8031 0.000000 0.000000 
1 1 1   15    0  -92 o   45.582   3.9236   88.130   14.320   88.130   14.320   88.130   14.320   45.582   3.9236   45.582   3.9236 0.000000 0.000000 
1 1 1   15    0  -91 o   9.5282   6.2057  -0.1864   11.671  -0.1864   11.671  -0.1864   11.671   9.5282   6.2057   9.5282   6.2057 0.000000 0.000000 
1 1 1   15    0  -90 o   31.950   5.6778   46.588   13.396   46.588   13.396   46.588   13.396   31.950   5.6778   31.950   5.6778 0.000000 0.000000 
1 1 1   15    0  -89 o   16.117   8.0316   16.645   12.815   16.645   12.815   16.645   12.815   16.117   8.0316   16.117   8.0316 0.000000 0.000000 
1 1 1   15    0  -88 o   18.373   7.9960   20.640   12.409   20.640   12.409   20.640   12.409   18.373   7.9960   18.373   7.9960 0.000000 0.000000 
1 1 1   15    0  -87 o   10.860   6.9109   2.2355   13.427   2.2355   13.427   2.2355   13.427   10.860   6.9109   10.860   6.9109 0.000000 0.000000 
1 1 1   15    0  -86 o   54.004   3.8672  122.237   16.820  122.237   16.820  122.237   16.820   54.004   3.8672   54.004   3.8672 0.000000 0.000000 
1 1 1   15    0  -85 o   11.467   7.1952   3.6685   13.989   3.6685   13.989   3.6685   13.989   11.467   7.1952   11.467   7.1952 0.000000 0.000000 
1 1 1   15    0  -84 o   48.717   3.7603   99.479   14.723   99.479   14.723   99.479   14.723   48.717   3.7603   48.717   3.7603 0.000000 0.000000 
1 1 1   15    0  -83 o   69.837   3.0470  201.223   17.270  201.223   17.270  201.223   17.270   69.837   3.0470   69.837   3.0470 0.000000 0.000000 
1 1 1   15    0  -82 o   37.153   2.0074   56.899   6.0387   56.899   6.0387   56.899   6.0387   37.153   2.0074   37.153   2.0074 0.000000 0.000000 
1 1 1   15    0  -81 o  123.801   1.7035  626.144   17.184  626.144   17.184  626.144   17.184  123.801   1.7035  123.801   1.7035 0.000000 0.000000 
1 1 1   15    0  -80 o   10.303   5.5834   6.2494   6.5722   6.2494   6.5722   6.2494   6.5722   10.303   5.5834   10.303   5.5834 0.000000 0.000000 
1 1 1   15    0  -79 o   64.690   2.2473  171.626   11.818  171.626   11.818  171.626   11.818   64.690   2.2473   64.690   2.2473 0.000000 0.000000 
1 1 1   15    0  -78 o   49.319   2.5860  100.268   10.330  100.268   10.330  100.268   10.330   49.319   2.5860   49.319   2.5860 0.000000 0.000000 
1 1 1   15    0  -77 o   30.217   4.2108   39.586   9.7961   39.586   9.7961   39.586   9.7961   30.217   4.2108   30.217   4.2108 0.000000 0.000000 
1 1 1   15    0  -76 o   18.114   8.5227   20.088   14.157   20.088   14.157   20.088   14.157   18.114   8.5227   18.114   8.5227 0.000000 0.000000 
1 1 1   15    0  -75 o   79.399   3.0813  259.030   19.874  259.030   19.874  259.030   19.874   79.399   3.0813   79.399   3.0813 0.000000 0.000000 
1 1 1   15    0  -74 o   7.7550   5.1711  -2.7846   8.8837  -2.7846   8.8837  -2.7846   8.8837   7.7550   5.1711   7.7550   5.1711 0.000000 0.000000 
1 1 1   15    0  -73 o  101.464   2.1968  420.858   18.150  420.858   18.150  420.858   18.150  101.464   2.1968  101.464   2.1968 0.000000 0.000000 
1 1 1   15    0  -72 f  140.382   2.8249  806.174   32.296  806.174   32.296  806.174   32.296  140.382   2.8249  140.382   2.8249 0.000000 0.000000 
1 1 1   15    0  -71 o   13.573   7.2481   10.947   10.926   10.947   10.926   10.947   10.926   13.573   7.2481   13.573   7.2481 0.000000 0.000000 
1 1 1   15    0  -70 o   19.505   7.3620   21.147   10.962   21.147   10.962   21.147   10.962   19.505   7.3620   19.505   7.3620 0.000000 0.000000 
1 1 1   15    0  -69 o   49.733   3.7340  102.850   14.937  102.850   14.937  102.850   14.937   49.733   3.7340   49.733   3.7340 0.000000 0.000000 
1 1 1   15    0  -68 o  103.497   2.8625  438.435   24.108  438.435   24.108  438.435   24.108  103.497   2.8625  103.497   2.8625 0.000000 0.000000 
1 1 1   15    0  -67 o   93.481   2.8841  357.849   21.930  357.849   21.930  357.849   21.930   93.481   2.8841   93.481   2.8841 0.000000 0.000000 
1 1 1   15    0  -66 o   16.171   7.4581   15.689   10.806   15.689   10.806   15.689   10.806   16.171   7.4581   16.171   7.4581 0.000000 0.000000 
1 1 1   15    0  -65 o   9.5362   6.0342   1.4430   10.070   1.4430   10.070   1.4430   10.070   9.5362   6.0342   9.5362   6.0342 0.000000 0.000000 
1 1 1   15    0  -64 o   40.480   3.3968   68.329   11.020   68.329   11.020   68.329   11.020   40.480   3.3968   40.480   3.3968 0.000000 0.000000 
1 1 1   15    0  -63 o   82.843   2.2400  280.591   15.102  280.591   15.102  280.591   15.102   82.843   2.2400   82.843   2.2400 0.000000 0.000000 
1 1 1   15    0  -62 o   15.516   7.1708   14.419   9.9922   14.419   9.9922   14.419   9.9922   15.516   7.1708   15.516   7.1708 0.000000 0.000000 
1 1 1   15    0  -61 o  140.827   2.1196  809.476   24.320  809.476   24.320  809.476   24.320  140.827   2.1196  140.827   2.1196 0.000000 0.000000 
1 1 1   15    0  -60 o   17.337   7.2612   17.383   10.290   17.383   10.290   17.383   10.290   17.337   7.2612   17.337   7.2612 0.000000 0.000000 
1 1 1   15    0  -59 o   98.095   2.1851  393.056   17.453  393.056   17.453  393.056   17.453   98.095   2.1851   98.095   2.1851 0.000000 0.000000 
1 1 1   15    0  -58 o   76.667   2.3556  240.433   14.690  240.433   14.690  240.433   14.690   76.667   2.3556   76.667   2.3556 0.000000 0.000000 
1 1 1   15    0  -57 o  149.154   2.1482  907.875   26.106  907.875   26.106  907.875   26.106  149.154   2.1482  149.154   2.1482 0.000000 0.000000 
1 1 1   15    0  -56 f   98.284   2.2052  394.552   17.647  394.552   17.647  394.552   17.647   98.284   2.2052   98.284   2.2052 0.000000 0.000000 
1 1 1   15    0  -55 o  195.319   2.3099  1556.58   36.765  1556.58   36.765  1556.58   36.765  195.319   2.3099  195.319   2.3099 0.000000 0.000000 
1 1 1   15    0  -54 f   91.115   2.2896  339.217   16.981  339.217   16.981  339.217   16.981   91.115   2.2896   91.115   2.2896 0.000000 0.000000 
1 1 1   15    0  -53 o   19.345   7.5891   21.037   11.459   21.037   11.459   21.037   11.459   19.345   7.5891   19.345   7.5891 0.000000 0.000000 
1 1 1   15    0  -52 o  112.222   2.2043  514.154   20.147  514.154   20.147  514.154   20.147  112.222   2.2043  112.222   2.2043 0.000000 0.000000 
1 1 1   15    0  -51 f   89.998   2.3779  331.006   17.417  331.006   17.417  331.006   17.417   89.998   2.3779   89.998   2.3779 0.000000 0.000000 
1 1 1   15    0  -50 o  211.817   2.7509  1830.95   47.480  1830.95   47.480  1830.95   47.480  211.817   2.7509  211.817   2.7509 0.000000 0.000000 
1 1 1   15    0  -49 o   7.6331   5.3808 -15.6355   13.282 -15.6355   13.282 -15.6355   13.282   7.6331   5.3808   7.6331   5.3808 0.000000 0.000000 
1 1 1   15    0  -48 o  184.031   3.3785  1383.26   50.644  1383.26   50.644  1383.26   50.644  184.031   3.3785  184.031   3.3785 0.000000 0.000000 
1 1 1   15    0  -47 o  162.270   2.5422  1074.67   33.608  1074.67   33.608  1074.67   33.608  162.270   2.5422  162.270   2.5422 0.000000 0.000000 
1 1 1   15    0  -46 o   44.323   3.7986   81.922   13.483   81.922   13.483   81.922   13.483   44.323   3.7986   44.323   3.7986 0.000000 0.000000 
1 1 1   15    0  -45 o  219.050   2.4561  1957.46   43.842  1957.46   43.842  1957.46   43.842  219.050   2.4561  219.050   2.4561 0.000000 0.000000 
1 1 1   15    0  -44 o   71.242   2.1637  207.518   12.539  207.518   12.539  207.518   12.539   71.242   2.1637   71.242   2.1637 0.000000 0.000000 
1 1 1   15    0  -43 o  251.946   2.6058  2589.48   53.504  2589.48   53.504  2589.48   53.504  251.946   2.6058  251.946   2.6058 0.000000 0.000000 
1 1 1   15    0  -42 o  150.311   3.2526  922.950   39.810  922.950   39.810  922.950   39.810  150.311   3.2526  150.311   3.2526 0.000000 0.000000 
1 1 1   15    0  -41 o  102.589   2.1743  429.692   18.164  429.692   18.164  429.692   18.164  102.589   2.1743  102.589   2.1743 0.000000 0.000000 
1 1 1   15    0  -40 o  147.881   2.1242  892.180   25.594  892.180   25.594  892.180   25.594  147.881   2.1242  147.881   2.1242 0.000000 0.000000 
1 1 1   15    0  -39 o  103.885   1.8534  440.396   15.684  440.396   15.684  440.396   15.684  103.885   1.8534  103.885   1.8534 0.000000 0.000000 
1 1 1   15    0  -38 o  197.346   2.0277  1588.31   32.611  1588.31   32.611  1588.31   32.611  197.346   2.0277  197.346   2.0277 0.000000 0.000000 
1 1 1   15    0  -37 o  182.155   1.9647  1353.21   29.165  1353.21   29.165  1353.21   29.165  182.155   1.9647  182.155   1.9647 0.000000 0.000000 
1 1 1   15    0  -36 o  245.274   2.2600  2453.48   45.177  2453.48   45.177  2453.48   45.177  245.274   2.2600  245.274   2.2600 0.000000 0.000000 
1 1 1   15    0  -35 o  201.505   2.0406  1655.92   33.511  1655.92   33.511  1655.92   33.511  201.505   2.0406  201.505   2.0406 0.000000 0.000000 
1 1 1   15    0  -34 o  136.813   1.8416  763.482   20.530  763.482   20.530  763.482   20.530  136.813   1.8416  136.813   1.8416 0.000000 0.000000 
1 1 1   15    0  -33 o   96.635   1.8672  381.125   14.696  381.125   14.696  381.125   14.696   96.635   1.8672   96.635   1.8672 0.000000 0.000000 
1 1 1   15    0  -32 o  265.449   2.3590  2873.67   51.036  2873.67   51.036  2873.67   51.036  265.449   2.3590  265.449   2.3590 0.000000 0.000000 
1 1 1   15    0  -31 o  231.472   2.1735  2185.03   41.003  2185.03   41.003  2185.03   41.003  231.472   2.1735  231.472   2.1735 0.000000 0.000000 
1 1 1   15    0  -30 o   19.378   6.3865   19.601   8.9562   19.601   8.9562   19.601   8.9562   19.378   6.3865   19.378   6.3865 0.000000 0.000000 
1 1 1   15    0  -29 o   50.532   2.4874  104.871   10.189  104.871   10.189  104.871   10.189   50.532   2.4874   50.532   2.4874 0.000000 0.000000 
1 1 1   15    0  -28 f  190.328   1.9871  1477.28   30.821  1477.28   30.821  1477.28   30.821  190.328   1.9871  190.328   1.9871 0.000000 0.000000 
1 1 1   15    0  -27 o   27.260   4.8444   33.044   9.7517   33.044   9.7517   33.044   9.7517   27.260   4.8444   27.260   4.8444 0.000000 0.000000 
1 1 1   15    0  -26 o   45.550   2.8807   85.617   10.597   85.617   10.597   85.617   10.597   45.550   2.8807   45.550   2.8807 0.000000 0.000000 
1 1 1   15    0  -25 o   53.863   2.6288  119.140   11.479  119.140   11.479  119.140   11.479   53.863   2.6288   53.863   2.6288 0.000000 0.000000 
1 1 1   15    0  -24 o   35.725   3.5924   53.618   10.200   53.618   10.200   53.618   10.200   35.725   3.5924   35.725   3.5924 0.000000 0.000000 
1 1 1   15    0  -23 o   28.495   4.4898   35.499   9.6557   35.499   9.6557   35.499   9.6557   28.495   4.4898   28.495   4.4898 0.000000 0.000000 
1 1 1   15    0  -22 o  186.592   2.1572  1419.99   32.801  1419.99   32.801  1419.99   32.801  186.592   2.1572  186.592   2.1572 0.000000 0.000000 
1 1 1   15    0  -21 o   95.148   2.3778  369.798   18.416  369.798   18.416  369.798   18.416   95.148   2.3778   95.148   2.3778 0.000000 0.000000 
1 1 1   15    0  -20 o  220.821   3.3190  1990.04   59.712  1990.04   59.712  1990.04   59.712  220.821   3.3190  220.821   3.3190 0.000000 0.000000 
1 1 1   15    0  -19 o  154.089   2.8910  969.209   36.284  969.209   36.284  969.209   36.284  154.089   2.8910  154.089   2.8910 0.000000 0.000000 
1 1 1   15    0  -18 o   96.332   2.8490  379.389   22.327  379.389   22.327  379.389   22.327   96.332   2.8490   96.332   2.8490 0.000000 0.000000 
1 1 1   15    0  -17 o   26.775   7.4495   35.291   14.065   35.291   14.065   35.291   14.065   26.775   7.4495   26.775   7.4495 0.000000 0.000000 
1 1 1   15    0  -16 o  124.076   2.2324  628.239   22.562  628.239   22.562  628.239   22.562  124.076   2.2324  124.076   2.2324 0.000000 0.000000 
1 1 1   15    0  -15 o  165.456   2.3735  1116.80   31.997  1116.80   31.997  1116.80   31.997  165.456   2.3735  165.456   2.3735 0.000000 0.000000 
1 1 1   15    0  -14 o   55.810   2.8686  128.010   12.971  128.010   12.971  128.010   12.971   55.810   2.8686   55.810   2.8686 0.000000 0.000000 
1 1 1   15    0  -13 o   87.942   2.3355  315.969   16.716  315.969   16.716  315.969   16.716   87.942   2.3355   87.942   2.3355 0.000000 0.000000 
1 1 1   15    0  -12 o  328.524   3.4991  4403.30   93.681  4403.30   93.681  4403.30   93.681  328.524   3.4991  328.524   3.4991 0.000000 0.000000 
1 1 1   15    0  -11 o  113.446   2.2768  525.330   21.036  525.330   21.036  525.330   21.036  113.446   2.2768  113.446   2.2768 0.000000 0.000000 
1 1 1   15    0  -10 o  336.251   3.5663  4612.95   97.725  4612.95   97.725  4612.95   97.725  336.251   3.5663  336.251   3.5663 0.000000 0.000000 
1 1 1   15    0   -9 o   58.466   2.8370  140.363   13.448  140.363   13.448  140.363   13.448   58.466   2.8370   58.466   2.8370 0.000000 0.000000 
1 1 1   15    0   -8 o  108.895   2.2654  484.068   20.089  484.068   20.089  484.068   20.089  108.895   2.2654  108.895   2.2654 0.000000 0.000000 
1 1 1   15    0   -7 o   25.731   6.0667   31.116   11.052   31.116   11.052   31.116   11.052   25.731   6.0667   25.731   6.0667 0.000000 0.000000 
1 1 1   15    0   -6 o   87.914   2.3610  315.779   16.892  315.779   16.892  315.779   16.892   87.914   2.3610   87.914   2.3610 0.000000 0.000000 
1 1 1   15    0   -5 o  147.298   2.3207  885.214   27.850  885.214   27.850  885.214   27.850  147.298   2.3207  147.298   2.3207 0.000000 0.000000 
1 1 1   15    0   -4 f  153.535   2.3520  961.730   29.421  961.730   29.421  961.730   29.421  153.535   2.3520  153.535   2.3520 0.000000 0.000000 
1 1 1   15    0   -3 o  176.230   2.4623  1266.94   35.357  1266.94   35.357  1266.94   35.357  176.230   2.4623  176.230   2.4623 0.000000 0.000000 
1 1 1   15    0   -2 o  374.763   4.7510  5733.75  145.085  5733.75  145.085  5733.75  145.085  374.763   4.7510  374.763   4.7510 0.000000 0.000000 
1 1 1   15    0   -1 o  150.413   2.3480  923.030   28.773  923.030   28.773  923.030   28.773  150.413   2.3480  150.413   2.3480 0.000000 0.000000 
1 1 1   15    0    0 o  216.447   2.6724  1911.04   47.134  1911.04   47.134  1911.04   47.134  216.447   2.6724  216.447   2.6724 0.000000 0.000000 
1 1 1   15    0    1 o   40.057   3.8286   67.219   12.222   67.219   12.222   67.219   12.222   40.057   3.8286   40.057   3.8286 0.000000 0.000000 
1 1 1   15    0    2 o  379.484   3.9322  5876.00  121.609  5876.00  121.609  5876.00  121.609  379.484   3.9322  379.484   3.9322 0.000000 0.000000 
1 1 1   15    0    3 o  229.354   3.3586  2146.62   62.762  2146.62   62.762  2146.62   62.762  229.354   3.3586  229.354   3.3586 0.000000 0.000000 
1 1 1   15    0    4 f  415.286   5.1915  7042.34  175.681  7042.34  175.681  7042.34  175.681  415.286   5.1915  415.286   5.1915 0.000000 0.000000 
1 1 1   15    0    6 o   43.439   4.2235   79.135   14.609   79.135   14.609   79.135   14.609   43.439   4.2235   43.439   4.2235 0.000000 0.000000 
1 1 1   15    0    7 o   95.272   2.8298  371.077   21.932  371.077   21.932  371.077   21.932   95.272   2.8298   95.272   2.8298 0.000000 0.000000 
1 1 1   15    0    8 o   43.001   3.5992   76.987   12.405   76.987   12.405   76.987   12.405   43.001   3.5992   43.001   3.5992 0.000000 0.000000 
1 1 1   15    0    9 o  118.674   2.9264  575.318   28.271  575.318   28.271  575.318   28.271  118.674   2.9264  118.674   2.9264 0.000000 0.000000 
1 1 1   15    0   10 o   96.458   2.3670  380.012   18.586  380.012   18.586  380.012   18.586   96.458   2.3670   96.458   2.3670 0.000000 0.000000 
1 1 1   15    0   11 o  106.980   2.3615  467.282   20.570  467.282   20.570  467.282   20.570  106.980   2.3615  106.980   2.3615 0.000000 0.000000 
1 1 1   15    0   12 o  303.386   3.3189  3755.03   82.056  3755.03   82.056  3755.03   82.056  303.386   3.3189  303.386   3.3189 0.000000 0.000000 
1 1 1   15    0   13 o  150.797   2.3763  927.786   29.193  927.786   29.193  927.786   29.193  150.797   2.3763  150.797   2.3763 0.000000 0.000000 
1 1 1   15    0   14 o   23.642   7.0545   28.145   11.835   28.145   11.835   28.145   11.835   23.642   7.0545   23.642   7.0545 0.000000 0.000000 
1 1 1   15    0   15 o  117.197   2.8009  561.014   26.724  561.014   26.724  561.014   26.724  117.197   2.8009  117.197   2.8009 0.000000 0.000000 
1 1 1   15    0   16 o   96.783   2.3900  382.591   18.829  382.591   18.829  382.591   18.829   96.783   2.3900   96.783   2.3900 0.000000 0.000000 
1 1 1   15    0   17 o  127.649   2.3486  664.990   24.419  664.990   24.419  664.990   24.419  127.649   2.3486  127.649   2.3486 0.000000 0.000000 
1 1 1   15    0   18 o  278.072   3.1392  3154.50   71.135  3154.50   71.135  3154.50   71.135  278.072   3.1392  278.072   3.1392 0.000000 0.000000 
1 1 1   15    0   19 o  122.028   2.3588  607.791   23.443  607.791   23.443  607.791   23.443  122.028   2.3588  122.028   2.3588 0.000000 0.000000 
1 1 1   15    0   20 o  151.093   2.3917  931.466   29.441  931.466   29.441  931.466   29.441  151.093   2.3917  151.093   2.3917 0.000000 0.000000 
1 1 1   15    0   21 o  126.255   2.3561  650.574   24.229  650.574   24.229  650.574   24.229  126.255   2.3561  126.255   2.3561 0.000000 0.000000 
1 1 1   15    0   22 o  365.212   3.8276  5442.78  113.921  5442.78  113.921  5442.78  113.921  365.212   3.8276  365.212   3.8276 0.000000 0.000000 
1 1 1   15    0   23 o  153.329   2.3852  959.221   29.796  959.221   29.796  959.221   29.796  153.329   2.3852  153.329   2.3852 0.000000 0.000000 
1 1 1   15    0   24 o  143.094   2.3478  835.504   27.368  835.504   27.368  835.504   27.368  143.094   2.3478  143.094   2.3478 0.000000 0.000000 
1 1 1   15    0   25 o   66.223   2.7907  179.777   15.003  179.777   15.003  179.777   15.003   66.223   2.7907   66.223   2.7907 0.000000 0.000000 
1 1 1   15    0   26 o   42.009   5.1136   75.175   16.819   75.175   16.819   75.175   16.819   42.009   5.1136   42.009   5.1136 0.000000 0.000000 
1 1 1   15    0   27 o   46.870   4.6956   92.323   17.495   92.323   17.495   92.323   17.495   46.870   4.6956   46.870   4.6956 0.000000 0.000000 
1 1 1   15    0   28 f  130.091   2.9523  691.223   31.271  691.223   31.271  691.223   31.271  130.091   2.9523  130.091   2.9523 0.000000 0.000000 
1 1 1   15    0   29 o   63.671   2.9034  166.348   14.997  166.348   14.997  166.348   14.997   63.671   2.9034   63.671   2.9034 0.000000 0.000000 
1 1 1   15    0   30 o  319.668   4.2358  4172.10  110.332  4172.10  110.332  4172.10  110.332  319.668   4.2358  319.668   4.2358 0.000000 0.000000 
1 1 1   15    0   31 o  183.577   3.0763  1375.58   46.006  1375.58   46.006  1375.58   46.006  183.577   3.0763  183.577   3.0763 0.000000 0.000000 
1 1 1   15    0   32 o  278.808   3.8437  3173.25   87.318  3173.25   87.318  3173.25   87.318  278.808   3.8437  278.808   3.8437 0.000000 0.000000 
1 1 1   15    0   33 o   89.950   2.9546  331.038   21.611  331.038   21.611  331.038   21.611   89.950   2.9546   89.950   2.9546 0.000000 0.000000 
1 1 1   15    0   34 o  112.157   2.8570  513.986   26.082  513.986   26.082  513.986   26.082  112.157   2.8570  112.157   2.8570 0.000000 0.000000 
1 1 1   15    0   35 o  185.777   3.1123  1408.83   47.101  1408.83   47.101  1408.83   47.101  185.777   3.1123  185.777   3.1123 0.000000 0.000000 
1 1 1   15    0   36 o   60.616   3.5732  151.449   17.514  151.449   17.514  151.449   17.514   60.616   3.5732   60.616   3.5732 0.000000 0.000000 
1 1 1   15    0   37 o   73.927   2.6702  223.735   16.044  223.735   16.044  223.735   16.044   73.927   2.6702   73.927   2.6702 0.000000 0.000000 
1 1 1   15    0   38 o  136.111   2.3779  756.098   26.364  756.098   26.364  756.098   26.364  136.111   2.3779  136.111   2.3779 0.000000 0.000000 
1 1 1   15    0   39 o  133.196   2.3815  724.097   25.839  724.097   25.839  724.097   25.839  133.196   2.3815  133.196   2.3815 0.000000 0.000000 
1 1 1   15    0   40 o   82.656   2.6331  279.455   17.700  279.455   17.700  279.455   17.700   82.656   2.6331   82.656   2.6331 0.000000 0.000000 
1 1 1   15    0   41 o  194.538   2.6117  1544.14   41.398  1544.14   41.398  1544.14   41.398  194.538   2.6117  194.538   2.6117 0.000000 0.000000 
1 1 1   15    0   42 o  102.105   2.4736  425.874   20.561  425.874   20.561  425.874   20.561  102.105   2.4736  102.105   2.4736 0.000000 0.000000 
1 1 1   15    0   43 o   58.823   3.2803  142.467   15.616  142.467   15.616  142.467   15.616   58.823   3.2803   58.823   3.2803 0.000000 0.000000 
1 1 1   15    0   44 o  106.621   2.5373  464.377   22.024  464.377   22.024  464.377   22.024  106.621   2.5373  106.621   2.5373 0.000000 0.000000 
1 1 1   15    0   45 o  114.580   2.5343  536.186   23.644  536.186   23.644  536.186   23.644  114.580   2.5343  114.580   2.5343 0.000000 0.000000 
1 1 1   15    0   46 o  237.050   2.9231  2293.13   56.463  2293.13   56.463  2293.13   56.463  237.050   2.9231  237.050   2.9231 0.000000 0.000000 
1 1 1   15    0   47 o  201.464   3.3342  1657.39   54.722  1657.39   54.722  1657.39   54.722  201.464   3.3342  201.464   3.3342 0.000000 0.000000 
1 1 1   15    0   48 o  253.771   3.7279  2629.99   77.078  2629.99   77.078  2629.99   77.078  253.771   3.7279  253.771   3.7279 0.000000 0.000000 
1 1 1   15    0   49 o  160.321   3.1548  1049.80   41.192  1049.80   41.192  1049.80   41.192  160.321   3.1548  160.321   3.1548 0.000000 0.000000 
1 1 1   15    0   50 o  209.204   3.3587  1787.19   57.243  1787.19   57.243  1787.19   57.243  209.204   3.3587  209.204   3.3587 0.000000 0.000000 
1 1 1   15    0   51 f   15.582   8.2606   14.359   14.104   14.359   14.104   14.359   14.104   15.582   8.2606   15.582   8.2606 0.000000 0.000000 
1 1 1   15    0   52 o  164.596   2.5464  1105.77   34.147  1105.77   34.147  1105.77   34.147  164.596   2.5464  164.596   2.5464 0.000000 0.000000 
1 1 1   15    0   53 o  249.663   2.9797  2544.14   60.622  2544.14   60.622  2544.14   60.622  249.663   2.9797  249.663   2.9797 0.000000 0.000000 
1 1 1   15    0   54 f   27.554   7.1379   36.667   13.853   36.667   13.853   36.667   13.853   27.554   7.1379   27.554   7.1379 0.000000 0.000000 
1 1 1   15    0   55 o  141.689   2.4603  819.605   28.396  819.605   28.396  819.605   28.396  141.689   2.4603  141.689   2.4603 0.000000 0.000000 
1 1 1   15    0   56 f  225.958   2.8202  2084.15   51.926  2084.15   51.926  2084.15   51.926  225.958   2.8202  225.958   2.8202 0.000000 0.000000 
1 1 1   15    0   57 o  128.913   2.4818  678.665   26.058  678.665   26.058  678.665   26.058  128.913   2.4818  128.913   2.4818 0.000000 0.000000 
1 1 1   15    0   58 o   12.513   7.4385   6.9931   13.251   6.9931   13.251   6.9931   13.251   12.513   7.4385   12.513   7.4385 0.000000 0.000000 
1 1 1   15    0   59 o  188.623   3.2159  1453.63   49.415  1453.63   49.415  1453.63   49.415  188.623   3.2159  188.623   3.2159 0.000000 0.000000 
1 1 1   15    0   60 o  217.830   2.7853  1937.26   49.438  1937.26   49.438  1937.26   49.438  217.830   2.7853  217.830   2.7853 0.000000 0.000000 
1 1 1   15    0   61 o  256.808   3.0351  2693.27   63.516  2693.27   63.516  2693.27   63.516  256.808   3.0351  256.808   3.0351 0.000000 0.000000 
1 1 1   15    0   62 o   60.952   3.3003  153.039   16.287  153.039   16.287  153.039   16.287   60.952   3.3003   60.952   3.3003 0.000000 0.000000 
1 1 1   15    0   63 o   19.580   8.2743   22.322   13.339   22.322   13.339   22.322   13.339   19.580   8.2743   19.580   8.2743 0.000000 0.000000 
1 1 1   15    0   64 o  115.926   2.4764  549.132   23.377  549.132   23.377  549.132   23.377  115.926   2.4764  115.926   2.4764 0.000000 0.000000 
1 1 1   15    0   65 o  185.813   3.2149  1411.41   48.662  1411.41   48.662  1411.41   48.662  185.813   3.2149  185.813   3.2149 0.000000 0.000000 
1 1 1   15    0   66 o   46.669   5.1096   92.383   18.846   92.383   18.846   92.383   18.846   46.669   5.1096   46.669   5.1096 0.000000 0.000000 
1 1 1   15    0   67 o   52.266   4.6817  114.525   19.561  114.525   19.561  114.525   19.561   52.266   4.6817   52.266   4.6817 0.000000 0.000000 
1 1 1   15    0   68 o  174.044   2.5494  1237.30   36.151  1237.30   36.151  1237.30   36.151  174.044   2.5494  174.044   2.5494 0.000000 0.000000 
1 1 1   15    0   69 o  104.436   2.5584  446.073   21.750  446.073   21.750  446.073   21.750  104.436   2.5584  104.436   2.5584 0.000000 0.000000 
1 1 1   15    0   70 o   90.922   2.6641  338.444   19.707  338.444   19.707  338.444   19.707   90.922   2.6641   90.922   2.6641 0.000000 0.000000 
1 1 1   15    0   71 o   14.495   7.9504   12.210   13.492   12.210   13.492   12.210   13.492   14.495   7.9504   14.495   7.9504 0.000000 0.000000 
1 1 1   15    0   72 f   39.362   6.9542   69.537   20.235   69.537   20.235   69.537   20.235   39.362   6.9542   39.362   6.9542 0.000000 0.000000 
1 1 1   15    0   73 o   6.7947   4.8607 -19.0470   12.357 -19.0470   12.357 -19.0470   12.357   6.7947   4.8607   6.7947   4.8607 0.000000 0.000000 
1 1 1   15    0   74 o   12.450   7.2706   7.7719   12.273   7.7719   12.273   7.7719   12.273   12.450   7.2706   12.450   7.2706 0.000000 0.000000 
1 1 1   15    0   75 o   34.610   4.8125   51.964   12.828   51.964   12.828   51.964   12.828   34.610   4.8125   34.610   4.8125 0.000000 0.000000 
1 1 1   15    0   76 o   28.954   5.7105   38.257   11.987   38.257   11.987   38.257   11.987   28.954   5.7105   28.954   5.7105 0.000000 0.000000 
1 1 1   15    0   77 o   12.550   6.8367   9.2625   9.9053   9.2625   9.9053   9.2625   9.9053   12.550   6.8367   12.550   6.8367 0.000000 0.000000 
1 1 1   15    0   78 o   97.942   1.9429  392.146   15.498  392.146   15.498  392.146   15.498   97.942   1.9429   97.942   1.9429 0.000000 0.000000 
1 1 1   15    0   79 o   15.736   6.7864   14.655   8.9468   14.655   8.9468   14.655   8.9468   15.736   6.7864   15.736   6.7864 0.000000 0.000000 
1 1 1   15    0   80 o  121.573   1.8749  604.025   18.571  604.025   18.571  604.025   18.571  121.573   1.8749  121.573   1.8749 0.000000 0.000000 
1 1 1   15    0   81 o   11.620   6.4562   7.7928   9.0263   7.7928   9.0263   7.7928   9.0263   11.620   6.4562   11.620   6.4562 0.000000 0.000000 
1 1 1   15    0   82 o   30.790   3.7617   40.672   9.0652   40.672   9.0652   40.672   9.0652   30.790   3.7617   30.790   3.7617 0.000000 0.000000 
1 1 1   15    0   83 o   30.865   3.9760   41.117   9.5477   41.117   9.5477   41.117   9.5477   30.865   3.9760   30.865   3.9760 0.000000 0.000000 
1 1 1   15    0   84 o   11.675   6.4005   8.0808   8.7392   8.0808   8.7392   8.0808   8.7392   11.675   6.4005   11.675   6.4005 0.000000 0.000000 
1 1 1   15    0   85 o   10.714   6.1661   6.2137   8.6264   6.2137   8.6264   6.2137   8.6264   10.714   6.1661   10.714   6.1661 0.000000 0.000000 
1 1 1   15    0   86 o   30.170   3.7375   39.199   8.8125   39.199   8.8125   39.199   8.8125   30.170   3.7375   30.170   3.7375 0.000000 0.000000 
1 1 1   15    0   87 o   13.864   6.5547   11.889   8.3827   11.889   8.3827   11.889   8.3827   13.864   6.5547   13.864   6.5547 0.000000 0.000000 
1 1 1   15    0   88 o   5.6251   4.0043 -11.0132   7.9990 -11.0132   7.9990 -11.0132   7.9990   5.6251   4.0043   5.6251   4.0043 0.000000 0.000000 
1 1 1   15    0   89 o   20.903   5.6952   21.792   8.3875   21.792   8.3875   21.792   8.3875   20.903   5.6952   20.903   5.6952 0.000000 0.000000 
1 1 1   15    0   90 o   52.465   2.3231  113.524   9.8906  113.524   9.8906  113.524   9.8906   52.465   2.3231   52.465   2.3231 0.000000 0.000000 
1 1 1   15    0   91 o   62.469   2.1034  160.426   10.683  160.426   10.683  160.426   10.683   62.469   2.1034   62.469   2.1034 0.000000 0.000000 
1 1 1   15    0   92 o   42.005   2.6642   73.408   9.0370   73.408   9.0370   73.408   9.0370   42.005   2.6642   42.005   2.6642 0.000000 0.000000 
1 1 1   15    0   93 o   90.183   1.8338  333.345   13.468  333.345   13.468  333.345   13.468   90.183   1.8338   90.183   1.8338 0.000000 0.000000 
1 1 1   15    0   94 o   56.084   2.1978  129.624   10.012  129.624   10.012  129.624   10.012   56.084   2.1978   56.084   2.1978 0.000000 0.000000 
1 1 1   15    0   95 o   34.054   3.0402   48.987   8.2775   48.987   8.2775   48.987   8.2775   34.054   3.0402   34.054   3.0402 0.000000 0.000000 
1 1 1   15    0   96 o   64.438   2.3284  171.279   12.194  171.279   12.194  171.279   12.194   64.438   2.3284   64.438   2.3284 0.000000 0.000000 
1 1 1   15    0   97 o   37.896   3.6811   61.386   11.108   61.386   11.108   61.386   11.108   37.896   3.6811   37.896   3.6811 0.000000 0.000000 
1 1 1   15    0   98 o   8.7785   5.6561   0.8364   9.3474   0.8364   9.3474   0.8364   9.3474   8.7785   5.6561   8.7785   5.6561 0.000000 0.000000 
1 1 1   15    0   99 o   32.826   4.1010   47.182   10.511   47.182   10.511   47.182   10.511   32.826   4.1010   32.826   4.1010 0.000000 0.000000 
1 1 1   15    0  100 o   15.690   6.0319   14.305   7.2982   14.305   7.2982   14.305   7.2982   15.690   6.0319   15.690   6.0319 0.000000 0.000000 
1 1 1   15    0  101 o   21.299   4.9691   21.974   7.5003   21.974   7.5003   21.974   7.5003   21.299   4.9691   21.299   4.9691 0.000000 0.000000 
1 1 1   15    0  102 o   38.935   2.7089   63.687   8.5001   63.687   8.5001   63.687   8.5001   38.935   2.7089   38.935   2.7089 0.000000 0.000000 
1 1 1   15    0  103 o   10.171   5.7387   6.3386   7.2684   6.3386   7.2684   6.3386   7.2684   10.171   5.7387   10.171   5.7387 0.000000 0.000000 
1 1 1   15    0  104 o   10.314   5.8168   6.5957   7.4628   6.5957   7.4628   6.5957   7.4628   10.314   5.8168   10.314   5.8168 0.000000 0.000000 
1 1 1   15    0  105 o   13.998   7.7447   13.763   12.926   13.763   12.926   13.763   12.926   13.998   7.7447   13.998   7.7447 0.000000 0.000000 
1 1 1   15    0  106 o   11.751   7.1024   8.1091   12.479   8.1091   12.479   8.1091   12.479   11.751   7.1024   11.751   7.1024 0.000000 0.000000 
1 1 1   15    0  107 o   15.653   8.0261   17.770   12.998   17.770   12.998   17.770   12.998   15.653   8.0261   15.653   8.0261 0.000000 0.000000 
1 1 1   15    0  108 o   16.386   8.1446   19.448   13.162   19.448   13.162   19.448   13.162   16.386   8.1446   16.386   8.1446 0.000000 0.000000 
1 1 1   15    0  109 o   31.107   6.0594   47.352   13.694   47.352   13.694   47.352   13.694   31.107   6.0594   31.107   6.0594 0.000000 0.000000 
1 1 1   15    0  110 o   50.071   3.7855  108.670   15.242  108.670   15.242  108.670   15.242   50.071   3.7855   50.071   3.7855 0.000000 0.000000 
1 1 1   15    0  111 o   7.5509   5.3856 -17.2218   14.734 -17.2218   14.734 -17.2218   14.734   7.5509   5.3856   7.5509   5.3856 0.000000 0.000000 
1 1 1   15    0  112 o   30.010   7.8769   49.441   16.648   49.441   16.648   49.441   16.648   30.010   7.8769   30.010   7.8769 0.000000 0.000000 
1 1 1   15    0  113 o   26.530   9.0721   44.028   17.614   44.028   17.614   44.028   17.614   26.530   9.0721   26.530   9.0721 0.000000 0.000000 
1 1 1   15    0  114 f   19.467   9.3153   29.172   16.982   29.172   16.982   29.172   16.982   19.467   9.3153   19.467   9.3153 0.000000 0.000000 
1 1 1   15    0  115 o   10.609   7.0545   1.1844   16.336   1.1844   16.336   1.1844   16.336   10.609   7.0545   10.609   7.0545 0.000000 0.000000 
1 1 1   15    0  116 o   16.218   8.9603   21.713   17.274   21.713   17.274   21.713   17.274   16.218   8.9603   16.218   8.9603 0.000000 0.000000 
1 1 1   15    0  117 o   6.5950   4.8127 -31.0517   15.510 -31.0517   15.510 -31.0517   15.510   6.5950   4.8127   6.5950   4.8127 0.000000 0.000000 
1 1 1   15    0  118 o   6.1630   4.5328 -39.5312   15.792 -39.5312   15.792 -39.5312   15.792   6.1630   4.5328   6.1630   4.5328 0.000000 0.000000 
1 1 1   15    0  119 o   13.842   8.3142   14.704   16.885   14.704   16.885   14.704   16.885   13.842   8.3142   13.842   8.3142 0.000000 0.000000 
1 1 1   15    1 -118 o   12.893   6.1567  -8.8712   18.122 -22.6239   28.478   0.4876   23.492   14.108   6.9523   15.394   7.2500 -1.286005 10.04473 
1 1 1   15    1 -117 o   13.708   6.1887   2.4918   14.693  -8.8205   27.332   7.0902   17.426   15.019   7.2703   15.279   6.8314 -0.2595654 9.976263 
1 1 1   15    1 -116 o   12.348   5.8053  -5.2945   14.943 -23.4657   26.764   2.9343   18.011   13.641   6.7255   14.619   6.6972 -0.9782152 9.491336 
1 1 1   15    1 -115 o   10.715   5.1743 -12.9744   13.636 -40.0418   22.260   3.2850   17.252   11.304   5.6630   14.571   6.6291 -3.267667 8.718628 
1 1 1   15    1 -114 o   12.002   5.5366  -2.7912   12.611   16.586   18.097 -21.0800   17.582   17.622   7.4139   11.352   5.5678 6.270029 9.271754 
1 1 1   15    1 -113 o   14.110   6.0846   5.9525   12.729   0.4339   18.654   10.762   17.413   14.522   6.7116   16.244   7.0603 -1.721673 9.741348 
1 1 1   15    1 -112 o   22.133   6.6716   27.745   13.030   28.523   18.739   27.016   18.131   21.030   7.9636   20.660   7.8310 0.3699970 11.16885 
1 1 1   15    1 -111 o   19.900   6.2542   21.552   11.306   24.623   18.063   19.574   14.498   20.041   7.7605   18.664   7.0186 1.376841 10.46357 
1 1 1   15    1 -110 o   11.989   5.5170  -3.0202   12.412  -6.7605   17.869   0.4675   17.255   13.341   6.2953   14.320   6.5584 -0.9793482 9.090812 
1 1 1   15    1 -109 o   23.666   5.9018   29.173   11.346   35.320   14.488   19.424   18.245   25.085   6.8801   18.741   7.6202 6.344217 10.26659 
1 1 1   15    1 -108 o   9.1133   4.4396 -14.7939   10.631  -9.7149   13.719 -22.4305   16.822   11.427   5.4284   11.106   5.4471 0.3207903 7.690157 
1 1 1   15    1 -107 o   27.247   5.2586   36.329   11.257   41.746   14.398   27.810   18.054   28.112   6.4238   21.469   7.8775 6.643696 10.16460 
1 1 1   15    1 -106 o   15.827   5.8015   11.823   9.7885   21.656   13.760   1.7481   13.928   19.877   6.9236   13.761   6.1330 6.115938 9.249307 
1 1 1   15    1 -105 o   23.229   5.3820   26.630   9.9908   53.278   14.504   2.5665   13.782   32.908   5.6078   13.959   6.1673 18.94883 8.335644 
1 1 1   15    1 -104 o   10.891   4.9191  -2.0682   9.2957  -8.3719   13.161   4.2073   13.131   11.543   5.4334   14.220   6.1561 -2.676515 8.210934 
1 1 1   15    1 -103 o   10.836   4.9113  -2.6117   9.3614   1.9160   13.342  -7.0017   13.138   13.813   6.0869   11.842   5.5270 1.970930 8.221789 
1 1 1   15    1 -102 o   36.844   3.4047   59.013   10.110   72.205   14.182   45.381   14.416   39.960   4.4280   30.337   6.0420 9.623032 7.490835 
1 1 1   15    1 -101 o   19.812   5.5238   18.995   9.2544   9.1870   12.682   30.166   13.535   15.848   6.3858   24.254   6.6488 -8.406582 9.218760 
1 1 1   15    1 -100 o   11.880   5.2028   0.1741   9.6115 -13.6805   14.297   11.600   12.983   11.475   5.4767   16.825   6.5614 -5.349803 8.546716 
1 1 1   15    1  -99 o   27.685   4.6375   34.760   10.096   30.955   14.786   38.084   13.818   24.594   7.0261   27.940   6.2263 -3.345585 9.387886 
1 1 1   15    1  -98 o   20.501   6.5969   20.443   12.518   15.016   14.327   37.958   25.738   18.496   6.9723   25.810   9.4158 -7.314367 11.71622 
1 1 1   15    1  -97 o   35.219   3.7236   53.642   10.528   39.600   13.905   72.508   16.117   28.842   6.1049   40.106   5.0410 -11.26388 7.917149 
1 1 1   15    1  -96 o   10.180   4.7167  -6.2675   9.3000   2.6151   12.485 -17.3414   13.940   14.191   6.0712   10.960   5.2773 3.230927 8.044168 
1 1 1   15    1  -95 o   41.573   2.9598   72.771   9.9645   50.358   13.854   96.791   14.342   33.388   5.2646   47.546   3.7304 -14.15798 6.452271 
1 1 1   15    1  -94 o   25.657   4.5885   29.248   9.2440   26.293   12.792   32.479   13.374   23.513   6.4709   26.208   6.3317 -2.694746 9.053305 
1 1 1   15    1  -93 o   10.338   4.7245  -4.7547   8.8906  -3.5364   12.787  -5.8947   12.370   12.927   5.8101   12.185   5.5702 0.7411299 8.048878 
1 1 1   15    1  -92 o   22.480   5.0386   22.787   9.0042   17.940   12.597   27.851   12.875   19.930   6.6302   24.355   6.4023 -4.424767 9.216765 
1 1 1   15    1  -91 o   49.491   2.5164  101.752   10.119   88.034   14.136  116.166   14.490   45.447   3.8520   52.487   3.4052 -7.039711 5.141322 
1 1 1   15    1  -90 o   21.732   5.0639   21.240   8.8036   26.876   12.494   15.683   12.407   24.048   6.2995   19.034   6.5775 5.014097 9.107523 
1 1 1   15    1  -89 o   53.743   2.4595  119.689   10.746  114.623   15.150  124.819   15.245   52.111   3.5884   54.457   3.4521 -2.346603 4.979331 
1 1 1   15    1  -88 o   30.028   3.8281   38.535   9.1574   36.753   12.898   40.346   13.004   28.541   5.7429   30.043   5.5131 -1.501656 7.960894 
1 1 1   15    1  -87 f   25.504   2.6784   27.205   5.4851   14.358   12.445   30.303   6.1107   18.639   6.5776   26.893   2.8299 -8.253325 7.160553 
1 1 1   15    1  -86 o   18.710   3.9764   15.249   5.8776   25.691   12.604   12.347   6.6441   23.713   6.3813   16.775   4.6817 6.938240 7.914483 
1 1 1   15    1  -85 o   52.237   1.8036  112.042   7.6684  109.874   15.316  112.768   8.8589   51.126   3.7000   52.342   2.0805 -1.215435 4.244784 
1 1 1   15    1  -84 o   68.905   1.6622  194.494   9.3364  179.771   16.552  201.364   11.307   65.769   3.0961   70.010   1.9833 -4.240501 3.676872 
1 1 1   15    1  -83 o   65.568   1.9171  176.476   10.235  162.983   16.356  185.162   13.123   62.604   3.2158   67.028   2.4057 -4.423138 4.016075 
1 1 1   15    1  -82 o   30.376   4.4049   39.493   10.589   37.788   14.849   41.258   15.105   28.994   6.4494   30.378   6.3064 -1.383902 9.020292 
1 1 1   15    1  -81 o   50.511   2.7934  105.499   11.457  107.484   17.315  103.953   15.279   50.520   4.2439   49.840   3.7893 0.6792297 5.689378 
1 1 1   15    1  -80 o   43.751   2.4055   78.868   8.5458   67.366   16.438   83.129   10.004   39.621   5.2161   44.848   2.7497 -5.226784 5.896478 
1 1 1   15    1  -79 o   43.466   1.8711   77.490   6.6139   75.861   8.5831   79.872   10.377   42.907   2.4644   43.936   2.9139 -1.029732 3.816310 
1 1 1   15    1  -78 o  111.646   1.4260  509.263   12.978  506.597   18.017  512.138   18.708  111.227   1.9872  111.816   2.0526 -0.5890961 2.856920 
1 1 1   15    1  -77 o   48.847   1.8331   97.743   7.2859  103.193   9.9628   91.477   10.682   50.095   2.4472   47.093   2.7953 3.001682 3.715171 
1 1 1   15    1  -76 o   47.753   1.8577   93.406   7.2172   91.995   9.7690   95.101   10.709   47.287   2.5437   48.044   2.7460 -0.7569809 3.743126 
1 1 1   15    1  -75 o   31.046   2.5887   39.800   6.4918   40.297   9.0095   39.264   9.3621   31.049   3.6280   30.598   3.8378 0.4511642 5.281217 
1 1 1   15    1  -74 o   49.344   2.3325   99.925   9.3553   87.388   17.628  104.840   11.038   45.610   4.8138   50.489   2.6917 -4.878719 5.515306 
1 1 1   15    1  -73 o   35.594   2.9150   52.332   8.3836   44.997   15.107   55.596   10.078   32.296   5.9578   36.607   3.4168 -4.311253 6.868067 
1 1 1   15    1  -72 o   36.548   2.4909   54.946   7.3764   44.725   10.341   65.535   10.525   32.704   3.9594   39.807   3.2726 -7.103745 5.136811 
1 1 1   15    1  -71 o   33.370   2.8033   45.954   7.5551   45.657   10.161   46.321   11.298   33.083   3.8391   33.238   4.2684 -0.1544991 5.740908 
1 1 1   15    1  -70 o   8.4222   3.9537  -7.1481   6.8871 -13.5998   9.5576  -0.1798   9.9329   9.2048   4.4158   12.651   5.4140 -3.446679 6.986459 
1 1 1   15    1  -69 o   84.400   1.7555  290.881   12.078  286.143   17.814  294.911   16.430   83.573   2.6182   84.883   2.3769 -1.310257 3.536223 
1 1 1   15    1  -68 o   45.729   2.4589   85.768   9.1321   99.672   12.954   72.031   12.876   49.198   3.2483   41.693   3.8314 7.505219 5.023061 
1 1 1   15    1  -67 o   45.476   2.3979   84.782   8.8576  102.463   13.730   72.178   11.593   49.872   3.3977   41.812   3.4314 8.059204 4.828970 
1 1 1   15    1  -66 o   21.650   4.4739   19.996   7.6344   14.571   11.665   24.061   10.097   19.185   6.3803   23.667   5.3588 -4.481783 8.332152 
1 1 1   15    1  -65 o   86.648   1.7904  306.474   12.646  295.528   20.788  312.906   15.934   84.916   3.0079   87.487   2.2361 -2.571152 3.748052 
1 1 1   15    1  -64 o   55.552   2.3305  126.307   10.530  115.077   15.990  134.905   13.992   52.840   3.7364   57.337   3.0041 -4.497292 4.794261 
1 1 1   15    1  -63 o   43.640   2.6069   78.123   9.2314   75.015   13.233   81.070   12.885   42.595   3.8527   44.333   3.5963 -1.737656 5.270351 
1 1 1   15    1  -62 o  114.824   1.7238  538.022   16.134  566.382   23.055  510.802   22.587  117.744   2.4021  111.810   2.4782 5.934898 3.451311 
1 1 1   15    1  -61 o  141.218   1.6174  813.630   18.618  824.211   24.628  799.516   28.443  142.080   2.1265  139.889   2.4944 2.190948 3.277765 
1 1 1   15    1  -60 o   51.942   2.2451  110.375   9.4834  103.806   12.494  119.304   14.566   50.286   3.0626   53.889   3.3322 -3.602936 4.525841 
1 1 1   15    1  -59 o   57.045   2.1126  133.026   9.8066  120.907   12.908  149.569   15.081   54.303   2.9270   60.398   3.0733 -6.094509 4.244075 
1 1 1   15    1  -58 o   19.694   5.1178   16.542   8.2898   14.184   11.014   19.623   12.590   18.904   6.1960   21.699   6.5617 -2.794687 9.024792 
1 1 1   15    1  -57 o  165.164   1.6626  1112.83   22.384  1108.09   29.371  1119.39   34.574  164.758   2.1869  165.547   2.5621 -0.7891998 3.368540 
1 1 1   15    1  -56 o  177.217   1.6970  1281.17   24.515  1277.79   32.206  1285.82   37.801  176.925   2.2331  177.430   2.6136 -0.5042877 3.437701 
1 1 1   15    1  -55 o   15.245   5.2422   8.6893   7.8773   20.426   11.289  -2.4466   10.997   21.943   6.0947   12.733   5.5711 9.210072 8.257220 
1 1 1   15    1  -54 o  125.504   1.5296  642.406   15.648  640.179   21.908  644.725   22.359  125.246   2.1458  125.687   2.1823 -0.4410477 3.060592 
1 1 1   15    1  -53 o  154.482   1.5427  973.298   19.426  955.121   27.158  992.343   27.799  152.983   2.1778  155.934   2.1870 -2.951538 3.086405 
1 1 1   15    1  -52 o   72.800   1.7676  216.186   10.489  213.020   14.780  219.400   14.889   72.191   2.5154   73.267   2.4967 -1.076050 3.544118 
1 1 1   15    1  -51 o  156.967   1.5487  1004.81   19.816  1015.35   27.951  994.163   28.098  157.742   2.1737  156.084   2.2084 1.657547 3.098748 
1 1 1   15    1  -50 o   73.414   1.9916  220.038   11.908  209.718   14.792  239.035   20.070   71.632   2.5374   76.418   3.2292 -4.786392 4.106811 
1 1 1   15    1  -49 o   31.496   3.3577   40.993   8.4879   41.475   11.688   40.455   12.346   31.480   4.6984   31.021   5.0565 0.4591732 6.902403 
1 1 1   15    1  -48 f  117.655   1.5762  564.497   15.117  556.728   21.249  572.459   21.511  116.810   2.2316  118.449   2.2279 -1.639023 3.153346 
1 1 1   15    1  -47 o  295.888   2.0529  3571.46   49.514  3544.45   69.538  3599.24   70.520  294.638   2.8953  296.903   2.9138 -2.265167 4.107690 
1 1 1   15    1  -46 o   84.852   1.6889  293.618   11.681  272.179   17.261  311.735   15.867   81.622   2.5976   87.384   2.2294 -5.761444 3.423095 
1 1 1   15    1  -45 o   87.239   1.9869  310.431   14.130  333.703   27.566  302.138   16.456   90.283   3.7539   86.021   2.3490 4.262306 4.428238 
1 1 1   15    1  -44 o  134.611   2.2777  739.271   24.992  657.231   36.394  812.486   34.381  126.784   3.5249  141.067   2.9899 -14.28354 4.622138 
1 1 1   15    1  -43 o  109.185   1.8722  486.218   16.663  527.085   32.438  471.568   19.422  113.530   3.5094  107.513   2.2161 6.016785 4.150549 
1 1 1   15    1  -42 o  141.206   1.7635  813.151   20.299  813.072   37.398  813.184   24.168  141.099   3.2516  141.192   2.0999 -0.9233093E-01 3.870697 
1 1 1   15    1  -41 o  121.794   1.6563  604.890   16.444  577.603   26.995  620.990   20.735  118.960   2.7838  123.387   2.0616 -4.426788 3.464111 
1 1 1   15    1  -40 o  197.599   1.5263  1592.05   24.584  1598.07   33.421  1584.96   36.291  197.937   2.0714  197.109   2.2587 0.8279419 3.064658 
1 1 1   15    1  -39 o   80.049   1.5954  261.282   10.410  250.312   15.048  271.351   14.417   78.294   2.3605   81.532   2.1711 -3.238182 3.207121 
1 1 1   15    1  -38 o  222.751   1.5982  2023.18   29.019  1985.63   38.897  2070.30   43.579  220.634   2.1627  225.271   2.3732 -4.636703 3.210831 
1 1 1   15    1  -37 o  227.570   1.6121  2111.66   29.906  2133.63   40.743  2086.00   44.035  228.709   2.1854  226.124   2.3890 2.584686 3.237790 
1 1 1   15    1  -36 o   49.074   1.9579   98.370   7.8165  108.212   11.032   88.449   11.077   51.430   2.6403   46.459   2.9399 4.970646 3.951465 
1 1 1   15    1  -35 o  229.367   1.6166  2145.11   30.225  2144.80   40.895  2145.48   44.870  229.310   2.1878  229.329   2.4003 -0.1847839E-01 3.247744 
1 1 1   15    1  -34 o  174.829   1.4349  1246.17   20.449  1252.76   27.850  1238.46   30.123  175.267   1.9494  174.254   2.1207 1.013199 2.880523 
1 1 1   15    1  -33 o  132.951   1.3555  720.635   14.690  706.283   19.970  737.560   21.687  131.604   1.8615  134.482   1.9783 -2.877762 2.716427 
1 1 1   15    1  -32 o  148.675   1.3702  901.164   16.606  901.073   22.596  901.272   24.486  148.649   1.8648  148.658   2.0207 -0.9536743E-02 2.749679 
1 1 1   15    1  -31 o  106.301   1.3476  460.683   11.677  447.794   15.894  475.797   17.212  104.791   1.8607  108.015   1.9548 -3.224068 2.698779 
1 1 1   15    1  -30 o   41.873   2.0831   71.684   7.0880   69.741   9.8210   73.797   10.240   41.235   2.9411   42.420   2.9804 -1.184612 4.187221 
1 1 1   15    1  -29 o  131.779   1.3409  707.962   14.404  712.034   19.727  703.312   21.080  132.142   1.8314  131.325   1.9691 0.8169098 2.689170 
1 1 1   15    1  -28 o  155.713   1.4710  988.533   18.672  979.435   27.116  996.737   25.748  154.967   2.1466  156.336   2.0205 -1.368698 2.947902 
1 1 1   15    1  -27 o   89.256   1.5056  324.802   10.954  319.236   16.329  329.357   14.771   88.441   2.2668   89.868   2.0163 -1.427292 3.033818 
1 1 1   15    1  -26 o  145.463   1.4490  862.661   17.182  861.172   25.015  863.991   23.641  145.314   2.1118  145.556   1.9925 -0.2426453 2.903380 
1 1 1   15    1  -25 o  131.415   1.5207  704.105   16.291  724.910   26.223  691.030   20.789  133.311   2.4132  130.176   1.9591 3.134735 3.108306 
1 1 1   15    1  -24 o  140.783   1.5439  808.068   17.718  833.325   28.387  791.950   22.677  142.931   2.4365  139.357   1.9963 3.574875 3.149862 
1 1 1   15    1  -23 o  123.562   1.5359  622.461   15.470  601.116   20.468  650.900   23.625  121.409   2.0682  126.328   2.2943 -4.919067 3.088845 
1 1 1   15    1  -22 o  207.548   1.8779  1756.51   31.771  1743.86   39.027  1781.36   54.708  206.774   2.3154  208.916   3.2125 -2.141785 3.960000 
1 1 1   15    1  -21 o  207.769   2.0469  1760.39   34.667  1745.98   44.800  1781.90   54.732  206.877   2.6566  208.949   3.2134 -2.071655 4.169369 
1 1 1   15    1  -20 o  134.824   1.8007  741.180   19.789  722.936   25.615  768.190   31.168  133.133   2.3603  137.217   2.7865 -4.083832 3.651806 
1 1 1   15    1  -19 o  202.251   1.8358  1667.94   30.266  1618.86   42.718  1717.40   42.887  199.207   2.6307  205.185   2.5641 -5.977631 3.673609 
1 1 1   15    1  -18 o  329.296   2.3084  4422.60   61.964  4516.69   96.337  4356.21   80.926  332.623   3.5531  326.732   3.0385 5.891022 4.675128 
1 1 1   15    1  -17 o   38.607   2.5167   61.057   7.8771   55.850   12.508   64.480   10.141   36.731   4.2562   39.624   3.1659 -2.892601 5.304584 
1 1 1   15    1  -16 o  186.021   1.6337  1410.83   24.773  1399.20   37.768  1419.61   32.818  185.210   2.5017  186.575   2.1579 -1.364883 3.303747 
1 1 1   15    1  -15 o  246.050   1.7769  2468.45   35.638  2466.40   50.848  2470.43   49.964  245.897   2.5368  246.101   2.4906 -0.2044525 3.555061 
1 1 1   15    1  -14 o   41.675   2.2319   71.035   7.5543   78.803   11.332   64.822   10.135   43.827   3.1940   39.731   3.1551 4.096264 4.489577 
1 1 1   15    1  -13 o  102.483   1.6037  428.199   13.397  409.190   18.958  447.163   18.936  100.165   2.3219  104.712   2.2184 -4.547531 3.211323 
1 1 1   15    1  -12 o  141.203   1.6295  812.897   18.755  797.146   26.533  828.628   26.516  139.805   2.3282  142.540   2.2821 -2.735825 3.260125 
1 1 1   15    1  -11 f  219.165   1.9039  1958.57   34.013  1971.69   48.531  1945.91   47.683  219.848   2.7081  218.408   2.6783 1.439835 3.808826 
1 1 1   15    1  -10 o  126.716   1.6100  654.649   16.631  657.432   23.746  651.970   23.299  126.965   2.2944  126.438   2.2606 0.5273132 3.220953 
1 1 1   15    1   -9 o  207.391   1.8500  1753.73   31.275  1716.15   43.802  1792.82   44.671  205.114   2.6198  209.646   2.6140 -4.532074 3.700825 
1 1 1   15    1   -8 f  127.787   1.6100  665.754   16.771  656.147   23.824  675.190   23.612  126.841   2.3042  128.670   2.2512 -1.829346 3.221407 
1 1 1   15    1   -7 o  124.384   1.6083  630.763   16.307  605.793   23.032  655.858   23.090  121.877   2.3184  126.816   2.2336 -4.939133 3.219315 
1 1 1   15    1   -6 o   79.039   1.7285  254.710   11.137  259.058   15.967  250.591   15.541   79.659   2.4620   78.346   2.4364 1.312447 3.463689 
1 1 1   15    1   -5 o  163.166   1.8402  1085.52   24.476  1100.67   32.118  1064.54   37.800  164.278   2.3985  161.535   2.8707 2.742676 3.740775 
1 1 1   15    1   -4 o   87.645   1.6884  313.192   12.063  298.749   17.090  327.530   17.029   85.550   2.4533   89.585   2.3339 -4.035477 3.386088 
1 1 1   15    1   -3 o  222.747   1.9259  2023.12   34.970  2013.79   49.557  2032.37   49.353  222.184   2.7362  223.208   2.7125 -1.024429 3.852887 
1 1 1   15    1   -2 o  196.176   2.1970  1569.44   35.133  1575.06   49.673  1563.81   49.697  196.471   3.1016  195.768   3.1142 0.7037201 4.395277 
1 1 1   15    1   -1 o  105.626   1.7967  454.893   15.470  466.323   20.398  439.418   23.735  106.930   2.3402  103.747   2.8091 3.183113 3.656170 
1 1 1   15    1    0 o  307.402   2.8963  3855.20   72.575  3921.15  104.248  3793.16  101.099  309.863   4.1273  304.772   4.0694 5.090607 5.796075 
1 1 1   15    1    1 o  203.472   2.2520  1688.39   37.351  1671.77   52.909  1704.91   52.737  202.406   3.2068  204.405   3.1651 -1.999283 4.505697 
1 1 1   15    1    2 o  236.667   2.4401  2284.46   47.073  2283.45   66.976  2285.45   66.174  236.529   3.4737  236.637   3.4306 -0.1080322 4.882208 
1 1 1   15    1    3 o  163.933   1.8595  1095.76   24.848  1149.91   40.504  1063.07   31.465  167.882   2.9598  161.448   2.3909 6.434082 3.804835 
1 1 1   15    1    4 o  154.211   1.6785  969.569   21.100  954.872   30.065  983.834   29.619  153.010   2.4105  155.316   2.3395 -2.306244 3.359146 
1 1 1   15    1    5 o   55.045   2.1088  123.739   9.4447  109.081   13.690  137.050   13.047   51.598   3.2719   57.895   2.7725 -6.297810 4.288591 
1 1 1   15    1    6 o  188.008   1.7793  1441.19   27.269  1449.84   38.944  1432.86   38.195  188.535   2.5340  187.429   2.4999 1.105621 3.559643 
1 1 1   15    1    7 o   37.118   2.8224   56.531   8.4756   63.143   12.182   50.329   11.800   39.136   3.8693   34.848   4.2412 4.287941 5.740973 
1 1 1   15    1    8 f   85.779   1.7223  300.003   12.042  299.782   17.288  300.212   16.784   85.696   2.4775   85.761   2.4033 -0.6550598E-01 3.451624 
1 1 1   15    1    9 o  243.937   2.2341  2426.74   44.423  2387.87   70.144  2452.78   57.402  241.864   3.5578  245.194   2.8720 -3.330261 4.572322 
1 1 1   15    1   10 o   68.118   1.9246  189.352   10.676  167.030   15.452  209.740   14.768   63.914   2.9741   71.664   2.5320 -7.749954 3.905905 
1 1 1   15    1   11 f  153.265   1.8592  957.799   23.227  970.297   30.116  939.450   36.490  154.240   2.3953  151.741   2.9501 2.499008 3.800112 
1 1 1   15    1   12 o  166.733   1.8989  1133.55   25.808  1112.92   33.034  1165.88   41.346  165.184   2.4534  169.038   3.0006 -3.853333 3.875904 
1 1 1   15    1   13 o  195.944   1.8244  1565.48   29.140  1540.60   41.111  1590.61   41.310  194.339   2.5952  197.470   2.5664 -3.131104 3.649800 
1 1 1   15    1   14 o  220.806   1.9310  1988.06   34.756  1965.54   49.017  2010.83   49.289  219.500   2.7395  222.016   2.7235 -2.515869 3.862990 
1 1 1   15    1   15 o  210.562   2.0644  1808.00   35.432  1795.32   45.800  1826.89   55.920  209.784   2.6783  211.576   3.2424 -1.791977 4.205505 
1 1 1   15    1   16 o   93.888   1.7172  359.413   13.142  383.512   19.161  338.003   18.060   96.967   2.4241   90.999   2.4369 5.967766 3.437290 
1 1 1   15    1   17 o  106.297   1.8070  460.715   15.658  487.228   25.355  444.372   19.907  109.242   2.8497  104.380   2.3396 4.861938 3.687122 
1 1 1   15    1   18 o  135.460   1.6599  748.140   18.328  738.672   26.137  757.300   25.708  134.575   2.3826  136.264   2.3145 -1.689148 3.321720 
1 1 1   15    1   19 o  141.595   1.6734  817.451   19.314  817.080   27.702  817.802   26.943  141.536   2.4011  141.601   2.3342 -0.6544495E-01 3.348675 
1 1 1   15    1   20 o   93.670   1.7233  357.745   13.158  374.609   19.285  343.053   17.999   95.800   2.4715   91.677   2.4106 4.123131 3.452500 
1 1 1   15    1   21 o  136.664   1.8470  761.572   20.576  763.860   33.735  760.216   25.964  136.817   3.0248  136.524   2.3331 0.2931061 3.820076 
1 1 1   15    1   22 o  121.806   2.0993  605.064   20.844  581.553   29.695  627.902   29.266  119.338   3.0551  124.050   2.8942 -4.712845 4.208342 
1 1 1   15    1   23 o  151.644   2.1233  937.826   26.246  960.484   38.081  917.323   36.224  153.415   3.0451  149.934   2.9639 3.481644 4.249430 
1 1 1   15    1   24 o  216.685   2.1273  1914.84   37.574  1895.23   48.498  1944.28   59.427  215.527   2.7605  218.245   3.3404 -2.717926 4.333458 
1 1 1   15    1   25 o  269.351   2.3893  2959.28   52.460  2974.31   67.994  2937.19   82.460  269.963   3.0898  268.186   3.7720 1.776398 4.875969 
1 1 1   15    1   26 o   17.684   5.3249   12.891   8.3037   33.626   12.413  -3.9024   11.171   28.171   5.6029   12.487   5.5331 15.68355 7.874546 
1 1 1   15    1   27 o  117.920   1.6701  566.962   16.054  561.466   22.868  572.302   22.542  117.323   2.3912  118.452   2.3347 -1.128937 3.341899 
1 1 1   15    1   28 o  263.432   2.1495  2830.30   46.158  2899.95   66.586  2765.87   64.044  266.562   3.0644  260.332   3.0179 6.229858 4.301000 
1 1 1   15    1   29 o  157.097   1.7235  1006.31   22.070  1036.25   31.926  978.901   30.544  159.381   2.4574  154.910   2.4189 4.471115 3.448112 
1 1 1   15    1   30 o  105.265   1.7040  451.815   14.621  429.060   20.768  474.178   20.588  102.555   2.4842  107.818   2.3426 -5.262833 3.414529 
1 1 1   15    1   31 o   50.090   2.4198  102.587   9.8510  101.438   14.320  103.619   13.572   49.715   3.5572   50.270   3.3309 -0.5555382 4.873312 
1 1 1   15    1   32 o  217.529   1.9300  1929.70   34.223  1957.70   48.970  1902.97   47.846  219.039   2.7427  215.957   2.7180 3.081528 3.861300 
1 1 1   15    1   33 o   61.956   2.3362  156.805   11.777  151.118   15.555  164.447   18.029   60.763   3.1512   63.363   3.5043 -2.600132 4.712726 
1 1 1   15    1   34 o  187.810   1.9958  1438.52   30.554  1422.46   39.403  1462.73   48.388  186.719   2.5888  189.296   3.1359 -2.577240 4.066426 
1 1 1   15    1   35 o   81.128   2.0263  268.430   13.400  254.664   17.433  288.311   20.950   78.953   2.7128   83.987   3.0653 -5.034088 4.093280 
1 1 1   15    1   36 o   96.297   1.9298  378.180   15.148  385.673   19.987  368.065   23.221   97.193   2.5249   94.912   3.0052 2.280540 3.925087 
1 1 1   15    1   37 o   71.577   2.1663  209.165   12.625  201.834   16.679  218.999   19.319   70.261   2.9186   73.166   3.2473 -2.905655 4.366179 
1 1 1   15    1   38 o   94.912   1.9739  367.395   15.271  389.779   20.499  339.478   22.893   97.704   2.5761   91.139   3.0860 6.564880 4.019859 
1 1 1   15    1   39 o   87.052   1.8802  309.050   13.342  299.560   19.332  317.680   18.436   85.629   2.7734   88.198   2.5670 -2.569092 3.779021 
1 1 1   15    1   40 o  247.617   2.1003  2500.99   42.392  2521.90   60.716  2481.10   59.216  248.548   2.9968  246.536   2.9466 2.011978 4.202775 
1 1 1   15    1   41 o  156.538   1.7931  999.314   22.880  1005.03   32.976  994.005   31.773  156.935   2.5778  156.078   2.4974 0.8575897 3.589107 
1 1 1   15    1   42 o  120.934   1.8062  596.445   17.805  582.818   25.492  609.426   24.880  119.504   2.6169  122.208   2.4976 -2.704552 3.617436 
1 1 1   15    1   43 o   89.240   2.6947  325.337   19.580  314.478   32.387  331.592   24.581   87.546   4.5540   90.037   3.3550 -2.491524 5.656419 
1 1 1   15    1   44 o   56.100   3.5557  129.098   16.176  112.964   26.945  138.190   20.227   52.040   6.4928   57.965   4.3117 -5.924725 7.794075 
1 1 1   15    1   45 o  130.692   2.5095  697.009   26.734  693.717   45.945  698.694   32.872  130.152   4.3367  130.809   3.0829 -0.6565247 5.320806 
1 1 1   15    1   46 o  218.269   2.8142  1944.85   50.070   0.0000   0.0000  1944.85   50.070  ?   ?   218.269   2.8142 0.000000 2.814156 
1 1 1   15    1   47 o  203.360   2.1078  1687.11   34.941  1699.50   55.617  1679.03   44.911  203.960   3.3452  202.810   2.7166 1.150772 4.309324 
1 1 1   15    1   48 f  124.603   1.9295  633.312   19.597  656.233   31.539  618.895   25.012  126.760   3.0523  123.143   2.4918 3.616852 3.940241 
1 1 1   15    1   49 o  111.105   1.9383  503.555   17.554  519.806   28.180  493.251   22.440  112.768   3.0685  109.930   2.5042 2.838112 3.960635 
1 1 1   15    1   50 o   91.736   2.0140  343.326   15.060  314.657   23.313  363.857   19.729   87.692   3.2672   94.375   2.5669 -6.683434 4.154931 
1 1 1   15    1   51 o  142.767   1.7513  831.380   20.380  831.716   29.185  831.060   28.473  142.738   2.5083  142.687   2.4480 0.5094910E-01 3.504894 
1 1 1   15    1   52 o   96.698   1.8410  381.446   14.511  375.625   20.881  386.883   20.180   95.872   2.6745   97.312   2.5462 -1.439323 3.692747 
1 1 1   15    1   53 o   80.791   1.9788  266.319   13.032  249.981   18.844  281.295   18.042   78.166   2.9628   82.952   2.6717 -4.786430 3.989524 
1 1 1   15    1   54 o   86.685   1.9110  306.579   13.503  302.753   19.482  310.117   18.733   86.047   2.7812   87.102   2.6415 -1.054947 3.835728 
1 1 1   15    1   55 o  100.106   1.8476  408.856   15.077  423.784   21.836  395.257   20.842  101.831   2.6328   98.344   2.6022 3.486290 3.701793 
1 1 1   15    1   56 o  123.220   1.9489  619.552   19.575  614.231   25.381  627.364   30.754  122.639   2.5389  123.889   3.0453 -1.249886 3.964816 
1 1 1   15    1   57 o  119.477   1.7729  582.401   17.266  591.689   24.909  573.810   23.955  120.361   2.5388  118.535   2.4793 1.826698 3.548566 
1 1 1   15    1   58 o   60.715   2.4730  150.811   12.214  110.255   19.098  178.876   15.887   51.625   4.5859   66.083   2.9568 -14.45751 5.456529 
1 1 1   15    1   59 o  179.094   1.9888  1309.15   29.034  1319.27   46.311  1302.59   37.267  179.589   3.1635  178.561   2.5604 1.027863 4.069826 
1 1 1   15    1   60 o  158.121   1.7713  1020.23   22.831  1035.33   32.972  1006.32   31.645  159.188   2.5410  156.951   2.4734 2.236481 3.546023 
1 1 1   15    1   61 o   86.833   2.4092  308.237   17.036  315.117   25.535  302.718   22.871   87.638   3.5819   85.941   3.2707 1.696762 4.850501 
1 1 1   15    1   62 o   89.725   2.3515  329.084   17.184  354.270   26.144  309.929   22.800   92.942   3.4569   86.959   3.2221 5.982666 4.725694 
1 1 1   15    1   63 o   86.053   3.2064  303.562   22.452   0.0000   0.0000  303.562   22.452  ?   ?    86.053   3.2064 0.000000 3.206429 
1 1 1   15    1   64 o   92.650   1.8214  350.390   13.756  315.827   19.699  383.285   19.217   87.834   2.7547   96.814   2.4370 -8.979393 3.677955 
1 1 1   15    1   65 o   46.848   2.6017   90.013   9.8962   88.356   14.731   91.377   13.360   46.224   3.9474   47.083   3.5061 -0.8594589 5.279642 
1 1 1   15    1   66 o   26.196   4.4959   29.030   9.2547   24.027   13.592   33.355   12.637   23.697   6.7252   27.881   5.7513 -4.184040 8.849077 
1 1 1   15    1   67 o   56.784   2.3744  132.046   10.966  104.082   16.127  156.101   14.957   50.168   3.9759   61.668   2.9843 -11.50028 4.971328 
1 1 1   15    1   68 o   89.569   1.8870  327.646   13.778  307.313   20.129  345.568   18.898   86.585   2.8559   91.877   2.5257 -5.292656 3.812521 
1 1 1   15    1   69 o   53.733   2.6075  118.442   11.387  130.668   17.046  108.590   15.301   56.259   3.7381   51.274   3.6855 4.985371 5.249462 
1 1 1   15    1   70 o  119.530   1.7980  583.561   17.519  583.443   25.550  583.666   24.068  119.374   2.6257  119.427   2.4723 -0.5361176E-01 3.606468 
1 1 1   15    1   71 o   84.081   1.8534  288.837   12.703  274.913   17.873  303.052   18.058   81.878   2.6815   85.989   2.5792 -4.111763 3.720582 
1 1 1   15    1   72 o   47.921   2.8345   94.485   11.023   83.221   18.027  101.212   13.930   44.490   5.0606   49.489   3.4753 -4.999237 6.138978 
1 1 1   15    1   73 o   58.031   2.3214  138.067   10.959  144.503   17.303  133.756   14.161   59.128   3.6071   56.992   3.0594 2.136269 4.729825 
1 1 1   15    1   74 o   54.312   2.6736  121.260   11.800  114.315   15.997  129.551   17.478   52.508   3.7623   55.890   3.8600 -3.381947 5.390211 
1 1 1   15    1   75 o   30.399   3.7569   38.718   9.1115   36.701   14.243   40.115   11.855   28.971   6.2171   30.672   4.9069 -1.700285 7.920216 
1 1 1   15    1   76 o   13.756   5.2839   5.4937   8.3248   2.1551   13.173   7.7135   10.742   15.084   6.3345   15.808   6.0192 -0.7238588 8.738277 
1 1 1   15    1   77 o   59.922   2.0220  147.165   9.8621  152.212   13.398  141.196   14.570   60.808   2.7097   58.480   3.0672 2.328487 4.092718 
1 1 1   15    1   78 o   35.077   2.5859   50.813   7.3418   46.836   11.210   53.801   9.7157   33.298   4.2248   35.942   3.3549 -2.643780 5.394804 
1 1 1   15    1   79 o  120.594   1.7084  594.952   16.794  571.817   30.537  604.983   20.108  117.641   3.1874  121.513   2.0301 -3.871948 3.778953 
1 1 1   15    1   80 o  109.266   1.5556  488.221   13.855  475.902   21.543  496.911   18.094  107.613   2.4559  110.110   2.0159 -2.497429 3.177290 
1 1 1   15    1   81 o   27.418   3.1499   31.478   6.9121   41.593   10.597   23.987   9.1190   31.261   4.2700   23.434   4.9302 7.827288 6.522272 
1 1 1   15    1   82 o   11.772   4.5487   3.9556   6.1957   17.370   9.9592  -4.5138   7.9134   19.879   5.7931   9.8479   4.4838 10.03107 7.325609 
1 1 1   15    1   83 o   36.005   2.4163   53.599   7.0508   56.991   11.723   51.677   8.8253   36.700   3.9826   35.187   3.1089 1.513451 5.052343 
1 1 1   15    1   84 o   79.895   1.4710  261.197   9.5800  274.281   14.912  252.001   12.501   81.628   2.2432   78.357   1.9572 3.271408 2.976993 
1 1 1   15    1   85 o   18.121   4.2810   14.384   6.2223   8.3134   9.8853   18.367   8.0077   15.466   5.7998   20.377   4.8845 -4.910782 7.582632 
1 1 1   15    1   86 o   35.044   2.2997   50.806   6.5331   44.091   10.192   55.488   8.5115   32.155   3.9730   36.479   2.8859 -4.323956 4.910475 
1 1 1   15    1   87 f   31.988   2.4931   42.515   6.4494   47.480   10.275   39.287   8.2848   33.399   3.8440   30.494   3.3902 2.905024 5.125412 
1 1 1   15    1   88 o   15.358   4.4671   10.289   5.9269   3.8495   9.4345   14.487   7.6176   13.411   5.4697   18.048   5.0039 -4.637172 7.413273 
1 1 1   15    1   89 o   29.872   2.8971   37.434   6.9660   35.034   10.130   39.586   9.5943   28.317   4.5424   30.362   3.9716 -2.045483 6.033823 
1 1 1   15    1   90 o   11.917   4.7839   3.4078   7.0887  -2.7073   11.594   7.0590   8.9584   12.558   5.5963   14.424   5.4959 -1.866303 7.843677 
1 1 1   15    1   91 o   64.431   1.7455  170.686   9.1590  174.269   13.578  167.694   12.406   64.774   2.5768   63.619   2.3966 1.154900 3.519048 
1 1 1   15    1   92 o   85.246   1.5598  298.162   10.839  304.547   16.040  292.796   14.704   85.792   2.2957   84.200   2.1441 1.592072 3.141239 
1 1 1   15    1   93 o   15.084   4.6790   9.9255   6.3501  -0.9416   10.080   17.075   8.1763   12.105   5.3142   19.397   5.1033 -7.291726 7.367761 
1 1 1   15    1   94 o   58.425   1.8915  140.791   8.9963  145.567   15.931  138.554   10.901   58.682   3.3443   57.788   2.3188 0.8939171 4.069551 
1 1 1   15    1   95 o   57.585   1.8743  136.832   8.7865  141.375   15.364  134.624   10.711   57.818   3.2733   56.937   2.3126 0.8814087 4.007831 
1 1 1   15    1   96 o   45.968   1.8016   87.223   6.7378   75.345   10.940   94.481   8.5523   42.141   3.2089   47.698   2.2056 -5.557289 3.893827 
1 1 1   15    1   97 o   35.110   2.0309   51.173   5.7877   48.944   8.8988   52.806   7.6193   33.852   3.2653   35.442   2.6567 -1.589813 4.209550 
1 1 1   15    1   98 o   12.083   4.2234   5.8910   5.1225   4.9341   8.0527   6.5413   6.6390   12.859   5.1200   13.022   4.7771 -0.1632442 7.002474 
1 1 1   15    1   99 o   20.685   3.2486   18.596   5.2971   24.580   8.3898   14.630   6.8307   23.212   4.5968   17.813   4.6539 5.399349 6.541367 
1 1 1   15    1  100 o   50.819   1.5952  106.584   6.6000   99.974   9.8128  112.044   8.9187   48.791   2.4753   51.865   2.1140 -3.073063 3.255198 
1 1 1   15    1  101 o   8.7271   3.7813  -0.0555   4.9628 -10.9705   7.5765   8.1468   6.5679   7.8957   3.8234   13.757   4.7839 -5.861192 6.124083 
1 1 1   15    1  102 o   34.661   2.6399   50.973   7.4027   47.942   8.8025   58.294   13.681   33.252   3.2906   35.530   4.8504 -2.278664 5.861260 
1 1 1   15    1  103 o   29.339   3.0253   37.174   7.1315   34.657   8.4390   43.461   13.338   27.871   3.8145   29.815   5.6959 -1.944286 6.855156 
1 1 1   15    1  104 o   33.710   3.0340   49.136   8.2480   37.470   10.303   69.956   13.764   28.371   4.6133   39.115   4.3926 -10.74433 6.369986 
1 1 1   15    1  105 o   39.850   3.1664   69.043   10.201   63.781   14.840   73.758   14.046   36.549   5.1214   40.109   4.3667 -3.560516 6.730236 
1 1 1   15    1  106 o   21.176   5.3252   22.271   9.1817   33.402   13.372   12.342   12.629   25.013   6.4999   16.402   6.4493 8.610483 9.156511 
1 1 1   15    1  107 o   14.428   5.6331   8.6655   9.5779   8.2821   15.396   8.9076   12.233   15.691   6.7279   15.143   6.2083 0.5473366 9.154697 
1 1 1   15    1  108 o   26.286   5.3593   34.229   11.094   39.993   16.450   29.422   15.024   26.284   7.3779   22.551   7.2242 3.732618 10.32583 
1 1 1   15    1  109 o   42.342   3.5989   80.000   12.304   75.971   17.699   83.768   17.117   38.808   5.7701   41.529   5.1677 -2.721180 7.745893 
1 1 1   15    1  110 o   12.912   5.8048   0.5984   12.771 -21.8916   21.965   12.084   15.697   12.844   6.2840   16.507   6.9222 -3.662148 9.349049 
1 1 1   15    1  111 o   29.288   6.0683   44.922   14.011   51.380   25.225   42.041   16.849   26.089   9.3480   26.562   7.4706 -0.4731121 11.96638 
1 1 1   15    1  112 o   15.474   6.4573   9.9839   13.558  -9.6207   24.162   18.994   16.380   14.568   6.9973   18.362   7.3052 -3.793746 10.11570 
1 1 1   15    1  113 o   14.313   6.2139   5.9912   13.457  -6.7618   23.862   11.939   16.295   14.752   7.0503   16.363   6.9662 -1.610771 9.911340 
1 1 1   15    1  114 o   11.780   5.5067  -5.0575   13.126 -15.2310   21.925   0.6262   16.388   13.318   6.4621   13.923   6.3821 -0.6046886 9.082356 
1 1 1   15    1  115 o   10.415   4.9615  -8.8663   11.621  -6.6314   16.521 -11.0548   16.349   12.719   6.0173   12.039   5.7754 0.6801262 8.340432 
1 1 1   15    1  116 o   24.268   6.0702   32.003   11.977   37.948   17.279   26.506   16.615   24.204   7.7469   20.349   7.5411 3.855289 10.81117 
1 1 1   15    1  117 o   29.467   5.3689   44.070   12.421   24.567   17.530   63.735   17.602   19.609   7.6308   33.926   6.6028 -14.31673 10.09084 
1 1 1   15    1  118 o   11.417   5.2845  -3.4133   11.629   9.3178   17.075 -14.4272   15.881   15.717   6.9073   11.420   5.5314 4.296492 8.849163 
1 1 1   15    2 -116 o   27.884   7.0125   45.392   15.921   45.804   29.140   45.217   19.010   22.767   9.4808   26.054   8.0978 -3.287853 12.46835 
1 1 1   15    2 -115 f   13.220   5.9078   2.6334   13.015   1.8298   18.350   3.4469   18.462   14.484   6.6808   14.782   6.7751 -0.2975407 9.514953 
1 1 1   15    2 -114 o   24.824   7.1152   37.037   15.140   15.194   25.356   49.139   18.873   17.593   8.0164   27.521   7.9615 -9.928371 11.29815 
1 1 1   15    2 -113 o   27.761   6.2770   41.989   13.870   54.902   19.482   28.718   19.751   29.441   7.9381   20.571   8.0721 8.870090 11.32129 
1 1 1   15    2 -112 o   17.020   6.6252   15.391   13.217  -5.5692   18.630   36.631   18.754   13.547   6.4032   23.381   8.0865 -9.834754 10.31465 
1 1 1   15    2 -111 o   17.228   6.6913   15.849   13.459   21.710   19.100   10.068   18.968   18.950   7.7620   16.298   7.2163 2.652359 10.59827 
1 1 1   15    2 -110 o   15.597   6.4086   10.748   13.073   2.1409   18.856   18.715   18.141   14.890   6.8329   18.274   7.5332 -3.383808 10.17041 
1 1 1   15    2 -109 o   16.930   6.6044   14.659   13.157   8.2465   18.789   20.829   18.431   16.050   7.1401   18.915   7.6708 -2.865196 10.47960 
1 1 1   15    2 -108 o   20.494   6.7294   23.715   12.990   26.327   18.666   21.262   18.089   20.527   7.9050   19.113   7.6524 1.414106 11.00214 
1 1 1   15    2 -107 o   22.040   6.6563   27.089   12.962   26.759   18.396   27.414   18.266   20.786   7.8859   21.004   7.8823 -0.2178822 11.14983 
1 1 1   15    2 -106 o   21.925   6.6181   26.503   12.816   14.277   18.150   38.660   18.099   17.504   7.3977   25.040   7.9186 -7.536415 10.83650 
1 1 1   15    2 -105 f   18.516   6.6715   18.255   12.869   11.400   18.486   24.700   17.924   16.974   7.3263   20.455   7.7786 -3.481041 10.68557 
1 1 1   15    2 -104 o   46.263   3.3145   93.747   12.417   93.118   15.608   94.831   20.492   45.066   4.3009   43.428   5.9445 1.637730 7.337224 
1 1 1   15    2 -103 o   16.574   6.2105   13.129   11.330   31.452   14.242 -18.4570   18.700   23.893   6.9175   12.349   5.9862 11.54380 9.148029 
1 1 1   15    2 -102 o   21.289   6.0064   23.274   10.874   32.852   13.973   8.5697   17.313   24.727   6.7465   16.382   7.0805 8.344568 9.779982 
1 1 1   15    2 -101 o   25.438   6.0315   32.660   12.316   25.533   13.647   63.943   28.591   21.827   6.8725   30.362   9.9843 -8.534258 12.12100 
1 1 1   15    2 -100 o   22.332   6.4506   25.668   12.398   27.337   13.796   18.659   28.269   22.758   6.8658   20.398   8.9284 2.360415 11.26302 
1 1 1   15    2  -99 o   33.398   4.8490   51.382   12.815   43.265   14.160   88.125   30.127   29.671   6.0599   37.864   9.7141 -8.193575 11.44931 
1 1 1   15    2  -98 o   28.919   5.2655   39.247   11.955   36.165   13.290   52.322   27.374   27.088   6.1587   28.718   9.7749 -1.629635 11.55322 
1 1 1   15    2  -97 o   11.915   5.2218   0.0340   9.6953   5.3520   12.748  -7.2634   14.933   14.826   6.2290   12.858   5.9644 1.967217 8.624085 
1 1 1   15    2  -96 o   20.776   5.9934   20.828   10.709   12.315   14.351   31.525   16.087   17.545   6.8819   24.689   7.4064 -7.144848 10.11018 
1 1 1   15    2  -95 o   34.566   4.0481   52.302   11.190   43.396   15.076   63.225   16.698   29.993   6.3639   36.855   5.7454 -6.862478 8.573725 
1 1 1   15    2  -94 o   46.207   3.2353   90.656   12.109   85.154   17.143   96.135   17.106   43.674   4.8997   46.699   4.5514 -3.025150 6.687515 
1 1 1   15    2  -93 o   15.671   4.2947   10.975   5.6480   27.356   12.730   6.9604   6.3022   23.881   6.4073   13.222   4.6794 10.65893 7.934078 
1 1 1   15    2  -92 o   17.153   4.3335   13.166   6.0603   9.9902   12.681   14.107   6.8992   16.689   6.4913   17.682   4.7046 -0.9932480 8.016859 
1 1 1   15    2  -91 o   53.985   2.0369  120.414   8.9475   83.080   19.760  130.044   10.035   42.773   5.8178   56.042   2.2011 -13.26830 6.220275 
1 1 1   15    2  -90 o   43.742   2.0804   79.110   7.3969   77.816   14.564   79.560   8.5867   42.435   4.2683   43.759   2.4167 -1.323448 4.905005 
1 1 1   15    2  -89 o   24.040   4.2132   25.301   7.9555   20.791   12.890   28.076   10.111   21.196   6.6802   24.981   5.1369 -3.784672 8.426890 
1 1 1   15    2  -88 o   36.467   2.9521   55.778   8.7004   70.524   13.494   45.285   11.382   40.511   4.1446   32.251   4.4480 8.259609 6.079685 
1 1 1   15    2  -87 o   54.401   1.9148  121.880   8.4778   87.618   15.170  137.441   10.223   45.224   4.1617   57.687   2.1780 -12.46322 4.697178 
1 1 1   15    2  -86 f   43.134   2.3956   77.094   8.3901   74.418   14.008   78.591   10.477   41.688   4.1785   43.358   2.9826 -1.670033 5.133781 
1 1 1   15    2  -85 o   30.828   3.1016   39.949   7.6882   25.475   12.887   47.947   9.5797   23.494   6.5064   33.652   3.5455 -10.15791 7.409682 
1 1 1   15    2  -84 o   57.192   2.0717  134.712   9.6423  120.518   15.594  143.497   12.269   53.531   3.5946   58.870   2.5628 -5.338520 4.414640 
1 1 1   15    2  -83 o   15.334   4.9496   9.8949   7.0432   10.560   12.322   9.5722   8.5838   17.177   6.4680   15.572   5.4654 1.604899 8.467875 
1 1 1   15    2  -82 o   30.836   3.1481   39.871   7.8020   18.990   13.488   50.370   9.5645   20.837   6.8580   34.608   3.4357 -13.77129 7.670429 
1 1 1   15    2  -81 f   61.595   1.9770  155.877   9.9132  157.546   16.162  154.871   12.552   61.514   3.2345   61.243   2.5196 0.2715950 4.100073 
1 1 1   15    2  -80 o   36.377   2.7788   54.946   8.1777   42.827   13.756   61.570   10.170   31.185   5.6182   38.385   3.2816 -7.200542 6.506386 
1 1 1   15    2  -79 o   89.769   1.7468  330.030   12.782  328.667   20.211  330.938   16.502   89.213   2.7826   89.721   2.2581 -0.5073929 3.583524 
1 1 1   15    2  -78 o   52.901   2.2213  115.084   9.5574   94.512   15.997  126.502   11.918   47.380   4.1850   55.366   2.6485 -7.986141 4.952661 
1 1 1   15    2  -77 o   64.577   1.6771  170.730   8.8208  179.929   12.157  160.503   12.818   66.175   2.2570   62.433   2.5240 3.742447 3.385900 
1 1 1   15    2  -76 o   69.075   1.6829  195.171   9.4755  206.336   13.196  183.287   13.614   70.879   2.2870   66.747   2.5067 4.132294 3.393229 
1 1 1   15    2  -75 o   55.021   1.8061  123.995   8.0893  129.772   10.905  116.926   12.063   56.188   2.3863   53.245   2.7889 2.942677 3.670521 
1 1 1   15    2  -74 o   44.998   1.9903   83.043   7.2823   82.922   9.8024   83.192   10.879   44.849   2.6937   44.863   2.9920 -0.1414871E-01 4.025907 
1 1 1   15    2  -73 o   63.469   1.7038  164.790   8.8071  166.218   11.921  163.073   13.069   63.648   2.3014   62.995   2.5503 0.6537056 3.435178 
1 1 1   15    2  -72 o   33.506   3.0711   46.541   8.2948   39.303   14.430   50.113   10.137   30.029   6.1032   34.664   3.6419 -4.635542 7.107201 
1 1 1   15    2  -71 o   40.523   2.2897   67.449   7.5328   68.206   9.6275   66.254   12.096   40.653   2.9248   39.901   3.7635 0.7522049 4.766410 
1 1 1   15    2  -70 o   20.873   4.0237   18.581   6.5980   16.809   8.8652   20.781   9.8789   19.751   5.3674   21.891   5.5340 -2.140512 7.709386 
1 1 1   15    2  -69 f   66.045   2.0709  178.537   11.135  203.121   18.643  164.903   13.883   70.235   3.2653   63.376   2.6935 6.858997 4.232855 
1 1 1   15    2  -68 o   67.310   1.8266  185.236   10.013  188.408   13.805  181.715   14.544   67.792   2.5025   66.546   2.6867 1.246361 3.671602 
1 1 1   15    2  -67 o   15.916   5.0742   10.316   7.4187   18.526   10.332   1.5771   10.659   20.790   5.8509   13.646   5.7122 7.143955 8.176948 
1 1 1   15    2  -66 o   42.534   2.5265   74.291   8.7202   70.097   12.079   78.856   12.602   41.143   3.6393   43.668   3.5713 -2.525352 5.098889 
1 1 1   15    2  -65 o   35.367   2.9872   51.608   8.5315   49.783   12.448   53.226   11.716   34.454   4.5429   35.734   4.0960 -1.280327 6.116828 
1 1 1   15    2  -64 o   49.080   2.3467   98.700   9.3611   91.133   13.431  105.849   13.055   46.994   3.5319   50.723   3.1733 -3.728050 4.748028 
1 1 1   15    2  -63 o  142.991   1.7145  834.624   19.984  806.518   28.377  862.279   28.149  140.445   2.4787  145.238   2.3776 -4.792557 3.434678 
1 1 1   15    2  -62 o   10.845   4.7155  -1.2820   7.7743   10.373   11.497 -11.0994   10.552   17.341   6.2981   10.388   4.8820 6.953129 7.968669 
1 1 1   15    2  -61 o  121.881   1.9991  606.585   19.862  557.281   28.037  656.253   28.140  116.657   2.9507  126.671   2.7253 -10.01376 4.016739 
1 1 1   15    2  -60 o   71.543   2.0566  209.180   11.981  215.188   19.049  205.248   15.411   72.422   3.2349   70.801   2.6751 1.620941 4.197761 
1 1 1   15    2  -59 o   71.243   2.7932  207.868   16.190  208.443   18.957  206.317   31.119   71.278   3.2714   70.501   5.4574 0.7771530 6.362850 
1 1 1   15    2  -58 o   23.607   6.2769   23.887   12.286   20.255   14.067   35.572   25.231   22.181   6.9767   29.253   9.3610 -7.071547 11.67490 
1 1 1   15    2  -57 o   45.249   2.9889   84.102   10.963   83.192   11.952   88.930   27.524   44.967   3.2833   45.611   7.6751 -0.6443253 8.347895 
1 1 1   15    2  -56 o  105.696   1.7935  455.878   15.453  457.558   18.770  452.346   27.222  105.860   2.1751  105.102   3.1811 0.7586441 3.853649 
1 1 1   15    2  -55 o   27.953   3.6888   32.550   8.2002   30.639   11.637   34.434   11.557   26.792   5.5127   28.501   5.1645 -1.709850 7.553887 
1 1 1   15    2  -54 o  146.533   1.6076  875.917   19.202  871.843   25.887  880.900   28.632  146.137   2.1731  146.869   2.3916 -0.7317352 3.231416 
1 1 1   15    2  -53 o   46.509   2.1807   88.492   8.2445   81.556   13.091   93.052   10.614   44.489   3.6417   47.644   2.7445 -3.155132 4.560074 
1 1 1   15    2  -52 o   84.386   1.5587  290.456   10.722  284.562   16.205  295.045   14.300   83.449   2.3847   85.026   2.0632 -1.576813 3.153330 
1 1 1   15    2  -51 o   39.046   2.4780   62.503   7.8462   51.135   12.197   70.528   10.248   35.055   4.3624   41.429   3.0562 -6.373348 5.326476 
1 1 1   15    2  -50 f   34.643   2.8559   49.359   7.9932   43.292   11.911   54.331   10.782   32.160   4.6809   36.253   3.7002 -4.093048 5.966758 
1 1 1   15    2  -49 f   62.343   1.9052  158.721   9.6707  141.810   14.009  174.115   13.366   58.843   2.9299   65.254   2.5176 -6.411064 3.862978 
1 1 1   15    2  -48 o  121.983   1.7287  606.961   17.190  599.289   21.640  620.079   28.297  121.180   2.1907  123.212   2.8174 -2.031532 3.568912 
1 1 1   15    2  -47 o  256.612   2.1178  2686.99   44.299  2775.07   56.414  2545.33   71.545  260.697   2.6547  249.500   3.5178 11.19685 4.407118 
1 1 1   15    2  -46 o  120.514   1.9680  592.518   19.333  597.552   26.863  587.108   27.846  120.972   2.7241  119.899   2.8491 1.072182 3.941897 
1 1 1   15    2  -45 o  166.358   1.7759  1128.80   24.083  1173.62   36.827  1095.32   31.832  169.548   2.6647  163.823   2.3837 5.725281 3.575275 
1 1 1   15    2  -44 o   86.316   1.7601  303.877   12.384  336.055   21.995  288.940   14.986   90.662   2.9802   84.123   2.1872 6.539032 3.696721 
1 1 1   15    2  -43 o   59.965   2.1410  146.891   10.448  140.677   18.773  149.679   12.576   58.517   3.9590   60.504   2.5557 -1.986607 4.712254 
1 1 1   15    2  -42 o  204.969   1.6733  1713.33   27.958  1659.01   39.614  1767.24   39.464  201.630   2.4102  208.111   2.3263 -6.481766 3.349757 
1 1 1   15    2  -41 o   72.552   1.8683  214.832   11.040  206.251   16.888  221.235   14.589   71.015   2.9236   73.591   2.4353 -2.575806 3.805039 
1 1 1   15    2  -40 o  135.342   1.6532  746.973   18.239  764.214   28.763  735.379   23.587  136.842   2.5786  134.262   2.1552 2.579849 3.360610 
1 1 1   15    2  -39 o  116.815   1.7105  556.481   16.288  527.151   25.303  577.234   21.284  113.644   2.7314  118.951   2.1950 -5.307045 3.504109 
1 1 1   15    2  -38 o  110.909   1.7278  501.643   15.620  553.780   25.336  469.673   19.840  116.482   2.6683  107.294   2.2685 9.188721 3.502256 
1 1 1   15    2  -37 o  208.846   1.9312  1779.00   32.877  1733.56   56.702  1802.01   40.353  206.009   3.3766  210.156   2.3556 -4.147018 4.117045 
1 1 1   15    2  -36 o  137.318   1.5383  768.870   17.219  729.943   24.932  804.372   23.809  133.760   2.2866  140.426   2.0800 -6.665894 3.091107 
1 1 1   15    2  -35 o  114.582   1.5397  535.342   14.381  506.519   21.108  560.313   19.647  111.424   2.3239  117.204   2.0564 -5.780144 3.103148 
1 1 1   15    2  -34 o  225.239   1.7315  2068.85   31.791  2025.82   45.311  2110.56   44.615  222.820   2.4947  227.441   2.4064 -4.621490 3.466170 
1 1 1   15    2  -33 o   62.180   1.8635  157.822   9.4345  168.787   14.709  150.158   12.297   64.246   2.8155   60.613   2.4942 3.633041 3.761431 
1 1 1   15    2  -32 f   73.493   1.5853  220.233   9.4969  220.358   13.515  220.111   13.348   73.462   2.2597   73.423   2.2328 0.3952789E-01 3.176671 
1 1 1   15    2  -31 o  128.880   1.3741  677.194   14.435  667.504   19.844  688.086   21.038  127.935   1.9028  129.889   1.9870 -1.953873 2.751160 
1 1 1   15    2  -30 f  181.494   1.5489  1343.08   22.915  1326.69   32.848  1358.62   31.982  180.344   2.2344  182.507   2.1498 -2.162842 3.100698 
1 1 1   15    2  -29 o  227.003   1.7098  2101.25   31.638  2054.75   44.678  2148.03   44.809  224.421   2.4423  229.463   2.3956 -5.042099 3.421074 
1 1 1   15    2  -28 o  218.660   1.6728  1949.58   29.816  1900.57   42.043  1999.17   42.290  215.844   2.3896  221.375   2.3436 -5.531799 3.347000 
1 1 1   15    2  -27 o   85.162   1.6734  295.731   11.617  297.325   15.682  293.791   17.294   85.346   2.2561   84.822   2.5039 0.5239487 3.370383 
1 1 1   15    2  -26 o  238.493   1.8825  2319.52   36.598  2314.87   48.642  2325.60   55.559  238.202   2.5051  238.718   2.8552 -0.5161896 3.798373 
1 1 1   15    2  -25 o  188.538   1.6891  1449.43   25.959  1475.59   34.875  1416.92   38.874  190.199   2.2494  186.358   2.5590 3.840988 3.407106 
1 1 1   15    2  -24 o   57.808   1.9965  136.446   9.3938  128.336   12.706  146.221   13.950   56.011   2.7917   59.790   2.8707 -3.778942 4.004351 
1 1 1   15    2  -23 o   83.160   1.5346  281.965   10.403  278.728   15.429  284.663   14.086   82.632   2.2928   83.545   2.0684 -0.9134140 3.087895 
1 1 1   15    2  -22 o   70.859   1.6360  204.726   9.4497  198.592   14.166  209.644   12.684   69.726   2.4964   71.661   2.1739 -1.934860 3.310283 
1 1 1   15    2  -21 o  117.171   1.4306  559.730   13.664  562.653   19.899  557.122   18.796  117.457   2.0783  116.882   1.9728 0.5749741 2.865558 
1 1 1   15    2  -20 o   61.767   1.7597  155.695   8.8510  159.057   13.019  152.805   12.070   62.387   2.5655   61.156   2.4260 1.231609 3.530837 
1 1 1   15    2  -19 o  102.840   1.4543  431.190   12.191  449.596   18.214  416.250   16.410  104.994   2.1281  101.029   1.9926 3.964615 2.915373 
1 1 1   15    2  -18 o  180.998   1.5416  1335.68   22.745  1337.61   32.792  1333.88   31.574  181.095   2.2214  180.847   2.1418 0.2481232 3.085779 
1 1 1   15    2  -17 o  252.548   1.9349  2600.92   39.832  2606.88   53.388  2593.44   59.821  252.784   2.5910  252.099   2.9110 0.6844330 3.897087 
1 1 1   15    2  -16 o   57.881   1.9444  136.771   9.1608  148.753   13.247  125.788   12.682   60.321   2.7009   55.452   2.8149 4.869511 3.901102 
1 1 1   15    2  -15 o  159.444   1.6887  1036.57   21.948  1030.75   31.515  1042.05   30.584  158.962   2.4321  159.835   2.3474 -0.8737183 3.380153 
1 1 1   15    2  -14 o   55.903   2.1497  127.645   9.7778  130.755   14.951  125.320   12.925   56.505   3.2598   55.344   2.8748 1.160614 4.346370 
1 1 1   15    2  -13 o  273.370   2.1907  3047.88   48.816  2975.42   68.427  3122.98   69.662  270.010   3.1089  276.626   3.0894 -6.616608 4.382871 
1 1 1   15    2  -12 o  243.423   1.8887  2416.25   37.476  2424.07   57.780  2410.58   49.237  243.734   2.9082  243.093   2.4848 0.6409607 3.825139 
1 1 1   15    2  -11 o  327.398   2.3007  4371.95   61.402  4391.80   94.528  4357.46   80.759  327.978   3.5357  326.767   3.0319 1.210327 4.657665 
1 1 1   15    2  -10 o  152.372   1.5685  946.591   19.482  941.924   30.408  949.841   25.374  151.959   2.4548  152.615   2.0397 -0.6568146 3.191625 
1 1 1   15    2   -9 o  202.619   1.8626  1674.06   30.764  1726.78   44.749  1626.81   42.362  205.733   2.6683  199.694   2.6024 6.039276 3.727261 
1 1 1   15    2   -8 o  232.841   2.0060  2210.87   38.075  2177.66   46.609  2277.49   66.011  231.053   2.4747  236.199   3.4285 -5.146179 4.228335 
1 1 1   15    2   -7 o  219.773   1.8008  1969.46   32.261  1936.54   42.615  2013.65   49.375  217.892   2.3993  222.162   2.7265 -4.270264 3.631838 
1 1 1   15    2   -6 o  116.390   1.8192  552.371   17.259  529.608   22.605  584.192   26.726  113.946   2.4337  119.661   2.7400 -5.715027 3.664720 
1 1 1   15    2   -5 o   91.982   2.2197  345.062   16.643  345.062   16.643   0.0000   0.0000   91.982   2.2197  ?   ?  0.000000 2.219702 
1 1 1   15    2   -4 o  209.156   2.0519  1784.00   34.984  1817.26   56.692  1763.54   44.459  211.003   3.2961  207.916   2.6232 3.086472 4.212511 
1 1 1   15    2   -3 o  179.839   1.9217  1318.84   28.171  1336.52   45.724  1308.02   35.765  180.969   3.0996  179.073   2.4502 1.896347 3.951057 
1 1 1   15    2   -2 o  137.348   1.9681  769.265   22.034  732.931   42.900  782.284   25.681  133.903   3.9346  138.493   2.2748 -4.589874 4.544898 
1 1 1   15    2   -1 o  136.692   1.8114  761.875   20.184  740.638   32.604  775.070   25.701  134.723   2.9688  137.853   2.2871 -3.129181 3.747659 
1 1 1   15    2    0 o  341.713   2.8120  4764.20   78.327  4820.94  125.721  4728.21  100.137  343.460   4.4905  340.303   3.6099 3.156860 5.761579 
1 1 1   15    2    1 o  230.169   1.9747  2160.35   37.050  2136.23   52.503  2184.28   52.290  228.818   2.8149  231.381   2.7724 -2.562897 3.950936 
1 1 1   15    2    2 o  122.776   1.6458  614.600   16.471  596.334   23.645  631.822   22.959  120.913   2.3990  124.464   2.2629 -3.551117 3.297850 
1 1 1   15    2    3 o  117.543   1.6462  563.327   15.773  549.684   22.770  575.911   21.870  116.087   2.4063  118.830   2.2578 -2.742668 3.299638 
1 1 1   15    2    4 o  163.929   1.7153  1095.70   22.921  1085.05   32.776  1105.89   32.067  163.096   2.4653  164.659   2.3891 -1.563004 3.433033 
1 1 1   15    2    5 o  187.729   1.7926  1437.00   27.431  1435.18   39.313  1438.73   38.294  187.567   2.5712  187.803   2.5015 -0.2364655 3.587266 
1 1 1   15    2    6 o  159.449   1.7076  1036.62   22.195  1061.64   32.289  1014.21   30.559  161.327   2.4553  157.686   2.3774 3.640823 3.417746 
1 1 1   15    2    7 o   71.664   1.8693  209.561   10.910  211.370   16.216  208.064   14.748   71.924   2.7710   71.373   2.5390 0.5508881 3.758331 
1 1 1   15    2    8 o   74.952   1.8320  229.071   11.193  225.893   16.514  231.772   15.223   74.360   2.7290   75.337   2.4823 -0.9777298 3.689109 
1 1 1   15    2    9 o   91.538   1.7179  341.649   12.818  351.490   18.925  333.307   17.423   92.792   2.5043   90.366   2.3674 2.425896 3.446173 
1 1 1   15    2   10 o  191.656   1.9934  1497.92   31.142  1496.74   50.598  1498.64   39.513  191.495   3.2414  191.670   2.5290 -0.1754456 4.111300 
1 1 1   15    2   11 o  227.268   1.9658  2106.26   36.417  2119.29   52.220  2093.93   50.813  227.906   2.8109  226.543   2.7516 1.363037 3.933491 
1 1 1   15    2   12 o   90.816   1.7307  336.287   12.812  336.006   18.873  336.526   17.448   90.720   2.5547   90.802   2.3593 -0.8152771E-01 3.477463 
1 1 1   15    2   13 o  121.220   1.6512  599.127   16.316  632.828   24.122  570.705   22.153  124.557   2.3758  118.289   2.2975 6.268677 3.304981 
1 1 1   15    2   14 o  175.973   1.9435  1262.78   27.878  1216.11   35.633  1336.43   44.762  172.659   2.5318  180.963   3.0345 -8.304550 3.951985 
1 1 1   15    2   15 o  197.531   2.0207  1591.20   32.537  1675.05   54.000  1543.41   40.768  202.575   3.2702  194.507   2.5713 8.067322 4.160020 
1 1 1   15    2   16 o  224.736   2.4019  2060.18   44.002  2103.09   64.034  2021.79   60.566  226.964   3.4611  222.547   3.3387 4.417114 4.808952 
1 1 1   15    2   17 o  362.310   3.3126  5358.56   97.834  5450.68  140.550  5271.97  136.265  365.115   4.7224  359.096   4.6552 6.019379 6.631147 
1 1 1   15    2   18 o  110.119   2.1342  494.556   19.157  520.207   28.353  473.010   25.986  112.856   3.0849  107.620   2.9650 5.236252 4.278744 
1 1 1   15    2   19 o  146.737   1.8712  878.032   22.381  859.604   28.829  905.990   35.510  145.163   2.4363  149.000   2.9236 -3.836685 3.805697 
1 1 1   15    2   20 o  153.075   2.1023  955.646   26.233  955.097   37.410  956.177   36.795  152.979   2.9999  153.069   2.9489 -0.8988953E-01 4.206648 
1 1 1   15    2   21 o   78.949   1.8456  254.165   11.877  240.816   17.437  265.721   16.223   76.772   2.7909   80.670   2.4701 -3.897636 3.726981 
1 1 1   15    2   22 o  168.526   1.7482  1158.08   24.016  1179.16   34.784  1138.88   33.198  170.011   2.5100  167.087   2.4374 2.924667 3.498719 
1 1 1   15    2   23 o  117.302   1.6858  561.053   16.119  584.339   23.727  541.095   21.967  119.684   2.4320  115.174   2.3398 4.509834 3.374784 
1 1 1   15    2   24 o   49.939   2.4105  101.974   9.7835  121.995   15.002   87.159   12.905   54.557   3.3902   46.072   3.4616 8.485176 4.845217 
1 1 1   15    2   25 o  249.687   2.0862  2542.69   42.460  2581.86   61.108  2506.12   59.040  251.515   2.9806  247.804   2.9228 3.710342 4.174530 
1 1 1   15    2   26 o  126.919   1.6917  656.831   17.502  662.464   25.483  651.801   24.080  127.430   2.4533  126.406   2.3370 1.024200 3.388232 
1 1 1   15    2   27 o  171.454   1.7675  1198.72   24.702  1213.15   35.718  1185.48   34.200  172.437   2.5411  170.465   2.4612 1.972137 3.537622 
1 1 1   15    2   28 o   29.324   3.8674   35.737   9.0192   17.274   13.599   50.235   12.051   20.962   6.8855   34.787   4.3442 -13.82562 8.141376 
1 1 1   15    2   29 o   68.194   2.0166  189.829   11.198  182.001   16.734  196.176   15.068   66.701   3.0861   69.286   2.6730 -2.584610 4.082755 
1 1 1   15    2   30 f  183.982   1.8188  1380.37   27.276  1397.68   39.489  1364.57   37.720  185.077   2.6175  182.878   2.5303 2.198532 3.640594 
1 1 1   15    2   31 o   73.219   2.2293  218.889   13.290  211.678   17.950  227.639   19.771   71.944   3.0678   74.596   3.2594 -2.651993 4.476043 
1 1 1   15    2   32 f   68.999   2.0457  194.350   11.493  203.852   17.468  187.096   15.262   70.600   3.0424   67.651   2.7735 2.948730 4.116853 
1 1 1   15    2   33 o   96.028   1.8219  376.063   14.262  374.628   21.374  377.215   19.148   95.770   2.7407   96.122   2.4457 -0.3513107 3.673287 
1 1 1   15    2   34 o  165.809   1.8035  1121.18   24.376  1108.48   35.157  1132.93   33.826  164.814   2.6169  166.631   2.4904 -1.817123 3.612447 
1 1 1   15    2   35 o   63.370   2.2702  164.039   11.708  189.956   17.818  144.344   15.532   68.128   3.2175   59.367   3.2217 8.761341 4.553186 
1 1 1   15    2   36 o  201.811   2.1125  1661.36   34.752  1666.91   45.377  1653.48   54.046  202.088   2.7546  201.210   3.2952 0.8780060 4.294877 
1 1 1   15    2   37 o   89.044   2.1960  323.461   15.940  324.966   21.405  321.588   23.882   89.169   2.9490   88.672   3.3099 0.4971924 4.433024 
1 1 1   15    2   38 o  131.314   2.6015  703.728   27.846  681.324   35.157  741.450   45.618  129.107   3.3434  134.583   4.1632 -5.475983 5.339523 
1 1 1   15    2   39 o  127.839   2.6109  666.990   27.208  710.179   35.303  603.810   42.699  131.862   3.2844  121.416   4.3211 10.44550 5.427668 
1 1 1   15    2   40 o  154.301   2.6063  971.695   32.782  953.258   41.206  1003.48   54.108  152.768   3.3089  156.575   4.2433 -3.806992 5.380962 
1 1 1   15    2   41 o  133.994   2.1989  732.499   24.017  703.526   35.272  757.545   32.795  131.195   3.3008  136.212   2.9536 -5.016663 4.429348 
1 1 1   15    2   42 o   43.219   3.1558   76.694   11.041   75.960   16.849   77.246   14.617   42.784   4.9207   43.253   4.1986 -0.4691925 6.468521 
1 1 1   15    2   43 o   42.500   3.1075   74.166   10.691   66.374   16.175   80.212   14.247   39.926   5.0853   44.105   4.0065 -4.179657 6.473988 
1 1 1   15    2   44 o   96.917   1.8645  383.135   14.730  366.388   21.639  397.596   20.108   94.686   2.8067   98.666   2.5022 -3.979851 3.760110 
1 1 1   15    2   45 o  115.074   1.8830  540.166   17.663  526.282   28.264  549.063   22.626  113.466   3.0586  115.988   2.3931 -2.521591 3.883522 
1 1 1   15    2   46 o   50.094   2.6263  102.730   10.687   77.247   16.167  122.507   14.242   43.171   4.6683   54.661   3.2105 -11.49057 5.665747 
1 1 1   15    2   47 o  119.395   1.7601  581.471   17.130  578.872   25.178  583.711   23.375  119.072   2.5941  119.583   2.3979 -0.5118713 3.532590 
1 1 1   15    2   48 o  128.185   1.8833  670.350   19.678  676.197   31.701  666.685   25.099  128.645   3.0231  127.795   2.4094 0.8501968 3.865766 
1 1 1   15    2   49 f  154.695   1.9193  976.355   24.202  955.988   38.558  989.596   31.089  152.947   3.0927  155.690   2.4497 -2.742996 3.945302 
1 1 1   15    2   50 f   97.865   1.9547  390.789   15.594  396.201   25.360  387.500   19.774   98.402   3.1657   97.387   2.4929 1.014786 4.029415 
1 1 1   15    2   51 o  170.465   1.9558  1185.70   27.176  1201.77   43.784  1175.63   34.661  171.461   3.1327  169.677   2.5060 1.784500 4.011720 
1 1 1   15    2   52 o   33.616   3.9818   46.923   10.699   40.985   17.594   50.408   13.477   30.863   7.1361   34.703   4.9006 -3.840206 8.656746 
1 1 1   15    2   53 o   98.627   1.9674  396.964   15.817  426.251   25.697  379.100   20.069  102.059   3.0924   96.306   2.5587 5.752571 4.013686 
1 1 1   15    2   54 o   57.788   2.5114  136.659   11.802  124.056   19.180  144.339   14.972   54.826   4.3267   59.330   3.1065 -4.504490 5.326471 
1 1 1   15    2   55 o   60.485   2.4040  149.654   11.829  161.886   19.473  142.501   14.891   62.742   3.8257   58.945   3.1101 3.797104 4.930394 
1 1 1   15    2   56 o   41.289   3.6651   70.374   12.207   60.038   17.711   79.728   16.849   37.687   5.9635   43.784   4.7993 -6.096409 7.654844 
1 1 1   15    2   57 o  121.077   2.4446  598.886   24.127  601.710   43.526  597.634   28.989  120.965   4.4217  120.888   2.9418 0.7673645E-01 5.310857 
1 1 1   15    2   58 o   32.801   5.1764   45.370   13.382   30.368   25.014   51.385   15.839   27.635   9.3447   34.827   5.7820 -7.192205 10.98887 
1 1 1   15    2   59 o   72.232   2.4133  213.413   14.189  248.158   32.529  205.249   15.769   77.422   5.1843   70.799   2.7375 6.622742 5.862652 
1 1 1   15    2   60 o   28.186   4.3048   33.375   9.5773   44.625   16.701   27.863   11.690   32.219   6.5819   25.466   5.7662 6.753614 8.750421 
1 1 1   15    2   61 o   76.707   2.0787  240.478   12.986  248.249   21.801  236.205   16.166   77.752   3.4484   75.961   2.6147 1.791046 4.327618 
1 1 1   15    2   62 o   80.788   2.0364  266.725   13.400  289.730   22.804  254.592   16.561   84.016   3.3363   78.863   2.5796 5.152946 4.217276 
1 1 1   15    2   63 o   59.751   2.3903  146.175   11.619  141.164   19.644  148.872   14.409   58.446   4.1503   60.230   2.9438 -1.783966 5.088327 
1 1 1   15    2   64 o  101.885   1.9419  423.966   16.127  423.430   26.760  424.272   20.210  101.582   3.2358  101.861   2.4340 -0.2790756 4.049099 
1 1 1   15    2   65 o   65.745   2.3090  176.939   12.355  165.317   20.961  183.128   15.295   63.249   4.0875   66.816   2.8145 -3.567715 4.962772 
1 1 1   15    2   66 o   75.236   2.2267  231.626   13.641  217.694   22.682  239.521   17.073   72.647   3.8439   76.430   2.7449 -3.782890 4.723314 
1 1 1   15    2   67 o   34.944   3.7465   50.797   10.505   65.223   18.063   43.424   12.914   39.158   5.8370   31.980   5.1270 7.178299 7.768961 
1 1 1   15    2   68 o  101.569   1.9416  421.603   16.075  430.258   26.811  416.745   20.085  102.315   3.2187  100.902   2.4419 1.412277 4.040210 
1 1 1   15    2   69 f   16.916   5.5478   11.512   8.8298  -4.2957   14.807   20.236   11.000   14.374   6.3696   21.655   6.0164 -7.281196 8.761765 
1 1 1   15    2   70 o   68.355   2.0456  191.253   11.385  175.376   17.800  202.247   14.811   65.213   3.3598   70.204   2.5926 -4.990837 4.243810 
1 1 1   15    2   71 o   63.232   2.0790  163.752   10.701  156.705   17.083  168.304   13.729   61.600   3.4155   64.012   2.6368 -2.411907 4.314859 
1 1 1   15    2   72 o   44.521   2.8506   81.733   10.291   87.370   21.709   80.100   11.687   45.166   6.0485   43.989   3.2831 1.177135 6.882036 
1 1 1   15    2   73 o   43.755   2.6444   78.868   9.3878   95.464   15.761   69.743   11.687   47.827   4.0818   40.960   3.5349 6.867546 5.399673 
1 1 1   15    2   74 o   23.157   4.8263   23.199   8.8146   25.017   16.998   22.531   10.309   24.077   7.6812   22.689   5.6068 1.388411 9.509819 
1 1 1   15    2   75 o   62.492   2.4402  160.531   12.406  152.518   20.825  164.939   15.447   60.386   4.2580   63.208   3.0066 -2.821285 5.212497 
1 1 1   15    2   76 o   56.875   2.9683  133.674   13.714  107.524   19.289  160.404   19.502   50.439   4.7473   62.027   3.8765 -11.58881 6.128912 
1 1 1   15    2   77 o   66.541   1.9339  181.537   10.479  189.706   14.143  171.594   15.603   67.874   2.5608   64.430   2.9789 3.443886 3.928274 
1 1 1   15    2   78 o   44.899   2.4250   83.109   8.8423   84.291   12.202   81.802   12.832   44.989   3.3514   44.247   3.5884 0.7419243 4.910045 
1 1 1   15    2   79 o   52.960   2.0313  115.226   8.7527  114.686   12.428  115.756   12.329   52.618   2.9089   52.874   2.8713 -0.2565002 4.087308 
1 1 1   15    2   80 o   36.213   2.3507   54.169   6.9015   64.405   11.213   47.927   8.7568   39.185   3.5489   33.852   3.2118 5.332600 4.786438 
1 1 1   15    2   81 f   15.009   4.6801   9.5392   6.3441 -10.3112   11.328   18.609   7.6575   10.867   5.0914   20.583   4.6713 -9.716432 6.909698 
1 1 1   15    2   82 o   38.407   2.1706   60.851   6.7681   76.994   11.328   51.890   8.4401   42.913   3.2629   35.269   2.9631 7.644287 4.407582 
1 1 1   15    2   83 o   12.114   4.4816   5.0341   5.8638  -7.0273   9.9042   11.544   7.2761   10.592   4.8937   16.343   4.9978 -5.750622 6.994679 
1 1 1   15    2   84 o   31.828   2.5690   42.131   6.6084   40.643   11.582   42.849   8.0468   30.514   4.8160   31.947   3.1301 -1.432863 5.743773 
1 1 1   15    2   85 o   23.297   3.8024   23.373   6.9719   32.127   10.532   16.545   9.3016   26.965   4.9749   19.226   5.5974 7.739296 7.488653 
1 1 1   15    2   86 f   18.305   4.5283   14.861   6.7191   14.911   9.9277   14.819   9.1272   18.395   5.8704   18.273   5.5993 0.1228771 8.112565 
1 1 1   15    2   87 o   16.762   4.7372   12.450   6.7580   4.0074   9.8642   19.918   9.2773   13.640   5.5815   20.962   5.3971 -7.322129 7.764197 
1 1 1   15    2   88 o   36.409   2.2315   54.931   6.5909   59.837   10.974   52.163   8.2433   37.514   3.6341   35.279   2.8919 2.234726 4.644280 
1 1 1   15    2   89 o   59.348   1.7120  144.815   8.2736  139.450   12.539  148.952   11.010   57.880   2.6649   60.000   2.2552 -2.119541 3.491087 
1 1 1   15    2   90 o   65.468   1.6487  176.142   8.7917  161.592   13.420  187.080   11.636   62.298   2.6488   67.290   2.1241 -4.991776 3.395245 
1 1 1   15    2   91 o   26.676   3.0102   30.129   6.4315   13.475   12.302   36.394   7.5448   17.953   6.5155   29.276   3.2144 -11.32252 7.265265 
1 1 1   15    2   92 o   39.561   2.1954   64.940   7.0518   71.113   13.664   62.700   8.2329   40.484   4.2016   38.723   2.6237 1.760902 4.953541 
1 1 1   15    2   93 o   49.933   1.7349  102.761   7.0506   97.441   11.853  105.674   8.7711   48.072   3.0404   50.493   2.1358 -2.421089 3.715621 
1 1 1   15    2   94 o   18.068   3.9443   14.524   5.6458   19.006   10.058   12.461   6.8219   20.096   5.8117   16.584   4.7833 3.512383 7.526995 
1 1 1   15    2   95 o   80.600   1.4715  266.969   9.6679  271.453   17.117  264.868   11.716   80.528   2.6110   80.123   1.7938 0.4052811 3.167830 
1 1 1   15    2   96 o   19.861   3.6739   17.413   5.7287   25.438   11.414   14.711   6.6234   22.916   6.0298   17.930   4.5307 4.986237 7.542233 
1 1 1   15    2   97 o   34.070   2.2721   48.577   6.2740   51.179   12.131   47.627   7.3305   33.740   4.5247   33.554   2.7030 0.1864204 5.270561 
1 1 1   15    2   98 o   41.568   1.9747   71.859   6.6719   76.595   12.915   70.135   7.7922   41.802   3.8329   40.898   2.3472 0.9040909 4.494497 
1 1 1   15    2   99 o   31.549   3.7129   43.783   9.3659   49.983   12.733   36.475   13.825   32.897   4.8974   26.903   6.3980 5.994507 8.057206 
1 1 1   15    2  100 o   15.335   5.5599   10.402   8.9549   4.7949   11.945   17.595   13.531   14.141   5.9900   18.810   6.8322 -4.669004 9.086239 
1 1 1   15    2  101 o   75.236   2.0578  236.348   12.608  232.667   17.357  240.460   18.346   73.797   2.8910   74.877   3.0118 -1.080956 4.174782 
1 1 1   15    2  102 o   28.575   3.7736   36.546   8.5751   40.855   11.172   30.366   13.379   29.459   4.8187   23.839   6.6397 5.619703 8.204030 
1 1 1   15    2  103 o   24.631   4.5626   28.486   8.8234   37.240   12.148   18.712   12.836   27.351   5.6365   18.837   6.6771 8.514496 8.738027 
1 1 1   15    2  104 o   9.1532   4.4027 -10.9854   9.6457   12.766   15.332 -26.5458   12.409   16.898   6.9414   8.7190   4.3465 8.178638 8.189940 
1 1 1   15    2  105 f   19.327   6.1816   19.711   11.003   31.590   16.198   9.5305   14.994   23.138   7.5091   15.898   6.7217 7.239325 10.07809 
1 1 1   15    2  106 o   33.135   4.4307   51.180   11.667   43.566   17.028   57.917   16.019   27.387   7.4372   33.548   6.0815 -6.161158 9.607090 
1 1 1   15    2  107 o   13.549   5.7256   5.4421   10.871   9.9562   16.035   1.6025   14.789   16.051   6.8740   13.838   6.2316 2.212890 9.278220 
1 1 1   15    2  108 o   34.723   6.6362   65.109   18.099   65.109   18.099   0.0000   0.0000   34.723   6.6362  ?   ?  0.000000 6.636159 
1 1 1   15    2  109 o   29.697   5.1520   43.416   12.020   55.826   18.087   33.602   16.085   31.193   7.2514   23.517   7.4686 7.675566 10.40974 
1 1 1   15    2  110 o   11.235   5.1925  -3.6806   11.167   15.100   16.424 -19.8285   15.229   17.236   7.1425   10.613   5.2006 6.623295 8.835233 
1 1 1   15    2  111 o   32.693   4.7872   51.623   12.380   51.965   18.027   51.318   17.031   29.498   7.4859   29.863   7.1006 -0.3649254 10.31781 
1 1 1   15    2  112 o   14.633   6.0338   8.7943   11.642   33.071   17.261 -11.4636   15.768   22.635   7.7606   11.800   5.6637 10.83512 9.607528 
1 1 1   15    2  113 o   11.688   5.3787  -2.4594   11.798  -3.7485   17.104  -1.2894   16.295   13.320   6.2457   13.483   6.2461 -0.1638107 8.833071 
1 1 1   15    2  114 o   20.575   6.4366   24.181   11.989   25.595   17.065   22.804   16.848   19.943   7.5885   19.109   7.4680 0.8336887 10.64689 
1 1 1   15    2  115 f   25.502   6.7143   37.387   14.147   40.287   17.701   32.260   23.537   24.838   7.8280   20.798   8.5780 4.039305 11.61290 
1 1 1   15    2  116 o   13.686   6.1154   3.3905   13.942 -14.2107   17.265   36.382   23.637   11.921   5.7725   21.803   8.7414 -9.881955 10.47542 
1 1 1   15    3 -114 o   16.885   7.3490   14.053   18.920 -32.0575   28.911   48.593   25.022   13.464   6.6996   24.446   9.2146 -10.98187 11.39266 
1 1 1   15    3 -113 o   20.792   7.2752   27.119   15.203   15.378   18.983   48.114   25.386   17.135   7.4100   24.111   9.2356 -6.975613 11.84080 
1 1 1   15    3 -112 o   13.005   5.8435   1.9407   12.922 -45.6056   18.282   49.416   18.268   9.5707   4.8375   27.896   7.7546 -18.32523 9.139791 
1 1 1   15    3 -111 f   9.3651   4.6179 -19.8965   12.629 -21.2668   18.143 -18.6084   17.590   11.457   5.6269   11.539   5.6407 -0.8204174E-01 7.967360 
1 1 1   15    3 -110 o   9.9048   4.8404 -16.7240   12.927 -32.2351   18.428  -1.6974   18.138   10.615   5.2926   13.948   6.5047 -3.332693 8.385830 
1 1 1   15    3 -109 o   12.073   5.5897  -3.2062   13.025 -12.7327   18.332   6.5051   18.509   12.524   6.0358   15.483   6.9720 -2.958665 9.221683 
1 1 1   15    3 -108 o   12.624   5.7597  -0.8440   13.143 -11.3273   18.712   9.3651   18.466   12.856   6.1706   16.097   7.1241 -3.240258 9.424890 
1 1 1   15    3 -107 o   15.024   6.3263   8.6979   13.196   5.5245   19.215   11.530   18.154   15.569   7.0484   16.579   7.2074 -1.010178 10.08100 
1 1 1   15    3 -106 f   10.279   4.9723 -13.7939   12.730 -17.3866   18.011 -10.2076   17.994   11.987   5.8257   12.856   6.1380 -0.8685255 8.462469 
1 1 1   15    3 -105 f   21.134   6.6714   25.093   12.852   37.150   18.126   12.906   18.224   24.223   7.9490   17.024   7.3100 7.199492 10.79920 
1 1 1   15    3 -104 o   11.858   5.4733  -3.6719   12.346  -0.1921   17.413  -7.1896   17.508   14.300   6.5637   13.206   6.2317 1.093552 9.050797 
1 1 1   15    3 -103 o   9.6264   4.7102 -17.8433   12.353 -34.6155   16.896   1.4171   18.105   10.017   5.0058   14.847   6.7685 -4.829733 8.418477 
1 1 1   15    3 -102 o   17.286   6.5189   15.029   12.527   14.941   16.816   15.139   18.777   17.628   7.2584   17.882   7.5392 -0.2546768 10.46540 
1 1 1   15    3 -101 o   11.162   5.2276  -6.7156   11.920   1.2055   16.563 -15.2270   17.169   14.481   6.5511   12.128   5.8438 2.353273 8.778731 
1 1 1   15    3 -100 o   18.071   6.5069   16.712   12.239   14.608   16.991   18.981   17.643   17.742   7.2999   19.003   7.5746 -1.260765 10.51965 
1 1 1   15    3  -99 o   16.085   5.9856   11.887   10.488   3.0103   13.094   27.775   17.518   13.912   6.0834   21.957   7.7986 -8.044976 9.890681 
1 1 1   15    3  -98 o   17.741   6.1103   15.420   10.704   21.007   13.544   6.1249   17.470   20.040   6.8743   16.082   7.0295 3.958063 9.832093 
1 1 1   15    3  -97 o   17.484   6.0608   14.637   10.538   18.023   13.348   9.0349   17.168   19.009   6.8013   16.818   7.1548 2.191294 9.871604 
1 1 1   15    3  -96 o   17.156   6.0594   13.714   10.564   10.637   13.427   18.713   17.114   16.498   6.5971   19.596   7.5631 -3.098177 10.03604 
1 1 1   15    3  -95 o   22.205   5.7454   23.944   10.478   10.736   13.277   45.749   17.060   16.590   6.5845   29.758   7.1272 -13.16798 9.703196 
1 1 1   15    3  -94 o   13.602   5.5924   4.8435   9.9626   0.0308   12.929   11.879   15.632   13.499   5.9682   17.596   7.0899 -4.097710 9.267473 
1 1 1   15    3  -93 o   32.495   3.4154   45.462   8.9116   55.247   14.284   39.226   11.403   34.724   5.2068   29.333   4.9447 5.391321 7.180571 
1 1 1   15    3  -92 o   31.743   3.1188   42.924   7.9656   47.431   15.928   41.420   9.1986   31.371   6.4445   30.896   3.7276 0.4742489 7.444912 
1 1 1   15    3  -91 o   21.059   4.5273   20.002   7.5405   36.008   15.515   15.052   8.6281   26.994   6.9946   18.087   5.4238 8.907154 8.851063 
1 1 1   15    3  -90 o   31.558   3.3115   42.461   8.3918   37.204   16.527   44.287   9.7410   27.404   7.2771   32.017   3.8069 -4.613316 8.212671 
1 1 1   15    3  -89 o   16.075   5.3426   11.221   8.1797   27.914   12.963   0.1783   10.544   24.196   6.4540   12.639   5.4937 11.55679 8.475542 
1 1 1   15    3  -88 o   36.445   2.9287   55.837   8.6274   49.292   13.734   60.102   11.088   33.138   5.2598   37.501   3.6744 -4.362583 6.416144 
1 1 1   15    3  -87 o   23.816   4.2519   24.914   7.9515   24.149   12.803   25.395   10.145   22.643   6.5594   23.599   5.3923 -0.9556961 8.491351 
1 1 1   15    3  -86 o   74.515   1.9676  228.842   11.941  239.267   17.575  219.904   16.274   75.735   2.8520   72.659   2.7526 3.076073 3.963676 
1 1 1   15    3  -85 o   29.074   3.3476   35.889   7.7891   38.817   13.627   34.468   9.4925   29.115   5.9433   28.141   4.2722 0.9736729 7.319445 
1 1 1   15    3  -84 o   78.438   1.8131  252.838   11.593  235.208   17.821  265.772   15.264   75.112   2.9162   80.168   2.3382 -5.055832 3.737846 
1 1 1   15    3  -83 o   26.229   3.6360   29.418   7.5651   34.550   13.053   26.822   9.2833   27.506   5.9916   24.617   4.7987 2.888861 7.676420 
1 1 1   15    3  -82 o   31.157   3.1557   40.845   7.9043   44.272   13.681   39.127   9.6842   31.507   5.5283   30.192   4.0359 1.315100 6.844785 
1 1 1   15    3  -81 o   54.408   2.1530  122.043   9.5300   97.648   15.270  137.606   12.197   48.007   3.9367   57.629   2.6031 -9.622719 4.719529 
1 1 1   15    3  -80 o   13.661   4.9435   6.8720   7.0748   8.1183   12.859   6.3309   8.4724   16.483   6.4994   14.003   5.3425 2.479448 8.413369 
1 1 1   15    3  -79 o   22.737   4.3586   22.500   7.7842   1.3844   15.023   30.251   9.1014   15.454   6.6365   26.448   4.3744 -10.99389 7.948517 
1 1 1   15    3  -78 o   25.398   3.7913   27.521   7.6091   23.100   13.618   29.527   9.1750   22.634   6.8199   26.115   4.4707 -3.480326 8.154648 
1 1 1   15    3  -77 o   17.182   4.9085   12.863   7.2166   35.806   13.005   2.6552   8.6746   28.371   5.8189   12.661   5.2134 15.70945 7.812748 
1 1 1   15    3  -76 o   60.204   1.7180  148.551   8.4225  131.072   11.142  171.853   12.865   56.390   2.4297   64.578   2.4484 -8.187523 3.449362 
1 1 1   15    3  -75 o   42.275   2.0966   73.497   7.2025   65.010   9.7778   83.566   10.650   39.549   3.0567   44.902   2.9255 -5.352818 4.231103 
1 1 1   15    3  -74 o   29.391   2.7454   35.877   6.5013   46.887   8.8298   22.841   9.6078   33.515   3.2737   22.803   5.2739 10.71163 6.207355 
1 1 1   15    3  -73 o  111.513   1.5371  508.395   13.972  522.155   18.825  491.522   20.847  112.877   2.0460  109.424   2.3372 3.452354 3.106189 
1 1 1   15    3  -72 o   57.654   2.2027  136.480   10.333  146.835   18.910  132.072   12.337   59.340   3.9316   56.614   2.6810 2.725430 4.758719 
1 1 1   15    3  -71 o   24.601   3.3378   25.416   6.5209   32.299   9.1694   18.372   9.2755   27.579   4.2121   20.524   5.4524 7.055140 6.889865 
1 1 1   15    3  -70 o   53.598   1.9295  117.698   8.4162  116.862   11.743  118.580   12.068   53.272   2.7132   53.652   2.7689 -0.3798714 3.876578 
1 1 1   15    3  -69 o   43.901   2.4686   79.269   8.7985   79.680   10.224   78.095   17.273   43.945   2.8700   42.970   5.0262 0.9752159 5.787866 
1 1 1   15    3  -68 o   42.831   2.5535   75.480   8.8747   81.669   10.494   59.943   16.628   44.498   2.9092   37.432   5.6231 7.065868 6.331079 
1 1 1   15    3  -67 o   68.527   1.9637  192.181   10.958  203.313   13.128  166.605   19.899   70.434   2.2896   63.417   3.8677 7.016628 4.494601 
1 1 1   15    3  -66 o   59.585   2.1563  145.429   10.456  148.565   12.453  137.933   19.251   60.166   2.5449   57.642   4.1244 2.524395 4.846371 
1 1 1   15    3  -65 o   66.673   1.8181  181.764   9.8718  185.279   13.459  177.672   14.523   67.225   2.4603   65.786   2.7140 1.438614 3.663218 
1 1 1   15    3  -64 o   41.525   2.5598   70.871   8.6225   66.607   12.324   74.960   12.068   40.042   3.8220   42.558   3.5100 -2.516716 5.189156 
1 1 1   15    3  -63 o   52.087   2.6016  111.351   11.011  118.491   18.349  107.332   13.765   53.435   4.2475   51.022   3.3278 2.412354 5.395877 
1 1 1   15    3  -62 o   89.508   1.7167  327.137   12.525  321.469   16.938  333.977   18.606   88.627   2.3467   90.306   2.5300 -1.678726 3.450781 
1 1 1   15    3  -61 o   90.435   1.6968  333.901   12.509  322.654   16.858  347.678   18.658   88.802   2.3310   92.159   2.4860 -3.357384 3.407845 
1 1 1   15    3  -60 o   85.301   1.7245  297.049   11.991  300.188   16.502  293.537   17.454   85.655   2.3657   84.677   2.5315 0.9786301 3.464788 
1 1 1   15    3  -59 o   66.978   1.8937  183.330   10.328  185.143   14.170  181.275   15.085   67.230   2.5906   66.497   2.7892 0.7335968 3.806709 
1 1 1   15    3  -58 o   63.312   1.9301  163.831   9.9494  163.228   13.890  164.465   14.258   63.111   2.7063   63.342   2.7681 -0.2311134 3.871249 
1 1 1   15    3  -57 o   90.968   1.5804  337.676   11.719  333.344   18.863  340.399   14.955   90.259   2.5664   91.301   2.0095 -1.042000 3.259511 
1 1 1   15    3  -56 o  118.931   1.5396  577.115   14.926  556.203   23.793  590.686   19.166  116.653   2.5021  120.281   1.9548 -3.628281 3.175226 
1 1 1   15    3  -55 o   33.030   3.0428   45.018   8.1004   43.914   14.790   45.491   9.6816   32.104   5.8678   33.117   3.6467 -1.012321 6.908674 
1 1 1   15    3  -54 o  121.238   1.7824  599.868   17.615  559.754   28.943  623.470   22.201  116.928   3.0392  123.557   2.2043 -6.628647 3.754375 
1 1 1   15    3  -53 o   74.971   1.9182  229.568   11.713  222.732   20.196  233.032   14.377   73.681   3.3716   75.496   2.3391 -1.814636 4.103499 
1 1 1   15    3  -52 o  125.156   1.7762  639.202   18.121  691.269   31.365  613.117   22.200  130.012   2.9595  122.533   2.2227 7.479362 3.701218 
1 1 1   15    3  -51 o   72.815   1.8349  216.504   10.883  210.988   17.144  220.227   14.084   71.774   2.9364   73.394   2.3572 -1.619804 3.765511 
1 1 1   15    3  -50 o   68.229   1.8998  190.125   10.556  193.829   16.946  187.777   13.493   68.782   3.0298   67.759   2.4469 1.022308 3.894507 
1 1 1   15    3  -49 o   70.711   1.6850  203.988   9.7125  196.901   14.818  209.327   12.861   69.374   2.6250   71.571   2.2070 -2.197227 3.429510 
1 1 1   15    3  -48 o   85.303   1.7273  296.868   12.011  269.577   20.706  310.709   14.745   81.136   3.1366   87.250   2.0733 -6.113914 3.759879 
1 1 1   15    3  -47 o  142.656   1.6200  830.133   18.838  823.641   30.811  834.008   23.806  141.997   2.6619  142.954   2.0429 -0.9564514 3.355488 
1 1 1   15    3  -46 o   51.694   2.2917  109.303   9.6330  113.016   17.503  107.690   11.538   52.362   4.1342   51.268   2.7711 1.093616 4.977006 
1 1 1   15    3  -45 o   71.727   2.1627  210.167   12.631  214.127   15.259  201.550   22.509   72.365   2.5910   70.050   3.9580 2.314804 4.730656 
1 1 1   15    3  -44 o  191.672   1.6029  1498.45   25.044  1519.98   36.532  1479.36   34.399  192.967   2.3225  190.384   2.2166 2.582932 3.210471 
1 1 1   15    3  -43 o  130.629   1.4910  695.909   15.876  691.142   23.481  699.923   21.549  130.132   2.2136  130.971   2.0184 -0.8390350 2.995625 
1 1 1   15    3  -42 o   49.171   2.1905   98.865   8.7577   89.738   13.753  105.090   11.358   46.700   3.6417   50.652   2.7613 -3.951805 4.570222 
1 1 1   15    3  -41 o  119.125   1.5008  578.715   14.574  580.916   21.728  576.915   19.649  119.310   2.2341  118.911   2.0271 0.3981628 3.016725 
1 1 1   15    3  -40 o  136.916   1.6245  764.534   18.130  762.516   29.731  765.729   22.876  136.659   2.6689  136.996   2.0485 -0.3373413 3.364444 
1 1 1   15    3  -39 o  128.352   1.5075  671.810   15.773  702.169   23.633  647.427   21.180  131.179   2.2101  125.971   2.0626 5.207695 3.023049 
1 1 1   15    3  -38 o   24.672   4.4308   25.673   8.5835   29.626   13.499   22.991   11.121   26.318   6.3631   23.213   5.8737 3.105255 8.659671 
1 1 1   15    3  -37 o  216.578   1.8198  1913.18   32.128  1936.32   43.890  1886.46   47.159  217.817   2.4719  214.967   2.6913 2.849823 3.654206 
1 1 1   15    3  -36 o  120.986   1.6382  596.940   16.156  638.342   23.340  558.851   22.386  125.077   2.2892  117.027   2.3467 8.049950 3.278323 
1 1 1   15    3  -35 o  191.379   2.0253  1494.06   31.595  1487.97   51.770  1497.68   39.884  190.850   3.3278  191.562   2.5542 -0.7126617 4.194986 
1 1 1   15    3  -34 o  212.651   2.1287  1844.77   36.900  1814.54   59.399  1863.76   47.088  210.743   3.4577  213.683   2.7033 -2.940231 4.389061 
1 1 1   15    3  -33 f   59.995   2.5471  147.156   12.428  181.429   22.286  131.686   14.973   66.479   4.1330   56.689   3.2538 9.789623 5.260153 
1 1 1   15    3  -32 o  142.367   2.1496  826.846   24.946  749.260   36.162  897.287   34.457  135.441   3.2754  148.255   2.8512 -12.81482 4.342569 
1 1 1   15    3  -31 o  148.844   1.8023  903.550   21.867  848.923   31.250  955.957   30.609  144.220   2.6582  153.058   2.4533 -8.837921 3.617294 
1 1 1   15    3  -30 o   62.081   2.3017  157.462   11.627  147.799   16.031  168.188   16.890   60.065   3.2867   64.090   3.2435 -4.024647 4.617651 
1 1 1   15    3  -29 o  244.385   1.9542  2436.00   38.929  2418.80   51.769  2458.39   59.056  243.451   2.6087  245.389   2.9524 -1.938660 3.939782 
1 1 1   15    3  -28 o  114.675   1.6801  536.265   15.705  518.574   21.046  558.496   23.592  112.742   2.2901  116.992   2.4739 -4.249466 3.371147 
1 1 1   15    3  -27 o  119.898   1.6619  586.210   16.242  562.840   21.632  616.412   24.592  117.458   2.2593  122.910   2.4545 -5.452347 3.336039 
1 1 1   15    3  -26 o  186.190   1.5958  1413.58   24.220  1373.22   34.537  1452.64   33.975  183.466   2.3094  188.705   2.2087 -5.239120 3.195558 
1 1 1   15    3  -25 o   46.080   2.3147   86.843   8.6667   75.717   13.337   94.976   11.402   42.872   3.8575   48.148   2.9189 -5.275715 4.837377 
1 1 1   15    3  -24 o  158.313   1.5159  1021.92   19.563  1016.54   28.215  1026.90   27.148  157.861   2.1927  158.669   2.0990 -0.8079681 3.035383 
1 1 1   15    3  -23 o   87.940   1.5765  315.331   11.301  319.674   16.975  311.875   15.144   88.489   2.3555   87.441   2.1247 1.047409 3.172186 
1 1 1   15    3  -22 o  306.164   2.0699  3823.27   51.659  3750.15   72.550  3898.47   73.575  303.109   2.9363  309.048   2.9206 -5.938599 4.141475 
1 1 1   15    3  -21 o   39.903   2.5099   65.220   8.1226   79.157   12.655   55.457   10.592   43.878   3.5689   36.673   3.5892 7.205502 5.061597 
1 1 1   15    3  -20 o  148.193   1.4855  895.411   17.945  883.404   25.996  906.340   24.802  147.165   2.1671  149.070   2.0410 -1.904800 2.976913 
1 1 1   15    3  -19 o  168.157   1.6172  1152.99   22.168  1150.55   34.351  1154.72   29.019  167.928   2.5095  168.258   2.1158 -0.3294373 3.282366 
1 1 1   15    3  -18 o  243.749   1.8944  2422.97   37.641  2355.65   56.881  2475.42   50.205  240.243   2.9046  246.319   2.5004 -6.076080 3.832576 
1 1 1   15    3  -17 o  156.293   1.6140  996.026   20.563  980.471   27.591  1015.46   30.839  155.041   2.1832  157.770   2.3979 -2.729294 3.242900 
1 1 1   15    3  -16 o   95.006   1.6386  368.038   12.690  333.332   17.086  410.730   18.950   90.366   2.3215  100.343   2.3168 -9.977295 3.279797 
1 1 1   15    3  -15 o  219.284   1.8102  1960.88   32.357  1969.35   43.395  1950.26   48.559  219.712   2.4230  218.617   2.7249 1.095093 3.646379 
1 1 1   15    3  -14 o  349.391   2.4358  4980.11   69.372  5035.70   92.935  4910.15  104.251  351.206   3.2463  346.716   3.6887 4.490387 4.913711 
1 1 1   15    3  -13 o   11.262   4.8305  -0.5476   7.9414 -14.2123   11.572   11.618   10.919   10.555   5.0059   17.777   6.1689 -7.222199 7.944461 
1 1 1   15    3  -12 o  105.303   1.5683  452.123   13.462  458.065   18.723  445.763   19.369  105.974   2.1674  104.538   2.2730 1.436554 3.140776 
1 1 1   15    3  -11 o  109.815   1.5717  491.700   14.070  486.017   19.445  497.944   20.383  109.159   2.1853  110.488   2.2631 -1.328209 3.146015 
1 1 1   15    3  -10 o   80.266   1.6976  262.704   11.108  261.155   15.685  264.263   15.732   79.975   2.4088   80.450   2.4016 -0.4752121 3.401445 
1 1 1   15    3   -9 o  236.330   1.8752  2277.61   36.124  2207.00   47.490  2374.57   55.651  232.588   2.5048  241.224   2.8302 -8.636002 3.779413 
1 1 1   15    3   -8 o  267.066   2.0255  2908.82   44.094  2917.60   68.348  2902.56   57.709  267.350   3.1362  266.717   2.6543 0.6328430 4.108726 
1 1 1   15    3   -7 o  194.019   1.7137  1534.94   27.103  1572.73   43.156  1510.33   34.829  196.328   2.6966  192.428   2.2204 3.899902 3.493156 
1 1 1   15    3   -6 o  157.011   1.6089  1005.17   20.592  990.625   32.648  1014.78   26.535  155.823   2.5703  157.740   2.0637 -1.916855 3.296264 
1 1 1   15    3   -5 o  162.660   1.6288  1078.81   21.596  1053.85   34.375  1095.08   27.758  160.716   2.6239  163.861   2.0781 -3.145508 3.347182 
1 1 1   15    3   -4 o   97.774   1.5864  389.784   12.644  402.534   20.480  381.931   16.072   99.299   2.5322   96.773   2.0374 2.526520 3.250113 
1 1 1   15    3   -3 o  111.388   1.5582  505.879   14.148  478.082   22.072  525.268   18.433  108.253   2.5012  113.490   1.9925 -5.236229 3.197866 
1 1 1   15    3   -2 o  151.437   1.5785  935.054   19.485  922.306   30.423  943.922   25.373  150.359   2.4822  152.134   2.0460 -1.774612 3.216733 
1 1 1   15    3   -1 o  238.099   1.8771  2311.83   36.432  2269.17   55.630  2343.86   48.209  235.806   2.8941  239.697   2.4673 -3.890793 3.803130 
1 1 1   15    3    0 o  249.571   1.9300  2540.04   39.263  2546.17   60.629  2535.61   51.528  249.775   2.9778  249.302   2.5356 0.4723663 3.911075 
1 1 1   15    3    1 o   74.534   1.8292  226.533   11.114  221.451   15.828  231.476   15.609   73.625   2.6416   75.282   2.5473 -1.656303 3.669666 
1 1 1   15    3    2 o  235.235   1.8754  2256.53   35.961  2193.06   47.454  2342.15   55.115  231.854   2.5109  239.575   2.8222 -7.721054 3.777493 
1 1 1   15    3    3 o  177.898   1.7740  1290.50   25.726  1308.36   37.348  1274.38   35.487  179.079   2.5585  176.745   2.4631 2.334015 3.551455 
1 1 1   15    3    4 o   21.281   4.9330   19.269   8.3902   22.560   12.814   16.799   11.100   23.143   6.5171   20.221   6.1709 2.922373 8.975101 
1 1 1   15    3    5 o   67.795   1.9559  187.591   10.797  181.559   16.255  192.354   14.444   66.630   3.0005   68.615   2.5872 -1.984848 3.961849 
1 1 1   15    3    6 o  179.328   1.7744  1311.33   25.938  1306.29   37.420  1315.99   35.986  178.936   2.5655  179.607   2.4580 -0.6708679 3.552967 
1 1 1   15    3    7 o   80.673   1.8040  265.389   11.863  267.109   17.806  264.015   15.907   80.864   2.7052   80.411   2.4297 0.4527283 3.636103 
1 1 1   15    3    8 o  152.141   1.8728  943.917   23.225  968.279   38.965  930.492   28.926  154.019   3.1036  151.032   2.3495 2.987396 3.892595 
1 1 1   15    3    9 o   69.576   2.1259  197.620   12.043  198.718   21.659  197.129   14.489   69.642   3.8300   69.464   2.5632 0.1787338 4.608608 
1 1 1   15    3   10 o   39.629   3.1175   64.499   9.9895   79.581   18.858   58.616   11.778   43.762   5.4010   37.680   3.8904 6.081650 6.656254 
1 1 1   15    3   11 o   88.567   1.9448  319.897   14.040  291.161   24.281  334.333   17.209   84.364   3.5386   90.502   2.3347 -6.137543 4.239453 
1 1 1   15    3   12 o  178.799   1.9709  1303.77   28.725  1287.20   37.381  1327.66   44.888  177.620   2.5818  180.352   3.0533 -2.732666 3.998540 
1 1 1   15    3   13 o   22.383   5.4243   21.334   9.7920   3.8741   13.428   41.160   14.309   16.004   6.5261   31.196   5.8417 -15.19225 8.758759 
1 1 1   15    3   14 o  147.843   1.8888  891.362   22.763  900.831   30.059  878.630   34.854  148.595   2.4816  146.726   2.9142 1.869781 3.827636 
1 1 1   15    3   15 o  135.354   1.8816  747.127   20.761  769.788   27.605  717.622   31.499  137.363   2.4653  132.602   2.9141 4.761612 3.817076 
1 1 1   15    3   16 o  143.628   1.7125  841.178   20.049  882.394   29.401  805.353   27.411  147.068   2.4525  140.504   2.3933 6.563507 3.426783 
1 1 1   15    3   17 o   89.195   2.2466  324.730   16.321  316.790   19.266  344.911   30.717   88.070   2.6868   91.774   4.1165 -3.704269 4.915803 
1 1 1   15    3   18 o  170.859   1.7687  1190.43   24.633  1194.21   35.586  1186.96   34.134  171.082   2.5517  170.569   2.4550 0.5135345 3.540930 
1 1 1   15    3   19 o  139.011   1.7179  787.984   19.467  756.600   27.969  817.474   27.111  136.176   2.5196  141.558   2.3495 -5.381943 3.445105 
1 1 1   15    3   20 o  281.511   2.2569  3232.73   51.789  3236.76   73.877  3228.83   72.620  281.562   3.2188  281.225   3.1679 0.3373108 4.516217 
1 1 1   15    3   21 o   72.724   2.0046  215.866   11.872  226.773   17.859  207.230   15.892   74.479   2.9475   71.207   2.7430 3.271614 4.026383 
1 1 1   15    3   22 o  147.838   2.1490  891.507   25.897  924.336   38.067  863.222   35.334  150.471   3.1035  145.421   2.9808 5.050018 4.303131 
1 1 1   15    3   23 o  286.763   2.5093  3355.28   58.657  3380.82   94.087  3339.04   75.021  287.607   4.0132  285.967   3.2183 1.639679 5.144272 
1 1 1   15    3   24 o   72.059   2.0621  211.963   12.100  194.549   18.034  226.218   16.317   68.952   3.2175   74.404   2.6948 -5.452721 4.196971 
1 1 1   15    3   25 o  229.338   2.0258  2145.25   37.872  2156.79   54.400  2134.39   52.755  229.864   2.9033  228.676   2.8301 1.188278 4.054466 
1 1 1   15    3   26 o  292.384   2.3409  3487.77   55.792  3533.27   79.925  3444.52   77.917  294.134   3.3335  290.424   3.2913 3.710297 4.684532 
1 1 1   15    3   27 o  107.733   1.8347  473.342   16.112  448.502   23.531  495.267   22.107  104.790   2.7571  110.172   2.4616 -5.381577 3.696145 
1 1 1   15    3   28 o  106.067   1.8631  458.835   16.108  483.114   24.365  439.983   21.470  108.761   2.7505  103.836   2.5366 4.924248 3.741563 
1 1 1   15    3   29 o  310.768   2.4504  3940.81   62.074  3928.11   88.377  3953.17   87.208  310.081   3.4964  311.080   3.4391 -0.9992065 4.904359 
1 1 1   15    3   30 o  262.818   2.2089  2817.97   47.322  2832.98   68.034  2803.91   65.865  263.383   3.1688  262.042   3.0835 1.341217 4.421497 
1 1 1   15    3   31 o  169.146   1.8887  1166.92   26.041  1178.74   38.220  1156.67   35.577  169.933   2.7592  168.349   2.5925 1.583633 3.786058 
1 1 1   15    3   32 o  132.464   2.0522  715.761   22.159  656.478   29.113  797.412   34.166  126.813   2.8163  139.749   2.9992 -12.93617 4.114256 
1 1 1   15    3   33 f   75.874   2.4227  235.150   14.965  217.852   20.814  253.662   21.532   72.936   3.5112   78.730   3.3629 -5.793709 4.861793 
1 1 1   15    3   34 o  151.062   2.2233  931.008   27.378  898.591   40.494  958.303   37.157  148.314   3.3494  153.200   2.9754 -4.885269 4.480153 
1 1 1   15    3   35 o  123.555   2.4062  622.949   24.234  580.102   42.454  643.659   29.515  118.983   4.3847  125.559   2.8838 -6.575378 5.248004 
1 1 1   15    3   36 o  244.149   2.5428  2432.88   50.606  2537.10  103.984  2400.53   57.929  248.793   5.1274  242.465   2.9310 6.328415 5.905972 
1 1 1   15    3   37 o  150.755   1.9256  927.055   23.664  921.573   38.153  930.482   30.167  150.208   3.1160  150.995   2.4509 -0.7862549 3.964437 
1 1 1   15    3   38 o  161.405   1.9329  1062.71   25.431  1095.86   41.368  1042.57   32.244  163.793   3.0984  159.824   2.4750 3.968201 3.965513 
1 1 1   15    3   39 o   50.220   3.1670  103.445   12.899  122.613   19.238   87.789   17.386   54.553   4.3624   46.055   4.6968 8.498432 6.410181 
1 1 1   15    3   40 o   43.826   3.4636   79.003   12.273   60.122   17.894   95.775   16.865   37.785   6.0109   48.171   4.3416 -10.38541 7.414875 
1 1 1   15    3   41 o  119.589   2.1269  583.565   20.733  586.515   29.582  580.718   29.067  119.781   3.0322  119.191   2.9941 0.5893402 4.261326 
1 1 1   15    3   42 o   82.634   2.3598  278.950   15.879  266.151   22.559  291.519   22.355   80.609   3.4411   84.391   3.2558 -3.781952 4.737225 
1 1 1   15    3   43 o   96.142   2.2547  377.264   17.670  365.623   25.087  388.726   24.892   94.519   3.2609   97.477   3.1368 -2.958611 4.524763 
1 1 1   15    3   44 o   99.151   1.9439  401.119   15.711  388.724   25.907  408.329   19.760   97.458   3.2657  100.009   2.4239 -2.551003 4.066920 
1 1 1   15    3   45 o  105.786   1.9248  456.600   16.598  431.884   26.845  471.896   21.119  102.734   3.2096  107.510   2.4098 -4.776184 4.013560 
1 1 1   15    3   46 o   47.036   2.8831   90.736   11.001  116.619   19.378   78.427   13.363   53.139   4.5165   43.608   3.7972 9.530621 5.900595 
1 1 1   15    3   47 o  149.227   1.9079  908.653   23.208  870.218   36.898  933.812   29.853  145.899   3.1025  151.225   2.4217 -5.326721 3.935766 
1 1 1   15    3   48 o   87.982   2.0178  315.916   14.471  286.817   23.609  333.429   18.315   83.651   3.4698   90.322   2.4900 -6.670563 4.270812 
1 1 1   15    3   49 o  137.695   2.1449  773.987   24.075  764.040   33.991  783.999   34.103  136.697   3.0505  138.475   3.0213 -1.778152 4.293398 
1 1 1   15    3   50 o   75.479   2.1150  232.752   13.000  222.095   21.424  238.963   16.355   73.563   3.5836   76.431   2.6290 -2.868050 4.444560 
1 1 1   15    3   51 o  123.383   2.9295  622.464   29.463   0.0000   0.0000  622.464   29.463  ?   ?   123.383   2.9295 0.000000 2.929482 
1 1 1   15    3   52 o  113.137   2.4760  522.929   22.834  496.362   41.730  534.283   27.281  109.796   4.6733  114.267   2.9313 -4.470917 5.516520 
1 1 1   15    3   53 o   43.010   3.9970   76.517   13.853   56.041   27.474   83.497   16.041   35.807   9.3229   44.871   4.4440 -9.064690 10.32790 
1 1 1   15    3   54 o   26.749   6.0009   30.741   12.762   71.411   26.669   18.662   14.534   40.580   8.3413   21.613   7.1192 18.96693 10.96630 
1 1 1   15    3   55 o   19.402   5.5419   15.925   9.2000   26.798   16.348   10.886   11.130   25.139   7.4484   17.442   6.2138 7.696516 9.699999 
1 1 1   15    3   56 o   87.406   1.9532  311.917   13.916  326.945   23.457  303.755   17.287   89.295   3.2280   86.176   2.4634 3.119720 4.060577 
1 1 1   15    3   57 o   51.994   2.5602  110.792   10.817  105.634   18.993  113.268   13.160   50.439   4.6727   52.508   3.0883 -2.069557 5.601062 
1 1 1   15    3   58 o   84.837   1.9853  293.922   13.729  280.787   22.959  301.233   17.129   82.691   3.4134   85.806   2.4515 -3.115356 4.202546 
1 1 1   15    3   59 o   96.372   1.9184  379.273   15.070  340.451   24.654  402.433   19.042   91.070   3.3266   99.222   2.3543 -8.152214 4.075438 
1 1 1   15    3   60 o   28.253   4.3266   33.605   9.6476   26.493   17.368   36.779   11.602   25.049   7.7328   29.442   5.0139 -4.392569 9.216049 
1 1 1   15    3   61 o  103.970   1.9263  441.543   16.326  422.723   27.093  452.272   20.457  101.468   3.2800  105.164   2.3864 -3.696442 4.056205 
1 1 1   15    3   62 o  140.030   1.9192  801.032   21.906  800.296   36.022  801.464   27.596  139.689   3.1635  139.973   2.4186 -0.2836609 3.982160 
1 1 1   15    3   63 o   61.871   2.4120  156.865   12.142  136.031   20.811  167.615   14.949   57.216   4.4983   63.888   2.8780 -6.672115 5.340212 
1 1 1   15    3   64 o   39.889   3.1284   65.695   10.091   66.372   18.388   65.404   12.070   39.468   5.8959   39.684   3.7769 -0.2155075 7.001950 
1 1 1   15    3   65 o   28.083   4.1569   33.237   9.2289   21.865   16.673   38.261   11.081   23.068   7.6262   30.054   4.6754 -6.985592 8.945226 
1 1 1   15    3   66 o   75.691   2.0453  234.454   12.608  243.734   21.703  229.727   15.489   76.885   3.4719   74.840   2.5426 2.044487 4.303367 
1 1 1   15    3   67 o   35.828   3.0317   53.096   8.7709   45.433   14.696   57.335   10.931   32.484   5.7610   37.121   3.6601 -4.636658 6.825368 
1 1 1   15    3   68 o   71.442   1.9585  208.914   11.395  226.175   18.426  198.225   14.500   74.114   3.0564   69.483   2.5645 4.631760 3.989785 
1 1 1   15    3   69 o   25.918   4.0535   28.453   8.2834   16.655   14.226   34.505   10.189   20.462   7.0443   28.476   4.5418 -8.013876 8.381557 
1 1 1   15    3   70 o  108.010   1.8886  477.278   16.628  480.430   29.608  475.826   20.096  107.872   3.3714  107.751   2.2880 0.1214066 4.074419 
1 1 1   15    3   71 o   31.950   3.7813   42.836   9.6572   29.690   17.695   48.413   11.525   25.878   7.7688   33.866   4.2695 -7.988855 8.864698 
1 1 1   15    3   72 o   37.135   3.0700   57.226   9.2100   58.900   14.800   56.168   11.766   37.143   5.0164   36.557   4.0142 0.5856628 6.424798 
1 1 1   15    3   73 o   91.084   2.1675  340.223   16.093  315.601   27.543  352.987   19.831   87.053   3.8913   92.607   2.6296 -5.553719 4.696514 
1 1 1   15    3   74 o   46.687   2.4888   89.855   9.4374  105.876   15.718   80.823   11.801   50.307   3.8626   44.077   3.3087 6.230133 5.085976 
1 1 1   15    3   75 o   48.517   2.4303   97.025   9.5810  113.154   16.065   88.122   11.936   51.995   3.8170   46.040   3.2004 5.954628 4.981130 
1 1 1   15    3   76 o   38.756   2.8423   62.336   8.9168   48.260   14.988   70.047   11.094   33.131   5.7586   40.957   3.3521 -7.826405 6.663211 
1 1 1   15    3   77 o   43.062   2.5673   76.699   8.9707   76.417   14.918   76.858   11.227   42.402   4.3789   42.925   3.2325 -0.5228157 5.442778 
1 1 1   15    3   78 o   23.167   4.1857   23.203   7.6138   27.897   10.908   18.742   10.633   25.041   5.4950   20.524   5.9870 4.516092 8.126480 
1 1 1   15    3   79 o   9.2319   4.1854  -3.5230   6.8044  -5.6820   10.293  -1.8471   9.0687   11.168   5.0961   11.377   5.0157 -0.2087746 7.150374 
1 1 1   15    3   80 o   24.246   3.7316   25.157   7.1391   8.8453   10.749   38.031   9.5495   15.975   6.0355   29.815   4.0325 -13.84037 7.258670 
1 1 1   15    3   81 o   20.235   3.8767   17.755   6.1618   19.230   10.867   17.056   7.4806   20.656   6.0604   19.616   4.7331 1.040049 7.689604 
1 1 1   15    3   82 o   13.052   4.9680   5.5229   7.3157   2.4778   11.602   7.5325   9.4255   14.050   5.9251   14.873   5.6443 -0.8233271 8.183224 
1 1 1   15    3   83 o   29.389   3.3532   36.578   7.8896   20.367   12.380   47.663   10.238   21.130   6.5297   33.421   3.8268 -12.29037 7.568463 
1 1 1   15    3   84 o   12.541   5.0999   3.4232   8.1736   14.902   11.721  -7.4433   11.404   18.602   6.3945   11.373   5.2533 7.229189 8.275649 
1 1 1   15    3   85 o   13.741   4.8205   7.4687   6.6772 -17.9897   11.382   20.828   8.2450   9.5281   4.6307   21.577   4.8104 -12.04932 6.677110 
1 1 1   15    3   86 o   47.960   2.2187   95.199   8.6504   96.145   16.638   94.849   10.127   47.184   4.3757   47.732   2.6127 -0.5473900 5.096381 
1 1 1   15    3   87 o   8.2204   3.8332  -5.3770   6.2962 -11.2261   13.493  -3.7488   7.1187   11.788   5.5339   9.3365   4.2517 2.451777 6.978582 
1 1 1   15    3   88 o   20.889   3.8883   19.100   6.3772   24.322   12.528   17.273   7.4091   22.683   6.4630   19.591   4.6998 3.091522 7.991168 
1 1 1   15    3   89 o   41.523   2.0468   71.357   6.9066   63.757   11.597   75.533   8.5974   38.562   3.7362   42.571   2.4884 -4.008411 4.488996 
1 1 1   15    3   90 o   46.509   1.8758   89.323   7.0971   89.782   11.879   89.067   8.8501   46.074   3.1825   46.270   2.3542 -0.1967316 3.958633 
1 1 1   15    3   91 o   69.916   1.4916  200.791   8.5011  217.712   14.280  191.502   10.580   72.303   2.4263   68.086   1.9082 4.217667 3.086831 
1 1 1   15    3   92 o   8.4325   3.7892  -2.0419   5.4353 -15.0094   10.063   3.2995   6.4584   9.0218   4.3776   11.352   4.5631 -2.330567 6.323392 
1 1 1   15    3   93 o   27.769   2.6358   32.565   5.8950   38.454   11.133   30.271   6.9492   29.083   4.8680   26.511   3.2860 2.572037 5.873255 
1 1 1   15    3   94 o   20.489   4.2555   18.994   6.8746   8.6475   10.981   25.664   8.8161   15.343   6.0194   23.651   4.7382 -8.307665 7.660480 
1 1 1   15    3   95 o   11.002   4.4838   2.8994   6.3341  -4.7107   10.409   7.3749   7.9823   11.059   5.0755   13.805   5.2043 -2.746385 7.269507 
1 1 1   15    3   96 o   28.042   2.8124   33.570   6.3419   38.187   11.031   31.290   7.7510   28.721   4.8864   26.654   3.6644 2.067837 6.107783 
1 1 1   15    3   97 o   48.165   2.4259   97.624   9.4939   87.708   12.123  113.349   15.267   45.028   3.3264   50.868   3.7073 -5.839939 4.980855 
1 1 1   15    3   98 o   13.382   5.2787   6.3844   8.4853   4.7786   11.126   8.6169   13.119   13.780   5.8062   15.586   6.4136 -1.805899 8.651366 
1 1 1   15    3   99 o   13.063   5.2511   5.7016   8.5536  -1.3426   11.319   15.081   13.061   12.110   5.4528   17.611   6.6531 -5.500761 8.602101 
1 1 1   15    3  100 o   21.007   5.2036   21.663   8.8639   11.714   11.814   34.477   13.408   16.119   6.2666   25.574   6.4373 -9.454582 8.983866 
1 1 1   15    3  101 o   10.475   4.7669  -2.6182   8.9294   8.5266   11.207 -21.9951   14.777   14.803   5.9892   10.338   5.0773 4.465034 7.851730 
1 1 1   15    3  102 o   24.098   5.0398   28.243   9.5813   29.459   12.070   26.170   15.755   23.643   6.1908   21.213   7.4073 2.429672 9.653749 
1 1 1   15    3  103 o   17.308   5.7167   15.188   9.3694   13.918   11.884   17.275   15.231   16.778   6.3445   18.129   7.0960 -1.350882 9.518750 
1 1 1   15    3  104 o   37.806   4.0149   65.184   12.184   63.246   17.295   67.094   17.167   34.693   6.3494   36.126   6.0428 -1.433304 8.765285 
1 1 1   15    3  105 f   42.626   3.6850   81.610   12.678   76.447   18.348   86.327   17.539   38.471   6.0504   41.976   5.2398 -3.504936 8.003943 
1 1 1   15    3  106 f   33.168   4.6869   52.455   12.319   40.659   17.596   63.797   17.254   25.645   7.7577   34.695   6.3341 -9.049854 10.01508 
1 1 1   15    3  107 o   16.174   6.2461   12.953   11.678   12.647   16.871   13.234   16.180   16.669   7.0921   16.735   7.0236 -0.6604004E-01 9.981441 
1 1 1   15    3  108 o   29.193   5.3266   42.725   12.209   31.939   17.757   52.395   16.813   22.201   7.8549   30.451   6.9298 -8.249212 10.47478 
1 1 1   15    3  109 o   12.908   5.6940   2.7651   11.704 -17.5937   17.519   19.173   15.728   11.688   5.6951   18.254   7.1910 -6.566046 9.173069 
1 1 1   15    3  110 o   24.240   6.6120   33.367   13.424   26.987   17.044   43.792   21.785   20.534   7.6324   24.505   8.6974 -3.971043 11.57142 
1 1 1   15    3  111 f   15.866   6.4910   12.146   13.338   24.938   16.674 -10.5786   22.225   19.828   7.5113   13.771   6.6389 6.057151 10.02468 
1 1 1   15    3  112 o   21.967   6.9113   28.961   13.803   35.560   17.745   18.850   21.965   23.023   7.8695   17.978   7.8697 5.044638 11.12924 
1 1 1   15    3  113 o   10.428   5.1428 -22.2090   15.688 -33.9351   23.674 -13.0282   20.948   12.053   6.0080   13.129   6.3575 -1.075384 8.747177 
1 1 1   15    3  114 o   20.127   7.4671   25.792   16.299   20.489   24.122   30.248   22.111   18.395   8.1419   20.508   8.3699 -2.112907 11.67672 
1 1 1   15    4 -112 o   18.168   8.2185   19.189   26.065   0.0000   0.0000   19.189   26.065  ?   ?    18.168   8.2185 0.000000 8.218544 
1 1 1   15    4 -111 o   12.724   5.9064  -2.2166   14.685  -2.8623   18.720  -1.1836   23.678   13.780   6.4842   15.057   7.1470 -1.277718 9.650071 
1 1 1   15    4 -110 o   12.652   5.9074  -3.2709   15.032  -3.2877   18.948  -3.2424   24.690   13.774   6.4944   14.995   7.1679 -1.221876 9.672434 
1 1 1   15    4 -109 o   25.837   7.0942   39.949   15.395   41.418   19.515   37.527   25.051   24.348   8.2537   21.662   8.8829 2.686668 12.12552 
1 1 1   15    4 -108 o   15.240   6.5689   9.0944   14.823   7.5611   18.496   11.847   24.783   15.554   6.9897   17.081   7.8366 -1.526727 10.50083 
1 1 1   15    4 -107 f   25.334   6.5149   35.970   13.529   44.498   19.136   27.449   19.129   25.860   8.1378   20.332   7.9541 5.527189 11.37948 
1 1 1   15    4 -106 o   29.189   5.9054   44.715   13.568   34.373   19.301   54.818   19.076   22.458   8.1597   29.811   7.7718 -7.353340 11.26856 
1 1 1   15    4 -105 o   21.001   6.8431   25.646   13.444   49.386   19.097   2.3184   18.930   27.920   7.9876   14.887   6.8372 13.03282 10.51422 
1 1 1   15    4 -104 o   20.049   6.7849   23.038   13.187   31.340   18.371   14.213   18.941   21.952   7.9628   17.256   7.4317 4.695591 10.89203 
1 1 1   15    4 -103 o   20.459   7.3229   25.075   15.475   27.557   18.173   18.524   29.517   20.861   7.8551   18.843   8.6101 2.018017 11.65492 
1 1 1   15    4 -102 o   13.936   6.0029   5.2953   12.363   8.9822   16.952   1.1057   18.070   15.936   6.9457   14.632   6.7050 1.303796 9.654015 
1 1 1   15    4 -101 o   26.657   6.1949   37.500   13.204   44.086   18.346   30.422   19.019   26.852   7.8732   21.875   8.0751 4.977242 11.27807 
1 1 1   15    4 -100 o   17.144   6.5367   14.782   12.679   10.258   17.485   19.798   18.411   16.484   7.1200   18.947   7.6728 -2.462969 10.46740 
1 1 1   15    4  -99 o   29.053   5.8587   42.880   13.395   14.196   18.502   74.479   19.420   17.611   7.4572   37.589   6.5773 -19.97785 9.943400 
1 1 1   15    4  -98 o   12.459   5.6447  -1.3389   12.352   3.6030   17.323  -6.4494   17.616   15.164   6.7932   13.501   6.3332 1.662784 9.287455 
1 1 1   15    4  -97 o   19.743   6.5283   20.683   12.218   15.740   16.926   26.059   17.654   18.050   7.3394   21.168   7.7858 -3.117491 10.69985 
1 1 1   15    4  -96 o   13.002   5.7731   0.6782   12.223   21.696   17.283 -20.3531   17.289   20.000   7.6304   11.690   5.6872 8.310019 9.516685 
1 1 1   15    4  -95 o   17.085   6.4329   13.531   12.188   30.144   17.029  -3.9165   17.451   23.123   7.7092   14.141   6.5198 8.982213 10.09654 
1 1 1   15    4  -94 o   13.363   5.6554   3.8237   10.632   12.247   13.823  -8.3758   16.635   17.002   6.7279   13.192   6.1775 3.810126 9.133781 
1 1 1   15    4  -93 o   12.314   5.3717   0.8782   10.158   10.628   13.304 -12.7506   15.730   16.465   6.5727   12.212   5.8048 4.252942 8.769068 
1 1 1   15    4  -92 o   13.325   5.5953   3.8217   10.277   0.5749   13.323   8.5920   16.149   13.719   6.0626   16.680   7.0096 -2.960225 9.267691 
1 1 1   15    4  -91 o   33.361   3.0503   47.518   8.2032   54.294   13.774   43.794   10.212   34.405   5.0625   31.469   4.0766 2.936287 6.499825 
1 1 1   15    4  -90 o   27.480   3.6182   32.855   7.9081   25.415   13.289   36.934   9.8399   22.599   6.7203   28.792   4.3262 -6.193859 7.992434 
1 1 1   15    4  -89 o   10.224   4.4850  -0.7134   7.1685   2.6865   12.872  -2.2421   8.6309   14.292   6.1403   10.725   4.8005 3.567081 7.794132 
1 1 1   15    4  -88 o   33.651   3.1639   48.167   8.5772   42.321   16.011   50.520   10.158   29.431   6.8092   34.214   3.7009 -4.783148 7.749993 
1 1 1   15    4  -87 o   16.546   5.2034   12.249   7.8250   13.623   15.804   11.803   9.0064   18.607   7.2442   16.468   5.6068 2.139326 9.160478 
1 1 1   15    4  -86 o   23.941   4.7411   25.735   8.9250   33.713   25.121   24.583   9.5479   25.536   9.3044   23.200   5.1799 2.335957 10.64912 
1 1 1   15    4  -85 o   45.503   2.3745   86.041   8.7769   91.324   14.285   82.838   11.124   46.191   3.8284   44.349   3.0966 1.841805 4.923971 
1 1 1   15    4  -84 o   11.978   4.8151   3.5133   7.1920  -8.8648   12.572   9.5349   8.7686   11.703   5.4435   15.417   5.5129 -3.714049 7.747516 
1 1 1   15    4  -83 o   24.567   4.5399   26.688   8.7567   31.313   12.973   22.817   11.869   25.905   6.2217   22.118   6.2870 3.786987 8.845080 
1 1 1   15    4  -82 o   45.170   3.1178   85.701   11.409   79.012   17.753   90.407   14.892   42.230   5.2716   45.960   4.0153 -3.730461 6.626647 
1 1 1   15    4  -81 o   23.971   4.6284   25.423   8.7164   25.335   12.712   25.501   11.974   23.301   6.4657   23.454   6.1783 -0.1531734 8.942939 
1 1 1   15    4  -80 o   34.672   3.1438   50.565   8.7888   38.937   13.502   59.114   11.577   29.277   5.8624   37.226   3.8717 -7.949177 7.025533 
1 1 1   15    4  -79 o   31.614   3.9633   42.811   9.9897   53.761   13.383   29.032   15.012   35.112   4.8015   24.856   7.0726 10.25603 8.548459 
1 1 1   15    4  -78 o   17.489   5.7667   13.100   9.5353   18.007   12.693   6.7447   14.446   20.187   6.6533   16.572   6.7646 3.614935 9.488254 
1 1 1   15    4  -77 f   36.366   3.6011   55.862   10.535   61.330   14.100   48.953   15.850   37.680   4.6921   32.961   6.1245 4.719040 7.715213 
1 1 1   15    4  -76 o   27.035   5.1741   32.271   10.987   34.468   13.173   27.248   19.917   27.635   6.0184   24.475   8.3378 3.160152 10.28298 
1 1 1   15    4  -75 o   11.306   4.4840   3.1434   6.1530   4.0552   8.5401   2.1593   8.8729   13.098   5.2533   12.564   5.2317 0.5343609 7.414019 
1 1 1   15    4  -74 o   29.333   2.9171   35.939   6.8828   37.083   9.3047   34.558   10.228   29.507   3.9690   28.265   4.5972 1.242418 6.073481 
1 1 1   15    4  -73 o  100.745   1.5431  415.332   12.673  415.759   16.972  414.793   19.051  100.636   2.0690  100.423   2.3272 0.2126770 3.113942 
1 1 1   15    4  -72 o   22.754   4.4804   22.466   8.0142   33.152   13.597   16.777   9.9206   27.193   6.2633   19.578   5.8026 7.614876 8.538077 
1 1 1   15    4  -71 o   10.851   4.4693   1.7236   6.3776  -0.9490   8.5035   5.1597   9.6420   11.341   4.9316   14.186   5.6173 -2.845110 7.474908 
1 1 1   15    4  -70 o   47.189   2.0521   91.460   7.8747   88.955   10.574   94.580   11.800   46.382   2.8098   47.772   3.0461 -1.390247 4.144154 
1 1 1   15    4  -69 o   33.919   2.6246   47.588   7.2003   42.177   9.6664   54.332   10.792   31.652   3.8239   36.003   3.7312 -4.351467 5.342730 
1 1 1   15    4  -68 o   69.101   1.7100  195.312   9.6322  191.481   12.960  200.040   14.397   68.277   2.3320   69.739   2.5368 -1.461945 3.445810 
1 1 1   15    4  -67 o   54.525   1.9836  121.872   8.8016  133.375   12.445  110.358   12.450   56.910   2.6902   51.695   2.9670 5.214478 4.005027 
1 1 1   15    4  -66 o   20.313   4.3144   17.775   6.9232   9.6402   9.6047   26.572   9.9883   16.170   5.7712   24.762   5.1178 -8.591602 7.713519 
1 1 1   15    4  -65 o   44.789   2.2312   82.367   8.1202   80.997   11.316   83.822   11.659   44.250   3.1581   45.011   3.1984 -0.7604408 4.494829 
1 1 1   15    4  -64 o   38.966   2.5611   62.525   8.0897   59.165   11.532   65.780   11.351   37.662   3.8086   39.791   3.5364 -2.129021 5.197268 
1 1 1   15    4  -63 o  123.571   1.6642  623.855   16.764  642.313   24.107  606.573   23.327  125.232   2.3616  121.701   2.3514 3.531464 3.332546 
1 1 1   15    4  -62 o   15.818   4.9558   10.326   7.1045   2.2428   9.6028   20.101   10.560   13.224   5.4690   21.551   5.8587 -8.326870 8.014599 
1 1 1   15    4  -61 o   66.193   1.6623  179.075   8.9623  179.263   13.615  178.932   11.905   66.108   2.5313   66.097   2.2128 0.1139832E-01 3.362112 
1 1 1   15    4  -60 o   12.116   4.6831   3.9788   6.5687   2.1205   10.187   5.3014   8.5940   13.540   5.6193   13.867   5.3575 -0.3266630 7.763936 
1 1 1   15    4  -59 o   55.932   1.9387  127.988   8.8259  135.441   13.384  122.253   11.740   57.412   2.8689   54.572   2.6471 2.840130 3.903556 
1 1 1   15    4  -58 f  125.234   1.6491  640.356   16.835  665.093   23.070  612.182   24.621  127.538   2.2191  122.313   2.4694 5.224884 3.320012 
1 1 1   15    4  -57 o   84.857   1.6068  293.945   11.114  290.840   16.700  296.414   14.890   84.286   2.4332   85.132   2.1475 -0.8461456 3.245304 
1 1 1   15    4  -56 o  125.394   1.4826  641.676   15.155  659.388   22.456  626.862   20.536  127.021   2.1688  123.869   2.0339 3.152084 2.973289 
1 1 1   15    4  -55 o  155.257   1.5163  983.687   19.190  961.080   27.718  1004.50   26.595  153.352   2.2174  156.803   2.0807 -3.451050 3.040734 
1 1 1   15    4  -54 o  127.470   1.4729  663.009   15.305  647.639   22.352  676.576   21.000  125.899   2.1780  128.706   2.0016 -2.806747 2.958018 
1 1 1   15    4  -53 o   54.573   1.9187  121.756   8.5219  125.125   12.988  119.209   11.293   55.216   2.8957   53.931   2.5762 1.285172 3.875792 
1 1 1   15    4  -52 o  156.696   1.5905  1001.96   20.316  982.753   27.622  1024.59   29.986  155.104   2.1848  158.347   2.3231 -3.243637 3.189036 
1 1 1   15    4  -51 o   79.879   1.7403  260.420   11.332  252.745   19.851  264.130   13.802   78.513   3.1078   80.392   2.1079 -1.879173 3.755265 
1 1 1   15    4  -50 o   94.128   1.6520  361.546   12.676  358.458   21.788  363.126   15.584   93.569   2.8600   94.304   2.0273 -0.7350159 3.505637 
1 1 1   15    4  -49 o   87.421   1.7894  311.908   12.751  313.484   25.139  311.362   14.796   87.400   3.5359   87.324   2.0786 0.7576752E-01 4.101566 
1 1 1   15    4  -48 o   65.533   1.9456  175.461   10.382  176.524   16.178  174.716   13.536   65.619   3.0327   65.338   2.5464 0.2810822 3.960040 
1 1 1   15    4  -47 o   19.829   5.1131   16.799   8.3178   17.777   14.842   16.352   10.043   21.344   7.1981   19.745   5.8349 1.598511 9.265974 
1 1 1   15    4  -46 f   48.115   2.5076   94.840   9.8011  102.085   16.953   91.203   12.012   49.701   4.2244   47.111   3.1460 2.590084 5.267169 
1 1 1   15    4  -45 o   30.884   3.2785   39.465   8.1277   36.070   13.609   41.348   10.133   29.044   5.9485   31.503   4.0389 -2.458931 7.190071 
1 1 1   15    4  -44 o   93.502   1.8159  356.751   13.841  361.696   20.328  352.477   18.898   94.048   2.6543   92.858   2.4989 1.189606 3.645506 
1 1 1   15    4  -43 o  120.932   1.5822  596.576   15.597  582.602   24.879  605.624   20.019  119.425   2.5557  121.813   2.0161 -2.388474 3.255161 
1 1 1   15    4  -42 o  105.884   1.7879  457.429   15.431  455.922   22.363  458.798   21.320  105.647   2.5968  105.991   2.4676 -0.3441772 3.582263 
1 1 1   15    4  -41 o   43.496   2.5198   77.522   8.8959   67.964   15.126   82.576   10.999   40.431   4.6757   44.845   3.0267 -4.414169 5.569849 
1 1 1   15    4  -40 o   77.898   1.7723  247.562   11.254  250.719   18.630  245.748   14.122   78.274   2.9250   77.558   2.2360 0.7156677 3.681753 
1 1 1   15    4  -39 o  165.330   1.6461  1114.97   22.184  1154.69   35.886  1090.41   28.223  168.144   2.6183  163.455   2.1182 4.688416 3.367787 
1 1 1   15    4  -38 o   65.315   1.9637  174.228   10.443  173.713   17.732  174.501   12.922   65.092   3.3532   65.331   2.4307 -0.2391586 4.141517 
1 1 1   15    4  -37 o   98.615   1.7981  396.733   14.454  402.862   29.950  394.871   16.503   99.156   3.7121   98.370   2.0581 0.7866516 4.244433 
1 1 1   15    4  -36 o   71.673   1.8473  209.707   10.784  183.353   18.167  224.046   13.400   66.885   3.3426   74.058   2.2222 -7.172813 4.013890 
1 1 1   15    4  -35 o   97.215   1.6447  385.473   13.033  381.110   21.675  387.943   16.311   96.561   2.7566   97.507   2.0522 -0.9457169 3.436612 
1 1 1   15    4  -34 o   81.505   1.9595  271.023   13.019  279.566   19.729  264.433   17.327   82.677   2.9320   80.431   2.6464 2.245277 3.949701 
1 1 1   15    4  -33 o  129.204   1.7718  680.936   18.660  655.978   26.928  703.993   25.883  126.756   2.6062  131.329   2.4177 -4.572807 3.554940 
1 1 1   15    4  -32 o   97.996   1.8457  391.726   14.743  377.495   21.842  403.639   19.983   96.107   2.7910   99.442   2.4652 -3.334877 3.723783 
1 1 1   15    4  -31 o   39.520   3.2152   64.231   10.268   62.950   15.900   65.148   13.449   38.846   5.1478   39.675   4.2233 -0.8291016 6.658517 
1 1 1   15    4  -30 o   83.211   1.7867  282.418   12.119  263.630   20.567  292.410   14.999   80.272   3.1493   84.627   2.1761 -4.355644 3.828028 
1 1 1   15    4  -29 o  146.059   1.7370  870.076   20.681  816.996   36.635  894.904   25.055  141.421   3.1779  148.107   2.0753 -6.685822 3.795564 
1 1 1   15    4  -28 o  137.626   1.7473  772.501   19.603  741.812   35.144  786.362   23.618  134.758   3.1993  138.835   2.0869 -4.077194 3.819809 
1 1 1   15    4  -27 o  275.697   2.2455  3101.28   50.463  3111.77   71.964  3091.13   70.782  276.009   3.1986  275.100   3.1564 0.9093628 4.493766 
1 1 1   15    4  -26 o  166.769   1.8477  1134.35   25.118  1114.86   31.526  1168.23   41.566  165.294   2.3398  169.140   3.0148 -3.846512 3.816194 
1 1 1   15    4  -25 o   41.564   3.2330   70.987   10.868   57.937   14.923   85.721   15.858   37.273   5.0408   45.572   4.3205 -8.298248 6.638959 
1 1 1   15    4  -24 o   68.468   2.3384  191.497   13.032  188.146   17.585  195.581   19.410   67.798   3.1908   69.103   3.4569 -1.304359 4.704369 
1 1 1   15    4  -23 o   98.109   1.9936  392.619   15.944  411.039   21.113  368.179   24.320  100.323   2.5839   94.897   3.1483 5.425957 4.072910 
1 1 1   15    4  -22 o  108.297   2.1262  478.446   18.770  454.984   25.980  504.064   27.148  105.516   3.0237  111.068   3.0013 -5.551941 4.260332 
1 1 1   15    4  -21 o  146.268   1.8027  872.544   21.493  882.156   31.991  864.636   29.018  147.013   2.6695  145.563   2.4456 1.450363 3.620374 
1 1 1   15    4  -20 f  123.542   1.8384  622.493   18.514  632.224   28.586  615.462   24.299  124.447   2.8179  122.812   2.4273 1.635323 3.719166 
1 1 1   15    4  -19 o   19.256   5.6056   15.496   9.3296   7.6891   14.110   21.560   12.436   17.529   6.8390   22.627   6.4369 -5.097147 9.391801 
1 1 1   15    4  -18 o  170.460   1.6031  1184.87   22.275  1172.49   32.180  1196.25   30.863  169.520   2.3288  171.238   2.2111 -1.717789 3.211259 
1 1 1   15    4  -17 o  140.132   1.5438  800.717   17.634  774.885   25.430  824.645   24.475  137.816   2.2636  142.181   2.1118 -4.365295 3.095740 
1 1 1   15    4  -16 o  124.957   1.5350  636.683   15.635  604.224   22.724  665.862   21.546  121.696   2.2908  127.765   2.0688 -6.068382 3.086651 
1 1 1   15    4  -15 o  127.003   1.6436  657.745   17.015  628.071   23.253  691.949   24.965  124.075   2.2991  130.228   2.3517 -6.153687 3.288858 
1 1 1   15    4  -14 o  137.393   1.5300  769.706   17.135  759.962   25.098  778.212   23.451  136.485   2.2559  138.124   2.0828 -1.638824 3.070375 
1 1 1   15    4  -13 o  141.909   1.6447  821.190   19.026  813.862   30.937  825.647   24.128  141.215   2.6876  142.272   2.0805 -1.057083 3.398746 
1 1 1   15    4  -12 o  165.844   1.6777  1121.58   22.680  1137.88   36.525  1111.35   28.935  166.977   2.6835  165.058   2.1505 1.918915 3.438866 
1 1 1   15    4  -11 o  207.973   1.8001  1763.92   30.518  1713.45   47.322  1799.85   39.930  204.886   2.8334  210.038   2.3322 -5.152069 3.669817 
1 1 1   15    4  -10 o  174.035   1.6953  1235.11   24.050  1267.48   38.805  1214.93   30.645  176.229   2.7013  172.577   2.1784 3.651886 3.470186 
1 1 1   15    4   -9 o   28.468   3.6769   33.659   8.3335   34.263   13.101   33.248   10.800   28.391   5.8556   28.100   4.8927 0.2913551 7.630603 
1 1 1   15    4   -8 o  253.453   1.8469  2619.79   38.158  2573.14   54.154  2665.81   53.776  251.104   2.6457  255.594   2.5811 -4.489532 3.696162 
1 1 1   15    4   -7 o   88.449   1.6350  319.007   11.788  332.038   18.024  309.265   15.584   90.177   2.4543   87.043   2.1981 3.133499 3.294717 
1 1 1   15    4   -6 o  152.070   1.6406  942.980   20.337  920.336   27.699  969.461   29.954  150.201   2.2623  154.149   2.3839 -3.948761 3.286476 
1 1 1   15    4   -5 o  175.833   1.6837  1260.74   24.132  1281.84   33.074  1236.73   35.290  177.260   2.2889  174.098   2.4867 3.161880 3.379762 
1 1 1   15    4   -4 f  195.678   1.7465  1561.44   27.858  1579.56   37.846  1540.03   41.154  196.766   2.3596  194.268   2.5988 2.498016 3.510216 
1 1 1   15    4   -3 o  106.114   1.6703  459.163   14.448  476.763   20.357  441.297   20.510  108.104   2.3101  104.001   2.4193 4.103287 3.345061 
1 1 1   15    4   -2 o  212.940   1.9327  1849.29   33.547  1876.30   48.503  1824.53   46.449  214.413   2.7751  211.443   2.6949 2.970322 3.868329 
1 1 1   15    4   -1 o  201.223   1.8929  1651.33   31.048  1709.06   56.658  1626.56   37.117  204.566   3.3977  199.679   2.2804 4.887009 4.092027 
1 1 1   15    4    0 o  154.502   1.6460  973.375   20.730  950.695   33.239  987.811   26.518  152.632   2.6716  155.620   2.0905 -2.988861 3.392247 
1 1 1   15    4    1 o  155.264   1.6508  983.007   20.893  981.705   33.828  983.810   26.566  155.100   2.6756  155.304   2.0985 -0.2040100 3.400363 
1 1 1   15    4    2 o  105.450   1.6652  453.432   14.314  446.053   23.932  457.543   17.861  104.503   2.8119  105.913   2.0688 -1.409462 3.490963 
1 1 1   15    4    3 o  150.240   1.6383  920.421   20.064  930.317   32.736  914.467   25.391  150.987   2.6598  149.732   2.0804 1.255295 3.376774 
1 1 1   15    4    4 f   62.786   1.9322  160.926   9.8770  169.617   15.494  154.977   12.819   64.393   2.9597   61.575   2.5596 2.818001 3.912993 
1 1 1   15    4    5 o  111.396   1.5503  505.976   14.077  509.212   21.189  503.419   18.834  111.721   2.3266  111.095   2.0798 0.6265106 3.120700 
1 1 1   15    4    6 o  130.521   1.5286  694.618   16.263  669.395   23.871  716.465   22.217  128.096   2.2862  132.535   2.0564 -4.438980 3.074965 
1 1 1   15    4    7 o  165.418   1.8025  1115.90   24.304  1074.33   34.425  1157.21   34.319  162.256   2.6027  168.407   2.5000 -6.150269 3.608892 
1 1 1   15    4    8 o   41.087   3.0932   69.311   10.284   71.371   15.312   67.619   13.880   41.516   4.6018   40.442   4.2750 1.074276 6.281088 
1 1 1   15    4    9 o  135.071   1.7681  744.009   19.468  743.614   28.351  744.361   26.779  134.992   2.5765  135.069   2.4322 -0.7658386E-01 3.543147 
1 1 1   15    4   10 o  162.790   2.1482  1081.01   28.506  1060.00   40.278  1102.09   40.350  161.130   3.0665  164.303   3.0127 -3.172928 4.298846 
1 1 1   15    4   11 o   14.286   5.7661   3.6221   10.359  -4.1966   23.906   5.4295   11.494   18.953   8.2548   15.537   6.1390 3.416121 10.28736 
1 1 1   15    4   12 o   20.178   5.6728   17.145   9.7176   23.356   17.281   14.273   11.752   24.111   7.7502   19.196   6.4043 4.914879 10.05392 
1 1 1   15    4   13 o   31.437   4.0344   41.060   10.101   42.828   17.579   40.188   12.341   31.663   6.9975   30.930   5.0703 0.7325573 8.641407 
1 1 1   15    4   14 o  134.956   1.7709  742.755   19.482  740.408   28.896  744.710   26.378  134.694   2.6318  135.100   2.3953 -0.4058380 3.558633 
1 1 1   15    4   15 o   69.964   2.1508  199.868   12.252  183.987   18.796  211.602   16.156   67.023   3.4520   71.949   2.7598 -4.925377 4.419540 
1 1 1   15    4   16 o   59.866   2.3921  146.465   11.650  172.396   18.905  130.589   14.792   64.858   3.5898   56.456   3.2278 8.401989 4.827580 
1 1 1   15    4   17 o   45.201   3.2502   83.871   11.896   93.098   17.177   75.368   16.490   47.491   4.4904   42.637   4.8295 4.854183 6.594550 
1 1 1   15    4   18 o   25.173   5.1832   26.911   10.281   21.889   16.069   30.391   13.377   23.318   7.4716   26.675   6.2603 -3.357519 9.747618 
1 1 1   15    4   19 o  174.102   1.8731  1236.29   26.582  1238.40   38.718  1234.40   36.561  174.183   2.7269  173.915   2.5790 0.2677917 3.753267 
1 1 1   15    4   20 f   58.817   2.9464  141.599   14.082  149.676   19.408  132.621   20.462   60.375   3.9656   56.756   4.4586 3.619041 5.967016 
1 1 1   15    4   21 o   49.715   3.0548  101.305   12.320  124.780   18.757   83.493   16.338   55.074   4.2100   44.944   4.5210 10.12956 6.177672 
1 1 1   15    4   22 o   84.192   2.4084  289.475   16.512  161.432   27.016  365.826   20.862   62.530   5.3516   94.632   2.7072 -32.10176 5.997396 
1 1 1   15    4   23 o  107.723   1.9798  473.332   17.384  443.489   25.401  499.629   23.844  104.176   2.9943  110.640   2.6438 -6.464691 3.994425 
1 1 1   15    4   24 o  105.155   1.9750  451.030   16.929  424.136   24.610  475.187   23.324  101.878   2.9667  107.899   2.6519 -6.021729 3.979124 
1 1 1   15    4   25 o   20.381   6.3611   16.934   11.717   5.9232   20.995   21.915   14.121   19.909   8.1443   22.993   6.9482 -3.084307 10.70549 
1 1 1   15    4   26 o   81.410   2.4342  270.703   16.136  273.978   24.511  268.198   21.436   81.790   3.6859   80.964   3.2546 0.8254700 4.917141 
1 1 1   15    4   27 o  180.125   2.2553  1323.82   33.115  1290.82   47.569  1354.86   46.127  177.757   3.2829  182.135   3.1069 -4.377975 4.519991 
1 1 1   15    4   28 o  207.244   2.3830  1752.72   40.256  1722.09   57.941  1781.32   55.972  205.283   3.4626  208.810   3.2884 -3.527283 4.775235 
1 1 1   15    4   29 o  121.462   2.4085  602.076   23.846  601.680   42.563  602.257   28.789  121.171   4.3161  121.443   2.9081 -0.2724686 5.204382 
1 1 1   15    4   30 o  123.425   2.0966  621.518   21.094  570.898   41.510  639.140   24.492  118.018   4.3222  125.142   2.4009 -7.124092 4.944286 
1 1 1   15    4   31 o   42.349   3.4411   73.780   11.776   77.178   24.421   72.751   13.443   42.673   7.2818   41.984   3.9753 0.6884003 8.296222 
1 1 1   15    4   32 o  110.870   1.9037  501.442   17.205  476.785   27.653  517.015   21.976  107.981   3.1450  112.549   2.3954 -4.568054 3.953363 
1 1 1   15    4   33 o   66.989   2.2649  183.344   12.350  192.485   20.695  178.288   15.391   68.502   3.7201   66.009   2.8672 2.493469 4.696799 
1 1 1   15    4   34 o   95.943   1.9608  375.552   15.335  364.249   25.129  382.258   19.357   94.348   3.2724   96.737   2.4567 -2.389580 4.091934 
1 1 1   15    4   35 o  143.211   1.8850  836.709   22.005  873.112   36.249  815.467   27.690  146.180   3.0421  141.339   2.4034 4.841660 3.876955 
1 1 1   15    4   36 o  158.117   1.9209  1020.02   24.758  1028.84   40.007  1014.55   31.519  158.669   3.0932  157.641   2.4528 1.028244 3.947663 
1 1 1   15    4   37 o  211.281   2.1114  1821.71   36.364  1843.64   58.580  1807.95   46.383  212.337   3.3844  210.396   2.7045 1.940933 4.332283 
1 1 1   15    4   38 o   83.762   2.0469  286.311   13.976  273.095   22.728  294.347   17.723   81.646   3.4225   84.862   2.5650 -3.216095 4.277003 
1 1 1   15    4   39 o   49.844   2.7492  101.797   11.127   92.733   18.697  106.768   13.846   47.277   4.9236   50.987   3.3499 -3.709766 5.955144 
1 1 1   15    4   40 o   15.133   5.7326   6.7432   9.7125  -7.2142   16.604   14.003   11.975   14.854   6.6529   19.094   6.4656 -4.239305 9.277174 
1 1 1   15    4   41 o  150.815   1.8980  928.105   23.333  962.667   38.193  907.524   29.473  153.457   3.0533  149.079   2.4253 4.378098 3.899296 
1 1 1   15    4   42 o  114.941   2.1601  539.294   20.239  535.348   28.935  543.074   28.320  114.383   3.1062  115.219   3.0179 -0.8356628 4.330844 
1 1 1   15    4   43 o   23.188   6.1055   22.995   11.697   25.536   17.254   20.834   15.911   24.818   7.7150   22.790   7.4457 2.028191 10.72193 
1 1 1   15    4   44 o  125.539   2.1383  643.394   21.881  638.916   31.163  647.748   30.731  124.994   3.0586  125.864   2.9953 -0.8695450 4.280982 
1 1 1   15    4   45 o   84.357   2.3661  290.863   16.254  265.925   23.210  314.867   22.770   80.509   3.5453   87.670   3.1916 -7.160942 4.770269 
1 1 1   15    4   46 f   28.755   7.5874   35.680   18.040   77.723   26.721   0.4695   24.454   42.497   8.0073   19.947   8.5143 22.54980 11.68801 
1 1 1   15    4   47 o   74.563   2.7577  227.586   16.732  226.768   31.822  227.898   19.671   73.995   5.3111   74.552   3.2447 -0.5567169 6.223819 
1 1 1   15    4   48 o   96.565   4.6313  384.238   36.349  384.238   36.349   0.0000   0.0000   96.565   4.6313  ?   ?  0.000000 4.631315 
1 1 1   15    4   49 o   32.044   4.5141   43.017   11.465   32.829   17.613   50.507   15.102   27.610   7.5912   34.562   5.5481 -6.952364 9.402506 
1 1 1   15    4   50 o   28.958   4.2387   35.159   9.7092   25.036   17.021   40.041   11.821   24.528   7.6687   30.820   4.8665 -6.291574 9.082541 
1 1 1   15    4   51 o  104.631   1.8939  446.929   16.153  447.139   26.629  446.807   20.318  104.460   3.1309  104.566   2.3837 -0.1058655 3.935000 
1 1 1   15    4   52 o   54.093   2.4973  119.866   10.982  137.724   19.027  110.945   13.448   57.762   4.0670   51.950   3.1910 5.811382 5.169435 
1 1 1   15    4   53 o   53.215   2.5086  116.040   10.851  132.161   18.717  107.877   13.318   56.563   4.0869   51.216   3.2061 5.346970 5.194407 
1 1 1   15    4   54 o  115.240   1.8839  542.281   17.697  551.813   29.298  536.807   22.205  116.023   3.1006  114.594   2.3772 1.429352 3.907047 
1 1 1   15    4   55 o   42.371   3.0421   73.918   10.437   55.036   18.071   83.369   12.785   35.834   6.4226   44.940   3.5181 -9.105896 7.323032 
1 1 1   15    4   56 o   26.721   4.6999   30.309   9.8635   35.879   17.363   27.655   11.985   28.684   7.3828   25.300   5.9176 3.383818 9.461689 
1 1 1   15    4   57 o   28.855   4.3949   35.091   10.011   23.309   18.049   40.328   12.032   23.932   7.9354   30.855   4.9512 -6.923351 9.353388 
1 1 1   15    4   58 f   41.600   3.1784   71.402   10.696   51.710   18.690   80.992   13.044   34.524   6.8831   44.240   3.6494 -9.715622 7.790690 
1 1 1   15    4   59 o   12.544   5.2688   1.0824   9.1159 -17.2565   16.068   9.7861   11.070   12.673   5.9769   16.876   6.1722 -4.203489 8.591778 
1 1 1   15    4   60 o   70.714   2.1439  204.676   12.344  180.633   20.682  217.979   15.384   66.105   3.8549   72.907   2.5928 -6.801659 4.645740 
1 1 1   15    4   61 o   74.368   2.1033  226.364   12.738  242.040   21.997  218.455   15.624   76.614   3.5318   72.969   2.6310 3.644470 4.404047 
1 1 1   15    4   62 o   36.887   3.2242   56.341   9.5971   56.634   16.999   56.204   11.628   36.325   5.9463   36.699   3.9490 -0.3734169 7.138143 
1 1 1   15    4   63 o   61.005   2.2270  152.540   11.056  149.922   19.250  153.828   13.505   60.118   3.9500   61.180   2.7148 -1.061440 4.793018 
1 1 1   15    4   64 o  145.255   1.8659  862.727   22.094  855.594   36.141  866.983   27.917  144.253   3.0735  145.473   2.3543 -1.219711 3.871589 
1 1 1   15    4   65 o   80.909   2.0325  268.074   13.394  264.972   24.446  269.405   16.011   79.983   3.7601   81.028   2.4268 -1.045319 4.475245 
1 1 1   15    4   66 o   52.982   2.6423  115.540   11.376  123.534   20.130  111.789   13.789   54.266   4.5937   51.977   3.2710 2.289555 5.639318 
1 1 1   15    4   67 o  101.018   2.0955  417.986   17.255  410.203   28.364  422.560   21.742   99.572   3.4999  101.390   2.6329 -1.817482 4.379682 
1 1 1   15    4   68 o   26.199   4.4674   29.395   9.1986   16.264   16.095   35.765   11.210   20.643   7.4581   28.823   4.9493 -8.179756 8.950931 
1 1 1   15    4   69 o   9.4746   4.3748  -6.0137   7.8992   1.9195   15.143  -8.9793   9.2587   15.869   6.7342   9.8076   4.5977 6.061614 8.154036 
1 1 1   15    4   70 o   30.888   3.4953   40.020   8.6462   55.077   16.868   34.654   10.070   35.446   6.0552   28.447   4.4914 6.999182 7.539074 
1 1 1   15    4   71 o   74.328   2.0125  226.679   12.182  209.985   21.108  235.016   14.917   70.989   3.6600   75.570   2.4247 -4.580582 4.390334 
1 1 1   15    4   72 o   45.718   2.5807   86.351   9.5783   80.947   17.455   88.680   11.457   43.453   5.0201   46.207   3.0591 -2.754353 5.878766 
1 1 1   15    4   73 o   72.792   2.2443  218.002   13.301  229.574   32.114  215.606   14.613   73.081   5.4295   72.315   2.4827 0.7658157 5.970217 
1 1 1   15    4   74 o   12.597   5.0397   3.7298   7.8400  -6.7366   13.848   8.6673   9.5111   13.052   5.9383   15.513   5.7132 -2.461021 8.240446 
1 1 1   15    4   75 o   39.830   2.7656   65.903   8.9234   67.821   15.067   64.867   11.075   39.703   4.7497   39.296   3.4937 0.4072380 5.896285 
1 1 1   15    4   76 o   39.093   2.7638   63.537   8.7505   55.117   14.604   68.254   10.930   35.517   5.1982   40.342   3.3540 -4.825611 6.186328 
1 1 1   15    4   77 f   29.610   3.5547   37.163   8.4085   38.630   14.211   36.372   10.430   29.179   6.1680   28.938   4.5735 0.2410755 7.678596 
1 1 1   15    4   78 o   10.871   4.6613   0.2024   7.3899  -6.5989   10.849   6.0899   10.094   11.264   5.1741   14.582   5.7557 -3.318316 7.739493 
1 1 1   15    4   79 o   15.065   5.0206   9.4546   7.2226   11.276   10.810   7.9858   9.7076   16.907   6.1115   15.158   5.7337 1.749291 8.380100 
1 1 1   15    4   80 o   40.897   3.2961   70.405   10.895   63.352   11.903  106.830   27.051   38.564   3.8375   47.955   7.1373 -9.391476 8.103510 
1 1 1   15    4   81 o   11.627   5.1478  -1.9180   9.6514  -5.7569   10.586   16.984   23.491   11.235   5.1422   21.587   8.6935 -10.35189 10.10052 
1 1 1   15    4   82 o   13.902   5.5363   5.3752   9.4175   0.7597   12.728   10.959   13.999   14.005   6.0619   17.574   6.8247 -3.569807 9.128137 
1 1 1   15    4   83 o   16.682   4.7417   12.393   6.7513   8.7525   13.074   13.717   7.8839   16.518   6.5409   17.504   5.1689 -0.9860611 8.336685 
1 1 1   15    4   84 o   37.291   2.5306   57.970   7.6470   65.516   14.426   55.021   9.0183   38.675   4.6704   36.128   3.0919 2.546120 5.601128 
1 1 1   15    4   85 o   24.958   3.2883   26.614   6.5272   11.055   11.105   34.827   8.0681   16.691   6.1688   28.503   3.5492 -11.81222 7.116898 
1 1 1   15    4   86 o   67.196   1.7071  185.847   9.3432  159.767   16.170  198.917   11.448   61.520   3.2358   69.382   2.0263 -7.862316 3.817908 
1 1 1   15    4   87 o   26.073   3.2172   29.044   6.6927   15.729   12.282   34.669   7.9820   18.732   6.5401   28.394   3.5242 -9.662739 7.429170 
1 1 1   15    4   88 o   33.802   2.3539   47.701   6.4454   54.249   11.555   44.743   7.7659   35.253   4.0972   32.507   2.9632 2.745670 5.056448 
1 1 1   15    4   89 o   62.051   1.6145  158.579   8.1592  164.420   13.899  155.508   10.079   62.584   2.7310   61.267   2.0209 1.317608 3.397355 
1 1 1   15    4   90 o   42.824   1.9381   76.023   6.7478   68.315   12.088   79.512   8.1329   39.664   3.7845   43.652   2.2937 -3.987827 4.425328 
1 1 1   15    4   91 o   25.097   3.4078   27.362   6.7917   22.144   11.110   30.476   8.5820   21.284   6.0935   26.134   4.1685 -4.849382 7.382909 
1 1 1   15    4   92 o   43.871   2.1559   80.304   7.6864   68.166   11.982   88.791   10.020   39.482   3.7686   45.845   2.6931 -6.362495 4.631985 
1 1 1   15    4   93 o   43.186   2.1293   77.863   7.4725   79.581   11.968   76.766   9.5664   42.847   3.4559   42.530   2.7745 0.3161850 4.431887 
1 1 1   15    4   94 o   26.620   4.3078   32.184   9.0285   21.126   11.879   47.307   13.892   20.383   6.4114   31.331   5.6472 -10.94725 8.543814 
1 1 1   15    4   95 o   45.982   2.7416   89.963   10.229   75.139   13.773  108.199   15.276   40.880   4.1927   49.494   3.8159 -8.614231 5.669137 
1 1 1   15    4   96 o   26.770   4.2703   32.818   9.0055   35.672   12.279   29.496   13.247   26.757   5.7976   23.574   6.6221 3.182409 8.801339 
1 1 1   15    4   97 o   28.151   4.3280   36.529   9.6140   32.504   12.263   42.951   15.488   25.163   6.0526   28.286   6.8011 -3.123613 9.104375 
1 1 1   15    4   98 o   8.6480   4.1691 -10.7504   8.7653 -12.9708   11.081  -7.0378   14.328   9.6645   4.6662   12.184   5.7142 -2.519309 7.377359 
1 1 1   15    4   99 o   11.549   5.0588   1.0378   9.0893  -8.9339   11.513   17.538   14.809   10.526   4.9927   18.247   7.0373 -7.720416 8.628499 
1 1 1   15    4  100 o   36.307   3.5297   58.611   10.315   57.346   13.101   60.674   16.730   34.805   4.7408   34.198   6.2311 0.6067085 7.829569 
1 1 1   15    4  101 o   9.2177   4.4107  -9.5084   9.4014  -9.8553   11.948  -8.9446   15.234   10.544   5.0252   12.130   5.7503 -1.585852 7.636632 
1 1 1   15    4  102 o   23.925   5.2861   28.640   10.034   41.580   12.969   9.3411   15.838   28.474   5.7851   15.812   6.8024 12.66227 8.929775 
1 1 1   15    4  103 o   26.296   5.6640   35.477   11.782   35.249   16.924   35.692   16.413   23.828   7.6707   24.192   7.5253 -0.3644962 10.74569 
1 1 1   15    4  104 o   12.352   5.5345   0.5950   11.502   0.0023   16.713   1.1285   15.855   13.977   6.4209   13.940   6.3468 0.3705883E-01 9.028295 
1 1 1   15    4  105 o   26.513   5.9035   36.942   12.431   56.683   17.958   18.783   17.224   31.380   7.1769   18.207   7.4036 13.17304 10.31124 
1 1 1   15    4  106 o   15.470   6.4029   10.609   13.177   1.5933   16.834   24.871   21.173   14.191   6.4913   19.561   8.1082 -5.369763 10.38652 
1 1 1   15    4  107 f   26.863   6.5756   40.417   14.281   30.816   18.483   54.639   22.495   21.453   7.9530   27.606   8.8394 -6.152975 11.89056 
1 1 1   15    4  108 o   16.099   6.5070   12.940   13.213   3.9934   16.911   26.962   21.171   14.562   6.6005   19.870   8.1591 -5.308287 10.49465 
1 1 1   15    4  109 o   16.035   6.5003   12.911   13.230   8.2971   17.024   19.945   21.020   15.386   6.8233   18.189   7.8312 -2.803805 10.38676 
1 1 1   15    4  110 o   13.944   6.3464   2.5699   15.833   18.519   23.337 -11.0349   21.553   17.903   7.9614   13.466   6.5033 4.436705 10.27995 
1 1 1   15    4  111 o   14.385   6.4772   4.6198   15.974   8.1378   24.013   1.8272   21.395   16.324   7.5689   15.034   7.0288 1.289534 10.32922 
1 1 1   15    5 -109 o   16.790   7.9125   8.5087   28.059   8.5087   28.059   0.0000   0.0000   16.790   7.9125  ?   ?  0.000000 7.912498 
1 1 1   15    5 -108 o   14.413   6.6675   1.8976   18.470   1.8976   18.470   0.0000   0.0000   14.413   6.6675  ?   ?  0.000000 6.667486 
1 1 1   15    5 -107 o   15.722   6.6312   11.647   14.535   12.444   17.854   10.079   25.033   16.289   7.1135   16.636   7.7186 -0.3463345 10.49660 
1 1 1   15    5 -106 o   20.850   7.3101   27.479   15.354   32.676   19.291   18.497   25.360   21.571   8.0994   18.001   8.1283 3.570518 11.47473 
1 1 1   15    5 -105 o   18.265   7.6214   20.038   18.886   20.038   18.886   0.0000   0.0000   18.265   7.6214  ?   ?  0.000000 7.621394 
1 1 1   15    5 -104 o   11.318   5.4444 -11.8241   14.753 -11.1269   18.737 -12.9618   23.934   12.786   6.1466   13.953   6.7658 -1.167027 9.140961 
1 1 1   15    5 -103 o   11.903   5.6503  -8.0903   14.804 -24.7472   18.023   26.450   25.953   11.122   5.4902   19.654   8.5798 -8.532160 10.18603 
1 1 1   15    5 -102 o   21.028   6.8470   25.806   13.461   14.978   18.845   37.087   19.234   17.306   7.4324   23.435   8.1844 -6.129189 11.05556 
1 1 1   15    5 -101 o   11.887   5.5146  -3.8824   12.772  -5.0754   17.506  -2.5247   18.675   13.358   6.2812   14.078   6.5771 -0.7200842 9.094548 
1 1 1   15    5 -100 o   26.027   6.2735   36.541   13.153   51.718   18.418   20.745   18.789   29.339   7.6303   18.830   7.7040 10.50884 10.84314 
1 1 1   15    5  -99 o   14.291   6.1111   6.3632   12.640   2.6565   17.005   10.939   18.893   14.614   6.6220   16.649   7.2931 -2.035207 9.850873 
1 1 1   15    5  -98 o   18.916   6.7285   19.724   13.045   6.5995   17.708   35.301   19.291   15.631   6.9440   23.324   8.1926 -7.692838 10.73957 
1 1 1   15    5  -97 o   31.399   5.4129   48.760   13.354   27.086   17.811   76.587   20.181   21.072   7.8080   37.668   6.8239 -16.59558 10.36965 
1 1 1   15    5  -96 o   18.364   6.6485   17.963   12.799   7.0888   17.843   29.487   18.369   15.883   7.0175   21.846   7.9568 -5.963268 10.60923 
1 1 1   15    5  -95 o   11.809   5.4769  -4.8632   12.584   17.175   17.640 -27.7003   17.956   18.341   7.4795   11.070   5.4677 7.270397 9.264940 
1 1 1   15    5  -94 o   17.155   6.5275   14.352   12.626   7.1752   17.753   21.699   17.961   16.058   7.0508   19.748   7.7128 -3.689987 10.44991 
1 1 1   15    5  -93 o   11.032   5.1901  -7.9985   11.981 -14.0561   16.576  -1.3712   17.338   12.154   5.8265   14.395   6.5857 -2.241401 8.793140 
1 1 1   15    5  -92 o   33.819   4.9129   53.461   13.148   62.258   18.673   44.813   18.515   34.563   6.8699   28.121   7.8030 6.441925 10.39624 
1 1 1   15    5  -91 o   26.717   5.8510   35.161   12.389   43.121   17.415   27.005   17.628   28.130   7.4701   22.058   7.8242 6.071789 10.81757 
1 1 1   15    5  -90 o   28.533   5.2793   38.517   11.827   31.741   16.709   45.319   16.742   24.076   7.6080   29.445   7.0657 -5.368084 10.38296 
1 1 1   15    5  -89 o   14.245   5.7525   6.5332   10.317   3.6415   13.851   10.137   15.462   14.652   6.3327   16.877   6.9557 -2.224805 9.406671 
1 1 1   15    5  -88 o   22.381   5.5695   24.011   10.120   19.178   13.605   29.998   15.142   19.768   6.8847   24.028   7.1804 -4.259836 9.947709 
1 1 1   15    5  -87 o   27.123   4.9305   33.722   10.499   11.613   13.740   64.755   16.278   17.152   6.7319   37.327   5.5158 -20.17476 8.703027 
1 1 1   15    5  -86 o   18.001   5.0383   14.988   7.6833   23.732   12.782   10.040   9.6143   21.967   6.6046   15.628   5.7461 6.338763 8.754328 
1 1 1   15    5  -85 o   20.631   4.7375   19.420   7.7986   32.005   12.882   12.140   9.7980   25.814   6.2002   16.677   5.8402 9.137478 8.517612 
1 1 1   15    5  -84 o   17.704   5.2384   14.334   8.0908   2.3110   14.463   19.811   9.7610   14.939   6.4640   20.574   5.6488 -5.635799 8.584449 
1 1 1   15    5  -83 o   43.061   3.0591   78.240   10.668   96.481   27.035   74.876   11.610   44.149   7.7973   41.940   3.4257 2.208649 8.516656 
1 1 1   15    5  -82 o   39.331   2.9444   65.088   9.3715   43.355   16.971   74.623   11.241   29.867   7.0794   41.958   3.3135 -12.09060 7.816463 
1 1 1   15    5  -81 o   32.481   3.4285   44.941   8.9408   67.416   16.721   35.943   10.580   38.717   5.4488   28.459   4.7266 10.25862 7.213147 
1 1 1   15    5  -80 o   24.261   4.1897   25.798   7.9862   31.829   13.376   22.457   9.9555   26.015   6.3614   22.114   5.5360 3.900171 8.432927 
1 1 1   15    5  -79 o   23.194   4.6847   23.963   8.5518   30.631   12.815   18.610   11.483   25.624   6.2026   20.150   6.2984 5.473883 8.839798 
1 1 1   15    5  -78 o   37.819   2.8878   59.918   8.8352   45.457   13.769   70.038   11.519   31.773   5.5164   40.651   3.5106 -8.878223 6.538763 
1 1 1   15    5  -77 o   34.525   3.2631   50.316   9.0744   52.379   13.655   48.685   12.144   34.467   5.0064   33.413   4.5790 1.053944 6.784635 
1 1 1   15    5  -76 o   26.352   4.1515   30.115   8.6229   23.556   13.008   35.257   11.517   22.534   6.6355   28.115   5.2174 -5.580786 8.441029 
1 1 1   15    5  -75 o   28.227   3.8473   34.145   8.6220   26.398   12.731   40.708   11.718   23.893   6.4061   30.444   4.8872 -6.551392 8.057507 
1 1 1   15    5  -74 o   24.702   3.5337   26.031   6.9131   20.414   9.1390   33.544   10.569   21.324   5.2847   27.618   4.8729 -6.294138 7.188387 
1 1 1   15    5  -73 o   47.770   2.6589   94.676   10.313  104.181   14.784   85.667   14.392   49.730   3.6730   44.946   3.9690 4.783276 5.407806 
1 1 1   15    5  -72 o   22.046   4.2019   21.127   7.2757   11.454   9.1236   38.024   12.058   16.649   5.6435   29.375   5.2275 -12.72581 7.692600 
1 1 1   15    5  -71 o   36.401   2.7038   55.052   7.9653   65.796   10.280   38.911   12.600   39.666   3.2067   29.682   5.4070 9.983860 6.286356 
1 1 1   15    5  -70 o   32.533   2.9924   44.192   7.8467   40.693   10.163   49.354   12.347   30.869   4.1435   33.883   4.5880 -3.013361 6.182097 
1 1 1   15    5  -69 o   33.586   2.6843   46.830   7.2879   51.615   10.129   41.693   10.494   35.027   3.5988   31.251   4.2277 3.775806 5.552055 
1 1 1   15    5  -68 o   15.369   4.8404   9.9365   6.7690   10.704   9.3732   9.1005   9.7859   16.449   5.7153   15.848   5.8021 0.6008749 8.144240 
1 1 1   15    5  -67 o   37.884   2.4782   59.286   7.6109   69.319   10.611   48.655   10.923   40.800   3.2165   33.915   4.0296 6.884911 5.155880 
1 1 1   15    5  -66 o   30.645   2.9787   39.111   7.3471   36.230   9.9605   42.549   10.881   29.139   4.3244   31.619   4.3357 -2.480499 6.123668 
1 1 1   15    5  -65 o   18.159   4.6603   14.351   6.9324   19.262   9.5493   8.8787   10.080   20.935   5.5186   15.931   5.8791 5.003839 8.063417 
1 1 1   15    5  -64 o   14.069   4.6004   8.0181   6.0736   7.5746   9.4258   8.3329   7.9422   15.128   5.6654   14.891   5.2546 0.2371035 7.727074 
1 1 1   15    5  -63 o   71.732   1.6178  210.369   9.4598  208.264   15.047  211.745   12.165   71.152   2.5987   71.864   2.0788 -0.7122116 3.327820 
1 1 1   15    5  -62 o   32.126   2.6473   42.673   6.8710   45.192   10.939   41.033   8.8304   32.728   4.1968   31.325   3.5190 1.402542 5.476931 
1 1 1   15    5  -61 o   56.415   1.8248  130.304   8.3807  134.883   13.379  127.346   10.752   57.209   2.8782   55.683   2.3742 1.525642 3.731044 
1 1 1   15    5  -60 o   33.560   2.6231   46.491   7.1188   51.964   11.264   42.851   9.1859   35.216   3.9943   32.032   3.5792 3.184311 5.363274 
1 1 1   15    5  -59 o  112.832   1.5361  520.018   14.128  508.716   19.712  531.957   20.260  111.478   2.1692  113.994   2.1803 -2.515526 3.075608 
1 1 1   15    5  -58 o   93.821   1.4915  359.458   11.407  367.145   16.931  353.070   15.435   94.713   2.1930   92.906   2.0382 1.806671 2.993898 
1 1 1   15    5  -57 o   86.757   1.5330  307.365   10.841  315.248   16.241  301.029   14.560   87.732   2.2729   85.788   2.0821 1.943802 3.082396 
1 1 1   15    5  -56 o   28.321   3.2283   33.372   7.3198   39.714   11.121   28.525   9.7228   30.642   4.5937   25.830   4.7941 4.811642 6.639738 
1 1 1   15    5  -55 o   55.668   2.0584  126.873   9.3244  134.941   13.690  119.892   12.735   57.282   2.9417   53.991   2.9044 3.291027 4.133903 
1 1 1   15    5  -54 o   98.156   1.5793  393.375   12.636  371.063   18.487  412.938   17.311   95.195   2.3843  100.497   2.1131 -5.302025 3.185918 
1 1 1   15    5  -53 o   85.427   1.8345  298.110   12.775  297.114   22.952  298.556   15.377   85.004   3.3188   85.419   2.2102 -0.4155350 3.987411 
1 1 1   15    5  -52 o   56.372   2.2922  130.161   10.511  125.524   19.498  132.061   12.480   54.993   4.3859   56.727   2.7066 -1.734028 5.153804 
1 1 1   15    5  -51 o   73.858   1.9182  222.974   11.539  215.823   20.552  226.266   13.944   72.421   3.4916   74.355   2.3034 -1.933220 4.182954 
1 1 1   15    5  -50 o   76.577   1.7032  239.400   10.632  243.675   16.257  236.206   14.054   77.131   2.5893   75.982   2.2716 1.149048 3.444537 
1 1 1   15    5  -49 o   52.828   2.0397  114.173   8.7668  120.876   13.510  109.298   11.522   54.233   3.0685   51.606   2.7490 2.627636 4.119763 
1 1 1   15    5  -48 o   47.385   2.1724   91.931   8.3688   90.387   12.965   93.034   10.957   46.826   3.4204   47.593   2.8372 -0.7666969 4.443919 
1 1 1   15    5  -47 o   37.330   2.6260   57.273   7.9399   48.565   12.481   63.194   10.291   34.037   4.6173   39.139   3.2550 -5.102268 5.649293 
1 1 1   15    5  -46 o   74.047   1.6819  223.778   10.152  226.694   15.569  221.622   13.389   74.416   2.5705   73.617   2.2338 0.7985764 3.405480 
1 1 1   15    5  -45 o   42.637   2.3827   74.521   8.2484   83.471   12.923   68.368   10.715   44.985   3.5531   40.728   3.2544 4.256714 4.818263 
1 1 1   15    5  -44 o  101.101   1.6166  417.086   13.323  396.969   21.452  429.717   16.998   98.496   2.6744  102.585   2.0328 -4.089073 3.359214 
1 1 1   15    5  -43 o   73.613   2.1376  221.484   12.813  223.032   17.552  219.717   18.748   73.780   2.9242   73.198   3.1495 0.5820236 4.297709 
1 1 1   15    5  -42 o   94.673   1.8724  365.843   14.450  361.625   23.997  368.243   18.099   93.949   3.1379   94.944   2.3386 -0.9946060 3.913461 
1 1 1   15    5  -41 o  101.157   1.8516  417.639   15.268  406.915   25.339  423.752   19.131   99.673   3.1225  101.855   2.3042 -2.182190 3.880641 
1 1 1   15    5  -40 o   23.395   5.0207   23.379   9.2879 -17.7537   16.279   43.231   11.309   12.785   6.0256   32.147   4.4337 -19.36244 7.480966 
1 1 1   15    5  -39 o   65.728   2.2980  176.653   12.293  176.667   19.686  176.644   15.740   65.561   3.6986   65.657   2.9484 -0.9602356E-01 4.729986 
1 1 1   15    5  -38 o   75.874   2.5329  235.464   15.644  264.874   22.064  205.733   22.184   80.372   3.3753   70.745   3.8615 9.627472 5.128746 
1 1 1   15    5  -37 o  103.927   2.0640  440.901   17.485  416.018   22.389  479.805   27.996  100.857   2.7258  108.254   3.1760 -7.397026 4.185385 
1 1 1   15    5  -36 o  105.039   2.0553  450.362   17.598  431.651   22.674  478.709   27.909  102.742   2.7097  108.138   3.1695 -5.395256 4.169922 
1 1 1   15    5  -35 o   52.450   3.5132  113.095   14.934  151.761   23.459   86.747   19.365   60.599   4.7879   45.617   5.3067 14.98204 7.147378 
1 1 1   15    5  -34 o  119.932   1.9826  587.005   19.383  583.967   34.252  588.436   23.509  119.402   3.5230  120.041   2.4025 -0.6393890 4.264245 
1 1 1   15    5  -33 o   78.584   1.9527  252.006   12.508  242.604   19.201  258.936   16.486   76.975   3.0663   79.583   2.5446 -2.608292 3.984642 
1 1 1   15    5  -32 o   79.866   1.7582  260.229   11.446  255.420   19.247  262.861   14.238   78.996   2.9944   80.219   2.1794 -1.222992 3.703557 
1 1 1   15    5  -31 o  106.862   1.6314  465.809   14.210  468.650   23.543  464.181   17.823  107.077   2.6995  106.650   2.0502 0.4276581 3.389749 
1 1 1   15    5  -30 o   66.776   1.9347  182.094   10.520  185.252   18.262  180.527   12.870   67.223   3.3432   66.454   2.3797 0.7693024 4.103611 
1 1 1   15    5  -29 f   84.307   1.7326  289.943   11.907  288.786   20.147  290.564   14.761   84.017   2.9463   84.350   2.1486 -0.3326645 3.646501 
1 1 1   15    5  -28 o  161.401   1.6447  1062.57   21.638  1071.70   34.941  1056.89   27.559  161.992   2.6461  160.929   2.1008 1.063095 3.378657 
1 1 1   15    5  -27 o   83.781   1.7525  286.335   11.968  295.944   20.689  281.502   14.673   85.052   2.9888   83.023   2.1699 2.028969 3.693461 
1 1 1   15    5  -26 o   62.873   2.0096  161.462   10.286  161.231   17.944  161.575   12.553   62.690   3.5257   62.862   2.4545 -0.1728783 4.295974 
1 1 1   15    5  -25 o   90.634   1.7146  335.071   12.667  310.239   21.248  348.763   15.778   87.089   2.9976   92.449   2.0937 -5.360695 3.656374 
1 1 1   15    5  -24 o   88.106   1.8292  316.669   13.137  349.086   25.099  304.437   15.418   92.351   3.3395   86.344   2.1923 6.007698 3.994823 
1 1 1   15    5  -23 o  221.720   1.9699  2005.64   35.602  1940.21   61.991  2037.84   43.490  217.840   3.4910  223.440   2.3878 -5.600250 4.229492 
1 1 1   15    5  -22 o  130.537   1.6093  694.961   17.124  670.487   26.821  711.801   22.249  128.153   2.5675  132.081   2.0664 -3.928085 3.295754 
1 1 1   15    5  -21 o  121.412   1.6065  601.181   15.900  584.899   25.113  612.074   20.541  119.696   2.5739  122.481   2.0573 -2.785385 3.295060 
1 1 1   15    5  -20 o  130.685   1.5341  696.478   16.342  710.915   24.409  684.749   22.001  131.988   2.2687  129.549   2.0834 2.439041 3.080155 
1 1 1   15    5  -19 o   80.581   1.7176  264.840   11.282  265.079   17.290  264.663   14.889   80.536   2.6373   80.501   2.2713 0.3488922E-01 3.480494 
1 1 1   15    5  -18 o   97.636   1.7407  388.813   13.854  386.700   19.750  390.859   19.438   97.303   2.4921   97.860   2.4367 -0.5569077 3.485415 
1 1 1   15    5  -17 o  104.542   1.7153  445.746   14.617  422.703   24.571  458.367   18.185  101.692   2.9673  105.994   2.1047 -4.301567 3.637990 
1 1 1   15    5  -16 o  167.089   1.6973  1138.64   23.117  1130.09   37.121  1144.06   29.545  166.373   2.7372  167.452   2.1645 -1.078583 3.489608 
1 1 1   15    5  -15 o  195.977   1.7769  1566.48   28.385  1615.32   46.037  1536.52   36.055  198.900   2.8394  194.050   2.2794 4.849762 3.641141 
1 1 1   15    5  -14 f   63.927   1.9889  166.868   10.351  172.408   16.275  163.105   13.414   64.898   3.0854   63.159   2.6112 1.739315 4.042019 
1 1 1   15    5  -13 o  144.132   1.5653  847.150   18.391  833.652   26.961  858.897   25.151  142.934   2.3140  145.095   2.1265 -2.161301 3.142713 
1 1 1   15    5  -12 o  123.457   1.5792  621.541   15.892  633.923   23.749  611.499   21.386  124.640   2.3375  122.427   2.1430 2.212746 3.171140 
1 1 1   15    5  -11 o   67.485   2.2886  186.043   12.571  213.562   17.163  154.192   18.465   72.262   2.9198   61.305   3.7124 10.95632 4.723037 
1 1 1   15    5  -10 o   83.423   2.0603  283.905   14.011  298.431   22.415  274.592   17.949   85.414   3.2252   81.974   2.6897 3.440704 4.199615 
1 1 1   15    5   -9 o   85.396   2.0495  297.484   14.267  290.227   22.533  302.339   18.432   84.225   3.2884   86.025   2.6316 -1.799850 4.211724 
1 1 1   15    5   -8 o  241.057   2.1171  2370.58   41.600  2382.08   60.716  2360.40   57.113  241.513   3.0841  240.438   2.9140 1.075623 4.243002 
1 1 1   15    5   -7 o  149.951   1.9706  917.186   24.087  1007.45   41.826  872.394   29.464  157.046   3.2672  146.210   2.4722 10.83563 4.097117 
1 1 1   15    5   -6 o   81.084   2.1315  268.400   14.076  283.308   22.930  259.386   17.831   83.206   3.3879   79.666   2.7499 3.539917 4.363441 
1 1 1   15    5   -5 o  151.879   1.8648  940.834   23.087  859.535   33.915  1011.03   31.516  145.098   2.8675  157.402   2.4563 -12.30417 3.775695 
1 1 1   15    5   -4 o   10.473   4.8323  -7.7228   9.6139 -34.7999   14.662   12.700   12.733   9.8003   4.8583   18.824   6.6524 -9.024139 8.237579 
1 1 1   15    5   -3 o   8.0533   3.9810 -21.7993   9.5918 -42.9952   14.841  -6.5959   12.570   9.1727   4.5995   12.709   5.7322 -3.536573 7.349377 
1 1 1   15    5   -2 o   97.384   2.0471  386.864   16.250  414.555   27.147  371.402   20.286  100.685   3.3122   95.357   2.6123 5.328201 4.218369 
1 1 1   15    5   -1 o  280.520   2.1594  3210.34   49.379  3193.11   66.106  3232.09   74.268  279.659   2.8999  281.300   3.2389 -1.641663 4.347363 
1 1 1   15    5    0 o  188.416   1.8144  1447.90   27.867  1472.93   38.211  1419.45   40.728  189.984   2.4674  186.482   2.6793 3.501770 3.642340 
1 1 1   15    5    1 o   81.834   2.0880  273.366   13.917  288.283   20.191  259.865   19.209   83.975   2.9543   79.723   2.9610 4.252182 4.182695 
1 1 1   15    5    2 o  102.290   2.1053  426.846   17.554  436.688   22.212  410.471   28.650  103.403   2.6373  100.166   3.5143 3.236229 4.393870 
1 1 1   15    5    3 o   51.872   2.9154  110.205   12.278  107.595   17.256  112.881   17.473   51.120   4.1775   52.375   4.1260 -1.254982 5.871545 
1 1 1   15    5    4 o  184.629   1.8159  1390.27   27.329  1402.31   37.270  1376.27   40.194  185.373   2.4665  183.623   2.6853 1.750443 3.646186 
1 1 1   15    5    5 o   50.339   2.9160  103.806   11.914  109.448   17.121   98.510   16.590   51.569   4.1068   48.895   4.2030 2.673813 5.876346 
1 1 1   15    5    6 o  186.871   1.6779  1424.11   25.560  1429.88   37.646  1419.18   34.813  187.186   2.4673  186.500   2.2899 0.6854248 3.366183 
1 1 1   15    5    7 o  208.930   1.9852  1780.60   33.809  1739.16   48.753  1818.98   46.926  206.389   2.8979  211.093   2.7271 -4.704025 3.979284 
1 1 1   15    5    8 o   72.353   2.0155  213.711   11.876  208.693   18.676  217.117   15.387   71.407   3.2167   72.889   2.5939 -1.481987 4.132268 
1 1 1   15    5    9 o  132.144   1.6208  712.101   17.459  709.590   26.192  714.109   23.422  131.864   2.4367  132.301   2.1718 -0.4363556 3.264082 
1 1 1   15    5   10 o  136.037   1.6228  754.679   17.995  744.291   26.691  763.335   24.365  135.051   2.4246  136.783   2.1852 -1.732925 3.264004 
1 1 1   15    5   11 o  115.328   1.6588  542.414   15.595  538.985   23.649  545.053   20.743  114.918   2.5246  115.582   2.2017 -0.6639938 3.349781 
1 1 1   15    5   12 o   27.394   4.7098   31.595   10.138   27.835   18.618   33.179   12.088   25.963   8.0046   27.963   5.4991 -1.999620 9.711484 
1 1 1   15    5   13 o  116.217   1.6392  550.805   15.528  531.456   23.127  566.691   20.954  114.113   2.4862  117.854   2.1812 -3.740463 3.307418 
1 1 1   15    5   14 f   50.809   2.5012  105.620   10.328   82.381   16.008  122.188   13.517   44.641   4.4587   54.613   3.0484 -9.971729 5.401167 
1 1 1   15    5   15 o  131.037   1.6900  700.279   18.051  687.263   28.662  708.835   23.239  129.748   2.7100  131.808   2.1629 -2.059982 3.467335 
1 1 1   15    5   16 o   97.544   1.7954  388.084   14.276  374.627   23.060  396.445   18.177   95.732   2.9587   98.568   2.2623 -2.835533 3.724485 
1 1 1   15    5   17 o  163.387   1.8113  1088.85   24.124  1072.97   41.839  1096.76   29.526  162.064   3.1670  163.948   2.2094 -1.884232 3.861538 
1 1 1   15    5   18 o  158.633   1.9446  1026.55   25.145  1003.02   39.650  1042.39   32.522  156.697   3.1041  159.806   2.4966 -3.109192 3.983577 
1 1 1   15    5   19 o  171.584   1.9752  1201.06   27.626  1219.88   44.327  1189.11   35.326  172.798   3.1470  170.676   2.5392 2.122452 4.043612 
1 1 1   15    5   20 o   82.235   2.2761  276.186   15.243  272.039   22.373  279.779   20.823   81.516   3.3743   82.698   3.0944 -1.182335 4.578365 
1 1 1   15    5   21 o   71.863   2.4029  211.017   14.056  220.045   21.185  203.918   18.786   73.277   3.5573   70.564   3.2750 2.712563 4.835297 
1 1 1   15    5   22 o  112.413   1.9128  515.518   17.528  548.767   28.637  495.599   22.165  115.861   3.0348  110.186   2.4677 5.674629 3.911463 
1 1 1   15    5   23 o   93.645   2.5374  358.271   19.351  380.851   34.510  347.915   23.371   96.325   4.4068   92.224   3.1133 4.100990 5.395630 
1 1 1   15    5   24 o  137.521   2.0929  771.696   23.462  826.274   49.722  756.064   26.610  141.973   4.3014  136.096   2.3987 5.876266 4.924995 
1 1 1   15    5   25 o  107.237   2.1185  469.272   18.518  478.893   38.901  466.453   21.057  108.020   4.4273  106.895   2.4166 1.125603 5.043903 
1 1 1   15    5   26 o  157.300   2.1238  1009.74   27.232  1050.76   56.822  997.511   31.027  160.083   4.3585  156.314   2.4350 3.769302 4.992629 
1 1 1   15    5   27 o  197.752   2.0563  1595.76   33.146  1613.71   53.510  1584.58   42.222  198.672   3.3042  196.983   2.6295 1.689423 4.222764 
1 1 1   15    5   28 o   48.994   3.0963   98.496   12.303   82.303   26.535  102.930   13.886   43.955   7.6853   50.053   3.4239 -6.097710 8.413519 
1 1 1   15    5   29 f  159.930   1.9332  1043.63   25.202  1024.65   40.320  1055.80   32.286  158.330   3.1241  160.805   2.4631 -2.475540 3.978278 
1 1 1   15    5   30 o  145.541   1.9050  864.275   22.601  881.716   36.987  853.884   28.551  146.872   3.0894  144.615   2.4220 2.256973 3.925585 
1 1 1   15    5   31 o  181.756   1.9989  1348.08   29.615  1388.81   48.368  1323.66   37.456  184.300   3.2196  180.032   2.5523 4.268234 4.108533 
1 1 1   15    5   32 o   90.351   2.0240  333.142   14.907  353.697   25.179  322.050   18.496   92.935   3.3291   88.763   2.5590 4.172325 4.198994 
1 1 1   15    5   33 o   61.055   2.4002  152.447   11.922  130.861   20.045  164.262   14.830   56.319   4.4013   63.335   2.8801 -7.015541 5.259880 
1 1 1   15    5   34 o  101.464   1.9361  420.120   16.013  431.154   26.577  413.832   20.063  102.631   3.1807  100.665   2.4450 1.966026 4.011845 
1 1 1   15    5   35 o   15.670   5.7606   8.0641   9.6621   23.648   16.483  -0.0938   11.926   23.980   7.5535   13.950   5.9499 10.02968 9.615447 
1 1 1   15    5   36 o   98.942   1.9555  399.532   15.771  417.033   26.413  389.835   19.661  100.919   3.2148   97.663   2.4717 3.255646 4.055156 
1 1 1   15    5   37 o   89.334   1.9915  325.737   14.502  320.165   24.102  328.899   18.157   88.386   3.3514   89.696   2.4857 -1.309486 4.172603 
1 1 1   15    5   38 o   71.631   2.2086  209.712   12.880  214.854   21.708  206.918   16.002   72.326   3.6943   71.096   2.7664 1.230515 4.615232 
1 1 1   15    5   39 o   99.873   1.9597  407.146   15.954  381.481   26.400  421.911   20.024   96.477   3.3621  101.628   2.4171 -5.151711 4.140817 
1 1 1   15    5   40 o  101.509   2.1577  420.749   17.854  413.715   38.583  422.665   20.140  100.195   4.7375  101.715   2.4291 -1.520027 5.323919 
1 1 1   15    5   41 o   73.078   2.8288  218.691   16.819  193.677   30.767  229.353   20.086   68.285   5.5759   74.777   3.3034 -6.492226 6.481009 
1 1 1   15    5   42 o  132.564   4.4635  723.012   48.163  723.012   48.163   0.0000   0.0000  132.564   4.4635  ?   ?  0.000000 4.463503 
1 1 1   15    5   43 o   97.099   2.6783  385.753   21.179  383.901   25.819  389.561   37.030   96.773   3.2777   97.194   4.6877 -0.4210663 5.719933 
1 1 1   15    5   44 o  122.424   1.8878  611.830   18.839  630.088   31.153  601.303   23.655  124.072   3.0802  121.307   2.3922 2.764839 3.900065 
1 1 1   15    5   45 o   50.369   2.6920  104.047   11.013   99.072   18.891  106.608   13.555   48.812   4.8102   50.912   3.2836 -2.099865 5.824138 
1 1 1   15    5   46 o   21.720   6.0563   20.141   11.124   25.182   16.806   16.209   14.841   24.525   7.6125   20.695   7.1916 3.830515 10.47228 
1 1 1   15    5   47 o   58.932   2.7983  142.424   13.404  156.435   19.774  130.511   18.233   61.586   3.9598   56.222   4.0047 5.364468 5.631881 
1 1 1   15    5   48 o   98.329   2.2529  395.119   18.058  371.666   25.605  418.328   25.471   95.164   3.3057  101.009   3.0972 -5.845627 4.529938 
1 1 1   15    5   49 o   19.692   6.3492   15.770   11.592   25.133   17.181   7.9470   15.705   24.515   7.7104   18.132   7.1723 6.383028 10.53051 
1 1 1   15    5   50 o   34.805   3.7278   50.320   10.412   46.560   18.512   52.059   12.592   32.724   7.1409   35.264   4.4816 -2.539593 8.430686 
1 1 1   15    5   51 o   14.084   5.6575   3.9949   9.9209 -10.0445   17.443   10.708   12.062   14.646   6.6640   17.646   6.4445 -3.000266 9.270417 
1 1 1   15    5   52 o   56.330   2.6281  130.171   12.034  146.685   21.303  122.430   14.584   59.465   4.4266   54.522   3.2970 4.942272 5.519452 
1 1 1   15    5   53 o   56.259   2.6406  129.886   12.076  122.179   20.439  134.018   14.968   54.164   4.6750   57.054   3.2316 -2.890102 5.683222 
1 1 1   15    5   54 o   25.837   5.0337   28.602   10.220   14.359   18.057   35.316   12.397   20.864   7.8355   28.676   5.5038 -7.811954 9.575335 
1 1 1   15    5   55 o  142.412   2.4250  830.227   28.151   0.0000   0.0000  830.227   28.151  ?   ?   142.412   2.4250 0.000000 2.425025 
1 1 1   15    5   56 o   16.151   5.6879   9.6742   9.3025   10.494   16.699   9.3053   11.202   19.175   7.4516   16.702   6.1914 2.472849 9.688120 
1 1 1   15    5   57 o   64.831   2.2264  172.204   11.748  145.741   19.821  186.535   14.586   59.246   4.1301   67.404   2.6600 -8.157719 4.912602 
1 1 1   15    5   58 o   50.742   2.5189  105.773   10.386   97.313   17.522  110.356   12.896   48.240   4.5081   51.734   3.0719 -3.494209 5.455222 
1 1 1   15    5   59 o   67.484   2.1415  186.585   11.765  176.004   20.065  192.128   14.524   65.175   3.7932   68.394   2.6100 -3.218910 4.604418 
1 1 1   15    5   60 o   9.4638   4.4824 -10.6848   9.2169  -4.1428   19.564 -12.5511   10.449   16.636   7.3492   9.9824   4.7410 6.653895 8.745748 
1 1 1   15    5   61 o   39.984   3.3765   66.391   10.902   49.675   20.777   72.742   12.807   33.254   7.8004   41.765   3.8034 -8.511631 8.678237 
1 1 1   15    5   62 o   77.744   2.1911  247.859   13.872  233.058   22.102  257.478   17.818   74.986   3.6267   79.097   2.7678 -4.110603 4.562187 
1 1 1   15    5   63 o   59.299   2.5622  144.700   12.356   82.033   20.951  178.118   15.299   43.561   6.0644   65.728   2.8624 -22.16656 6.705996 
1 1 1   15    5   64 o  102.477   1.7794  429.734   14.864  419.928   23.090  436.673   19.424  100.962   2.8084  103.159   2.3099 -2.197418 3.636335 
1 1 1   15    5   65 o   35.359   3.0567   51.968   8.7236   61.346   14.698   46.868   10.839   37.915   4.8678   33.308   4.0772 4.607128 6.349725 
1 1 1   15    5   66 o   58.381   2.1783  140.046   10.348  142.565   17.127  138.597   12.987   58.496   3.6093   57.937   2.7577 0.5594101 4.542284 
1 1 1   15    5   67 o   32.040   3.3489   42.989   8.6173   42.783   14.790   43.094   10.603   31.085   6.0549   31.846   4.1857 -0.7608891 7.360837 
1 1 1   15    5   68 o   60.381   2.1132  149.852   10.385  157.900   16.706  144.782   13.258   61.602   3.3393   59.175   2.7562 2.426643 4.329850 
1 1 1   15    5   69 o   16.029   5.2717   10.653   7.9705   25.521   14.005   3.5300   9.6935   23.743   6.8552   13.549   5.5374 10.19409 8.812247 
1 1 1   15    5   70 o   15.626   5.2866   9.9249   8.0059   11.889   13.777   8.9238   9.8374   18.183   6.8410   15.737   5.8079 2.446316 8.973853 
1 1 1   15    5   71 o   51.557   2.3481  109.710   9.8424   89.487   15.946  122.157   12.510   45.860   4.3164   54.256   2.8384 -8.395706 5.166017 
1 1 1   15    5   72 o   27.759   3.7817   32.845   8.3349   41.419   13.755   27.870   10.478   30.467   5.7491   25.033   5.3001 5.434124 7.819419 
1 1 1   15    5   73 o   38.637   3.1353   62.487   9.7898   57.814   19.788   64.001   11.265   35.338   7.1160   38.949   3.5884 -3.611244 7.969628 
1 1 1   15    5   74 o   19.992   4.9590   17.823   8.0419   18.665   13.079   17.311   10.198   20.507   6.7533   19.660   5.8966 0.8468094 8.965299 
1 1 1   15    5   75 o   18.008   5.4608   14.362   8.7113   6.6805   13.043   20.548   11.705   15.974   6.4619   21.223   6.3060 -5.249321 9.028939 
1 1 1   15    5   76 o   16.656   5.4582   11.917   8.5476   28.919   12.894  -1.4125   11.417   24.975   6.3271   12.811   5.6385 12.16447 8.474963 
1 1 1   15    5   77 o   8.5294   4.0968 -11.2340   8.2825 -12.8454   17.331 -10.7571   9.4290   13.496   6.3150   9.4371   4.4881 4.058985 7.747464 
1 1 1   15    5   78 o   31.045   3.5736   41.100   8.8787   46.083   13.690   37.482   11.664   32.038   5.4363   28.977   5.1258 3.061598 7.471774 
1 1 1   15    5   79 o   27.051   3.9239   31.648   8.4002   38.481   14.065   27.859   10.473   28.803   6.1758   24.778   5.3427 4.024691 8.166133 
1 1 1   15    5   80 o   49.647   2.5148  102.525   10.144   92.412   12.636  120.857   17.013   46.771   3.3364   53.151   3.9552 -6.380180 5.174466 
1 1 1   15    5   81 o   27.183   4.3485   32.459   9.3111   26.370   11.719   42.884   15.334   23.740   6.0416   30.194   6.4275 -6.453983 8.821205 
1 1 1   15    5   82 o   56.133   2.0243  130.232   9.2474  131.094   13.537  129.477   12.662   55.868   2.9833   55.619   2.8019 0.2496605 4.092816 
1 1 1   15    5   83 o   57.828   2.2017  138.648   10.359  136.132   13.757  141.943   15.744   56.903   2.9762   57.873   3.3517 -0.9698219 4.482366 
1 1 1   15    5   84 o   67.987   1.6594  190.187   9.1961  171.560   14.688  202.196   11.794   63.944   2.8249   69.887   2.0725 -5.942688 3.503628 
1 1 1   15    5   85 o   56.475   1.7921  131.656   8.2394  100.531   13.141  151.819   10.577   48.577   3.3389   60.484   2.1487 -11.90717 3.970542 
1 1 1   15    5   86 o   12.912   4.6143   6.6509   6.1418   19.413   10.898   0.7103   7.4351   20.125   6.1088   10.880   4.6706 9.244279 7.689717 
1 1 1   15    5   87 o   30.360   2.6304   38.906   6.4455   46.362   11.490   35.482   7.7859   32.171   4.5048   28.656   3.3992 3.514160 5.643441 
1 1 1   15    5   88 o   42.263   2.0672   74.344   7.0998   74.619   13.804   74.245   8.2788   41.062   4.1825   42.071   2.4243 -1.009464 4.834279 
1 1 1   15    5   89 o   54.650   2.1965  124.686   9.7652  124.340   16.873  124.860   11.974   53.227   3.9163   54.353   2.7112 -1.126144 4.763208 
1 1 1   15    5   90 o   15.638   4.2214   11.225   5.5055   22.580   11.971   8.1785   6.2001   21.097   6.4022   13.677   4.6521 7.420753 7.913947 
1 1 1   15    5   91 o   36.421   3.2692   57.461   9.6028   66.722   12.830   45.661   14.481   38.604   4.1416   30.369   6.0620 8.235115 7.341755 
1 1 1   15    5   92 o   53.826   2.5651  122.627   11.222  127.728   14.304  114.462   18.098   54.340   3.2441   50.155   4.4736 4.185604 5.526019 
1 1 1   15    5   93 o   18.278   5.6867   16.679   9.3723   20.726   11.879   10.006   15.254   19.901   6.4282   16.327   6.8339 3.574274 9.382108 
1 1 1   15    5   94 o   18.622   5.6245   17.484   9.2545   13.767   11.578   24.060   15.400   16.843   6.2848   20.661   7.3146 -3.818735 9.643736 
1 1 1   15    5   95 o   51.517   2.6801  113.444   11.216  101.798   14.042  133.973   18.642   47.885   3.6243   54.141   4.2584 -6.256599 5.591866 
1 1 1   15    5   96 o   24.267   5.1699   28.935   9.9131   32.803   12.626   22.718   16.006   24.913   6.2334   19.904   7.3967 5.008347 9.672996 
1 1 1   15    5   97 o   10.381   4.7816  -3.7619   9.3529  -7.0388   11.741   1.9296   15.473   10.947   5.1463   14.167   6.3775 -3.219986 8.194895 
1 1 1   15    5   98 o   12.587   5.3302   4.0161   9.4536   2.4979   11.895   6.6193   15.576   13.069   5.7538   15.161   6.6319 -2.091172 8.779974 
1 1 1   15    5   99 o   13.823   5.5337   7.5875   9.4574   17.090   12.051  -7.6468   15.259   17.853   6.4530   12.276   5.8004 5.576162 8.676750 
1 1 1   15    5  100 o   25.488   5.0639   32.073   10.150   21.058   12.736   51.249   16.804   19.326   6.6647   30.127   6.9796 -10.80044 9.650584 
1 1 1   15    5  101 o   12.850   5.5673   3.6023   10.756  -1.5367   12.602   17.389   20.641   12.290   5.6197   18.039   7.7632 -5.748519 9.583702 
1 1 1   15    5  102 o   14.999   5.9907   10.132   11.059   19.159   12.973 -13.8657   21.153   18.434   6.6908   13.257   6.4121 5.177204 9.267251 
1 1 1   15    5  103 o   12.631   5.7753  -0.8244   13.307  -4.0631   17.041   4.2369   21.303   13.280   6.2293   15.573   7.1885 -2.293432 9.512074 
1 1 1   15    5  104 o   19.588   6.8416   22.611   13.441   23.179   17.015   21.668   21.920   19.283   7.5139   18.702   8.0237 0.5806847 10.99263 
1 1 1   15    5  105 o   12.484   5.8875  -5.7476   15.585  -3.4865   23.434  -7.5407   20.869   14.823   7.0569   13.768   6.5835 1.054865 9.651044 
1 1 1   15    5  106 o   12.593   5.9253  -4.8899   15.627 -35.8816   23.466   19.809   20.949   11.845   5.9160   18.124   7.8106 -6.279608 9.798217 
1 1 1   15    5  107 o   14.846   6.6323   6.6663   16.390   25.514   25.530  -6.5480   21.376   19.051   8.4064   13.894   6.6489 5.156731 10.71806 
1 1 1   15    5  108 o   16.021   7.3037   8.9258   21.081   0.0000   0.0000   8.9258   21.081  ?   ?    16.021   7.3037 0.000000 7.303700 
1 1 1   15    6 -106 o   11.622   5.8481 -45.6005   25.097 -45.6005   25.097   0.0000   0.0000   11.622   5.8481  ?   ?  0.000000 5.848077 
1 1 1   15    6 -105 o   14.292   6.9940 -14.3848   27.262 -14.3848   27.262   0.0000   0.0000   14.292   6.9940  ?   ?  0.000000 6.993992 
1 1 1   15    6 -104 o   14.867   6.8187   4.6124   18.744   4.6124   18.744   0.0000   0.0000   14.867   6.8187  ?   ?  0.000000 6.818750 
1 1 1   15    6 -103 o   16.984   7.2776   15.387   17.993   15.387   17.993   0.0000   0.0000   16.984   7.2776  ?   ?  0.000000 7.277629 
1 1 1   15    6 -102 o   16.805   7.2959   14.058   18.552   14.058   18.552   0.0000   0.0000   16.805   7.2959  ?   ?  0.000000 7.295938 
1 1 1   15    6 -101 o   20.000   7.8597   26.551   18.750   26.551   18.750   0.0000   0.0000   20.000   7.8597  ?   ?  0.000000 7.859743 
1 1 1   15    6 -100 o   18.673   7.6959   21.371   18.926   21.371   18.926   0.0000   0.0000   18.673   7.6959  ?   ?  0.000000 7.695864 
1 1 1   15    6  -99 o   17.132   6.9600   15.539   15.205   9.7755   18.728   26.687   26.045   16.130   7.1549   19.726   8.6034 -3.595325 11.18975 
1 1 1   15    6  -98 o   17.730   7.0177   17.326   15.043   19.112   18.368   13.689   26.215   18.280   7.5623   17.720   8.1035 0.5600376 11.08402 
1 1 1   15    6  -97 o   11.938   5.6361  -7.1591   14.354  -4.1295   17.562 -13.2548   24.911   13.510   6.3330   14.304   6.9282 -0.7943182 9.386515 
1 1 1   15    6  -96 o   13.473   5.9345   3.3775   12.670  -1.3256   17.717   8.3001   18.125   14.051   6.5104   15.913   7.0497 -1.861622 9.596024 
1 1 1   15    6  -95 o   11.846   5.4870  -4.0077   12.573  -6.7005   17.049  -0.7974   18.615   13.065   6.1603   14.450   6.6875 -1.384627 9.092375 
1 1 1   15    6  -94 o   16.175   6.5084   12.045   13.153   28.222   18.175  -5.7424   19.058   21.290   7.8876   13.883   6.5359 7.407080 10.24364 
1 1 1   15    6  -93 o   18.681   6.6152   18.879   12.597   23.426   16.771   12.993   19.080   19.999   7.5427   17.292   7.4532 2.706661 10.60390 
1 1 1   15    6  -92 o   17.799   6.6025   16.467   12.742   26.778   17.469   4.7433   18.627   21.115   7.7485   15.602   7.0125 5.513073 10.45059 
1 1 1   15    6  -91 o   16.029   6.3216   11.549   12.167   27.874   16.893  -6.0472   17.538   21.700   7.6629   13.520   6.3348 8.180214 9.942310 
1 1 1   15    6  -90 o   29.231   6.6394   45.204   15.459   61.654   17.987  -1.2763   30.236   34.259   6.6809   17.261   8.1585 16.99824 10.54494 
1 1 1   15    6  -89 o   15.325   5.6347   10.559   9.2451   13.220   16.250   9.2860   11.242   17.427   7.1512   15.233   6.0546 2.194242 9.370028 
1 1 1   15    6  -88 o   25.172   4.8257   29.737   9.5416   27.806   16.518   30.704   11.689   22.336   7.5934   24.829   5.8687 -2.492783 9.596983 
1 1 1   15    6  -87 o   13.855   5.4110   7.0996   8.8399   7.6456   15.340   6.8281   10.817   15.994   6.7821   14.409   5.8641 1.585485 8.965714 
1 1 1   15    6  -86 o   34.554   3.4775   51.981   9.6618   60.665   17.512   48.180   11.585   34.962   6.3796   32.596   4.4783 2.366348 7.794465 
1 1 1   15    6  -85 o   9.9223   4.5796  -4.9345   8.6421   1.5345   15.522  -7.8406   10.404   14.764   6.5329   10.380   4.8685 4.383428 8.147511 
1 1 1   15    6  -84 o   11.743   5.0703   0.9701   8.8602 -24.6379   15.751   12.824   10.716   10.803   5.2928   16.927   6.0896 -6.124045 8.068243 
1 1 1   15    6  -83 o   16.242   5.4261   11.896   8.4352   16.762   13.357   8.6679   10.879   18.941   6.8004   15.364   6.0021 3.576616 9.070316 
1 1 1   15    6  -82 o   27.963   3.9624   34.349   8.7794   7.4062   13.377   54.738   11.636   15.802   6.4868   35.307   4.1205 -19.50500 7.684816 
1 1 1   15    6  -81 o   26.871   4.4316   32.194   9.3688   43.042   14.029   23.460   12.587   30.252   5.9009   21.965   6.5426 8.287106 8.810542 
1 1 1   15    6  -80 o   32.848   3.4001   46.166   8.9726   46.010   14.089   46.272   11.638   31.531   5.6912   32.308   4.5443 -0.7773323 7.282862 
1 1 1   15    6  -79 o   36.112   3.0206   55.096   8.8103   65.206   13.767   48.082   11.466   38.545   4.4640   33.097   4.3556 5.447636 6.236845 
1 1 1   15    6  -78 o   37.304   3.0516   58.737   9.1982   57.036   14.128   59.989   12.118   35.773   4.9798   37.222   4.0597 -1.448975 6.424914 
1 1 1   15    6  -77 o   16.888   5.5181   12.562   8.7392   14.906   15.391   11.446   10.617   19.088   7.2197   16.727   6.0554 2.360306 9.422943 
1 1 1   15    6  -76 o   14.884   5.4761   8.4402   8.7342  -0.6440   14.954   13.144   10.760   14.615   6.4421   17.534   6.1217 -2.919042 8.886802 
1 1 1   15    6  -75 o   12.244   5.1154   2.2545   8.5237   24.527   14.795  -8.8094   10.428   22.730   7.1559   10.448   4.8919 12.28169 8.668225 
1 1 1   15    6  -74 o   67.049   2.0461  185.488   11.170  191.344   17.062  181.096   14.776   67.567   3.1062   65.923   2.7558 1.644081 4.152499 
1 1 1   15    6  -73 o   42.476   2.6747   75.197   9.2138   63.726   13.887   84.218   12.315   38.295   4.5366   44.661   3.4085 -6.365784 5.674393 
1 1 1   15    6  -72 o   29.812   3.2061   37.551   7.6688   36.134   10.323   39.297   11.456   28.735   4.5592   29.853   4.8759 -1.117191 6.675379 
1 1 1   15    6  -71 o   20.851   4.6795   19.319   7.7578   19.325   9.9273   19.310   12.433   20.631   5.7094   20.653   6.5671 -0.2162743E-01 8.701977 
1 1 1   15    6  -70 o   25.276   3.9631   27.554   7.8974   28.107   10.040   26.655   12.791   25.134   5.0754   24.022   6.4123 1.111485 8.177820 
1 1 1   15    6  -69 o   57.275   1.9990  135.035   9.3184  141.158   12.468  127.289   14.025   58.353   2.6280   55.211   3.1291 3.141697 4.086301 
1 1 1   15    6  -68 o   17.238   4.9352   13.068   7.2878   10.430   9.6258   16.611   11.156   16.272   5.7807   19.444   6.2247 -3.172371 8.494913 
1 1 1   15    6  -67 f   28.042   3.4607   33.273   7.7428   36.227   10.294   29.427   11.749   28.928   4.5128   25.578   5.7726 3.350300 7.327247 
1 1 1   15    6  -66 o   61.252   1.7125  153.887   8.5420  143.803   12.694  162.232   11.548   58.948   2.6485   62.745   2.2614 -3.796913 3.482656 
1 1 1   15    6  -65 o   8.2839   3.8464  -5.1842   6.2341  -7.9241   9.5803  -3.1719   8.2101   10.200   4.7470   10.417   4.6709 -0.2168493 6.659699 
1 1 1   15    6  -64 o   56.036   1.8993  128.919   8.6632  120.991   12.254  136.840   12.249   54.055   2.7906   57.548   2.6180 -3.493191 3.826384 
1 1 1   15    6  -63 o   68.818   1.7311  194.080   9.7034  184.826   13.545  203.837   13.908   66.962   2.4858   70.343   2.4291 -3.381401 3.475626 
1 1 1   15    6  -62 o   35.052   2.7394   50.946   7.7650   56.505   11.842   46.754   10.284   36.576   4.0391   33.285   3.8621 3.291378 5.588377 
1 1 1   15    6  -61 o   60.551   1.8416  150.302   9.0794  144.159   12.905  156.323   12.776   59.107   2.6856   61.591   2.5502 -2.484501 3.703494 
1 1 1   15    6  -60 o   17.713   4.6558   13.642   6.8094   17.316   10.027   10.496   9.2767   19.927   5.8143   16.385   5.6862 3.541874 8.132584 
1 1 1   15    6  -59 o   9.3999   4.1669  -1.9832   6.3423  -2.8674   9.7478  -1.3341   8.3519   11.630   5.1602   11.140   4.8650 0.4908276 7.091939 
1 1 1   15    6  -58 o   37.764   2.3591   58.743   7.2258   63.867   10.912   54.741   9.6432   39.156   3.4540   36.265   3.2982 2.891384 4.775785 
1 1 1   15    6  -57 o   27.241   3.2817   31.042   7.1404   15.927   10.252   45.281   9.9507   19.322   5.9369   32.857   3.7843 -13.53446 7.040440 
1 1 1   15    6  -56 o   36.625   2.9009   55.507   8.5899   47.222   16.903   58.392   9.9739   32.761   6.5584   37.489   3.2973 -4.728889 7.340654 
1 1 1   15    6  -55 o   58.279   2.1091  139.244   10.003  136.435   19.345  140.269   11.687   57.202   4.1775   58.432   2.4591 -1.230537 4.847578 
1 1 1   15    6  -54 o   37.396   2.8512   57.774   8.6258   75.107   17.704   52.379   9.8775   42.060   5.2799   35.481   3.4591 6.579102 6.312069 
1 1 1   15    6  -53 o   66.742   1.7151  182.164   9.3231  170.473   13.987  191.511   12.507   64.409   2.6698   68.353   2.2477 -3.944344 3.489977 
1 1 1   15    6  -52 o   54.493   1.9390  121.577   8.5994  132.678   12.999  112.937   11.467   56.792   2.8167   52.407   2.6934 4.384384 3.897190 
1 1 1   15    6  -51 o   69.492   1.8829  197.544   10.656  203.310   14.739  191.229   15.424   70.389   2.5731   68.224   2.7792 2.164932 3.787470 
1 1 1   15    6  -50 o   85.695   1.7480  300.031   12.210  291.852   16.704  309.416   17.893   84.389   2.4308   86.874   2.5294 -2.484840 3.508083 
1 1 1   15    6  -49 o   52.704   2.2826  113.868   9.7833  115.080   13.616  112.575   14.066   52.843   3.1757   52.235   3.3208 0.6072922 4.594824 
1 1 1   15    6  -48 o   24.300   4.5787   25.198   8.7368  -4.4719   12.227   56.147   12.488   12.882   5.7436   36.640   4.2606 -23.75787 7.151363 
1 1 1   15    6  -47 o   43.436   3.3311   77.926   11.704   75.889   22.778   78.657   13.643   41.974   6.8968   43.537   3.8850 -1.563614 7.915742 
1 1 1   15    6  -46 o   12.934   5.3759   1.7752   9.3430  -7.5250   14.460   8.4411   12.242   13.517   6.1173   16.827   6.4214 -3.310692 8.868796 
1 1 1   15    6  -45 o   87.991   1.7422  316.162   12.496  309.111   20.343  320.434   15.836   86.815   2.8786   88.534   2.1943 -1.719322 3.619566 
1 1 1   15    6  -44 o   63.429   1.9948  164.529   10.301  180.202   17.143  155.672   12.887   66.217   3.1854   61.627   2.5710 4.590015 4.093491 
1 1 1   15    6  -43 o   29.633   3.5373   36.548   8.3760   46.435   14.207   31.280   10.370   33.057   5.4629   27.123   4.8693 5.934334 7.318042 
1 1 1   15    6  -42 o   55.774   2.7961  127.650   12.672  148.352   16.838  100.614   19.243   60.036   3.4553   49.133   4.8687 10.90317 5.970192 
1 1 1   15    6  -41 o   24.936   4.9279   26.542   9.6613   28.007   14.303   25.313   13.102   25.456   6.7745   24.232   6.4994 1.223574 9.388057 
1 1 1   15    6  -40 o   34.904   3.4841   50.450   9.7805   53.961   14.376   47.425   13.345   35.810   5.0662   33.536   5.0371 2.274143 7.144168 
1 1 1   15    6  -39 o  123.674   1.6028  624.188   16.158  659.744   26.370  602.813   20.446  127.024   2.5468  121.487   2.0646 5.537102 3.278529 
1 1 1   15    6  -38 o   76.199   1.7982  237.016   11.169  238.979   18.612  235.912   13.963   76.350   2.9963   75.954   2.2577 0.3964767 3.751731 
1 1 1   15    6  -37 o   97.676   1.7743  389.420   14.127  368.194   21.298  406.094   18.877   94.838   2.7580   99.693   2.3229 -4.854370 3.605896 
1 1 1   15    6  -36 o   51.749   2.8275  109.864   11.882  113.685   15.982  105.141   17.766   52.514   3.7584   50.389   4.3684 2.125221 5.762647 
1 1 1   15    6  -35 o  110.938   1.7394  502.276   15.729  542.102   24.351  473.762   20.605  115.158   2.5941  107.684   2.3474 7.474419 3.498500 
1 1 1   15    6  -34 o  191.318   2.0185  1494.43   31.479  1464.28   50.585  1513.48   40.215  189.108   3.2815  192.431   2.5638 -3.323029 4.164291 
1 1 1   15    6  -33 o  119.520   1.7104  582.931   16.663  570.555   29.876  588.519   20.076  118.038   3.1077  120.059   2.0514 -2.021027 3.723740 
1 1 1   15    6  -32 o   17.342   5.4774   12.239   8.6621 -25.7553   17.035   25.489   10.060   12.086   5.8229   24.418   5.2128 -12.33198 7.815321 
1 1 1   15    6  -31 o  101.455   1.9394  420.154   16.039  446.079   44.013  416.184   17.223  103.924   5.2121  100.962   2.0927 2.962616 5.616545 
1 1 1   15    6  -30 o  220.424   1.9669  1983.30   35.340  1929.40   61.470  2009.91   43.192  217.058   3.4742  221.818   2.3888 -4.760040 4.216170 
1 1 1   15    6  -29 o   91.627   1.8115  342.612   13.530  381.048   25.734  327.928   15.906   96.436   3.2785   89.617   2.1774 6.819366 3.935669 
1 1 1   15    6  -28 f  198.325   1.7640  1604.98   28.517  1563.83   44.563  1633.53   37.110  195.592   2.7950  200.002   2.2763 -4.410400 3.604660 
1 1 1   15    6  -27 f   44.786   2.6977   82.263   9.8027  102.375   19.416   75.383   11.356   49.671   4.8575   42.798   3.2802 6.873840 5.861298 
1 1 1   15    6  -26 o   83.677   1.7912  285.707   12.217  296.844   21.183  280.156   14.956   85.144   3.0570   82.805   2.2177 2.338676 3.776711 
1 1 1   15    6  -25 o  166.368   1.6839  1129.22   22.836  1122.12   36.409  1133.82   29.321  165.715   2.6953  166.653   2.1584 -0.9379272 3.453022 
1 1 1   15    6  -24 o   71.128   1.9411  206.617   11.244  203.853   19.198  208.060   13.872   70.508   3.3499   71.339   2.3889 -0.8307953 4.114405 
1 1 1   15    6  -23 o   40.363   2.8516   66.911   9.3219   60.608   16.954   69.642   11.160   37.959   5.6515   41.123   3.3585 -3.164257 6.574114 
1 1 1   15    6  -22 o  156.298   1.9752  996.950   25.165  998.198   44.138  996.348   30.632  156.187   3.4668  156.202   2.4058 -0.1551819E-01 4.219768 
1 1 1   15    6  -21 o   90.157   2.0933  331.758   15.384  310.464   29.284  339.876   18.080   86.938   4.1441   91.198   2.4343 -4.260002 4.806196 
1 1 1   15    6  -20 o   54.317   2.4590  120.724   10.859  108.011   25.093  123.653   12.046   50.809   6.1860   54.951   2.6974 -4.142036 6.748512 
1 1 1   15    6  -19 o  116.296   1.6416  551.703   15.562  493.288   25.093  588.208   19.837  109.842   2.8048  120.055   2.0270 -10.21309 3.460612 
1 1 1   15    6  -18 o  100.773   1.7855  414.314   14.667  424.463   27.920  410.445   17.237  101.816   3.3687  100.282   2.1086 1.533882 3.974208 
1 1 1   15    6  -17 o   36.116   3.2579   53.765   9.4883   62.718   18.981   50.782   10.955   38.522   6.2593   35.003   3.9062 3.518951 7.378134 
1 1 1   15    6  -16 o   87.035   1.7428  309.026   12.365  306.755   20.457  310.334   15.521   86.596   2.9021   87.169   2.1861 -0.5729446 3.633327 
1 1 1   15    6  -15 o  105.196   1.6419  451.397   14.079  449.971   22.819  452.273   17.891  104.927   2.6701  105.272   2.0849 -0.3456726 3.387643 
1 1 1   15    6  -14 o   31.381   3.3580   40.725   8.4564   35.373   13.658   44.052   10.769   28.782   6.0156   32.533   4.1554 -3.751724 7.311319 
1 1 1   15    6  -13 f  152.331   1.5454  946.432   19.189  934.942   28.170  956.380   26.211  151.341   2.2835  153.084   2.1005 -1.743378 3.102621 
1 1 1   15    6  -12 o   98.169   1.5987  393.081   12.793  385.553   19.413  398.860   17.010   97.145   2.4534   98.861   2.1108 -1.716072 3.236455 
1 1 1   15    6  -11 o   91.991   1.6307  345.172   12.228  355.620   18.768  337.464   16.120   93.294   2.4700   90.931   2.1747 2.362953 3.290982 
1 1 1   15    6  -10 o  182.042   1.6927  1351.78   25.119  1386.31   39.586  1328.51   32.500  184.244   2.6358  180.415   2.2099 3.828384 3.439605 
1 1 1   15    6   -9 o   59.061   2.0602  142.517   9.9035  160.281   15.744  130.887   12.740   62.548   3.0976   56.539   2.7726 6.009182 4.157207 
1 1 1   15    6   -8 o   73.967   1.8313  223.200   11.042  216.644   16.921  228.062   14.572   72.767   2.8583   74.705   2.3960 -1.937721 3.729671 
1 1 1   15    6   -7 f  194.301   1.6510  1539.89   26.149  1560.97   38.305  1521.48   35.785  195.543   2.4031  193.070   2.2738 2.473053 3.308323 
1 1 1   15    6   -6 o   17.055   5.4141   11.740   8.4536   18.474   13.419   7.3088   10.885   21.370   6.8255   15.921   6.0601 5.448907 9.127550 
1 1 1   15    6   -5 o   81.451   1.7428  270.621   11.571  265.565   17.645  274.436   15.327   80.594   2.6897   81.965   2.2963 -1.370743 3.536560 
1 1 1   15    6   -4 o  144.247   1.6828  848.714   19.786  827.787   26.763  873.942   29.385  142.408   2.3055  146.309   2.4638 -3.901016 3.374260 
1 1 1   15    6   -3 o  137.246   1.6843  768.323   18.843  744.620   25.439  797.138   28.048  135.065   2.3106  139.733   2.4624 -4.667908 3.376729 
1 1 1   15    6   -2 o  123.395   1.7829  621.128   17.934  601.293   25.444  640.709   25.281  121.351   2.5722  125.274   2.4757 -3.922714 3.570065 
1 1 1   15    6   -1 o  124.875   1.7895  636.120   18.215  611.763   25.746  660.531   25.774  122.402   2.5804  127.196   2.4858 -4.793594 3.582981 
1 1 1   15    6    0 o   79.097   1.7770  255.214   11.457  266.299   17.602  247.065   15.092   80.708   2.6792   77.761   2.3837 2.947189 3.586153 
1 1 1   15    6    1 o  153.380   1.5641  959.488   19.555  954.112   28.719  964.134   26.701  152.890   2.3044  153.707   2.1311 -0.8171234 3.138734 
1 1 1   15    6    2 o   64.627   1.9796  170.573   10.417  166.893   16.075  173.237   13.677   63.831   3.0986   65.085   2.5830 -1.253239 4.034038 
1 1 1   15    6    3 o   70.264   1.8833  201.564   10.777  191.727   16.584  208.754   14.179   68.438   2.9799   71.467   2.4374 -3.029144 3.849798 
1 1 1   15    6    4 o  127.573   1.6549  663.821   17.210  667.458   24.107  660.042   24.576  127.875   2.3127  127.158   2.3710 0.7171860 3.312149 
1 1 1   15    6    5 o  101.090   1.7456  416.858   14.384  446.156   20.333  387.508   20.351  104.543   2.3860   97.384   2.5659 7.158829 3.503855 
1 1 1   15    6    6 o   38.650   3.1988   61.474   9.9879   71.083   14.407   52.581   13.859   41.431   4.3297   35.466   4.9267 5.965496 6.558877 
1 1 1   15    6    7 f  127.160   1.8087  659.636   18.748  663.688   24.014  653.312   30.001  127.512   2.3103  126.456   2.9104 1.056366 3.715924 
1 1 1   15    6    8 o   16.135   5.7942   9.0385   9.6974   9.1842   13.372   8.8769   14.084   17.698   6.7213   17.883   6.8718 -0.1852798 9.612329 
1 1 1   15    6    9 o   58.598   2.4257  140.423   11.561  131.445   15.436  151.897   17.450   56.600   3.3607   60.838   3.5339 -4.238522 4.876790 
1 1 1   15    6   10 o  121.562   1.8095  602.851   17.930  608.032   23.207  595.178   28.242  122.045   2.3327  120.700   2.8705 1.345497 3.698810 
1 1 1   15    6   11 o  167.158   1.9665  1140.11   26.795  1156.79   35.725  1118.66   40.511  168.305   2.6040  165.454   3.0038 2.851364 3.975322 
1 1 1   15    6   12 o   34.044   3.9439   48.078   10.742   55.849   15.429   40.768   14.965   36.489   5.3459   30.926   6.1530 5.562965 8.150931 
1 1 1   15    6   13 f   65.414   2.7098  175.074   14.418  175.089   23.208  175.065   18.399   65.213   4.3914   65.332   3.4673 -0.1189804 5.595220 
1 1 1   15    6   14 o  107.534   1.8086  471.757   15.853  470.344   23.648  472.911   21.365  107.274   2.7066  107.623   2.4353 -0.3486481 3.640921 
1 1 1   15    6   15 o  141.013   1.7591  811.193   20.220  810.150   29.567  812.110   27.714  140.847   2.5753  141.035   2.4106 -0.1876526 3.527500 
1 1 1   15    6   16 o  128.540   1.7686  674.058   18.531  697.481   27.706  655.098   24.927  130.683   2.6009  126.668   2.4142 4.014847 3.548632 
1 1 1   15    6   17 o   93.687   1.8803  358.124   14.359  336.993   21.626  374.786   19.203   90.764   2.9268   95.773   2.4618 -5.008896 3.824530 
1 1 1   15    6   18 o  100.712   2.0169  413.923   16.557  417.492   28.775  412.156   20.245  100.957   3.5019  100.465   2.4720 0.4917450 4.286538 
1 1 1   15    6   19 o   80.767   2.3977  266.586   15.768  249.393   24.883  278.123   20.384   77.937   3.9294   82.431   3.0387 -4.494499 4.967287 
1 1 1   15    6   20 o  132.001   1.9187  711.002   20.646  820.949   49.479  687.824   22.718  141.443   4.2964  129.812   2.1469 11.63062 4.802969 
1 1 1   15    6   21 o  176.792   1.8247  1275.27   26.296  1266.20   45.528  1279.80   32.213  175.970   3.1740  177.059   2.2319 -1.088760 3.880139 
1 1 1   15    6   22 o   46.778   2.7093   89.699   10.287   97.908   18.425   85.982   12.399   48.612   4.7085   45.725   3.3498 2.887543 5.778518 
1 1 1   15    6   23 o  120.572   1.7579  593.132   17.277  571.516   30.206  603.644   21.063  118.179   3.1383  121.607   2.1248 -3.427582 3.789992 
1 1 1   15    6   24 o   99.715   1.8075  405.707   14.692  427.512   26.454  395.983   17.667  102.190   3.1797   98.486   2.2006 3.704437 3.866916 
1 1 1   15    6   25 o   74.735   2.4702  228.380   15.028  259.700   22.551  203.360   20.156   79.579   3.4848   70.396   3.5237 9.182785 4.955828 
1 1 1   15    6   26 o   54.935   2.6137  123.579   11.671  128.656   19.337  120.669   14.637   55.839   4.2809   54.203   3.3289 1.635967 5.422901 
1 1 1   15    6   27 f   38.620   3.1433   61.410   9.8099   91.834   18.753   49.949   11.510   46.999   4.9703   34.654   4.1577 12.34538 6.479965 
1 1 1   15    6   28 f   32.467   3.6715   43.722   9.5465   28.771   17.360   50.204   11.430   26.049   7.6642   34.748   4.1151 -8.698742 8.699089 
1 1 1   15    6   29 o   82.892   1.9113  280.443   12.915  299.036   23.504  272.401   15.457   85.401   3.3829   81.634   2.3253 3.767021 4.105011 
1 1 1   15    6   30 o   79.127   1.9366  255.562   12.491  260.516   22.471  253.347   15.027   79.686   3.4677   78.721   2.3443 0.9642639 4.185769 
1 1 1   15    6   31 o   98.750   1.9614  398.060   15.788  377.173   35.942  403.055   17.575   95.679   4.6221   99.350   2.1701 -3.670677 5.106164 
1 1 1   15    6   32 o   61.802   2.6284  156.395   13.211  164.685   30.004  154.401   14.714   62.849   5.9266   61.370   2.9500 1.479084 6.620193 
1 1 1   15    6   33 o   78.437   2.3232  251.540   14.838  265.219   32.538  247.949   16.672   80.097   5.0086   77.840   2.6313 2.257004 5.657753 
1 1 1   15    6   34 o  110.234   2.1200  496.223   19.050  497.994   40.340  495.715   21.611  109.969   4.5097  110.147   2.4070 -0.1783905 5.111839 
1 1 1   15    6   35 o  153.025   2.4883  956.998   31.038  929.009   54.963  970.103   37.609  150.244   4.4929  153.975   2.9965 -3.730499 5.400440 
1 1 1   15    6   36 o  114.807   2.1510  538.337   20.130  537.635   29.180  538.975   27.807  114.556   3.1277  114.727   2.9759 -0.1707993 4.317234 
1 1 1   15    6   37 o   94.677   2.2268  366.181   17.186  373.616   25.018  359.537   23.649   95.459   3.2197   93.662   3.1017 1.797745 4.470695 
1 1 1   15    6   38 o   21.100   6.1507   18.843   11.225   5.9107   16.380   30.295   15.414   17.846   7.2335   26.481   7.0258 -8.635509 10.08389 
1 1 1   15    6   39 o   90.303   2.0585  333.063   15.152  350.797   25.020  322.791   19.041   92.461   3.3251   88.802   2.6334 3.659149 4.241591 
1 1 1   15    6   40 o   67.058   2.6855  184.252   14.650  188.839   21.635  180.367   19.908   67.686   3.9383   66.188   3.7047 1.497742 5.406957 
1 1 1   15    6   41 o   98.438   1.9826  395.774   15.909  389.034   26.145  399.737   20.047   97.361   3.2991   98.839   2.4901 -1.477898 4.133413 
1 1 1   15    6   42 o   29.989   4.4069   37.812   10.452   19.823   18.173   46.703   12.777   22.782   7.9555   33.301   4.8491 -10.51818 9.316835 
1 1 1   15    6   43 o   15.243   5.8559   6.5768   10.226   27.307   18.063  -3.2000   12.405   25.424   7.8924   13.336   5.8733 12.08805 9.837911 
1 1 1   15    6   44 o   27.109   4.9741   31.314   10.587   39.136   18.836   27.702   12.800   29.904   7.6856   25.287   6.2469 4.616796 9.904217 
1 1 1   15    6   45 o   36.102   3.8043   54.178   11.027   70.602   19.231   46.131   13.460   40.769   5.9630   32.991   5.1753 7.777798 7.895637 
1 1 1   15    6   46 o   55.427   2.7361  126.129   12.324  112.313   20.952  133.438   15.238   51.837   5.0212   56.922   3.2983 -5.085403 6.007612 
1 1 1   15    6   47 o   92.639   2.0781  350.821   15.693  392.257   27.127  329.981   19.239   97.654   3.4131   89.727   2.6332 7.926743 4.310815 
1 1 1   15    6   48 o   70.503   2.3156  203.594   13.290  224.463   23.382  193.634   16.152   73.707   3.9056   68.660   2.8925 5.046616 4.860063 
1 1 1   15    6   49 o   47.795   3.4269   94.399   13.263   95.559   19.875   93.468   17.807   47.672   5.1986   47.279   4.6820 0.3932571 6.996203 
1 1 1   15    6   50 o   89.834   2.3508  330.582   17.199  329.872   24.558  331.267   24.096   89.500   3.3722   89.709   3.3008 -0.2085266 4.718757 
1 1 1   15    6   51 o   10.721   5.0017  -9.8327   10.740 -13.0405   15.658  -6.9828   14.758   13.099   6.0867   13.749   6.2052 -0.6500654 8.692110 
1 1 1   15    6   52 o   89.060   2.3051  324.979   16.720  333.464   24.067  317.063   23.246   89.973   3.2870   87.738   3.2559 2.234711 4.626616 
1 1 1   15    6   53 o  100.101   1.8930  409.741   15.446  435.948   25.904  395.281   19.241  102.928   3.0910   98.221   2.4032 4.706787 3.915299 
1 1 1   15    6   54 o   32.047   4.3946   43.388   11.178   4.1984   20.926   59.033   13.222   18.985   7.9790   37.461   4.4147 -18.47556 9.118878 
1 1 1   15    6   55 o   43.827   3.3301   79.618   11.808   46.244   22.073   92.996   13.975   31.965   8.3731   47.309   3.6522 -15.34351 9.134928 
1 1 1   15    6   56 o   20.780   5.7703   18.796   10.121   8.4778   19.697   22.497   11.797   19.499   7.9216   22.651   6.2066 -3.152203 10.06352 
1 1 1   15    6   57 o   46.406   2.8454   88.911   10.712   77.338   16.833   96.788   13.886   42.712   4.9248   48.257   3.5550 -5.545410 6.073887 
1 1 1   15    6   58 o   28.116   4.0075   33.466   8.9249   16.993   15.696   41.337   10.849   20.808   7.3828   31.200   4.3869 -10.39213 8.587862 
1 1 1   15    6   59 o   51.558   2.5044  109.473   10.494  124.044   18.780  102.857   12.653   54.373   4.2714   49.826   3.1312 4.547188 5.296209 
1 1 1   15    6   60 o   17.402   5.3308   12.911   8.2735  -5.5583   14.034   22.748   10.243   13.509   6.0781   22.712   5.5746 -9.202880 8.247386 
1 1 1   15    6   61 o   18.094   5.2707   14.187   8.2456   20.583   14.104   10.866   10.163   21.797   7.0012   16.807   5.9429 4.989229 9.183440 
1 1 1   15    6   62 o   32.377   3.4123   43.936   8.8705   42.455   15.175   44.705   10.933   30.889   6.2418   32.426   4.2375 -1.536772 7.544293 
1 1 1   15    6   63 o   40.803   2.7934   69.023   9.2349   50.338   15.094   80.202   11.675   33.887   5.6641   43.860   3.2895 -9.973263 6.549998 
1 1 1   15    6   64 o   41.414   2.7802   71.136   9.3310   70.579   15.628   71.444   11.632   40.562   4.8208   41.301   3.4876 -0.7388763 5.950125 
1 1 1   15    6   65 o  108.927   1.7853  486.401   15.852  461.036   24.321  505.137   20.902  105.553   2.8292  110.788   2.3146 -5.234505 3.655353 
1 1 1   15    6   66 o   76.590   2.0226  241.119   12.617  235.491   21.775  243.963   15.480   75.024   3.5709   76.881   2.4733 -1.856598 4.343807 
1 1 1   15    6   67 f   56.131   2.2372  129.898   10.216  115.072   16.361  139.374   13.079   52.227   3.8704   57.968   2.7760 -5.741005 4.763033 
1 1 1   15    6   68 o   21.774   4.7895   20.963   8.2695   22.439   14.079   20.185   10.218   22.239   6.9776   21.166   5.7667 1.072916 9.052171 
1 1 1   15    6   69 o   10.786   4.8401  -3.2450   8.8345 -12.3247   13.457   3.6333   11.712   11.700   5.5030   14.481   6.0190 -2.781742 8.155437 
1 1 1   15    6   70 o   13.978   5.4974   5.6444   9.1787   3.3680   13.660   7.5182   12.393   15.252   6.4303   16.013   6.3595 -0.7608948 9.043906 
1 1 1   15    6   71 o   20.728   5.9627   19.559   10.614   26.576   18.016   15.829   13.135   23.811   7.9293   19.270   6.7610 4.540705 10.42041 
1 1 1   15    6   72 o   41.721   2.9043   72.777   9.8156   74.814   19.495   72.086   11.361   40.682   6.0638   41.329   3.4023 -0.6475182 6.953085 
1 1 1   15    6   73 o   18.936   5.3988   16.194   8.7388   4.1315   17.477   20.216   10.091   16.833   7.1917   21.013   5.7331 -4.180113 9.197262 
1 1 1   15    6   74 o   15.726   5.3270   10.418   8.1287   32.111   13.634  -1.5461   10.125   26.155   6.4387   11.990   5.2923 14.16541 8.334559 
1 1 1   15    6   75 o   46.071   2.5349   88.326   9.4831   89.207   15.266   87.773   12.101   45.525   4.1598   45.614   3.2763 -0.8942032E-01 5.295046 
1 1 1   15    6   76 o   46.331   2.5107   89.334   9.4464   82.934   15.198   93.363   12.059   43.763   4.3166   47.086   3.1600 -3.323620 5.349639 
1 1 1   15    6   77 o   12.925   5.1001   4.8618   7.9232   0.4324   13.466   7.2074   9.7990   14.174   6.1839   14.711   5.7106 -0.5370064 8.417368 
1 1 1   15    6   78 o   29.253   3.3798   36.556   7.9111   35.550   11.911   37.351   10.583   27.889   5.4346   29.019   4.6292 -1.129612 7.138978 
1 1 1   15    6   79 o   39.777   3.2009   67.051   10.291   69.684   13.025   62.678   16.788   40.113   4.0385   36.945   5.7626 3.167271 7.036818 
1 1 1   15    6   80 o   39.583   3.1089   66.367   9.9507   71.129   12.786   59.053   15.847   40.549   3.9170   35.867   5.6033 4.681488 6.836599 
1 1 1   15    6   81 o   53.770   2.1149  119.957   9.2518  118.044   13.733  121.547   12.519   52.738   3.2098   53.731   2.8687 -0.9928513 4.304897 
1 1 1   15    6   82 o   38.222   2.6686   61.464   8.2621   73.982   12.743   52.386   10.852   41.295   3.8293   34.655   3.9098 6.640068 5.472653 
1 1 1   15    6   83 o   41.694   2.4713   72.874   8.3613   55.886   12.622   86.160   11.162   35.385   4.4758   45.023   3.0595 -9.638725 5.421611 
1 1 1   15    6   84 o   30.552   3.3120   40.268   8.1166   33.952   13.517   43.829   10.150   26.167   6.3927   31.478   4.0496 -5.310633 7.567378 
1 1 1   15    6   85 o   23.362   4.4665   24.920   8.1958   14.674   12.874   31.902   10.628   17.875   6.6354   26.061   5.1854 -8.185329 8.421190 
1 1 1   15    6   86 o   25.091   3.1931   27.307   6.3831   11.211   12.449   33.048   7.4348   16.449   6.4221   27.538   3.3830 -11.08971 7.258628 
1 1 1   15    6   87 o   34.568   2.9067   51.140   8.1147   47.583   13.387   53.206   10.203   31.618   5.3870   34.799   3.6512 -3.180376 6.507781 
1 1 1   15    6   88 o   14.923   5.8596   8.7583   10.413   6.7885   11.837   15.503   21.903   14.655   6.0674   18.950   8.0723 -4.294744 10.09827 
1 1 1   15    6   89 o   15.070   5.9073   9.2821   10.568   17.210   12.044 -17.2559   22.035   18.406   6.4726   13.718   6.6126 4.687525 9.253205 
1 1 1   15    6   90 o   18.296   6.5086   17.250   12.206   20.219   14.581   10.295   22.317   19.377   7.0841   17.574   7.8020 1.803152 10.53833 
1 1 1   15    6   91 o   14.490   5.8222   8.1832   10.510  -0.6619   11.863   40.447   22.658   12.395   5.5816   24.510   8.8497 -12.11501 10.46290 
1 1 1   15    6   92 o   15.062   5.9183   9.8015   10.630   9.4172   11.941   11.269   23.332   15.199   6.1703   17.608   7.8863 -2.408755 10.01333 
1 1 1   15    6   93 o   31.891   4.5074   47.691   11.391   45.255   12.774   57.147   25.170   30.261   5.3755   28.237   9.3714 2.024469 10.80372 
1 1 1   15    6   94 o   13.029   5.4348   5.1475   9.5991   5.9917   11.927   3.5951   16.174   14.047   5.9693   14.662   6.5665 -0.6145430 8.874193 
1 1 1   15    6   95 o   17.011   5.8484   14.881   9.8044   12.269   12.166   19.720   16.560   16.060   6.3251   18.689   7.3738 -2.629559 9.714928 
1 1 1   15    6   96 o   13.256   5.6211   5.1087   10.537   5.0556   12.042   5.2824   21.770   13.716   5.9165   16.026   7.3496 -2.309479 9.435170 
1 1 1   15    6   97 o   14.493   6.0958   7.7357   12.230  -2.8778   14.536   33.455   22.627   12.740   5.9009   21.674   8.5979 -8.934134 10.42803 
1 1 1   15    6   98 o   24.957   6.3947   34.322   13.067   28.197   15.816   47.494   23.192   21.345   7.4237   25.298   8.9744 -3.952488 11.64691 
1 1 1   15    6   99 o   8.6940   4.3377 -25.8382   12.468 -11.1374   14.829 -61.3051   23.033   11.476   5.5041   10.330   5.2438 1.146281 7.602159 
1 1 1   15    6  100 o   19.672   6.7218   22.564   12.946   23.117   15.495   21.285   23.564   19.437   7.2669   18.635   8.1541 0.8027363 10.92236 
1 1 1   15    6  101 o   12.660   5.6859   1.3354   12.220   21.997   15.283 -35.2827   20.346   19.022   7.1946   10.993   5.4935 8.029196 9.052083 
1 1 1   15    6  102 o   17.411   7.1202   17.079   16.040   27.840   24.467   8.9677   21.242   19.688   8.4623   16.140   7.3478 3.547960 11.20720 
1 1 1   15    6  103 o   18.894   7.2998   22.300   15.955   34.040   23.766   12.668   21.527   20.944   8.6271   16.720   7.5249 4.223867 11.44773 
1 1 1   15    6  104 o   15.239   6.6740   9.1543   15.815 -14.7964   22.991   30.664   21.788   13.350   6.5092   20.326   8.3038 -6.976043 10.55098 
1 1 1   15    6  105 o   12.448   5.8689  -5.0521   15.467 -20.8427   22.413   9.3046   21.371   12.657   6.2239   16.062   7.3343 -3.404364 9.619200 
1 1 1   15    6  106 o   15.806   6.9027   10.874   16.813   28.160   24.365  -4.8394   23.230   19.571   8.4288   14.475   6.9282 5.096255 10.91077 
1 1 1   15    7 -100 o   18.963   8.5042   25.866   27.226   25.866   27.226   0.0000   0.0000   18.963   8.5042  ?   ?  0.000000 8.504189 
1 1 1   15    7  -99 o   16.371   7.7492   5.8210   27.471   5.8210   27.471   0.0000   0.0000   16.371   7.7492  ?   ?  0.000000 7.749163 
1 1 1   15    7  -98 o   18.646   7.6380   21.863   18.497   21.863   18.497   0.0000   0.0000   18.646   7.6380  ?   ?  0.000000 7.637995 
1 1 1   15    7  -97 o   18.954   7.6759   22.774   18.426   22.774   18.426   0.0000   0.0000   18.954   7.6759  ?   ?  0.000000 7.675855 
1 1 1   15    7  -96 o   13.150   6.2201  -5.8415   17.638  -5.8415   17.638   0.0000   0.0000   13.150   6.2201  ?   ?  0.000000 6.220144 
1 1 1   15    7  -95 o   14.553   6.6848   2.0160   18.106   2.0160   18.106   0.0000   0.0000   14.553   6.6848  ?   ?  0.000000 6.684768 
1 1 1   15    7  -94 o   18.133   7.5361   18.645   18.359   18.645   18.359   0.0000   0.0000   18.133   7.5361  ?   ?  0.000000 7.536106 
1 1 1   15    7  -93 o   12.567   5.9858  -9.0507   16.901  -9.0507   16.901   0.0000   0.0000   12.567   5.9858  ?   ?  0.000000 5.985768 
1 1 1   15    7  -92 o   16.711   7.1397   12.605   17.226   12.605   17.226   0.0000   0.0000   16.711   7.1397  ?   ?  0.000000 7.139747 
1 1 1   15    7  -91 o   16.465   6.7180   12.774   14.240   2.8127   16.407   43.181   28.665   14.493   6.5418   23.215   9.5088 -8.721576 11.54178 
1 1 1   15    7  -90 o   10.565   5.0541 -10.7787   12.328  -7.0391   16.431 -15.5949   18.646   12.836   6.0508   12.464   6.0266 0.3715658 8.540027 
1 1 1   15    7  -89 o   25.731   6.2249   35.102   12.913   40.649   17.384   28.274   19.288   25.988   7.6757   21.192   8.0667 4.795483 11.13494 
1 1 1   15    7  -88 o   27.530   5.9949   39.101   13.071   40.771   17.854   37.172   19.187   25.972   7.8053   24.195   8.1843 1.776827 11.30954 
1 1 1   15    7  -87 o   25.957   5.1365   32.805   10.483   18.556   16.786   41.916   13.423   18.666   7.4051   28.667   5.9396 -10.00081 9.492857 
1 1 1   15    7  -86 o   11.071   5.0371  -2.6205   9.9641 -13.6012   16.064   4.2457   12.703   11.950   5.7309   14.005   6.0590 -2.054731 8.339956 
1 1 1   15    7  -85 o   15.619   5.8456   10.960   10.031   18.357   16.124   6.2900   12.813   18.905   7.3290   14.693   6.2130 4.211272 9.608113 
1 1 1   15    7  -84 o   29.699   4.8877   41.304   11.422   17.115   17.260   60.148   15.234   18.787   7.4907   35.415   5.4518 -16.62771 9.264555 
1 1 1   15    7  -83 o   21.504   5.7492   22.901   10.272   19.117   17.115   25.031   12.842   19.500   7.5533   21.932   6.6260 -2.432674 10.04774 
1 1 1   15    7  -82 f   12.054   5.2318   1.1476   9.5336   0.6454   16.331   1.4073   11.742   14.742   6.6006   13.160   5.7575 1.581610 8.758814 
1 1 1   15    7  -81 o   8.6730   4.2050 -13.2360   9.2369 -16.9988   15.600 -11.2048   11.462   11.584   5.5788   10.360   4.9331 1.223891 7.447059 
1 1 1   15    7  -80 o   10.775   4.8660  -2.7585   9.0905 -14.9623   15.205   4.0300   11.340   11.733   5.6131   13.860   5.8521 -2.126731 8.108858 
1 1 1   15    7  -79 o   22.201   5.4057   23.336   9.6899   52.841   17.125   9.4403   11.752   32.716   6.6482   15.871   6.2270 16.84530 9.109027 
1 1 1   15    7  -78 o   13.733   5.5127   5.6673   9.4123   13.990   16.785   1.8498   11.368   18.581   7.3940   13.341   5.7515 5.240131 9.367574 
1 1 1   15    7  -77 o   26.043   4.3732   30.271   8.9551   21.844   13.469   36.948   11.989   21.147   6.8461   28.237   5.4054 -7.089523 8.722869 
1 1 1   15    7  -76 o   23.609   4.7034   25.210   8.7335   35.576   13.567   17.875   11.413   27.262   6.2400   19.502   6.3011 7.760757 8.868001 
1 1 1   15    7  -75 o   32.250   3.5683   44.689   9.2239   33.241   13.692   54.203   12.481   26.299   6.4393   35.071   4.4671 -8.772118 7.837089 
1 1 1   15    7  -74 o   27.831   4.0664   33.846   8.9527   36.603   13.577   31.725   11.908   27.869   6.1425   26.109   5.7510 1.759855 8.414512 
1 1 1   15    7  -73 o   37.250   3.1425   58.672   9.4529   58.103   14.370   59.106   12.551   36.099   5.0188   36.848   4.2567 -0.7490273 6.580855 
1 1 1   15    7  -72 o   35.056   3.2408   52.063   9.1562   49.603   13.636   54.083   12.356   33.260   5.1998   35.192   4.4033 -1.931702 6.813756 
1 1 1   15    7  -71 o   52.223   1.9724  112.568   8.3813  110.914   13.637  113.572   10.625   51.274   3.2799   52.257   2.5016 -0.9831085 4.124999 
1 1 1   15    7  -70 o   12.193   4.9994   3.0100   7.9338   15.013   11.235  -8.9288   11.205   18.465   6.2626   10.903   5.0938 7.561766 8.072611 
1 1 1   15    7  -69 o   44.508   2.5171   82.393   9.0949   85.164   12.775   79.544   12.951   44.827   3.5244   43.225   3.7116 1.602524 5.118312 
1 1 1   15    7  -68 o   15.076   4.8559   9.7330   6.7815   10.771   11.197   9.1316   8.5225   16.711   6.1909   15.198   5.4350 1.512732 8.238097 
1 1 1   15    7  -67 o   52.568   1.8644  113.765   7.9765  102.978   11.884  122.609   10.761   49.636   2.9504   54.387   2.4333 -4.750858 3.824437 
1 1 1   15    7  -66 o   44.564   2.4223   82.337   8.7664   83.769   11.644   80.463   13.319   44.665   3.2198   43.525   3.7919 1.139896 4.974473 
1 1 1   15    7  -65 o   27.918   3.5994   33.217   8.0008   35.131   10.747   30.836   11.984   28.259   4.8394   26.056   5.7923 2.202993 7.547872 
1 1 1   15    7  -64 o   35.775   2.9171   53.488   8.4331   52.715   11.084   54.551   12.995   35.164   3.9343   35.502   4.5985 -0.3382339 6.051838 
1 1 1   15    7  -63 o   13.313   4.9562   6.1286   7.1923   13.405   9.9761  -1.7473   10.379   17.742   5.9003   12.190   5.3702 5.551987 7.978222 
1 1 1   15    7  -62 o   18.399   4.9956   14.990   7.6835   13.665   11.427   16.083   10.381   18.179   6.3107   19.124   5.9902 -0.9451275 8.701016 
1 1 1   15    7  -61 o   23.668   4.0113   24.141   7.4629   40.183   10.548   8.0602   10.561   30.561   4.3573   15.608   5.9623 14.95214 7.384779 
1 1 1   15    7  -60 o   60.686   1.8827  151.247   9.3019  148.975   13.170  153.507   13.140   59.989   2.7002   60.913   2.6527 -0.9236031 3.785185 
1 1 1   15    7  -59 f   61.929   1.9363  157.512   9.7628  159.813   16.740  156.326   12.018   61.922   3.3287   61.569   2.3992 0.3529129 4.103242 
1 1 1   15    7  -58 o   33.827   2.9471   47.668   8.0453   66.639   14.458   39.160   9.6828   39.502   4.5746   30.343   4.0131 9.159864 6.085383 
1 1 1   15    7  -57 o   10.511   4.5470  -0.5348   7.1535   11.027   13.017  -5.5377   8.5624   17.721   6.6533   10.061   4.6123 7.660068 8.095598 
1 1 1   15    7  -56 o   27.033   3.2706   30.689   7.0607   31.614   10.915   30.023   9.2590   26.902   5.1650   26.413   4.4591 0.4893150 6.823519 
1 1 1   15    7  -55 o   40.390   2.3539   67.248   7.7164   57.658   11.854   74.299   10.165   36.985   3.9954   42.327   2.9648 -5.341343 4.975219 
1 1 1   15    7  -54 o   26.215   3.5531   28.988   7.3973   33.124   10.992   25.564   10.001   27.628   5.0674   24.159   5.2303 3.469566 7.282484 
1 1 1   15    7  -53 o   46.456   2.1789   88.702   8.2281   85.731   11.811   91.504   11.469   45.447   3.2087   47.010   3.0088 -1.562714 4.398756 
1 1 1   15    7  -52 o   37.715   2.5532   58.705   7.8029   55.101   11.234   62.066   10.846   36.239   3.8624   38.581   3.4864 -2.342392 5.203148 
1 1 1   15    7  -51 o   16.878   5.0486   12.125   7.4828   20.602   12.053   6.8085   9.5449   21.732   6.3841   14.874   5.6716 6.857812 8.539539 
1 1 1   15    7  -50 o   41.489   2.6792   71.011   9.0124   58.612   15.004   78.010   11.273   37.067   5.1007   43.384   3.2103 -6.316437 6.026911 
1 1 1   15    7  -49 o   39.037   2.6649   62.868   8.4292   60.206   15.232   64.043   10.120   37.600   5.1013   39.302   3.1862 -1.701645 6.014586 
1 1 1   15    7  -48 o   12.655   4.9768   4.0043   7.5217   13.253   13.943   0.2080   8.9330   19.076   6.9346   12.074   5.1497 7.001820 8.637577 
1 1 1   15    7  -47 o   33.576   2.9203   46.669   7.9134   41.263   13.377   49.580   9.8152   30.942   5.5052   34.494   3.5410 -3.552034 6.545680 
1 1 1   15    7  -46 o   58.402   2.2773  139.891   10.821  136.649   15.680  142.838   14.952   57.509   3.3594   58.854   3.1278 -1.344440 4.590052 
1 1 1   15    7  -45 o   77.721   1.9657  247.194   12.444  237.598   17.880  256.207   17.329   76.019   2.8907   78.988   2.6954 -2.969139 3.952374 
1 1 1   15    7  -44 o   15.333   5.6115   8.0679   9.1524   12.184   13.342   4.4098   12.578   18.563   6.7782   15.529   6.3224 3.034150 9.269117 
1 1 1   15    7  -43 o   13.796   5.1785   5.9824   7.8848  -7.7123   13.581   12.946   9.6842   12.936   5.8838   17.841   5.8074 -4.904623 8.267106 
1 1 1   15    7  -42 o   19.979   5.0335   17.226   8.1925   12.890   13.964   19.502   10.117   19.053   6.9378   21.242   5.7172 -2.189293 8.989913 
1 1 1   15    7  -41 o   63.270   2.2301  163.967   11.483  145.712   17.544  177.650   15.189   59.388   3.6416   65.761   2.8402 -6.372597 4.618253 
1 1 1   15    7  -40 o   68.427   2.0203  191.564   11.256  205.268   19.380  184.587   13.828   70.598   3.3774   67.095   2.5329 3.503174 4.221655 
1 1 1   15    7  -39 o   93.661   1.7861  358.334   13.636  399.554   23.234  336.673   16.842   98.683   2.8914   90.695   2.2800 7.988510 3.682165 
1 1 1   15    7  -38 o   77.539   1.9455  245.820   12.287  238.011   20.575  250.147   15.318   76.066   3.3264   78.154   2.4073 -2.087952 4.106038 
1 1 1   15    7  -37 o   66.119   2.0587  178.835   11.082  164.079   18.467  187.139   13.854   63.085   3.6062   67.577   2.5195 -4.491501 4.399130 
1 1 1   15    7  -36 o   14.749   5.4078   7.2994   8.5059   14.833   15.223   3.8797   10.256   20.223   7.2600   14.221   5.7383 6.002537 9.253971 
1 1 1   15    7  -35 o   87.041   1.7829  309.368   12.650  302.723   21.140  313.074   15.789   85.896   3.0239   87.487   2.2158 -1.591881 3.748801 
1 1 1   15    7  -34 o  115.991   1.6689  549.229   15.780  541.019   25.647  554.231   20.017  114.965   2.7368  116.462   2.1085 -1.497406 3.454842 
1 1 1   15    7  -33 o  147.264   1.8119  885.525   21.750  876.668   31.533  893.563   30.040  146.374   2.6429  147.809   2.4932 -1.435593 3.633293 
1 1 1   15    7  -32 o  154.209   1.6568  970.687   20.827  976.769   33.654  966.911   26.514  154.506   2.6721  153.837   2.1144 0.6696167 3.407454 
1 1 1   15    7  -31 o   11.920   5.0708   0.1321   8.6222 -22.5769   17.790   7.1041   9.8573   12.872   6.1340   15.298   5.7797 -2.425189 8.427991 
1 1 1   15    7  -30 o   75.931   2.0166  235.648   12.471  235.776   20.064  235.568   15.919   75.782   3.2556   75.851   2.5784 -0.6903076E-01 4.152940 
1 1 1   15    7  -29 f   32.301   3.5433   43.297   9.1765   38.134   15.476   46.097   11.396   29.708   6.5656   33.205   4.3121 -3.497019 7.855033 
1 1 1   15    7  -28 o   74.547   2.2409  227.264   13.602  193.875   26.187  239.600   15.917   68.437   4.7232   76.507   2.5559 -8.070282 5.370403 
1 1 1   15    7  -27 o  156.892   1.8016  1004.82   23.041  1082.89   45.268  977.520   26.767  162.544   3.4166  154.699   2.1226 7.844742 4.022242 
1 1 1   15    7  -26 o   58.242   2.3389  138.833   11.082  167.866   25.057  131.773   12.356   63.643   4.8669   56.702   2.6808 6.941372 5.556357 
1 1 1   15    7  -25 o  120.010   1.9876  588.076   19.444  496.393   33.834  633.287   23.759  109.933   3.7813  124.494   2.3413 -14.56052 4.447426 
1 1 1   15    7  -24 o  160.243   1.8099  1048.11   23.641  1028.06   34.795  1065.30   32.220  158.561   2.6921  161.453   2.4482 -2.892197 3.638811 
1 1 1   15    7  -23 o   20.430   5.2512   17.868   8.7924   10.738   16.500   20.695   10.391   19.357   7.4378   21.972   5.7395 -2.615681 9.394831 
1 1 1   15    7  -22 o   36.897   3.1842   56.140   9.4832   65.038   18.067   52.756   11.141   39.252   5.8229   35.652   3.8971 3.600441 7.006697 
1 1 1   15    7  -21 o   47.272   2.6002   91.618   9.9811   93.143   18.460   90.988   11.865   47.326   4.8538   47.049   3.1112 0.2761688 5.765309 
1 1 1   15    7  -20 o  111.749   1.7494  509.633   15.936  536.944   29.218  498.068   19.013  114.499   3.1334  110.441   2.1119 4.057533 3.778703 
1 1 1   15    7  -19 o  160.754   1.7772  1054.64   23.288  1058.34   41.569  1052.94   28.114  160.804   3.1713  160.576   2.1478 0.2283783 3.830150 
1 1 1   15    7  -18 o  114.588   1.7527  535.839   16.372  551.744   29.608  528.835   19.649  116.073   3.1321  113.803   2.1181 2.269768 3.781091 
1 1 1   15    7  -17 o   75.276   1.8946  231.438   11.616  206.849   19.227  245.572   14.577   71.002   3.3314   77.503   2.3100 -6.501656 4.053882 
1 1 1   15    7  -16 o  119.462   1.6573  582.301   16.139  594.898   26.835  575.163   20.201  120.632   2.7290  118.689   2.0879 1.943687 3.436147 
1 1 1   15    7  -15 o   91.147   1.7742  339.034   13.182  353.938   22.499  331.245   16.266   92.976   2.9725   90.062   2.2156 2.913879 3.707347 
1 1 1   15    7  -14 o  221.411   1.8617  2000.80   33.601  1915.61   51.709  2063.06   44.205  216.426   2.9310  224.725   2.4132 -8.298508 3.796602 
1 1 1   15    7  -13 o   66.893   2.0374  182.844   11.097  177.245   19.378  185.576   13.536   65.676   3.6339   67.352   2.4696 -1.675453 4.393643 
1 1 1   15    7  -12 o   48.526   2.6228   96.509   10.336  106.388   21.116   93.396   11.853   50.568   5.1966   47.685   3.0656 2.882671 6.033491 
1 1 1   15    7  -11 o  115.602   1.6370  545.237   15.426  536.536   24.796  550.731   19.702  114.579   2.6548  116.146   2.0810 -1.566498 3.373236 
1 1 1   15    7  -10 o   40.528   2.8187   67.468   9.2539   73.452   15.529   64.174   11.523   42.036   4.6074   39.417   3.6270 2.619144 5.863689 
1 1 1   15    7   -9 o   48.089   2.7890   94.847   10.886  110.597   16.268   82.077   14.649   51.801   3.8808   44.552   4.0789 7.249043 5.630131 
1 1 1   15    7   -8 o   39.582   3.1271   64.486   10.008   60.072   14.140   68.915   14.166   37.958   4.6682   40.752   4.3306 -2.794243 6.367561 
1 1 1   15    7   -7 o  110.802   1.7411  500.954   15.725  501.542   21.769  500.313   22.741  110.810   2.4100  110.663   2.5210 0.1471252 3.487623 
1 1 1   15    7   -6 o   33.757   3.2419   47.050   8.8113   54.467   14.159   42.363   11.257   36.066   4.9462   31.819   4.4624 4.246826 6.661662 
1 1 1   15    7   -5 o  120.434   1.5625  591.693   15.339  584.697   22.904  597.383   20.656  119.652   2.3483  120.968   2.0948 -1.316177 3.146863 
1 1 1   15    7   -4 f  115.115   1.5825  540.595   14.850  552.387   22.467  531.447   19.789  116.297   2.3699  114.094   2.1278 2.202728 3.184951 
1 1 1   15    7   -3 o  151.718   1.5724  939.024   19.446  945.655   28.871  933.517   26.309  152.171   2.3275  151.215   2.1344 0.9558258 3.158017 
1 1 1   15    7   -2 o   72.686   1.9697  215.794   11.660  210.784   19.530  218.570   14.534   71.689   3.3513   73.110   2.4422 -1.420578 4.146744 
1 1 1   15    7   -1 o  156.747   1.7943  1002.58   22.926  1061.86   34.016  953.238   31.034  161.212   2.5885  152.758   2.4923 8.454498 3.593325 
1 1 1   15    7    0 o  136.077   1.6857  755.483   18.699  776.065   26.049  733.606   26.857  137.854   2.3182  134.013   2.4585 3.840454 3.379066 
1 1 1   15    7    1 o  125.156   1.8298  639.209   18.667  646.843   24.139  627.852   29.444  125.851   2.3530  123.923   2.9148 1.928223 3.746015 
1 1 1   15    7    2 o   89.519   1.8362  327.022   13.399  340.013   19.221  314.740   18.688   91.188   2.5885   87.728   2.6163 3.460327 3.680388 
1 1 1   15    7    3 o  124.343   1.7724  630.887   17.964  691.448   26.888  582.055   24.144  130.096   2.5355  119.368   2.4813 10.72809 3.547611 
1 1 1   15    7    4 f  130.725   1.6353  697.192   17.426  695.437   27.252  698.406   22.665  130.467   2.5624  130.794   2.1258 -0.3275146 3.329467 
1 1 1   15    7    5 o  108.863   1.6044  483.481   14.237  452.351   21.017  509.881   19.355  105.233   2.4501  111.755   2.1247 -6.522339 3.243022 
1 1 1   15    7    6 o   73.893   1.9050  222.990   11.465  246.061   18.562  208.761   14.578   77.519   2.9429   71.441   2.5071 6.077972 3.866053 
1 1 1   15    7    7 o  138.952   1.6321  787.711   18.486  770.019   28.793  800.118   24.113  137.281   2.5730  139.995   2.1130 -2.713715 3.329448 
1 1 1   15    7    8 o   68.398   1.9950  191.124   11.111  185.796   17.838  194.501   14.203   67.304   3.2611   68.952   2.5312 -1.647102 4.128170 
1 1 1   15    7    9 o   19.797   5.3503   16.686   8.8378   5.1746   14.628   23.303   11.091   16.896   6.8403   23.310   5.8476 -6.414351 8.999075 
1 1 1   15    7   10 o  166.489   1.6779  1130.96   22.772  1083.36   34.805  1166.58   30.110  162.822   2.6224  169.028   2.1854 -6.206268 3.413594 
1 1 1   15    7   11 o  118.304   1.7968  571.141   17.327  538.417   24.823  602.237   24.198  114.780   2.6531  121.417   2.4449 -6.636955 3.607830 
1 1 1   15    7   12 o  102.073   2.0449  425.337   17.014  459.361   29.084  407.635   20.979  105.876   3.3743   99.845   2.5798 6.030495 4.247466 
1 1 1   15    7   13 o  138.818   2.4823  787.317   28.088   0.0000   0.0000  787.317   28.088  ?   ?   138.818   2.4823 0.000000 2.482251 
1 1 1   15    7   14 o   13.289   5.7580  -1.5057   11.508 -12.0998   31.621   0.1118   12.356   20.529   9.1889   14.241   6.0644 6.288394 11.00967 
1 1 1   15    7   15 o   62.594   2.1177  160.159   10.790  162.746   17.715  158.633   13.605   62.945   3.4659   62.239   2.6879 0.7055817 4.386038 
1 1 1   15    7   16 o  115.625   1.6611  545.503   15.656  568.297   25.359  531.463   19.902  117.916   2.6383  114.086   2.1401 3.830521 3.397124 
1 1 1   15    7   17 o  127.319   1.6430  661.416   17.052  678.851   27.320  650.288   21.825  128.880   2.6005  126.197   2.1216 2.682198 3.356200 
1 1 1   15    7   18 o   36.954   3.1668   56.293   9.4474   57.017   15.642   55.878   11.853   36.812   5.3712   36.688   4.0298 0.1235008 6.714794 
1 1 1   15    7   19 o  151.285   1.7863  934.070   22.029  958.317   32.366  913.142   30.069  153.124   2.5930  149.491   2.4676 3.632904 3.579468 
1 1 1   15    7   20 o  103.247   1.7052  435.002   14.351  483.763   23.185  404.716   18.272  108.789   2.6144   99.542   2.2518 9.247284 3.450505 
1 1 1   15    7   21 o   91.968   1.8999  345.267   14.243  346.355   26.807  344.840   16.812   91.862   3.5869   91.883   2.2447 -0.2104950E-01 4.231340 
1 1 1   15    7   22 o   78.494   1.8628  251.500   11.919  240.042   19.440  258.402   15.087   76.518   3.1234   79.496   2.3308 -2.978249 3.897148 
1 1 1   15    7   23 o  113.035   1.6738  521.402   15.423  499.207   24.277  536.419   19.970  110.494   2.6954  114.606   2.1376 -4.112572 3.440138 
1 1 1   15    7   24 o   95.722   1.8649  374.034   14.551  381.363   27.161  371.083   17.233   96.409   3.4618   95.313   2.2180 1.096756 4.111417 
1 1 1   15    7   25 o   92.502   2.0000  349.386   15.080  350.954   34.512  349.016   16.766   92.232   4.6049   92.432   2.2252 -0.1997986 5.114380 
1 1 1   15    7   26 o   76.611   2.1455  239.921   13.385  222.744   30.854  243.904   14.856   73.284   5.1986   77.221   2.3629 -3.936600 5.710454 
1 1 1   15    7   27 o   62.386   2.3982  159.301   12.173  205.375   29.013  149.457   13.411   70.371   5.0922   60.386   2.7315 9.984322 5.778586 
1 1 1   15    7   28 o   56.097   2.6109  128.964   11.906  146.406   19.730  118.974   14.932   59.553   4.0891   53.766   3.4247 5.786701 5.333786 
1 1 1   15    7   29 f   98.426   2.0106  395.652   16.132  386.052   25.748  401.855   20.697   97.010   3.2607   99.099   2.5643 -2.088799 4.148244 
1 1 1   15    7   30 o   36.375   4.0718   55.051   11.867   47.624   17.665   61.159   16.019   33.225   6.7528   38.113   5.2994 -4.888176 8.583925 
1 1 1   15    7   31 o   81.502   2.3286  271.737   15.454  258.251   22.538  283.705   21.232   79.268   3.4967   83.156   3.1379 -3.887833 4.698222 
1 1 1   15    7   32 o  138.452   2.1490  783.248   24.254  781.470   34.805  784.926   33.816  138.108   3.0916  138.435   2.9967 -0.3267975 4.305623 
1 1 1   15    7   33 o   92.986   2.0355  353.224   15.428  344.197   25.551  358.405   19.355   91.531   3.4306   93.570   2.5400 -2.039368 4.268574 
1 1 1   15    7   34 o  118.765   2.1650  576.441   20.959  559.115   43.441  581.698   23.929  116.331   4.5901  119.258   2.4615 -2.927055 5.208471 
1 1 1   15    7   35 o   34.159   3.9215   48.606   10.722   57.711   18.698   44.146   13.087   36.664   6.4939   32.276   5.1468 4.387798 8.286215 
1 1 1   15    7   36 o   33.705   4.7962   47.856   12.806   37.870   18.613   56.832   17.647   29.412   7.6813   36.451   6.1582 -7.039272 9.845067 
1 1 1   15    7   37 o   51.094   2.8900  107.309   11.987  111.332   20.875  105.329   14.642   51.615   5.0250   50.505   3.5798 1.110638 6.169765 
1 1 1   15    7   38 o   48.531   3.1092   97.003   12.235   88.941   21.332  100.956   14.937   45.852   5.8396   49.402   3.7369 -3.550335 6.932923 
1 1 1   15    7   39 o   66.245   2.4997  179.889   13.474  196.846   23.570  171.658   16.422   68.948   4.2139   64.604   3.1276 4.343506 5.247756 
1 1 1   15    7   40 o   65.954   2.5040  178.350   13.438  156.870   23.249  189.126   16.467   61.385   4.6816   67.837   2.9853 -6.451954 5.552405 
1 1 1   15    7   41 o  107.385   1.9912  471.396   17.430  466.668   29.057  474.053   21.785  106.504   3.3511  107.598   2.4838 -1.094322 4.171224 
1 1 1   15    7   42 o   63.789   2.4194  166.839   12.557  142.461   21.249  179.920   15.566   58.498   4.4905   66.163   2.8932 -7.664688 5.341835 
1 1 1   15    7   43 o   78.987   2.4990  255.822   16.070  228.574   22.933  282.110   22.525   74.360   3.7959   82.755   3.3460 -8.395103 5.060112 
1 1 1   15    7   44 o   57.195   2.4795  134.268   11.533  172.123   20.036  115.514   14.103   64.478   3.8294   52.897   3.2869 11.58112 5.046597 
1 1 1   15    7   45 o   59.947   2.3785  147.426   11.599  134.740   19.995  153.860   14.241   56.868   4.3463   61.155   2.8646 -4.286694 5.205442 
1 1 1   15    7   46 o   17.606   5.6042   12.822   9.0524   1.6834   15.556   18.525   11.131   16.143   6.8368   20.774   6.1438 -4.630474 9.191773 
1 1 1   15    7   47 o   59.249   2.5854  144.274   12.457  135.878   19.188  150.391   16.377   57.122   4.1491   60.329   3.3433 -3.207470 5.328497 
1 1 1   15    7   48 o   59.103   2.8859  143.914   13.862  164.936   26.324  135.849   16.305   62.557   5.2095   57.271   3.5095 5.285477 6.281349 
1 1 1   15    7   49 o   73.845   2.5549  224.073   15.356  238.306   28.306  218.138   18.280   75.473   4.6232   72.723   3.0907 2.750153 5.561147 
1 1 1   15    7   50 o   28.543   4.9022   34.984   10.995   35.227   20.969   34.892   12.912   28.026   8.4667   28.255   5.8006 -0.2291679 10.26319 
1 1 1   15    7   51 o   63.186   2.2666  163.920   11.655  189.455   20.209  151.192   14.267   67.543   3.6844   60.539   2.8996 7.004562 4.688576 
1 1 1   15    7   52 o   31.746   3.6228   42.260   9.2072   36.522   15.580   45.340   11.414   28.590   6.7872   32.691   4.3944 -4.100889 8.085601 
1 1 1   15    7   53 o   40.488   3.5121   68.380   11.477   60.676   17.090   74.708   15.489   37.385   5.7954   42.003   4.5988 -4.617321 7.398348 
1 1 1   15    7   54 o   62.238   2.6424  159.683   13.375  164.262   19.041  155.222   18.793   62.774   3.7380   60.994   3.7987 1.779842 5.329428 
1 1 1   15    7   55 o   46.300   3.1995   89.076   12.001  101.963   17.910   78.573   16.168   49.102   4.5255   42.995   4.6891 6.106453 6.516697 
1 1 1   15    7   56 o   29.710   3.9614   37.434   9.3548   31.776   16.043   40.350   11.515   26.428   7.2363   30.611   4.7702 -4.183445 8.667089 
1 1 1   15    7   57 o   72.848   2.0845  217.984   12.366  210.666   20.904  221.923   15.336   71.060   3.6208   73.357   2.5687 -2.297058 4.439467 
1 1 1   15    7   58 o   19.809   5.2615   17.338   8.6385   19.595   14.364   16.059   10.812   21.296   7.0799   19.278   6.1235 2.018330 9.360614 
1 1 1   15    7   59 f   14.403   5.4190   6.9454   8.6452   11.751   14.261   4.1531   10.870   18.294   6.9427   14.351   5.8643 3.943466 9.087948 
1 1 1   15    7   60 o   53.053   2.3796  116.167   10.265  111.055   16.617  119.321   13.053   51.288   4.0064   53.575   3.0008 -2.287186 5.005664 
1 1 1   15    7   61 o   29.137   3.7811   36.115   8.7688   26.923   14.626   41.273   10.956   24.197   7.0115   30.937   4.4743 -6.739828 8.317514 
1 1 1   15    7   62 o   33.353   3.4865   46.934   9.3392   85.078   17.334   31.333   11.086   44.395   4.8698   26.563   5.3056 17.83182 7.201741 
1 1 1   15    7   63 o   91.770   1.8453  345.748   13.804  325.086   21.085  361.247   18.262   88.455   2.9283   93.542   2.3969 -5.087273 3.784232 
1 1 1   15    7   64 o   13.986   5.4733   5.7621   9.0599   8.4296   13.453   3.5480   12.256   16.731   6.6318   14.697   6.1365 2.034018 9.035381 
1 1 1   15    7   65 o   36.806   3.7846   57.602   11.193   48.439   19.573   62.055   13.644   31.815   7.6432   37.901   4.5043 -6.085751 8.871696 
1 1 1   15    7   66 o   17.836   5.6249   14.012   9.1379   11.900   18.604   14.683   10.491   19.257   7.7432   18.338   6.0487 0.9190388 9.825700 
1 1 1   15    7   67 o   12.066   5.1225   1.2189   8.7690 -12.1740   17.744   5.5467   10.087   13.799   6.4349   14.299   5.7180 -0.5000525 8.608344 
1 1 1   15    7   68 o   28.140   3.8342   34.065   8.5662   40.952   14.346   30.248   10.679   29.830   6.1055   25.928   5.2334 3.902063 8.041436 
1 1 1   15    7   69 o   29.413   3.6514   37.042   8.5666   38.035   14.109   36.462   10.782   28.614   6.2262   28.710   4.7745 -0.9642029E-01 7.846163 
1 1 1   15    7   70 o   21.481   4.9076   20.793   8.4048   11.237   13.358   27.055   10.813   17.430   6.6936   24.292   5.5787 -6.862289 8.713602 
1 1 1   15    7   71 o   29.342   3.7015   36.986   8.6565   28.670   14.036   42.091   10.997   24.485   6.7938   30.979   4.4851 -6.494289 8.140804 
1 1 1   15    7   72 o   21.373   4.8851   20.645   8.3245   17.470   13.659   22.521   10.500   19.740   6.8967   22.022   5.7779 -2.282505 8.997160 
1 1 1   15    7   73 o   24.538   4.8110   27.051   9.2789   23.100   18.803   28.322   10.668   22.176   8.0542   24.841   5.4212 -2.665028 9.708742 
1 1 1   15    7   74 o   29.726   3.6676   38.081   8.6987   51.267   14.622   30.858   10.822   33.505   5.5476   25.976   5.2909 7.529509 7.666135 
1 1 1   15    7   75 o   36.183   3.0663   55.424   8.9588   50.772   14.658   58.197   11.319   33.241   5.6090   36.707   3.8397 -3.465946 6.797361 
1 1 1   15    7   76 o   29.125   3.7446   36.808   8.6845   45.448   14.356   31.822   10.906   31.168   5.8658   26.297   5.2717 4.871107 7.886628 
1 1 1   15    7   77 o   15.920   5.3542   11.197   8.2120  -7.2608   13.808   21.299   10.215   12.465   5.7658   21.175   5.7644 -8.709512 8.153112 
1 1 1   15    7   78 o   21.804   4.4333   21.510   7.6107   14.598   11.617   26.707   10.073   17.927   6.3524   23.902   5.3083 -5.974871 8.278328 
1 1 1   15    7   79 o   38.426   3.9603   64.707   12.227   53.881   14.513   91.185   22.697   34.042   5.4110   43.184   6.6619 -9.141525 8.582506 
1 1 1   15    7   80 o   19.042   5.9370   17.515   10.209   36.097   13.560  -6.8014   15.512   27.048   6.2724   13.162   6.0960 13.88669 8.746689 
1 1 1   15    7   81 o   22.074   4.4583   22.333   7.7454   14.644   12.812   26.763   9.7234   17.820   6.6186   23.805   5.1599 -5.985689 8.392302 
1 1 1   15    7   82 f   34.175   3.1949   50.401   8.7972   33.183   13.325   63.703   11.713   25.580   6.4053   38.009   3.8326 -12.42922 7.464396 
1 1 1   15    7   83 o   16.601   5.2771   13.076   8.0288   2.5668   12.241   21.011   10.636   13.619   5.9196   20.471   5.9928 -6.851465 8.423439 
1 1 1   15    7   84 o   38.723   3.7270   66.238   11.619   57.063   13.119   99.612   25.022   35.150   4.6962   43.279   7.3554 -8.129799 8.726726 
1 1 1   15    7   85 o   21.450   6.4085   24.150   12.062   26.476   14.187   18.080   22.916   21.998   7.0173   19.340   8.2483 2.657772 10.82946 
1 1 1   15    7   86 o   25.182   5.9747   32.404   12.078   24.896   14.233   51.720   22.830   21.183   7.0477   28.240   8.8888 -7.056633 11.34375 
1 1 1   15    7   87 o   10.588   5.1152 -14.4984   13.363 -14.4984   13.363   0.0000   0.0000   10.588   5.1152  ?   ?  0.000000 5.115201 
1 1 1   15    7   88 o   11.818   5.3977  -2.4378   11.582   1.5959   13.336 -14.8241   23.369   13.431   5.9926   14.062   6.7862 -0.6308270 9.053414 
1 1 1   15    7   89 o   31.158   4.6201   45.890   11.379   38.032   12.637   79.570   26.163   27.188   5.8739   34.653   9.1344 -7.465202 10.86007 
1 1 1   15    7   90 o   19.848   6.1095   21.065   10.851   20.370   12.115   23.884   24.404   19.282   6.5032   19.779   8.4756 -0.4975014 10.68305 
1 1 1   15    7   91 o   19.623   6.5232   21.336   12.194   21.336   12.194   0.0000   0.0000   19.623   6.5232  ?   ?  0.000000 6.523160 
1 1 1   15    7   92 o   29.972   6.4374   48.541   15.258   48.541   15.258   0.0000   0.0000   29.972   6.4374  ?   ?  0.000000 6.437437 
1 1 1   15    7   93 o   14.657   6.1022   8.4451   12.068   8.4451   12.068   0.0000   0.0000   14.657   6.1022  ?   ?  0.000000 6.102239 
1 1 1   15    7   94 o   12.384   5.6188  -0.3660   12.293  -0.3660   12.293   0.0000   0.0000   12.384   5.6188  ?   ?  0.000000 5.618811 
1 1 1   15    7   95 o   13.311   5.9013   3.1273   12.723   3.1273   12.723   0.0000   0.0000   13.311   5.9013  ?   ?  0.000000 5.901268 
1 1 1   15    7   96 o   17.978   7.0903   18.621   15.306   18.621   15.306   0.0000   0.0000   17.978   7.0903  ?   ?  0.000000 7.090277 
1 1 1   15    7   97 o   19.821   6.7332   23.144   12.987   26.188   15.330   15.402   24.447   20.449   7.2918   17.539   7.9442 2.910133 10.78334 
1 1 1   15    7   98 o   20.146   6.6414   23.819   12.648   10.396   14.923   58.053   23.831   15.510   6.6365   27.561   9.1178 -12.05053 11.27727 
1 1 1   15    7   99 o   12.448   5.6775  -0.1385   12.757   3.5509   15.363  -8.3328   22.896   13.987   6.3202   14.037   6.7598 -0.5001259E-01 9.254176 
1 1 1   15    7  100 o   11.472   5.3839  -4.9939   12.756  -8.6667   15.648   2.2806   22.022   11.965   5.7156   15.099   7.0823 -3.134522 9.100976 
1 1 1   15    7  101 f   15.781   6.3815   12.764   12.715   8.7775   15.138   22.318   23.433   14.995   6.5492   18.353   8.0780 -3.357951 10.39938 
1 1 1   15    7  102 o   14.530   6.5425   5.6126   16.297   9.1683   23.937   2.5406   22.250   16.269   7.5482   15.127   7.1028 1.141973 10.36459 
1 1 1   15    7  103 o   23.579   9.0586   46.321   24.471   0.0000   0.0000   46.321   24.471  ?   ?    23.579   9.0586 0.000000 9.058642 
1 1 1   15    8  -99 o   22.760   9.1577   45.809   26.040   45.809   26.040   0.0000   0.0000   22.760   9.1577  ?   ?  0.000000 9.157706 
1 1 1   15    8  -98 o   15.800   7.5142   3.7172   26.430   3.7172   26.430   0.0000   0.0000   15.800   7.5142  ?   ?  0.000000 7.514208 
1 1 1   15    8  -95 o   17.305   7.9865   14.511   26.279   14.511   26.279   0.0000   0.0000   17.305   7.9865  ?   ?  0.000000 7.986526 
1 1 1   15    8  -94 o   17.054   7.8881   12.318   25.842   12.318   25.842   0.0000   0.0000   17.054   7.8881  ?   ?  0.000000 7.888058 
1 1 1   15    8  -93 f   13.686   6.6962 -17.1324   24.951 -17.1324   24.951   0.0000   0.0000   13.686   6.6962  ?   ?  0.000000 6.696228 
1 1 1   15    8  -92 o   21.855   9.2145   40.415   28.051   40.415   28.051   0.0000   0.0000   21.855   9.2145  ?   ?  0.000000 9.214462 
1 1 1   15    8  -91 o   22.244   9.0646   39.832   25.886   39.832   25.886   0.0000   0.0000   22.244   9.0646  ?   ?  0.000000 9.064601 
1 1 1   15    8  -90 o   23.529   7.8567   36.138   17.685   36.138   17.685   0.0000   0.0000   23.529   7.8567  ?   ?  0.000000 7.856653 
1 1 1   15    8  -89 o   16.464   7.0284   12.424   16.667   12.424   16.667   0.0000   0.0000   16.464   7.0284  ?   ?  0.000000 7.028358 
1 1 1   15    8  -88 o   13.215   6.1852  -4.2273   16.643  -4.2273   16.643   0.0000   0.0000   13.215   6.1852  ?   ?  0.000000 6.185158 
1 1 1   15    8  -87 o   27.843   7.7745   47.503   18.318   47.503   18.318   0.0000   0.0000   27.843   7.7745  ?   ?  0.000000 7.774465 
1 1 1   15    8  -86 o   15.764   6.3521   11.255   12.549   24.748   16.509  -7.2113   19.313   20.273   7.5162   13.689   6.4851 6.583579 9.927223 
1 1 1   15    8  -85 o   19.077   6.3957   19.780   11.718   22.253   16.412   17.208   16.737   19.532   7.4396   18.017   7.3085 1.515043 10.42889 
1 1 1   15    8  -84 o   13.595   5.8205   4.8262   11.491  -7.4263   16.480   16.421   16.031   12.834   6.0528   17.835   7.1821 -5.001787 9.392563 
1 1 1   15    8  -83 o   12.971   5.6444   2.9024   11.156  -6.4055   15.365   13.280   16.223   12.636   5.9232   17.064   7.0874 -4.428152 9.236645 
1 1 1   15    8  -82 o   14.291   6.0587   6.0110   12.238 -12.0123   16.273   29.476   18.568   12.203   5.8293   22.000   8.0018 -9.796974 9.899934 
1 1 1   15    8  -81 o   20.099   6.4716   21.370   12.046   24.321   16.143   17.661   18.094   20.768   7.4736   18.712   7.5959 2.055889 10.65607 
1 1 1   15    8  -80 o   17.566   6.3975   15.103   11.874   11.040   15.673   20.578   18.193   16.761   6.9644   19.721   7.7446 -2.959881 10.41544 
1 1 1   15    8  -79 o   21.803   6.4690   24.703   12.325   33.248   16.509   13.945   18.524   24.387   7.5410   18.119   7.5533 6.268393 10.67330 
1 1 1   15    8  -78 o   22.833   8.0718   29.654   18.748   0.0000   0.0000   29.654   18.748  ?   ?    22.833   8.0718 0.000000 8.071823 
1 1 1   15    8  -77 o   14.726   6.0507   6.8159   11.653   8.5783   15.826   4.7282   17.224   16.432   6.9243   15.893   6.9626 0.5390368 9.819571 
1 1 1   15    8  -76 o   18.968   5.7974   17.458   9.7926   16.804   15.841   17.862   12.458   18.939   7.2851   19.083   6.5912 -0.1446362 9.824265 
1 1 1   15    8  -75 o   10.576   4.9407  -7.3863   10.537  -5.2697   23.290  -7.9311   11.816   16.128   7.4699   11.187   5.2280 4.941302 9.117645 
1 1 1   15    8  -74 f   19.214   4.8813   17.157   7.6592   8.5038   15.372   20.015   8.8337   16.592   6.8958   20.610   5.2456 -4.018656 8.664211 
1 1 1   15    8  -73 o   10.661   4.6314   0.0310   7.4856  -2.0578   14.804   0.7486   8.6767   13.903   6.2499   11.624   5.0182 2.278429 8.015218 
1 1 1   15    8  -72 f   25.564   4.5779   29.436   9.1892   30.504   13.560   28.529   12.496   24.900   6.5821   24.242   6.2752 0.6577206 9.094051 
1 1 1   15    8  -71 o   12.115   5.1500   1.6960   8.8828 -10.1053   13.031   11.938   12.140   11.583   5.4378   17.085   6.4230 -5.501859 8.415781 
1 1 1   15    8  -70 o   14.651   5.0141   9.0788   7.2045   16.439   12.760   5.6344   8.7290   19.027   6.6645   13.542   5.3502 5.485889 8.546372 
1 1 1   15    8  -69 o   18.819   4.4967   15.966   6.8037   23.727   10.605   10.538   8.8695   22.500   5.7588   15.819   5.5553 6.681636 8.001537 
1 1 1   15    8  -68 o   10.555   4.4858   0.8542   6.7359  -3.6523   10.679   3.8322   8.6808   11.685   5.2757   12.852   5.2448 -1.167005 7.439192 
1 1 1   15    8  -67 o   19.848   4.4483   17.627   7.0183   20.446   10.885   15.622   9.1815   20.922   6.0446   18.510   5.6048 2.412491 8.243234 
1 1 1   15    8  -66 o   27.305   3.2838   31.768   7.1625   34.400   10.995   29.828   9.4406   27.667   5.0616   25.908   4.6406 1.758497 6.866970 
1 1 1   15    8  -65 o   25.645   3.5180   28.224   7.1606   28.614   10.794   27.917   9.5693   25.030   5.4456   24.964   4.8776 0.6644058E-01 7.310628 
1 1 1   15    8  -64 o   27.766   3.2177   32.733   7.1480   30.666   10.876   34.304   9.4840   26.020   5.3076   28.019   4.2886 -1.999136 6.823744 
1 1 1   15    8  -63 o   28.526   3.3408   34.601   7.6212   34.624   12.487   34.588   9.6208   27.502   5.7553   28.138   4.3335 -0.6356735 7.204335 
1 1 1   15    8  -62 o   42.081   2.6069   73.739   8.8983   56.109   13.463   87.412   11.857   35.806   4.7282   45.589   3.2112 -9.782375 5.715602 
1 1 1   15    8  -61 o   36.622   2.9417   56.204   8.7079   47.208   16.507   59.674   10.250   31.870   6.5722   37.580   3.3823 -5.709635 7.391483 
1 1 1   15    8  -60 o   34.948   3.1210   51.346   8.7976   58.802   14.834   47.301   10.927   36.539   5.1209   33.155   4.1324 3.383942 6.580319 
1 1 1   15    8  -59 o   25.861   3.6801   28.634   7.5391   27.835   10.916   29.362   10.424   24.818   5.5368   25.649   5.1648 -0.8312149 7.571714 
1 1 1   15    8  -58 o   67.696   1.8346  188.345   10.114  180.844   14.353  195.743   14.255   66.027   2.6724   68.751   2.5480 -2.724167 3.692405 
1 1 1   15    8  -57 o   73.465   1.6937  221.348   10.143  227.874   15.186  216.092   13.629   74.222   2.5136   72.357   2.3136 1.865051 3.416300 
1 1 1   15    8  -56 o   56.783   1.9122  132.568   8.8383  143.754   13.520  124.221   11.679   58.834   2.8274   54.753   2.6245 4.080688 3.857756 
1 1 1   15    8  -55 o   28.683   3.2057   34.626   7.3672   19.548   11.150   46.310   9.8149   20.862   6.1435   33.062   3.7056 -12.19949 7.174494 
1 1 1   15    8  -54 o   16.875   5.0634   12.375   7.5179   23.389   12.981   6.8160   9.2220   22.699   6.6134   14.562   5.5693 8.137719 8.646055 
1 1 1   15    8  -53 o   45.525   2.3277   85.540   8.6093   84.903   14.560   85.882   10.676   44.803   4.0297   45.461   2.8958 -0.6582870 4.962311 
1 1 1   15    8  -52 o   39.099   2.6026   63.326   8.2476   64.793   13.711   62.494   10.324   38.988   4.3905   38.650   3.3088 0.3383675 5.497669 
1 1 1   15    8  -51 o   27.933   3.4679   32.914   7.7266   14.316   12.896   43.329   9.6506   18.914   6.6937   32.016   3.7701 -13.10215 7.682372 
1 1 1   15    8  -50 o   54.826   2.4007  123.887   10.703  128.984   15.732  119.495   14.603   55.608   3.4884   53.559   3.3619 2.048405 4.844652 
1 1 1   15    8  -49 o   25.009   4.5383   27.041   8.9113   40.013   13.122   15.936   12.140   30.212   5.5319   19.491   6.5095 10.72153 8.542596 
1 1 1   15    8  -48 o   58.534   2.2639  140.907   10.782  136.947   15.461  144.656   15.043   57.409   3.3180   59.067   3.1355 -1.658409 4.565084 
1 1 1   15    8  -47 o   49.118   2.2136   99.213   8.8402   90.232   14.838  104.155   11.007   46.379   3.9629   50.222   2.6986 -3.842983 4.794419 
1 1 1   15    8  -46 o   61.581   1.9468  155.508   9.7603  159.998   16.450  153.069   12.126   62.126   3.2596   60.988   2.4440 1.137600 4.074105 
1 1 1   15    8  -45 o   27.561   3.6193   31.996   7.9351   23.408   13.526   36.502   9.7984   23.026   6.7627   29.310   4.2228 -6.283846 7.972771 
1 1 1   15    8  -44 o   13.567   5.1277   5.7862   7.7608   29.997   15.575  -2.2100   8.9511   25.895   7.1459   11.293   4.9807 14.60164 8.710384 
1 1 1   15    8  -43 o   27.197   4.0954   31.387   8.7981   53.404   16.375   22.452   10.432   35.047   5.9440   22.613   5.6703 12.43374 8.214793 
1 1 1   15    8  -42 o   22.967   4.7212   22.802   8.5431   22.973   15.895   22.733   10.131   23.139   7.4326   22.787   5.5142 0.3516464 9.254679 
1 1 1   15    8  -41 o   28.474   3.6727   34.059   8.3262   22.172   13.599   41.187   10.531   22.594   6.8167   31.214   4.2490 -8.619774 8.032583 
1 1 1   15    8  -40 o   47.765   2.6740   93.971   10.370   89.720   15.057   97.806   14.302   46.362   4.0241   48.520   3.6428 -2.158432 5.428035 
1 1 1   15    8  -39 o   72.739   1.9286  216.605   11.425  196.327   17.449  231.823   15.116   69.001   3.1102   75.147   2.4710 -6.146294 3.972288 
1 1 1   15    8  -38 o   59.616   2.0020  145.577   9.7154  137.634   15.910  150.300   12.268   57.694   3.3981   60.495   2.4932 -2.800591 4.214641 
1 1 1   15    8  -37 o   99.755   1.6576  406.610   13.479  384.933   21.658  420.314   17.220   96.806   2.7474  101.347   2.0845 -4.540565 3.448634 
1 1 1   15    8  -36 o  109.196   1.6377  487.145   14.577  471.449   23.370  497.141   18.650  107.209   2.6742  110.231   2.0755 -3.021568 3.385109 
1 1 1   15    8  -35 o   44.425   2.5126   81.129   9.0617   79.990   15.673   81.702   11.106   43.712   4.4609   44.487   3.0817 -0.7743187 5.421897 
1 1 1   15    8  -34 o   38.456   3.0189   61.099   9.3876   83.764   18.484   53.221   10.898   44.556   5.1862   35.726   3.8003 8.829479 6.429524 
1 1 1   15    8  -33 o   68.609   2.1745  192.781   12.146  208.532   26.372  188.541   13.683   70.782   4.5956   67.800   2.4801 2.982330 5.222059 
1 1 1   15    8  -32 o  116.967   1.8565  559.126   17.700  522.480   34.300  572.428   20.665  112.541   3.7442  118.296   2.1430 -5.755356 4.314056 
1 1 1   15    8  -31 f   77.149   2.1196  243.605   13.317  220.760   27.647  250.508   15.197   72.845   4.6808   78.192   2.3870 -5.347214 5.254284 
1 1 1   15    8  -30 o   96.115   2.2726  377.966   17.805  375.371   31.562  379.178   21.564   95.299   4.0723   96.144   2.7543 -0.8452682 4.916325 
1 1 1   15    8  -29 o  133.288   1.7311  725.650   18.809  746.425   30.829  713.333   23.738  134.947   2.8026  132.063   2.2051 2.883286 3.566150 
1 1 1   15    8  -28 o   64.525   2.3804  170.596   12.499  202.692   20.048  150.192   15.985   70.130   3.5182   60.394   3.2592 9.736748 4.795857 
1 1 1   15    8  -27 o   46.766   2.7529   89.903   10.448  103.901   18.402   83.245   12.692   49.936   4.5714   44.874   3.4973 5.061779 5.755817 
1 1 1   15    8  -26 o   75.846   1.9776  235.228   12.216  254.566   20.740  224.954   15.117   78.692   3.2402   74.096   2.5065 4.595871 4.096516 
1 1 1   15    8  -25 o   46.592   2.9151   89.303   11.016  105.975   24.901   85.246   12.283   50.008   6.2442   45.450   3.3387 4.558201 7.080778 
1 1 1   15    8  -24 o   92.084   1.9322  346.411   14.503  361.256   22.238  335.424   19.132   93.852   2.9103   90.489   2.5964 3.362709 3.900154 
1 1 1   15    8  -23 o   69.712   2.1875  198.849   12.415  186.108   19.186  208.029   16.285   67.229   3.5132   71.215   2.8108 -3.985985 4.499199 
1 1 1   15    8  -22 o   54.819   2.5639  123.234   11.425  111.412   17.711  131.660   14.953   51.838   4.2281   56.563   3.2568 -4.725338 5.336970 
1 1 1   15    8  -21 o  100.405   1.7548  411.630   14.362  393.971   23.311  422.436   18.235   98.028   2.9205  101.662   2.2004 -3.633934 3.656670 
1 1 1   15    8  -20 o   74.715   1.9319  228.164   11.756  239.556   19.776  221.939   14.619   76.376   3.1835   73.626   2.4392 2.750481 4.010539 
1 1 1   15    8  -19 o   61.171   2.1405  153.092   10.657  161.264   18.033  148.707   13.210   62.579   3.5497   60.219   2.6980 2.360081 4.458635 
1 1 1   15    8  -18 o   33.330   3.4431   46.054   9.2200   34.772   16.523   51.155   11.111   28.267   7.1632   35.057   3.9570 -6.790215 8.183464 
1 1 1   15    8  -17 o  107.866   1.6973  474.974   14.924  474.048   24.832  475.497   18.672  107.571   2.8344  107.877   2.1233 -0.3061066 3.541546 
1 1 1   15    8  -16 o   80.875   2.0483  267.361   13.492  281.815   29.877  263.658   15.122   82.591   4.4543   80.280   2.3133 2.311607 5.019135 
1 1 1   15    8  -15 o   92.416   1.9568  348.814   14.741  365.058   22.366  336.337   19.601   94.381   2.9106   90.631   2.6561 3.750336 3.940329 
1 1 1   15    8  -14 o   20.558   5.8534   17.983   10.279   17.785   15.989   18.122   13.420   21.552   7.4660   21.104   6.8339 0.4475327 10.12142 
1 1 1   15    8  -13 o   46.979   3.0007   90.742   11.431   99.530   17.454   84.141   15.126   48.974   4.4198   45.045   4.1668 3.929092 6.074255 
1 1 1   15    8  -12 o   42.741   3.1081   75.217   10.755   97.817   17.449   61.373   13.657   48.542   4.4597   38.360   4.4500 10.18218 6.300130 
1 1 1   15    8  -11 o  160.234   1.8544  1048.29   24.221  1002.93   35.289  1088.69   33.304  156.560   2.7652  163.174   2.5039 -6.613571 3.730380 
1 1 1   15    8  -10 o   53.245   2.6851  116.264   11.617  132.392   19.747  107.730   14.365   56.566   4.3152   51.140   3.4664 5.425827 5.535087 
1 1 1   15    8   -9 f   92.322   2.0159  348.102   15.171  362.789   25.293  339.848   18.961   94.030   3.3050   91.129   2.5550 2.900864 4.177445 
1 1 1   15    8   -8 o  101.288   1.9856  418.966   16.394  419.215   27.146  418.823   20.568  101.090   3.2987  101.213   2.4930 -0.1233444 4.134849 
1 1 1   15    8   -7 o  131.263   1.7541  703.328   18.768  691.931   33.713  708.447   22.594  129.967   3.1822  131.696   2.1046 -1.728287 3.815176 
1 1 1   15    8   -6 o   20.483   5.5895   17.924   9.5905   62.243   22.703   8.2972   10.581   37.908   7.6117   16.123   6.0097 21.78458 9.698169 
1 1 1   15    8   -5 o   20.387   5.5459   17.759   9.4590   44.704   21.424   11.235   10.542   31.992   8.1832   17.374   6.0598 14.61792 10.18264 
1 1 1   15    8   -4 o   73.563   1.9394  221.122   11.619  209.680   19.328  227.597   14.540   71.455   3.3275   74.584   2.3946 -3.129128 4.099578 
1 1 1   15    8   -3 o  124.038   1.7873  628.055   18.072  625.073   27.313  630.377   24.102  123.618   2.7105  124.192   2.3808 -0.5742416 3.607623 
1 1 1   15    8   -2 o  108.369   1.7691  479.381   15.628  473.453   23.166  484.331   21.171  107.596   2.6413  108.859   2.3858 -1.263168 3.559288 
1 1 1   15    8   -1 f   55.839   2.1973  127.577   9.9819  138.753   16.308  120.881   12.623   58.076   3.4605   54.277   2.8631 3.799530 4.491383 
1 1 1   15    8    0 o  128.272   1.6338  671.487   17.083  695.438   27.245  655.971   21.929  130.416   2.5628  126.725   2.1228 3.691116 3.327847 
1 1 1   15    8    1 f  127.108   1.6366  659.355   16.957  653.824   26.644  663.120   21.985  126.450   2.5849  127.414   2.1167 -0.9640503 3.341005 
1 1 1   15    8    2 o  183.121   1.7173  1368.71   25.635  1405.02   40.408  1344.25   33.162  185.344   2.6745  181.386   2.2429 3.958298 3.490501 
1 1 1   15    8    3 o   24.516   4.5354   25.511   8.7299   23.239   14.921   26.694   10.765   23.503   7.1510   24.941   5.4477 -1.437685 8.989646 
1 1 1   15    8    4 o   96.136   1.8354  377.306   14.383  367.629   21.104  385.702   19.655   94.760   2.7350   97.101   2.4853 -2.340744 3.695509 
1 1 1   15    8    5 o   78.927   1.8433  254.322   11.859  248.280   19.150  258.082   15.105   77.815   3.0247   79.434   2.3353 -1.618469 3.821336 
1 1 1   15    8    6 o   29.057   4.2387   35.427   9.7441   48.589   19.465   31.026   11.256   33.464   7.3382   26.949   5.3128 6.514805 9.059499 
1 1 1   15    8    7 o  129.580   1.7811  685.442   18.813  693.169   34.454  682.160   22.456  130.070   3.2496  129.226   2.1318 0.8440399 3.886439 
1 1 1   15    8    8 o   29.706   4.2045   36.984   9.8967   50.875   19.782   32.346   11.430   34.258   7.3069   27.533   5.2848 6.724737 9.017786 
1 1 1   15    8    9 f   64.805   2.0443  171.699   10.785  165.296   17.419  175.680   13.735   63.412   3.3821   65.493   2.5778 -2.081367 4.252485 
1 1 1   15    8   10 o   59.266   2.1949  143.704   10.585  140.057   17.025  146.002   13.515   58.319   3.5988   59.669   2.7863 -1.349911 4.551347 
1 1 1   15    8   11 o  138.469   1.6422  782.555   18.537  799.283   29.274  771.358   23.950  139.801   2.5688  137.409   2.1382 2.392456 3.342265 
1 1 1   15    8   12 o  107.634   1.6673  472.856   14.629  495.108   23.410  458.601   18.737  110.022   2.6103  105.946   2.1696 4.076164 3.394273 
1 1 1   15    8   13 o   12.812   5.2035   2.7833   8.4961   22.952   14.377  -8.0399   10.532   23.298   7.0046   11.003   5.0702 12.29518 8.647017 
1 1 1   15    8   14 o   58.245   2.3129  138.877   10.959  151.004   20.743  134.181   12.908   60.437   4.2374   57.194   2.7770 3.242691 5.066302 
1 1 1   15    8   15 o   51.135   2.5441  107.206   10.571   91.851   19.809  113.321   12.500   46.839   5.2800   52.527   2.9310 -5.688023 6.038977 
1 1 1   15    8   16 o   17.839   5.6784   12.975   9.2938  -7.2634   17.713   20.664   10.917   15.331   6.8687   21.942   5.9535 -6.611176 9.089733 
1 1 1   15    8   17 o   33.319   4.1330   46.354   10.985   34.302   18.286   53.158   13.740   28.101   7.7381   35.566   4.8670 -7.464626 9.141461 
1 1 1   15    8   18 o   80.635   2.2244  265.939   14.607  292.690   24.945  251.980   18.020   84.353   3.6364   78.403   2.8242 5.950279 4.604239 
1 1 1   15    8   19 o   54.715   2.6008  122.763   11.567  111.353   16.934  132.741   15.836   51.876   4.0364   56.776   3.4379 -4.899368 5.301997 
1 1 1   15    8   20 o   99.280   2.0899  402.742   16.913  416.359   22.564  385.279   25.552  100.814   2.7483   96.879   3.2402 3.935738 4.248782 
1 1 1   15    8   21 o  124.782   1.6715  635.657   17.002  639.231   27.019  633.315   21.875  124.976   2.6523  124.483   2.1558 0.4921875 3.417858 
1 1 1   15    8   22 o   94.662   1.9125  366.026   14.757  419.016   28.092  345.831   17.343  100.982   3.4177   91.937   2.3160 9.045052 4.128498 
1 1 1   15    8   23 o   87.183   2.0111  310.566   14.292  330.477   21.283  294.214   19.288   89.766   2.9125   84.713   2.7970 5.052483 4.038075 
1 1 1   15    8   24 o   59.250   2.5226  143.910   12.156  143.455   18.135  144.281   16.380   58.942   3.7947   59.185   3.4096 -0.2437515 5.101519 
1 1 1   15    8   25 o   78.011   2.1849  248.995   13.880  261.701   20.792  238.780   18.642   79.804   3.2027   76.261   3.0048 3.542831 4.391571 
1 1 1   15    8   26 o  158.710   1.8696  1029.01   24.187  1047.46   35.169  1012.45   33.318  159.926   2.6978  157.258   2.5992 2.668365 3.746152 
1 1 1   15    8   27 o  108.000   1.8869  476.547   16.611  451.707   28.953  488.736   20.281  104.810   3.3934  109.312   2.2761 -4.501549 4.086045 
1 1 1   15    8   28 o   78.058   2.0140  249.208   12.804  266.753   20.957  238.757   16.175   80.550   3.1980   76.312   2.6040 4.237404 4.124099 
1 1 1   15    8   29 o   45.313   2.9968   84.589   11.007  118.164   20.089   70.186   13.158   53.230   4.6773   41.078   3.9793 12.15253 6.140988 
1 1 1   15    8   30 o   13.583   5.5638   2.8692   9.8140 -27.6904   18.100   15.595   11.680   12.332   5.9567   19.559   6.3786 -7.226105 8.727466 
1 1 1   15    8   31 f   63.414   2.5402  164.969   13.104  170.303   21.611  161.868   16.479   64.088   4.1593   62.687   3.2359 1.400810 5.269813 
1 1 1   15    8   32 o   34.727   4.0753   50.448   11.317   58.160   18.278   45.654   14.411   36.724   6.3347   32.635   5.6201 4.089066 8.468447 
1 1 1   15    8   33 o   62.884   2.2584  162.045   11.557  177.553   20.867  155.182   13.881   65.480   3.9276   61.450   2.7783 4.029236 4.810926 
1 1 1   15    8   34 o   75.491   2.0003  233.213   12.298  245.037   22.185  227.968   14.776   77.055   3.5415   74.564   2.4343 2.490761 4.297477 
1 1 1   15    8   35 o   22.271   5.0533   21.451   8.9626   11.464   16.200   25.857   10.759   19.262   7.3779   24.403   5.5364 -5.140520 9.224181 
1 1 1   15    8   36 o   48.147   2.5140   95.266   9.8326   93.982   17.461   95.862   11.899   47.371   4.5788   48.205   3.0436 -0.8345222 5.498100 
1 1 1   15    8   37 o   84.472   2.0207  291.927   13.914  265.738   30.582  298.763   15.624   79.794   4.7229   85.388   2.2467 -5.593895 5.230062 
1 1 1   15    8   38 o   50.200   2.4217  103.529   9.8804  132.210   18.417   91.938   11.708   56.377   4.0343   47.186   3.0604 9.190975 5.063773 
1 1 1   15    8   39 o   27.070   4.3671   31.162   9.3085   47.931   16.538   23.386   11.262   33.127   6.3554   23.114   5.9440 10.01304 8.701831 
1 1 1   15    8   40 o   45.482   2.7558   85.283   10.169   70.259   17.117   93.479   12.642   40.616   5.2959   47.514   3.2843 -6.897850 6.231604 
1 1 1   15    8   41 o   82.768   2.0110  280.446   13.568  302.036   23.166  269.173   16.739   85.506   3.3300   80.943   2.5401 4.562820 4.188256 
1 1 1   15    8   42 o   75.372   2.1305  232.922   13.076  249.378   22.669  224.715   16.008   77.573   3.5947   73.909   2.6615 3.664642 4.472770 
1 1 1   15    8   43 o   99.901   1.9387  408.581   15.787  400.993   35.874  410.403   17.581   97.922   4.5065  100.071   2.1553 -2.149628 4.995332 
1 1 1   15    8   44 o   47.281   2.6751   92.204   10.268  118.349   24.470   86.617   11.312   52.519   5.8130   45.739   3.0515 6.780724 6.565200 
1 1 1   15    8   45 o   15.464   5.5448   8.8090   8.8766   27.908   22.202   5.1751   9.6843   25.531   8.7998   14.253   5.6341 11.27852 10.44887 
1 1 1   15    8   46 o   74.955   1.9449  230.317   11.873  254.966   21.697  219.779   14.186   78.407   3.4028   73.113   2.3835 5.294456 4.154512 
1 1 1   15    8   47 o   18.872   5.3730   15.519   8.6615   37.967   15.892   6.0331   10.331   29.040   6.8289   14.865   5.8364 14.17525 8.983221 
1 1 1   15    8   48 o  101.862   1.9454  425.266   16.153  435.670   26.403  419.042   20.421  102.586   3.1612  100.938   2.4819 1.648705 4.019116 
1 1 1   15    8   49 o   73.329   1.9828  220.649   11.841  244.734   21.584  210.280   14.162   76.708   3.4608   71.461   2.4348 5.246918 4.231462 
1 1 1   15    8   50 o   40.216   2.9423   67.182   9.5787   65.661   17.274   67.857   11.511   38.819   5.6224   40.250   3.5445 -1.430485 6.646376 
1 1 1   15    8   51 o   38.534   2.9533   61.762   9.2059   64.723   16.766   60.484   11.015   38.549   5.4906   37.946   3.6043 0.6024933 6.567910 
1 1 1   15    8   52 o   71.990   1.9674  212.838   11.534  207.978   20.513  215.085   13.948   70.550   3.5786   72.246   2.3717 -1.696152 4.293195 
1 1 1   15    8   53 o   69.761   1.9198  199.860   10.907  199.998   18.292  199.784   13.586   69.300   3.2472   69.600   2.3983 -0.3003922 4.036836 
1 1 1   15    8   54 o   74.958   1.8774  230.714   11.462  227.637   19.212  232.415   14.283   73.939   3.1952   75.081   2.3365 -1.142792 3.958355 
1 1 1   15    8   55 o   58.632   2.3159  141.849   11.047  125.530   17.105  153.526   14.469   54.549   3.8720   60.781   2.9290 -6.232098 4.855038 
1 1 1   15    8   56 o   53.903   2.5540  120.298   11.190  131.272   17.075  112.036   14.815   55.808   3.7757   51.644   3.5407 4.164589 5.176116 
1 1 1   15    8   57 o   37.035   3.3987   57.749   10.146   61.408   15.400   54.943   13.487   37.444   5.1845   35.576   4.7708 1.868340 7.045496 
1 1 1   15    8   58 o   34.605   4.7071   52.036   12.934   49.791   20.180   53.601   16.850   32.257   7.7679   34.369   6.2443 -2.112827 9.966519 
1 1 1   15    8   59 o   47.093   2.9101   92.531   11.116   78.541   20.815   98.114   13.148   41.626   6.3340   48.314   3.3595 -6.688133 7.169814 
1 1 1   15    8   60 o   22.670   5.5229   23.332   10.110   29.859   19.320   20.870   11.865   24.964   8.2074   21.328   6.3518 3.635487 10.37817 
1 1 1   15    8   61 o   51.156   2.3704  108.411   9.8575   87.064   17.052  119.125   12.080   44.740   4.7482   53.468   2.7813 -8.728321 5.502779 
1 1 1   15    8   62 o   20.997   4.8375   19.761   8.1091   17.670   14.048   20.806   9.9306   20.033   6.9946   21.327   5.6304 -1.294060 8.979159 
1 1 1   15    8   63 o   21.806   4.6834   21.231   8.0762   37.444   14.610   14.096   9.6916   28.250   6.4822   17.858   5.8094 10.39219 8.704505 
1 1 1   15    8   64 o   12.858   5.0574   4.8135   7.7687  -6.2383   13.906   9.8275   9.3666   12.934   5.9101   15.732   5.6887 -2.797886 8.203087 
1 1 1   15    8   65 o   38.005   2.8361   60.558   8.7228   61.389   14.919   60.127   10.752   37.191   5.0517   37.576   3.5525 -0.3846397 6.175764 
1 1 1   15    8   66 o   19.676   5.0512   17.596   8.1422   24.174   14.478   14.553   9.8468   22.497   7.0783   18.032   5.8550 4.465170 9.186016 
1 1 1   15    8   67 o   15.411   5.2772   10.021   7.9807   14.259   14.004   7.9824   9.7122   18.556   6.9143   14.980   5.7189 3.575520 8.972866 
1 1 1   15    8   68 o   15.039   5.3769   9.1541   8.3408  -0.6593   13.464   15.265   10.625   13.855   6.1098   18.385   6.0883 -4.530067 8.625385 
1 1 1   15    8   69 o   24.352   4.6544   26.607   8.9026   35.904   14.958   21.507   11.078   27.189   6.7741   21.334   6.0773 5.854975 9.100718 
1 1 1   15    8   70 o   27.787   4.0128   33.778   8.8262   55.624   14.612   21.229   11.075   35.011   5.2845   21.152   6.0927 13.85869 8.065190 
1 1 1   15    8   71 o   21.849   4.9580   21.900   8.6271   27.090   14.526   19.072   10.723   23.358   7.0450   20.062   6.0533 3.295828 9.288365 
1 1 1   15    8   72 f   12.317   5.0725   3.3393   8.2142  -1.0273   13.965   5.6493   10.157   13.822   6.1519   14.070   5.6985 -0.2474298 8.385667 
1 1 1   15    8   73 o   17.381   5.7449   13.896   9.4616   46.154   26.840   9.3188   10.111   27.889   9.6725   15.423   5.8474 12.46640 11.30262 
1 1 1   15    8   74 f   23.709   5.2165   26.318   9.8072  -4.4348   24.440   32.221   10.707   16.687   7.7017   26.325   5.1742 -9.637562 9.278386 
1 1 1   15    8   75 o   13.059   5.3663   4.3914   9.1671   45.136   22.736  -3.5180   10.017   27.868   8.8828   11.133   5.0594 16.73549 10.22263 
1 1 1   15    8   76 o   11.564   5.1398  -1.0375   9.7142 -10.4369   22.922   1.0203   10.725   15.197   7.1587   12.652   5.5195 2.545041 9.039466 
1 1 1   15    8   77 o   13.620   5.5112   5.8236   9.4901   14.862   17.974   2.3301   11.175   18.517   7.5506   13.173   5.6910 5.343662 9.455090 
1 1 1   15    8   78 o   11.791   5.0033   2.2912   8.3582   7.0529   12.705  -1.3417   11.098   15.064   6.2656   12.114   5.4313 2.949727 8.291936 
1 1 1   15    8   79 o   12.000   4.9868   3.4001   8.0373   1.5249   12.197   4.8392   10.685   13.280   5.8371   13.632   5.7135 -0.3521385 8.168024 
1 1 1   15    8   80 o   13.013   5.6010   2.9317   10.747   6.4860   12.343  -8.2065   21.850   14.643   6.1392   14.778   6.9698 -0.1354733 9.288065 
1 1 1   15    8   81 o   10.380   4.8727  -7.0786   10.461 -10.8804   11.827   6.5766   22.416   10.433   4.9797   16.975   7.6555 -6.541956 9.132608 
1 1 1   15    8   82 o   14.461   5.8728   7.8359   10.822   5.4685   12.428   15.257   22.004   14.194   6.0645   18.337   7.9536 -4.142801 10.00195 
1 1 1   15    8   83 o   10.152   4.7970  -7.8144   10.441  -2.1911   11.841 -27.4561   22.130   11.995   5.4704   12.499   6.1535 -0.5042191 8.233521 
1 1 1   15    8   84 o   17.206   6.1576   15.195   10.942   20.863   12.454  -3.9855   22.910   19.503   6.5936   15.152   7.1432 4.351027 9.721210 
1 1 1   15    8   85 o   17.282   6.1478   15.500   10.891   13.086   12.219   24.825   24.017   16.388   6.3726   19.957   8.4754 -3.568869 10.60388 
1 1 1   15    8   86 o   13.521   5.8668   4.2390   11.982   4.2390   11.982   0.0000   0.0000   13.521   5.8668  ?   ?  0.000000 5.866810 
1 1 1   15    8   87 o   25.140   6.3190   34.257   12.933   34.257   12.933   0.0000   0.0000   25.140   6.3190  ?   ?  0.000000 6.318959 
1 1 1   15    8   88 o   16.227   6.3458   13.081   12.171   13.081   12.171   0.0000   0.0000   16.227   6.3458  ?   ?  0.000000 6.345788 
1 1 1   15    8   89 o   15.115   6.2773   9.6322   12.725   9.6322   12.725   0.0000   0.0000   15.115   6.2773  ?   ?  0.000000 6.277329 
1 1 1   15    8   90 o   14.668   6.4319   6.5095   14.730   6.5095   14.730   0.0000   0.0000   14.668   6.4319  ?   ?  0.000000 6.431946 
1 1 1   15    8   91 o   21.869   7.3225   29.726   15.361   29.726   15.361   0.0000   0.0000   21.869   7.3225  ?   ?  0.000000 7.322464 
1 1 1   15    8   92 o   21.404   7.4019   28.984   15.713   28.984   15.713   0.0000   0.0000   21.404   7.4019  ?   ?  0.000000 7.401942 
1 1 1   15    8   93 f   15.324   6.9852   6.0229   19.277   6.0229   19.277   0.0000   0.0000   15.324   6.9852  ?   ?  0.000000 6.985233 
1 1 1   15    8   94 o   15.812   6.7175   11.639   15.096   11.639   15.096   0.0000   0.0000   15.812   6.7175  ?   ?  0.000000 6.717456 
1 1 1   15    8   95 o   11.732   5.5694  -7.2759   14.387  -7.2759   14.387   0.0000   0.0000   11.732   5.5694  ?   ?  0.000000 5.569418 
1 1 1   15    8   96 o   15.666   6.7178   11.378   15.351   11.378   15.351   0.0000   0.0000   15.666   6.7178  ?   ?  0.000000 6.717775 
1 1 1   15    8   97 o   14.694   6.4526   7.9025   14.872   7.9025   14.872   0.0000   0.0000   14.694   6.4526  ?   ?  0.000000 6.452618 
1 1 1   15    8   98 o   14.832   6.5502   7.9737   15.528   7.9737   15.528   0.0000   0.0000   14.832   6.5502  ?   ?  0.000000 6.550170 
1 1 1   15    8   99 o   15.640   6.4290   12.295   13.163   21.067   15.895  -6.8489   23.483   18.318   7.2252   14.185   6.8350 4.132607 9.945852 
1 1 1   15    9  -95 o   13.867   6.6915  -7.8037   22.711  -7.8037   22.711   0.0000   0.0000   13.867   6.6915  ?   ?  0.000000 6.691475 
1 1 1   15    9  -94 o   11.989   5.9399 -25.4687   21.802 -25.4687   21.802   0.0000   0.0000   11.989   5.9399  ?   ?  0.000000 5.939891 
1 1 1   15    9  -93 o   13.204   6.4388 -13.7119   22.520 -13.7119   22.520   0.0000   0.0000   13.204   6.4388  ?   ?  0.000000 6.438850 
1 1 1   15    9  -92 o   17.062   7.6545   15.753   22.080   15.753   22.080   0.0000   0.0000   17.062   7.6545  ?   ?  0.000000 7.654481 
1 1 1   15    9  -91 o   15.876   7.3826   7.1208   23.099   7.1208   23.099   0.0000   0.0000   15.876   7.3826  ?   ?  0.000000 7.382617 
1 1 1   15    9  -90 o   15.633   7.3181   4.6382   23.316   4.6382   23.316   0.0000   0.0000   15.633   7.3181  ?   ?  0.000000 7.318079 
1 1 1   15    9  -89 o   17.795   7.9006   18.416   22.888   18.416   22.888   0.0000   0.0000   17.795   7.9006  ?   ?  0.000000 7.900628 
1 1 1   15    9  -88 o   17.711   8.0638   16.647   25.590   16.647   25.590   0.0000   0.0000   17.711   8.0638  ?   ?  0.000000 8.063806 
1 1 1   15    9  -87 o   16.744   7.7658   9.4996   25.303   9.4996   25.303   0.0000   0.0000   16.744   7.7658  ?   ?  0.000000 7.765840 
1 1 1   15    9  -86 o   24.947   9.7707   55.503   28.891   55.503   28.891   0.0000   0.0000   24.947   9.7707  ?   ?  0.000000 9.770690 
1 1 1   15    9  -85 o   12.528   6.0097 -10.6797   17.696 -17.4732   26.431  -5.1603   23.824   14.103   6.8983   14.778   7.0576 -0.6748495 9.868890 
1 1 1   15    9  -84 o   13.288   6.1801  -2.5455   16.198 -21.2654   26.440   8.7028   20.495   13.844   6.7979   16.205   7.3133 -2.360862 9.984773 
1 1 1   15    9  -83 o   19.046   7.4237   21.611   16.613   7.7586   26.278   30.834   21.442   16.943   7.8771   21.149   8.3759 -4.205971 11.49799 
1 1 1   15    9  -82 o   12.300   5.8282  -8.0943   15.612   5.9724   25.059 -17.0180   19.959   16.643   7.7223   12.643   6.1418 4.000117 9.866934 
1 1 1   15    9  -81 o   24.353   7.5663   36.182   16.598   16.617   25.802   49.992   21.678   18.384   8.2589   27.111   8.6771 -8.727142 11.97919 
1 1 1   15    9  -80 o   12.765   5.9846  -5.6624   15.690   5.9956   24.934 -13.3044   20.188   16.757   7.7499   13.194   6.3523 3.563070 10.02060 
1 1 1   15    9  -79 o   17.345   6.3106   15.588   11.550   11.379   15.839   20.370   16.880   16.396   6.9191   18.985   7.4587 -2.588781 10.17378 
1 1 1   15    9  -78 o   10.848   5.0936  -6.8191   11.441  -8.6052   15.997  -4.9491   16.369   12.506   5.9178   13.212   6.1673 -0.7060328 8.547252 
1 1 1   15    9  -77 o   17.971   6.2552   16.683   11.230   13.994   15.618   19.562   16.159   17.274   7.0404   18.982   7.3429 -1.707897 10.17282 
1 1 1   15    9  -76 o   15.862   6.1244   11.277   11.225   3.6357   15.630   19.417   16.131   14.779   6.5470   19.087   7.3490 -4.307926 9.842326 
1 1 1   15    9  -75 f   41.053   2.8464   72.218   9.4664   84.646   18.101   67.539   11.106   41.961   5.4183   39.202   3.5127 2.759506 6.457343 
1 1 1   15    9  -74 o   41.703   3.7456   76.880   12.598   67.972   17.425   86.635   18.234   37.125   5.9595   42.638   5.3647 -5.513191 8.018475 
1 1 1   15    9  -73 o   10.877   4.6969   0.9034   7.6059   7.5888   15.317  -1.2847   8.7626   15.910   6.7629   10.870   4.8532 5.040178 8.324063 
1 1 1   15    9  -72 o   27.698   4.1996   34.630   9.1847   55.879   27.764   32.018   9.7327   29.020   9.8447   26.295   4.7139 2.725475 10.91508 
1 1 1   15    9  -71 o   8.6366   4.0991  -7.9337   7.7857 -10.8042   16.172  -7.0676   8.8830   12.688   5.9877   9.5728   4.4927 3.115176 7.485791 
1 1 1   15    9  -70 o   32.751   3.8982   47.305   10.203   0.0000   0.0000   47.305   10.203  ?   ?    32.751   3.8982 0.000000 3.898183 
1 1 1   15    9  -69 o   27.367   3.9447   33.132   8.5461   14.041   16.896   39.696   9.9068   18.418   7.3883   29.855   4.1856 -11.43791 8.491554 
1 1 1   15    9  -68 o   24.234   4.4809   26.583   8.5259   19.171   17.571   28.866   9.7508   20.142   7.6914   25.016   4.9570 -4.874350 9.150404 
1 1 1   15    9  -67 o   15.058   5.0961   9.9090   7.4393  -7.2010   11.941   20.763   9.5105   11.475   5.3265   20.948   5.5004 -9.473399 7.656699 
1 1 1   15    9  -66 o   15.895   4.9687   11.385   7.1457   10.625   10.957   11.948   9.4259   16.231   6.1021   16.483   5.7311 -0.2521057 8.371436 
1 1 1   15    9  -65 o   38.416   2.7027   62.032   8.4094   49.827   11.907   74.178   11.878   33.535   4.4667   41.591   3.5372 -8.055969 5.697592 
1 1 1   15    9  -64 o   21.980   4.5340   21.745   7.8536   18.902   13.702   23.135   9.5841   20.088   6.9135   22.340   5.3363 -2.252748 8.733451 
1 1 1   15    9  -63 o   30.290   3.3793   39.252   8.2018   43.925   14.764   37.167   9.8638   30.550   6.1419   29.055   4.2939 1.495487 7.494046 
1 1 1   15    9  -62 o   14.846   5.0411   9.3300   7.2800   6.1541   11.566   11.414   9.3687   14.953   6.0719   16.368   5.7123 -1.415488 8.336519 
1 1 1   15    9  -61 o   41.395   2.4103   71.339   8.0977   87.465   12.668   60.198   10.530   45.367   3.4515   37.583   3.4765 7.784267 4.898893 
1 1 1   15    9  -60 o   45.492   2.3266   85.955   8.5992  110.718   14.416   72.279   10.714   51.076   3.4834   41.356   3.2030 9.720169 4.732218 
1 1 1   15    9  -59 f   9.2708   4.2161  -3.5313   6.9706  -5.2456   11.335  -2.4889   8.8395   11.730   5.3506   10.894   4.8687 0.8353329 7.234152 
1 1 1   15    9  -58 o   27.137   3.4015   31.455   7.3595   31.523   11.566   31.409   9.5397   26.234   5.5804   26.657   4.5536 -0.4226723 7.202544 
1 1 1   15    9  -57 o   26.740   3.7027   30.774   7.8545   13.500   14.080   38.578   9.4640   18.408   6.9178   29.874   3.9858 -11.46611 7.983852 
1 1 1   15    9  -56 o   20.133   4.7628   18.189   7.6933   3.4314   13.755   24.906   9.2806   15.169   6.4267   23.542   4.9912 -8.373537 8.137272 
1 1 1   15    9  -55 o   28.602   3.6222   34.990   8.2561   42.958   15.998   32.098   9.6388   30.255   6.6671   27.025   4.5360 3.229387 8.063853 
1 1 1   15    9  -54 o   47.882   2.8220   95.672   10.966   86.046   17.304  102.132   14.176   44.399   4.8605   49.144   3.5628 -4.744629 6.026493 
1 1 1   15    9  -53 o   14.298   5.7537   5.2705   10.281  -3.5242   14.748   13.586   14.341   14.004   6.2714   18.650   6.9873 -4.645287 9.388914 
1 1 1   15    9  -52 o   23.422   5.7438   25.004   10.881   16.582   15.313   33.593   15.465   19.954   7.2653   26.678   7.0182 -6.724031 10.10148 
1 1 1   15    9  -51 o   13.356   5.1560   5.5332   7.9550  -8.0478   13.237   13.211   9.9528   12.338   5.6849   17.593   5.8943 -5.254505 8.189021 
1 1 1   15    9  -50 o   46.715   2.3220   90.232   8.8145   81.109   14.910   95.133   10.929   43.556   4.2536   47.812   2.8166 -4.255974 5.101621 
1 1 1   15    9  -49 o   48.911   2.2745   98.796   9.0435  114.508   15.631   90.890   11.088   52.119   3.7032   46.707   2.9270 5.412567 4.720264 
1 1 1   15    9  -48 o   22.238   4.4302   21.645   7.7485   41.730   13.926   12.638   9.3253   30.521   5.8096   17.258   5.7033 13.26254 8.141213 
1 1 1   15    9  -47 o   27.358   3.6630   31.842   7.9638   39.968   14.469   28.311   9.5386   29.725   6.1735   25.408   4.7810 4.317167 7.808370 
1 1 1   15    9  -46 o   65.386   1.9418  175.690   10.338  179.473   17.738  173.744   12.722   65.571   3.3295   64.879   2.4098 0.6916428 4.110057 
1 1 1   15    9  -45 o   77.558   1.7909  246.652   11.322  244.302   18.703  248.010   14.224   76.717   2.9966   77.604   2.2510 -0.8868637 3.747840 
1 1 1   15    9  -44 o   28.474   3.5841   34.304   8.1349   32.487   14.269   35.179   9.9016   26.703   6.5949   28.589   4.3889 -1.885971 7.921830 
1 1 1   15    9  -43 o   70.302   1.8764  202.820   10.743  192.588   17.629  208.866   13.551   68.068   3.1860   71.210   2.3376 -3.141663 3.951617 
1 1 1   15    9  -42 o   52.684   2.2141  114.254   9.4873   96.044   15.869  124.383   11.835   47.706   4.1211   54.857   2.6546 -7.151455 4.902051 
1 1 1   15    9  -41 o   64.298   1.9578  169.694   10.249  148.689   16.914  181.880   12.884   59.721   3.4897   66.457   2.3821 -6.736568 4.225227 
1 1 1   15    9  -40 o   39.210   2.6982   63.659   8.5714   61.057   14.765   64.981   10.527   37.722   4.9190   39.466   3.3024 -1.743561 5.924709 
1 1 1   15    9  -39 o   50.372   2.2054  104.363   9.0334  114.265   15.530   99.300   11.105   52.303   3.6658   48.997   2.7921 3.306175 4.608023 
1 1 1   15    9  -38 o   30.317   4.3034   39.165   10.337   46.518   30.026   38.177   11.010   31.355   10.227   29.809   4.6854 1.545990 11.24941 
1 1 1   15    9  -37 o   13.394   5.3414   4.2424   8.7777   1.2581   27.511   4.5807   9.2618   20.390   8.8684   13.785   5.4902 6.605671 10.43022 
1 1 1   15    9  -36 o   45.817   2.8703   86.838   10.666  109.839   31.867   83.937   11.319   49.217   8.2338   44.985   3.1058 4.231373 8.800094 
1 1 1   15    9  -35 f   66.490   2.0273  181.316   10.975  167.794   20.076  187.079   13.107   63.424   3.9021   67.459   2.3873 -4.034779 4.574492 
1 1 1   15    9  -34 o   45.353   2.4182   84.683   8.9076  102.695   15.269   75.390   10.967   49.610   3.8047   42.625   3.1793 6.984760 4.958251 
1 1 1   15    9  -33 o   34.374   3.0050   49.042   8.3355   48.816   13.825   49.172   10.448   33.708   5.1983   34.235   3.8084 -0.5270653 6.444128 
1 1 1   15    9  -32 o   75.206   1.8190  231.422   11.151  233.576   18.085  230.100   14.164   75.261   2.9537   74.864   2.3239 0.3966446 3.758263 
1 1 1   15    9  -31 o   21.267   5.2158   19.736   8.9721   24.856   13.261   15.414   12.184   23.739   6.6100   19.433   6.5217 4.305489 9.285732 
1 1 1   15    9  -30 o   55.144   2.2468  124.835   10.078  141.538   15.996  113.838   12.979   58.469   3.3705   52.495   3.0461 5.974525 4.542981 
1 1 1   15    9  -29 o   33.540   3.2985   46.815   8.9015   47.591   13.930   46.279   11.573   33.297   5.3105   33.084   4.4003 0.2131004 6.896615 
1 1 1   15    9  -28 o   45.197   2.6673   84.159   9.7832   81.020   15.155   86.401   12.810   43.971   4.2823   45.630   3.4699 -1.658615 5.511711 
1 1 1   15    9  -27 o   68.082   2.2788  190.119   12.629  175.905   17.146  206.975   18.671   65.274   3.2324   70.814   3.2432 -5.540100 4.578995 
1 1 1   15    9  -26 o   43.395   3.3388   78.036   11.720   76.018   14.988   81.211   18.802   42.576   4.3810   43.717   5.3903 -1.141323 6.946095 
1 1 1   15    9  -25 o   62.919   2.3633  162.436   12.099  196.263   19.822  142.346   15.275   68.893   3.5415   58.725   3.2032 10.16787 4.775185 
1 1 1   15    9  -24 o   56.319   2.3874  130.191   10.935  126.168   16.330  133.462   14.724   55.180   3.6510   56.868   3.1891 -1.687756 4.847711 
1 1 1   15    9  -23 o   17.439   5.6819   12.393   9.2690   15.155   14.437   10.456   12.090   19.978   7.0813   17.448   6.4386 2.529869 9.570786 
1 1 1   15    9  -22 o   22.019   5.8241   21.080   10.613   36.067   20.219   15.381   12.468   28.523   8.2374   19.583   6.5975 8.939411 10.55371 
1 1 1   15    9  -21 o   39.822   3.3640   65.721   10.818   39.143   15.358   91.889   15.239   29.909   6.4867   46.988   4.0173 -17.07934 7.629913 
1 1 1   15    9  -20 o   26.726   4.8812   30.580   10.242   35.874   15.300   26.281   13.787   28.581   6.6868   24.521   6.7058 4.060434 9.469995 
1 1 1   15    9  -19 o   66.605   2.3521  181.874   12.750  176.080   18.964  186.653   17.224   65.282   3.5774   67.320   3.1473 -2.038368 4.764825 
1 1 1   15    9  -18 o   85.988   2.0124  302.370   14.105  336.421   21.977  278.516   18.394   90.471   2.9841   82.363   2.7435 8.107567 4.053609 
1 1 1   15    9  -17 o   48.374   2.8295   96.317   11.108  100.667   17.565   93.417   14.341   49.115   4.4349   47.464   3.7367 1.651649 5.799266 
1 1 1   15    9  -16 f   10.572   4.8510  -6.6122   9.5007  -8.2089   15.444  -5.6400   12.051   13.880   6.2977   12.481   5.6224 1.398796 8.442243 
1 1 1   15    9  -15 o   28.747   4.5366   35.020   10.279   24.008   16.070   42.643   13.371   23.777   7.4540   31.574   5.3884 -7.797152 9.197683 
1 1 1   15    9  -14 o   34.203   3.5396   48.646   9.7263   60.871   16.854   42.541   11.910   37.796   5.6429   31.697   4.7561 6.099270 7.379870 
1 1 1   15    9  -13 o   78.404   2.0008  251.482   12.777  267.729   21.584  242.718   15.853   80.647   3.2902   76.939   2.5311 3.708000 4.151183 
1 1 1   15    9  -12 o  134.128   1.7360  734.928   18.981  749.422   31.024  726.256   23.996  135.192   2.8152  133.240   2.2093 1.952209 3.578605 
1 1 1   15    9  -11 o  122.716   1.7635  615.211   17.640  635.879   28.821  602.831   22.307  124.528   2.8393  121.385   2.2544 3.143555 3.625468 
1 1 1   15    9  -10 o   10.789   4.9239  -6.0788   9.6152 -19.5634   16.995   0.2690   11.661   12.817   6.0752   13.803   5.8851 -0.9857864 8.458317 
1 1 1   15    9   -9 o   41.124   3.2021   69.859   10.649   71.812   18.196   68.841   13.134   41.161   5.5657   40.666   4.0144 0.4947891 6.862356 
1 1 1   15    9   -8 o   65.139   2.2858  173.813   12.119  140.893   20.093  192.634   15.193   58.260   4.2604   68.509   2.7260 -10.24918 5.057919 
1 1 1   15    9   -7 o   64.410   2.2842  169.939   11.974  189.215   20.822  160.415   14.636   67.680   3.7893   62.483   2.8813 5.197601 4.760299 
1 1 1   15    9   -6 o   40.234   3.4892   67.044   11.330   87.487   18.610   55.002   14.283   45.639   5.0888   36.091   4.9881 9.548763 7.125813 
1 1 1   15    9   -5 o   71.484   2.1645  209.160   12.598  195.501   21.078  216.751   15.714   68.807   3.7725   72.693   2.6563 -3.886467 4.613867 
1 1 1   15    9   -4 o   54.486   2.7491  121.957   12.170  131.596   19.291  115.584   15.686   56.309   4.2337   52.877   3.6619 3.432190 5.597670 
1 1 1   15    9   -3 o   40.937   3.3186   69.280   10.979   78.108   20.369   65.664   13.035   42.850   5.9954   39.701   4.0862 3.148872 7.255455 
1 1 1   15    9   -2 o   33.242   4.3553   46.389   11.518   64.732   19.756   36.944   14.177   38.804   6.4736   29.199   6.1509 9.604958 8.929817 
1 1 1   15    9   -1 o   19.841   6.9433   14.967   13.847   65.777   33.452   4.4601   15.212   38.072   10.459   16.822   6.9126 21.25037 12.53706 
1 1 1   15    9    0 o   48.375   3.1815   96.468   12.476   68.219   35.073  100.560   13.349   38.710   10.739   49.367   3.3369 -10.65685 11.24522 
1 1 1   15    9    1 o   83.789   2.4568  287.615   16.762   0.0000   0.0000  287.615   16.762  ?   ?    83.789   2.4568 0.000000 2.456756 
1 1 1   15    9    2 o   67.180   2.6974  185.188   14.741   0.0000   0.0000  185.188   14.741  ?   ?    67.180   2.6974 0.000000 2.697412 
1 1 1   15    9    3 o   64.758   2.4883  171.927   13.111  240.103   30.731  156.757   14.496   75.926   4.9930   61.767   2.8871 14.15825 5.767629 
1 1 1   15    9    4 o   68.286   2.5526  191.201   14.184  210.070   24.187  181.311   17.510   71.229   4.1841   66.370   3.2465 4.859451 5.295901 
1 1 1   15    9    5 o   63.457   3.0143  165.558   15.547  223.057   23.942  123.632   20.445   73.448   4.0142   54.466   4.6493 18.98256 6.142496 
1 1 1   15    9    6 o   88.123   2.0068  317.432   14.415  375.159   27.240  294.977   16.989   95.455   3.5068   84.852   2.4588 10.60242 4.282897 
1 1 1   15    9    7 o   64.753   2.3599  171.813   12.436  217.563   23.799  154.630   14.585   72.523   4.0417   61.336   2.9256 11.18764 4.989485 
1 1 1   15    9    8 o   37.234   3.3973   57.442   10.198   74.294   17.039   48.037   12.729   42.012   5.0784   33.737   4.7609 8.274925 6.961006 
1 1 1   15    9    9 o   11.500   5.0967  -3.0126   9.4828   20.614   16.110 -15.5392   11.730   22.508   7.4982   10.355   4.9471 12.15326 8.983117 
1 1 1   15    9   10 o   91.779   1.8499  344.194   13.840  349.614   22.185  340.740   17.709   92.271   2.9534   91.210   2.3839 1.060638 3.795414 
1 1 1   15    9   11 o   62.075   2.2503  157.857   11.368  164.760   18.667  153.789   14.331   63.164   3.6410   61.169   2.8823 1.994652 4.643795 
1 1 1   15    9   12 o   19.722   5.5942   16.660   9.4068   16.208   15.611   16.918   11.787   20.752   7.3628   20.171   6.3918 0.5814533 9.750168 
1 1 1   15    9   13 o   49.739   2.5695  101.610   10.383  102.280   16.848  101.200   13.184   49.586   4.2078   49.518   3.2848 0.6867218E-01 5.338123 
1 1 1   15    9   14 o   36.465   3.2849   55.083   9.6597   64.325   15.935   49.715   12.146   39.013   5.1355   34.391   4.4357 4.621716 6.785890 
1 1 1   15    9   15 o   36.936   3.4830   56.620   10.363   69.817   19.640   51.529   12.200   40.367   6.1637   35.035   4.3662 5.331345 7.553494 
1 1 1   15    9   16 f   51.585   2.4532  109.225   10.286   89.251   16.390  122.204   13.212   46.237   4.4017   54.482   2.9864 -8.244236 5.319165 
1 1 1   15    9   17 o   55.917   2.5708  128.391   11.686  117.363   17.259  137.730   15.881   53.168   4.0117   57.765   3.3876 -4.596775 5.250727 
1 1 1   15    9   18 o   74.236   2.1306  225.641   12.879  248.660   19.129  206.553   17.419   77.757   3.0237   70.858   3.0227 6.898979 4.275507 
1 1 1   15    9   19 o   40.785   3.2202   68.804   10.619   76.323   16.032   62.926   14.175   42.638   4.6901   38.697   4.5825 3.941227 6.557171 
1 1 1   15    9   20 o  108.869   1.6966  484.267   15.057  467.673   23.390  496.008   19.675  106.755   2.6900  110.090   2.1925 -3.334747 3.470346 
1 1 1   15    9   21 o   62.300   2.2849  159.124   11.584  175.712   17.311  145.674   15.588   65.277   3.2637   59.429   3.2300 5.848392 4.591811 
1 1 1   15    9   22 o   26.684   4.2413   30.175   8.9172   29.351   14.302   30.699   11.405   25.845   6.7252   26.642   5.4361 -0.7969246 8.647508 
1 1 1   15    9   23 o   16.583   5.7947   10.416   9.6428   6.3986   14.027   14.017   13.278   16.799   6.7342   19.223   6.7932 -2.424839 9.565409 
1 1 1   15    9   24 o   43.861   3.1156   79.504   11.067   65.666   17.542   88.653   14.264   39.194   5.6537   46.173   3.8240 -6.978584 6.825492 
1 1 1   15    9   25 o   47.141   2.7290   91.516   10.442  101.133   15.278   83.087   14.304   49.326   3.8297   44.647   3.9717 4.679482 5.517330 
1 1 1   15    9   26 o   24.147   4.5355   24.990   8.5996   28.717   13.821   22.636   10.985   25.530   6.5949   22.760   5.8797 2.769850 8.835317 
1 1 1   15    9   27 o   60.481   2.0696  149.907   10.188  160.249   16.414  143.426   12.995   62.291   3.2438   59.042   2.7072 3.249310 4.225086 
1 1 1   15    9   28 o   14.090   5.3008   6.2990   8.2718 -12.4062   13.475   17.609   10.478   11.920   5.5747   20.219   5.9559 -8.299000 8.157865 
1 1 1   15    9   29 o   28.585   4.1660   34.589   9.4218   38.971   13.941   30.904   12.783   29.885   5.9319   26.525   6.0470 3.359987 8.470732 
1 1 1   15    9   30 o   40.757   2.9721   68.717   9.8063   70.256   14.712   67.486   13.155   40.835   4.4939   40.129   4.0782 0.7060738 6.068525 
1 1 1   15    9   31 o   13.118   5.2881   3.5348   8.7005   8.9329   13.268  -0.5370   11.524   17.239   6.6579   13.399   5.7839 3.839871 8.819333 
1 1 1   15    9   32 o   72.795   2.0199  217.177   11.974  225.189   17.909  210.699   16.103   73.888   2.9795   71.526   2.7671 2.361633 4.066252 
1 1 1   15    9   33 o   55.394   2.4826  126.245   11.182  134.097   18.311  121.576   14.120   56.684   3.9885   54.187   3.2111 2.496571 5.120486 
1 1 1   15    9   34 o   12.166   5.3229  -1.6547   10.038   23.134   14.734 -23.1279   13.713   23.014   7.1253   10.410   5.0646 12.60414 8.741865 
1 1 1   15    9   35 f   17.776   5.3547   13.528   8.3957   14.060   15.435   13.304   10.005   19.662   7.2716   17.946   5.9066 1.715931 9.368224 
1 1 1   15    9   36 o   19.741   5.5149   17.033   9.2149   21.882   21.812   15.980   10.167   23.594   8.6584   19.273   5.9103 4.321587 10.48327 
1 1 1   15    9   37 o   25.057   4.7294   27.178   9.3056   22.980   21.089   28.193   10.370   23.751   8.5428   25.405   5.1831 -1.653938 9.992243 
1 1 1   15    9   38 o   40.643   3.0657   68.614   10.082   77.560   22.642   66.402   11.259   41.768   6.8905   39.865   3.5004 1.902847 7.728586 
1 1 1   15    9   39 o   73.212   1.9878  219.911   11.852  191.507   21.176  232.867   14.302   67.695   3.8535   75.245   2.3345 -7.550385 4.505472 
1 1 1   15    9   40 o   27.225   4.4638   31.872   9.5632   43.626   22.098   29.164   10.608   30.508   8.5466   25.789   5.2255 4.718805 10.01749 
1 1 1   15    9   41 o   66.531   2.0583  181.807   11.149  237.856   20.678  158.836   13.238   75.637   3.3623   62.030   2.6241 13.60659 4.265060 
1 1 1   15    9   42 o   76.893   1.9298  242.635   12.086  262.847   22.066  233.972   14.446   79.463   3.4146   75.381   2.3539 4.081596 4.147300 
1 1 1   15    9   43 o   13.838   5.3109   5.9023   8.4056   13.470   15.788   2.9087   9.9298   19.336   7.3125   13.450   5.5619 5.885295 9.187359 
1 1 1   15    9   44 o   18.873   5.3152   15.710   8.5233   22.237   15.930   13.092   10.089   22.455   7.4555   17.710   5.9344 4.744436 9.529004 
1 1 1   15    9   45 o   22.447   4.8334   22.186   8.5824  -1.7507   15.220   33.345   10.392   14.807   6.5140   27.666   4.7809 -12.85927 8.080184 
1 1 1   15    9   46 o   27.679   4.0639   32.844   8.8962   39.168   16.444   30.226   10.578   29.105   7.0141   26.166   5.1428 2.938662 8.697449 
1 1 1   15    9   47 o   63.088   2.1486  163.921   11.033  185.476   20.113  154.644   13.195   66.431   3.7292   61.106   2.6555 5.325199 4.578017 
1 1 1   15    9   48 o   47.087   2.6103   91.923   9.9797   93.631   18.407   91.212   11.877   46.542   4.9264   46.729   3.1362 -0.1872406 5.839987 
1 1 1   15    9   49 o   14.452   5.4197   7.2340   8.6320   7.0235   16.001   7.3204   10.252   17.253   7.0898   15.145   5.8514 2.107631 9.192619 
1 1 1   15    9   50 o   89.433   1.9528  328.770   14.236  303.522   21.719  347.790   18.851   85.314   3.1284   91.691   2.5245 -6.376907 4.019929 
1 1 1   15    9   51 o   57.681   2.3391  137.540   10.975   93.220   21.585  152.994   12.746   45.710   5.9328   60.749   2.5798 -15.03867 6.469457 
1 1 1   15    9   52 o   18.652   6.1656   15.207   10.898   2.8458   18.740   21.523   13.396   17.097   7.3778   21.667   6.8074 -4.570633 10.03853 
1 1 1   15    9   53 o   21.720   5.5530   21.453   9.8683   23.032   18.102   20.786   11.771   22.532   7.9345   21.278   6.3242 1.254015 10.14652 
1 1 1   15    9   54 o   35.953   3.3437   54.624   9.6868   58.522   15.072   51.881   12.644   36.337   5.2397   34.491   4.6128 1.846272 6.980861 
1 1 1   15    9   55 o   20.367   5.0365   18.709   8.3144   16.705   14.166   19.761   10.269   19.675   7.0104   20.760   5.8299 -1.084667 9.117726 
1 1 1   15    9   56 o   18.345   5.3232   15.179   8.4254   30.600   14.304   6.9872   10.426   25.373   6.7848   14.934   5.8634 10.43855 8.967324 
1 1 1   15    9   57 o   40.506   2.7849   68.641   9.1392   63.919   15.113   71.363   11.475   38.024   4.9965   41.021   3.4642 -2.996342 6.079922 
1 1 1   15    9   58 o   8.7519   4.1667  -9.5054   8.1706 -14.6813   13.824  -6.7263   10.129   11.384   5.4197   10.682   4.9400 0.7017355 7.333291 
1 1 1   15    9   59 f   28.045   4.4943   34.667   9.9273   28.352   15.195   39.369   13.113   24.187   7.1846   29.311   5.6933 -5.124582 9.166874 
1 1 1   15    9   60 o   17.942   6.0097   14.285   10.347   25.331   16.923   7.6907   13.075   22.902   7.6861   16.072   6.4813 6.829792 10.05399 
1 1 1   15    9   61 o   20.800   5.9286   20.194   10.540   25.629   16.757   16.636   13.557   22.955   7.6473   19.342   6.8614 3.613117 10.27427 
1 1 1   15    9   62 o   14.882   5.4698   8.6154   8.7106   16.140   16.519   5.7171   10.252   19.585   7.4628   14.269   5.7443 5.316579 9.417558 
1 1 1   15    9   63 o   40.672   2.9487   69.730   9.7097   64.818   18.369   71.635   11.438   37.156   6.2889   40.977   3.4566 -3.821400 7.176212 
1 1 1   15    9   64 o   13.456   5.3158   5.5605   8.6166   4.7681   16.532   5.8561   10.096   16.289   6.9779   14.198   5.7059 2.091346 9.013838 
1 1 1   15    9   65 o   32.159   3.4118   44.365   8.8074   45.570   14.914   43.720   10.914   31.014   6.1167   31.434   4.3779 -0.4195518 7.521998 
1 1 1   15    9   66 o   13.922   5.2855   7.1068   8.2675  -9.9770   13.826   16.615   10.315   11.978   5.6164   18.809   5.9816 -6.830970 8.205079 
1 1 1   15    9   67 o   14.349   5.4325   7.7878   8.7192  -2.7732   16.983   11.568   10.160   14.640   6.6272   16.396   5.9254 -1.755767 8.889910 
1 1 1   15    9   68 o   40.866   2.9684   70.917   9.8208   74.968   19.406   69.522   11.387   39.528   6.2286   40.139   3.5155 -0.6116867 7.152246 
1 1 1   15    9   69 o   41.578   3.1342   73.868   10.544   83.299   19.452   69.944   12.548   41.934   5.8497   39.954   3.9025 1.980095 7.031931 
1 1 1   15    9   70 o   17.379   5.7057   14.239   9.3385   31.795   17.918   7.6922   10.942   24.106   7.9028   14.889   5.9549 9.217501 9.895185 
1 1 1   15    9   71 o   15.424   5.6980   10.194   9.4730   0.2259   18.838   13.568   10.960   15.519   7.0067   17.127   6.1587 -1.608644 9.328585 
1 1 1   15    9   72 o   11.712   5.0887   0.9244   9.0388 -23.8137   17.688   9.6676   10.516   11.609   5.6710   15.382   5.9307 -3.772781 8.205686 
1 1 1   15    9   73 o   28.192   4.2953   36.135   9.5594   28.975   18.057   38.923   11.268   22.605   7.9274   28.790   4.9815 -6.185719 9.362680 
1 1 1   15    9   74 o   26.123   5.0331   32.407   10.329   6.5157   26.324   37.119   11.229   17.944   8.1733   27.934   5.1203 -9.989119 9.644640 
1 1 1   15    9   75 f   38.638   3.2301   64.898   10.081   53.349   19.011   69.415   11.890   30.895   7.6016   39.566   3.7305 -8.671223 8.467670 
1 1 1   15    9   76 o   33.654   3.5358   50.112   9.5551   52.829   18.500   49.123   11.159   30.690   7.4673   32.738   4.2840 -2.048777 8.608933 
1 1 1   15    9   77 o   21.225   6.2668   23.925   11.589   15.555   17.753   30.140   15.299   17.930   7.4276   22.890   7.2855 -4.960155 10.40421 
1 1 1   15    9   78 o   12.356   5.2781   3.2431   9.4100  -1.9402   12.035   11.395   15.093   12.117   5.5218   16.350   6.8172 -4.233571 8.772919 
1 1 1   15    9   79 o   35.423   3.5641   56.032   10.152   49.660   13.008   65.960   16.236   31.875   5.1842   36.224   5.6857 -4.348438 7.694386 
1 1 1   15    9   80 o   18.502   5.9824   18.104   10.286   27.862   12.324  -4.3083   18.677   22.554   6.4049   13.928   6.5295 8.626569 9.146405 
1 1 1   15    9   81 o   14.640   5.7859   9.2929   10.212   5.8398   12.077   17.956   19.129   13.975   5.9748   18.226   7.6423 -4.250984 9.700727 
1 1 1   15    9   82 o   15.372   5.7915   11.338   9.8817   12.931   11.717   7.4136   18.390   16.179   6.2544   15.777   7.0385 0.4022264 9.415833 
1 1 1   15    9   83 o   15.545   5.8685   11.805   10.158   5.8912   12.029   26.500   18.963   13.895   5.9522   20.283   7.9240 -6.388349 9.910552 
1 1 1   15    9   84 o   14.416   5.9765   8.2257   11.507  -2.3186   14.212   28.291   19.605   12.675   5.8582   20.584   8.0526 -7.909005 9.958100 
1 1 1   15    9   85 o   16.435   6.3091   14.062   11.864   3.7392   14.799   32.626   19.846   14.031   6.2827   21.674   8.1982 -7.642996 10.32878 
1 1 1   15    9   86 o   18.670   6.4077   19.675   11.768   18.465   14.850   21.718   19.295   17.931   7.0101   18.725   7.7490 -0.7938004 10.44932 
1 1 1   15    9   87 o   9.7410   4.7238 -13.1584   11.674  -2.6830   14.829 -30.2355   18.933   12.728   5.9174   10.902   5.4241 1.825626 8.027216 
1 1 1   15    9   88 o   22.643   6.4729   29.363   12.546   24.572   15.897   37.273   20.428   19.695   7.3612   22.625   8.3658 -2.930019 11.14337 
1 1 1   15    9   89 o   15.784   6.2752   12.674   12.079   4.4968   14.797   29.006   20.912   14.040   6.2849   20.133   8.1685 -6.092881 10.30654 
1 1 1   15    9   90 o   11.530   5.3357  -2.7735   11.845   3.5098   14.898 -13.5703   19.529   13.825   6.2375   12.580   6.1029 1.244271 8.726484 
1 1 1   15    9   91 o   21.775   6.3862   27.398   12.069   26.319   15.160   29.265   19.945   20.246   7.2478   20.172   8.0492 0.7333565E-01 10.83140 
1 1 1   15    9   92 o   13.465   5.8241   5.7688   11.733  -1.4454   14.878   17.636   19.081   12.791   5.9400   17.314   7.4579 -4.523404 9.534371 
1 1 1   15    9   93 o   9.4185   4.6010 -14.6723   11.647 -30.4926   14.966   9.6204   18.546   9.2730   4.6453   15.556   6.9941 -6.283145 8.396201 
1 1 1   15    9   94 o   13.336   6.3600  -5.4384   19.202  -5.4384   19.202   0.0000   0.0000   13.336   6.3600  ?   ?  0.000000 6.359964 
1 1 1   15    9   95 o   17.790   7.1279   19.529   15.706   19.529   15.706   0.0000   0.0000   17.790   7.1279  ?   ?  0.000000 7.127904 
1 1 1   15   10  -91 o   15.227   7.0692   5.7278   21.048   5.7278   21.048   0.0000   0.0000   15.227   7.0692  ?   ?  0.000000 7.069196 
1 1 1   15   10  -90 o   12.202   6.0073 -20.1813   21.094 -20.1813   21.094   0.0000   0.0000   12.202   6.0073  ?   ?  0.000000 6.007324 
1 1 1   15   10  -89 o   11.372   5.6598 -28.7171   20.678 -28.7171   20.678   0.0000   0.0000   11.372   5.6598  ?   ?  0.000000 5.659774 
1 1 1   15   10  -88 o   11.304   5.6156 -27.1805   19.989 -27.1805   19.989   0.0000   0.0000   11.304   5.6156  ?   ?  0.000000 5.615624 
1 1 1   15   10  -87 o   13.248   6.4024  -9.9239   20.984  -9.9239   20.984   0.0000   0.0000   13.248   6.4024  ?   ?  0.000000 6.402390 
1 1 1   15   10  -86 f   13.832   6.5695  -3.6754   20.068  -3.6754   20.068   0.0000   0.0000   13.832   6.5695  ?   ?  0.000000 6.569502 
1 1 1   15   10  -85 o   14.914   6.9963   1.9039   21.504   1.9039   21.504   0.0000   0.0000   14.914   6.9963  ?   ?  0.000000 6.996317 
1 1 1   15   10  -84 o   17.106   7.5558   15.641   20.674   15.641   20.674   0.0000   0.0000   17.106   7.5558  ?   ?  0.000000 7.555799 
1 1 1   15   10  -83 o   12.826   5.9555  -1.9762   14.948   17.521   20.521 -24.0175   21.819   17.558   7.6476   12.257   6.0489 5.300587 9.750626 
1 1 1   15   10  -82 o   21.786   7.5846   31.011   16.511   15.490   22.622   48.707   24.155   17.353   7.7693   24.624   9.0985 -7.270643 11.96430 
1 1 1   15   10  -81 o   11.985   5.5477  -2.8105   12.817  -0.5638   15.736  -7.2384   22.091   13.386   6.1787   14.079   6.7435 -0.6932621 9.146094 
1 1 1   15   10  -80 o   10.195   4.9461 -13.9202   12.830 -18.9674   16.002  -4.8345   21.470   10.913   5.3441   14.253   6.7769 -3.340542 8.630532 
1 1 1   15   10  -79 o   13.066   5.8463   2.0856   12.786   6.6430   15.905  -6.2417   21.499   14.924   6.6081   14.142   6.7401 0.7825918 9.439084 
1 1 1   15   10  -78 o   11.027   5.2318  -8.1932   12.660 -17.0368   15.470   9.7370   22.028   10.983   5.3514   16.608   7.5300 -5.625472 9.237900 
1 1 1   15   10  -77 o   16.391   6.5193   13.361   13.042   6.2476   16.017   27.358   22.468   14.987   6.6339   20.204   8.3616 -5.216945 10.67358 
1 1 1   15   10  -76 o   23.667   6.6507   31.531   13.360   23.059   16.503   47.639   22.756   19.586   7.4601   25.724   8.9069 -6.138464 11.61837 
1 1 1   15   10  -75 o   17.336   6.6135   15.861   12.982   19.029   16.223   10.220   21.649   18.404   7.2867   16.851   7.5681 1.553272 10.50580 
1 1 1   15   10  -74 o   20.805   6.7761   24.554   13.183   22.036   16.518   28.971   21.881   19.401   7.4453   20.928   8.4035 -1.526482 11.22727 
1 1 1   15   10  -73 o   12.079   5.4893  -1.4572   11.790   16.608   17.255 -17.2755   16.147   17.918   7.3627   11.361   5.5203 6.556641 9.202307 
1 1 1   15   10  -72 o   13.709   6.1294   1.8096   14.029  -4.5212   27.400   4.0589   16.332   16.078   7.6477   14.875   6.6346 1.203067 10.12448 
1 1 1   15   10  -71 o   21.618   5.8707   24.109   10.610   19.002   27.877   24.975   11.473   19.458   8.6741   21.764   6.1798 -2.305988 10.65035 
1 1 1   15   10  -70 o   19.706   5.9989   20.013   10.499   20.105   28.564   19.999   11.289   19.908   8.8331   19.563   6.2617 0.3450260 10.82743 
1 1 1   15   10  -69 o   33.551   4.2549   51.259   11.375   34.700   29.595   54.129   12.322   22.778   9.5252   34.264   4.5219 -11.48622 10.54410 
1 1 1   15   10  -68 o   28.699   4.8661   38.664   10.978   57.118   29.031   35.585   11.858   28.300   10.040   26.961   5.5796 1.338743 11.48661 
1 1 1   15   10  -67 o   33.939   4.1985   51.965   11.368   26.544   29.619   56.356   12.310   21.681   9.3147   35.210   4.3838 -13.52971 10.29469 
1 1 1   15   10  -66 o   30.104   4.5711   41.554   10.865   54.349   29.232   39.503   11.703   28.081   10.063   28.921   5.1533 -0.8401089 11.30569 
1 1 1   15   10  -65 o   14.293   5.7529   6.8747   10.280 -38.5041   27.240   14.411   11.101   13.650   6.7404   17.469   6.2077 -3.818817 9.163412 
1 1 1   15   10  -64 o   20.802   5.4211   20.809   9.2838   21.520   16.331   20.470   11.285   20.516   7.4978   20.286   6.2278 0.2293758 9.746938 
1 1 1   15   10  -63 o   15.287   5.3372   10.285   8.1792   23.007   15.988   5.7757   9.5192   21.165   7.4565   13.709   5.5294 7.456810 9.283006 
1 1 1   15   10  -62 o   10.045   4.5404  -2.8005   7.9368   3.1455   15.274  -4.9997   9.2893   15.151   6.5986   10.358   4.7687 4.793668 8.141412 
1 1 1   15   10  -61 o   36.274   3.0645   56.069   8.9766   57.624   17.328   55.498   10.495   34.457   6.4047   35.768   3.6506 -1.310196 7.372086 
1 1 1   15   10  -60 o   27.907   3.8796   34.159   8.5870   19.192   15.920   40.301   10.198   20.120   7.3947   30.135   4.2709 -10.01546 8.539402 
1 1 1   15   10  -59 o   9.4790   4.3369  -3.9855   7.5203  -9.9465   13.330  -1.2023   9.1082   11.732   5.5051   11.309   5.0044 0.4224834 7.439789 
1 1 1   15   10  -58 o   11.322   5.0060  -1.2207   9.0963 -31.8137   13.532   23.996   12.286   9.0707   4.5246   22.255   6.4192 -13.18446 7.853578 
1 1 1   15   10  -57 o   13.137   5.3941   4.0108   9.2528  -8.4109   13.825   14.089   12.453   12.316   5.7219   18.014   6.5528 -5.697352 8.699406 
1 1 1   15   10  -56 o   17.137   5.1830   13.327   7.8547   4.0745   14.269   17.350   9.4084   15.328   6.5219   19.320   5.6307 -3.992761 8.616287 
1 1 1   15   10  -55 o   22.250   4.5973   22.251   8.0624   8.3813   14.398   28.587   9.7311   16.631   6.7667   25.142   4.9245 -8.511105 8.368895 
1 1 1   15   10  -54 o   29.945   3.5179   38.451   8.4233   41.688   15.068   36.980   10.159   29.642   6.4221   28.945   4.4476 0.6972160 7.811879 
1 1 1   15   10  -53 o   8.3247   3.9761  -9.2782   7.5652 -18.8322   13.810  -5.1819   9.0427   10.741   5.1916   10.305   4.7300 0.4357738 7.023210 
1 1 1   15   10  -52 o   15.204   5.2367   9.6720   7.8620   10.133   14.136   9.4656   9.4600   17.193   6.8036   15.541   5.7022 1.651938 8.877138 
1 1 1   15   10  -51 o   36.715   2.8399   56.580   8.4332   63.910   14.699   52.984   10.296   38.036   4.8510   35.196   3.6414 2.840858 6.065642 
1 1 1   15   10  -50 o   26.384   3.8281   30.118   7.9928   39.317   14.171   25.826   9.6793   29.042   6.1764   23.878   5.1262 5.163931 8.026620 
1 1 1   15   10  -49 o   11.310   4.7901   1.1794   7.6368   8.4382   13.655  -2.1246   9.2122   16.572   6.6439   11.251   5.0027 5.320943 8.316761 
1 1 1   15   10  -48 o   14.681   5.1767   8.6511   7.7075  -5.8942   13.606   15.523   9.3527   12.862   5.8651   18.543   5.6653 -5.681770 8.154457 
1 1 1   15   10  -47 f   45.777   2.7708   87.485   10.291  105.391   18.309   79.217   12.442   49.269   4.6125   43.216   3.5635 6.053116 5.828676 
1 1 1   15   10  -46 o   17.178   5.3447   13.038   8.2785   2.4275   13.564   19.337   10.451   14.847   6.3393   20.544   5.9188 -5.696823 8.672903 
1 1 1   15   10  -45 o   47.686   2.7048   94.707   10.471  106.564   18.915   89.469   12.573   49.535   4.7423   46.072   3.3711 3.462605 5.818406 
1 1 1   15   10  -44 o   65.570   2.2764  177.703   12.149  191.425   21.027  170.828   14.884   67.199   3.8548   64.030   2.8589 3.168190 4.799236 
1 1 1   15   10  -43 o   38.423   3.5604   62.492   11.024   46.850   25.507   66.085   12.225   30.291   9.3746   39.397   3.8561 -9.105902 10.13667 
1 1 1   15   10  -42 o   45.242   3.1858   85.798   11.674  129.947   29.804   77.798   12.688   53.149   7.0532   42.878   3.6651 10.27109 7.948682 
1 1 1   15   10  -41 o   18.131   6.2456   13.850   11.183   0.0000   0.0000   13.850   11.183  ?   ?    18.131   6.2456 0.000000 6.245583 
1 1 1   15   10  -40 o   38.531   3.0856   62.156   9.6106   65.229   15.268   60.139   12.368   38.705   4.9526   37.518   4.1115 1.187893 6.436796 
1 1 1   15   10  -39 o   29.760   3.7884   37.751   8.9822   48.741   14.108   30.260   11.648   33.206   5.3974   25.922   5.6706 7.284119 7.828635 
1 1 1   15   10  -38 o   13.672   5.3285   5.5129   8.5579   1.7501   13.412   8.0972   11.115   14.755   6.3020   15.796   6.0954 -1.040504 8.767530 
1 1 1   15   10  -37 o   24.112   4.6490   25.479   8.8063   47.718   13.997   10.910   11.329   32.890   5.4088   16.996   6.2396 15.89399 8.257535 
1 1 1   15   10  -36 o   83.922   1.7972  288.903   12.294  319.697   20.273  270.990   15.462   87.820   2.8357   81.065   2.3424 6.755074 3.678048 
1 1 1   15   10  -35 o   15.561   5.5322   9.3646   8.8174   12.841   13.968   7.0615   11.369   18.529   6.9051   15.560   6.1187 2.969009 9.225979 
1 1 1   15   10  -34 o   72.848   1.8867  217.883   11.194  216.481   18.141  218.744   14.225   72.171   3.0908   72.828   2.3994 -0.6567917 3.912824 
1 1 1   15   10  -33 o   36.783   2.9353   56.351   8.7281   56.451   14.579   56.295   10.896   36.064   5.1017   36.534   3.7103 -0.4701805 6.308184 
1 1 1   15   10  -32 o   31.409   3.3104   41.415   8.3482   39.357   14.097   42.526   10.360   29.670   6.0344   31.586   4.1220 -1.916607 7.307884 
1 1 1   15   10  -31 o   90.945   1.8505  339.096   13.719  352.757   25.404  333.472   16.300   92.066   3.3909   90.072   2.2200 1.994057 4.052949 
1 1 1   15   10  -30 o   68.579   2.4146  193.786   13.477   0.0000   0.0000  193.786   13.477  ?   ?    68.579   2.4146 0.000000 2.414587 
1 1 1   15   10  -29 o   33.278   3.3846   46.419   9.0536   49.116   17.433   45.423   10.594   33.030   6.7041   32.719   4.0593 0.3108292 7.837244 
1 1 1   15   10  -28 o   17.255   5.1993   12.824   7.9148   23.234   13.564   7.4500   9.7458   22.812   6.7911   15.134   5.7403 7.678063 8.892078 
1 1 1   15   10  -27 o   22.520   5.2468   22.354   9.4523   29.925   13.896   15.835   12.895   25.765   6.5907   19.594   6.7081 6.170912 9.403973 
1 1 1   15   10  -26 o   29.807   4.0892   37.759   9.6741   36.759   14.008   38.670   13.376   28.729   6.1661   29.629   5.7457 -0.9001331 8.428156 
1 1 1   15   10  -25 o   27.605   4.3930   32.660   9.5543   38.110   14.004   27.914   13.068   29.314   6.0609   24.960   6.3948 4.354239 8.810661 
1 1 1   15   10  -24 o   34.788   3.1339   50.409   8.7917   67.957   14.545   40.308   11.036   40.009   4.5401   30.692   4.5486 9.317318 6.426714 
1 1 1   15   10  -23 o   40.066   3.1838   66.762   10.313   68.839   15.005   64.902   14.197   40.241   4.6605   39.101   4.5383 1.140060 6.505158 
1 1 1   15   10  -22 o   20.145   5.1118   17.781   8.4066   23.266   14.206   14.825   10.429   22.960   6.9757   18.736   6.0205 4.224470 9.214501 
1 1 1   15   10  -21 o   52.067   2.3429  111.533   9.9184  127.349   16.506  102.594   12.409   55.276   3.6843   49.763   3.0740 5.513115 4.798269 
1 1 1   15   10  -20 o   9.8852   4.5349  -5.5803   8.2964 -15.7131   13.937  -0.0188   10.325   11.580   5.4928   12.813   5.5020 -1.232123 7.774505 
1 1 1   15   10  -19 o   17.851   5.5723   13.499   8.9908   13.983   14.532   13.199   11.444   19.387   7.0748   18.243   6.3164 1.143339 9.484182 
1 1 1   15   10  -18 o   47.809   2.9721   94.553   11.525   90.130   23.055   96.026   13.307   45.487   6.3943   48.068   3.4186 -2.580734 7.250779 
1 1 1   15   10  -17 o   32.222   3.6839   43.562   9.5025   44.877   15.471   42.765   12.042   31.958   6.1621   31.607   4.8266 0.3505802 7.827389 
1 1 1   15   10  -16 f   63.774   2.2148  166.960   11.496  181.316   18.243  157.503   14.806   66.148   3.3946   61.767   2.9491 4.381329 4.496712 
1 1 1   15   10  -15 o   87.970   1.9116  316.808   13.708  353.437   21.482  291.649   17.804   92.625   2.8486   84.209   2.5968 8.416161 3.854633 
1 1 1   15   10  -14 o  111.278   1.8174  506.677   16.485  497.785   24.835  513.683   22.042  109.977   2.7725  111.876   2.4170 -1.898903 3.678134 
1 1 1   15   10  -13 o   65.875   2.0429  177.903   10.956  203.803   18.790  164.561   13.486   70.192   3.2932   63.233   2.6221 6.958794 4.209605 
1 1 1   15   10  -12 o   51.156   2.3477  107.567   9.7639  118.453   16.465  101.662   12.126   53.331   3.8126   49.593   3.0138 3.738335 4.859953 
1 1 1   15   10  -11 o   48.237   2.6767   95.903   10.484  100.008   16.509   93.128   13.571   48.878   4.1838   47.334   3.5430 1.543880 5.482439 
1 1 1   15   10  -10 o   40.371   3.1569   67.576   10.306   59.773   15.895   73.235   13.538   37.343   5.3763   41.824   4.0202 -4.480785 6.713199 
1 1 1   15   10   -9 o   84.378   2.1447  291.871   14.740  285.129   20.252  299.464   21.493   83.169   2.9921   85.202   3.0999 -2.032684 4.308345 
1 1 1   15   10   -8 o   48.182   2.7354   95.709   10.699   88.429   16.062  101.516   14.345   45.905   4.3440   49.429   3.5846 -3.523518 5.632075 
1 1 1   15   10   -7 o   78.113   2.1640  250.168   13.766  239.066   34.552  252.263   15.008   75.058   5.6898   78.398   2.3511 -3.340111 6.156382 
1 1 1   15   10   -6 o   51.951   2.7110  111.187   11.441  108.883   31.093  111.548   12.304   49.485   7.9796   51.993   2.9149 -2.508209 8.495281 
1 1 1   15   10   -5 o   49.395   2.8049  100.612   11.247   64.120   30.255  106.464   12.116   37.066   9.8474   50.787   2.9391 -13.72100 10.27663 
1 1 1   15   10   -4 o   65.432   2.1272  175.539   11.331  201.185   20.811  164.733   13.508   69.653   3.6783   63.285   2.6242 6.368473 4.518491 
1 1 1   15   10   -3 o   32.348   3.5573   43.732   9.2254   31.036   16.630   49.376   11.088   26.411   7.4197   34.278   4.0461 -7.867283 8.451201 
1 1 1   15   10   -2 o   39.850   3.0208   65.726   9.7397   76.456   18.078   61.338   11.561   42.355   5.3557   38.329   3.7481 4.026196 6.536931 
1 1 1   15   10   -1 f   37.896   3.1300   59.539   9.5827   65.376   17.956   57.215   11.331   38.960   5.8333   36.991   3.8123 1.968731 6.968588 
1 1 1   15   10    0 o   25.628   4.5322   28.120   9.1217   19.479   16.940   31.648   10.825   22.047   7.6820   27.080   5.0908 -5.033255 9.215671 
1 1 1   15   10    1 f   35.338   3.3969   51.986   9.6645   52.255   18.156   51.880   11.416   34.460   6.7051   35.146   4.0594 -0.6858711 7.838139 
1 1 1   15   10    2 o   58.483   2.3078  140.420   10.980  162.577   20.135  131.041   13.100   62.506   3.9723   56.383   2.8596 6.123554 4.894540 
1 1 1   15   10    3 o   28.037   4.2080   33.330   9.3205   34.929   17.018   32.645   11.140   27.956   7.3662   27.494   5.1600 0.4617100 8.993666 
1 1 1   15   10    4 o   32.400   3.6011   43.898   9.3503   43.096   17.517   44.217   11.057   31.116   7.0676   32.348   4.2998 -1.231977 8.272840 
1 1 1   15   10    5 o   88.840   1.8780  322.920   13.600  373.678   25.230  302.131   16.146   95.146   3.2578   85.817   2.3103 9.328903 3.993814 
1 1 1   15   10    6 o   88.295   1.8738  318.978   13.487  321.833   24.158  317.685   16.256   88.250   3.3644   88.009   2.2678 0.2416687 4.057367 
1 1 1   15   10    7 o   40.816   3.1072   69.011   10.260   70.894   23.163   68.552   11.444   39.983   7.3786   40.594   3.4925 -0.6109734 8.163446 
1 1 1   15   10    8 o   51.441   2.5974  108.936   10.856  138.143   25.270  102.325   12.022   57.022   5.5051   49.773   2.9768 7.248539 6.258351 
1 1 1   15   10    9 o   21.349   5.3944   19.910   9.3897  -3.0992   20.341   26.141   10.585   17.111   7.5289   24.466   5.4475 -7.355053 9.292965 
1 1 1   15   10   10 o   69.024   2.9219  196.410   16.403   0.0000   0.0000  196.410   16.403  ?   ?    69.024   2.9219 0.000000 2.921894 
1 1 1   15   10   11 o   44.978   2.7553   83.475   10.054   97.761   14.825   71.311   13.680   48.438   3.7846   41.234   4.1254 7.204220 5.598433 
1 1 1   15   10   12 o   94.769   1.8666  367.536   14.419  369.687   20.897  365.582   19.922   94.797   2.7071   94.305   2.5940 0.4925690 3.749296 
1 1 1   15   10   13 o   50.890   2.5652  106.636   10.607  110.929   15.630  102.970   14.442   51.617   3.7400   49.765   3.5842 1.852501 5.180145 
1 1 1   15   10   14 o   28.498   3.7385   34.195   8.4753   46.583   13.725   26.559   10.775   32.887   5.2999   24.630   5.5053 8.257092 7.641826 
1 1 1   15   10   15 o   23.954   4.4741   24.674   8.4150   22.721   13.572   25.893   10.726   22.772   6.7962   24.302   5.5380 -1.530001 8.766865 
1 1 1   15   10   16 f   24.135   4.7937   25.207   9.0983   41.600   17.438   19.076   10.665   30.446   7.1492   20.899   5.9660 9.546503 9.311503 
1 1 1   15   10   17 o   48.271   2.3913   95.877   9.3802  100.202   14.940   93.062   12.052   49.014   3.7684   47.394   3.1371 1.619877 4.903278 
1 1 1   15   10   18 o   63.140   2.0227  163.495   10.397  162.288   16.456  164.297   13.413   62.606   3.2356   63.165   2.6107 -0.5591164 4.157472 
1 1 1   15   10   19 o   60.968   2.0858  152.531   10.351  154.618   16.597  151.202   13.242   61.063   3.3471   60.567   2.6888 0.4956512 4.293354 
1 1 1   15   10   20 o   31.283   3.9568   41.315   9.8647   59.127   16.488   31.385   12.311   36.945   5.6547   26.682   5.8241 10.26240 8.117615 
1 1 1   15   10   21 o   50.077   2.5573  103.373   10.404  105.597   15.338  101.478   14.160   50.286   3.7693   49.360   3.5428 0.9264984 5.172939 
1 1 1   15   10   22 o   26.759   4.3330   30.639   9.1284   31.261   13.521   30.119   12.374   26.469   6.3486   26.072   5.9534 0.3969173 8.703319 
1 1 1   15   10   23 o   37.515   3.1317   58.542   9.4896   69.184   14.087   49.702   12.840   40.452   4.3400   34.087   4.7498 6.365421 6.433988 
1 1 1   15   10   24 o   16.055   5.5364   10.158   8.7885   8.9790   12.962   11.162   11.956   17.028   6.5794   17.494   6.4118 -0.4660912 9.186988 
1 1 1   15   10   25 o   71.078   2.0688  207.390   11.974  228.216   17.363  188.503   16.535   74.323   2.8713   67.490   3.0131 6.832481 4.162167 
1 1 1   15   10   26 o   24.248   4.4021   25.363   8.3808   23.416   13.437   26.602   10.722   22.923   6.7423   24.547   5.4957 -1.623331 8.698392 
1 1 1   15   10   27 o   11.254   4.8534  -0.3478   8.0996   13.418   13.196  -8.6690   10.260   18.701   6.7535   10.538   4.9070 8.163066 8.347980 
1 1 1   15   10   28 o   59.695   2.0980  146.427   10.193  166.458   16.543  134.168   12.942   63.312   3.2159   56.957   2.7960 6.355667 4.261405 
1 1 1   15   10   29 o   96.327   1.8760  380.349   14.731  391.020   21.397  370.734   20.309   97.337   2.6994   94.806   2.6305 2.530701 3.769141 
1 1 1   15   10   30 o   49.772   2.8869  102.701   11.662  120.437   20.145   93.760   14.303   53.205   4.6930   47.275   3.7421 5.929886 6.002288 
1 1 1   15   10   31 o   94.180   2.0784  364.202   15.956  412.207   27.090  338.701   19.744   99.560   3.3427   90.564   2.6775 8.995522 4.282834 
1 1 1   15   10   32 o   59.390   2.2705  145.282   10.972  164.939   21.070  137.969   12.851   62.536   4.1569   57.736   2.7385 4.800198 4.977876 
1 1 1   15   10   33 o   69.368   1.9260  197.604   10.880  206.721   17.484  191.843   13.899   70.558   3.0471   68.172   2.5055 2.386070 3.944931 
1 1 1   15   10   34 o   61.336   2.0506  154.715   10.238  155.457   16.635  154.262   12.990   61.029   3.3567   61.076   2.6152 -0.4671478E-01 4.255210 
1 1 1   15   10   35 o   40.878   2.7007   69.360   8.9487   84.340   14.817   60.758   11.228   44.588   4.1233   37.952   3.6753 6.636356 5.523545 
1 1 1   15   10   36 o   46.378   2.4293   88.932   9.1520   80.442   14.826   94.158   11.633   43.470   4.2379   47.544   3.0171 -4.073853 5.202198 
1 1 1   15   10   37 o   15.580   5.6830   9.0629   9.3755   2.2464   15.370   13.102   11.832   15.781   6.7433   18.033   6.4086 -2.252543 9.302833 
1 1 1   15   10   38 o   8.6236   4.1240 -10.5776   8.1938  -8.6662   14.739 -11.4326   9.8574   13.067   6.0128   9.6532   4.5904 3.413851 7.564733 
1 1 1   15   10   39 o   38.288   2.9944   61.255   9.2713   80.308   17.102   53.324   11.033   43.018   4.9682   35.406   3.8867 7.611481 6.307893 
1 1 1   15   10   40 o   34.027   3.3436   48.785   9.1545   31.929   16.222   56.662   11.089   26.033   7.3332   36.536   3.7777 -10.50377 8.249084 
1 1 1   15   10   41 o   23.727   4.7850   24.892   8.9350   36.527   16.602   20.147   10.601   27.804   7.2510   21.069   5.9258 6.734491 9.364425 
1 1 1   15   10   42 o   44.386   2.9518   82.275   10.619   31.258   25.028   93.476   11.727   25.733   9.2999   47.281   3.0591 -21.54826 9.790081 
1 1 1   15   10   43 o   10.728   4.9523  -6.7814   10.112   0.0000   0.0000  -6.7814   10.112  ?   ?    10.728   4.9523 0.000000 4.952336 
1 1 1   15   10   44 o   11.005   4.9455  -3.3272   9.2596 -31.9499   22.706   2.3826   10.141   13.479   6.5484   13.229   5.5569 0.2494669 8.588444 
1 1 1   15   10   45 o   30.468   3.9326   39.900   9.5395   44.958   17.964   37.914   11.258   30.662   7.2938   29.291   4.8872 1.370779 8.779785 
1 1 1   15   10   46 o   38.719   3.3490   63.336   10.466   64.715   17.556   62.576   13.036   37.828   5.8847   38.071   4.2743 -0.2426338 7.273229 
1 1 1   15   10   47 f   25.364   5.0438   28.840   10.061   11.067   16.709   38.948   12.602   18.364   7.3539   29.373   5.4642 -11.00909 9.161722 
1 1 1   15   10   48 o   28.888   4.3505   36.465   9.9269   21.380   16.177   45.576   12.572   21.584   7.5079   32.053   4.9729 -10.46885 9.005460 
1 1 1   15   10   49 o   26.433   4.4109   30.732   9.1696   35.172   16.674   28.807   10.979   26.844   7.3881   25.097   5.5173 1.747349 9.220873 
1 1 1   15   10   50 o   16.357   5.5371   11.474   8.7824   0.9333   15.994   16.025   10.508   15.400   6.7287   18.819   6.0432 -3.419069 9.044083 
1 1 1   15   10   51 o   30.113   3.5941   38.864   8.6483   37.512   14.595   39.596   10.736   28.143   6.4940   29.984   4.5341 -1.840914 7.920236 
1 1 1   15   10   52 o   14.552   5.3800   8.0076   8.4478   33.029   14.666  -4.4159   10.334   26.186   6.8084   11.320   5.1422 14.86672 8.532064 
1 1 1   15   10   53 o   8.3575   4.0234 -11.1807   8.0946   12.786   14.081 -23.0104   9.8925   18.033   6.8855   7.9072   3.9319 10.12528 7.929061 
1 1 1   15   10   54 o   13.162   5.2125   5.0722   8.3034   5.1842   14.178   5.0138   10.244   15.667   6.5750   14.021   5.7066 1.646192 8.706039 
1 1 1   15   10   55 o   38.743   2.9008   63.204   9.0946   68.211   15.504   60.577   11.229   39.101   4.9770   37.543   3.7182 1.557270 6.212507 
1 1 1   15   10   56 o   39.285   2.9258   65.073   9.3020   65.123   15.744   65.045   11.529   37.982   5.2233   38.907   3.6791 -0.9244995 6.388900 
1 1 1   15   10   57 o   9.6537   4.4704  -5.6875   8.3355 -20.1875   14.366   1.6723   10.235   10.789   5.2340   12.839   5.4950 -2.050241 7.588741 
1 1 1   15   10   58 o   43.710   2.6932   80.213   9.5492  105.678   16.272   66.837   11.793   49.298   4.0860   39.363   3.7197 9.935459 5.525502 
1 1 1   15   10   59 o   18.306   5.4133   15.597   8.6423   11.881   14.345   17.715   10.828   17.504   6.8760   19.340   6.1261 -1.836565 9.209091 
1 1 1   15   10   60 o   20.179   5.1092   18.974   8.4109   9.1696   14.260   24.206   10.416   16.569   6.7369   22.555   5.6717 -5.985649 8.806458 
1 1 1   15   10   61 o   40.869   2.9679   70.898   9.8200   80.805   19.685   67.616   11.331   41.276   6.0284   39.572   3.5503 1.703972 6.996164 
1 1 1   15   10   62 o   23.622   6.3744   27.714   12.556   30.751   18.374   25.053   17.198   23.884   8.0088   21.972   7.7341 1.911631 11.13363 
1 1 1   15   10   63 o   46.756   3.6880   95.068   13.942  102.210   21.088   89.522   18.584   46.603   5.6674   43.961   5.2924 2.642830 7.754294 
1 1 1   15   10   64 o   21.544   5.4941   22.385   9.6773   43.384   19.585   15.601   11.131   27.849   8.1260   18.060   6.2306 9.789824 10.23976 
1 1 1   15   10   65 o   32.966   3.8614   48.069   10.180   57.314   19.501   44.605   11.935   32.828   7.4577   31.051   4.8759 1.777122 8.910211 
1 1 1   15   10   66 o   8.9548   4.3000 -10.8432   9.1108   8.5727   17.359 -18.2247   10.703   16.712   7.1545   8.8263   4.3323 7.885785 8.363936 
1 1 1   15   10   67 o   18.980   5.6968   17.813   9.5155   17.621   17.438   17.895   11.355   18.990   7.5432   18.853   6.2954 0.1368637 9.825048 
1 1 1   15   10   68 o   34.928   3.6069   53.788   10.122   44.117   18.404   57.982   12.119   27.828   7.8008   35.781   4.2373 -7.952408 8.877381 
1 1 1   15   10   69 o   21.668   5.3831   23.110   9.4657   23.802   17.083   22.803   11.371   20.645   7.6473   20.975   6.2111 -0.3299713 9.851844 
1 1 1   15   10   70 o   10.884   4.8875  -1.3832   9.0243  -8.3170   16.216   1.7276   10.862   12.777   6.0195   12.632   5.5316 0.1454592 8.175108 
1 1 1   15   10   71 o   20.713   5.5173   21.644   9.4817   32.683   17.289   16.896   11.339   23.327   7.7677   18.063   6.2855 5.264593 9.992265 
1 1 1   15   10   72 o   13.588   5.4149   7.0587   9.0147   16.702   16.654   3.0625   10.721   18.018   7.2972   12.836   5.5597 5.181569 9.173850 
1 1 1   15   10   73 o   12.979   5.3417   5.5047   9.1017  -1.3750   16.791   8.3673   10.831   13.894   6.4020   14.507   5.8813 -0.6132326 8.693380 
1 1 1   15   10   74 o   17.631   7.0868   16.244   15.578   42.749   25.449   0.3641   19.699   23.797   9.2125   14.907   6.8923 8.889192 11.50538 
1 1 1   15   10   75 o   15.031   6.2769   8.8915   12.825  -4.2269   16.495   28.939   20.391   13.225   6.1793   20.965   8.2093 -7.739717 10.27503 
1 1 1   15   10   76 o   12.598   5.7005  -0.0990   12.550   7.7654   16.223 -11.8199   19.805   15.413   6.7547   13.172   6.3290 2.241004 9.256448 
1 1 1   15   10   77 o   15.500   6.1092   11.324   11.357  -2.4108   13.715   41.279   20.255   12.527   5.7772   24.543   8.4072 -12.01632 10.20077 
1 1 1   15   10   78 o   13.131   5.7247   3.8432   11.521   5.8585   14.134  -0.1478   19.890   14.398   6.3073   14.658   6.8276 -0.2598629 9.295114 
1 1 1   15   10   79 o   11.559   5.3244  -2.6820   11.599  -5.1856   14.230   2.2759   20.024   12.137   5.6930   14.989   6.9366 -2.851751 8.973666 
1 1 1   15   10   80 o   12.062   5.4819  -0.5364   11.759   2.3026   14.417  -6.1769   20.322   13.577   6.1300   13.810   6.5737 -0.2324800 8.988322 
1 1 1   15   10   81 o   11.208   5.2416  -4.9313   11.915  -7.4391   14.773  -0.2631   20.156   11.925   5.6560   14.548   6.8083 -2.622894 8.851192 
1 1 1   15   10   82 o   13.230   5.8025   4.1299   11.993   3.1401   14.584   6.1970   21.076   13.740   6.1879   15.640   7.1943 -1.899515 9.489357 
1 1 1   15   10   83 o   16.658   6.3997   15.095   12.214  -2.9418   14.601   57.118   22.287   12.543   5.8451   27.995   8.7785 -15.45160 10.54640 
1 1 1   15   10   84 o   14.677   6.0631   9.5647   11.785   8.8865   14.433   10.921   20.411   14.942   6.4613   16.209   7.3083 -1.267555 9.754985 
1 1 1   15   10   85 o   12.980   5.7314   3.6408   11.885   11.454   14.744 -10.8586   20.084   15.609   6.6352   12.999   6.2777 2.610280 9.134278 
1 1 1   15   10   86 f   18.187   6.4850   19.382   12.125   29.613   14.925  -0.4724   20.792   21.506   7.2182   14.411   6.7974 7.094877 9.915010 
1 1 1   15   10   87 o   22.532   6.4339   29.625   12.402   23.741   15.369   40.609   20.998   19.162   7.2219   22.888   8.4783 -3.725414 11.13716 
1 1 1   15   10   88 o   15.108   6.2166   11.177   12.324   14.460   15.114   4.6608   21.289   16.285   6.8082   15.093   7.0417 1.191117 9.794719 
1 1 1   15   10   89 o   15.335   6.2960   11.882   12.604   14.797   15.804   6.7889   20.891   16.377   6.9114   15.321   7.0887 1.056011 9.900341 
1 1 1   15   10   90 o   15.880   6.7760   12.921   15.479   12.921   15.479   0.0000   0.0000   15.880   6.7760  ?   ?  0.000000 6.776008 
1 1 1   15   10   91 o   15.293   6.9115   8.4611   18.382   8.4611   18.382   0.0000   0.0000   15.293   6.9115  ?   ?  0.000000 6.911505 
1 1 1   15   11  -86 o   13.747   6.5374  -2.9939   19.998  -2.9939   19.998   0.0000   0.0000   13.747   6.5374  ?   ?  0.000000 6.537369 
1 1 1   15   11  -85 o   17.830   7.8263   21.524   21.858   21.524   21.858   0.0000   0.0000   17.830   7.8263  ?   ?  0.000000 7.826276 
1 1 1   15   11  -84 o   14.841   6.8792   5.1972   19.810   5.1972   19.810   0.0000   0.0000   14.841   6.8792  ?   ?  0.000000 6.879204 
1 1 1   15   11  -83 f   14.110   6.6886  -1.0954   20.608  -1.0954   20.608   0.0000   0.0000   14.110   6.6886  ?   ?  0.000000 6.688619 
1 1 1   15   11  -82 o   14.460   6.7429   2.5634   19.485   2.5634   19.485   0.0000   0.0000   14.460   6.7429  ?   ?  0.000000 6.742895 
1 1 1   15   11  -81 o   10.636   5.1819 -14.9260   14.500 -14.0884   18.795 -16.1571   22.788   12.195   5.9322   13.037   6.3828 -0.8419933 8.713898 
1 1 1   15   11  -80 o   14.230   6.3896   5.3599   15.422  -2.3648   20.460   15.522   23.467   14.060   6.6647   17.075   7.7536 -3.015193 10.22434 
1 1 1   15   11  -79 o   14.507   6.4613   6.5044   15.432   0.2716   20.476   14.699   23.479   14.455   6.7957   17.000   7.7337 -2.545011 10.29523 
1 1 1   15   11  -78 o   20.462   7.4129   27.400   15.915   27.659   21.161   27.063   24.147   19.630   8.1184   19.248   8.3403 0.3823338 11.63918 
1 1 1   15   11  -77 o   20.868   7.5081   28.614   16.291   21.665   22.141   36.819   24.057   18.358   7.9704   21.426   8.7360 -3.068439 11.82559 
1 1 1   15   11  -76 o   12.249   5.8148  -7.0681   15.683   6.9141   21.008 -24.6665   23.569   15.699   7.2072   12.678   6.2620 3.021282 9.547604 
1 1 1   15   11  -75 o   11.671   5.5902 -10.0089   15.182  -0.9657   19.957 -22.4338   23.392   14.354   6.7359   12.848   6.3256 1.506529 9.240402 
1 1 1   15   11  -74 o   16.929   6.8996   15.440   15.000   24.955   19.574   1.9041   23.347   19.422   7.8945   15.443   7.2588 3.979445 10.72439 
1 1 1   15   11  -73 o   10.089   4.8837 -13.0716   12.336  -2.1655   14.570 -40.6864   23.184   12.763   5.9102   11.499   5.7634 1.264084 8.255178 
1 1 1   15   11  -72 o   16.383   6.5350   13.634   13.142  -5.4126   15.611   59.974   24.350   12.604   5.9281   28.331   9.2079 -15.72672 10.95109 
1 1 1   15   11  -71 f   10.093   4.8988 -14.3601   12.625  -1.7083   15.123 -43.4496   22.932   13.114   6.0546   11.320   5.6819 1.794073 8.303139 
1 1 1   15   11  -70 o   17.118   6.5927   15.510   12.984   24.375   15.508  -5.2699   23.744   20.072   7.3110   14.892   7.0936 5.179776 10.18675 
1 1 1   15   11  -69 o   21.035   6.7338   25.346   13.055   15.475   15.531   49.118   24.101   17.266   7.0268   25.597   9.1412 -8.330667 11.52988 
1 1 1   15   11  -68 o   15.487   5.7961   11.582   9.8623  -6.5240   15.363   24.275   12.863   12.465   5.8682   20.690   6.6897 -8.224851 8.898767 
1 1 1   15   11  -67 o   18.506   5.7110   17.826   9.4743   24.832   15.536   13.678   11.954   20.443   7.3349   16.545   6.3377 3.898396 9.693670 
1 1 1   15   11  -66 o   28.168   5.8319   40.669   12.949   56.894   28.516   36.455   14.534   26.694   9.8817   25.531   6.8445 1.162708 12.02059 
1 1 1   15   11  -65 o   26.296   5.3592   34.249   11.097   51.514   17.260   22.081   14.489   30.458   7.0857   19.811   7.0864 10.64659 10.02121 
1 1 1   15   11  -64 o   9.8683   4.6945  -9.1802   10.329 -26.7807   16.491   2.1847   13.251   10.580   5.2280   13.610   6.0286 -3.030146 7.979684 
1 1 1   15   11  -63 o   33.681   5.0038   53.904   13.321   50.020   28.653   54.975   15.046   25.955   9.8431   33.296   5.7515 -7.340063 11.40032 
1 1 1   15   11  -62 o   31.379   5.5702   48.143   13.726   47.295   15.544   51.145   29.245   30.182   6.5097   26.377   9.9576 3.804377 11.89664 
1 1 1   15   11  -61 o   14.804   6.2715   6.2205   13.096   14.370   15.137 -18.0330   26.113   17.652   7.0225   14.841   7.1650 2.810396 10.03259 
1 1 1   15   11  -60 o   43.132   3.2751   80.666   11.429   75.614   17.281   84.593   15.237   39.727   5.4823   43.176   4.3903 -3.449188 7.023575 
1 1 1   15   11  -59 o   35.310   4.1701   56.042   11.772   69.174   21.691   50.559   14.015   35.661   7.6884   32.469   5.4908 3.192287 9.447822 
1 1 1   15   11  -58 o   20.150   5.5660   19.836   9.4444  -7.6231   16.804   32.516   11.419   13.385   6.2483   25.917   5.5708 -12.53232 8.371131 
1 1 1   15   11  -57 o   13.800   5.3943   6.8765   8.7917   17.002   17.228   3.3109   10.223   19.068   7.5217   13.074   5.5400 5.994020 9.341702 
1 1 1   15   11  -56 o   10.437   4.7646  -3.7871   9.0110 -10.6254   16.697  -0.9768   10.704   12.982   6.1135   12.110   5.3881 0.8722048 8.148996 
1 1 1   15   11  -55 o   37.212   3.4342   59.856   10.300   66.868   18.705   56.805   12.339   36.920   6.4496   35.659   4.3337 1.261467 7.770384 
1 1 1   15   11  -54 o   18.798   5.4372   16.758   8.8029  -1.0833   14.141   28.046   11.248   13.747   6.1496   24.122   5.7935 -10.37458 8.448810 
1 1 1   15   11  -53 o   35.999   3.0112   55.158   8.7555   45.668   14.938   60.124   10.806   30.755   6.1734   37.264   3.6024 -6.508976 7.147629 
1 1 1   15   11  -52 o   39.119   2.7842   64.612   8.8202   83.605   15.498   55.513   10.727   43.425   4.4406   35.752   3.7359 7.672951 5.803084 
1 1 1   15   11  -51 f   9.0213   4.2343  -6.9087   7.8944  -8.4061   14.087  -6.2232   9.5317   12.373   5.7574   10.288   4.7697 2.084721 7.476496 
1 1 1   15   11  -50 o   35.925   3.2367   55.047   9.3768   37.983   19.550   60.146   10.686   26.774   8.1929   37.401   3.5476 -10.62723 8.928007 
1 1 1   15   11  -49 o   33.403   3.2338   47.588   8.6952   43.452   15.707   49.416   10.441   29.930   6.6145   33.732   3.8669 -3.802450 7.661927 
1 1 1   15   11  -48 o   7.4202   3.6511 -15.1683   7.7545 -33.5427   14.515  -7.8291   9.1734   9.4318   4.7017   9.7457   4.5712 -0.3139019 6.557595 
1 1 1   15   11  -47 o   32.440   3.5698   45.229   9.2839   35.591   19.469   48.065   10.562   26.181   8.2039   33.253   3.9752 -7.071646 9.116277 
1 1 1   15   11  -46 o   46.189   2.7311   89.411   10.237   58.118   21.532   98.551   11.636   33.849   7.9414   48.383   2.9647 -14.53428 8.476743 
1 1 1   15   11  -45 o   19.824   5.1110   18.006   8.3120   28.014   15.408   13.898   9.8715   23.866   7.2678   17.637   5.8693 6.228811 9.341865 
1 1 1   15   11  -44 o   58.537   3.0327  144.111   14.421   0.0000   0.0000  144.111   14.421  ?   ?    58.537   3.0327 0.000000 3.032660 
1 1 1   15   11  -43 o   45.093   2.6221   84.926   9.5965   68.650   16.287   93.581   11.877   39.139   5.2362   47.115   3.1099 -7.976204 6.090155 
1 1 1   15   11  -42 o   34.683   3.2064   50.969   8.9624   27.738   15.474   62.695   10.994   23.852   7.2873   38.333   3.5591 -14.48116 8.109981 
1 1 1   15   11  -41 o   36.814   2.9901   57.079   8.8958   62.133   15.558   54.623   10.843   37.228   5.2744   35.665   3.7876 1.562717 6.493473 
1 1 1   15   11  -40 o   17.906   5.5436   14.448   8.9186   7.4566   14.367   18.831   11.376   16.471   6.7377   20.172   6.2634 -3.700241 9.199265 
1 1 1   15   11  -39 o   17.980   5.8165   14.436   9.7232   13.849   14.398   14.928   13.184   18.562   6.9912   18.712   6.7513 -0.1505089 9.718944 
1 1 1   15   11  -38 o   34.704   3.4618   51.213   9.6625   71.675   15.265   37.534   12.481   40.447   4.7184   28.736   5.5291 11.71128 7.268655 
1 1 1   15   11  -37 o   57.752   2.2025  137.972   10.349  156.667   17.239  127.436   12.941   60.883   3.4881   55.208   2.8856 5.674786 4.527026 
1 1 1   15   11  -36 o   56.214   2.4425  131.128   11.165  118.480   16.952  140.820   14.839   52.657   3.9788   57.917   3.1551 -5.260372 5.077881 
1 1 1   15   11  -35 o   13.617   5.3108   5.6952   8.5058   4.0527   14.137   6.6272   10.649   15.520   6.5424   14.907   5.9031 0.6134424 8.811925 
1 1 1   15   11  -34 o   22.935   4.8241   23.478   8.7325   16.424   14.639   27.374   10.880   19.670   7.1119   24.511   5.5721 -4.841692 9.034809 
1 1 1   15   11  -33 o   40.163   3.4509   68.201   11.188   84.123   17.845   57.887   14.362   43.760   5.0980   36.274   4.9893 7.486462 7.133190 
1 1 1   15   11  -32 f   50.113   2.9206  104.878   11.879  122.059   19.102   94.045   15.168   53.263   4.4401   46.951   4.0014 6.312531 5.977066 
1 1 1   15   11  -31 o   49.260   2.9427  101.334   11.762  123.225   18.893   87.479   15.030   53.596   4.3622   45.232   4.1217 8.364151 6.001473 
1 1 1   15   11  -30 o   68.600   2.0746  193.955   11.587  193.459   20.881  194.176   13.929   67.636   3.8027   68.468   2.4999 -0.8317337 4.550799 
1 1 1   15   11  -29 o   28.935   3.8842   35.887   8.9304   45.486   16.714   32.051   10.565   31.294   6.7505   26.899   5.0025 4.395464 8.402042 
1 1 1   15   11  -28 o   59.558   2.2301  146.425   10.808  172.853   19.789  135.192   12.902   63.958   3.8130   57.022   2.7841 6.936306 4.721302 
1 1 1   15   11  -27 o   44.381   2.6211   81.795   9.4401   95.863   15.800   73.985   11.773   47.435   4.1272   41.905   3.4777 5.530125 5.397067 
1 1 1   15   11  -26 o   15.114   5.4493   8.7194   8.5870   26.333   15.688   1.1845   10.261   23.798   7.3496   12.967   5.5243 10.83182 9.194307 
1 1 1   15   11  -25 o   15.504   5.4063   9.6249   8.3909   1.1920   14.271   14.081   10.374   14.982   6.4515   18.119   6.0164 -3.136746 8.821447 
1 1 1   15   11  -24 o   29.546   3.9590   37.360   9.2954   50.502   18.338   32.816   10.783   32.987   7.0345   27.269   5.0367 5.717785 8.651694 
1 1 1   15   11  -23 o   43.863   2.8748   80.112   10.222   84.682   19.429   78.363   12.020   43.892   5.5547   43.182   3.4434 0.7090683 6.535383 
1 1 1   15   11  -22 o   22.361   5.2057   22.309   9.3107   37.728   17.959   16.642   10.888   28.251   7.6235   19.435   6.1414 8.815460 9.789504 
1 1 1   15   11  -21 o   37.785   3.0260   59.635   9.2423   62.215   15.242   58.134   11.623   37.804   5.0740   37.005   3.9124 0.7990341 6.407193 
1 1 1   15   11  -20 o   36.200   3.1424   54.854   9.1810   47.343   15.357   59.032   11.453   32.498   6.0189   37.336   3.8167 -4.838753 7.127079 
1 1 1   15   11  -19 o   55.926   2.5237  129.344   11.476  116.250   16.652  141.186   15.836   52.478   3.9212   58.119   3.3570 -5.640850 5.161876 
1 1 1   15   11  -18 o   34.388   3.2874   49.630   9.1030   41.335   15.348   54.132   11.306   30.166   6.4377   35.707   3.9506 -5.541101 7.553187 
1 1 1   15   11  -17 o   48.743   2.5044   98.250   9.9173   81.264   16.469  107.915   12.422   43.511   4.7188   50.932   3.0054 -7.421574 5.594608 
1 1 1   15   11  -16 o   59.744   2.1784  146.975   10.591  132.339   17.356  155.659   13.369   56.094   3.8184   61.327   2.6808 -5.232937 4.665483 
1 1 1   15   11  -15 o   18.118   5.6827   14.208   9.3392   2.3383   19.609   17.691   10.621   17.571   7.5643   19.991   6.0228 -2.420631 9.669169 
1 1 1   15   11  -14 o   43.117   2.9686   77.351   10.370   51.900   21.261   85.296   11.879   33.213   7.9573   45.199   3.2458 -11.98600 8.593846 
1 1 1   15   11  -13 o   13.298   5.4472   3.3174   9.4072 -19.8680   19.992   9.9112   10.661   13.931   6.5992   16.442   6.0500 -2.511234 8.952735 
1 1 1   15   11  -12 o   10.753   4.9516  -6.7837   10.020 -23.6756   19.986  -1.1134   11.580   13.447   6.4335   13.122   5.7297 0.3244343 8.615063 
1 1 1   15   11  -11 o   28.884   4.3417   35.835   9.9066   18.566   21.243   40.635   11.199   22.178   8.4599   30.697   4.6185 -8.519072 9.638503 
1 1 1   15   11  -10 o   60.758   2.2682  152.026   11.214  189.329   20.330  135.713   13.444   67.244   3.7234   57.214   2.8920 10.02983 4.714621 
1 1 1   15   11   -9 o   19.024   5.5395   15.910   9.1097  -1.1783   16.164   23.865   11.028   15.422   6.7509   23.083   5.8534 -7.660598 8.935189 
1 1 1   15   11   -8 o   58.474   2.3042  140.854   10.961  146.314   19.483  138.325   13.259   58.942   4.0802   57.793   2.8230 1.149200 4.961640 
1 1 1   15   11   -7 o   14.169   5.4550   6.1329   8.8870   26.863   16.024  -3.0759   10.680   24.322   7.4126   12.093   5.3812 12.22987 9.159882 
1 1 1   15   11   -6 o   10.931   4.8527  -2.4778   8.6337  -9.2332   15.489   0.5671   10.399   13.454   6.1809   12.957   5.5420 0.4966536 8.301682 
1 1 1   15   11   -5 o   23.185   5.2810   23.781   9.7566   44.382   16.202   12.061   12.221   31.380   6.5462   17.840   6.4912 13.54014 9.218884 
1 1 1   15   11   -4 o   44.313   3.4056   82.056   12.207   82.952   17.902   81.277   16.690   43.904   5.0968   43.593   4.7748 0.3112068 6.983972 
1 1 1   15   11   -3 o   27.850   5.1459   33.936   11.252   52.555   17.012   19.457   15.002   34.329   6.3120   21.342   7.2367 12.98677 9.602681 
1 1 1   15   11   -2 o   58.248   2.8394  140.478   13.441  168.676   20.126  117.772   18.059   63.408   3.9128   52.811   4.2304 10.59668 5.762516 
1 1 1   15   11   -1 o   73.915   2.2430  224.760   13.499  255.192   22.473  207.582   16.884   78.236   3.5329   70.798   2.9320 7.438416 4.591080 
1 1 1   15   11    0 o   25.223   5.1143   27.937   10.155   32.803   17.321   25.389   12.535   26.681   7.5987   23.744   6.3525 2.937529 9.904225 
1 1 1   15   11    1 o   22.240   5.4682   21.965   9.8427   23.287   16.814   21.276   12.140   23.025   7.6601   21.841   6.4047 1.184107 9.984822 
1 1 1   15   11    2 o   52.370   2.4785  113.182   10.550  150.490   19.539   97.829   12.535   59.827   4.0301   48.480   3.1896 11.34774 5.139583 
1 1 1   15   11    3 o   29.421   4.5893   37.298   10.647   31.584   17.127   40.897   13.593   26.206   7.5855   30.435   5.6881 -4.229570 9.481206 
1 1 1   15   11    4 o   41.283   3.3292   71.197   11.108   97.860   18.508   56.183   13.888   47.860   4.8092   36.138   4.8358 11.72148 6.820097 
1 1 1   15   11    5 o   59.633   2.5514  146.799   12.373  166.762   20.253  134.911   15.629   63.014   3.9630   56.886   3.3858 6.127819 5.212360 
1 1 1   15   11    6 o   31.089   4.3446   41.362   10.710   59.354   17.419   30.427   13.580   36.642   6.0424   25.932   6.4508 10.71005 8.838798 
1 1 1   15   11    7 o   15.268   5.5510   8.5499   8.9348   35.113   16.239  -2.9839   10.700   27.650   7.1515   12.129   5.3925 15.52122 8.956717 
1 1 1   15   11    8 o   23.798   5.3377   25.088   10.099   11.653   16.589   32.999   12.730   18.999   7.4146   27.176   5.9148 -8.176952 9.484776 
1 1 1   15   11    9 o   43.194   3.1431   77.743   10.991   92.182   18.181   69.426   13.798   46.377   4.8823   40.438   4.2494 5.939331 6.472591 
1 1 1   15   11   10 o   15.611   5.7801   8.6637   9.7576   5.7006   16.483   10.262   12.107   17.246   7.1518   17.083   6.4159 0.1630802 9.607931 
1 1 1   15   11   11 o   60.629   2.5146  151.753   12.400  163.454   20.623  145.128   15.519   62.288   4.0843   59.041   3.2370 3.247581 5.211487 
1 1 1   15   11   12 o   69.871   2.3184  201.119   13.186  194.222   21.574  205.232   16.661   67.997   3.9088   70.368   2.9109 -2.370262 4.873562 
1 1 1   15   11   13 o   32.638   3.9430   45.231   10.278   67.533   23.839   40.139   11.391   38.032   7.9461   30.447   4.7441 7.584990 9.254579 
1 1 1   15   11   14 o   62.168   2.3849  159.401   12.063  141.719   27.084  163.777   13.474   56.904   5.9256   62.936   2.6322 -6.032200 6.483890 
1 1 1   15   11   15 o   24.957   4.9164   27.344   9.6458   78.735   23.317   16.734   10.595   41.589   7.1346   19.521   6.0418 22.06727 9.349154 
1 1 1   15   11   16 o   13.414   5.4412   3.8542   9.2770 -24.1910   21.295   10.423   10.306   13.937   6.6607   16.527   5.9685 -2.589962 8.943588 
1 1 1   15   11   17 o   13.868   5.4116   5.5725   8.8359  -9.9089   16.739   11.553   10.403   13.895   6.3990   17.046   6.0140 -3.150331 8.781506 
1 1 1   15   11   18 o   54.237   2.4035  121.475   10.600  148.606   19.890  110.713   12.527   59.268   4.1431   51.588   2.9917 7.679691 5.110313 
1 1 1   15   11   19 o   20.658   5.2770   19.030   8.9170   20.922   17.090   18.322   10.453   22.015   7.7129   20.257   5.9437 1.757656 9.737363 
1 1 1   15   11   20 o   46.006   2.5143   87.612   9.3930   90.793   14.978   85.551   12.059   46.298   4.0082   45.211   3.2947 1.086826 5.188546 
1 1 1   15   11   21 o   39.852   3.1487   66.426   10.145   78.230   14.980   56.423   13.790   42.793   4.3549   36.093   4.8064 6.700249 6.485835 
1 1 1   15   11   22 o   42.388   2.7290   74.655   9.3792   92.460   15.168   63.632   11.934   46.694   4.0243   38.756   3.8275 7.938316 5.553826 
1 1 1   15   11   23 o   78.133   2.1853  251.521   13.904  232.617   22.937  262.503   17.483   74.331   3.7982   79.598   2.6983 -5.266983 4.659137 
1 1 1   15   11   24 o   35.799   3.3518   53.928   9.6675   64.867   18.033   49.517   11.452   38.086   6.0076   33.978   4.2259 4.107712 7.345029 
1 1 1   15   11   25 o   27.168   4.3972   32.040   9.4054   29.067   17.680   33.214   11.108   24.880   7.8209   27.378   5.1666 -2.497517 9.373373 
1 1 1   15   11   26 o   58.423   2.1446  140.718   10.196  129.705   16.175  147.979   13.134   55.516   3.5937   59.714   2.7053 -4.198204 4.498101 
1 1 1   15   11   27 o   79.409   1.8405  258.978   11.914  272.987   18.885  249.716   15.355   81.045   2.8630   77.723   2.4266 3.322838 3.753057 
1 1 1   15   11   28 o   86.286   1.7911  305.691   12.598  324.132   19.879  293.316   16.285   88.363   2.7633   84.256   2.3735 4.107285 3.642714 
1 1 1   15   11   29 o   34.038   3.2843   48.827   8.9996   51.092   14.509   47.411   11.474   33.916   5.4311   33.133   4.3534 0.7823753 6.960569 
1 1 1   15   11   30 o   39.166   2.8810   64.087   9.1336   73.535   14.955   58.467   11.534   41.268   4.5197   37.033   3.8785 4.234909 5.955674 
1 1 1   15   11   31 o   37.984   2.9246   60.369   8.9857   61.581   14.488   59.611   11.455   37.550   4.8461   37.411   3.8094 0.1384201 6.164067 
1 1 1   15   11   32 f   8.2096   4.0030 -14.9387   8.6987  -8.1331   16.564 -17.5303   10.222   13.949   6.4022   8.8684   4.3275 5.080300 7.727567 
1 1 1   15   11   33 o   26.022   4.5010   29.726   9.2019   24.038   17.735   31.822   10.764   22.796   7.8645   26.679   5.1360 -3.883694 9.393050 
1 1 1   15   11   34 o   18.339   5.9330   14.896   10.116   21.608   17.636   11.605   12.350   21.915   7.8204   17.367   6.4889 4.547632 10.16189 
1 1 1   15   11   35 o   13.775   5.5818   4.6280   9.7502   30.307   17.027  -7.9013   11.893   25.023   7.6439   11.540   5.3425 13.48272 9.325826 
1 1 1   15   11   36 o   17.163   5.6737   12.820   9.2285   23.657   13.990   4.4727   12.279   22.422   6.9434   14.849   6.1665 7.572856 9.286357 
1 1 1   15   11   37 o   35.522   3.1383   53.217   8.9938   52.984   14.531   53.362   11.450   34.393   5.3577   35.179   4.0679 -0.7856903 6.726958 
1 1 1   15   11   38 o   27.821   3.9143   33.476   8.6319   40.338   14.272   29.519   10.839   29.486   6.1379   25.474   5.3883 4.011711 8.167450 
1 1 1   15   11   39 o   45.479   2.7933   86.527   10.306   85.915   15.271   87.039   13.965   44.577   4.2542   45.110   3.8341 -0.5331573 5.726989 
1 1 1   15   11   40 o   43.634   3.1060   80.194   10.975  102.983   18.567   67.956   13.607   48.470   4.7608   39.571   4.2868 8.899158 6.406392 
1 1 1   15   11   41 o   12.511   5.3594   1.1277   9.7522   11.045   16.241  -4.4649   12.196   18.071   7.2456   12.372   5.6067 5.699267 9.161527 
1 1 1   15   11   42 o   20.133   5.2701   18.576   8.7485   23.265   14.773   16.043   10.857   22.074   7.1719   18.806   6.1508 3.267229 9.448211 
1 1 1   15   11   43 o   22.359   5.0739   22.763   9.0350   10.993   15.447   28.884   11.139   17.800   7.0898   25.004   5.6042 -7.204424 9.037299 
1 1 1   15   11   44 o   19.533   5.4107   17.567   8.9109   26.485   15.661   13.298   10.836   23.274   7.3669   17.524   6.1413 5.750530 9.591011 
1 1 1   15   11   45 o   16.004   5.8119   10.413   9.7903  -2.5789   15.447   19.137   12.657   14.295   6.4085   20.233   6.6426 -5.938239 9.230043 
1 1 1   15   11   46 o   21.141   5.5521   20.807   9.6889   1.4787   20.353   26.471   11.017   16.907   7.4811   23.779   5.7480 -6.872637 9.434305 
1 1 1   15   11   47 o   17.066   5.5424   13.083   8.8233  -6.2919   14.826   23.708   10.979   13.223   6.0645   22.393   5.9243 -9.170034 8.477937 
1 1 1   15   11   48 o   49.049   2.6412  100.743   10.521  113.095   19.549   95.706   12.483   50.480   4.8089   47.483   3.2446 2.996414 5.801147 
1 1 1   15   11   49 o   59.411   2.2324  146.658   10.792  171.342   18.618  134.167   13.244   63.255   3.6260   56.459   2.8874 6.796547 4.635152 
1 1 1   15   11   50 o   34.506   3.3445   50.964   9.2893   48.142   15.890   52.430   11.450   31.668   6.3763   34.575   4.1451 -2.906673 7.605190 
1 1 1   15   11   51 f   10.573   4.7187  -1.9258   8.2749  -2.9860   13.785  -1.3285   10.346   13.295   5.9992   11.972   5.3139 1.323002 8.014208 
1 1 1   15   11   52 o   20.381   5.1888   19.431   8.6416  -5.9312   14.749   32.691   10.664   13.104   6.0243   26.629   5.0984 -13.52476 7.892160 
1 1 1   15   11   53 o   17.256   5.6983   13.752   9.3094   15.216   14.734   12.779   12.010   18.531   7.0512   17.195   6.4040 1.336504 9.525263 
1 1 1   15   11   54 o   37.774   3.2780   61.257   9.9936   78.122   15.891   50.223   12.854   41.578   4.7752   33.171   4.9010 8.406475 6.842676 
1 1 1   15   11   55 o   13.715   5.6207   5.2302   10.022  -2.1252   18.897   8.1086   11.821   15.260   6.9405   15.345   6.1715 -0.8482170E-01 9.287578 
1 1 1   15   11   56 o   27.348   4.8853   34.576   10.491   37.227   19.739   33.533   12.385   25.672   8.2860   26.209   5.9355 -0.5370750 10.19257 
1 1 1   15   11   57 o   32.901   4.1191   48.323   10.806   42.812   20.337   50.491   12.755   27.301   8.3567   33.094   4.8742 -5.792913 9.674308 
1 1 1   15   11   58 o   16.721   5.8979   13.027   10.005   22.562   18.298   8.9605   11.950   20.685   7.8610   15.497   6.2147 5.187509 10.02081 
1 1 1   15   11   59 o   24.435   5.3439   28.778   10.347   34.006   18.194   26.278   12.579   24.373   7.9618   22.530   6.4945 1.843075 10.27464 
1 1 1   15   11   60 o   14.760   5.6868   8.8742   9.6636   2.6263   17.376   11.672   11.628   15.304   6.8336   16.275   6.2463 -0.9704514 9.258201 
1 1 1   15   11   61 o   13.498   5.5212   5.7195   9.6475  -8.8282   16.711   12.992   11.815   13.002   6.1208   16.743   6.3273 -3.741365 8.803360 
1 1 1   15   11   62 o   18.696   5.7709   17.566   9.6734   19.233   16.924   16.757   11.789   19.185   7.4886   18.183   6.4031 1.001724 9.852862 
1 1 1   15   11   63 o   14.098   5.5792   7.6751   9.5072  -0.5612   16.849   11.523   11.516   14.315   6.5274   16.010   6.1973 -1.694633 9.000737 
1 1 1   15   11   64 o   16.892   5.7623   14.205   9.5136  -9.3307   16.772   25.370   11.552   12.765   6.0461   21.938   6.1913 -9.173335 8.653723 
1 1 1   15   11   65 o   28.163   5.4941   39.489   12.160   33.221   17.832   44.936   16.624   23.221   7.8897   28.194   7.2068 -4.973183 10.68572 
1 1 1   15   11   66 o   19.823   6.4235   21.435   11.855   7.8691   16.996   34.290   16.544   15.766   6.9115   23.829   7.5753 -8.063025 10.25445 
1 1 1   15   11   67 o   18.855   5.7127   18.529   9.5364   23.621   17.057   16.213   11.502   19.856   7.5792   17.531   6.3085 2.324837 9.861158 
1 1 1   15   11   68 o   13.995   5.6699   7.6974   10.059   9.8136   16.672   6.4861   12.613   16.001   6.9318   14.286   6.1067 1.714989 9.238034 
1 1 1   15   11   69 o   16.340   5.9234   13.610   10.164   28.554   17.039   5.3558   12.663   21.289   7.6761   13.953   6.0430 7.336320 9.769342 
1 1 1   15   11   70 o   18.882   7.3284   20.990   16.135   25.966   26.453   18.042   20.361   19.754   8.6418   18.128   7.7542 1.625883 11.61070 
1 1 1   15   11   71 f   13.003   6.0639  -3.5341   15.761 -19.2101   25.479   6.1828   20.060   13.825   6.7648   15.729   7.1527 -1.903303 9.844941 
1 1 1   15   11   72 o   22.460   7.5652   32.025   16.394   17.770   26.859   40.489   20.697   18.223   8.2829   23.878   8.4771 -5.654509 11.85194 
1 1 1   15   11   73 o   14.886   6.6012   6.6159   15.931 -11.4206   25.284   18.491   20.515   14.375   6.9667   17.974   7.7375 -3.598235 10.41170 
1 1 1   15   11   74 o   13.178   6.1168  -1.7140   15.747   30.865   25.478 -21.8524   20.031   20.236   8.6655   11.983   5.8908 8.252913 10.47819 
1 1 1   15   11   75 o   19.457   7.3913   23.966   16.173   55.628   25.496   2.6453   20.922   25.983   9.3868   15.075   7.0155 10.90827 11.71879 
1 1 1   15   11   76 o   11.530   5.5474 -11.2878   15.333   8.3405   23.938 -24.9439   19.967   16.302   7.5584   11.637   5.7511 4.664975 9.497598 
1 1 1   15   11   77 o   10.134   4.8936 -11.8305   12.194 -12.5275   15.166 -10.5556   20.510   11.281   5.4496   13.194   6.3649 -1.913278 8.379172 
1 1 1   15   11   78 o   14.385   6.0897   8.3476   12.334   4.1380   15.536   15.523   20.284   14.078   6.3590   17.020   7.5025 -2.942274 9.834857 
1 1 1   15   11   79 o   9.2648   4.5465 -16.5353   11.769 -18.9388   14.572 -12.0261   19.959   10.235   5.0301   12.806   6.2022 -2.570555 7.985589 
1 1 1   15   11   80 o   10.894   5.1407  -5.9821   11.915  -4.0814   14.943  -9.3005   19.745   12.354   5.8070   13.031   6.2758 -0.6769562 8.550209 
1 1 1   15   11   81 o   14.568   6.3107   8.3852   13.816   13.988   19.075   2.2012   20.040   16.463   7.2653   14.563   6.8067 1.899180 9.955727 
1 1 1   15   11   82 o   12.944   5.8991   1.5474   13.740   0.6223   18.140   2.7921   21.043   13.891   6.4870   14.768   6.9256 -0.8769732 9.489244 
1 1 1   15   11   83 f   22.447   7.0731   32.146   14.452   18.126   18.950   51.635   22.342   17.189   7.4183   25.301   8.8219 -8.112270 11.52633 
1 1 1   15   11   84 o   15.865   6.5490   13.565   13.735   16.783   18.441   9.5567   20.584   16.856   7.2963   15.639   7.1627 1.216663 10.22446 
1 1 1   15   11   85 o   15.176   6.9729   7.3558   19.722   7.3558   19.722   0.0000   0.0000   15.176   6.9729  ?   ?  0.000000 6.972950 
1 1 1   15   11   86 o   18.815   7.9181   25.652   20.652   25.652   20.652   0.0000   0.0000   18.815   7.9181  ?   ?  0.000000 7.918111 
1 1 1   15   12  -80 o   12.369   6.0307 -13.6694   19.734 -13.6694   19.734   0.0000   0.0000   12.369   6.0307  ?   ?  0.000000 6.030686 
1 1 1   15   12  -79 o   13.958   6.5982  -0.3740   19.790  -0.3740   19.790   0.0000   0.0000   13.958   6.5982  ?   ?  0.000000 6.598153 
1 1 1   15   12  -78 o   10.289   5.0571 -17.9778   14.740 -22.2331   19.008 -11.5594   23.345   11.331   5.6017   13.409   6.5426 -2.078780 8.613055 
1 1 1   15   12  -77 o   14.540   6.5404   7.0159   16.238   13.646   21.453  -1.8775   24.848   16.349   7.4198   14.689   7.0657 1.660000 10.24589 
1 1 1   15   12  -76 o   10.838   5.2858 -14.9925   15.191   1.1862   19.564 -39.5539   24.106   14.210   6.6685   11.531   5.7929 2.679330 8.833236 
1 1 1   15   12  -75 o   14.732   6.5159   8.1361   15.424   0.4091   19.413   21.365   25.400   14.120   6.6314   17.868   8.0951 -3.748306 10.46450 
1 1 1   15   12  -74 o   13.415   6.1146   2.3792   14.765   12.421   18.592 -14.7681   24.296   16.081   7.1312   13.480   6.5978 2.601394 9.715183 
1 1 1   15   12  -73 o   12.323   5.8012  -4.2716   15.010   18.912   18.760 -45.5115   25.022   17.531   7.4695   11.494   5.7910 6.037388 9.451402 
1 1 1   15   12  -72 o   16.484   6.9408   14.683   15.882   43.344   21.198 -21.9866   23.977   23.718   8.5605   12.861   6.3456 10.85750 10.65598 
1 1 1   15   12  -71 o   13.821   6.2969   2.8085   15.640   8.4225   20.603  -4.8250   24.025   15.740   7.1927   14.535   6.9801 1.205525 10.02284 
1 1 1   15   12  -70 o   12.684   5.9201  -2.7553   15.076  -2.0856   19.739  -3.6927   23.355   14.035   6.6211   14.581   6.9701 -0.5453081 9.613619 
1 1 1   15   12  -69 o   13.168   6.0662  -0.1696   15.060   16.254   19.696 -23.2885   23.369   17.223   7.4972   12.712   6.2710 4.510763 9.774102 
1 1 1   15   12  -68 o   10.996   5.3180 -12.9879   14.542 -17.0556   18.380  -6.1791   23.779   11.886   5.8007   14.456   6.9429 -2.569782 9.047232 
1 1 1   15   12  -67 o   14.878   6.4815   8.0112   14.745   1.5852   18.789   18.313   23.791   14.480   6.7074   17.900   7.9942 -3.420764 10.43539 
1 1 1   15   12  -66 o   18.597   7.1029   20.701   14.987   25.511   18.917   12.593   24.559   19.663   7.8413   17.123   7.8353 2.539885 11.08504 
1 1 1   15   12  -65 o   12.620   6.2121 -23.4271   22.527   0.0000   0.0000 -23.4271   22.527  ?   ?    12.620   6.2121 0.000000 6.212101 
1 1 1   15   12  -64 o   17.790   7.4472   17.583   18.120   34.086   27.972   5.6505   23.785   20.914   9.0191   16.183   7.5138 4.730509 11.73891 
1 1 1   15   12  -63 o   24.792   6.2033   33.413   12.505   40.262   27.856   31.685   13.994   22.216   9.2620   23.310   6.8873 -1.094395 11.54203 
1 1 1   15   12  -62 f   14.332   5.9856   7.7393   11.664  -7.2162   26.802   11.234   12.956   15.256   7.3384   15.669   6.4023 -0.4127331 9.738700 
1 1 1   15   12  -61 o   14.535   5.9627   8.5326   11.294  -4.3050   27.244   11.196   12.410   15.697   7.5103   15.618   6.3085 0.7856274E-01 9.808269 
1 1 1   15   12  -60 o   13.394   5.6348   5.6181   10.453 -30.8016   27.267   11.892   11.317   13.442   6.6570   15.764   6.1321 -2.321900 9.050902 
1 1 1   15   12  -59 o   23.978   5.0336   28.307   9.5244   27.396   15.926   28.815   11.884   21.275   7.4462   23.153   6.1810 -1.877857 9.677270 
1 1 1   15   12  -58 o   12.964   5.3576   5.3597   9.2060   1.9076   15.832   7.1234   11.316   14.224   6.4225   14.219   5.9135 0.5127907E-02 8.730323 
1 1 1   15   12  -57 f   15.591   5.7079   11.566   9.4706   13.489   15.642   10.453   11.900   17.030   7.0051   15.523   6.2094 1.506831 9.361028 
1 1 1   15   12  -56 o   30.461   4.1324   42.465   9.9965   23.068   16.087   54.667   12.759   20.127   7.4272   34.074   4.7202 -13.94740 8.800173 
1 1 1   15   12  -55 o   33.218   3.8436   49.537   10.216   16.292   16.421   70.527   13.048   18.134   7.2805   39.432   4.1202 -21.29830 8.365550 
1 1 1   15   12  -54 o   13.355   5.4631   5.7026   9.4460   13.716   15.724   1.1779   11.816   17.399   7.0743   12.913   5.7077 4.485491 9.089748 
1 1 1   15   12  -53 o   13.118   5.4231   4.9542   9.4370  -0.5643   16.330   7.7211   11.563   14.243   6.4677   14.773   6.0439 -0.5304632 8.852094 
1 1 1   15   12  -52 o   37.880   3.9141   64.028   11.912   73.322   31.196   62.442   12.889   31.846   10.427   37.037   4.3521 -5.190950 11.29866 
1 1 1   15   12  -51 o   11.886   5.3245  -1.1788   10.642 -19.1488   28.953   1.6279   11.442   15.538   7.5120   12.989   5.6830 2.549090 9.419425 
1 1 1   15   12  -50 o   20.052   6.0688   20.249   10.767 -38.8757   28.559   30.045   11.624   13.878   6.8621   24.587   5.8795 -10.70887 9.036399 
1 1 1   15   12  -49 o   28.469   4.5586   37.149   10.222   45.686   18.788   33.559   12.183   28.676   7.8223   26.109   5.8678 2.567236 9.778521 
1 1 1   15   12  -48 o   14.826   5.6878   8.7400   9.6381  -5.0856   18.151   14.169   11.374   14.341   6.6254   17.403   6.2720 -3.061770 9.123212 
1 1 1   15   12  -47 o   19.061   5.8303   17.679   9.9015   13.913   18.443   19.204   11.736   18.463   7.6018   19.662   6.3926 -1.199732 9.932437 
1 1 1   15   12  -46 o   28.756   4.1387   36.914   9.4223   25.445   14.723   44.870   12.262   22.129   7.1574   31.175   4.9939 -9.045523 8.727359 
1 1 1   15   12  -45 o   9.3851   4.4236  -7.8168   8.7777 -13.8636   14.221  -4.0952   11.157   11.426   5.4557   11.627   5.3056 -0.2014713 7.610097 
1 1 1   15   12  -44 o   22.000   5.1680   22.733   9.1093   20.959   14.397   23.917   11.763   20.519   7.0856   22.015   6.2595 -1.495916 9.454504 
1 1 1   15   12  -43 f   36.827   3.3370   58.267   9.9088   43.817   15.380   68.521   12.956   29.837   6.5074   39.472   4.0856 -9.635536 7.683656 
1 1 1   15   12  -42 o   25.864   4.8978   30.653   9.9479   87.087   18.200   6.6077   11.880   43.653   5.2178   14.985   6.1278 28.66760 8.048362 
1 1 1   15   12  -41 o   12.029   5.0339   2.5392   8.2748   11.706   14.207  -2.1667   10.180   17.361   6.8360   11.646   5.2130 5.715149 8.596880 
1 1 1   15   12  -40 o   34.651   3.2883   51.364   9.1768   44.286   15.305   55.337   11.466   30.267   6.4037   35.573   4.0250 -5.305666 7.563565 
1 1 1   15   12  -39 o   33.189   3.8473   47.897   10.216   51.203   15.337   45.262   13.697   33.020   5.9155   31.225   5.5862 1.794704 8.136250 
1 1 1   15   12  -38 o   20.860   5.7130   20.548   9.9984   18.530   15.050   22.143   13.377   19.971   7.2123   21.335   6.8150 -1.363758 9.922830 
1 1 1   15   12  -37 o   23.057   5.5219   24.856   10.241   17.050   15.142   31.437   13.904   19.499   7.2039   25.363   6.6462 -5.863489 9.801442 
1 1 1   15   12  -36 o   13.241   5.2659   5.1645   8.5084 -10.6005   14.685   13.132   10.439   12.365   5.7944   17.284   6.0300 -4.919773 8.362752 
1 1 1   15   12  -35 o   22.596   4.9071   23.250   8.7790   48.186   15.165   10.683   10.766   32.082   6.0201   16.320   6.0661 15.76216 8.546285 
1 1 1   15   12  -34 o   16.456   5.7203   11.657   9.3903   16.305   14.936   8.6198   12.075   19.312   7.1511   15.942   6.2945 3.370043 9.526793 
1 1 1   15   12  -33 o   14.988   5.5922   8.5595   9.1664   17.812   14.555   2.4771   11.801   19.834   7.1015   13.886   5.9204 5.948295 9.245662 
1 1 1   15   12  -32 o   15.692   5.6429   10.066   9.2009  -4.9201   14.752   19.607   11.771   13.501   6.1374   20.423   6.3759 -6.922494 8.849833 
1 1 1   15   12  -31 o   15.493   5.6076   9.6703   9.1043   15.078   14.651   6.2690   11.620   18.907   7.0669   15.019   6.0908 3.887262 9.329401 
1 1 1   15   12  -30 o   8.0182   3.9103 -14.0744   8.3103 -10.5021   14.199 -15.9355   10.249   12.211   5.7144   9.0556   4.3995 3.155229 7.211834 
1 1 1   15   12  -29 o   28.795   3.9298   35.981   8.9836   36.010   15.290   35.966   11.102   27.268   6.8802   28.286   4.9976 -1.017624 8.503687 
1 1 1   15   12  -28 o   10.681   4.7823  -2.5598   8.5718  -5.9116   14.573  -0.7867   10.599   13.259   6.0552   12.399   5.4459 0.8600292 8.143891 
1 1 1   15   12  -27 o   38.546   3.0630   62.662   9.5450   79.000   16.089   53.788   11.857   42.377   4.7385   35.167   4.2205 7.210072 6.345564 
1 1 1   15   12  -26 o   18.240   5.4651   15.112   8.7629   10.424   14.775   17.656   10.884   17.478   6.9429   19.584   6.1336 -2.106234 9.264187 
1 1 1   15   12  -25 o   19.559   5.3110   17.489   8.6839   16.724   14.868   17.886   10.699   19.632   7.1572   19.704   6.0666 -0.7235336E-01 9.382416 
1 1 1   15   12  -24 o   11.430   4.9443   0.0724   8.4575   7.3838   14.474  -3.7186   10.422   16.493   6.7563   11.558   5.2157 4.935064 8.535326 
1 1 1   15   12  -23 o   35.633   3.2553   53.751   9.3510   40.304   15.847   60.934   11.582   29.056   6.8102   37.701   3.8215 -8.645704 7.809186 
1 1 1   15   12  -22 f   26.796   4.2538   31.414   8.9812   60.003   15.546   17.093   11.003   36.589   5.3722   19.379   6.1797 17.21049 8.188396 
1 1 1   15   12  -21 o   14.922   5.4909   8.4610   8.7820 -12.8599   14.820   20.000   10.902   12.208   5.7521   20.787   6.0622 -8.579348 8.356855 
1 1 1   15   12  -20 o   31.229   3.9702   42.074   9.8785   37.875   19.979   43.433   11.365   27.470   8.2569   31.469   4.5635 -3.998758 9.434067 
1 1 1   15   12  -19 o   11.640   5.1145  -1.1279   9.3560 -11.7509   18.714   2.4119   10.803   14.218   6.6230   13.516   5.7095 0.7024364 8.744287 
1 1 1   15   12  -18 o   19.263   5.6101   16.872   9.3426   15.166   19.320   17.392   10.673   20.140   7.9589   19.550   6.0665 0.5908432 10.00730 
1 1 1   15   12  -17 o   15.529   5.7515   9.1056   9.6626   56.839   23.146  -0.9685   10.633   33.626   8.4545   12.443   5.4604 21.18270 10.06450 
1 1 1   15   12  -16 o   26.262   6.2410   32.111   13.162   49.126   23.402   24.237   15.919   30.990   8.8345   22.695   7.4494 8.295340 11.55599 
1 1 1   15   12  -15 o   28.556   4.5351   35.761   10.204   12.192   23.058   41.501   11.379   20.315   8.4446   30.734   4.6903 -10.41860 9.659699 
1 1 1   15   12  -14 o   28.406   4.1822   35.024   9.3944   39.452   17.010   33.080   11.269   28.655   7.2713   27.123   5.2870 1.531725 8.990242 
1 1 1   15   12  -13 f   49.377   2.6436  101.460   10.601  115.704   19.025   95.045   12.767   51.724   4.5589   47.505   3.3179 4.219032 5.638466 
1 1 1   15   12  -12 o   21.982   5.2113   21.839   9.1948   24.697   16.411   20.531   11.101   22.944   7.5654   21.129   6.1040 1.814564 9.720771 
1 1 1   15   12  -11 o   33.749   3.9423   48.848   10.641   73.992   25.546   43.569   11.705   38.779   8.3299   31.526   4.6980 7.252760 9.563384 
1 1 1   15   12  -10 o   31.656   3.8135   42.896   9.6425   66.633   17.371   32.324   11.593   38.554   5.6987   26.737   5.5027 11.81765 7.921794 
1 1 1   15   12   -9 o   26.630   4.5261   31.108   9.4735   31.072   16.649   31.125   11.520   25.444   7.5108   26.205   5.5653 -0.7611217 9.348027 
1 1 1   15   12   -8 o   39.197   3.1678   64.586   10.035   32.623   17.161   81.197   12.371   26.022   7.6105   43.840   3.4907 -17.81752 8.372838 
1 1 1   15   12   -7 o   12.553   5.2716   2.0210   9.1236  -2.2168   16.011   4.0588   11.103   14.860   6.6021   14.252   5.8862 0.6074076 8.845029 
1 1 1   15   12   -6 o   14.866   5.7649   7.1054   9.9787   6.6713   15.878   7.3887   12.829   16.967   7.0261   16.072   6.4411 0.8949928 9.531734 
1 1 1   15   12   -5 o   23.028   5.5556   24.107   10.307   18.589   16.190   27.868   13.366   20.767   7.4830   24.426   6.5705 -3.659197 9.958234 
1 1 1   15   12   -4 o   29.233   5.1408   37.981   11.803   31.200   16.330   45.398   17.079   25.557   7.4093   31.089   6.9177 -5.531683 10.13669 
1 1 1   15   12   -3 o   35.425   4.3124   54.164   12.196   50.348   16.838   58.376   17.690   33.039   6.4838   35.745   6.3015 -2.706276 9.041503 
1 1 1   15   12   -2 o   16.137   6.1746   9.0575   11.339  -5.6994   15.594   25.612   16.516   13.965   6.3331   23.373   7.5824 -9.408273 9.879337 
1 1 1   15   12   -1 o   44.249   3.6672   82.952   13.109  103.421   18.297   61.367   18.789   48.903   4.6457   36.521   6.5523 12.38286 8.032146 
1 1 1   15   12    0 o   27.412   4.5034   32.859   9.7134   15.264   16.572   42.067   11.989   19.738   7.4857   30.903   4.9243 -11.16508 8.960148 
1 1 1   15   12    1 o   29.462   4.1071   37.456   9.5958   59.502   17.038   27.214   11.613   36.296   5.9658   24.366   5.9084 11.92940 8.396440 
1 1 1   15   12    2 o   19.534   5.5747   17.232   9.3133 -16.1057   15.838   34.851   11.514   12.307   5.8427   27.931   5.2499 -15.62413 7.854843 
1 1 1   15   12    3 o   68.165   2.4287  192.376   13.473  222.597   21.855  173.850   17.112   72.593   3.7056   64.387   3.2711 8.206413 4.942839 
1 1 1   15   12    4 o   75.110   2.2780  233.100   13.931  260.090   22.561  216.469   17.710   78.605   3.5300   72.006   3.0241 6.599510 4.648253 
1 1 1   15   12    5 o   24.670   5.3021   27.399   10.345   16.168   16.115   35.270   13.491   19.926   7.4186   27.691   6.1381 -7.765680 9.628728 
1 1 1   15   12    6 o   16.915   5.6776   12.195   9.2341   5.2305   16.118   15.597   11.266   16.670   7.0040   18.849   6.2702 -2.179581 9.400592 
1 1 1   15   12    7 o   51.385   2.5768  109.668   10.759  142.948   19.473   95.046   12.908   57.852   4.1571   47.516   3.3540 10.33502 5.341380 
1 1 1   15   12    8 o   54.842   2.4815  124.728   11.065  144.079   19.901  116.069   13.312   58.023   4.2369   52.639   3.1164 5.384865 5.259534 
1 1 1   15   12    9 o   40.146   3.1606   67.737   10.260   64.015   18.142   69.487   12.440   37.524   6.1438   40.387   3.8243 -2.863518 7.236781 
1 1 1   15   12   10 o   43.963   3.1730   81.187   11.294   82.087   18.650   80.665   14.193   43.017   5.4400   43.418   4.0573 -0.4002380 6.786418 
1 1 1   15   12   11 o   56.099   2.6447  130.857   12.060  142.526   20.019  124.210   15.109   57.644   4.2913   54.287   3.4318 3.356846 5.494787 
1 1 1   15   12   12 o   62.448   2.7233  162.297   13.830  185.006   27.732  154.780   15.955   64.888   5.2888   60.725   3.2350 4.162567 6.199707 
1 1 1   15   12   13 f   19.791   5.8159   17.818   10.002   41.538   17.128   5.5457   12.320   29.472   7.1936   15.237   6.2367 14.23526 9.520760 
1 1 1   15   12   14 o   9.3040   4.4495 -11.8519   9.5379  -1.0808   16.145 -17.6261   11.821   15.119   6.6777   9.8462   4.7698 5.272351 8.206223 
1 1 1   15   12   15 o   23.035   5.4169   24.137   9.9994   38.956   17.079   16.407   12.335   28.428   7.3247   19.283   6.5616 9.145256 9.833870 
1 1 1   15   12   16 o   42.780   3.5914   77.662   12.408   50.275   27.554   84.628   13.897   30.749   9.7763   44.532   3.8667 -13.78296 10.51319 
1 1 1   15   12   17 o   28.397   6.3275   37.574   14.272   15.695   27.973   45.274   16.594   22.051   9.2436   30.990   6.7597 -8.939039 11.45149 
1 1 1   15   12   18 o   46.063   3.1220   89.170   11.653   94.899   29.392   88.102   12.694   43.634   8.5694   45.641   3.4372 -2.006199 9.233023 
1 1 1   15   12   19 o   25.111   4.8051   28.099   9.4774   16.130   16.981   33.515   11.422   19.925   7.5726   27.237   5.3354 -7.311602 9.263445 
1 1 1   15   12   20 o   55.760   2.6266  129.448   11.905  137.896   25.849  127.174   13.412   55.377   5.8128   55.092   2.9979 0.2853088 6.540368 
1 1 1   15   12   21 o   15.079   5.7617   7.9516   9.8641   7.3037   21.136   8.1320   11.153   18.614   7.9294   15.613   6.0835 3.000953 9.994187 
1 1 1   15   12   22 f   74.721   2.4898  231.863   15.144  248.656   30.968  226.585   17.362   75.227   5.0799   73.622   2.8986 1.604805 5.848721 
1 1 1   15   12   23 o   35.758   3.7943   54.829   10.891   37.725   18.070   64.587   13.649   27.587   7.7285   38.511   4.4284 -10.92377 8.907329 
1 1 1   15   12   24 o   35.000   3.5261   52.224   9.9230   32.558   17.738   61.182   11.971   25.628   7.7966   37.703   3.9540 -12.07557 8.741896 
1 1 1   15   12   25 o   60.127   2.3239  149.948   11.369  165.047   20.339  143.087   13.710   62.017   4.0455   58.458   2.8860 3.558372 4.969425 
1 1 1   15   12   26 o   20.847   5.4404   19.995   9.3415   26.513   16.700   17.027   11.270   23.348   7.6279   19.308   6.2633 4.040909 9.869831 
1 1 1   15   12   27 o   32.087   3.8456   44.402   9.8583   19.021   17.440   56.321   11.951   20.751   7.7191   36.034   4.1440 -15.28350 8.761132 
1 1 1   15   12   28 o   64.569   2.2346  172.764   11.743  165.147   20.619  176.422   14.287   61.931   4.1076   65.003   2.7022 -3.072437 4.916707 
1 1 1   15   12   29 o   31.444   3.8507   42.709   9.6644   56.619   17.474   36.578   11.600   34.724   6.4094   28.428   5.1972 6.295807 8.251809 
1 1 1   15   12   30 o   9.6144   4.5152  -8.0667   8.9984 -13.2901   16.046  -5.6705   10.868   12.665   5.9729   11.328   5.1944 1.336274 7.915700 
1 1 1   15   12   31 o   36.252   3.1217   55.612   9.1349   67.696   14.604   47.846   11.708   39.187   4.6634   32.976   4.4706 6.210960 6.460118 
1 1 1   15   12   32 o   26.901   4.4992   32.112   9.5177   45.683   14.124   20.823   12.882   31.493   5.7119   20.963   6.6868 10.53028 8.794271 
1 1 1   15   12   33 o   29.267   4.1802   37.530   9.6898   47.774   14.590   29.445   12.961   32.159   5.7781   24.804   6.3757 7.355431 8.604435 
1 1 1   15   12   34 o   55.922   2.4543  130.286   11.160  149.338   16.740  115.043   14.974   59.240   3.4820   51.922   3.5594 7.317947 4.979315 
1 1 1   15   12   35 o   14.056   5.3576   7.0337   8.5154   7.8885   13.765   6.5037   10.838   16.231   6.6117   14.740   5.9159 1.491230 8.872015 
1 1 1   15   12   36 o   13.601   5.3205   5.9766   8.5581   2.6194   13.934   8.0103   10.845   14.787   6.3712   15.274   5.9850 -0.4874172 8.741417 
1 1 1   15   12   37 o   37.487   3.1199   59.641   9.4473   92.083   15.795   41.571   11.788   45.892   4.2714   30.348   4.9347 15.54438 6.526516 
1 1 1   15   12   38 o   36.673   2.9991   56.965   8.8872   70.878   13.888   47.318   11.565   40.170   4.3086   32.666   4.4596 7.503956 6.200983 
1 1 1   15   12   39 o   29.509   3.7265   37.823   8.7645   40.394   13.494   35.947   11.527   29.286   5.8571   27.953   5.2517 1.333055 7.866774 
1 1 1   15   12   40 o   25.875   4.6234   30.199   9.3939   22.572   13.282   37.833   13.288   21.446   6.7837   28.209   5.9655 -6.763065 9.033588 
1 1 1   15   12   41 o   24.907   5.1857   28.755   10.186   25.828   13.199   33.064   16.016   22.824   6.6740   25.394   7.3306 -2.570604 9.913634 
1 1 1   15   12   42 o   24.027   4.8212   26.458   9.1139   35.758   12.866   17.093   12.912   27.318   5.9470   19.051   6.7017 8.266432 8.959905 
1 1 1   15   12   43 f   47.570   2.8588   95.711   11.034  101.276   17.085   91.729   14.453   47.750   4.4403   45.858   3.9034 1.892223 5.912102 
1 1 1   15   12   44 o   65.833   2.3092  180.936   12.373  192.228   19.053  172.701   16.270   66.835   3.5096   63.675   3.1444 3.160294 4.712142 
1 1 1   15   12   45 o   42.646   3.0801   77.622   10.635   63.968   16.505   87.314   13.907   36.793   5.6863   44.687   3.8554 -7.893314 6.870068 
1 1 1   15   12   46 o   21.697   5.5141   22.636   9.7712   20.849   15.597   23.791   12.536   20.347   7.3431   21.711   6.5438 -1.363413 9.835792 
1 1 1   15   12   47 o   29.826   4.1852   39.834   9.8957   33.355   15.652   44.149   12.772   25.091   7.2479   30.642   5.3055 -5.551394 8.982197 
1 1 1   15   12   48 o   13.337   5.6050   4.0236   10.326   18.697   19.569  -1.6382   12.156   19.754   7.9421   12.601   5.6642 7.153134 9.754986 
1 1 1   15   12   49 o   21.537   5.8325   22.989   10.490   12.334   19.308   27.450   12.494   18.036   7.6267   23.173   6.4024 -5.136192 9.957765 
1 1 1   15   12   50 o   22.323   6.0550   25.139   11.295   29.321   26.687   24.226   12.466   22.285   9.1565   21.617   6.5277 0.6674175 11.24517 
1 1 1   15   12   51 o   11.378   5.1220  -1.8370   9.9802   15.499   18.586  -8.8609   11.830   18.510   7.6272   10.865   5.1255 7.644986 9.189379 
1 1 1   15   12   52 o   9.7293   4.6327  -9.7215   10.107   2.0167   17.377 -15.7239   12.426   15.125   6.7876   10.071   4.8814 5.054161 8.360622 
1 1 1   15   12   53 o   22.064   5.8009   24.547   10.569   21.555   18.468   26.005   12.889   19.951   7.8124   22.103   6.6293 -2.152102 10.24599 
1 1 1   15   12   54 o   15.626   5.8604   11.052   10.093  -3.4859   16.672   19.462   12.681   13.770   6.3573   19.233   6.6497 -5.463500 9.199619 
1 1 1   15   12   55 o   13.027   5.4874   4.3331   9.9340   3.1090   16.142   5.0793   12.603   14.801   6.5991   14.192   6.0863 0.6089544 8.977260 
1 1 1   15   12   56 o   25.647   6.2437   34.500   12.929   0.0000   0.0000   34.500   12.929  ?   ?    25.647   6.2437 0.000000 6.243713 
1 1 1   15   12   57 f   17.904   5.9618   16.562   10.185  -5.1733   16.987   28.760   12.726   13.398   6.2635   23.001   6.5006 -9.603154 9.027132 
1 1 1   15   12   58 o   12.721   5.4371   3.7639   9.9955  -9.3049   16.971   10.705   12.368   12.707   6.0371   15.616   6.3014 -2.908532 8.726622 
1 1 1   15   12   59 o   18.580   5.8875   18.200   10.000   3.8796   16.635   26.303   12.514   14.761   6.6313   21.745   6.5344 -6.984153 9.309826 
1 1 1   15   12   60 o   10.776   4.9340  -2.7118   9.7566  -9.8669   16.045   1.4864   12.290   12.208   5.8195   12.884   5.7505 -0.6767750 8.181356 
1 1 1   15   12   61 o   21.389   5.6208   23.840   9.9264   35.640   17.012   17.749   12.223   23.816   7.6930   18.000   6.4998 5.815958 10.07119 
1 1 1   15   12   62 f   22.145   6.4416   27.439   12.324   33.506   26.251   25.725   13.957   21.139   8.9133   20.869   6.9798 0.2694263 11.32104 
1 1 1   15   12   63 o   11.936   5.4347  -1.1657   11.627 -38.8251   25.529   8.6907   13.061   12.340   6.1645   14.900   6.2852 -2.560331 8.803661 
1 1 1   15   12   64 o   18.518   6.4619   19.248   11.989   22.745   25.571   18.263   13.573   19.002   8.3978   17.987   6.7852 1.014593 10.79639 
1 1 1   15   12   65 o   12.534   5.6101   1.3548   11.787   0.1052   25.852   1.6828   13.244   15.725   7.4651   13.110   5.9010 2.615000 9.515728 
1 1 1   15   12   66 o   23.388   7.6770   35.504   16.906   47.823   27.293   27.835   21.536   23.538   9.4079   19.987   8.2203 3.550776 12.49331 
1 1 1   15   12   67 o   18.181   7.3306   19.936   16.723  -0.7475   26.149   34.250   21.753   15.527   7.4094   21.443   8.4540 -5.915665 11.24142 
1 1 1   15   12   68 o   16.595   7.0559   14.193   16.680 -15.3631   26.783   32.918   21.319   14.165   6.9321   21.079   8.3507 -6.913906 10.85304 
1 1 1   15   12   69 o   14.517   6.8792  -2.0502   21.766   0.0000   0.0000  -2.0502   21.766  ?   ?    14.517   6.8792 0.000000 6.879189 
1 1 1   15   12   70 o   16.953   7.5814   14.633   21.472   0.0000   0.0000   14.633   21.472  ?   ?    16.953   7.5814 0.000000 7.581360 
1 1 1   15   12   71 o   14.599   6.9009  -0.5335   21.647   0.0000   0.0000  -0.5335   21.647  ?   ?    14.599   6.9009 0.000000 6.900881 
1 1 1   15   12   72 o   18.186   7.9213   21.840   22.018   0.0000   0.0000   21.840   22.018  ?   ?    18.186   7.9213 0.000000 7.921322 
1 1 1   15   12   73 o   11.652   5.7755 -25.7847   20.687   0.0000   0.0000 -25.7847   20.687  ?   ?    11.652   5.7755 0.000000 5.775496 
1 1 1   15   12   74 o   14.488   6.8263   0.7342   20.870   0.0000   0.0000   0.7342   20.870  ?   ?    14.488   6.8263 0.000000 6.826320 
1 1 1   15   12   75 o   10.289   5.1890 -42.9991   20.362   0.0000   0.0000 -42.9991   20.362  ?   ?    10.289   5.1890 0.000000 5.189008 
1 1 1   15   12   76 o   14.793   6.4077   9.4001   14.242   18.585   19.268  -1.6624   21.146   17.275   7.4679   14.131   6.7207 3.143920 10.04676 
1 1 1   15   12   77 o   10.407   5.0615 -13.5160   13.664 -13.3333   18.503 -13.7351   20.265   12.085   5.8803   12.523   6.1068 -0.4379292 8.477690 
1 1 1   15   12   78 o   16.844   6.7730   17.051   14.235   6.2043   19.357   29.824   21.006   14.849   6.8537   19.548   8.0869 -4.698104 10.60054 
1 1 1   15   12   79 o   17.695   7.5542   21.010   19.255   21.010   19.255   0.0000   0.0000   17.695   7.5542  ?   ?  0.000000 7.554191 
1 1 1   15   12   80 o   10.534   5.2543 -28.9052   18.245 -28.9052   18.245   0.0000   0.0000   10.534   5.2543  ?   ?  0.000000 5.254296 
1 1 1   15   13  -74 o   17.057   7.5669   18.506   20.952   18.506   20.952   0.0000   0.0000   17.057   7.5669  ?   ?  0.000000 7.566889 
1 1 1   15   13  -73 o   14.238   6.7199   1.4435   20.381   1.4435   20.381   0.0000   0.0000   14.238   6.7199  ?   ?  0.000000 6.719938 
1 1 1   15   13  -72 o   15.800   6.7784   13.508   15.642 -12.1004   20.227   51.613   24.673   12.593   6.1323   23.676   9.0959 -11.08285 10.96997 
1 1 1   15   13  -71 o   14.161   6.3506   6.5422   15.182   5.7968   19.630   7.6518   23.950   14.759   6.8434   15.549   7.3223 -0.7901573 10.02243 
1 1 1   15   13  -70 o   18.207   7.1456   21.836   15.479   20.728   20.170   23.423   24.144   17.571   7.6182   17.952   8.0327 -0.3811817 11.07073 
1 1 1   15   13  -69 o   17.084   6.9683   17.884   15.314   4.3106   19.535   39.526   24.667   14.609   6.7921   21.071   8.7444 -6.461778 11.07236 
1 1 1   15   13  -68 o   19.228   8.4666   30.398   25.766   0.0000   0.0000   30.398   25.766  ?   ?    19.228   8.4666 0.000000 8.466580 
1 1 1   15   13  -67 o   11.733   5.8752 -35.4195   23.816   0.0000   0.0000 -35.4195   23.816  ?   ?    11.733   5.8752 0.000000 5.875232 
1 1 1   15   13  -66 o   11.494   5.7711 -39.2952   23.765   0.0000   0.0000 -39.2952   23.765  ?   ?    11.494   5.7711 0.000000 5.771103 
1 1 1   15   13  -65 o   17.420   7.9518   17.972   25.089   0.0000   0.0000   17.972   25.089  ?   ?    17.420   7.9518 0.000000 7.951764 
1 1 1   15   13  -64 o   16.643   7.7266   12.016   25.140   0.0000   0.0000   12.016   25.140  ?   ?    16.643   7.7266 0.000000 7.726561 
1 1 1   15   13  -63 o   20.837   8.8402   37.025   26.084   0.0000   0.0000   37.025   26.084  ?   ?    20.837   8.8402 0.000000 8.840233 
1 1 1   15   13  -62 o   14.585   6.9961  -4.2969   23.977   0.0000   0.0000  -4.2969   23.977  ?   ?    14.585   6.9961 0.000000 6.996086 
1 1 1   15   13  -61 o   16.659   6.7743   15.233   14.421   0.0000   0.0000   15.233   14.421  ?   ?    16.659   6.7743 0.000000 6.774348 
1 1 1   15   13  -60 f   10.718   5.1783 -12.3540   13.703   0.0000   0.0000 -12.3540   13.703  ?   ?    10.718   5.1783 0.000000 5.178329 
1 1 1   15   13  -59 o   17.760   7.0296   18.542   15.095   0.0000   0.0000   18.542   15.095  ?   ?    17.760   7.0296 0.000000 7.029585 
1 1 1   15   13  -58 o   9.7451   4.8202 -22.4904   14.139   0.0000   0.0000 -22.4904   14.139  ?   ?    9.7451   4.8202 0.000000 4.820217 
1 1 1   15   13  -57 o   23.443   7.2977   34.067   15.432   0.0000   0.0000   34.067   15.432  ?   ?    23.443   7.2977 0.000000 7.297744 
1 1 1   15   13  -56 o   9.3566   4.6508 -25.1628   13.789   0.0000   0.0000 -25.1628   13.789  ?   ?    9.3566   4.6508 0.000000 4.650844 
1 1 1   15   13  -55 o   16.218   6.7513   12.646   14.770   0.0000   0.0000   12.646   14.770  ?   ?    16.218   6.7513 0.000000 6.751336 
1 1 1   15   13  -54 o   11.944   5.3399   0.6608   10.647   1.8362   19.915   0.1904   12.598   14.927   6.9114   12.589   5.7025 2.337849 8.960275 
1 1 1   15   13  -53 o   12.363   5.3604   3.0764   9.9865  -0.3722   15.593   5.4747   13.003   13.491   6.1994   14.008   6.0946 -0.5162907 8.693501 
1 1 1   15   13  -52 o   27.582   4.8538   37.059   10.515   46.896   16.973   30.932   13.395   28.160   7.3256   23.297   6.6974 4.862352 9.925655 
1 1 1   15   13  -51 o   44.078   3.4671   86.653   12.357   74.839   17.905   97.398   17.076   37.970   5.9826   45.175   4.7062 -7.204426 7.611835 
1 1 1   15   13  -50 o   21.658   5.6131   24.301   9.9901   18.628   16.617   27.512   12.502   18.281   7.3293   22.243   6.4930 -3.961500 9.791707 
1 1 1   15   13  -49 o   16.611   5.8750   14.009   9.9330   9.9580   16.141   16.479   12.602   16.019   6.8791   17.629   6.5609 -1.609949 9.506213 
1 1 1   15   13  -48 o   10.008   4.6967  -6.3118   9.7045  -6.7495   15.984  -6.0563   12.213   12.750   5.9973   11.337   5.3037 1.413327 8.006073 
1 1 1   15   13  -47 o   22.490   5.5670   25.657   10.151   40.041   16.472   16.851   12.888   26.287   7.3842   17.927   6.6420 8.360142 9.931909 
1 1 1   15   13  -46 o   16.299   5.8188   12.954   9.7646   12.683   15.851   13.120   12.396   16.931   7.0166   16.604   6.4291 0.3269768 9.516647 
1 1 1   15   13  -45 o   13.950   6.1005   3.5326   13.171  -4.1603   15.807   21.004   23.821   13.275   6.1503   19.712   8.4083 -6.437181 10.41757 
1 1 1   15   13  -44 o   9.4817   4.6168 -15.8604   11.459   10.959   16.000 -44.1013   16.419   16.640   6.9842   9.1922   4.6388 7.448162 8.384329 
1 1 1   15   13  -43 o   14.186   5.9699   5.8158   11.738  -9.2958   16.035   23.265   17.231   12.602   5.9517   20.401   7.6558 -7.799300 9.697091 
1 1 1   15   13  -42 o   12.209   5.3350   1.2868   10.057   18.498   17.338  -7.4400   12.346   19.022   7.5324   11.326   5.3094 7.695994 9.215551 
1 1 1   15   13  -41 o   15.413   5.8698   10.280   10.216  -1.5942   17.928   15.990   12.431   14.613   6.6897   17.961   6.5451 -3.348288 9.359031 
1 1 1   15   13  -40 o   21.548   5.4891   22.837   9.6669   30.298   14.720   17.178   12.819   23.616   7.0847   18.492   6.6592 5.124161 9.723057 
1 1 1   15   13  -39 o   22.296   5.8659   24.870   10.803  -6.9816   18.817   40.528   13.194   14.117   6.5974   28.679   5.8424 -14.56123 8.812476 
1 1 1   15   13  -38 o   13.063   5.4411   4.2944   9.6012   12.861   14.821  -1.9002   12.603   17.322   6.9297   12.679   5.7274 4.642829 8.990183 
1 1 1   15   13  -37 o   19.526   5.7423   18.763   9.7470   19.903   15.157   17.959   12.728   19.746   7.2222   18.972   6.6553 0.7735920 9.821120 
1 1 1   15   13  -36 o   11.135   5.0023  -1.9817   9.4663   9.4361   14.398 -10.6762   12.564   16.319   6.7176   11.011   5.2204 5.308098 8.507579 
1 1 1   15   13  -35 o   27.097   4.6691   33.720   9.9410   27.104   15.177   38.691   13.156   22.612   7.2628   28.160   5.9194 -5.548500 9.369472 
1 1 1   15   13  -34 f   26.395   4.8050   32.164   9.9575   44.347   15.506   23.614   12.990   29.695   6.5791   21.517   6.6950 8.177912 9.386534 
1 1 1   15   13  -33 o   15.423   5.9872   9.2662   10.771   10.616   14.871   7.7765   15.622   16.909   6.8781   16.312   6.8770 0.5967960 9.726298 
1 1 1   15   13  -32 o   17.305   5.8775   13.956   9.8964   19.197   15.056   9.9687   13.132   19.788   7.2042   16.325   6.5255 3.463346 9.720203 
1 1 1   15   13  -31 o   41.268   2.9430   72.389   9.8351   90.558   16.286   61.959   12.339   45.001   4.5001   37.443   4.1103 7.558205 6.094671 
1 1 1   15   13  -30 o   34.871   3.4610   52.552   9.7083   44.233   15.876   57.521   12.270   29.760   6.7058   35.987   4.2655 -6.226431 7.947445 
1 1 1   15   13  -29 o   41.444   2.9757   72.959   9.9857   69.249   16.226   75.222   12.669   38.772   5.2702   41.579   3.7792 -2.807106 6.485177 
1 1 1   15   13  -28 o   11.770   5.0827   0.8572   8.9071   20.183   14.815 -10.0830   11.147   20.320   7.1760   10.459   4.9466 9.860871 8.715748 
1 1 1   15   13  -27 o   25.788   4.9712   30.565   10.071   16.447   19.211   35.915   11.827   19.649   7.8795   27.724   5.4275 -8.075468 9.567907 
1 1 1   15   13  -26 o   20.313   5.9984   19.817   10.617   32.107   19.433   14.587   12.677   24.514   8.2365   18.073   6.6057 6.440788 10.55822 
1 1 1   15   13  -25 o   30.504   4.6620   41.826   11.225   12.107   19.788   55.925   13.630   18.747   7.8103   35.198   4.8816 -16.45128 9.210405 
1 1 1   15   13  -24 o   24.792   5.6440   28.998   11.149   32.678   15.649   25.204   15.888   25.378   7.2209   22.376   7.4462 3.001997 10.37249 
1 1 1   15   13  -23 o   32.633   3.9974   46.584   10.411   32.432   15.824   57.386   13.825   25.275   7.2836   35.704   4.8777 -10.42901 8.765961 
1 1 1   15   13  -22 o   15.183   5.7586   8.7958   9.8076   5.1824   15.312   11.310   12.772   15.874   6.7553   16.959   6.5366 -1.084270 9.400064 
1 1 1   15   13  -21 o   43.023   3.1494   78.591   10.968   59.010   16.593   93.789   14.618   35.486   5.9464   46.544   3.8883 -11.05749 7.104848 
1 1 1   15   13  -20 o   12.696   5.4057   1.9743   9.8143   7.6301   15.177  -2.0906   12.867   16.521   6.8578   13.117   5.8671 3.403393 9.025060 
1 1 1   15   13  -19 o   26.277   5.3812   31.945   11.138   39.400   15.715   24.420   15.788   28.274   6.8840   22.210   7.4235 6.064079 10.12410 
1 1 1   15   13  -18 o   51.467   2.7649  111.214   11.557  115.091   17.839  108.410   15.171   51.317   4.3043   50.216   3.7330 1.100765 5.697576 
1 1 1   15   13  -17 o   19.671   5.5320   18.052   9.2395   0.9882   15.249   27.951   11.614   14.906   6.5399   24.290   5.9206 -9.384295 8.821813 
1 1 1   15   13  -16 o   9.6388   4.5386  -8.4273   9.1972 -10.7581   16.519  -7.3802   11.072   13.195   6.1713   11.030   5.1229 2.165099 8.020525 
1 1 1   15   13  -15 o   20.895   5.4961   20.366   9.4850   53.693   17.508   6.5226   11.284   33.414   6.6620   14.904   6.0173 18.50910 8.977187 
1 1 1   15   13  -14 o   28.805   4.2845   36.580   9.7544   54.937   17.481   28.280   11.755   33.901   6.5631   24.451   5.9540 9.450077 8.861347 
1 1 1   15   13  -13 o   11.570   5.0935  -0.9456   9.3205   21.493   16.760 -10.9919   11.215   21.294   7.6209   10.436   4.9434 10.85712 9.083831 
1 1 1   15   13  -12 o   60.116   2.9672  152.047   14.495  195.463   20.850  111.437   20.165   67.514   3.8040   50.003   5.0150 17.51136 6.294515 
1 1 1   15   13  -11 o   52.931   2.8863  117.729   12.406  119.030   19.737  116.880   15.951   51.956   4.7113   52.188   3.7752 -0.2317619 6.037239 
1 1 1   15   13  -10 o   52.487   3.1923  116.523   13.593  133.829   27.511  110.934   15.635   53.454   6.4437   50.824   3.8014 2.629776 7.481455 
1 1 1   15   13   -9 o   41.684   4.4618   76.225   14.925  112.780   26.785   59.764   17.974   48.536   6.9697   35.547   6.4401 12.98903 9.489551 
1 1 1   15   13   -8 o   25.339   5.3510   29.519   10.705   27.200   24.221   30.082   11.934   23.576   9.0235   25.306   5.8954 -1.730682 10.77867 
1 1 1   15   13   -7 o   9.3927   4.5142 -13.0556   10.091 -21.5550   23.600 -11.1540   11.163   14.637   6.9998   10.390   4.9245 4.247375 8.558499 
1 1 1   15   13   -6 o   50.999   2.6205  108.695   10.858  103.358   19.252  111.183   13.148   48.224   4.9686   51.297   3.1597 -3.072529 5.888198 
1 1 1   15   13   -5 o   20.961   5.5301   20.422   9.5840   31.265   17.410   15.708   11.480   24.913   7.7507   18.633   6.3303 6.280895 10.00731 
1 1 1   15   13   -4 o   9.9096   4.6227  -7.1741   9.1710  -5.8804   16.555  -7.7469   11.016   14.109   6.4473   10.953   5.0949 3.155720 8.217443 
1 1 1   15   13   -3 o   21.130   5.5178   20.742   9.6052   15.121   17.511   23.162   11.488   19.424   7.6069   22.101   6.1515 -2.677389 9.782921 
1 1 1   15   13   -2 o   30.040   4.1114   39.417   9.8037   44.241   17.462   37.196   11.847   29.958   7.2332   28.576   5.2805 1.381645 8.955572 
1 1 1   15   13   -1 o   24.058   5.1281   26.421   9.7489   23.940   17.018   27.634   11.894   22.243   7.7025   24.178   6.0501 -1.935406 9.794480 
1 1 1   15   13    0 o   49.038   3.4553  102.312   13.723  126.508   19.988   80.735   18.876   53.703   4.6105   42.094   5.6430 11.60848 7.287025 
1 1 1   15   13    1 o   31.355   3.9675   42.704   9.9138   41.002   17.812   43.468   11.933   28.612   7.5344   31.185   4.8521 -2.573046 8.961617 
1 1 1   15   13    2 o   14.579   5.6178   7.3851   9.4314   28.860   16.952  -2.2429   11.350   24.050   7.6705   12.389   5.5280 11.66167 9.454915 
1 1 1   15   13    3 o   14.848   5.6425   8.0338   9.4276   25.741   16.833  -0.0585   11.380   22.887   7.6654   12.971   5.6715 9.915457 9.535443 
1 1 1   15   13    4 o   30.232   4.1592   39.979   9.9783   53.198   18.147   34.251   11.946   33.157   6.9374   27.237   5.5689 5.920298 8.896043 
1 1 1   15   13    5 o   35.311   3.5590   53.417   10.105   69.221   18.095   46.256   12.181   38.731   5.9192   32.219   4.7828 6.511608 7.609962 
1 1 1   15   13    6 o   50.604   2.6623  107.102   10.943  120.925   19.837  101.055   13.120   52.420   4.6919   48.808   3.3175 3.612053 5.746303 
1 1 1   15   13    7 o   24.837   5.0190   28.024   9.8115   37.694   17.377   23.499   11.888   27.392   7.5436   22.206   6.2853 5.186190 9.818886 
1 1 1   15   13    8 o   32.952   4.1250   47.362   10.838   40.699   23.381   49.186   12.231   27.512   9.0279   33.318   4.6285 -5.805376 10.14524 
1 1 1   15   13    9 o   14.154   5.7778   5.1249   10.539   4.6544   26.799   5.2110   11.462   19.251   8.5479   14.569   5.9952 4.681975 10.44075 
1 1 1   15   13   10 o   16.540   6.2906   10.543   11.724   3.1729   25.887   12.445   13.149   18.771   8.3638   17.600   6.6695 1.170902 10.69746 
1 1 1   15   13   11 o   13.752   5.8764   2.2854   11.671   1.0365   26.309   2.5914   13.022   18.523   8.3289   14.438   6.1892 4.084545 10.37671 
1 1 1   15   13   12 o   41.957   3.3610   74.928   11.399   83.503   18.491   69.672   14.477   42.944   5.4015   39.764   4.5480 3.179569 7.061238 
1 1 1   15   13   13 o   14.284   5.7663   5.7519   10.361  -3.2860   16.348   11.820   13.395   14.479   6.5332   17.414   6.6990 -2.935237 9.357341 
1 1 1   15   13   14 o   28.590   4.3302   36.099   9.7758   37.635   17.411   35.392   11.814   27.271   7.5667   27.729   5.4209 -0.4587421 9.308081 
1 1 1   15   13   15 o   9.0468   4.3403 -11.6876   9.2372  -9.6536   16.663 -12.5900   11.099   13.446   6.2587   10.083   4.8158 3.363678 7.897058 
1 1 1   15   13   16 o   65.790   2.2660  179.803   12.134  194.246   21.930  173.430   14.567   67.043   4.0314   64.303   2.7858 2.739410 4.900285 
1 1 1   15   13   17 o   53.030   2.5499  117.514   10.990  133.256   20.175  110.871   13.106   55.058   4.5354   51.171   3.1573 3.886700 5.526204 
1 1 1   15   13   18 o   12.704   5.3062   2.9391   9.1682   1.5808   17.073   3.4896   10.868   15.713   6.9063   13.703   5.7541 2.009609 8.989241 
1 1 1   15   13   19 o   42.067   3.0592   74.929   10.419   73.859   19.105   75.382   12.430   39.696   6.0990   41.850   3.6810 -2.154613 7.123772 
1 1 1   15   13   20 o   29.845   4.1698   39.202   9.8678   51.537   18.256   34.111   11.729   32.236   7.1363   27.096   5.4984 5.140846 9.008846 
1 1 1   15   13   21 o   23.892   5.0726   26.247   9.5733   1.2071   17.294   37.310   11.495   15.660   6.9142   28.574   5.1236 -12.91372 8.605664 
1 1 1   15   13   22 o   9.0853   4.3512 -11.1650   9.1944  -3.9580   16.721 -14.2883   11.008   14.393   6.5394   9.7193   4.6822 4.673722 8.042831 
1 1 1   15   13   23 o   51.082   2.6449  109.450   10.976  123.172   19.980  103.519   13.135   52.642   4.7057   49.297   3.2876 3.344868 5.740337 
1 1 1   15   13   24 o   59.713   2.6449  149.516   12.842  166.166   20.980  139.540   16.240   61.675   4.1982   57.081   3.5071 4.593475 5.470396 
1 1 1   15   13   25 o   48.093   3.0573   98.065   11.924  116.069   19.916   88.007   14.886   50.896   4.8595   44.852   4.1174 6.043350 6.369310 
1 1 1   15   13   26 o   45.097   4.0860   88.985   14.857  115.921   26.231   76.262   18.028   48.829   6.7723   40.549   5.6038 8.280556 8.790186 
1 1 1   15   13   27 o   24.370   5.8540   28.480   11.483   43.403   22.802   23.409   13.291   27.706   8.9023   21.698   6.7754 6.007753 11.18741 
1 1 1   15   13   28 o   16.606   6.1391   11.769   11.000   6.9883   21.483   13.468   12.806   17.879   7.8054   17.608   6.6016 0.2709656 10.22274 
1 1 1   15   13   29 o   28.736   4.5715   37.278   10.350   40.642   16.900   35.260   13.092   28.033   7.3185   26.955   6.1011 1.077791 9.528065 
1 1 1   15   13   30 o   13.080   5.4907   3.4306   9.8909   2.0287   16.304   4.2469   12.442   15.264   6.7276   14.404   6.1079 0.8602448 9.086650 
1 1 1   15   13   31 o   11.590   5.1451  -1.1044   9.7042 -11.2056   15.732   5.0995   12.329   12.547   5.9166   14.586   6.1269 -2.038233 8.517326 
1 1 1   15   13   32 o   17.096   5.9430   13.462   10.136   6.9109   16.627   17.336   12.786   16.418   7.0146   18.963   6.6691 -2.545279 9.678930 
1 1 1   15   13   33 o   30.076   4.7489   41.374   11.257   29.307   15.243   55.848   16.694   23.609   7.2364   33.745   6.3006 -10.13603 9.594992 
1 1 1   15   13   34 f   11.234   5.1303  -3.9773   10.460  -4.4723   14.461  -3.4342   15.148   13.081   5.9957   13.570   6.1881 -0.4888554 8.616338 
1 1 1   15   13   35 o   38.200   3.7221   63.932   11.443   65.631   15.698   62.006   16.716   37.453   5.2889   35.822   5.9321 1.630280 7.947502 
1 1 1   15   13   36 o   25.522   5.5119   31.360   11.131   36.533   15.324   25.583   16.195   26.381   7.0081   21.839   7.5162 4.542591 10.27650 
1 1 1   15   13   37 o   23.275   5.7532   26.660   10.852   24.129   14.677   29.713   16.119   21.345   7.1577   23.316   7.4844 -1.970377 10.35610 
1 1 1   15   13   38 o   18.973   5.7954   17.772   9.7877   13.312   14.599   21.414   13.192   17.426   6.9082   20.320   6.7855 -2.894339 9.683244 
1 1 1   15   13   39 o   22.995   5.3420   25.626   9.8217   23.639   14.595   27.270   13.278   21.013   7.1378   22.757   6.7048 -1.744173 9.792985 
1 1 1   15   13   40 o   11.768   5.1757   0.3663   9.6021   7.5794   14.228  -5.6675   13.013   15.547   6.5591   12.024   5.5741 3.522671 8.607658 
1 1 1   15   13   41 o   15.924   6.0167   11.331   10.683   11.350   17.883   11.320   13.321   17.270   7.3229   16.403   6.5670 0.8668900 9.836182 
1 1 1   15   13   42 o   45.804   3.2916   91.277   12.208   86.086   19.792   94.465   15.510   41.628   6.0062   45.707   4.2101 -4.078499 7.334806 
1 1 1   15   13   43 o   52.600   2.9396  118.879   12.554  103.022   20.016  129.162   16.119   46.252   5.4110   54.061   3.6797 -7.808773 6.543689 
1 1 1   15   13   44 o   17.722   5.7971   15.748   9.6440   14.122   13.723   17.334   13.556   17.227   6.7378   18.342   6.8089 -1.114161 9.579056 
1 1 1   15   13   45 o   15.411   5.9409   10.498   10.551   2.1402   13.232   25.088   17.482   13.629   6.0313   20.789   7.7294 -7.159456 9.804106 
1 1 1   15   13   46 o   22.772   6.9454   29.005   14.064   32.423   17.557   22.882   23.497   23.147   7.8288   19.952   8.4239 3.194931 11.50010 
1 1 1   15   13   47 o   9.1722   4.5151 -19.6434   11.900 -10.5682   16.667 -29.0826   16.998   12.483   5.9451   10.528   5.2213 1.954350 7.912425 
1 1 1   15   13   48 o   20.044   6.0241   21.275   10.635   19.310   17.140   22.505   13.561   18.691   7.4605   19.991   6.8780 -1.300331 10.14723 
1 1 1   15   13   49 o   12.440   5.4176   2.5401   10.295   13.078   17.444  -3.0915   12.752   16.968   7.2150   12.106   5.5788 4.861172 9.120282 
1 1 1   15   13   50 o   13.354   5.6267   5.4844   10.449   9.3309   17.106   3.1946   13.198   15.965   6.9676   13.605   6.0221 2.359608 9.209387 
1 1 1   15   13   51 o   10.421   4.8667  -5.3083   10.213 -10.0089   16.657  -2.4770   12.927   12.376   5.9081   12.230   5.6288 0.1463985 8.160207 
1 1 1   15   13   52 o   12.875   5.8052   0.7796   12.882   0.0000   0.0000   0.7796   12.882  ?   ?    12.875   5.8052 0.000000 5.805247 
1 1 1   15   13   53 o   16.664   6.3356   14.511   11.889   37.706   27.157   9.0110   13.224   21.785   9.1182   15.018   6.3291 6.766617 11.09951 
1 1 1   15   13   54 o   16.377   6.3240   13.818   11.970  -3.2480   27.117   17.948   13.340   15.625   7.4805   17.882   6.7308 -2.256427 10.06289 
1 1 1   15   13   55 o   18.073   6.7589   18.570   13.406   9.8113   27.789   21.227   15.304   17.171   8.0221   18.846   7.1828 -1.675728 10.76784 
1 1 1   15   13   56 o   11.446   5.4732  -9.9339   14.425   0.0000   0.0000  -9.9339   14.425  ?   ?    11.446   5.4732 0.000000 5.473219 
1 1 1   15   13   57 o   12.805   5.9159  -1.6079   14.473   0.0000   0.0000  -1.6079   14.473  ?   ?    12.805   5.9159 0.000000 5.915943 
1 1 1   15   13   58 o   21.427   7.2843   28.917   15.201   0.0000   0.0000   28.917   15.201  ?   ?    21.427   7.2843 0.000000 7.284313 
1 1 1   15   13   59 o   27.823   6.9164   45.385   15.619   0.0000   0.0000   45.385   15.619  ?   ?    27.823   6.9164 0.000000 6.916414 
1 1 1   15   13   60 f   13.557   6.1518   2.4037   14.741   0.0000   0.0000   2.4037   14.741  ?   ?    13.557   6.1518 0.000000 6.151792 
1 1 1   15   13   61 o   17.817   6.9953   18.993   14.840   0.0000   0.0000   18.993   14.840  ?   ?    17.817   6.9953 0.000000 6.995319 
1 1 1   15   13   62 o   15.223   7.1962   1.7849   23.541   0.0000   0.0000   1.7849   23.541  ?   ?    15.223   7.1962 0.000000 7.196243 
1 1 1   15   13   63 o   10.336   5.2224 -47.4696   21.189   0.0000   0.0000 -47.4696   21.189  ?   ?    10.336   5.2224 0.000000 5.222440 
1 1 1   15   13   64 o   15.509   7.2760   5.0699   23.264   0.0000   0.0000   5.0699   23.264  ?   ?    15.509   7.2760 0.000000 7.275980 
1 1 1   15   13   65 o   10.897   5.4813 -41.1500   21.932   0.0000   0.0000 -41.1500   21.932  ?   ?    10.897   5.4813 0.000000 5.481343 
1 1 1   15   13   66 o   20.372   8.4330   33.531   22.861   0.0000   0.0000   33.531   22.861  ?   ?    20.372   8.4330 0.000000 8.432974 
1 1 1   15   13   67 o   17.160   7.7855   17.345   23.599   0.0000   0.0000   17.345   23.599  ?   ?    17.160   7.7855 0.000000 7.785542 
1 1 1   15   13   68 o   15.261   7.1526   5.4864   22.386   0.0000   0.0000   5.4864   22.386  ?   ?    15.261   7.1526 0.000000 7.152640 
1 1 1   15   13   69 o   11.205   5.6019 -32.3174   21.258   0.0000   0.0000 -32.3174   21.258  ?   ?    11.205   5.6019 0.000000 5.601852 
1 1 1   15   13   70 o   16.005   7.4162   11.180   22.995   0.0000   0.0000   11.180   22.995  ?   ?    16.005   7.4162 0.000000 7.416164 
1 1 1   15   13   71 o   11.633   5.7835 -26.2376   21.367   0.0000   0.0000 -26.2376   21.367  ?   ?    11.633   5.7835 0.000000 5.783513 
1 1 1   15   13   72 o   14.499   6.8536   2.2268   21.349   0.0000   0.0000   2.2268   21.349  ?   ?    14.499   6.8536 0.000000 6.853605 
1 1 1   15   14  -65 o   13.057   6.4483 -17.7537   24.945   0.0000   0.0000 -17.7537   24.945  ?   ?    13.057   6.4483 0.000000 6.448253 
1 1 1   15   14  -64 o   14.490   7.0136  -2.3313   25.421   0.0000   0.0000  -2.3313   25.421  ?   ?    14.490   7.0136 0.000000 7.013604 
1 1 1   15   14  -63 o   11.421   5.7530 -41.2960   24.608   0.0000   0.0000 -41.2960   24.608  ?   ?    11.421   5.7530 0.000000 5.753017 
1 1 1   15   14  -62 o   13.986   6.7981  -7.0469   24.552   0.0000   0.0000  -7.0469   24.552  ?   ?    13.986   6.7981 0.000000 6.798076 
1 1 1   15   14  -61 o   16.067   7.5818   10.200   25.921   0.0000   0.0000   10.200   25.921  ?   ?    16.067   7.5818 0.000000 7.581752 
1 1 1   15   14  -60 o   13.452   6.6275 -16.8025   25.831   0.0000   0.0000 -16.8025   25.831  ?   ?    13.452   6.6275 0.000000 6.627526 
1 1 1   15   14  -59 o   13.632   6.6820 -13.4646   25.193   0.0000   0.0000 -13.4646   25.193  ?   ?    13.632   6.6820 0.000000 6.681954 
1 1 1   15   14  -58 o   14.511   7.0176  -4.5233   25.315   0.0000   0.0000  -4.5233   25.315  ?   ?    14.511   7.0176 0.000000 7.017630 
1 1 1   15   14  -57 o   15.617   6.8274   11.665   16.486   0.0000   0.0000   11.665   16.486  ?   ?    15.617   6.8274 0.000000 6.827360 
1 1 1   15   14  -56 o   11.241   5.4615 -13.6756   15.801   0.0000   0.0000 -13.6756   15.801  ?   ?    11.241   5.4615 0.000000 5.461528 
1 1 1   15   14  -55 o   22.611   7.6389   34.902   16.715   0.0000   0.0000   34.902   16.715  ?   ?    22.611   7.6389 0.000000 7.638915 
1 1 1   15   14  -54 o   23.563   7.5752   37.029   16.508   0.0000   0.0000   37.029   16.508  ?   ?    23.563   7.5752 0.000000 7.575179 
1 1 1   15   14  -53 o   13.366   5.8943   4.6351   12.534   36.127   21.219 -12.2397   15.533   21.594   8.3976   11.378   5.5013 10.21553 10.03913 
1 1 1   15   14  -52 o   8.5715   4.2736 -23.8023   12.012 -25.1272   20.602 -23.1199   14.785   11.711   5.7972   9.8793   4.8942 1.831509 7.586869 
1 1 1   15   14  -51 o   12.989   5.8070   2.8834   12.590   1.4162   21.301   3.6711   15.608   14.774   6.9411   13.965   6.3343 0.8089085 9.396938 
1 1 1   15   14  -50 o   13.852   6.3474   2.1674   16.190  -2.0956   20.902   8.5612   25.598   14.266   6.7550   16.372   7.6654 -2.105804 10.21703 
1 1 1   15   14  -49 o   14.925   6.6394   7.3489   16.243   7.6089   20.875   6.9499   25.861   15.723   7.2057   16.262   7.6427 -0.5390043 10.50395 
1 1 1   15   14  -48 o   11.196   5.2695  -5.8185   12.375  -7.0114   19.749  -5.0474   15.878   13.448   6.4233   12.612   5.9462 0.8358183 8.753067 
1 1 1   15   14  -47 o   14.846   6.2201   9.3658   12.657   18.751   20.875   3.9099   15.917   17.885   7.7524   14.232   6.4318 3.653144 10.07305 
1 1 1   15   14  -46 o   26.148   6.4221   38.241   13.587   38.400   21.959   38.142   17.296   22.580   8.6042   24.159   7.7524 -1.579290 11.58150 
1 1 1   15   14  -45 o   11.969   5.5268  -2.5134   12.609  -5.9948   20.371  -0.3508   16.055   13.830   6.5828   13.523   6.2418 0.3062820 9.071532 
1 1 1   15   14  -44 o   22.637   6.6907   29.757   13.205   14.625   20.960   39.716   17.003   17.202   7.6027   24.996   7.6392 -7.793617 10.77769 
1 1 1   15   14  -43 o   13.581   5.9391   4.6310   12.484  -6.7176   19.844   12.065   16.061   13.647   6.4964   16.191   6.9052 -2.543380 9.480749 
1 1 1   15   14  -42 o   25.462   6.4175   35.997   13.313   61.508   21.979   21.215   16.731   30.238   8.5423   18.757   7.4082 11.48155 11.30717 
1 1 1   15   14  -41 o   12.979   5.8492   1.1469   13.059   8.9721   21.104  -3.7087   16.624   16.336   7.3920   13.225   6.1872 3.110774 9.639687 
1 1 1   15   14  -40 o   20.757   6.3927   24.121   11.879   23.053   17.145   25.108   16.473   19.391   7.5463   20.117   7.4984 -0.7264996 10.63830 
1 1 1   15   14  -39 o   12.566   5.4751   2.9592   10.524   1.4240   16.503   4.0115   13.663   14.133   6.4504   13.877   6.1354 0.2562656 8.902291 
1 1 1   15   14  -38 o   31.471   4.4837   46.833   11.177   43.921   18.011   48.658   14.254   26.578   7.8031   30.597   5.9293 -4.018642 9.800250 
1 1 1   15   14  -37 o   18.421   6.1231   18.165   10.744   13.531   17.371   21.036   13.673   17.013   7.2157   19.250   6.8842 -2.237238 9.972872 
1 1 1   15   14  -36 o   14.281   5.7999   7.9996   10.555   10.873   16.730   6.1000   13.603   16.353   7.0127   14.511   6.2738 1.842346 9.409521 
1 1 1   15   14  -35 o   20.387   6.0722   22.106   10.843   12.128   17.463   28.366   13.832   16.829   7.1894   22.346   6.9012 -5.517305 9.965648 
1 1 1   15   14  -34 o   16.403   6.0696   13.234   10.756   0.3054   17.380   21.259   13.694   14.426   6.5976   19.545   6.8994 -5.119112 9.546222 
1 1 1   15   14  -33 o   10.931   5.0530  -4.3724   10.582 -39.2671   17.282   16.559   13.385   9.8296   4.9337   17.867   6.7384 -8.037531 8.351454 
1 1 1   15   14  -32 o   15.882   6.0357   11.719   10.787   8.7424   18.086   13.363   13.440   16.375   7.1550   16.820   6.6407 -0.4449902 9.761792 
1 1 1   15   14  -31 o   13.903   5.9384   4.9773   11.910   17.611   17.784  -5.2964   16.037   18.539   7.5288   13.149   6.1270 5.389549 9.706866 
1 1 1   15   14  -30 o   16.369   5.8406   12.956   9.8363   14.253   14.216   11.765   13.624   17.285   6.8281   16.410   6.6166 0.8742199 9.507969 
1 1 1   15   14  -29 o   13.840   5.6049   6.7371   9.8251   10.335   14.349   3.5607   13.481   16.153   6.6833   14.103   6.1695 2.050151 9.095557 
1 1 1   15   14  -28 o   22.459   5.5497   25.144   10.100   15.020   14.756   34.071   13.855   17.668   6.9636   25.275   6.6401 -7.607468 9.622002 
1 1 1   15   14  -27 o   17.194   5.9400   14.558   10.118   10.307   14.905   18.192   13.781   16.325   6.7879   18.738   6.8811 -2.413233 9.665653 
1 1 1   15   14  -26 o   9.8378   4.6496  -8.1150   9.8181 -22.0002   14.385   3.9935   13.433   10.234   5.0231   14.273   6.2025 -4.038820 7.981370 
1 1 1   15   14  -25 o   23.748   5.4015   27.585   10.219   24.360   15.253   30.212   13.766   21.048   7.2920   23.755   6.7770 -2.706390 9.954989 
1 1 1   15   14  -24 o   22.394   5.5819   24.832   10.153   25.152   15.430   24.588   13.483   21.365   7.3372   21.428   6.8416 -0.6370354E-01 10.03207 
1 1 1   15   14  -23 o   15.148   5.7684   9.7501   9.8658   10.845   14.798   8.8738   13.237   16.587   6.8173   15.651   6.4417 0.9357996 9.379349 
1 1 1   15   14  -22 o   10.357   4.8094  -5.6045   9.7509 -13.4555   14.779   0.4481   12.976   11.559   5.5306   13.324   5.9303 -1.765873 8.109011 
1 1 1   15   14  -21 o   42.278   3.2304   77.321   11.049   67.862   16.530   84.960   14.854   37.579   5.5642   43.441   4.2491 -5.861515 7.001066 
1 1 1   15   14  -20 o   38.627   3.5225   65.249   10.969   59.160   16.388   70.192   14.764   34.660   6.0188   39.051   4.7346 -4.390911 7.657847 
1 1 1   15   14  -19 f   21.526   5.9832   23.246   10.876   32.157   17.752   17.891   13.761   23.836   7.8687   18.916   6.8873 4.920296 10.45710 
1 1 1   15   14  -18 o   41.365   3.9857   75.984   13.273  108.273   18.826   44.071   18.716   48.549   4.8208   28.051   7.8682 20.49814 9.227580 
1 1 1   15   14  -17 o   33.146   4.7774   50.625   12.536   62.911   17.734   38.354   17.723   35.545   6.3537   26.265   7.7483 9.280207 10.02021 
1 1 1   15   14  -16 o   11.603   5.2325  -2.2522   10.469 -19.0918   16.553   8.9748   13.516   11.686   5.6569   15.933   6.5282 -4.247835 8.638178 
1 1 1   15   14  -15 o   23.512   5.2995   26.439   9.9132   34.989   17.492   22.393   12.032   25.132   7.7606   20.997   6.4279 4.135014 10.07692 
1 1 1   15   14  -14 o   17.414   5.7863   14.453   9.5951   18.747   17.109   12.483   11.589   19.562   7.5589   16.757   6.2806 2.805687 9.827696 
1 1 1   15   14  -13 o   45.929   2.8976   89.815   10.793   84.128   18.776   92.621   13.190   42.110   5.6095   46.173   3.5313 -4.063503 6.628438 
1 1 1   15   14  -12 o   11.703   5.1414   0.0194   9.4523   16.133   16.652  -7.6412   11.481   18.771   7.3978   11.002   5.1456 7.768247 9.011342 
1 1 1   15   14  -11 f   21.808   5.4698   22.923   9.7053   33.453   17.147   17.960   11.772   24.753   7.6905   19.095   6.4106 5.657755 10.01196 
1 1 1   15   14  -10 o   52.347   2.6334  115.644   11.201  114.567   19.578  116.167   13.656   50.118   4.8528   52.016   3.2368 -1.897968 5.833290 
1 1 1   15   14   -9 o   19.655   5.6985   18.772   9.6589   13.720   16.925   21.212   11.762   18.161   7.3559   20.582   6.3653 -2.420883 9.727637 
1 1 1   15   14   -8 o   19.836   6.1225   19.408   10.889   0.0383   17.150   32.489   14.093   14.998   6.7359   25.179   6.7354 -10.18059 9.525643 
1 1 1   15   14   -7 o   31.938   3.9492   45.126   10.062   25.836   17.355   54.894   12.350   22.020   7.7678   34.919   4.4390 -12.89865 8.946678 
1 1 1   15   14   -6 o   27.410   4.5915   34.264   9.8965   40.065   17.248   31.416   12.084   27.391   7.5043   25.340   5.9519 2.050867 9.578051 
1 1 1   15   14   -5 o   14.135   5.6057   6.8636   9.6161   14.038   16.835   3.3895   11.715   18.285   7.3611   13.784   5.8887 4.500561 9.426666 
1 1 1   15   14   -4 o   29.095   4.7902   38.839   10.966   49.892   25.021   36.211   12.200   28.622   9.3360   27.507   5.6308 1.115723 10.90259 
1 1 1   15   14   -3 o   50.867   2.9289  109.964   12.093   96.125   27.457  113.295   13.470   42.079   8.2997   51.408   3.2307 -9.329365 8.906366 
1 1 1   15   14   -2 o   11.354   5.1370  -2.9167   10.187 -29.5674   23.118   3.5054   11.348   13.203   6.4569   13.676   5.8176 -0.4723034 8.691095 
1 1 1   15   14   -1 o   19.416   6.0007   18.384   10.455  -1.7918   23.800   23.209   11.639   16.711   7.6715   21.592   6.2539 -4.880730 9.897674 
1 1 1   15   14    0 o   31.379   3.9833   43.584   9.9594   69.278   17.833   31.937   12.006   38.002   5.9520   25.633   5.8724 12.36861 8.361312 
1 1 1   15   14    1 o   33.844   4.0978   50.839   11.075   63.630   25.907   47.979   12.251   32.693   9.2871   32.408   4.7807 0.2849121 10.44534 
1 1 1   15   14    2 o   27.307   5.0653   34.713   10.860   53.496   26.221   30.825   11.931   29.422   9.5545   25.134   5.9215 4.288221 11.24065 
1 1 1   15   14    3 o   48.251   3.0826   99.412   12.061   83.136   28.890  102.848   13.273   37.459   9.4606   48.881   3.3515 -11.42233 10.03666 
1 1 1   15   14    4 o   18.319   6.0335   16.125   10.439   46.396   25.015   9.7408   11.487   27.564   9.3447   15.788   6.1676 11.77622 11.19657 
1 1 1   15   14    5 o   21.242   5.5098   21.722   9.6204   42.957   17.171   12.006   11.615   28.571   7.3356   16.666   6.2788 11.90528 9.655791 
1 1 1   15   14    6 o   14.881   5.6807   8.7499   9.5828   18.178   17.199   4.5055   11.540   19.541   7.5712   14.042   5.9147 5.499524 9.607586 
1 1 1   15   14    7 o   11.331   5.0509  -1.3751   9.4507  -8.4376   16.724   1.9385   11.455   13.334   6.2276   13.252   5.7434 0.8255959E-01 8.471698 
1 1 1   15   14    8 o   14.491   5.6377   7.8437   9.5668   6.8491   16.886   8.3138   11.610   16.392   7.0377   15.290   6.1275 1.102554 9.331431 
1 1 1   15   14    9 o   14.947   5.9057   8.1891   10.636   0.0561   16.902   13.521   13.685   14.907   6.6918   17.548   6.7657 -2.640645 9.516029 
1 1 1   15   14   10 o   9.8750   4.6305  -7.2638   9.4019  -1.5377   16.637  -9.9506   11.396   14.494   6.5605   10.539   4.9895 3.954922 8.242279 
1 1 1   15   14   11 f   12.347   5.2931   1.9885   9.5251   4.2565   16.757   0.9059   11.577   15.726   6.8790   13.001   5.7015 2.725576 8.934699 
1 1 1   15   14   12 o   18.352   5.7895   16.292   9.6799   26.785   16.991   11.250   11.778   22.281   7.6974   16.349   6.2836 5.931675 9.936520 
1 1 1   15   14   13 o   16.334   5.7853   12.151   9.6348   3.5254   16.871   16.326   11.737   15.569   6.8533   18.358   6.3945 -2.789351 9.373212 
1 1 1   15   14   14 o   15.368   5.7128   10.059   9.5491   14.249   17.297   8.2231   11.452   18.280   7.4244   15.153   6.0814 3.126601 9.597140 
1 1 1   15   14   15 o   20.659   5.6482   20.872   9.7824   36.035   17.287   13.730   11.865   25.584   7.6785   17.270   6.3775 8.314083 9.981532 
1 1 1   15   14   16 o   34.997   3.6888   53.798   10.365   36.505   18.248   62.035   12.594   25.471   7.9366   37.199   4.2283 -11.72750 8.992653 
1 1 1   15   14   17 o   25.933   6.0965   33.546   12.669   51.114   18.117   16.733   17.723   31.031   7.2874   18.938   7.5772 12.09246 10.51285 
1 1 1   15   14   18 o   18.357   6.4526   16.553   11.968   10.287   16.907   22.847   16.945   17.046   7.1684   20.727   7.6271 -3.680916 10.46704 
1 1 1   15   14   19 f   13.259   5.7682   2.1287   11.645   4.4818   16.291  -0.3295   16.651   15.469   6.7743   14.576   6.5836 0.8936491 9.446453 
1 1 1   15   14   20 o   32.522   3.8956   47.075   10.122   32.207   17.489   54.564   12.413   23.856   7.8067   34.567   4.5128 -10.71097 9.017220 
1 1 1   15   14   21 o   26.778   5.1361   34.080   10.803   45.407   17.737   27.400   13.621   28.769   7.4909   22.737   6.8140 6.032022 10.12644 
1 1 1   15   14   22 o   29.455   4.6835   40.214   10.869   18.410   17.286   54.470   13.978   19.174   7.5433   33.884   5.2286 -14.71007 9.178250 
1 1 1   15   14   23 o   33.463   4.1587   50.565   11.100   39.632   17.463   57.976   14.378   26.493   7.6567   34.956   5.2045 -8.463001 9.258102 
1 1 1   15   14   24 o   41.288   3.4509   74.567   11.508   69.743   18.376   77.680   14.761   37.215   6.2810   41.233   4.4627 -4.018200 7.704971 
1 1 1   15   14   25 o   18.563   6.1076   17.412   10.698   32.216   17.277   8.2061   13.624   23.624   7.7611   15.501   6.4711 8.122969 10.10493 
1 1 1   15   14   26 o   16.094   6.0282   11.858   10.672   7.1501   16.570   15.197   13.952   15.936   6.9071   17.724   6.8319 -1.788011 9.715139 
1 1 1   15   14   27 o   20.495   5.7482   21.214   9.9900   17.926   14.485   24.197   13.796   18.656   7.0154   21.088   6.9357 -2.431339 9.865091 
1 1 1   15   14   28 o   13.733   5.5392   6.6338   9.5531   6.1695   13.471   7.1034   13.549   14.802   6.3189   15.080   6.3834 -0.2779131 8.981952 
1 1 1   15   14   29 o   16.626   5.8365   13.460   9.7893   9.5869   13.933   17.236   13.757   15.850   6.5743   18.312   6.8472 -2.462617 9.492385 
1 1 1   15   14   30 o   24.370   5.2091   28.975   10.034   48.304   14.134   9.3359   14.247   31.096   5.7891   15.810   6.6099 15.28636 8.786630 
1 1 1   15   14   31 o   10.406   4.8077  -4.4158   9.5601  -1.1207   13.444  -7.7864   13.597   12.959   5.8783   11.755   5.5298 1.204284 8.070492 
1 1 1   15   14   32 o   16.152   6.6198   11.022   13.903   0.0000   0.0000   11.022   13.903  ?   ?    16.152   6.6198 0.000000 6.619771 
1 1 1   15   14   33 o   26.059   5.9987   35.076   12.478   54.885   18.186   17.454   17.153   31.299   7.2679   18.324   7.4113 12.97505 10.38025 
1 1 1   15   14   34 o   34.032   4.9004   55.391   13.203   19.680   28.434   65.207   14.908   19.357   8.6852   36.717   5.1199 -17.35975 10.08193 
1 1 1   15   14   35 o   32.484   4.4162   49.297   11.391   37.627   18.235   56.765   14.588   24.497   7.9686   33.796   5.4831 -9.299162 9.672790 
1 1 1   15   14   36 o   10.429   4.8763  -5.7501   10.304   6.1658   16.431 -13.4721   13.227   15.223   6.7297   10.581   5.1062 4.642207 8.447665 
1 1 1   15   14   37 o   18.837   6.1226   19.064   10.766   9.8930   17.183   24.992   13.814   16.134   7.0129   20.790   6.9436 -4.655943 9.868884 
1 1 1   15   14   38 o   19.291   6.1904   20.255   11.028   17.390   17.683   22.079   14.108   17.935   7.4197   19.522   6.9913 -1.586958 10.19467 
1 1 1   15   14   39 o   20.412   6.1476   22.760   11.067 -20.5288   17.483   51.708   14.296   11.393   5.5806   31.711   5.7420 -20.31813 8.007092 
1 1 1   15   14   40 o   40.823   3.6306   75.160   11.956   54.367   18.682   89.581   15.558   29.963   7.6298   43.586   4.4411 -13.62254 8.828179 
1 1 1   15   14   41 o   19.415   6.4896   21.322   12.066   36.038   22.260   15.200   14.358   22.221   8.6123   16.992   6.8128 5.228655 10.98112 
1 1 1   15   14   42 o   13.364   5.7797   4.7787   11.550   53.439   21.876 -14.0308   13.601   27.541   8.7053   10.553   5.1132 16.98804 10.09586 
1 1 1   15   14   43 o   34.912   4.4507   57.959   12.378   67.955   22.794   53.777   14.742   31.808   8.5907   32.046   5.8592 -0.2387199 10.39856 
1 1 1   15   14   44 o   29.912   5.2835   45.141   12.412   17.250   22.392   57.511   14.912   17.789   7.8602   33.332   5.6926 -15.54378 9.705086 
1 1 1   15   14   45 o   13.756   5.8466   6.4309   11.445  -4.1366   20.579   11.163   13.771   14.120   6.6907   15.602   6.5089 -1.481273 9.334472 
1 1 1   15   14   46 o   13.698   5.8417   6.2594   11.493   26.398   22.025  -1.2770   13.473   19.566   8.2020   12.516   5.7553 7.050484 10.01979 
1 1 1   15   14   47 o   28.142   5.5222   40.982   12.215   43.049   22.578   40.126   14.524   23.605   8.7825   26.363   6.7351 -2.757988 11.06767 
1 1 1   15   14   48 o   18.705   8.0258   23.065   21.935   0.0000   0.0000   23.065   21.935  ?   ?    18.705   8.0258 0.000000 8.025786 
1 1 1   15   14   49 o   23.175   8.8191   42.857   23.050   0.0000   0.0000   42.857   23.050  ?   ?    23.175   8.8191 0.000000 8.819055 
1 1 1   15   14   52 o   18.932   7.9543   25.061   20.787   0.0000   0.0000   25.061   20.787  ?   ?    18.932   7.9543 0.000000 7.954336 
1 1 1   15   14   53 o   15.844   7.2341   9.4072   20.783   0.0000   0.0000   9.4072   20.783  ?   ?    15.844   7.2341 0.000000 7.234102 
1 1 1   15   14   54 o   13.279   6.3806  -7.7405   20.141   0.0000   0.0000  -7.7405   20.141  ?   ?    13.279   6.3806 0.000000 6.380637 
1 1 1   15   14   55 o   15.153   7.0239   5.6833   20.655   0.0000   0.0000   5.6833   20.655  ?   ?    15.153   7.0239 0.000000 7.023860 
1 1 1   15   14   56 o   14.872   6.9537   3.7210   20.951   0.0000   0.0000   3.7210   20.951  ?   ?    14.872   6.9537 0.000000 6.953715 
1 1 1   15   14   57 o   24.268   8.7584   48.004   22.189   0.0000   0.0000   48.004   22.189  ?   ?    24.268   8.7584 0.000000 8.758394 
1 1 1   15   14   59 o   13.783   6.7347 -11.3250   24.994   0.0000   0.0000 -11.3250   24.994  ?   ?    13.783   6.7347 0.000000 6.734661 
1 1 1   15   14   60 o   12.681   6.2649 -20.6606   23.625   0.0000   0.0000 -20.6606   23.625  ?   ?    12.681   6.2649 0.000000 6.264896 
1 1 1   15   14   61 o   16.985   7.7918   17.632   24.492   0.0000   0.0000   17.632   24.492  ?   ?    16.985   7.7918 0.000000 7.791835 
1 1 1   15   14   62 o   16.069   7.4891   11.784   23.980   0.0000   0.0000   11.784   23.980  ?   ?    16.069   7.4891 0.000000 7.489120 
1 1 1   15   14   63 o   14.011   6.7870  -5.2780   23.923   0.0000   0.0000  -5.2780   23.923  ?   ?    14.011   6.7870 0.000000 6.786993 
1 1 1   15   14   64 o   15.499   7.3228   8.0248   24.313   0.0000   0.0000   8.0248   24.313  ?   ?    15.499   7.3228 0.000000 7.322794 
1 1 1   15   14   65 o   14.999   7.1108   4.7606   23.298   0.0000   0.0000   4.7606   23.298  ?   ?    14.999   7.1108 0.000000 7.110755 
1 1 1   15   15    0 o   29.833   7.6217   44.747   18.600   0.0000   0.0000   44.747   18.600  ?   ?    29.833   7.6217 0.000000 7.621692 
1 1 1   15   15    1 o   13.403   5.5794   5.5979   10.086   8.6567   16.387   3.7321   12.798   15.919   6.8843   13.769   6.0175 2.150057 9.143525 
1 1 1   15   15    2 o   10.646   4.9167  -4.1724   9.9843   2.2559   16.412  -7.9492   12.580   14.540   6.5546   11.201   5.2846 3.338391 8.419596 
1 1 1   15   15    3 f   12.762   5.4610   3.6073   10.105   0.8827   16.659   5.1934   12.711   14.342   6.5205   14.121   6.0847 0.2212601 8.918531 
1 1 1   15   15    4 o   34.778   4.4095   56.236   12.220   77.760   26.103   50.194   13.829   34.333   9.1583   31.764   5.5426 2.569677 10.70492 
1 1 1   15   15    5 o   10.625   5.0851 -11.1994   12.507 -23.4315   23.322  -6.2616   14.818   13.190   6.4577   12.431   5.8239 0.7592430 8.696009 
1 1 1   15   15    6 o   19.532   6.6480   20.927   12.662   74.784   25.041   2.4285   14.676   33.980   8.9267   14.038   6.2733 19.94227 10.91055 
1 1 1   15   15    7 o   25.683   5.6223   33.398   11.443   26.192   17.283   39.023   15.270   20.848   7.6974   26.352   6.9935 -5.504036 10.39994 
1 1 1   15   15    8 f   21.397   6.1345   24.384   11.252   8.0665   17.178   36.648   14.892   15.884   6.9560   25.505   6.9673 -9.620433 9.845330 
1 1 1   15   15    9 o   11.274   5.2894  -6.6099   12.294   2.3713   17.137 -16.1339   17.647   14.697   6.6547   12.081   5.8464 2.616132 8.858036 
1 1 1   15   15   10 o   20.830   6.5861   24.036   12.520   24.262   17.156   23.778   18.313   20.163   7.6234   19.930   7.7869 0.2324238 10.89732 
1 1 1   15   15   11 o   10.145   4.8906 -12.6728   12.057 -15.2247   16.811  -9.9697   17.302   11.858   5.7307   12.718   6.0573 -0.8601179 8.338581 
1 1 1   15   15   12 o   14.124   5.8482   7.1721   10.998   13.588   16.918   2.4761   14.475   17.060   7.1724   13.909   6.2220 3.150943 9.495049 
1 1 1   15   15   13 o   33.302   4.4691   52.098   11.826   41.980   18.037   59.727   15.662   26.045   7.8491   34.217   5.8238 -8.171629 9.773676 
1 1 1   15   15   14 o   18.850   6.2102   19.149   11.060   26.916   17.070   13.529   14.519   20.906   7.6615   16.726   6.7989 4.180237 10.24317 
1 1 1   15   15   15 o   13.817   5.8052   6.2870   11.072  -5.7127   17.298   14.615   14.411   13.269   6.2405   17.021   6.8249 -3.751974 9.247850 
1 1 1   15   15   16 o   12.280   5.4314   1.4697   10.717   13.099   16.688  -6.6919   13.980   16.800   7.0966   11.911   5.6045 4.889268 9.042798 
1 1 1   15   15   17 o   13.079   5.6602   3.9052   11.092 -12.0307   17.136   15.397   14.552   12.295   5.9023   17.217   6.8736 -4.921892 9.060009 
1 1 1   15   15   18 o   28.082   5.2590   39.330   11.596   34.748   18.280   42.416   15.000   23.081   7.9836   27.536   6.7387 -4.454582 10.44734 
1 1 1   15   15   19 o   21.643   6.1021   25.402   11.227   13.042   17.257   34.472   14.784   16.752   7.1515   24.245   7.0561 -7.492456 10.04652 
1 1 1   15   15   20 o   10.166   4.8085  -7.3755   10.539   2.2651   16.434 -14.1089   13.735   14.253   6.4788   10.641   5.1515 3.612628 8.277245 
1 1 1   15   15   21 o   15.625   6.0574   11.903   11.014   19.868   17.319   6.4946   14.272   18.433   7.4500   14.588   6.3655 3.845064 9.799088 
1 1 1   15   15   22 o   14.501   5.7816   9.2358   10.282   11.850   14.519   6.6058   14.562   16.014   6.6822   14.664   6.4136 1.349878 9.262099 
1 1 1   15   15   23 o   26.010   5.6582   35.166   11.654   48.864   15.174   15.465   18.198   29.888   6.4199   17.272   7.3579 12.61572 9.764869 
1 1 1   15   15   24 o   21.030   6.6191   25.502   12.660   28.994   17.220   21.394   18.675   21.133   7.7029   18.717   7.6718 2.415817 10.87157 
1 1 1   15   15   25 o   11.593   5.3732  -3.4732   12.084 -14.0477   16.319   9.3618   17.979   11.622   5.6238   15.855   7.0226 -4.232832 8.996874 
1 1 1   15   15   26 o   13.629   6.1294   2.7316   14.255  -8.9129   22.422   10.631   18.468   14.000   6.7286   16.153   7.1379 -2.152893 9.809402 
1 1 1   15   15   27 o   22.461   6.5328   28.916   12.676   9.0308   23.202   37.377   15.135   16.454   7.5614   24.963   7.1008 -8.508472 10.37285 
1 1 1   15   15   28 o   21.826   6.5734   27.556   12.653   16.411   23.954   31.869   14.902   17.653   7.9417   22.758   7.1839 -5.105406 10.70888 
1 1 1   15   15   29 o   12.558   5.7584  -0.8242   13.356  -5.0396   21.344   1.8886   17.123   14.143   6.7337   14.166   6.5046 -0.2283382E-01 9.362289 
1 1 1   15   15   30 o   10.728   5.1723 -11.9834   13.499   1.9646   21.797 -20.6614   17.193   15.141   7.0839   11.139   5.4721 4.001880 8.951337 
1 1 1   15   15   31 o   16.468   6.3862   14.480   12.245 -10.9554   22.076   25.784   14.716   13.602   6.5719   20.356   7.1552 -6.754598 9.715298 
1 1 1   15   15   32 o   10.071   4.8616 -11.8175   12.016   5.6392   22.102 -19.1429   14.317   15.672   7.2648   10.166   4.9940 5.505446 8.815729 
1 1 1   15   15   33 o   24.861   6.2145   34.327   12.559   15.078   21.902   43.756   15.329   17.153   7.6647   27.327   6.8857 -10.17350 10.30341 
1 1 1   15   15   34 o   10.328   4.9558 -10.1064   12.055   4.4358   21.084 -17.1688   14.693   15.273   7.0854   10.526   5.1474 4.747407 8.757732 
1 1 1   15   15   35 o   32.811   4.9198   53.428   12.753   46.126   22.473   56.896   15.489   24.248   8.8055   32.423   6.0839 -8.174673 10.70279 
1 1 1   15   15   36 o   21.193   6.5442   26.469   12.438   43.765   22.688   19.036   14.873   23.406   8.7845   17.805   6.9993 5.600882 11.23200 
1 1 1   15   15   37 o   17.496   6.4822   17.684   12.275   31.221   22.175   11.702   14.740   20.239   8.3346   15.635   6.6398 4.604248 10.65612 
1 1 1   15   15   38 f   12.048   5.6838  -5.1585   14.551   0.0000   0.0000  -5.1585   14.551  ?   ?    12.048   5.6838 0.000000 5.683792 
1 1 1   15   15   39 o   20.692   7.1976   27.683   14.868   0.0000   0.0000   27.683   14.868  ?   ?    20.692   7.1976 0.000000 7.197583 
1 1 1   15   15   40 o   18.242   6.9105   20.596   14.114   29.097   23.152   15.569   17.805   19.457   8.2942   16.709   7.2008 2.747869 10.98384 
1 1 1   15   15   41 o   12.908   5.8867   1.3307   13.711   29.945   22.820 -14.8336   17.151   19.648   8.2990   11.586   5.6428 8.062571 10.03564 
1 1 1   15   15   42 o   20.955   7.0614   28.076   14.283   27.404   23.657   28.462   17.918   19.010   8.2462   20.052   7.7388 -1.041725 11.30883 
1 1 1   15   15   43 o   16.748   6.7144   16.272   13.945  -7.0483   22.891   30.034   17.584   13.890   6.7065   20.565   7.7304 -6.675046 10.23410 
1 1 1   15   15   44 o   13.280   5.9625   3.6917   13.425   13.497   22.144  -2.0076   16.882   16.450   7.4939   13.142   6.1758 3.307841 9.710812 
1 1 1   15   15   45 o   13.872   6.1518   5.9431   13.838   21.476   22.573  -3.4091   17.516   17.795   7.8761   13.076   6.1891 4.718547 10.01688 
1 1 1   15   15   46 o   14.333   6.2338   8.1537   13.593  -8.5850   22.473   17.811   17.070   13.562   6.5713   17.041   7.1866 -3.478868 9.738064 
1 1 1   15   15   47 o   15.890   6.5927   13.856   14.015   26.761   23.277   6.5164   17.555   18.628   8.1288   14.626   6.6667 4.001949 10.51298 
1 1 1   15   15   48 o   20.497   7.0256   27.436   14.146   71.290   24.128   4.4669   17.462   29.979   9.0876   14.222   6.5443 15.75679 11.19878 
1 1 1   15   15   49 o   18.169   6.8497   21.082   13.828   6.8216   23.351   28.783   17.160   15.397   7.2442   19.989   7.6088 -4.592643 10.50585 
1 1 1   15   15   50 o   17.332   7.2560   19.564   17.203   0.0000   0.0000   19.564   17.203  ?   ?    17.332   7.2560 0.000000 7.256004 
1 1 1   15   15   51 o   11.278   5.4989 -14.0159   16.410   0.0000   0.0000 -14.0159   16.410  ?   ?    11.278   5.4989 0.000000 5.498855 
1 1 1   15   15   52 o   12.188   5.8404  -6.9365   16.617   0.0000   0.0000  -6.9365   16.617  ?   ?    12.188   5.8404 0.000000 5.840427 
1 1 1   15   15   53 o   15.938   6.9319   14.318   16.807   0.0000   0.0000   14.318   16.807  ?   ?    15.938   6.9319 0.000000 6.931874 
1 1 1   15   15   54 o   17.414   8.0786   22.708   27.409   0.0000   0.0000   22.708   27.409  ?   ?    17.414   8.0786 0.000000 8.078594 
1 1 1   15   15   55 o   19.472   8.5947   36.590   26.703   0.0000   0.0000   36.590   26.703  ?   ?    19.472   8.5947 0.000000 8.594650 
1 1 1   15   15   56 o   15.547   7.4013   8.2923   25.774   0.0000   0.0000   8.2923   25.774  ?   ?    15.547   7.4013 0.000000 7.401330 
1 1 1   15   15   57 o   17.241   8.0152   21.785   27.197   0.0000   0.0000   21.785   27.197  ?   ?    17.241   8.0152 0.000000 8.015213 
1 1 1   16    0 -116 o   10.766   7.2366   0.3928   18.029   0.3928   18.029   0.3928   18.029   10.766   7.2366   10.766   7.2366 0.000000 0.000000 
1 1 1   16    0 -115 o   31.067   8.8215   56.996   19.349   56.996   19.349   56.996   19.349   31.067   8.8215   31.067   8.8215 0.000000 0.000000 
1 1 1   16    0 -114 o   21.618   9.9220   36.697   19.115   36.697   19.115   36.697   19.115   21.618   9.9220   21.618   9.9220 0.000000 0.000000 
1 1 1   16    0 -113 o   12.249   7.8577   8.0728   17.788   8.0728   17.788   8.0728   17.788   12.249   7.8577   12.249   7.8577 0.000000 0.000000 
1 1 1   16    0 -112 o   12.217   7.8561   7.6670   17.918   7.6670   17.918   7.6670   17.918   12.217   7.8561   12.217   7.8561 0.000000 0.000000 
1 1 1   16    0 -111 o   14.129   8.5273   15.205   17.934   15.205   17.934   15.205   17.934   14.129   8.5273   14.129   8.5273 0.000000 0.000000 
1 1 1   16    0 -110 o   12.435   7.9172   8.5153   17.650   8.5153   17.650   8.5153   17.650   12.435   7.9172   12.435   7.9172 0.000000 0.000000 
1 1 1   16    0 -109 o   10.163   7.2778 -27.4422   27.987 -27.4422   27.987 -27.4422   27.987   10.163   7.2778   10.163   7.2778 0.000000 0.000000 
1 1 1   16    0 -108 o   10.559   7.5116 -22.4105   27.981 -22.4105   27.981 -22.4105   27.981   10.559   7.5116   10.559   7.5116 0.000000 0.000000 
1 1 1   16    0 -107 o   13.829   9.1451   8.6024   26.842   8.6024   26.842   8.6024   26.842   13.829   9.1451   13.829   9.1451 0.000000 0.000000 
1 1 1   16    0 -106 o   11.630   7.2934   6.9974   14.353   6.9974   14.353   6.9974   14.353   11.630   7.2934   11.630   7.2934 0.000000 0.000000 
1 1 1   16    0 -105 o   20.176   8.6738   27.894   14.621   27.894   14.621   27.894   14.621   20.176   8.6738   20.176   8.6738 0.000000 0.000000 
1 1 1   16    0 -104 o   25.827   8.0984   38.476   14.962   38.476   14.962   38.476   14.962   25.827   8.0984   25.827   8.0984 0.000000 0.000000 
1 1 1   16    0 -103 o   15.735   8.2914   18.330   14.140   18.330   14.140   18.330   14.140   15.735   8.2914   15.735   8.2914 0.000000 0.000000 
1 1 1   16    0 -102 o   22.430   8.0874   30.459   13.547   30.459   13.547   30.459   13.547   22.430   8.0874   22.430   8.0874 0.000000 0.000000 
1 1 1   16    0 -101 o   12.677   7.4478   10.340   13.008   10.340   13.008   10.340   13.008   12.677   7.4478   12.677   7.4478 0.000000 0.000000 
1 1 1   16    0 -100 o   12.892   7.5212   10.704   13.111   10.704   13.111   10.704   13.111   12.892   7.5212   12.892   7.5212 0.000000 0.000000 
1 1 1   16    0  -99 o   37.087   4.9634   62.011   14.252   62.011   14.252   62.011   14.252   37.087   4.9634   37.087   4.9634 0.000000 0.000000 
1 1 1   16    0  -98 o   29.772   6.6393   43.844   14.076   43.844   14.076   43.844   14.076   29.772   6.6393   29.772   6.6393 0.000000 0.000000 
1 1 1   16    0  -97 o   18.381   8.3351   22.357   13.476   22.357   13.476   22.357   13.476   18.381   8.3351   18.381   8.3351 0.000000 0.000000 
1 1 1   16    0  -96 o   21.373   8.1421   27.419   13.351   27.419   13.351   27.419   13.351   21.373   8.1421   21.373   8.1421 0.000000 0.000000 
1 1 1   16    0  -95 o   18.455   8.9715   23.271   15.829   23.271   15.829   23.271   15.829   18.455   8.9715   18.455   8.9715 0.000000 0.000000 
1 1 1   16    0  -94 o   11.003   7.0948   2.0925   14.742   2.0925   14.742   2.0925   14.742   11.003   7.0948   11.003   7.0948 0.000000 0.000000 
1 1 1   16    0  -93 o   17.870   8.6409   21.270   14.658   21.270   14.658   21.270   14.658   17.870   8.6409   17.870   8.6409 0.000000 0.000000 
1 1 1   16    0  -92 o   15.628   7.9549   16.112   12.712   16.112   12.712   16.112   12.712   15.628   7.9549   15.628   7.9549 0.000000 0.000000 
1 1 1   16    0  -91 f   9.5186   6.2530  -0.8771   12.230  -0.8771   12.230  -0.8771   12.230   9.5186   6.2530   9.5186   6.2530 0.000000 0.000000 
1 1 1   16    0  -90 o   32.959   5.2895   49.020   13.115   49.020   13.115   49.020   13.115   32.959   5.2895   32.959   5.2895 0.000000 0.000000 
1 1 1   16    0  -89 o   36.267   4.7044   57.697   13.263   57.697   13.263   57.697   13.263   36.267   4.7044   36.267   4.7044 0.000000 0.000000 
1 1 1   16    0  -88 o   11.004   6.7876   4.7429   11.923   4.7429   11.923   4.7429   11.923   11.004   6.7876   11.004   6.7876 0.000000 0.000000 
1 1 1   16    0  -87 o   26.712   6.8553   35.491   12.901   35.491   12.901   35.491   12.901   26.712   6.8553   26.712   6.8553 0.000000 0.000000 
1 1 1   16    0  -86 o   11.636   7.1087   5.8140   12.791   5.8140   12.791   5.8140   12.791   11.636   7.1087   11.636   7.1087 0.000000 0.000000 
1 1 1   16    0  -85 o   57.218   3.4232  136.565   15.834  136.565   15.834  136.565   15.834   57.218   3.4232   57.218   3.4232 0.000000 0.000000 
1 1 1   16    0  -84 o   39.755   2.1285   65.270   6.8522   65.270   6.8522   65.270   6.8522   39.755   2.1285   39.755   2.1285 0.000000 0.000000 
1 1 1   16    0  -83 o   23.114   3.8661   23.789   6.6724   23.789   6.6724   23.789   6.6724   23.114   3.8661   23.114   3.8661 0.000000 0.000000 
1 1 1   16    0  -82 o   17.063   6.1484   16.074   7.8324   16.074   7.8324   16.074   7.8324   17.063   6.1484   17.063   6.1484 0.000000 0.000000 
1 1 1   16    0  -81 o   11.579   6.2684   8.0787   8.2758   8.0787   8.2758   8.0787   8.2758   11.579   6.2684   11.579   6.2684 0.000000 0.000000 
1 1 1   16    0  -80 o   6.2472   4.3159  -5.6723   7.4224  -5.6723   7.4224  -5.6723   7.4224   6.2472   4.3159   6.2472   4.3159 0.000000 0.000000 
1 1 1   16    0  -79 o   49.086   4.3470  101.854   17.065  101.854   17.065  101.854   17.065   49.086   4.3470   49.086   4.3470 0.000000 0.000000 
1 1 1   16    0  -78 o   47.123   4.4184   94.070   16.609   94.070   16.609   94.070   16.609   47.123   4.4184   47.123   4.4184 0.000000 0.000000 
1 1 1   16    0  -77 o   25.846   5.7164   31.345   10.531   31.345   10.531   31.345   10.531   25.846   5.7164   25.846   5.7164 0.000000 0.000000 
1 1 1   16    0  -76 o   35.648   3.4940   53.641   9.9133   53.641   9.9133   53.641   9.9133   35.648   3.4940   35.648   3.4940 0.000000 0.000000 
1 1 1   16    0  -75 o   8.9071   5.6351   1.4293   8.7772   1.4293   8.7772   1.4293   8.7772   8.9071   5.6351   8.9071   5.6351 0.000000 0.000000 
1 1 1   16    0  -74 f   23.795   5.8783   27.207   9.8696   27.207   9.8696   27.207   9.8696   23.795   5.8783   23.795   5.8783 0.000000 0.000000 
1 1 1   16    0  -73 o   40.711   3.2818   69.205   10.723   69.205   10.723   69.205   10.723   40.711   3.2818   40.711   3.2818 0.000000 0.000000 
1 1 1   16    0  -72 o   80.976   2.3119  268.550   15.232  268.550   15.232  268.550   15.232   80.976   2.3119   80.976   2.3119 0.000000 0.000000 
1 1 1   16    0  -71 o   47.595   3.0046   93.771   11.549   93.771   11.549   93.771   11.549   47.595   3.0046   47.595   3.0046 0.000000 0.000000 
1 1 1   16    0  -70 o   8.8808   5.7201   0.1585   9.5499   0.1585   9.5499   0.1585   9.5499   8.8808   5.7201   8.8808   5.7201 0.000000 0.000000 
1 1 1   16    0  -69 o   29.547   4.8154   38.557   10.674   38.557   10.674   38.557   10.674   29.547   4.8154   29.547   4.8154 0.000000 0.000000 
1 1 1   16    0  -68 o   70.863   2.8280  206.204   16.276  206.204   16.276  206.204   16.276   70.863   2.8280   70.863   2.8280 0.000000 0.000000 
1 1 1   16    0  -67 o   35.878   4.1741   54.836   11.777   54.836   11.777   54.836   11.777   35.878   4.1741   35.878   4.1741 0.000000 0.000000 
1 1 1   16    0  -66 o   54.975   2.9980  124.605   13.343  124.605   13.343  124.605   13.343   54.975   2.9980   54.975   2.9980 0.000000 0.000000 
1 1 1   16    0  -65 f   47.355   3.2272   92.930   12.322   92.930   12.322   92.930   12.322   47.355   3.2272   47.355   3.2272 0.000000 0.000000 
1 1 1   16    0  -64 o   66.576   2.5676  181.771   13.887  181.771   13.887  181.771   13.887   66.576   2.5676   66.576   2.5676 0.000000 0.000000 
1 1 1   16    0  -63 o   32.568   4.6516   46.008   11.621   46.008   11.621   46.008   11.621   32.568   4.6516   32.568   4.6516 0.000000 0.000000 
1 1 1   16    0  -62 o  110.360   2.1670  497.529   19.477  497.529   19.477  497.529   19.477  110.360   2.1670  110.360   2.1670 0.000000 0.000000 
1 1 1   16    0  -61 o   46.750   3.5831   90.889   13.465   90.889   13.465   90.889   13.465   46.750   3.5831   46.750   3.5831 0.000000 0.000000 
1 1 1   16    0  -60 o   16.986   7.7285   17.257   11.589   17.257   11.589   17.257   11.589   16.986   7.7285   16.986   7.7285 0.000000 0.000000 
1 1 1   16    0  -59 o   87.574   2.6001  313.835   18.524  313.835   18.524  313.835   18.524   87.574   2.6001   87.574   2.6001 0.000000 0.000000 
1 1 1   16    0  -58 o   55.680   3.3724  128.020   15.177  128.020   15.177  128.020   15.177   55.680   3.3724   55.680   3.3724 0.000000 0.000000 
1 1 1   16    0  -57 o  119.654   2.5041  584.984   24.400  584.984   24.400  584.984   24.400  119.654   2.5041  119.654   2.5041 0.000000 0.000000 
1 1 1   16    0  -56 o   92.131   2.6735  347.282   20.040  347.282   20.040  347.282   20.040   92.131   2.6735   92.131   2.6735 0.000000 0.000000 
1 1 1   16    0  -55 o  208.669   2.7662  1778.00   47.034  1778.00   47.034  1778.00   47.034  208.669   2.7662  208.669   2.7662 0.000000 0.000000 
1 1 1   16    0  -54 o   37.380   4.7567   59.853   13.854   59.853   13.854   59.853   13.854   37.380   4.7567   37.380   4.7567 0.000000 0.000000 
1 1 1   16    0  -53 o  110.888   2.5492  502.470   23.015  502.470   23.015  502.470   23.015  110.888   2.5492  110.888   2.5492 0.000000 0.000000 
1 1 1   16    0  -52 o   39.577   4.4093   66.360   13.773   66.360   13.773   66.360   13.773   39.577   4.4093   39.577   4.4093 0.000000 0.000000 
1 1 1   16    0  -51 o   83.668   2.4072  286.264   16.387  286.264   16.387  286.264   16.387   83.668   2.4072   83.668   2.4072 0.000000 0.000000 
1 1 1   16    0  -50 o  129.193   2.6811  681.846   28.208  681.846   28.208  681.846   28.208  129.193   2.6811  129.193   2.6811 0.000000 0.000000 
1 1 1   16    0  -49 o   60.286   3.7820  150.154   18.416  150.154   18.416  150.154   18.416   60.286   3.7820   60.286   3.7820 0.000000 0.000000 
1 1 1   16    0  -48 o  156.481   2.6736  999.809   34.080  999.809   34.080  999.809   34.080  156.481   2.6736  156.481   2.6736 0.000000 0.000000 
1 1 1   16    0  -47 f   35.876   4.4340   54.933   12.435   54.933   12.435   54.933   12.435   35.876   4.4340   35.876   4.4340 0.000000 0.000000 
1 1 1   16    0  -46 o   86.853   2.3652  308.344   16.717  308.344   16.717  308.344   16.717   86.853   2.3652   86.853   2.3652 0.000000 0.000000 
1 1 1   16    0  -45 o   8.1626   5.5997  -8.2003   11.987  -8.2003   11.987  -8.2003   11.987   8.1626   5.5997   8.1626   5.5997 0.000000 0.000000 
1 1 1   16    0  -44 o  197.859   2.3655  1597.24   38.140  1597.24   38.140  1597.24   38.140  197.859   2.3655  197.859   2.3655 0.000000 0.000000 
1 1 1   16    0  -43 o  190.198   2.0678  1475.60   32.050  1475.60   32.050  1475.60   32.050  190.198   2.0678  190.198   2.0678 0.000000 0.000000 
1 1 1   16    0  -42 o   50.391   3.3341  104.963   13.556  104.963   13.556  104.963   13.556   50.391   3.3341   50.391   3.3341 0.000000 0.000000 
1 1 1   16    0  -41 o   22.384   7.5088   26.381   12.226   26.381   12.226   26.381   12.226   22.384   7.5088   22.384   7.5088 0.000000 0.000000 
1 1 1   16    0  -40 o   60.914   2.9725  152.439   14.679  152.439   14.679  152.439   14.679   60.914   2.9725   60.914   2.9725 0.000000 0.000000 
1 1 1   16    0  -39 o   38.029   4.4683   61.452   13.351   61.452   13.351   61.452   13.351   38.029   4.4683   38.029   4.4683 0.000000 0.000000 
1 1 1   16    0  -38 o   89.421   2.3252  326.733   16.923  326.733   16.923  326.733   16.923   89.421   2.3252   89.421   2.3252 0.000000 0.000000 
1 1 1   16    0  -37 o  239.836   2.2880  2346.21   44.722  2346.21   44.722  2346.21   44.722  239.836   2.2880  239.836   2.2880 0.000000 0.000000 
1 1 1   16    0  -36 o   24.327   7.5735   30.292   13.161   30.292   13.161   30.292   13.161   24.327   7.5735   24.327   7.5735 0.000000 0.000000 
1 1 1   16    0  -35 o   64.783   2.4593  171.881   12.944  171.881   12.944  171.881   12.944   64.783   2.4593   64.783   2.4593 0.000000 0.000000 
1 1 1   16    0  -34 o  196.539   2.0719  1575.48   33.186  1575.48   33.186  1575.48   33.186  196.539   2.0719  196.539   2.0719 0.000000 0.000000 
1 1 1   16    0  -33 o   81.866   2.0990  273.797   13.986  273.797   13.986  273.797   13.986   81.866   2.0990   81.866   2.0990 0.000000 0.000000 
1 1 1   16    0  -32 o  115.467   1.8897  544.002   17.776  544.002   17.776  544.002   17.776  115.467   1.8897  115.467   1.8897 0.000000 0.000000 
1 1 1   16    0  -31 o   57.973   2.4517  137.782   11.539  137.782   11.539  137.782   11.539   57.973   2.4517   57.973   2.4517 0.000000 0.000000 
1 1 1   16    0  -30 o  247.673   2.5830  2502.31   52.136  2502.31   52.136  2502.31   52.136  247.673   2.5830  247.673   2.5830 0.000000 0.000000 
1 1 1   16    0  -29 o  128.700   2.1467  675.906   22.507  675.906   22.507  675.906   22.507  128.700   2.1467  128.700   2.1467 0.000000 0.000000 
1 1 1   16    0  -28 o   95.061   2.4584  369.219   19.021  369.219   19.021  369.219   19.021   95.061   2.4584   95.061   2.4584 0.000000 0.000000 
1 1 1   16    0  -27 o   49.298   3.4893  100.627   13.858  100.627   13.858  100.627   13.858   49.298   3.4893   49.298   3.4893 0.000000 0.000000 
1 1 1   16    0  -26 o   60.707   2.6154  151.118   12.888  151.118   12.888  151.118   12.888   60.707   2.6154   60.707   2.6154 0.000000 0.000000 
1 1 1   16    0  -25 o  438.586   3.8549  7850.69  137.792  7850.69  137.792  7850.69  137.792  438.586   3.8549  438.586   3.8549 0.000000 0.000000 
1 1 1   16    0  -24 o  341.703   3.1464  4763.63   87.624  4763.63   87.624  4763.63   87.624  341.703   3.1464  341.703   3.1464 0.000000 0.000000 
1 1 1   16    0  -23 o   36.399   3.6868   55.693   10.661   55.693   10.661   55.693   10.661   36.399   3.6868   36.399   3.6868 0.000000 0.000000 
1 1 1   16    0  -22 o   27.801   4.9400   34.375   10.141   34.375   10.141   34.375   10.141   27.801   4.9400   27.801   4.9400 0.000000 0.000000 
1 1 1   16    0  -21 o   13.759   6.9553   11.365   9.6803   11.365   9.6803   11.365   9.6803   13.759   6.9553   13.759   6.9553 0.000000 0.000000 
1 1 1   16    0  -20 o   8.2341   5.4388  -2.1731   9.4497  -2.1731   9.4497  -2.1731   9.4497   8.2341   5.4388   8.2341   5.4388 0.000000 0.000000 
1 1 1   16    0  -19 o  245.293   2.8736  2454.77   57.441  2454.77   57.441  2454.77   57.441  245.293   2.8736  245.293   2.8736 0.000000 0.000000 
1 1 1   16    0  -18 o   12.591   7.0434   8.7281   10.830   8.7281   10.830   8.7281   10.830   12.591   7.0434   12.591   7.0434 0.000000 0.000000 
1 1 1   16    0  -17 o  103.593   2.3158  438.205   19.533  438.205   19.533  438.205   19.533  103.593   2.3158  103.593   2.3158 0.000000 0.000000 
1 1 1   16    0  -16 o  215.861   3.2374  1901.79   56.935  1901.79   56.935  1901.79   56.935  215.861   3.2374  215.861   3.2374 0.000000 0.000000 
1 1 1   16    0  -15 o  247.195   3.5030  2494.11   70.554  2494.11   70.554  2494.11   70.554  247.195   3.5030  247.195   3.5030 0.000000 0.000000 
1 1 1   16    0  -14 o  253.412   3.5594  2621.17   73.493  2621.17   73.493  2621.17   73.493  253.412   3.5594  253.412   3.5594 0.000000 0.000000 
1 1 1   16    0  -13 o   38.139   4.6690   61.982   13.934   61.982   13.934   61.982   13.934   38.139   4.6690   38.139   4.6690 0.000000 0.000000 
1 1 1   16    0  -12 o   85.632   2.4289  299.707   16.923  299.707   16.923  299.707   16.923   85.632   2.4289   85.632   2.4289 0.000000 0.000000 
1 1 1   16    0  -11 o  227.500   2.7603  2111.46   51.172  2111.46   51.172  2111.46   51.172  227.500   2.7603  227.500   2.7603 0.000000 0.000000 
1 1 1   16    0  -10 o  127.278   2.3272  661.158   24.127  661.158   24.127  661.158   24.127  127.278   2.3272  127.278   2.3272 0.000000 0.000000 
1 1 1   16    0   -9 o  368.052   3.8427  5528.38  115.260  5528.38  115.260  5528.38  115.260  368.052   3.8427  368.052   3.8427 0.000000 0.000000 
1 1 1   16    0   -8 o   23.358   7.0751   27.623   11.751   27.623   11.751   27.623   11.751   23.358   7.0751   23.358   7.0751 0.000000 0.000000 
1 1 1   16    0   -7 f  261.296   2.9972  2785.50   63.819  2785.50   63.819  2785.50   63.819  261.296   2.9972  261.296   2.9972 0.000000 0.000000 
1 1 1   16    0   -6 o  146.781   2.3438  879.094   28.027  879.094   28.027  879.094   28.027  146.781   2.3438  146.781   2.3438 0.000000 0.000000 
1 1 1   16    0   -5 o   28.397   8.4695   40.647   17.065   40.647   17.065   40.647   17.065   28.397   8.4695   28.397   8.4695 0.000000 0.000000 
1 1 1   16    0   -4 o   12.586   7.4534   7.1528   13.211   7.1528   13.211   7.1528   13.211   12.586   7.4534   12.586   7.4534 0.000000 0.000000 
1 1 1   16    0   -3 o  135.016   2.8107  744.330   30.904  744.330   30.904  744.330   30.904  135.016   2.8107  135.016   2.8107 0.000000 0.000000 
1 1 1   16    0   -2 o   34.218   5.4763   51.321   14.104   51.321   14.104   51.321   14.104   34.218   5.4763   34.218   5.4763 0.000000 0.000000 
1 1 1   16    0   -1 o  140.334   2.8376  804.074   32.430  804.074   32.430  804.074   32.430  140.334   2.8376  140.334   2.8376 0.000000 0.000000 
1 1 1   16    0    0 o   51.801   3.1645  110.658   13.247  110.658   13.247  110.658   13.247   51.801   3.1645   51.801   3.1645 0.000000 0.000000 
1 1 1   16    0    1 o  132.566   2.3080  717.163   24.923  717.163   24.923  717.163   24.923  132.566   2.3080  132.566   2.3080 0.000000 0.000000 
1 1 1   16    0    2 o  125.600   2.3182  643.848   23.717  643.848   23.717  643.848   23.717  125.600   2.3182  125.600   2.3182 0.000000 0.000000 
1 1 1   16    0    3 o  178.820   2.4846  1304.58   36.201  1304.58   36.201  1304.58   36.201  178.820   2.4846  178.820   2.4846 0.000000 0.000000 
1 1 1   16    0    4 o  195.734   2.5739  1562.98   41.050  1562.98   41.050  1562.98   41.050  195.734   2.5739  195.734   2.5739 0.000000 0.000000 
1 1 1   16    0    5 o   76.048   2.5527  236.608   15.784  236.608   15.784  236.608   15.784   76.048   2.5527   76.048   2.5527 0.000000 0.000000 
1 1 1   16    0    6 o  122.015   2.3166  607.649   23.022  607.649   23.022  607.649   23.022  122.015   2.3166  122.015   2.3166 0.000000 0.000000 
1 1 1   16    0    7 f   48.784   3.3562   98.439   13.199   98.439   13.199   98.439   13.199   48.784   3.3562   48.784   3.3562 0.000000 0.000000 
1 1 1   16    0    8 o  175.208   2.4782  1252.42   35.378  1252.42   35.378  1252.42   35.378  175.208   2.4782  175.208   2.4782 0.000000 0.000000 
1 1 1   16    0    9 o   38.161   4.2318   61.579   12.751   61.579   12.751   61.579   12.751   38.161   4.2318   38.161   4.2318 0.000000 0.000000 
1 1 1   16    0   10 o  245.067   2.8948  2450.21   57.811  2450.21   57.811  2450.21   57.811  245.067   2.8948  245.067   2.8948 0.000000 0.000000 
1 1 1   16    0   11 o  256.786   2.9792  2690.21   62.340  2690.21   62.340  2690.21   62.340  256.786   2.9792  256.786   2.9792 0.000000 0.000000 
1 1 1   16    0   12 o  275.310   3.8394  3094.12   86.126  3094.12   86.126  3094.12   86.126  275.310   3.8394  275.310   3.8394 0.000000 0.000000 
1 1 1   16    0   13 o   55.007   3.1215  124.589   13.892  124.589   13.892  124.589   13.892   55.007   3.1215   55.007   3.1215 0.000000 0.000000 
1 1 1   16    0   14 o  212.219   2.6850  1837.38   46.431  1837.38   46.431  1837.38   46.431  212.219   2.6850  212.219   2.6850 0.000000 0.000000 
1 1 1   16    0   15 o  140.385   2.3679  804.241   27.080  804.241   27.080  804.241   27.080  140.385   2.3679  140.385   2.3679 0.000000 0.000000 
1 1 1   16    0   16 o   28.819   5.7951   37.737   12.069   37.737   12.069   37.737   12.069   28.819   5.7951   28.819   5.7951 0.000000 0.000000 
1 1 1   16    0   17 o   71.649   3.4314  210.839   19.935  210.839   19.935  210.839   19.935   71.649   3.4314   71.649   3.4314 0.000000 0.000000 
1 1 1   16    0   18 o   98.820   4.3942  400.908   35.237  400.908   35.237  400.908   35.237   98.820   4.3942   98.820   4.3942 0.000000 0.000000 
1 1 1   16    0   19 o   91.867   3.1225  345.405   23.322  345.405   23.322  345.405   23.322   91.867   3.1225   91.867   3.1225 0.000000 0.000000 
1 1 1   16    0   20 o  180.578   3.1384  1331.18   46.164  1331.18   46.164  1331.18   46.164  180.578   3.1384  180.578   3.1384 0.000000 0.000000 
1 1 1   16    0   21 o  193.351   2.5889  1525.27   40.787  1525.27   40.787  1525.27   40.787  193.351   2.5889  193.351   2.5889 0.000000 0.000000 
1 1 1   16    0   22 o   12.888   7.2798   8.9620   11.713   8.9620   11.713   8.9620   11.713   12.888   7.2798   12.888   7.2798 0.000000 0.000000 
1 1 1   16    0   23 o  163.466   2.4550  1090.31   32.696  1090.31   32.696  1090.31   32.696  163.466   2.4550  163.466   2.4550 0.000000 0.000000 
1 1 1   16    0   24 o  133.028   2.3878  722.267   25.874  722.267   25.874  722.267   25.874  133.028   2.3878  133.028   2.3878 0.000000 0.000000 
1 1 1   16    0   25 o  251.108   2.9560  2572.75   60.487  2572.75   60.487  2572.75   60.487  251.108   2.9560  251.108   2.9560 0.000000 0.000000 
1 1 1   16    0   26 o  134.539   2.3800  738.755   26.083  738.755   26.083  738.755   26.083  134.539   2.3800  134.539   2.3800 0.000000 0.000000 
1 1 1   16    0   27 o   27.085   6.5245   34.691   12.489   34.691   12.489   34.691   12.489   27.085   6.5245   27.085   6.5245 0.000000 0.000000 
1 1 1   16    0   28 o  204.998   2.6711  1714.64   44.618  1714.64   44.618  1714.64   44.618  204.998   2.6711  204.998   2.6711 0.000000 0.000000 
1 1 1   16    0   29 o  176.851   2.5191  1276.16   36.299  1276.16   36.299  1276.16   36.299  176.851   2.5191  176.851   2.5191 0.000000 0.000000 
1 1 1   16    0   30 o   80.002   2.6545  261.870   17.268  261.870   17.268  261.870   17.268   80.002   2.6545   80.002   2.6545 0.000000 0.000000 
1 1 1   16    0   31 o  132.588   2.4218  717.564   26.154  717.564   26.154  717.564   26.154  132.588   2.4218  132.588   2.4218 0.000000 0.000000 
1 1 1   16    0   32 o   74.551   2.7767  227.612   16.821  227.612   16.821  227.612   16.821   74.551   2.7767   74.551   2.7767 0.000000 0.000000 
1 1 1   16    0   33 o  271.810   3.1270  3014.91   69.263  3014.91   69.263  3014.91   69.263  271.810   3.1270  271.810   3.1270 0.000000 0.000000 
1 1 1   16    0   34 o   72.104   2.9209  213.100   17.104  213.100   17.104  213.100   17.104   72.104   2.9209   72.104   2.9209 0.000000 0.000000 
1 1 1   16    0   35 o   71.590   2.9123  210.082   16.931  210.082   16.931  210.082   16.931   71.590   2.9123   71.590   2.9123 0.000000 0.000000 
1 1 1   16    0   36 o   39.872   4.5959   67.456   14.423   67.456   14.423   67.456   14.423   39.872   4.5959   39.872   4.5959 0.000000 0.000000 
1 1 1   16    0   37 o   30.529   6.3788   42.708   13.990   42.708   13.990   42.708   13.990   30.529   6.3788   30.529   6.3788 0.000000 0.000000 
1 1 1   16    0   38 o   31.673   6.6481   46.025   15.116   46.025   15.116   46.025   15.116   31.673   6.6481   31.673   6.6481 0.000000 0.000000 
1 1 1   16    0   39 o  160.169   3.1585  1047.83   41.202  1047.83   41.202  1047.83   41.202  160.169   3.1585  160.169   3.1585 0.000000 0.000000 
1 1 1   16    0   40 o   73.714   3.8326  223.574   22.886  223.574   22.886  223.574   22.886   73.714   3.8326   73.714   3.8326 0.000000 0.000000 
1 1 1   16    0   41 o   9.4693   6.5580 -14.4770   17.404 -14.4770   17.404 -14.4770   17.404   9.4693   6.5580   9.4693   6.5580 0.000000 0.000000 
1 1 1   16    0   42 o   10.792   6.9574  -0.0663   14.168  -0.0663   14.168  -0.0663   14.168   10.792   6.9574   10.792   6.9574 0.000000 0.000000 
1 1 1   16    0   43 o   51.734   3.8887  111.092   16.181  111.092   16.181  111.092   16.181   51.734   3.8887   51.734   3.8887 0.000000 0.000000 
1 1 1   16    0   44 o   25.538   9.1918   35.414   17.517   35.414   17.517   35.414   17.517   25.538   9.1918   25.538   9.1918 0.000000 0.000000 
1 1 1   16    0   45 o  136.647   3.0299  762.964   33.711  762.964   33.711  762.964   33.711  136.647   3.0299  136.647   3.0299 0.000000 0.000000 
1 1 1   16    0   46 o  194.857   3.2549  1550.79   51.668  1550.79   51.668  1550.79   51.668  194.857   3.2549  194.857   3.2549 0.000000 0.000000 
1 1 1   16    0   47 f   75.412   3.4323  233.562   20.999  233.562   20.999  233.562   20.999   75.412   3.4323   75.412   3.4323 0.000000 0.000000 
1 1 1   16    0   48 o   13.531   8.1203   7.6864   16.079   7.6864   16.079   7.6864   16.079   13.531   8.1203   13.531   8.1203 0.000000 0.000000 
1 1 1   16    0   49 o  138.252   3.0045  781.089   33.824  781.089   33.824  781.089   33.824  138.252   3.0045  138.252   3.0045 0.000000 0.000000 
1 1 1   16    0   50 o   70.986   2.9673  206.703   17.102  206.703   17.102  206.703   17.102   70.986   2.9673   70.986   2.9673 0.000000 0.000000 
1 1 1   16    0   51 o   17.424   8.2489   18.299   13.280   18.299   13.280   18.299   13.280   17.424   8.2489   17.424   8.2489 0.000000 0.000000 
1 1 1   16    0   52 o   42.170   4.2896   74.897   14.367   74.897   14.367   74.897   14.367   42.170   4.2896   42.170   4.2896 0.000000 0.000000 
1 1 1   16    0   53 o   39.431   4.5856   66.095   14.220   66.095   14.220   66.095   14.220   39.431   4.5856   39.431   4.5856 0.000000 0.000000 
1 1 1   16    0   54 o   66.453   3.0718  181.414   16.558  181.414   16.558  181.414   16.558   66.453   3.0718   66.453   3.0718 0.000000 0.000000 
1 1 1   16    0   55 o   13.121   7.8407   7.4966   14.868   7.4966   14.868   7.4966   14.868   13.121   7.8407   13.121   7.8407 0.000000 0.000000 
1 1 1   16    0   56 o   52.625   3.5392  114.653   15.022  114.653   15.022  114.653   15.022   52.625   3.5392   52.625   3.5392 0.000000 0.000000 
1 1 1   16    0   57 o   77.801   3.6639  248.965   23.118  248.965   23.118  248.965   23.118   77.801   3.6639   77.801   3.6639 0.000000 0.000000 
1 1 1   16    0   58 o  167.732   3.1665  1150.15   43.259  1150.15   43.259  1150.15   43.259  167.732   3.1665  167.732   3.1665 0.000000 0.000000 
1 1 1   16    0   59 o   56.389   4.6009  132.714   20.814  132.714   20.814  132.714   20.814   56.389   4.6009   56.389   4.6009 0.000000 0.000000 
1 1 1   16    0   60 o   29.556   6.4364   40.511   13.587   40.511   13.587   40.511   13.587   29.556   6.4364   29.556   6.4364 0.000000 0.000000 
1 1 1   16    0   61 o   85.485   2.6958  299.220   18.743  299.220   18.743  299.220   18.743   85.485   2.6958   85.485   2.6958 0.000000 0.000000 
1 1 1   16    0   62 o  134.573   2.4732  739.936   27.109  739.936   27.109  739.936   27.109  134.573   2.4732  134.573   2.4732 0.000000 0.000000 
1 1 1   16    0   63 o   26.492   7.2755   34.631   13.583   34.631   13.583   34.631   13.583   26.492   7.2755   26.492   7.2755 0.000000 0.000000 
1 1 1   16    0   64 o   88.858   2.6513  323.273   19.165  323.273   19.165  323.273   19.165   88.858   2.6513   88.858   2.6513 0.000000 0.000000 
1 1 1   16    0   65 f   55.213   3.5228  126.188   15.705  126.188   15.705  126.188   15.705   55.213   3.5228   55.213   3.5228 0.000000 0.000000 
1 1 1   16    0   66 o   42.522   4.5481   76.625   15.310   76.625   15.310   76.625   15.310   42.522   4.5481   42.522   4.5481 0.000000 0.000000 
1 1 1   16    0   67 o   39.564   4.7983   67.001   14.869   67.001   14.869   67.001   14.869   39.564   4.7983   39.564   4.7983 0.000000 0.000000 
1 1 1   16    0   68 o   53.451   3.5371  118.463   15.254  118.463   15.254  118.463   15.254   53.451   3.5371   53.451   3.5371 0.000000 0.000000 
1 1 1   16    0   69 o   33.685   5.2788   49.934   13.433   49.934   13.433   49.934   13.433   33.685   5.2788   33.685   5.2788 0.000000 0.000000 
1 1 1   16    0   70 o   14.448   7.6074   12.633   11.896   12.633   11.896   12.633   11.896   14.448   7.6074   14.448   7.6074 0.000000 0.000000 
1 1 1   16    0   71 o   36.035   4.6375   55.934   13.003   55.934   13.003   55.934   13.003   36.035   4.6375   36.035   4.6375 0.000000 0.000000 
1 1 1   16    0   72 o   98.270   2.4879  395.456   19.900  395.456   19.900  395.456   19.900   98.270   2.4879   98.270   2.4879 0.000000 0.000000 
1 1 1   16    0   73 o   78.688   2.6287  254.061   16.818  254.061   16.818  254.061   16.818   78.688   2.6287   78.688   2.6287 0.000000 0.000000 
1 1 1   16    0   74 f   51.900   4.3014  113.071   17.900  113.071   17.900  113.071   17.900   51.900   4.3014   51.900   4.3014 0.000000 0.000000 
1 1 1   16    0   75 o   55.205   3.6224  126.721   16.138  126.721   16.138  126.721   16.138   55.205   3.6224   55.205   3.6224 0.000000 0.000000 
1 1 1   16    0   76 o   72.320   2.8210  215.176   16.572  215.176   16.572  215.176   16.572   72.320   2.8210   72.320   2.8210 0.000000 0.000000 
1 1 1   16    0   77 o   6.7449   4.8047 -16.1950   11.589 -16.1950   11.589 -16.1950   11.589   6.7449   4.8047   6.7449   4.8047 0.000000 0.000000 
1 1 1   16    0   78 o   9.7106   6.1470   1.8144   10.462   1.8144   10.462   1.8144   10.462   9.7106   6.1470   9.7106   6.1470 0.000000 0.000000 
1 1 1   16    0   79 o   83.423   2.0291  285.037   13.780  285.037   13.780  285.037   13.780   83.423   2.0291   83.423   2.0291 0.000000 0.000000 
1 1 1   16    0   80 o   58.190   2.7103  139.725   12.792  139.725   12.792  139.725   12.792   58.190   2.7103   58.190   2.7103 0.000000 0.000000 
1 1 1   16    0   81 o   27.408   4.4039   33.336   9.0782   33.336   9.0782   33.336   9.0782   27.408   4.4039   27.408   4.4039 0.000000 0.000000 
1 1 1   16    0   82 o   14.605   7.3000   13.423   10.602   13.423   10.602   13.423   10.602   14.605   7.3000   14.605   7.3000 0.000000 0.000000 
1 1 1   16    0   83 o   23.139   6.4720   27.022   10.563   27.022   10.563   27.022   10.563   23.139   6.4720   23.139   6.4720 0.000000 0.000000 
1 1 1   16    0   84 o   64.500   2.5288  171.466   13.249  171.466   13.249  171.466   13.249   64.500   2.5288   64.500   2.5288 0.000000 0.000000 
1 1 1   16    0   85 o   33.446   4.1799   48.495   10.915   48.495   10.915   48.495   10.915   33.446   4.1799   33.446   4.1799 0.000000 0.000000 
1 1 1   16    0   86 o   60.201   2.6087  149.707   12.747  149.707   12.747  149.707   12.747   60.201   2.6087   60.201   2.6087 0.000000 0.000000 
1 1 1   16    0   87 o   53.740   2.3920  119.225   10.431  119.225   10.431  119.225   10.431   53.740   2.3920   53.740   2.3920 0.000000 0.000000 
1 1 1   16    0   88 o   23.763   5.0443   26.472   8.5911   26.472   8.5911   26.472   8.5911   23.763   5.0443   23.763   5.0443 0.000000 0.000000 
1 1 1   16    0   89 o   69.464   2.0713  198.314   11.705  198.314   11.705  198.314   11.705   69.464   2.0713   69.464   2.0713 0.000000 0.000000 
1 1 1   16    0   90 o   34.936   3.8164   52.446   10.539   52.446   10.539   52.446   10.539   34.936   3.8164   34.936   3.8164 0.000000 0.000000 
1 1 1   16    0   91 f   63.413   2.7301  166.566   14.053  166.566   14.053  166.566   14.053   63.413   2.7301   63.413   2.7301 0.000000 0.000000 
1 1 1   16    0   92 o   54.093   2.6662  121.415   11.691  121.415   11.691  121.415   11.691   54.093   2.6662   54.093   2.6662 0.000000 0.000000 
1 1 1   16    0   93 o   57.595   2.2564  136.928   10.557  136.928   10.557  136.928   10.557   57.595   2.2564   57.595   2.2564 0.000000 0.000000 
1 1 1   16    0   94 o   14.121   6.5577   12.613   8.3621   12.613   8.3621   12.613   8.3621   14.121   6.5577   14.121   6.5577 0.000000 0.000000 
1 1 1   16    0   95 o   5.5390   3.9519 -11.1234   7.9576 -11.1234   7.9576 -11.1234   7.9576   5.5390   3.9519   5.5390   3.9519 0.000000 0.000000 
1 1 1   16    0   96 o   10.347   5.9595   6.2175   8.0675   6.2175   8.0675   6.2175   8.0675   10.347   5.9595   10.347   5.9595 0.000000 0.000000 
1 1 1   16    0   97 o   41.330   2.7585   71.654   9.1969   71.654   9.1969   71.654   9.1969   41.330   2.7585   41.330   2.7585 0.000000 0.000000 
1 1 1   16    0   98 o   52.295   2.3262  113.485   9.8711  113.485   9.8711  113.485   9.8711   52.295   2.3262   52.295   2.3262 0.000000 0.000000 
1 1 1   16    0   99 o   6.9377   4.6625  -2.3254   7.4799  -2.3254   7.4799  -2.3254   7.4799   6.9377   4.6625   6.9377   4.6625 0.000000 0.000000 
1 1 1   16    0  100 o   20.250   5.3593   20.762   7.6430   20.762   7.6430   20.762   7.6430   20.250   5.3593   20.250   5.3593 0.000000 0.000000 
1 1 1   16    0  101 o   9.8370   5.9333   5.0514   8.6719   5.0514   8.6719   5.0514   8.6719   9.8370   5.9333   9.8370   5.9333 0.000000 0.000000 
1 1 1   16    0  102 o   12.180   7.3809   8.8478   13.549   8.8478   13.549   8.8478   13.549   12.180   7.3809   12.180   7.3809 0.000000 0.000000 
1 1 1   16    0  103 o   22.231   7.9835   29.943   13.232   29.943   13.232   29.943   13.232   22.231   7.9835   22.231   7.9835 0.000000 0.000000 
1 1 1   16    0  104 o   30.313   7.5541   48.817   16.150   48.817   16.150   48.817   16.150   30.313   7.5541   30.313   7.5541 0.000000 0.000000 
1 1 1   16    0  105 o   9.0714   6.2270  -6.0395   14.877  -6.0395   14.877  -6.0395   14.877   9.0714   6.2270   9.0714   6.2270 0.000000 0.000000 
1 1 1   16    0  106 o   11.036   7.1167   4.2582   14.839   4.2582   14.839   4.2582   14.839   11.036   7.1167   11.036   7.1167 0.000000 0.000000 
1 1 1   16    0  107 o   10.469   6.8579   2.2237   14.555   2.2237   14.555   2.2237   14.555   10.469   6.8579   10.469   6.8579 0.000000 0.000000 
1 1 1   16    0  108 o   9.0431   6.2472  -7.2070   15.549  -7.2070   15.549  -7.2070   15.549   9.0431   6.2472   9.0431   6.2472 0.000000 0.000000 
1 1 1   16    0  109 o   9.1861   6.3436  -7.0705   15.994  -7.0705   15.994  -7.0705   15.994   9.1861   6.3436   9.1861   6.3436 0.000000 0.000000 
1 1 1   16    0  110 o   8.0712   5.7381 -16.6443   16.232 -16.6443   16.232 -16.6443   16.232   8.0712   5.7381   8.0712   5.7381 0.000000 0.000000 
1 1 1   16    0  111 o   21.048   9.2718   32.377   16.672   32.377   16.672   32.377   16.672   21.048   9.2718   21.048   9.2718 0.000000 0.000000 
1 1 1   16    0  112 o   19.946   10.918   37.715   25.387   37.715   25.387   37.715   25.387   19.946   10.918   19.946   10.918 0.000000 0.000000 
1 1 1   16    0  113 o   19.630   10.816   36.785   25.094   36.785   25.094   36.785   25.094   19.630   10.816   19.630   10.816 0.000000 0.000000 
1 1 1   16    0  114 o   13.173   8.7403   8.1934   24.856   8.1934   24.856   8.1934   24.856   13.173   8.7403   13.173   8.7403 0.000000 0.000000 
1 1 1   16    0  115 o   36.795   10.703   86.698   27.862   86.698   27.862   86.698   27.862   36.795   10.703   36.795   10.703 0.000000 0.000000 
1 1 1   16    1 -115 o   19.254   7.5194   23.329   17.071   28.555   23.961   17.943   24.326   19.968   8.4722   17.982   8.0534 1.986105 11.68917 
1 1 1   16    1 -114 o   12.372   5.6484  -0.5958   12.667  -3.9506   17.739   2.8947   18.094   13.400   6.3075   14.583   6.6927 -1.183662 9.196542 
1 1 1   16    1 -113 o   19.693   6.7675   22.952   13.128   17.885   18.689   27.888   18.445   17.699   7.4948   20.371   7.8545 -2.671515 10.85652 
1 1 1   16    1 -112 o   12.983   5.8282   1.8225   12.824   0.6713   18.454   2.8976   17.834   14.333   6.6423   14.564   6.6691 -0.2307377 9.412628 
1 1 1   16    1 -111 f   13.867   6.0891   4.8341   13.243   0.0043   18.723   9.6705   18.735   14.347   6.6631   16.060   7.1381 -1.712653 9.764736 
1 1 1   16    1 -110 o   18.620   6.8079   19.871   13.466   20.310   19.508   19.472   18.612   18.527   7.7394   18.316   7.5979 0.2109470 10.84560 
1 1 1   16    1 -109 o   17.917   7.1402   17.885   15.674   39.290   28.454   8.5596   18.781   22.035   9.2849   15.972   7.1200 6.062626 11.70060 
1 1 1   16    1 -108 o   18.065   7.1813   18.096   15.817   13.541   28.021   20.225   19.162   17.978   8.2792   18.680   7.7255 -0.7011757 11.32381 
1 1 1   16    1 -107 o   10.237   5.0423 -22.3239   14.919   2.9626   27.143 -33.2694   17.858   16.618   7.8161   10.418   5.1967 6.199866 9.385992 
1 1 1   16    1 -106 o   18.039   7.1967   17.586   15.941 -12.7899   28.103   31.994   19.356   15.175   7.3521   22.128   8.1501 -6.952702 10.97623 
1 1 1   16    1 -105 o   20.386   6.8091   23.405   13.283   27.517   18.906   19.397   18.667   20.975   7.9859   18.723   7.6717 2.252703 11.07388 
1 1 1   16    1 -104 o   22.195   6.8096   27.550   13.494   3.8764   18.767   52.886   19.416   15.441   6.9806   29.753   7.8812 -14.31171 10.52813 
1 1 1   16    1 -103 o   22.614   6.1085   26.869   11.524   51.859   18.461   10.916   14.750   30.022   7.5517   16.233   6.7514 13.78928 10.12959 
1 1 1   16    1 -102 f   9.3495   4.4850 -10.5767   9.8555  -0.1256   13.793 -21.4779   14.087   13.283   5.9966   10.074   4.9496 3.209469 7.775474 
1 1 1   16    1 -101 f   17.826   5.8358   16.024   9.7724   6.4845   13.746   25.772   13.896   14.912   6.3749   21.592   6.9507 -6.679456 9.431406 
1 1 1   16    1 -100 o   10.928   5.0551  -4.9415   10.619  -3.7855   13.642  -6.7185   16.914   12.592   5.7907   13.348   6.2435 -0.7562113 8.515458 
1 1 1   16    1  -99 o   30.497   4.6728   43.085   11.247   30.348   14.137   65.043   18.562   23.805   6.8919   35.599   6.6409 -11.79410 9.570728 
1 1 1   16    1  -98 o   16.649   6.0918   12.697   10.785   5.8436   13.243   26.195   18.585   14.898   6.3088   21.766   7.9913 -6.867266 10.18147 
1 1 1   16    1  -97 o   25.002   5.5389   30.121   10.991   34.091   13.680   22.892   18.460   25.920   6.4901   20.913   7.9075 5.006718 10.22985 
1 1 1   16    1  -96 o   14.024   5.5022   6.9629   9.1755   1.5387   12.843   12.617   13.113   13.750   6.0184   17.179   6.6230 -3.428665 8.949027 
1 1 1   16    1  -95 o   25.682   4.7434   30.179   9.5643   4.9009   13.267   57.532   13.801   14.893   6.3108   35.542   4.8932 -20.64935 7.985614 
1 1 1   16    1  -94 f   17.391   5.6711   13.956   9.2329   22.977   13.181   5.2669   12.937   21.534   6.7507   14.966   6.2807 6.568287 9.220584 
1 1 1   16    1  -93 o   20.018   5.9438   19.048   10.402   9.1642   17.782   24.190   12.825   17.614   7.3758   22.219   6.6005 -4.604918 9.897983 
1 1 1   16    1  -92 o   18.558   5.7077   15.962   9.4732   28.563   15.054   7.7001   12.189   23.956   7.1596   15.610   6.2708 8.345840 9.517516 
1 1 1   16    1  -91 o   23.958   5.0907   26.187   9.6349   27.633   14.882   25.144   12.642   23.719   7.1257   22.883   6.4832 0.8358727 9.633633 
1 1 1   16    1  -90 o   47.713   2.1978   94.387   8.5249   87.188   17.003   96.805   9.8527   44.492   4.7622   48.196   2.5166 -3.703358 5.386303 
1 1 1   16    1  -89 o   30.752   2.5018   39.504   6.2172   40.044   12.903   39.341   7.0951   29.650   5.5424   30.567   2.8815 -0.9170685 6.246723 
1 1 1   16    1  -88 o   47.189   1.9384   91.874   7.4405   81.507   14.484   95.591   8.6723   43.511   4.1332   48.045   2.2204 -4.534256 4.691847 
1 1 1   16    1  -87 o   17.284   4.3435   13.277   6.1113   23.855   12.852   10.186   6.9470   22.553   6.5833   15.362   4.9116 7.191052 8.213579 
1 1 1   16    1  -86 o   38.110   2.3047   60.235   7.1262   61.818   13.477   59.620   8.3961   37.743   4.4668   37.779   2.7451 -0.3538132E-01 5.242932 
1 1 1   16    1  -85 o   24.698   4.7987   27.066   9.3128   15.440   12.773   40.258   13.607   19.003   6.6672   29.773   5.8153 -10.76985 8.846964 
1 1 1   16    1  -84 o   28.158   4.2256   34.340   9.4000   36.985   13.096   31.528   13.501   28.557   5.8234   26.084   6.3989 2.473013 8.652041 
1 1 1   16    1  -83 o   53.675   2.1102  118.798   9.2146  110.245   15.329  123.637   11.530   51.090   3.7060   54.598   2.5983 -3.507641 4.526098 
1 1 1   16    1  -82 o   41.563   2.5066   71.613   8.4530   67.287   14.507   73.837   10.401   39.513   4.5893   42.036   3.0564 -2.522984 5.513869 
1 1 1   16    1  -81 o   56.794   1.7009  132.358   7.8656  131.617   10.628  133.254   11.696   56.473   2.3136   56.754   2.5346 -0.2804604 3.431726 
1 1 1   16    1  -80 o   41.847   2.0038   72.087   6.8154   67.399   9.0073   78.366   10.424   40.280   2.7600   43.386   2.9653 -3.106304 4.050958 
1 1 1   16    1  -79 o   24.353   3.2005   25.022   6.1999   21.848   8.3402   28.942   9.2690   22.312   4.7326   25.815   4.5721 -3.503464 6.580372 
1 1 1   16    1  -78 o   31.971   2.4649   42.338   6.3741   39.497   8.5025   45.983   9.6315   30.631   3.4660   33.028   3.6376 -2.396984 5.024487 
1 1 1   16    1  -77 o   41.287   2.5801   70.485   8.6399   67.956   14.371   71.917   10.812   39.962   4.4893   41.542   3.2179 -1.579941 5.523493 
1 1 1   16    1  -76 o   49.155   2.4296   99.585   9.7050   93.654   16.935  102.485   11.842   47.044   4.4699   49.742   2.9337 -2.697868 5.346646 
1 1 1   16    1  -75 o   60.041   1.8487  147.766   9.0373  142.524   12.553  153.406   13.022   58.795   2.6258   61.003   2.6248 -2.207787 3.712705 
1 1 1   16    1  -74 o   61.412   1.8145  154.512   9.0734  153.603   12.675  155.467   12.994   61.078   2.5515   61.436   2.6007 -0.3579063 3.643260 
1 1 1   16    1  -73 o   50.189   2.0725  103.377   8.4607   98.518   12.064  108.081   11.869   48.796   3.0482   51.164   2.8572 -2.367378 4.177885 
1 1 1   16    1  -72 o   63.124   1.7358  163.079   8.9230  165.875   12.740  160.387   12.502   63.531   2.4647   62.470   2.4599 1.060349 3.482185 
1 1 1   16    1  -71 o   37.685   2.3791   58.455   7.2711   56.193   10.318   60.687   10.248   36.738   3.4872   38.227   3.3218 -1.489079 4.816071 
1 1 1   16    1  -70 o   52.151   2.0644  111.485   8.7585  112.184   11.730  110.606   13.167   52.196   2.7669   51.752   3.1358 0.4443703 4.181976 
1 1 1   16    1  -69 o   83.476   1.5779  284.654   10.737  278.976   15.062  290.520   15.310   82.514   2.2414   84.207   2.2324 -1.692963 3.163443 
1 1 1   16    1  -68 o   14.356   4.8594   8.0041   6.7642   7.3269   9.4167   8.7261   9.7228   15.116   5.6623   15.858   5.7869 -0.7422447 8.096306 
1 1 1   16    1  -67 o   49.323   2.7145  100.029   10.872  111.029   14.216   84.534   16.872   51.851   3.3819   44.924   4.6758 6.927036 5.770633 
1 1 1   16    1  -66 o   24.609   3.9661   25.582   7.6855   29.830   10.785   21.199   10.955   26.350   5.2061   22.135   5.9457 4.215061 7.902812 
1 1 1   16    1  -65 f   12.939   5.0282   4.4183   7.6035   10.715   10.824  -1.7161   10.683   17.176   6.1269   12.657   5.5153 4.519373 8.243690 
1 1 1   16    1  -64 o  105.808   1.6081  457.074   13.870  459.168   19.641  454.991   19.590  105.960   2.2740  105.476   2.2785 0.4836884 3.219040 
1 1 1   16    1  -63 o   10.522   4.6596  -2.5543   7.9101   9.8495   11.582 -13.3982   10.829   17.119   6.3046   10.135   4.8173 6.983951 7.934404 
1 1 1   16    1  -62 o   50.776   2.2542  105.597   9.3070   96.195   13.089  115.210   13.236   48.312   3.3444   52.933   3.0809 -4.621517 4.547191 
1 1 1   16    1  -61 o   46.479   2.3763   88.549   8.9734   84.777   12.673   92.342   12.707   45.330   3.4558   47.343   3.3137 -2.012383 4.787838 
1 1 1   16    1  -60 o  114.091   1.5519  531.192   14.433  516.746   20.236  546.150   20.590  112.457   2.2075  115.615   2.1848 -3.158295 3.105853 
1 1 1   16    1  -59 o   61.789   1.9155  156.039   9.6361  157.095   13.605  154.976   13.650   61.914   2.7022   61.491   2.7301 0.4233551 3.841291 
1 1 1   16    1  -58 o   94.627   1.7881  365.504   13.793  379.036   17.663  344.359   22.080   96.321   2.2496   91.683   2.9583 4.638092 3.716492 
1 1 1   16    1  -57 o   27.557   4.3524   31.954   9.4525   27.226   11.519   41.703   16.541   25.172   5.7412   31.100   6.7211 -5.928558 8.839376 
1 1 1   16    1  -56 o   41.892   3.4906   72.387   11.811   58.768   13.831  109.080   22.702   37.527   4.6186   51.113   5.5371 -13.58579 7.210520 
1 1 1   16    1  -55 o   81.269   2.2451  269.947   14.859  278.341   17.962  251.747   26.447   82.476   2.6752   78.207   4.1636 4.268257 4.948930 
1 1 1   16    1  -54 o   90.070   1.8686  331.103   13.719  313.955   19.241  348.835   19.566   87.600   2.6978   92.355   2.6016 -4.754295 3.747875 
1 1 1   16    1  -53 o   47.877   2.5032   93.901   9.7351   83.801   13.061  106.529   14.603   45.094   3.5825   50.882   3.5431 -5.787697 5.038631 
1 1 1   16    1  -52 o  119.110   1.7467  578.882   16.959  569.296   24.505  587.694   23.494  118.045   2.5467  119.953   2.4028 -1.907974 3.501251 
1 1 1   16    1  -51 o  156.967   1.9838  1005.60   25.383  995.721   42.775  1010.97   31.536  155.991   3.3640  157.327   2.4590 -1.335709 4.166939 
1 1 1   16    1  -50 o   44.616   2.7363   81.640   9.9037  109.034   22.520   75.072   11.027   51.181   5.4833   42.727   3.1891 8.453987 6.343312 
1 1 1   16    1  -49 o  151.020   1.7668  930.484   21.751  918.071   41.259  935.261   25.596  149.810   3.3787  151.378   2.0743 -1.568344 3.964619 
1 1 1   16    1  -48 o  154.328   1.6124  971.502   20.284  987.925   32.330  960.839   26.049  155.533   2.5500  153.438   2.0827 2.095688 3.292413 
1 1 1   16    1  -47 o   42.870   2.8691   75.421   9.9684   67.907   14.798   81.664   13.488   40.440   4.5690   44.513   3.7521 -4.072701 5.912188 
1 1 1   16    1  -46 o   41.995   2.7941   72.357   9.5104   73.835   14.802   71.318   12.411   42.226   4.3631   41.587   3.6998 0.6392670 5.720560 
1 1 1   16    1  -45 o   98.784   1.6504  398.028   13.290  381.251   18.590  415.565   19.006   96.642   2.3598  100.900   2.3108 -4.258644 3.302842 
1 1 1   16    1  -44 o   76.000   2.0303  235.848   12.567  229.128   16.070  246.427   20.162   74.862   2.6375   77.585   3.1949 -2.723175 4.142929 
1 1 1   16    1  -43 o   55.859   2.1750  127.518   9.8845  135.336   14.503  120.737   13.508   57.469   3.1075   54.275   3.0655 3.193302 4.365086 
1 1 1   16    1  -42 o  205.394   1.9201  1721.00   32.147  1754.04   47.976  1694.07   43.308  207.243   2.8399  203.702   2.6082 3.541885 3.855850 
1 1 1   16    1  -41 o  112.757   1.4933  518.468   13.725  538.294   18.182  492.206   20.926  114.871   1.9418  109.821   2.3375 5.049805 3.038851 
1 1 1   16    1  -40 o   19.885   4.9328   16.845   7.9567   17.471   10.792   16.099   11.778   20.467   6.0483   20.002   6.3953 0.4646835 8.802373 
1 1 1   16    1  -39 o  104.630   1.5573  446.430   13.282  468.880   19.430  426.740   18.197  107.199   2.2236  102.270   2.1828 4.928520 3.115903 
1 1 1   16    1  -38 o  230.174   1.6666  2160.61   31.270  2155.65   42.283  2166.60   46.457  229.852   2.2567  230.410   2.4735 -0.5574646 3.348320 
1 1 1   16    1  -37 o   11.004   4.8780  -3.0573   8.6912  -0.5382   13.738  -4.7382   11.222   14.885   6.3683   12.294   5.4906 2.590486 8.408435 
1 1 1   16    1  -36 o   87.137   1.8240  309.675   12.955  317.071   20.532  304.781   16.700   88.082   2.8634   86.393   2.3736 1.688690 3.719259 
1 1 1   16    1  -35 o  104.623   1.7682  446.410   15.080  456.393   23.773  439.689   19.506  105.703   2.7614  103.810   2.3052 1.893349 3.597075 
1 1 1   16    1  -34 o  107.229   2.1953  469.079   19.189  521.259   33.038  442.515   23.573  112.888   3.5949  104.081   2.7809 8.806824 4.544945 
1 1 1   16    1  -33 o   45.946   2.7014   86.461   10.073   77.529   14.528   94.728   13.978   43.342   4.1633   48.015   3.5974 -4.672295 5.502210 
1 1 1   16    1  -32 o  185.842   1.6459  1408.40   24.934  1412.03   31.789  1402.59   40.196  186.051   2.0961  185.380   2.6600 0.6714783 3.386669 
1 1 1   16    1  -31 o   55.483   2.2352  125.787   10.088  134.270   12.917  112.517   16.155   57.288   2.7742   52.332   3.8132 4.956001 4.715622 
1 1 1   16    1  -30 o  262.155   1.8985  2802.96   40.570  2787.38   51.318  2828.94   66.250  261.372   2.4087  263.221   3.0876 -1.849579 3.916026 
1 1 1   16    1  -29 o   72.907   1.8203  216.775   10.818  223.528   13.860  206.248   17.306   73.985   2.3009   71.015   2.9963 2.969704 3.777811 
1 1 1   16    1  -28 o   96.357   1.4850  378.567   11.664  371.176   16.069  386.797   16.957   95.394   2.0665   97.378   2.1363 -1.984001 2.972210 
1 1 1   16    1  -27 o  127.599   1.4093  663.829   14.658  653.135   19.927  676.438   21.639  126.548   1.9317  128.780   2.0613 -2.231865 2.825030 
1 1 1   16    1  -26 o   78.404   1.5661  250.648   10.009  241.388   13.773  261.011   14.570   76.894   2.1996   79.959   2.2376 -3.064636 3.137656 
1 1 1   16    1  -25 o  210.372   1.6542  1804.61   28.368  1809.49   40.631  1799.98   39.623  210.604   2.3668  210.054   2.3141 0.5499420 3.310102 
1 1 1   16    1  -24 f   97.836   1.5216  390.278   12.135  377.457   17.605  401.884   16.750   96.193   2.2452   99.264   2.0700 -3.070183 3.053855 
1 1 1   16    1  -23 f  127.777   1.4681  665.686   15.291  639.347   21.967  690.444   21.298  125.198   2.1525  130.111   2.0081 -4.913269 2.943722 
1 1 1   16    1  -22 o  158.603   1.5006  1025.62   19.400  1002.72   27.591  1048.03   27.284  156.790   2.1588  160.298   2.0881 -3.507706 3.003407 
1 1 1   16    1  -21 o  233.617   1.7434  2225.50   33.201  2196.58   47.048  2254.20   46.858  232.034   2.4874  235.062   2.4455 -3.027802 3.488244 
1 1 1   16    1  -20 o   45.441   2.2242   84.429   8.2137   69.019   12.059   97.767   11.219   40.946   3.6512   48.864   2.8286 -7.918636 4.618649 
1 1 1   16    1  -19 o   69.761   1.8435  198.596   10.474  209.779   17.331  192.161   13.147   71.631   2.9747   68.593   2.3547 3.037163 3.793859 
1 1 1   16    1  -18 o  199.020   1.7030  1615.10   27.627  1572.30   41.540  1649.04   36.995  196.306   2.5959  201.066   2.2572 -4.760040 3.440038 
1 1 1   16    1  -17 o  326.474   2.2999  4347.73   61.205  4410.50   94.517  4302.40   80.320  328.637   3.5282  324.667   3.0349 3.969971 4.653962 
1 1 1   16    1  -16 o  130.714   1.6444  696.680   17.522  663.915   29.351  714.822   21.840  127.551   2.8229  132.391   2.0238 -4.839630 3.473408 
1 1 1   16    1  -15 o  204.668   1.7294  1708.08   28.852  1713.61   44.138  1703.95   38.125  204.936   2.6421  204.385   2.2883 0.5510101 3.495345 
1 1 1   16    1  -14 o  364.390   2.5024  5416.97   74.330  5422.59  113.584  5412.76   98.302  364.346   3.8244  364.117   3.3120 0.2286377 5.059193 
1 1 1   16    1  -13 o  205.701   1.8655  1725.48   31.280  1739.58   44.576  1711.81   43.905  206.484   2.6484  204.831   2.6296 1.653122 3.732088 
1 1 1   16    1  -12 o  174.802   1.9091  1246.06   27.202  1271.51   35.899  1211.75   41.685  176.544   2.4945  172.311   2.9678 4.232315 3.876933 
1 1 1   16    1  -11 o  334.214   3.0868  4559.10   84.095  4578.88   97.792  4502.96  164.762  334.855   3.5827  331.460   6.0980 3.394714 7.072596 
1 1 1   16    1  -10 o  120.996   2.0192  597.057   19.916  567.059   23.089  684.248   39.363  117.902   2.4024  129.381   3.7363 -11.47816 4.441993 
1 1 1   16    1   -9 o   72.556   2.4781  215.011   14.635  195.446   18.194  250.877   24.634   69.119   3.2382   78.273   3.8729 -9.154434 5.048325 
1 1 1   16    1   -8 o   64.599   3.0038  170.679   15.774  176.820   22.897  165.132   21.761   65.636   4.3034   63.427   4.2331 2.208515 6.036433 
1 1 1   16    1   -7 o  138.839   1.9997  786.118   22.632  793.721   43.993  783.381   26.392  139.341   3.8770  138.582   2.3363 0.7590332 4.526506 
1 1 1   16    1   -6 o   80.978   2.3704  267.716   15.630  280.328   26.198  260.746   19.476   82.749   3.8947   79.875   2.9966 2.874168 4.914140 
1 1 1   16    1   -5 o   87.405   2.0415  311.561   14.546  303.110   27.656  314.792   17.102   86.048   3.9535   87.814   2.3914 -1.766068 4.620460 
1 1 1   16    1   -4 o  315.108   2.4164  4050.42   62.068  3961.34   86.562  4144.68   89.046  311.492   3.4091  318.615   3.4286 -7.123566 4.835016 
1 1 1   16    1   -3 o  124.015   1.6524  627.087   16.705  615.715   23.795  638.138   23.456  122.859   2.3760  125.079   2.3006 -2.220390 3.307252 
1 1 1   16    1   -2 o  292.457   2.2911  3488.70   54.619  3502.80   77.640  3474.89   76.852  292.933   3.2515  291.766   3.2313 1.166412 4.584082 
1 1 1   16    1   -1 o  148.095   1.6747  894.262   20.217  920.679   29.184  869.886   28.034  150.235   2.3831  146.033   2.3550 4.201538 3.350394 
1 1 1   16    1    0 o   39.617   2.7582   64.350   8.8517   48.636   12.779   78.842   12.272   34.170   4.7134   43.808   3.4649 -9.637478 5.849978 
1 1 1   16    1    1 o  113.245   1.6567  522.904   15.293  518.925   21.859  526.719   21.404  112.790   2.3776  113.636   2.3107 -0.8464127 3.315437 
1 1 1   16    1    2 o  155.496   1.7002  985.892   21.551  1021.88   31.179  952.972   29.822  158.274   2.4167  152.846   2.3935 5.427963 3.401365 
1 1 1   16    1    3 o   60.536   2.0742  149.628   10.220  160.667   14.876  139.758   14.066   62.679   2.9195   58.446   2.9621 4.233067 4.159046 
1 1 1   16    1    4 o  146.198   1.6885  871.507   20.122  864.787   28.529  878.159   28.385  145.602   2.4037  146.725   2.3733 -1.122879 3.377894 
1 1 1   16    1    5 o  161.924   1.7239  1069.10   22.755  1079.19   32.558  1059.48   31.815  162.649   2.4557  161.159   2.4218 1.490219 3.448977 
1 1 1   16    1    6 o  229.010   1.9757  2138.77   36.881  2167.50   52.839  2111.49   51.503  230.474   2.8126  227.480   2.7775 2.994125 3.952826 
1 1 1   16    1    7 o  161.649   1.7220  1065.48   22.691  1080.31   32.641  1051.61   31.565  162.733   2.4607  160.560   2.4117 2.172836 3.445491 
1 1 1   16    1    8 o  120.050   1.6686  587.641   16.328  588.926   23.439  586.430   22.760  120.155   2.3931  119.903   2.3287 0.2521591 3.339066 
1 1 1   16    1    9 o  119.288   1.6655  580.203   16.195  557.487   22.945  602.753   22.862  116.903   2.4079  121.561   2.3072 -4.657722 3.334799 
1 1 1   16    1   10 o  213.674   1.9082  1861.87   33.236  1875.72   47.454  1848.53   46.566  214.408   2.7151  212.851   2.6838 1.556702 3.817705 
1 1 1   16    1   11 o   61.739   2.0969  155.638   10.537  140.308   15.420  169.068   14.433   58.537   3.2443   64.310   2.7597 -5.773285 4.259252 
1 1 1   16    1   12 o  272.084   2.4057  3019.90   53.357  3050.79   85.599  3000.27   68.234  273.286   3.8425  271.121   3.0875 2.165009 4.929257 
1 1 1   16    1   13 o   99.756   2.1689  405.876   17.637  397.351   25.528  413.660   24.395   98.611   3.1800  100.632   2.9772 -2.021179 4.356144 
1 1 1   16    1   14 o  129.510   2.0912  684.071   22.077  697.023   31.820  672.049   30.656  130.684   2.9870  128.325   2.9306 2.359238 4.184613 
1 1 1   16    1   15 o   73.124   2.1376  218.276   12.728  203.930   16.399  240.013   20.185   70.634   2.8540   76.609   3.2397 -5.974899 4.317540 
1 1 1   16    1   16 o   91.043   1.9450  338.026   14.435  346.377   18.780  325.969   22.565   92.109   2.5036   89.310   3.1042 2.798820 3.988003 
1 1 1   16    1   17 o  101.055   1.7080  416.408   14.069  404.305   20.146  427.932   19.657   99.550   2.4826  102.423   2.3545 -2.872536 3.421522 
1 1 1   16    1   18 o   38.269   2.9405   60.122   9.1025   58.697   13.109   61.448   12.649   37.645   4.3521   38.564   4.0859 -0.9188347 5.969553 
1 1 1   16    1   19 o   49.565   2.5992  100.513   10.465  101.922   14.061   98.763   15.669   49.838   3.4831   49.007   3.9559 0.8314705 5.270761 
1 1 1   16    1   20 o   90.101   1.7962  331.050   13.193  326.359   19.228  335.222   18.135   89.395   2.6415   90.613   2.4574 -1.218819 3.607840 
1 1 1   16    1   21 o   83.155   1.9837  282.007   13.446  301.157   21.916  270.448   17.027   85.834   3.1376   81.375   2.5702 4.458931 4.055917 
1 1 1   16    1   22 o  177.993   1.7932  1291.94   26.018  1299.81   37.249  1284.45   36.357  178.485   2.5602  177.431   2.5138 1.054535 3.587988 
1 1 1   16    1   23 f  221.087   2.1387  1993.73   38.543  2039.53   61.862  1964.67   49.276  223.483   3.3958  219.415   2.7550 4.067657 4.372851 
1 1 1   16    1   24 f  148.615   1.7337  900.635   21.003  902.651   30.140  898.732   29.283  148.741   2.4859  148.422   2.4204 0.3192444 3.469589 
1 1 1   16    1   25 o  127.034   1.7163  658.061   17.773  670.332   25.781  646.949   24.534  128.179   2.4675  125.927   2.3901 2.251450 3.435233 
1 1 1   16    1   26 o   45.286   2.6884   83.987   9.8798  103.826   14.937   68.555   13.173   50.280   3.6696   40.760   4.0170 9.520794 5.440770 
1 1 1   16    1   27 o   54.955   2.4513  123.466   10.953  136.458   15.896  111.719   15.115   57.705   3.3943   52.175   3.5755 5.529686 4.930059 
1 1 1   16    1   28 o  300.362   2.3760  3680.77   58.174  3793.25   84.258  3578.31   80.418  304.757   3.3917  296.007   3.3328 8.749969 4.755177 
1 1 1   16    1   29 o  232.399   2.0458  2202.96   38.756  2231.16   55.639  2176.39   54.015  233.788   2.9196  230.907   2.8697 2.881363 4.093788 
1 1 1   16    1   30 o  195.826   1.9067  1564.01   30.436  1566.25   43.505  1561.87   42.596  195.896   2.7244  195.627   2.6712 0.2684479 3.815454 
1 1 1   16    1   31 o  160.910   1.8178  1055.95   23.843  1083.18   34.613  1031.36   32.891  162.917   2.6064  158.977   2.5381 3.939362 3.638035 
1 1 1   16    1   32 o  103.841   1.8681  439.784   15.813  457.530   23.070  424.059   21.716  105.844   2.6760  101.901   2.6166 3.942917 3.742677 
1 1 1   16    1   33 o  127.980   1.8344  668.005   19.137  698.069   28.110  642.034   26.126  130.781   2.6368  125.428   2.5553 5.353500 3.671805 
1 1 1   16    1   34 o  115.449   2.0700  543.693   19.481  508.567   25.352  594.334   30.440  111.619   2.7864  120.602   3.0990 -8.983803 4.167443 
1 1 1   16    1   35 o   91.067   2.4258  338.646   17.992  361.354   26.543  319.344   24.471   93.983   3.4707   88.350   3.4043 5.633133 4.861586 
1 1 1   16    1   36 o   14.118   5.9790   0.4171   11.897   7.0148   17.791  -4.9194   16.001   18.891   7.5804   15.055   6.6488 3.836163 10.08312 
1 1 1   16    1   37 o   38.699   4.1607   61.959   12.919   68.968   19.457   56.432   17.277   40.544   6.0742   36.608   5.9973 3.935886 8.536022 
1 1 1   16    1   38 o   55.744   2.5080  127.077   11.367  124.696   16.753  129.108   15.474   55.103   3.7521   56.111   3.3991 -1.008221 5.062819 
1 1 1   16    1   39 o  217.847   1.9807  1935.92   35.173  1971.54   50.688  1902.84   48.848  219.742   2.8298  215.887   2.7758 3.855225 3.963922 
1 1 1   16    1   40 o  112.160   1.8002  513.103   16.459  473.322   23.336  552.478   23.217  107.676   2.6587  116.346   2.4480 -8.670197 3.614042 
1 1 1   16    1   41 o  210.641   2.1177  1810.32   36.362  1829.58   58.143  1797.95   46.600  211.584   3.3712  209.846   2.7243 1.737991 4.334323 
1 1 1   16    1   42 o  226.106   2.0032  2085.75   36.921  2086.58   52.555  2084.95   51.880  226.034   2.8524  225.952   2.8167 0.8227539E-01 4.008746 
1 1 1   16    1   43 o  118.815   1.7784  575.847   17.224  576.154   24.741  575.559   23.994  118.795   2.5549  118.740   2.4790 0.5551910E-01 3.559913 
1 1 1   16    1   44 o  187.039   2.0189  1427.41   30.781  1479.16   49.858  1395.55   39.129  190.238   3.2152  184.873   2.5965 5.365036 4.132678 
1 1 1   16    1   45 o  118.309   1.9638  571.100   18.939  576.901   24.888  563.120   29.191  118.863   2.5686  117.351   3.0542 1.512314 3.990694 
1 1 1   16    1   46 o   12.951   5.5550  -0.6064   10.501   2.1640   14.314  -3.8354   15.454   15.902   6.6353   14.977   6.5770 0.9255934 9.342586 
1 1 1   16    1   47 o   70.117   2.3308  200.924   13.303  192.475   17.496  212.505   20.483   68.548   3.1395   71.992   3.5008 -3.443520 4.702341 
1 1 1   16    1   48 o  106.903   1.9962  466.356   17.395  469.713   22.792  461.672   26.920  107.240   2.6073  106.226   3.1123 1.014320 4.060125 
1 1 1   16    1   49 o   95.351   2.0726  371.068   16.109  357.459   21.114  390.023   24.919   93.494   2.7736   97.619   3.1356 -4.125153 4.186248 
1 1 1   16    1   50 o   55.000   3.1992  124.129   14.281  162.064   22.631   99.029   18.409   62.694   4.4575   48.895   4.6757 13.79908 6.459994 
1 1 1   16    1   51 o   75.052   2.3195  230.232   14.173  219.027   24.535  235.844   17.364   72.971   4.1417   75.912   2.8109 -2.940529 5.005508 
1 1 1   16    1   52 o   89.205   2.0895  324.847   15.194  309.865   19.751  346.565   23.779   87.025   2.7879   91.988   3.1761 -4.962959 4.226058 
1 1 1   16    1   53 o   64.942   2.8896  172.776   15.258  174.526   22.544  171.296   20.727   65.074   4.2737   64.517   3.9602 0.5567398 5.826462 
1 1 1   16    1   54 o   68.009   2.8673  189.457   15.860  207.975   23.698  174.434   21.345   71.082   4.1074   65.088   4.0429 5.993347 5.763347 
1 1 1   16    1   55 o  190.740   2.6804  1487.17   41.676  1431.58   72.205  1514.94   51.035  186.498   4.7535  192.379   3.2544 -5.881302 5.760784 
1 1 1   16    1   56 o   93.557   1.8670  357.278   14.238  350.454   20.697  363.408   19.618   92.539   2.7468   94.261   2.5556 -1.721863 3.751816 
1 1 1   16    1   57 o   85.525   1.9189  298.609   13.378  307.082   19.581  291.193   18.320   86.608   2.7772   84.350   2.6678 2.258049 3.850969 
1 1 1   16    1   58 o   13.217   5.3970   2.6982   9.1993   4.7991   13.682   0.9651   12.427   16.306   6.6104   14.507   6.1258 1.798504 9.012314 
1 1 1   16    1   59 o   51.779   2.6816  109.951   11.280   93.433   17.769  121.099   14.598   47.405   4.6585   54.262   3.3163 -6.856964 5.718344 
1 1 1   16    1   60 o   70.365   2.2499  202.533   12.888  168.572   20.385  225.150   16.635   63.938   3.9302   74.128   2.7579 -10.18999 4.801317 
1 1 1   16    1   61 o   86.689   2.0834  307.017   14.722  296.632   23.633  313.603   18.821   84.972   3.4189   87.511   2.6414 -2.539124 4.320417 
1 1 1   16    1   62 o  119.821   1.9408  586.433   18.956  591.422   30.469  583.282   24.213  120.083   3.1154  119.414   2.4875 0.6683807 3.986607 
1 1 1   16    1   63 o   88.730   2.1114  321.768   15.271  323.000   24.644  321.000   19.458   88.638   3.4172   88.506   2.7002 0.1318207 4.355262 
1 1 1   16    1   64 o   52.075   2.8628  111.456   12.106  106.536   19.470  114.557   15.456   50.530   4.7838   52.667   3.6223 -2.136948 6.000537 
1 1 1   16    1   65 f   9.9628   4.6808 -10.0484   9.6881  -1.3249   15.942 -15.1565   12.199   15.666   6.7826   10.723   5.1014 4.942732 8.486950 
1 1 1   16    1   66 o   18.583   5.5710   14.576   9.1041   34.883   13.964  -0.4357   12.007   28.325   6.2188   13.797   5.9291 14.52798 8.592304 
1 1 1   16    1   67 o   68.731   2.0551  193.352   11.501  190.509   16.952  195.777   15.655   68.047   3.0640   69.039   2.7876 -0.9916153 4.142296 
1 1 1   16    1   68 o   17.531   5.4018   12.858   8.4802   15.355   12.937   10.977   11.229   19.700   6.7196   17.380   6.2359 2.319807 9.167254 
1 1 1   16    1   69 o   67.782   2.0405  188.136   11.261  184.747   16.533  191.069   15.381   66.978   3.0360   68.175   2.7736 -1.196411 4.112195 
1 1 1   16    1   70 o  105.111   1.7436  451.650   14.939  471.944   21.968  434.189   20.376  107.275   2.5122  102.915   2.4289 4.359802 3.494370 
1 1 1   16    1   71 o   62.456   2.2392  160.028   11.382  161.031   18.738  159.441   14.328   62.302   3.7064   62.220   2.8324 0.8165741E-01 4.664753 
1 1 1   16    1   72 o   52.013   2.6971  111.461   11.396  113.243   17.275  110.088   15.164   52.066   4.1035   51.466   3.6381 0.6005936 5.484007 
1 1 1   16    1   73 o   27.540   4.3970   32.368   9.5393   33.176   14.669   31.777   12.557   27.285   6.6555   26.875   5.8946 0.4104233 8.890523 
1 1 1   16    1   74 o   41.354   2.8442   70.762   9.5294   67.817   13.305   73.865   13.655   40.149   4.1239   41.942   4.0441 -1.792812 5.775967 
1 1 1   16    1   75 o   84.653   1.9429  293.613   13.407  290.906   21.142  295.433   17.339   83.869   3.0979   84.729   2.5133 -0.8606949 3.989138 
1 1 1   16    1   76 o   63.767   1.9949  166.879   10.357  169.312   14.839  164.568   14.462   64.002   2.8514   63.108   2.8184 0.8945274 4.009181 
1 1 1   16    1   77 o   20.670   5.3572   18.886   9.0997   6.1434   11.821   37.420   14.257   15.522   6.1957   28.919   6.2317 -13.39689 8.787556 
1 1 1   16    1   78 o   26.764   3.7881   30.461   8.0337   21.843   11.903   37.671   10.887   22.083   6.3026   29.529   4.6789 -7.445839 7.849460 
1 1 1   16    1   79 o   10.286   4.4241  -0.1555   6.6960  -3.7838   9.2441   3.8499   9.7126   10.966   4.9334   13.651   5.5565 -2.685696 7.430539 
1 1 1   16    1   80 o   53.497   1.9901  117.698   8.6633  123.236   11.287  109.756   13.516   54.590   2.5434   51.276   3.2504 3.314610 4.127221 
1 1 1   16    1   81 o   52.313   1.9273  112.531   8.2044  118.913   11.313  105.450   11.917   53.587   2.5976   50.350   2.9159 3.236534 3.905115 
1 1 1   16    1   82 o   21.870   3.8181   20.636   6.5591   13.970   10.690   24.661   8.3065   18.129   6.1090   23.751   4.4540 -5.621990 7.560258 
1 1 1   16    1   83 o   40.519   2.0698   67.741   6.8136   76.061   10.136   60.880   9.2036   42.687   2.9306   38.153   2.9831 4.534412 4.181754 
1 1 1   16    1   84 o   16.306   4.4920   11.727   6.1609   4.2516   9.2168   17.765   8.2833   13.432   5.4326   19.896   5.0879 -6.464718 7.443131 
1 1 1   16    1   85 o   35.896   2.2809   53.414   6.6394   57.922   9.9268   49.765   8.9310   37.048   3.3223   34.354   3.2271 2.694008 4.631594 
1 1 1   16    1   86 o   14.844   4.7188   9.4599   6.4198   14.934   8.9032   3.5307   9.2656   18.252   5.5176   13.142   5.3971 5.110813 7.718316 
1 1 1   16    1   87 o   48.331   2.0817   96.503   8.1821  114.169   12.289   82.434   10.966   52.257   2.8962   44.316   3.0545 7.941803 4.209234 
1 1 1   16    1   88 o   97.988   1.5091  393.868   12.054  405.946   17.785  383.605   16.394   99.121   2.2011   96.422   2.0858 2.699417 3.032423 
1 1 1   16    1   89 o   50.384   1.7922  104.582   7.3488  105.104   11.025  104.165   9.8582   50.169   2.7059   50.062   2.4229 0.1064796 3.632175 
1 1 1   16    1   90 o   12.786   4.5515   6.3698   5.9702   17.413   9.0357  -2.1873   7.9537   19.454   5.4705   10.369   4.6271 9.085065 7.164968 
1 1 1   16    1   91 o   36.372   2.2468   55.021   6.6289   49.726   9.8526   59.401   8.9602   34.035   3.6061   37.529   2.9527 -3.494392 4.660739 
1 1 1   16    1   92 o   13.563   4.5871   7.7315   6.0273  -0.3772   9.0886   14.097   8.0528   11.583   5.0663   17.549   5.2345 -5.966233 7.284759 
1 1 1   16    1   93 o   64.675   1.5273  171.992   8.0517  188.597   12.011  158.439   10.851   67.380   2.1896   61.769   2.1584 5.611034 3.074631 
1 1 1   16    1   94 f   29.269   2.6750   36.195   6.3116   34.790   9.4970   37.307   8.4469   27.934   4.3091   29.306   3.6123 -1.371698 5.622910 
1 1 1   16    1   95 o   25.299   3.3043   27.709   6.6516   32.765   9.1339   22.000   9.7057   27.043   4.2862   21.464   5.5173 5.579462 6.986591 
1 1 1   16    1   96 o   28.906   2.9294   35.724   6.8074   35.255   9.3023   36.264   9.9885   28.057   4.1961   28.292   4.4803 -0.2348137 6.138396 
1 1 1   16    1   97 o   36.906   2.1938   57.008   6.5701   59.603   10.374   55.271   8.4899   37.025   3.4779   35.977   2.9200 1.047920 4.541215 
1 1 1   16    1   98 o   28.380   2.9601   34.629   6.7474   48.009   12.431   29.041   8.0338   32.156   4.8969   25.426   4.0088 6.729128 6.328541 
1 1 1   16    1   99 o   45.789   2.6985   89.168   10.027   86.460   13.310   92.723   15.249   44.269   3.7229   45.428   4.1642 -1.159313 5.585758 
1 1 1   16    1  100 o   35.058   3.5185   54.158   9.9190   48.029   13.924   60.472   14.134   31.238   5.6773   35.800   4.9776 -4.562483 7.550429 
1 1 1   16    1  101 f   40.396   4.2399   74.426   13.754   83.526   25.339   70.625   16.376   37.349   8.5128   38.127   5.4217 -0.7777443 10.09271 
1 1 1   16    1  102 f   19.911   5.9794   20.601   10.481   23.829   15.077   17.583   14.580   20.522   7.2400   18.330   7.0046 2.192299 10.07384 
1 1 1   16    1  103 o   11.825   5.2976  -0.4817   10.535   7.7398   15.212  -8.0595   14.605   15.490   6.6655   12.091   5.7012 3.399369 8.771141 
1 1 1   16    1  104 o   14.902   5.9220   9.3604   10.753   1.5944   15.739   16.158   14.725   14.202   6.4091   17.733   6.9664 -3.531365 9.466118 
1 1 1   16    1  105 o   23.513   5.7479   28.511   10.923   30.700   15.624   26.418   15.276   22.734   7.3747   21.178   7.2994 1.556248 10.37633 
1 1 1   16    1  106 o   19.500   6.2289   20.587   11.175   27.338   16.272   14.562   15.374   21.202   7.5176   17.119   6.9822 4.083332 10.25992 
1 1 1   16    1  107 o   14.842   6.0172   9.2396   11.337  -1.4513   16.055   19.873   16.011   13.567   6.2546   18.684   7.2865 -5.116944 9.602705 
1 1 1   16    1  108 o   12.167   5.4509   0.4172   11.155  -4.5615   15.728   5.4563   15.823   12.885   6.0249   14.811   6.5728 -1.925961 8.916327 
1 1 1   16    1  109 o   11.705   5.3609  -2.1124   11.531 -10.1609   16.468   5.6282   16.150   12.257   5.8576   14.863   6.6155 -2.605944 8.836026 
1 1 1   16    1  110 o   9.1861   4.5051 -16.9612   11.499 -20.3973   16.322 -13.5752   16.202   10.939   5.3654   11.684   5.6416 -0.7448111 7.785587 
1 1 1   16    1  111 f   15.288   6.1505   10.855   11.745   23.771   16.948  -1.0797   16.292   19.502   7.5265   13.525   6.2585 5.976951 9.788626 
1 1 1   16    1  112 o   20.609   6.9765   25.592   13.942   29.081   17.401   19.336   23.300   21.020   7.7302   18.201   8.0312 2.819798 11.14701 
1 1 1   16    1  113 o   14.008   6.4176   1.7368   16.540  -7.5589   23.210   11.328   23.576   14.277   6.8576   16.808   7.6859 -2.531055 10.30050 
1 1 1   16    1  114 o   13.401   6.4808 -12.1163   21.585 -12.1163   21.585   0.0000   0.0000   13.401   6.4808  ?   ?  0.000000 6.480769 
1 1 1   16    2 -113 o   15.776   6.9781   9.5993   17.692   3.5235   25.158   15.544   24.885   15.932   7.5032   17.572   7.9813 -1.639802 10.95440 
1 1 1   16    2 -112 o   13.761   6.2007   3.1031   14.668  -2.5360   18.412   12.899   24.267   13.762   6.4618   17.068   7.8022 -3.305992 10.13060 
1 1 1   16    2 -111 o   15.497   6.5994   10.529   14.631 -18.8290   17.803   71.620   25.681   11.541   5.6486   30.643   9.3928 -19.10214 10.96042 
1 1 1   16    2 -110 o   16.603   6.4948   14.674   12.753   36.093   18.151  -6.2105   17.923   23.097   7.9568   13.130   6.2280 9.967674 10.10440 
1 1 1   16    2 -109 o   18.070   6.6963   18.597   13.101   8.5118   18.901   27.924   18.176   15.818   7.0903   20.540   7.8277 -4.722601 10.56150 
1 1 1   16    2 -108 o   15.737   6.4305   11.620   13.071   8.6430   18.694   14.467   18.282   15.879   7.0892   17.053   7.3221 -1.174205 10.19167 
1 1 1   16    2 -107 o   18.586   7.1917   20.179   15.503   23.556   27.876   18.667   18.654   19.231   8.6163   18.131   7.5707 1.100721 11.46980 
1 1 1   16    2 -106 f   12.623   5.8940  -4.4035   14.967   13.808   26.800 -12.6578   18.043   17.848   8.1740   12.488   6.0106 5.360260 10.14606 
1 1 1   16    2 -105 o   17.425   7.1270   15.776   16.074   9.9861   28.152   18.576   19.579   17.556   8.1591   18.320   7.7096 -0.7639065 11.22535 
1 1 1   16    2 -104 o   24.075   7.4551   35.039   16.129 -25.2550   28.452   63.588   19.578   14.154   6.9702   33.146   7.4301 -18.99228 10.18774 
1 1 1   16    2 -103 o   15.207   6.2873   9.3433   12.686   18.782   17.520  -1.0607   18.394   18.463   7.4819   14.370   6.6497 4.092697 10.00992 
1 1 1   16    2 -102 o   17.238   6.4901   15.203   12.405   11.781   17.008   19.093   18.134   16.709   7.1153   18.678   7.5961 -1.969374 10.40803 
1 1 1   16    2 -101 o   18.250   6.5802   17.650   12.521   11.033   17.003   25.492   18.509   16.605   7.0939   20.586   7.8859 -3.981558 10.60710 
1 1 1   16    2 -100 o   21.692   6.6977   25.888   13.029   28.901   17.812   22.422   19.108   21.835   7.8514   19.766   7.8814 2.068079 11.12479 
1 1 1   16    2  -99 o   16.547   6.8052   11.706   14.758   8.8960   17.510   18.599   27.426   16.348   7.0929   19.454   8.6421 -3.105930 11.18010 
1 1 1   16    2  -98 o   14.425   6.0318   6.5567   11.866   3.8030   16.136   9.7999   17.512   14.989   6.6453   16.662   7.1603 -1.673117 9.768805 
1 1 1   16    2  -97 o   14.040   5.7302   6.5684   10.363   13.888   12.913  -6.6769   17.371   17.200   6.5873   13.569   6.3406 3.630448 9.143093 
1 1 1   16    2  -96 o   13.756   5.6983   5.4037   10.449   6.3810   13.350   3.8582   16.788   15.030   6.3479   15.445   6.8161 -0.4152040 9.314240 
1 1 1   16    2  -95 o   10.929   5.0222  -4.5458   10.235   11.407   13.341 -27.3636   15.956   16.659   6.6040   10.505   5.1819 6.153885 8.394313 
1 1 1   16    2  -94 o   51.749   2.9042  113.868   12.201  114.189   15.749  113.385   19.298   51.070   3.8105   49.902   4.8035 1.168774 6.131331 
1 1 1   16    2  -93 o   28.337   4.7715   36.763   10.630   37.841   13.776   35.177   16.714   27.722   6.2463   25.716   7.5078 2.005688 9.766447 
1 1 1   16    2  -92 o   24.791   5.3656   28.901   10.528   19.703   13.592   42.694   16.645   20.069   6.8866   28.941   7.1080 -8.872108 9.896897 
1 1 1   16    2  -91 o   38.660   3.2060   63.765   10.012   56.575   14.973   69.579   13.465   35.010   5.4219   39.768   4.2181 -4.757557 6.869413 
1 1 1   16    2  -90 o   26.928   3.5624   31.394   7.6277   46.832   13.897   24.738   9.1250   31.803   5.5632   23.231   4.9691 8.572790 7.459333 
1 1 1   16    2  -89 o   47.812   2.5645   95.563   9.9581   96.266   14.851   94.989   13.423   47.232   3.8920   47.154   3.5174 0.7737732E-01 5.245872 
1 1 1   16    2  -88 o   67.164   2.3451  187.372   12.819  157.695   19.811  208.749   16.814   60.496   4.0405   70.528   2.9310 -10.03133 4.991666 
1 1 1   16    2  -87 f   42.792   2.7102   76.620   9.4052   93.688   17.142   69.269   11.250   46.259   4.6072   40.353   3.4532 5.905792 5.757644 
1 1 1   16    2  -86 o   17.156   5.2855   13.153   8.1192   32.060   15.741   6.2996   9.4772   25.666   7.2217   14.233   5.5896 11.43266 9.132163 
1 1 1   16    2  -85 o   12.394   4.9930   3.7459   7.7518   11.803   12.196  -1.7158   10.041   17.330   6.4535   11.877   5.2551 5.453042 8.322481 
1 1 1   16    2  -84 o   31.217   3.4269   41.430   8.5772   38.686   13.105   43.485   11.345   29.137   5.7220   31.520   4.5466 -2.383444 7.308403 
1 1 1   16    2  -83 o   47.102   2.5591   92.240   9.7885   98.268   14.705   87.443   13.117   48.072   3.7830   45.436   3.5703 2.636055 5.201739 
1 1 1   16    2  -82 o   17.417   5.1438   13.480   7.8072   0.9185   13.039   20.500   9.7477   14.238   6.1491   21.223   5.5666 -6.984976 8.294534 
1 1 1   16    2  -81 o   28.650   3.5961   34.976   8.2136   27.494   13.397   39.482   10.397   24.296   6.5964   30.179   4.3519 -5.882454 7.902613 
1 1 1   16    2  -80 o   34.676   2.2707   49.791   6.3830   49.922   8.0485   49.568   10.479   34.558   2.8834   34.112   3.8348 0.4457016 4.797887 
1 1 1   16    2  -79 o   44.353   2.0910   81.110   7.5384   87.432   10.091   73.125   11.340   45.876   2.7105   41.724   3.3626 4.152084 4.318999 
1 1 1   16    2  -78 o   38.196   2.2600   60.289   7.0053   57.233   9.0792   64.785   11.012   37.008   3.0364   39.243   3.4785 -2.235004 4.617331 
1 1 1   16    2  -77 o   25.149   3.1723   26.670   6.3588   29.924   8.1932   21.741   10.084   26.445   3.9193   22.021   5.6043 4.423845 6.838811 
1 1 1   16    2  -76 o   52.583   2.2676  113.970   9.6967  135.437   16.157  101.885   12.123   56.904   3.5001   49.495   3.0190 7.409054 4.622258 
1 1 1   16    2  -75 o  118.856   1.7361  578.801   16.820  595.269   25.826  566.670   22.166  120.125   2.6375  117.364   2.3169 2.760239 3.510618 
1 1 1   16    2  -74 o   52.732   1.8998  114.145   8.1530  107.147   10.812  123.370   12.413   50.924   2.6133   54.600   2.7984 -3.675716 3.828902 
1 1 1   16    2  -73 o   56.820   1.9358  132.490   8.9529  139.605   11.502  121.552   14.261   58.215   2.4291   54.084   3.2498 4.130955 4.057320 
1 1 1   16    2  -72 o   41.406   2.2382   70.575   7.5262   75.291   10.104   64.696   11.280   42.625   2.9258   39.337   3.5562 3.287380 4.605106 
1 1 1   16    2  -71 o   19.514   4.2877   16.493   6.6339   14.067   8.9028   19.522   9.9472   18.127   5.5253   21.072   5.6682 -2.944475 7.915633 
1 1 1   16    2  -70 o   14.446   4.8169   8.3379   6.6480   9.8593   9.2210   6.6911   9.5935   16.094   5.6633   14.831   5.6784 1.262868 8.019758 
1 1 1   16    2  -69 o   61.230   1.8767  153.573   9.3559  161.279   13.453  146.354   13.020   62.597   2.6425   59.615   2.6862 2.981750 3.768071 
1 1 1   16    2  -68 o   11.443   4.6024   2.6461   6.5743  -5.3971   9.3882   10.386   9.2094   10.751   4.8907   16.383   5.6666 -5.632051 7.485269 
1 1 1   16    2  -67 o   43.770   2.4701   78.814   8.7773   52.573   13.625   97.427   11.475   35.181   4.8827   48.598   2.9101 -13.41692 5.684100 
1 1 1   16    2  -66 o   29.117   3.6209   35.501   8.4089   45.389   9.9721   11.167   15.643   32.941   3.7823   18.932   7.2505 14.00879 8.177720 
1 1 1   16    2  -65 o   14.641   5.3008   7.5242   8.1360   5.5233   9.5764   12.716   15.425   14.431   5.6330   19.408   7.2517 -4.977677 9.182508 
1 1 1   16    2  -64 o   18.218   5.4060   14.069   8.6069   13.162   10.147   16.396   16.251   18.052   5.9485   20.951   7.5037 -2.898607 9.575459 
1 1 1   16    2  -63 o   51.659   2.5200  109.564   10.580  118.494   12.710   89.411   19.093   53.664   2.9164   46.088   5.1713 7.575714 5.937011 
1 1 1   16    2  -62 o   41.651   2.5793   71.323   8.7144   71.675   12.092   70.942   12.570   41.585   3.6026   41.337   3.7720 0.2479782 5.215995 
1 1 1   16    2  -61 o   56.911   2.1466  132.617   9.9402  140.544   13.885  124.283   14.237   58.477   2.9220   54.935   3.1931 3.541866 4.328329 
1 1 1   16    2  -60 o   79.166   1.8341  256.003   11.836  241.863   16.220  272.108   17.310   76.821   2.5939   81.485   2.6095 -4.664307 3.679355 
1 1 1   16    2  -59 o   78.853   1.8380  253.950   11.814  265.869   16.351  240.931   17.088   80.574   2.4925   76.660   2.7390 3.914299 3.703354 
1 1 1   16    2  -58 o   39.796   2.7850   65.152   8.9775   52.381   12.331   79.555   13.095   35.395   4.3664   43.855   3.6976 -8.459454 5.721697 
1 1 1   16    2  -57 o  107.356   1.6557  470.452   14.489  481.574   19.849  457.765   21.200  108.550   2.2432  105.803   2.4581 2.746613 3.327827 
1 1 1   16    2  -56 o  124.368   1.6158  631.277   16.381  631.413   22.244  631.116   24.213  124.310   2.1952  124.252   2.3906 0.5834961E-01 3.245562 
1 1 1   16    2  -55 o   61.503   2.0230  154.652   10.128  145.639   13.996  164.562   14.676   59.584   2.8903   63.351   2.8492 -3.766842 4.058507 
1 1 1   16    2  -54 o   56.025   1.9213  128.304   8.7615  109.089   13.647  141.777   11.428   51.503   3.2675   58.851   2.3870 -7.348938 4.046563 
1 1 1   16    2  -53 o  115.937   1.6027  548.472   15.146  548.127   25.473  548.660   18.838  115.776   2.6991  115.920   1.9937 -0.1433792 3.355597 
1 1 1   16    2  -52 o  135.642   1.6044  750.731   17.739  730.674   29.148  762.530   22.356  133.685   2.6748  136.661   2.0069 -2.976181 3.343982 
1 1 1   16    2  -51 o   36.542   3.2514   55.091   9.5841   78.807   19.815   47.849   10.950   43.311   5.7549   33.914   4.0404 9.397102 7.031669 
1 1 1   16    2  -50 o   68.753   2.1442  193.205   12.002  182.428   23.134  197.174   14.040   66.522   4.2892   69.424   2.4849 -2.901993 4.957000 
1 1 1   16    2  -49 o   31.480   3.4356   41.051   8.6729   36.577   13.997   43.840   11.050   29.222   6.0745   32.405   4.2883 -3.182808 7.435676 
1 1 1   16    2  -48 o  101.833   1.7235  423.132   14.307  422.071   21.599  423.962   19.097  101.598   2.6102  101.888   2.2993 -0.2900772 3.478515 
1 1 1   16    2  -47 o   89.186   1.6682  324.522   12.128  324.603   17.214  324.442   17.089   89.120   2.3717   89.099   2.3549 0.2036285E-01 3.342236 
1 1 1   16    2  -46 o   93.250   1.5707  354.719   11.939  350.823   17.968  357.799   15.976   92.654   2.3810   93.623   2.0934 -0.9686279 3.170382 
1 1 1   16    2  -45 o  114.199   1.5197  531.945   14.147  521.455   20.990  540.676   19.151  113.012   2.2785  115.096   2.0412 -2.083817 3.059077 
1 1 1   16    2  -44 o  119.237   1.7615  580.051   17.121  563.311   24.827  595.230   23.641  117.435   2.5935  120.735   2.4021 -3.299904 3.535033 
1 1 1   16    2  -43 o   32.911   3.7433   44.904   9.8641   36.893   14.856   51.222   13.192   29.345   6.3919   35.016   4.7436 -5.671194 7.959737 
1 1 1   16    2  -42 o  110.810   1.6145  500.845   14.584  493.294   23.547  505.543   18.575  109.899   2.6285  111.301   2.0473 -1.401848 3.331730 
1 1 1   16    2  -41 o  129.661   1.6149  685.738   17.069  659.515   27.055  703.078   21.999  127.079   2.6118  131.259   2.0561 -4.179733 3.323991 
1 1 1   16    2  -40 o  185.943   1.7062  1410.35   25.861  1382.03   40.269  1430.24   33.738  183.954   2.6855  187.197   2.2110 -3.243408 3.478589 
1 1 1   16    2  -39 o  105.268   1.7923  452.054   15.380  419.254   30.184  463.556   17.874  101.168   3.6663  106.584   2.0573 -5.416130 4.204026 
1 1 1   16    2  -38 o   72.930   1.8374  217.115   10.914  232.226   18.570  209.141   13.490   75.330   3.0304   71.545   2.3162 3.785408 3.814193 
1 1 1   16    2  -37 o   44.199   2.3462   79.959   8.4227   92.027   13.092   71.436   11.002   47.324   3.4168   41.681   3.2640 5.642632 4.725336 
1 1 1   16    2  -36 f   27.941   3.5553   32.429   7.9142   26.757   12.034   36.753   10.506   25.015   5.9823   29.625   4.4912 -4.610353 7.480603 
1 1 1   16    2  -35 o   81.517   1.7898  271.045   11.893  270.761   16.058  271.390   17.700   81.412   2.4225   81.487   2.6682 -0.7463074E-01 3.603854 
1 1 1   16    2  -34 o   95.248   1.7281  370.021   13.417  368.663   18.028  371.707   20.087   95.046   2.3269   95.389   2.5858 -0.3424911 3.478600 
1 1 1   16    2  -33 o   70.492   2.0125  202.883   11.553  205.788   14.166  197.113   19.963   70.966   2.4525   69.354   3.5428 1.611847 4.308838 
1 1 1   16    2  -32 o  153.341   1.6779  958.938   20.972  956.087   25.176  965.401   37.911  153.091   2.0174  153.749   3.0249 -0.6576538 3.635946 
1 1 1   16    2  -31 o  149.430   1.6253  910.607   19.797  909.495   26.834  911.935   29.326  149.303   2.2049  149.489   2.4066 -0.1852417 3.263955 
1 1 1   16    2  -30 o  169.548   1.7854  1172.41   24.676  1185.26   35.905  1160.91   33.969  170.412   2.5848  168.662   2.4708 1.749725 3.575723 
1 1 1   16    2  -29 o   56.005   2.4400  128.235   11.112  119.740   16.850  134.773   14.783   53.984   3.8545   57.358   3.1741 -3.373734 4.993227 
1 1 1   16    2  -28 o  113.383   1.9436  524.362   17.963  508.808   28.859  534.200   22.952  111.573   3.1764  114.415   2.4609 -2.842590 4.018139 
1 1 1   16    2  -27 o  141.045   1.8503  811.369   21.273  767.338   31.422  848.625   28.904  137.102   2.8116  144.209   2.4588 -7.106094 3.735094 
1 1 1   16    2  -26 o  309.210   2.2608  3900.85   56.983  3880.24   75.959  3927.37   86.178  308.268   3.0229  310.057   3.4097 -1.789063 4.556730 
1 1 1   16    2  -25 o  170.062   1.8330  1179.55   25.410  1102.29   42.491  1222.56   31.704  164.288   3.1729  173.105   2.2468 -8.817520 3.887867 
1 1 1   16    2  -24 o  228.731   1.7723  2133.66   33.045  2190.73   48.316  2083.51   45.295  231.691   2.5583  225.961   2.4591 5.729691 3.548524 
1 1 1   16    2  -23 o   76.160   1.8373  236.562   11.406  233.895   17.178  238.665   15.254   75.646   2.7906   76.439   2.4513 -0.7931900 3.714365 
1 1 1   16    2  -22 o  221.093   1.7320  1993.45   31.214  2044.70   45.749  1948.81   42.695  223.847   2.5073  218.546   2.3966 5.300812 3.468433 
1 1 1   16    2  -21 o   33.472   3.2580   46.185   8.7770   62.768   13.691   34.616   11.436   38.928   4.3912   28.652   5.0825 10.27603 6.716714 
1 1 1   16    2  -20 o  176.353   1.5832  1268.16   22.759  1258.36   32.868  1277.19   31.544  175.625   2.2959  176.942   2.1870 -1.316986 3.170801 
1 1 1   16    2  -19 o  188.893   1.6120  1454.94   24.821  1514.96   36.602  1403.83   33.773  192.700   2.3302  185.505   2.2335 7.195160 3.227702 
1 1 1   16    2  -18 o  105.247   1.7782  451.726   15.255  447.544   21.921  455.653   21.244  104.726   2.5678  105.675   2.4662 -0.9494781 3.560300 
1 1 1   16    2  -17 o  110.977   1.8955  502.292   17.147  519.704   22.671  479.020   26.211  112.859   2.4644  108.284   2.9723 4.574966 3.861039 
1 1 1   16    2  -16 o  322.401   2.3071  4240.45   60.631  4211.76   80.111  4278.91   92.765  321.194   3.0598  323.658   3.5161 -2.463928 4.661026 
1 1 1   16    2  -15 o  110.314   1.6570  496.222   14.900  478.522   20.107  517.781   22.191  108.305   2.2775  112.654   2.4165 -4.348679 3.320654 
1 1 1   16    2  -14 o  170.343   1.6671  1183.22   23.148  1170.27   31.069  1199.38   34.706  169.374   2.2503  171.452   2.4833 -2.077316 3.351205 
1 1 1   16    2  -13 o  164.437   1.5332  1102.51   20.551  1080.32   29.442  1123.58   28.699  162.738   2.2194  165.970   2.1213 -3.232620 3.070132 
1 1 1   16    2  -12 o   51.680   2.2567  109.158   9.4839  143.212   16.144   91.214   11.719   59.125   3.3636   47.170   3.0644 11.95440 4.550253 
1 1 1   16    2  -11 o  158.677   1.8898  1026.83   24.443  1027.19   39.546  1026.60   31.094  158.627   3.0584  158.630   2.4047 -0.2853394E-02 3.890538 
1 1 1   16    2  -10 o  161.252   1.7342  1060.32   22.796  989.489   38.959  1097.19   28.110  155.688   3.0699  164.012   2.1025 -8.324142 3.720847 
1 1 1   16    2   -9 o  232.649   2.0055  2207.52   38.034  2249.09   67.303  2188.01   46.100  234.664   3.5184  231.581   2.4421 3.083038 4.282917 
1 1 1   16    2   -8 o  115.750   1.5865  546.300   14.969  555.475   23.395  539.939   19.479  116.683   2.4597  115.057   2.0769 1.626526 3.219264 
1 1 1   16    2   -7 o  338.046   2.5580  4662.65   70.486  4619.70   99.323  4706.21  100.046  336.300   3.6232  339.436   3.6158 -3.135712 5.118732 
1 1 1   16    2   -6 o  198.307   2.0219  1603.91   32.683  1594.58   42.634  1617.21   50.899  197.682   2.6458  199.032   3.1373 -1.350082 4.103983 
1 1 1   16    2   -5 o   97.082   2.0397  384.398   16.141  386.374   23.316  382.579   22.368   97.250   2.9446   96.779   2.8385 0.4712143 4.089952 
1 1 1   16    2   -4 o  107.190   1.8374  468.552   16.054  484.055   21.607  449.443   23.988  108.926   2.4335  104.905   2.8077 4.020996 3.715511 
1 1 1   16    2   -3 o   52.309   2.5229  111.899   10.726  101.257   14.644  124.215   15.754   49.656   3.6433   55.036   3.5301 -5.379967 5.073002 
1 1 1   16    2   -2 o   38.778   2.8970   61.713   9.0912   62.249   13.916   61.314   12.008   38.760   4.4872   38.546   3.8742 0.2145042 5.928252 
1 1 1   16    2   -1 o  207.279   2.0486  1752.34   34.614  1755.60   54.913  1750.19   44.587  207.363   3.2487  207.104   2.6411 0.2586365 4.186826 
1 1 1   16    2    0 o   48.256   2.5607   95.280   10.037   95.257   16.401   95.294   12.691   48.090   4.2269   48.203   3.2488 -0.1132698 5.331182 
1 1 1   16    2    1 o  121.147   1.8037  598.500   17.812  625.348   28.895  582.045   22.621  123.784   2.8637  119.449   2.3232 4.334976 3.687561 
1 1 1   16    2    2 o  112.665   1.8072  517.629   16.597  537.407   26.862  505.416   21.109  114.714   2.8749  111.308   2.3265 3.405815 3.698306 
1 1 1   16    2    3 o  117.011   1.8009  558.331   17.177  548.250   27.242  564.984   22.130  115.901   2.8835  117.686   2.3069 -1.784660 3.692736 
1 1 1   16    2    4 o  124.493   1.7992  632.013   18.258  606.515   28.754  649.237   23.633  121.903   2.8937  126.156   2.2981 -4.252617 3.695262 
1 1 1   16    2    5 o   35.096   3.5624   50.823   10.051   54.318   18.036   49.248   12.104   35.854   6.4062   34.427   4.4147 1.427723 7.780036 
1 1 1   16    2    6 o  100.391   1.8989  411.016   15.540  368.942   25.572  435.649   19.567   94.999   3.3073  103.340   2.3228 -8.341476 4.041488 
1 1 1   16    2    7 o   41.315   3.0864   70.067   10.319   74.350   18.702   68.193   12.373   42.243   5.5665   40.682   3.7742 1.561031 6.725373 
1 1 1   16    2    8 o   48.646   2.7824   96.890   10.987  125.494   19.600   83.782   13.268   55.227   4.3898   45.144   3.6364 10.08353 5.700347 
1 1 1   16    2    9 o  106.445   1.9301  462.092   16.747  431.787   21.438  509.546   26.826  102.871   2.5566  111.691   2.9491 -8.820435 3.902953 
1 1 1   16    2   10 o  124.517   1.8920  632.301   19.204  604.222   24.555  676.521   30.815  121.694   2.4754  128.742   2.9363 -7.047852 3.840506 
1 1 1   16    2   11 o  243.551   2.2692  2419.73   45.050  2383.05   57.742  2476.79   72.019  241.627   2.9316  246.243   3.5880 -4.616440 4.633368 
1 1 1   16    2   12 o  104.920   1.7288  448.894   14.786  464.705   21.845  435.526   20.086  106.721   2.5111  103.322   2.3849 3.399406 3.463131 
1 1 1   16    2   13 o   76.425   2.1364  238.428   13.296  226.917   23.044  244.174   16.280   74.425   3.8110   77.313   2.5868 -2.887688 4.606029 
1 1 1   16    2   14 o   96.479   1.7924  379.593   14.096  381.173   20.888  378.271   19.101   96.611   2.6549   96.258   2.4363 0.3536606 3.603372 
1 1 1   16    2   15 o   56.432   2.2756  130.122   10.446  128.686   15.681  131.268   14.006   56.026   3.4504   56.624   3.0458 -0.5974808 4.602399 
1 1 1   16    2   16 o   32.074   3.6355   42.561   9.3375   49.153   14.270   37.626   12.348   34.249   5.2809   29.877   5.2623 4.372847 7.455233 
1 1 1   16    2   17 o  218.734   2.1638  1951.66   38.581  1964.96   50.294  1932.64   60.139  219.414   2.8120  217.532   3.3916 1.882401 4.405688 
1 1 1   16    2   18 o  186.442   2.0354  1417.82   30.933  1420.78   40.246  1413.55   48.355  186.588   2.6461  186.059   3.1882 0.5287323 4.143257 
1 1 1   16    2   19 o  145.208   1.9181  859.960   22.704  872.377   30.264  843.974   34.338  146.215   2.5392  143.787   2.9296 2.428131 3.876893 
1 1 1   16    2   20 o  105.336   1.8088  452.508   15.531  473.693   23.003  434.759   21.055  107.738   2.6193  103.221   2.5024 4.516739 3.622485 
1 1 1   16    2   21 o   85.035   1.9612  294.928   13.594  298.965   20.059  291.499   18.488   85.531   2.8812   84.469   2.6885 1.061111 3.940702 
1 1 1   16    2   22 o  172.882   1.8375  1218.95   25.894  1213.25   37.168  1224.33   36.096  172.417   2.6445  173.210   2.5565 -0.7932587 3.678243 
1 1 1   16    2   23 o  128.481   1.9515  673.299   20.438  666.817   32.814  677.407   26.124  127.785   3.1502  128.842   2.4874 -1.057648 4.013856 
1 1 1   16    2   24 o   50.201   2.8072  103.193   11.441   91.638   16.754  113.292   15.663   47.122   4.4129   52.524   3.6815 -5.401779 5.746957 
1 1 1   16    2   25 o  105.387   1.9167  453.003   16.465  454.686   23.962  451.498   22.663  105.502   2.7887  105.143   2.6464 0.3589325 3.844515 
1 1 1   16    2   26 o  189.160   1.9320  1459.45   29.790  1424.69   42.188  1494.03   42.072  186.819   2.7703  191.319   2.6977 -4.499969 3.866855 
1 1 1   16    2   27 o  111.685   2.1408  508.858   19.490  502.249   25.421  518.282   30.356  110.885   2.8147  112.594   3.3111 -1.709404 4.345766 
1 1 1   16    2   28 o   70.510   2.5306  203.155   14.521  246.410   20.159  156.508   20.935   77.609   3.1934   61.718   4.1860 15.89097 5.265008 
1 1 1   16    2   29 o   37.570   3.9945   58.362   12.046   67.146   17.323   50.137   16.762   40.109   5.4384   34.424   6.2014 5.684940 8.248208 
1 1 1   16    2   30 o  131.605   2.1947  706.629   23.544  695.757   34.587  716.017   32.140  130.510   3.2511  132.420   2.9775 -1.910156 4.408535 
1 1 1   16    2   31 o   48.599   3.4061   96.972   13.408   69.440   20.661  117.000   17.622   40.608   6.4578   53.328   4.0850 -12.72041 7.641315 
1 1 1   16    2   32 o  188.853   2.2876  1455.31   35.216  1436.57   50.641  1472.85   49.007  187.514   3.3131  189.887   3.1661 -2.373230 4.582614 
1 1 1   16    2   33 o   70.702   2.3342  204.209   13.434  204.092   22.710  204.272   16.661   70.527   3.9663   70.668   2.8985 -0.1413269 4.912520 
1 1 1   16    2   34 o  143.982   1.7721  845.554   20.798  887.256   30.889  810.968   28.130  147.429   2.5703  140.959   2.4482 6.470383 3.549659 
1 1 1   16    2   35 o   65.425   2.2584  174.884   12.026  189.431   18.387  164.006   15.899   68.003   3.3270   63.287   3.0913 4.716156 4.541490 
1 1 1   16    2   36 f  174.478   1.8217  1241.80   25.910  1254.88   37.737  1230.13   35.637  175.314   2.6407  173.591   2.5185 1.723114 3.649097 
1 1 1   16    2   37 o  114.335   1.7851  533.237   16.637  506.794   24.203  556.928   22.908  111.407   2.6651  116.808   2.4059 -5.400330 3.590433 
1 1 1   16    2   38 o  127.062   1.7693  658.571   18.325  641.730   26.599  673.786   25.282  125.365   2.6029  128.475   2.4141 -3.109344 3.550064 
1 1 1   16    2   39 o  119.542   1.7683  582.946   17.231  574.893   25.235  589.980   23.585  118.653   2.6091  120.217   2.4068 -1.563797 3.549610 
1 1 1   16    2   40 o  164.913   1.8020  1109.47   24.224  1138.85   35.407  1083.62   33.213  166.998   2.6010  162.910   2.5011 4.088287 3.608436 
1 1 1   16    2   41 o  107.842   1.8034  474.458   15.854  479.991   23.598  469.907   21.403  108.408   2.6704  107.281   2.4475 1.126915 3.622325 
1 1 1   16    2   42 o   34.957   3.5500   50.503   9.9754   46.229   15.456   53.554   13.060   33.010   5.9633   35.851   4.5727 -2.840919 7.514716 
1 1 1   16    2   43 o  175.198   1.8247  1252.33   26.059  1285.93   38.248  1223.22   35.601  177.431   2.6445  173.068   2.5235 4.363174 3.655311 
1 1 1   16    2   44 o   95.540   1.8610  372.445   14.493  349.179   21.386  392.206   19.709   92.395   2.8429   97.969   2.4700 -5.573708 3.766030 
1 1 1   16    2   45 o   84.282   1.9608  289.895   13.471  294.581   20.347  286.238   17.974   84.841   2.9466   83.664   2.6389 1.177231 3.955530 
1 1 1   16    2   46 o  137.306   1.7534  769.226   19.625  769.987   28.768  768.564   26.840  137.288   2.5707  137.182   2.4002 0.1064758 3.516987 
1 1 1   16    2   47 o  125.187   1.9554  639.634   19.954  654.956   26.552  619.750   30.248  126.613   2.5727  123.107   3.0142 3.505409 3.962811 
1 1 1   16    2   48 o  138.880   2.6410  788.200   29.898  798.720   37.061  768.593   50.595  139.708   3.2543  136.714   4.5463 2.994232 5.591018 
1 1 1   16    2   49 o   74.457   3.2207  227.288   19.501  218.570   24.541  242.224   32.123   72.870   4.1487   76.521   5.1805 -3.651009 6.636929 
1 1 1   16    2   50 o  138.283   2.6418  781.562   29.779  777.114   36.742  790.077   50.837  137.786   3.2713  138.593   4.5059 -0.8065338 5.568215 
1 1 1   16    2   51 o   78.971   3.1528  255.638   20.254  255.932   25.484  255.134   33.374   78.884   3.9760   78.500   5.2457 0.3846741 6.582265 
1 1 1   16    2   52 o  144.760   1.7563  855.239   20.725  860.687   30.269  850.431   28.435  145.111   2.5590  144.266   2.4180 0.8450928 3.520640 
1 1 1   16    2   53 o   93.236   1.8384  354.848   13.972  343.658   20.761  364.112   18.890   91.622   2.7830   94.357   2.4580 -2.734978 3.713128 
1 1 1   16    2   54 o  146.694   1.7566  878.359   21.005  864.252   30.586  890.951   28.897  145.388   2.5808  147.648   2.4010 -2.260010 3.524949 
1 1 1   16    2   55 o  116.502   1.8714  554.160   17.772  551.275   28.735  555.946   22.616  115.993   3.0418  116.627   2.3790 -0.6340866 3.861568 
1 1 1   16    2   56 o   88.639   1.8870  320.820   13.634  309.343   20.261  330.318   18.431   86.887   2.8646   89.841   2.5193 -2.954201 3.814835 
1 1 1   16    2   57 o  105.634   1.8141  455.619   15.621  446.098   23.312  463.377   21.044  104.368   2.7425  106.454   2.4251 -2.086090 3.660919 
1 1 1   16    2   58 o   18.448   5.7102   14.113   9.4634   33.149   14.966   1.4292   12.216   27.624   6.7130   14.497   6.0948 13.12623 9.067009 
1 1 1   16    2   59 o   48.789   2.7540   97.776   10.908   98.944   17.201   96.990   14.108   48.796   4.3707   48.459   3.5972 0.3371086 5.660614 
1 1 1   16    2   60 o   88.135   1.9875  317.415   14.279  283.957   21.280  344.819   19.259   83.141   3.1456   91.744   2.5777 -8.603432 4.066898 
1 1 1   16    2   61 o   79.615   2.0299  259.254   13.163  252.070   19.985  264.759   17.494   78.313   3.1370   80.354   2.6746 -2.040703 4.122344 
1 1 1   16    2   62 o   27.265   4.2910   31.421   9.2218   3.5317   14.326   51.152   12.050   16.136   6.6773   34.931   4.3242 -18.79549 7.955199 
1 1 1   16    2   63 o   65.273   2.1372  174.453   11.356  164.992   17.295  181.624   15.056   63.258   3.3661   66.497   2.7838 -3.238235 4.368124 
1 1 1   16    2   64 o   40.845   2.8396   68.771   9.3953   75.034   14.746   64.491   12.190   42.369   4.3304   39.357   3.8487 3.011982 5.793567 
1 1 1   16    2   65 o  113.727   1.7386  528.560   16.118  523.288   23.834  533.003   21.880  112.976   2.5881  114.078   2.3529 -1.102196 3.497771 
1 1 1   16    2   66 o  133.850   1.8653  732.611   20.351  716.423   32.676  742.870   26.012  132.004   3.0368  134.647   2.3700 -2.643341 3.852129 
1 1 1   16    2   67 o  129.517   2.2624  687.255   23.885  677.601   42.568  691.691   28.855  127.792   4.0917  129.782   2.7276 -1.989883 4.917525 
1 1 1   16    2   68 o   63.620   2.5727  166.420   13.315  165.034   23.994  167.036   16.005   62.710   4.7287   63.614   3.0958 -0.9042931 5.651977 
1 1 1   16    2   69 o   70.790   2.4234  205.874   13.964  217.914   25.745  200.856   16.620   72.188   4.3960   69.793   2.9279 2.394585 5.281837 
1 1 1   16    2   70 o   38.260   3.2517   60.869   10.045   56.700   16.566   63.293   12.633   36.142   5.8206   38.813   4.0526 -2.670460 7.092439 
1 1 1   16    2   71 o   50.803   2.4852  106.310   10.260   97.451   17.725  110.774   12.583   48.027   4.5830   51.740   2.9963 -3.712151 5.475562 
1 1 1   16    2   72 o   77.259   1.9281  244.566   12.143  228.898   18.987  255.408   15.795   74.357   3.1396   78.785   2.4625 -4.427460 3.990084 
1 1 1   16    2   73 o   29.294   3.6621   36.206   8.5543   50.616   14.357   28.274   10.652   34.156   5.3304   25.365   5.3217 8.791117 7.532152 
1 1 1   16    2   74 o   28.668   3.6691   34.750   8.3780   25.132   13.779   40.391   10.553   23.620   6.7936   30.740   4.3314 -7.120234 8.056931 
1 1 1   16    2   75 o   15.518   5.5188   9.2108   8.7754 -17.5335   19.523   15.982   9.8237   14.065   6.6194   19.116   5.7994 -5.051272 8.800591 
1 1 1   16    2   76 o   25.195   4.0913   27.286   8.1146   46.988   13.491   16.118   10.157   32.794   5.2216   19.184   5.9121 13.61033 7.887807 
1 1 1   16    2   77 o   15.331   5.1746   9.5892   7.6701   1.4659   12.945   13.984   9.5213   14.504   6.1929   18.007   5.7493 -3.503865 8.450212 
1 1 1   16    2   78 o   22.125   4.6132   21.515   8.0499   22.617   13.510   20.908   10.024   22.315   6.8074   21.562   5.6397 0.7526932 8.840079 
1 1 1   16    2   79 o   13.888   5.3607   5.9972   8.5985  -2.9175   12.677   13.592   11.701   13.181   5.8644   18.167   6.3807 -4.985707 8.666250 
1 1 1   16    2   80 o   35.555   2.8984   52.839   8.3275   54.861   11.495   50.607   12.080   35.839   4.0030   34.230   4.4335 1.608963 5.973263 
1 1 1   16    2   81 o   43.639   2.3420   78.857   8.3006   75.440   11.923   82.071   11.563   42.276   3.4910   44.213   3.2306 -1.936867 4.756469 
1 1 1   16    2   82 o   24.097   3.9341   25.147   7.4614   29.161   11.741   22.427   9.6638   25.245   5.8240   22.244   5.3874 3.000898 7.933672 
1 1 1   16    2   83 o   27.939   3.5581   33.345   7.9199   44.557   14.956   28.976   9.3365   31.155   6.1076   25.612   4.6430 5.543180 7.672037 
1 1 1   16    2   84 o   37.521   2.6993   58.802   8.2007   38.818   19.440   63.129   9.0449   27.951   8.0784   38.820   2.8788 -10.86852 8.576060 
1 1 1   16    2   85 o   20.228   4.3432   18.158   6.9473   37.138   14.472   12.474   7.9194   28.111   6.4524   16.788   5.2281 11.32303 8.304587 
1 1 1   16    2   86 o   58.012   1.7541  138.538   8.2853  151.217   14.153  131.927   10.219   60.105   2.8973   56.440   2.2256 3.665085 3.653451 
1 1 1   16    2   87 f   65.342   1.6577  175.612   8.8223  159.806   14.782  184.357   10.995   61.725   2.9464   66.803   2.0215 -5.078007 3.573212 
1 1 1   16    2   88 o   37.760   2.2898   59.313   7.0148   62.838   11.407   57.169   8.8955   38.263   3.7036   36.808   2.9905 1.455296 4.760235 
1 1 1   16    2   89 o   31.551   2.6614   41.848   6.7812   35.722   11.036   45.563   8.5950   28.082   5.0049   32.686   3.2697 -4.604462 5.978305 
1 1 1   16    2   90 o   36.851   2.5833   56.974   7.7109   51.433   11.195   61.975   10.636   34.281   4.0864   38.017   3.4704 -3.735962 5.361227 
1 1 1   16    2   91 o   59.094   1.8849  144.466   9.0678  139.379   13.144  149.085   12.526   57.524   2.8117   59.648   2.5823 -2.123646 3.817544 
1 1 1   16    2   92 o   28.947   3.1896   35.989   7.4018   38.068   11.087   34.318   9.9417   28.855   4.8880   27.543   4.5895 1.312225 6.704942 
1 1 1   16    2   93 o   18.955   4.0954   16.259   6.1427   19.673   10.440   14.452   7.5969   20.084   5.9525   17.564   5.0421 2.520395 7.800978 
1 1 1   16    2   94 o   18.101   4.2354   15.002   6.1378   15.550   10.392   14.708   7.6061   18.001   6.0229   17.657   5.0376 0.3432789 7.851902 
1 1 1   16    2   95 o   24.533   3.1938   26.153   6.2355   27.181   10.776   25.635   7.6456   23.581   5.6749   23.841   4.0807 -0.2600460 6.989807 
1 1 1   16    2   96 o   6.9937   3.4197 -11.1345   6.4792  -4.4778   9.2791 -17.4679   9.0510   10.351   4.7658   7.8917   3.8948 2.459163 6.154882 
1 1 1   16    2   97 o   15.685   5.2420   11.582   7.8725   12.941   9.7779   9.0761   13.274   16.492   5.8293   15.677   6.4514 0.8143711 8.694926 
1 1 1   16    2   98 o   28.304   3.8024   35.959   8.5512   38.318   10.266   30.611   15.456   28.701   4.5385   23.255   7.3129 5.446135 8.606759 
1 1 1   16    2   99 o   14.156   5.2503   8.7537   8.0571   8.6073   9.5923   9.1044   14.848   14.447   5.6381   15.843   6.6930 -1.396197 8.751297 
1 1 1   16    2  100 o   17.914   5.2932   15.993   8.2656   24.108   9.8283  -3.6146   15.277   21.863   5.5160   13.112   6.0648 8.751169 8.198057 
1 1 1   16    2  101 o   12.655   5.5465   2.0679   10.942  -3.6151   15.698   7.4380   15.260   13.227   6.1284   15.388   6.6490 -2.160869 9.042434 
1 1 1   16    2  102 o   10.245   4.8538  -8.2954   10.824  -3.9792   15.546 -12.3564   15.079   13.063   6.0683   11.582   5.5538 1.480846 8.226107 
1 1 1   16    2  103 o   16.703   6.2085   14.127   11.278   34.122   16.397  -3.8231   15.536   23.735   7.5410   13.031   6.0580 10.70395 9.672932 
1 1 1   16    2  104 o   39.227   4.0261   70.532   12.691   65.768   18.246   74.997   17.665   34.783   6.6781   38.293   5.8440 -3.509644 8.874127 
1 1 1   16    2  105 o   23.848   6.1374   30.551   12.000   16.596   17.017   44.355   16.925   17.705   7.2973   27.330   7.4116 -9.624640 10.40108 
1 1 1   16    2  106 f   20.174   6.3662   22.621   11.703   9.9432   16.730   34.771   16.378   15.957   6.9281   23.706   7.5372 -7.749726 10.23758 
1 1 1   16    2  107 o   10.987   5.1387  -5.3602   11.454  -7.6773   16.343  -3.1235   16.057   12.541   5.9482   13.158   6.1309 -0.6171331 8.542204 
1 1 1   16    2  108 o   16.025   6.5054   12.467   13.272   9.2790   16.374   18.572   22.660   15.628   6.8187   18.174   7.9733 -2.546659 10.49131 
1 1 1   16    2  109 o   22.411   6.9538   29.956   14.025   32.305   17.594   25.864   23.226   22.089   7.8185   19.515   8.3127 2.574909 11.41179 
1 1 1   16    2  110 o   19.919   7.4867   25.349   16.492   39.195   24.703   14.216   22.151   22.147   8.9165   17.162   7.6857 4.984358 11.77170 
1 1 1   16    2  111 o   18.944   7.4292   22.516   16.722   14.939   24.995   28.655   22.498   17.428   7.9483   19.982   8.3266 -2.553684 11.51120 
1 1 1   16    2  112 o   17.392   7.2318   17.003   16.918 -22.4483   24.186   54.804   23.675   13.050   6.4264   26.637   9.0900 -13.58686 11.13225 
1 1 1   16    3 -110 o   16.205   6.8227   12.966   15.344  -1.2254   19.129   38.577   25.697   14.111   6.6129   21.664   8.9518 -7.553555 11.12944 
1 1 1   16    3 -109 o   11.022   5.3329 -13.2390   14.664 -15.1669   18.363  -9.8452   24.364   12.100   5.8808   14.213   6.8761 -2.113109 9.047912 
1 1 1   16    3 -108 o   11.211   5.3991 -11.7018   14.609 -27.9106   17.964   19.953   25.105   10.728   5.3284   18.189   8.1610 -7.461577 9.746490 
1 1 1   16    3 -107 o   18.868   7.2204   21.715   15.506   21.153   19.735   22.622   25.066   18.488   7.7580   18.749   8.2991 -0.2611504 11.36052 
1 1 1   16    3 -106 o   14.853   6.5321   6.9912   15.293  -6.5740   19.102   31.212   25.524   13.468   6.4004   20.464   8.7157 -6.996239 10.81331 
1 1 1   16    3 -105 o   13.081   6.0828  -2.6556   15.682  -5.2509   29.209  -1.6046   18.589   15.747   7.5963   14.078   6.5719 1.668942 10.04461 
1 1 1   16    3 -104 o   15.517   6.7126   9.1622   15.590   17.686   28.025   5.3424   18.760   18.377   8.3943   15.332   6.9504 3.044881 10.89830 
1 1 1   16    3 -103 o   14.493   6.4451   4.7558   15.294  -2.3946   27.256   8.0415   18.476   15.883   7.5753   15.848   7.0636 0.3474045E-01 10.35758 
1 1 1   16    3 -102 o   16.247   6.8553   11.655   15.544 -15.8005   27.217   24.945   18.936   14.621   7.1184   19.955   7.8813 -5.333916 10.62014 
1 1 1   16    3 -101 f   23.286   8.3201   36.393   19.968   60.650   29.340   15.463   27.254   26.943   10.014   18.299   8.3276 8.643869 13.02429 
1 1 1   16    3 -100 o   14.061   6.1194   4.8500   13.116  -2.9439   18.075   13.518   19.062   13.987   6.5132   17.294   7.4518 -3.306884 9.896989 
1 1 1   16    3  -99 o   16.551   6.5316   13.122   12.996   29.070   18.184  -3.5298   18.581   21.637   7.9110   14.111   6.5816 7.526094 10.29091 
1 1 1   16    3  -98 o   17.089   6.5381   14.598   12.712   9.4427   17.438   20.444   18.571   16.302   7.0757   19.139   7.7220 -2.836292 10.47353 
1 1 1   16    3  -97 o   19.199   6.5998   19.846   12.486   5.1233   17.115   36.594   18.255   15.362   6.8255   24.400   7.9754 -9.038458 10.49735 
1 1 1   16    3  -96 o   21.303   6.6765   24.698   12.894   31.491   18.141   17.763   18.330   22.794   7.9491   18.623   7.6131 4.170790 11.00673 
1 1 1   16    3  -95 o   11.396   5.3346  -6.9870   12.387 -11.2476   17.531  -2.7388   17.505   12.871   6.1209   14.170   6.5322 -1.299183 8.951792 
1 1 1   16    3  -94 o   11.458   5.3165  -5.6911   11.881 -29.0918   16.763   17.926   16.841   10.594   5.2415   18.904   7.4429 -8.310614 9.103274 
1 1 1   16    3  -93 o   29.452   5.4801   41.723   12.672   38.488   17.606   45.202   18.254   26.206   7.7205   28.555   7.6773 -2.348593 10.88796 
1 1 1   16    3  -92 o   18.930   6.1401   17.718   10.831   11.341   13.882   27.638   17.314   16.754   6.7053   22.429   7.7690 -5.674908 10.26249 
1 1 1   16    3  -91 o   16.681   6.0601   12.542   10.646   20.249   13.918   1.6766   16.526   20.034   6.9642   15.103   6.7091 4.930430 9.670159 
1 1 1   16    3  -90 o   21.431   5.8169   22.328   10.420   26.711   13.521   15.918   16.351   22.901   6.7707   18.842   7.3589 4.058815 9.999842 
1 1 1   16    3  -89 o   12.535   5.0338   4.4826   7.8512   19.031   12.963  -3.9452   9.8666   19.792   6.7269   10.980   5.0021 8.812068 8.382855 
1 1 1   16    3  -88 o   41.642   2.9320   73.404   9.8888   53.618   18.625   81.172   11.670   32.657   7.1912   43.582   3.3096 -10.92421 7.916255 
1 1 1   16    3  -87 o   17.706   5.1534   14.432   7.8855   17.873   12.708   12.278   10.056   19.506   6.6597   16.773   5.9130 2.733328 8.905934 
1 1 1   16    3  -86 o   45.491   2.4875   86.418   9.1892   75.728   14.604   93.424   11.823   41.546   4.3778   46.996   3.1037 -5.450035 5.366388 
1 1 1   16    3  -85 o   33.476   3.1548   47.544   8.5073   55.472   13.969   42.869   10.726   35.204   5.0089   31.243   4.3277 3.961308 6.619526 
1 1 1   16    3  -84 o   31.054   3.6181   41.395   8.9874   35.086   16.915   43.876   10.609   26.588   7.4878   31.712   4.2077 -5.124218 8.589087 
1 1 1   16    3  -83 o   22.799   4.7873   23.350   8.6133   1.3746   15.700   32.812   10.302   15.365   6.6909   27.110   4.8395 -11.74450 8.257695 
1 1 1   16    3  -82 o   51.329   2.7284  109.962   11.375   96.586   18.228  118.493   14.557   46.938   4.8330   52.957   3.3901 -6.018867 5.903481 
1 1 1   16    3  -81 f   16.868   5.5425   12.383   8.8113   22.375   14.779   6.8726   10.975   21.888   7.1773   15.104   5.9891 6.784576 9.347871 
1 1 1   16    3  -80 o   35.437   3.5779   53.412   10.194   34.042   14.045   74.974   14.819   26.951   6.4744   41.608   4.4375 -14.65755 7.849185 
1 1 1   16    3  -79 o   59.775   1.9311  147.177   9.3972  151.668   11.020  135.205   17.992   60.574   2.2356   56.359   3.9413 4.215042 4.531187 
1 1 1   16    3  -78 o   21.990   3.8004   20.925   6.5660   17.479   8.1590   27.260   11.061   19.732   5.0515   24.483   5.6563 -4.751181 7.583628 
1 1 1   16    3  -77 o   44.187   2.1004   80.575   7.5436   84.760   10.112   75.323   11.328   45.121   2.7624   42.330   3.3094 2.791164 4.310838 
1 1 1   16    3  -76 o   40.999   2.2315   69.469   7.4298   67.862   9.7632   71.681   11.452   40.300   2.9934   41.266   3.4358 -0.9663048 4.556847 
1 1 1   16    3  -75 o   69.606   2.3611  200.010   13.377  198.726   17.633  201.751   20.533   69.046   3.1412   69.304   3.6474 -0.2579117 4.813608 
1 1 1   16    3  -74 o   53.739   2.1164  118.935   9.2530  121.013   10.839  113.352   17.768   54.108   2.4639   51.652   4.2579 2.455799 4.919403 
1 1 1   16    3  -73 o   26.382   3.6959   29.624   7.7304   34.368   8.9049   15.114   15.574   28.368   3.9585   19.750   7.3042 8.618507 8.307884 
1 1 1   16    3  -72 o   35.782   2.8808   53.293   8.3316   47.057   9.6057   72.238   16.741   33.415   3.5824   40.862   5.1396 -7.446125 6.264920 
1 1 1   16    3  -71 o   95.779   1.5763  375.473   12.307  372.604   16.550  379.022   18.406   95.246   2.1317   95.983   2.3525 -0.7365112 3.174624 
1 1 1   16    3  -70 o   77.032   1.6682  242.929   10.475  241.266   14.083  244.988   15.673   76.594   2.2580   77.107   2.4969 -0.5125198 3.366468 
1 1 1   16    3  -69 o   27.156   3.2491   30.944   7.0498   22.291   9.3903   42.120   10.672   22.508   5.2197   31.458   4.2721 -8.949871 6.745078 
1 1 1   16    3  -68 o   11.858   4.6483   3.6565   6.5439  -4.4539   8.6359   14.593   10.028   10.419   4.7203   18.549   5.8979 -8.129530 7.554240 
1 1 1   16    3  -67 o   21.040   4.3108   19.123   7.1446   28.295   9.8530   8.9532   10.375   25.548   4.9096   16.081   5.9591 9.467133 7.721073 
1 1 1   16    3  -66 o   59.166   1.9681  143.518   9.4786  142.626   13.543  144.374   13.271   58.796   2.8340   59.175   2.7588 -0.3786430 3.955107 
1 1 1   16    3  -65 o  120.972   1.6442  598.319   16.214  603.885   22.891  592.715   22.968  121.348   2.3142  120.210   2.3440 1.137123 3.293906 
1 1 1   16    3  -64 o   49.061   2.1796   98.799   8.6946   97.207   12.163  100.462   12.433   48.489   3.0934   49.294   3.1101 -0.8044395 4.386573 
1 1 1   16    3  -63 o   35.677   2.7783   52.597   8.0162   42.940   11.202   62.731   11.476   31.854   4.4344   38.799   3.6722 -6.945169 5.757516 
1 1 1   16    3  -62 o   91.891   1.6920  345.101   12.674  338.516   17.950  351.648   17.899   90.847   2.4260   92.607   2.3730 -1.759186 3.393648 
1 1 1   16    3  -61 o   44.398   2.3498   80.959   8.4737   89.107   11.866   72.482   12.104   46.447   3.1529   41.782   3.5887 4.665226 4.776972 
1 1 1   16    3  -60 o   63.818   1.8978  166.642   9.8615  154.761   13.418  180.599   14.543   61.377   2.6884   66.310   2.6961 -4.933388 3.807431 
1 1 1   16    3  -59 o   59.616   2.0063  145.481   9.7357  153.342   13.476  136.899   14.080   61.099   2.7126   57.672   3.0055 3.427628 4.048567 
1 1 1   16    3  -58 o   67.407   1.7221  185.724   9.4544  186.995   14.335  184.746   12.578   67.511   2.6099   67.153   2.3011 0.3583755 3.479433 
1 1 1   16    3  -57 o   69.786   1.7337  198.920   9.8624  185.142   14.846  209.803   13.195   67.167   2.7172   71.580   2.2642 -4.413231 3.536887 
1 1 1   16    3  -56 o   57.640   2.2181  136.062   10.403  147.392   14.371  123.592   15.077   59.888   2.9529   54.751   3.3950 5.136768 4.499530 
1 1 1   16    3  -55 o   53.275   2.1426  116.205   9.2857  125.203   14.425  109.838   12.134   55.150   3.2227   51.695   2.8911 3.454563 4.329452 
1 1 1   16    3  -54 o   97.011   1.7143  384.254   13.556  386.422   23.519  383.176   16.589   97.066   2.9759   96.831   2.1017 0.2344742 3.643285 
1 1 1   16    3  -53 o   59.267   2.1323  143.722   10.285  130.587   18.846  149.293   12.274   56.179   4.1446   60.363   2.4998 -4.183857 4.840116 
1 1 1   16    3  -52 f  147.915   1.6389  893.033   19.761  966.802   33.578  853.948   24.441  153.714   2.6798  144.578   2.0739 9.136215 3.388589 
1 1 1   16    3  -51 o   22.153   4.2047   20.840   7.3151   11.608   11.717   26.736   9.3641   17.919   6.3766   25.062   4.7576 -7.143427 7.955876 
1 1 1   16    3  -50 o   45.931   2.2922   86.424   8.5549   85.270   12.694   87.383   11.579   45.476   3.4502   46.090   3.1001 -0.6135368 4.638348 
1 1 1   16    3  -49 o   80.055   1.6161  261.533   10.546  260.504   15.933  262.335   14.068   79.795   2.4525   80.110   2.1563 -0.3148651 3.265663 
1 1 1   16    3  -48 o   20.351   4.5569   17.707   7.3712   6.4443   11.451   25.676   9.6322   15.803   6.1623   24.527   4.9879 -8.723639 7.927990 
1 1 1   16    3  -47 o  101.111   1.5187  417.110   12.518  420.811   18.865  414.198   16.732  101.494   2.2802  100.717   2.0380 0.7773285 3.058222 
1 1 1   16    3  -46 o   67.158   1.7762  184.201   9.7151  174.089   14.794  191.868   12.882   65.188   2.7905   68.495   2.3105 -3.306793 3.622932 
1 1 1   16    3  -45 o   50.773   2.3777  105.544   9.8134   92.617   15.093  115.011   12.916   47.357   3.9456   52.938   3.0056 -5.581173 4.959967 
1 1 1   16    3  -44 o   85.104   1.8238  295.584   12.652  270.992   18.881  315.627   17.046   81.359   2.8513   87.868   2.3820 -6.509354 3.715386 
1 1 1   16    3  -43 o  104.406   1.7318  444.799   14.739  446.756   21.978  443.199   19.869  104.561   2.5785  104.168   2.3400 0.3932648 3.482000 
1 1 1   16    3  -42 o   55.124   2.4004  124.351   10.760  134.226   15.898  116.004   14.617   57.159   3.4278   53.127   3.3929 4.031620 4.823033 
1 1 1   16    3  -41 o   38.500   2.9553   60.961   9.2040   55.554   13.084   66.257   12.950   36.516   4.4901   40.002   4.0260 -3.486031 6.030781 
1 1 1   16    3  -40 o   92.448   1.5952  348.656   12.022  352.943   18.228  345.355   15.993   92.931   2.4083   91.977   2.1330 0.9534225 3.217144 
1 1 1   16    3  -39 o  149.149   1.5291  907.384   18.590  879.110   26.989  932.911   25.644  146.738   2.2563  151.181   2.0809 -4.443085 3.069384 
1 1 1   16    3  -38 f   77.369   1.8874  244.257   11.903  230.687   16.470  259.095   17.223   75.095   2.6950   79.594   2.6583 -4.498978 3.785420 
1 1 1   16    3  -37 o   93.919   1.7477  359.862   13.380  333.344   18.320  390.177   19.588   90.313   2.4910   97.717   2.4611 -7.404526 3.501731 
1 1 1   16    3  -36 o   54.579   2.5609  121.924   11.362  119.767   18.082  123.331   14.605   53.908   4.1466   54.820   3.2834 -0.9120102 5.289203 
1 1 1   16    3  -35 o   77.203   1.9028  243.192   11.974  233.861   16.657  253.171   17.226   75.617   2.7067   78.682   2.6897 -3.065407 3.815901 
1 1 1   16    3  -34 o  110.552   1.6162  498.508   14.564  510.066   24.292  492.022   18.198  111.752   2.6667  109.806   2.0331 1.946259 3.353338 
1 1 1   16    3  -33 f   53.757   2.0503  118.096   8.9679  118.697   13.834  117.660   11.778   53.795   3.1688   53.605   2.7041 0.1901474 4.165767 
1 1 1   16    3  -32 f   28.381   3.5207   33.445   7.9706   21.080   12.325   42.335   10.450   22.357   6.4234   31.893   4.1155 -9.535511 7.628737 
1 1 1   16    3  -31 o   62.441   1.8817  159.207   9.5665  150.660   14.478  165.831   12.746   60.656   2.9368   63.686   2.4598 -3.029865 3.830840 
1 1 1   16    3  -30 o   75.427   1.7322  232.066   10.651  220.908   16.027  240.891   14.253   73.502   2.6795   76.792   2.2794 -3.289833 3.517908 
1 1 1   16    3  -29 o  308.677   2.0906  3887.84   52.603  3814.04   74.108  3962.77   74.679  305.557   2.9753  311.465   2.9414 -5.908539 4.183821 
1 1 1   16    3  -28 o  205.664   1.6659  1725.15   27.928  1718.63   40.270  1731.20   38.766  205.196   2.4076  205.957   2.3091 -0.7611847 3.335892 
1 1 1   16    3  -27 o  117.862   1.6561  566.558   15.911  566.819   21.729  566.256   23.364  117.854   2.2618  117.784   2.4334 0.7023621E-01 3.322240 
1 1 1   16    3  -26 o  177.607   1.8111  1286.67   26.221  1254.52   36.821  1319.75   37.348  175.303   2.5767  179.806   2.5482 -4.502914 3.623888 
1 1 1   16    3  -25 o   95.698   1.8449  373.562   14.391  351.530   20.511  394.926   20.198   92.751   2.7158   98.330   2.5220 -5.579834 3.706198 
1 1 1   16    3  -24 o   75.768   2.0210  234.368   12.471  251.514   18.631  220.450   16.786   78.425   2.9195   73.425   2.8098 5.000206 4.051956 
1 1 1   16    3  -23 o  133.509   1.7650  726.991   19.209  718.566   27.600  734.905   26.750  132.682   2.5519  134.190   2.4455 -1.508057 3.534511 
1 1 1   16    3  -22 o  286.107   2.0005  3339.22   46.656  3351.02   67.147  3328.21   64.875  286.477   2.8754  285.516   2.7875 0.9609680 4.004727 
1 1 1   16    3  -21 o  207.193   1.7881  1750.88   30.199  1702.36   46.244  1786.95   39.877  204.202   2.7782  209.265   2.3377 -5.062866 3.630823 
1 1 1   16    3  -20 o   63.590   2.0628  165.133   10.678  165.283   16.805  165.031   13.829   63.527   3.2560   63.528   2.6765 -0.1178741E-02 4.214905 
1 1 1   16    3  -19 o  146.619   1.5820  876.629   18.907  891.062   27.860  864.306   25.743  147.777   2.3128  145.551   2.1697 2.225815 3.171234 
1 1 1   16    3  -18 o  110.681   1.7424  499.604   15.720  489.623   21.927  510.159   22.549  109.536   2.4558  111.809   2.4741 -2.272408 3.485957 
1 1 1   16    3  -17 o  168.467   1.7380  1157.45   23.867  1132.97   32.414  1186.44   35.272  166.630   2.3864  170.504   2.5378 -3.874008 3.483584 
1 1 1   16    3  -16 o  102.881   1.9952  431.750   16.733  420.484   26.258  439.453   21.712  101.417   3.1801  103.768   2.5669 -2.350204 4.086839 
1 1 1   16    3  -15 o   73.281   2.8503  219.566   16.994  228.272   30.115  215.498   20.585   74.485   4.9887   72.541   3.4914 1.944626 6.089106 
1 1 1   16    3  -14 o  193.557   2.1281  1528.34   33.577  1710.78   58.610  1439.22   40.966  204.620   3.5139  187.778   2.6763 16.84258 4.417026 
1 1 1   16    3  -13 f  171.166   1.7577  1194.86   24.525  1193.68   33.772  1196.17   35.672  171.034   2.4224  171.200   2.5561 -0.1667175 3.521609 
1 1 1   16    3  -12 o   98.000   1.8629  391.710   14.882  381.643   21.197  401.494   20.898   96.658   2.6930   99.150   2.5879 -2.492226 3.734885 
1 1 1   16    3  -11 o  249.769   2.0014  2544.71   40.748  2579.37   55.410  2503.89   60.131  251.380   2.7041  247.635   2.9788 3.744354 4.023146 
1 1 1   16    3  -10 o  240.498   1.9602  2359.23   38.428  2372.22   52.082  2343.70   56.932  241.082   2.6502  239.592   2.9151 1.489563 3.939723 
1 1 1   16    3   -9 o   98.278   1.8086  393.914   14.488  406.927   20.829  381.717   20.167   99.822   2.5619   96.678   2.5612 3.143570 3.622636 
1 1 1   16    3   -8 o   71.084   1.9609  206.262   11.352  199.199   17.635  211.259   14.834   69.774   3.1084   71.905   2.5347 -2.130753 4.010834 
1 1 1   16    3   -7 o   60.271   2.1442  148.379   10.518  140.185   16.378  154.131   13.721   58.477   3.4512   61.388   2.7490 -2.911003 4.412249 
1 1 1   16    3   -6 o  187.479   1.6489  1433.33   25.199  1448.20   36.928  1420.38   34.472  188.391   2.4047  186.586   2.2665 1.805832 3.304444 
1 1 1   16    3   -5 f   53.849   2.4071  118.557   10.539  112.886   17.849  121.592   13.059   52.368   4.2169   54.493   2.9508 -2.125172 5.146798 
1 1 1   16    3   -4 o  159.400   1.6751  1036.15   21.765  977.651   33.581  1078.53   28.581  154.770   2.6618  162.598   2.1564 -7.827881 3.425657 
1 1 1   16    3   -3 o  141.006   1.5718  810.760   18.066  755.850   25.940  862.480   25.176  136.107   2.3381  145.405   2.1241 -9.297592 3.158830 
1 1 1   16    3   -2 o  113.141   1.8791  522.095   17.330  531.705   26.725  515.123   22.765  114.089   2.8760  112.354   2.4857 1.734596 3.801299 
1 1 1   16    3   -1 o  115.183   2.0118  541.159   18.889  551.100   32.572  536.122   23.186  116.096   3.4456  114.622   2.4816 1.474472 4.246244 
1 1 1   16    3    0 o   71.725   2.3898  210.141   13.953  194.955   24.353  217.562   17.024   68.897   4.3587   72.947   2.8685 -4.049332 5.217873 
1 1 1   16    3    1 o   56.761   2.7549  131.814   12.708  123.198   22.992  135.604   15.249   54.587   5.2311   57.529   3.2652 -2.941746 6.166502 
1 1 1   16    3    2 o   86.611   2.1404  306.017   15.112  291.237   20.794  322.561   22.000   84.402   3.0272   88.829   3.0427 -4.427185 4.292124 
1 1 1   16    3    3 o   86.733   1.9350  306.829   13.680  294.615   20.750  316.219   18.194   84.893   3.0033   87.990   2.5393 -3.097908 3.932947 
1 1 1   16    3    4 o  121.083   2.0128  598.027   19.866  573.913   26.145  630.966   30.558  118.579   2.7049  124.311   3.0156 -5.732643 4.050960 
1 1 1   16    3    5 f  153.804   2.0127  964.911   25.234  969.607   33.342  958.614   38.607  154.132   2.6538  153.217   3.0912 0.9143372 4.074064 
1 1 1   16    3    6 o  148.273   2.0145  896.774   24.348  911.133   32.455  878.288   36.825  149.411   2.6648  146.658   3.0803 2.752426 4.073007 
1 1 1   16    3    7 o  213.215   2.1942  1854.64   38.135  1853.21   49.825  1856.64   59.256  213.061   2.8688  213.186   3.4099 -0.1248322 4.456159 
1 1 1   16    3    8 o  159.547   1.8308  1038.19   23.811  1055.38   34.961  1023.31   32.518  160.802   2.6672  158.352   2.5192 2.450119 3.668843 
1 1 1   16    3    9 o   71.240   2.2578  207.268   13.095  203.368   20.103  210.142   17.259   70.464   3.5109   71.681   2.9601 -1.217026 4.592232 
1 1 1   16    3   10 o  161.339   1.9852  1061.78   26.108  1061.95   41.788  1061.67   33.437  161.251   3.1792  161.290   2.5433 -0.3825378E-01 4.071270 
1 1 1   16    3   11 o   32.770   4.5199   44.770   11.753   67.018   19.921   32.892   14.556   39.909   6.3348   27.738   6.5440 12.17126 9.107943 
1 1 1   16    3   12 o  146.658   1.9814  877.327   23.687  928.594   38.773  846.801   29.919  150.789   3.1545  144.046   2.5481 6.743423 4.055043 
1 1 1   16    3   13 f  115.713   2.0291  546.174   19.139  511.975   30.562  568.240   24.549  111.900   3.3543  117.998   2.5523 -6.097824 4.214948 
1 1 1   16    3   14 o   82.417   2.9178  277.674   19.572  170.492   34.983  326.505   23.613   64.026   6.8073   89.350   3.2475 -25.32371 7.542202 
1 1 1   16    3   15 o  151.708   2.0025  938.808   24.764  928.839   39.670  945.173   31.699  150.802   3.2271  152.182   2.5553 -1.380264 4.116282 
1 1 1   16    3   16 o  106.498   2.0765  462.669   18.026  509.811   29.939  435.861   22.577  111.670   3.2926  103.301   2.6834 8.367958 4.247614 
1 1 1   16    3   17 o   34.049   4.1238   48.102   11.213   50.028   17.498   46.760   14.605   34.337   6.4892   33.325   5.5733 1.011852 8.554022 
1 1 1   16    3   18 o  138.437   1.8372  781.652   20.732  771.307   30.293  790.765   28.433  137.462   2.7035  139.200   2.5058 -1.737839 3.686180 
1 1 1   16    3   19 o  172.404   2.0143  1212.46   28.308  1210.87   45.055  1213.50   36.387  172.178   3.2102  172.429   2.5888 -0.2515564 4.123977 
1 1 1   16    3   20 o  175.467   2.3042  1256.28   32.957  1262.28   38.577  1240.06   63.414  175.849   2.6912  174.002   4.4746 1.847748 5.221591 
1 1 1   16    3   21 o  136.417   1.8224  759.019   20.265  770.873   29.657  748.636   27.755  137.423   2.6474  135.436   2.5141 1.986450 3.650956 
1 1 1   16    3   22 o  130.424   1.8145  693.802   19.290  720.420   28.757  672.027   26.010  132.847   2.6556  128.320   2.4867 4.527130 3.638076 
1 1 1   16    3   23 o   93.170   2.1050  354.156   15.987  371.151   22.088  335.457   23.169   95.298   2.8466   90.568   3.1430 4.730194 4.240453 
1 1 1   16    3   24 o  124.604   1.9648  633.363   19.957  618.210   26.888  651.950   29.780  123.057   2.6805  126.353   2.8913 -3.296303 3.942701 
1 1 1   16    3   25 o   45.159   3.5671   83.883   13.024   87.700   20.699   81.380   16.758   45.876   5.6545   44.323   4.7102 1.552792 7.359312 
1 1 1   16    3   26 o  262.621   2.6650  2815.84   57.051  2901.26   83.693  2741.71   77.974  266.326   3.8551  258.937   3.6942 7.389008 5.339384 
1 1 1   16    3   27 o  134.877   1.9298  742.130   21.218  761.890   35.711  731.349   26.378  136.550   3.2083  133.859   2.4175 2.691483 4.017154 
1 1 1   16    3   28 o   22.189   5.6926   20.998   10.346   10.223   18.921   25.594   12.357   20.209   7.9093   24.471   6.1910 -4.262663 10.04420 
1 1 1   16    3   29 o  152.189   1.7788  944.775   22.067  950.562   32.431  939.786   30.114  152.582   2.6074  151.732   2.4347 0.8501434 3.567452 
1 1 1   16    3   30 o   99.624   1.8437  404.883   14.972  409.195   22.731  401.579   19.899  100.056   2.7898   99.182   2.4613 0.8744202 3.720299 
1 1 1   16    3   31 o   46.567   2.7833   88.885   10.517  100.530   16.949   81.595   13.411   49.361   4.2538   44.504   3.7312 4.857403 5.658353 
1 1 1   16    3   32 f   73.774   2.0737  222.272   12.458  235.181   18.979  212.498   16.515   75.799   3.0780   72.071   2.8165 3.728035 4.172158 
1 1 1   16    3   33 f   33.675   3.6656   46.941   9.9000   34.370   15.522   55.562   12.854   28.293   6.8122   36.561   4.4014 -8.267479 8.110442 
1 1 1   16    3   34 o   34.565   3.5301   49.377   9.8070   38.763   15.660   56.226   12.579   30.079   6.5711   36.800   4.2727 -6.721748 7.838105 
1 1 1   16    3   35 o   34.288   3.5916   48.625   9.8897   56.800   15.523   43.039   12.831   36.803   5.3293   31.985   5.0917 4.817726 7.370641 
1 1 1   16    3   36 o   75.662   2.0408  233.793   12.575  219.965   19.419  243.779   16.502   73.272   3.2595   77.212   2.6258 -3.939941 4.185584 
1 1 1   16    3   37 o   26.577   4.6083   29.803   9.6220   32.012   15.379   28.382   12.334   27.296   6.9074   25.735   5.9920 1.560995 9.144183 
1 1 1   16    3   38 f   58.519   2.3926  140.070   11.389  124.752   17.606  151.093   14.935   55.044   3.9500   60.720   3.0270 -5.675793 4.976516 
1 1 1   16    3   39 o  180.773   1.8622  1333.48   27.441  1365.48   40.176  1305.50   37.571  182.811   2.6961  178.770   2.5782 4.041412 3.730409 
1 1 1   16    3   40 o  274.490   2.4604  3077.45   55.051  3131.25   72.879  3005.97   84.008  276.664   3.2316  270.880   3.8046 5.783691 4.991787 
1 1 1   16    3   41 o  104.366   1.8485  444.500   15.726  461.679   23.782  431.154   20.963  106.248   2.7483  102.734   2.5032 3.514282 3.717429 
1 1 1   16    3   42 o   34.705   3.6198   49.860   10.090   51.037   16.301   49.129   12.846   34.678   5.9827   34.260   4.7257 0.4185562 7.623964 
1 1 1   16    3   43 o  106.638   1.9936  464.202   17.330  482.933   30.622  455.377   21.020  108.544   3.4653  105.579   2.4424 2.965302 4.239539 
1 1 1   16    3   44 o   50.323   3.4378  104.178   14.017   56.826   22.387  134.713   17.978   36.237   7.8094   57.190   3.8793 -20.95274 8.719847 
1 1 1   16    3   45 o  112.741   3.0070  520.343   27.610   0.0000   0.0000  520.343   27.610  ?   ?   112.741   3.0070 0.000000 3.007015 
1 1 1   16    3   46 o  219.852   2.8887  1977.02   51.769  1873.70   61.554  2226.72   95.693  213.842   3.5312  232.476   5.0497 -18.63370 6.161898 
1 1 1   16    3   47 o  126.161   1.9056  649.760   19.597  661.938   32.048  642.487   24.767  127.171   3.0916  125.390   2.4232 1.780220 3.928028 
1 1 1   16    3   48 o   91.440   1.9884  341.402   14.821  325.083   24.460  350.870   18.630   89.012   3.3773   92.621   2.4698 -3.608437 4.183984 
1 1 1   16    3   49 o   33.119   4.3901   45.884   11.560   39.627   16.945   51.332   15.811   30.242   7.0108   34.769   5.7819 -4.526886 9.087465 
1 1 1   16    3   50 o   21.814   6.0934   20.326   11.250   8.6473   16.710   30.008   15.215   18.767   7.4062   26.346   6.9758 -7.579287 10.17416 
1 1 1   16    3   51 o   79.795   2.4271  260.552   15.768  274.522   22.971  248.103   21.684   81.743   3.4553   77.707   3.4318 4.035789 4.869888 
1 1 1   16    3   52 f   91.439   2.3031  341.980   17.153  346.668   24.784  337.669   23.764   91.892   3.3142   90.708   3.2190 1.183403 4.620164 
1 1 1   16    3   53 o   97.966   2.3006  392.352   18.372  385.215   26.654  398.813   25.359   96.843   3.3816   98.587   3.1596 -1.744446 4.628003 
1 1 1   16    3   54 o   84.134   2.0773  289.260   14.247  266.322   23.669  302.292   17.841   80.437   3.6191   85.915   2.5503 -5.477577 4.427374 
1 1 1   16    3   55 o   83.984   2.6636  289.064   18.212   0.0000   0.0000  289.064   18.212  ?   ?    83.984   2.6636 0.000000 2.663584 
1 1 1   16    3   56 o   57.028   3.2983  133.962   15.267   0.0000   0.0000  133.962   15.267  ?   ?    57.028   3.2983 0.000000 3.298338 
1 1 1   16    3   57 o   64.323   2.3970  169.557   12.546  138.545   21.185  186.309   15.570   57.708   4.5400   67.357   2.8421 -9.648785 5.356264 
1 1 1   16    3   58 o   75.374   2.1237  232.524   13.035  223.766   21.546  237.579   16.371   73.650   3.5998   76.103   2.6431 -2.452271 4.465937 
1 1 1   16    3   59 o   89.455   1.9524  327.142   14.237  321.435   23.441  330.478   17.920   88.374   3.2596   89.799   2.4504 -1.425087 4.077928 
1 1 1   16    3   60 o   54.085   2.4390  120.057   10.725  118.208   18.207  121.040   13.272   53.296   4.2254   54.207   3.0156 -0.9110603 5.191168 
1 1 1   16    3   61 o   44.784   2.7734   82.615   10.075  100.834   17.501   73.585   12.321   49.125   4.4176   42.093   3.6263 7.031330 5.715358 
1 1 1   16    3   62 o  112.477   2.0173  517.637   18.496  517.612   38.189  517.645   21.141  111.676   4.2026  112.411   2.3071 -0.7340240 4.794238 
1 1 1   16    3   63 o   74.503   2.4333  227.840   14.758  186.963   26.663  245.894   17.719   66.733   4.9364   77.310   2.8165 -10.57657 5.683352 
1 1 1   16    3   64 o   68.057   2.4691  190.275   13.675  193.899   26.199  188.918   16.032   67.988   4.7574   67.710   2.9115 0.2778854 5.577648 
1 1 1   16    3   65 o   95.914   2.0376  376.754   15.931  358.274   24.229  390.829   21.145   93.155   3.1955   97.489   2.6633 -4.334030 4.159864 
1 1 1   16    3   66 o   42.370   2.7997   74.193   9.6155   94.349   16.858   64.473   11.707   47.351   4.4185   39.275   3.7002 8.076344 5.763209 
1 1 1   16    3   67 o   86.107   1.9213  303.669   13.486  328.115   22.889  290.672   16.690   89.083   3.1570   84.084   2.4376 4.998985 3.988592 
1 1 1   16    3   68 o   61.341   2.2080  154.605   11.023  151.723   19.019  156.062   13.526   60.256   3.8930   61.506   2.7044 -1.249741 4.740162 
1 1 1   16    3   69 o   40.647   2.8542   68.480   9.3966   78.774   16.639   63.660   11.386   42.977   4.8333   38.982   3.6247 3.995144 6.041508 
1 1 1   16    3   70 o   51.496   2.4211  109.328   10.135  134.888   18.041   97.543   12.250   56.707   3.9272   48.450   3.1184 8.256939 5.014689 
1 1 1   16    3   71 o   37.950   2.9474   59.906   9.0462   70.391   16.518   55.414   10.812   40.384   5.1336   36.275   3.7085 4.108501 6.332977 
1 1 1   16    3   72 o   34.816   3.1896   50.709   8.9517   57.300   15.988   47.699   10.804   36.128   5.6106   33.500   4.0378 2.628502 6.912531 
1 1 1   16    3   73 o   32.912   3.3385   45.520   8.8330   51.686   15.720   42.675   10.678   34.114   5.8644   31.561   4.2591 2.552879 7.247883 
1 1 1   16    3   74 o   12.276   4.9917   3.0464   7.8295   4.6236   13.579   2.2610   9.5827   15.678   6.4956   12.986   5.4246 2.692045 8.462783 
1 1 1   16    3   75 o   38.091   3.2076   60.815   9.8672  100.118   22.401   51.353   10.991   47.566   5.9041   34.728   3.9528 12.83771 7.105177 
1 1 1   16    3   76 o   15.436   5.2495   9.7784   7.8948   9.8440   13.709   9.7458   9.6568   17.292   6.7426   15.935   5.7742 1.356693 8.877208 
1 1 1   16    3   77 o   60.918   2.3669  153.459   11.731  158.706   16.541  148.149   16.640   61.533   3.3099   59.374   3.4531 2.159794 4.783190 
1 1 1   16    3   78 o   16.089   5.6168   10.566   9.0585  -0.8161   13.440   20.039   12.262   14.008   6.1431   20.955   6.5022 -6.947889 8.945176 
1 1 1   16    3   79 o   29.711   4.5196   38.576   10.601   67.010   18.814   25.347   12.833   38.327   6.2362   23.300   6.5078 15.02707 9.013381 
1 1 1   16    3   80 o   43.560   2.7128   79.145   9.5846   82.741   14.441   76.315   12.814   43.924   4.0800   42.333   3.7521 1.590614 5.542961 
1 1 1   16    3   81 f   39.216   2.8869   64.447   9.1637   64.349   12.018   64.585   14.164   38.778   3.8528   38.468   4.6087 0.3109550 6.007002 
1 1 1   16    3   82 o   35.069   2.8568   51.609   8.0958   53.747   11.634   49.602   11.273   35.261   4.1256   33.834   4.1759 1.426178 5.870109 
1 1 1   16    3   83 o   11.067   4.6952   1.0500   7.3577  -6.6232   10.782   7.7384   10.066   11.098   5.1195   15.030   5.8005 -3.932263 7.736584 
1 1 1   16    3   84 o   36.339   2.4897   55.110   7.3305   35.810   11.578   68.024   9.4706   28.099   5.2477   40.226   2.9079 -12.12723 5.999459 
1 1 1   16    3   85 o   50.539   2.0271  105.672   8.3340  102.076   13.982  107.653   10.379   48.939   3.5286   50.809   2.5138 -1.869797 4.332508 
1 1 1   16    3   86 o   10.484   4.4630   0.8446   6.6865   11.988   11.823  -4.3955   8.1076   17.076   6.3550   9.8208   4.4969 7.255748 7.785176 
1 1 1   16    3   87 o   41.415   2.3985   71.627   8.0624   59.691   12.160   80.989   10.770   36.942   4.1075   43.736   3.0398 -6.793381 5.110004 
1 1 1   16    3   88 o   52.026   2.0648  112.349   8.7392   91.896   12.917  129.613   11.867   46.295   3.4477   55.580   2.6268 -9.284885 4.334402 
1 1 1   16    3   89 o   27.314   3.3898   32.286   7.3855   17.667   11.007   44.256   9.9604   19.184   6.1872   31.740   3.9339 -12.55626 7.331960 
1 1 1   16    3   90 o   18.255   4.3819   15.276   6.4378   22.165   11.163   11.842   7.8804   21.214   6.1187   16.079   5.2391 5.134995 8.055182 
1 1 1   16    3   91 o   17.640   4.4723   14.390   6.4386   21.631   10.914   10.524   7.9739   20.893   6.0575   15.327   5.2740 5.566792 8.031694 
1 1 1   16    3   92 o   10.463   4.3960   1.7417   6.3488   18.201   11.409  -5.6417   7.6412   19.126   6.3079   9.0347   4.2163 10.09098 7.587249 
1 1 1   16    3   93 o   22.709   4.1976   23.514   7.4840   22.048   11.609   24.556   9.7898   20.779   6.3046   22.485   5.4078 -1.705748 8.306132 
1 1 1   16    3   94 o   10.034   4.6334  -4.5909   8.8642 -13.1657   10.940   11.796   15.124   9.6362   4.6486   16.891   6.9114 -7.254601 8.329270 
1 1 1   16    3   95 o   34.308   3.5385   51.995   9.7541   44.119   12.268   65.529   16.082   30.341   5.1439   36.649   5.5573 -6.307131 7.572597 
1 1 1   16    3   96 o   19.920   5.5572   20.020   9.3635   31.732   12.026   1.9922   14.921   24.829   6.0079   14.153   6.3252 10.67541 8.723660 
1 1 1   16    3   97 o   16.963   5.7049   14.403   9.3229   23.527   11.638  -1.9361   15.574   20.993   6.3002   13.523   6.2071 7.470430 8.844228 
1 1 1   16    3   98 o   15.470   5.6847   11.305   9.4078   10.995   11.694   11.873   15.840   15.679   6.1931   16.621   6.9608 -0.9425898 9.317060 
1 1 1   16    3   99 o   9.4266   4.4625  -7.5183   9.1132 -10.4586   11.452  -2.4406   15.049   10.204   4.8787   13.169   6.0655 -2.964816 7.784094 
1 1 1   16    3  100 o   16.611   5.8293   13.969   9.7650   21.051   12.409   2.4508   15.825   19.514   6.5818   14.302   6.4429 5.211864 9.210422 
1 1 1   16    3  101 f   19.871   6.3987   21.767   11.776   12.860   16.406   31.232   16.912   16.726   7.0492   22.382   7.6816 -5.655718 10.42588 
1 1 1   16    3  102 o   14.068   5.9740   6.4358   11.931   3.3583   16.699   9.6454   17.053   14.607   6.5959   15.999   6.9700 -1.391302 9.596183 
1 1 1   16    3  103 o   13.258   5.7524   4.1574   11.516  -5.9943   16.337   14.185   16.237   12.834   6.0449   16.934   7.0664 -4.099898 9.299164 
1 1 1   16    3  104 o   28.518   6.2962   43.997   14.244   32.958   17.954   62.751   23.401   22.413   7.9011   29.963   8.9196 -7.549789 11.91576 
1 1 1   16    3  105 o   13.230   5.9167   2.3253   13.080   4.6898   16.453  -1.7359   21.562   14.656   6.5886   14.754   6.9478 -0.9840488E-01 9.575035 
1 1 1   16    3  106 o   16.527   6.9493   13.453   15.885   17.545   23.232   9.8605   21.770   17.930   7.9602   16.476   7.4762 1.454369 10.92060 
1 1 1   16    3  107 o   15.875   6.8601   10.960   16.247  -3.3047   23.793   23.422   22.239   14.888   7.0943   18.937   8.1022 -4.049023 10.76920 
1 1 1   16    3  108 o   21.197   7.4842   29.103   16.114   9.4287   23.762   45.855   21.926   16.469   7.5986   24.653   8.7278 -8.183943 11.57207 
1 1 1   16    3  109 o   12.645   5.9481  -4.6242   15.729  -2.6231   23.875  -6.1587   20.906   14.900   7.1017   13.858   6.6163 1.041739 9.706206 
1 1 1   16    3  110 o   14.040   6.3892   2.8249   16.040 -25.1173   23.556   26.981   21.902   12.654   6.2522   19.618   8.1983 -6.964225 10.31028 
1 1 1   16    4 -108 o   14.464   6.9810  -8.1142   24.746  -8.1142   24.746   0.0000   0.0000   14.464   6.9810  ?   ?  0.000000 6.981030 
1 1 1   16    4 -107 o   14.136   6.5365   1.3495   17.724  -2.5097   24.524   5.5690   25.643   14.981   7.1562   16.100   7.5802 -1.119274 10.42451 
1 1 1   16    4 -106 o   19.346   7.2318   23.567   15.344   25.052   19.132   20.888   25.690   19.302   7.8197   18.247   8.2154 1.055136 11.34202 
1 1 1   16    4 -105 o   13.193   6.0514   0.2481   14.768 -13.8251   18.221   27.189   25.211   12.207   5.9155   19.423   8.4680 -7.215612 10.32953 
1 1 1   16    4 -104 o   19.236   7.2964   22.985   15.746   12.050   19.368   44.303   27.041   16.478   7.2943   22.746   9.2664 -6.268219 11.79292 
1 1 1   16    4 -103 o   15.258   6.9624   5.2040   19.213   5.2040   19.213   0.0000   0.0000   15.258   6.9624  ?   ?  0.000000 6.962381 
1 1 1   16    4 -102 o   34.240   7.5938   70.312   20.639   25.726   28.636  118.516   29.775   19.407   8.7111   42.263   8.9232 -22.85582 12.47028 
1 1 1   16    4 -101 o   15.242   6.9657   4.2926   19.328   40.621   28.042 -28.5829   26.677   22.230   9.2824   13.332   6.5992 8.898441 11.38910 
1 1 1   16    4 -100 o   21.367   7.5097   28.466   16.211   21.289   28.406   31.932   19.741   18.983   8.5843   21.721   8.1852 -2.737827 11.86116 
1 1 1   16    4  -99 o   15.014   6.5955   6.7192   15.551   39.141   27.883  -7.9195   18.736   22.219   9.2651   13.331   6.3364 8.887075 11.22456 
1 1 1   16    4  -98 o   10.969   5.3287 -16.2515   15.030 -14.0173   25.407 -17.4542   18.641   14.421   6.9875   12.182   5.9217 2.239084 9.159274 
1 1 1   16    4  -97 o   18.942   6.7008   19.884   12.922   17.774   17.846   22.211   18.735   18.189   7.4823   19.381   7.7783 -1.192135 10.79291 
1 1 1   16    4  -96 o   21.386   6.6850   25.508   12.935   26.764   17.623   24.041   19.046   20.933   7.7648   19.991   7.9014 0.9427223 11.07812 
1 1 1   16    4  -95 o   11.262   5.2841  -6.7389   12.275 -12.3364   16.904  -0.4943   17.854   12.311   5.8972   14.417   6.6280 -2.105457 8.871749 
1 1 1   16    4  -94 o   14.823   6.2273   7.5572   12.739 -11.2952   17.513   28.743   18.565   12.711   6.0651   21.624   7.9789 -8.913372 10.02234 
1 1 1   16    4  -93 f   12.448   5.6253  -1.0486   12.174  -6.3181   17.124   4.3373   17.312   13.352   6.2572   15.305   6.8284 -1.952919 9.261740 
1 1 1   16    4  -92 o   16.672   6.3744   13.059   12.078   3.1544   16.538   24.382   17.682   14.960   6.6743   20.660   7.7549 -5.699753 10.23155 
1 1 1   16    4  -91 o   29.193   5.4851   41.442   12.573   40.177   17.528   42.782   18.046   26.566   7.6687   27.372   7.7430 -0.8055935 10.89785 
1 1 1   16    4  -90 o   24.139   6.2557   29.723   12.409   36.277   17.452   23.022   17.647   25.349   7.7378   20.652   7.7482 4.696831 10.95022 
1 1 1   16    4  -89 o   18.609   6.4151   17.109   11.799   19.521   16.501   14.585   16.879   19.664   7.4668   18.215   7.3574 1.448416 10.48252 
1 1 1   16    4  -88 o   13.274   5.2816   5.7939   8.5633   10.707   16.299   3.9207   10.064   17.159   7.1135   13.210   5.5414 3.949714 9.017114 
1 1 1   16    4  -87 o   35.713   3.0888   54.608   8.9035   58.392   15.098   52.590   11.025   35.298   5.4201   34.500   3.9939 0.7978172 6.732694 
1 1 1   16    4  -86 o   16.414   5.2396   12.378   7.9082   20.981   14.107   8.4350   9.5501   20.536   7.0165   14.822   5.6678 5.714605 9.019730 
1 1 1   16    4  -85 o   14.951   5.3508   9.3790   8.2623   16.681   17.420   7.2597   9.3851   19.457   7.5968   14.343   5.5828 5.114339 9.427559 
1 1 1   16    4  -84 o   30.597   4.8392   42.290   11.668   45.890   16.995   39.079   16.048   30.370   7.0076   27.929   7.0497 2.440987 9.940053 
1 1 1   16    4  -83 o   26.096   4.9660   30.982   10.178   34.844   13.745   26.292   15.145   26.887   6.3697   22.987   7.2404 3.899967 9.643467 
1 1 1   16    4  -82 f   35.446   3.7230   54.114   10.597   56.420   13.891   50.905   16.389   35.516   4.9311   32.782   6.3624 2.734287 8.049605 
1 1 1   16    4  -81 o   25.930   4.8460   30.234   9.8665   21.992   13.093   41.064   15.009   21.480   6.7274   29.388   6.4432 -7.907402 9.315190 
1 1 1   16    4  -80 o   55.127   2.2151  125.931   9.9335  105.312   15.623  139.923   12.870   49.550   3.8994   57.867   2.7361 -8.316895 4.763603 
1 1 1   16    4  -79 o   12.150   5.0081   2.8243   8.0167   27.036   15.763  -5.6227   9.3107   23.635   7.3784   10.400   4.7832 13.23535 8.793113 
1 1 1   16    4  -78 o   30.725   2.9604   39.772   7.3229   41.105   9.5445   37.864   11.418   30.894   3.8750   29.139   4.9860 1.754896 6.314760 
1 1 1   16    4  -77 o   22.528   3.9329   22.111   6.9597   30.697   9.5956   12.581   10.110   26.349   4.6368   17.197   5.9376 9.152338 7.533560 
1 1 1   16    4  -76 o   18.530   4.3623   15.248   6.4791   12.880   8.6144   18.333   9.8315   17.125   5.4687   20.043   5.7303 -2.918039 7.921028 
1 1 1   16    4  -75 o   39.269   3.0064   64.651   9.5503   64.118   14.074   65.106   13.002   38.417   4.5846   38.923   4.1626 -0.5056229 6.192381 
1 1 1   16    4  -74 o   35.058   2.6691   51.246   7.5702   45.867   9.5877   60.150   12.336   32.836   3.6433   37.454   4.1080 -4.618118 5.490796 
1 1 1   16    4  -73 o   35.527   2.7203   52.623   7.8180   53.453   9.9752   51.302   12.588   35.557   3.4864   34.376   4.6082 1.180542 5.778421 
1 1 1   16    4  -72 f   37.081   2.6473   57.188   7.9490   52.037   9.9714   66.169   13.166   35.085   3.5347   39.345   4.1685 -4.260109 5.465405 
1 1 1   16    4  -71 o   32.540   2.8924   44.244   7.5921   45.787   9.5904   41.653   12.426   32.877   3.6394   30.777   5.1338 2.100063 6.292935 
1 1 1   16    4  -70 o   31.615   3.0510   41.861   7.7650   44.741   9.8173   37.048   12.690   32.469   3.7798   28.836   5.6007 3.632607 6.756872 
1 1 1   16    4  -69 o   12.026   4.7525   3.7203   6.8893   5.2961   8.7400   1.1344   11.196   13.704   5.3720   13.522   5.7660 0.1824894 7.880651 
1 1 1   16    4  -68 f   25.395   3.4972   27.339   7.0475   26.358   9.4310   28.580   10.605   24.511   4.8917   25.417   5.2909 -0.9063988 7.205749 
1 1 1   16    4  -67 o   22.228   3.9730   21.260   6.9346   10.665   9.3353   34.304   10.358   16.393   5.7033   28.151   4.6781 -11.75782 7.376468 
1 1 1   16    4  -66 o   71.380   1.8381  208.942   10.686  199.260   15.161  218.502   15.065   69.464   2.6825   72.793   2.5427 -3.328873 3.696126 
1 1 1   16    4  -65 o   37.852   2.8844   59.468   8.8327   47.078   10.277   94.496   17.279   33.406   3.8439   47.213   4.5459 -13.80672 5.953249 
1 1 1   16    4  -64 o   28.703   3.1563   34.451   7.2631   36.154   9.9107   32.475   10.675   29.110   4.3064   27.363   4.9688 1.746740 6.575260 
1 1 1   16    4  -63 o   41.959   2.3155   72.495   7.8890   72.568   10.833   72.412   11.512   41.786   3.2047   41.686   3.4178 0.1001358 4.685254 
1 1 1   16    4  -62 o   19.078   4.5263   15.814   6.9324   18.065   9.5790   13.338   10.045   20.321   5.6025   17.976   5.9185 2.345121 8.149630 
1 1 1   16    4  -61 o   99.711   1.4500  406.253   11.785  391.720   17.250  418.974   16.139   97.760   2.1647  101.155   1.9573 -3.395454 2.918345 
1 1 1   16    4  -60 o   42.602   2.1299   74.534   7.3731   53.959   11.306   89.759   9.7258   35.870   3.9310   46.686   2.5655 -10.81570 4.694123 
1 1 1   16    4  -59 o   75.767   1.6104  234.624   9.9461  226.654   15.498  240.205   12.969   74.268   2.5639   76.564   2.0799 -2.296005 3.301441 
1 1 1   16    4  -58 o   70.507   1.6672  203.183   9.5821  199.861   15.055  205.445   12.423   69.730   2.6536   70.800   2.1551 -1.070053 3.418471 
1 1 1   16    4  -57 o   20.859   4.2038   18.652   6.9007   19.982   11.174   17.831   8.7740   21.474   6.0989   20.277   5.2630 1.196444 8.055830 
1 1 1   16    4  -56 o   85.509   1.6726  298.753   11.658  281.027   19.849  308.089   14.405   82.665   2.9503   86.782   2.0363 -4.117897 3.584842 
1 1 1   16    4  -55 o  112.396   1.6188  516.019   14.831  478.691   24.197  538.482   18.771  107.996   2.7508  114.748   2.0068 -6.752777 3.405038 
1 1 1   16    4  -54 o  109.769   1.4965  491.982   13.390  488.777   19.869  494.649   18.123  109.291   2.2303  109.985   2.0215 -0.6936417 3.010096 
1 1 1   16    4  -53 o   44.960   2.2771   82.924   8.3183   80.171   12.812   84.930   10.937   43.990   3.6045   45.400   2.9717 -1.410030 4.671504 
1 1 1   16    4  -52 o   34.193   3.0444   48.346   8.3968   67.427   12.636   33.258   11.236   40.269   3.8982   27.882   5.1330 12.38791 6.445458 
1 1 1   16    4  -51 o   41.193   2.6146   69.763   8.7341   74.645   13.692   66.414   11.341   42.377   4.0114   40.047   3.5097 2.329979 5.330027 
1 1 1   16    4  -50 o   85.592   1.6790  299.142   11.714  299.792   17.603  298.625   15.695   85.548   2.5270   85.425   2.2559 0.1231766 3.387432 
1 1 1   16    4  -49 o   80.966   1.7047  267.670   11.251  277.268   17.068  260.294   14.961   82.274   2.5480   79.750   2.3039 2.523796 3.435150 
1 1 1   16    4  -48 o   78.288   1.7148  250.239   10.943  246.587   16.486  253.116   14.632   77.582   2.6106   78.650   2.2846 -1.068642 3.469116 
1 1 1   16    4  -47 o   69.275   1.8127  196.094   10.227  191.613   15.735  199.372   13.457   68.352   2.8302   69.789   2.3690 -1.436836 3.690815 
1 1 1   16    4  -46 o   55.334   2.0213  125.236   9.1017  118.916   13.966  129.902   12.000   53.771   3.2007   56.289   2.6226 -2.517689 4.137934 
1 1 1   16    4  -45 o  103.538   1.5353  437.465   12.958  427.744   19.280  445.474   17.500  102.301   2.3120  104.430   2.0558 -2.129349 3.093806 
1 1 1   16    4  -44 o  112.567   1.5169  517.047   13.919  520.258   20.824  514.455   18.713  112.835   2.2640  112.231   2.0455 0.6044922 3.051201 
1 1 1   16    4  -43 o   27.316   3.6254   31.131   7.8733   33.825   12.528   29.373   10.122   28.104   5.6645   26.281   4.9051 1.822954 7.493104 
1 1 1   16    4  -42 o   61.680   1.8990  155.467   9.5365  151.627   14.574  158.342   12.611   60.799   2.9496   62.190   2.4927 -1.390476 3.861812 
1 1 1   16    4  -41 o  150.288   1.8141  921.940   22.224  910.967   27.140  944.274   38.719  149.334   2.2296  151.874   3.1276 -2.539978 3.840924 
1 1 1   16    4  -40 o   79.754   2.0076  259.865   13.042  273.540   16.899  239.725   20.508   81.769   2.5384   76.440   3.2990 5.328568 4.162551 
1 1 1   16    4  -39 o   26.662   5.0720   30.237   10.621   33.407   15.052   27.094   14.988   27.820   6.7147   25.156   7.0356 2.664101 9.725593 
1 1 1   16    4  -38 o  148.771   2.1502  903.795   26.076  862.537   36.971  944.637   36.784  145.181   3.1240  151.963   2.9695 -6.781937 4.310123 
1 1 1   16    4  -37 o  101.112   2.1764  417.487   17.938  430.100   26.566  406.918   24.319  102.468   3.1845   99.694   2.9960 2.773369 4.372268 
1 1 1   16    4  -36 o   44.869   3.0174   82.717   10.972  102.522   18.993   72.797   13.442   49.713   4.7443   41.946   3.9788 7.766903 6.191870 
1 1 1   16    4  -35 o   60.519   2.4506  149.866   12.064  131.232   20.292  160.053   15.004   56.357   4.4534   62.491   2.9538 -6.134613 5.343961 
1 1 1   16    4  -34 o  101.637   1.8438  421.567   15.275  412.309   22.927  428.958   20.484  100.392   2.8044  102.474   2.4523 -2.081886 3.725360 
1 1 1   16    4  -33 o  131.383   1.9732  704.535   21.132  719.575   37.054  697.285   25.726  132.543   3.4325  130.659   2.4154 1.883957 4.197147 
1 1 1   16    4  -32 o  165.325   1.8136  1115.29   24.441  1099.41   35.468  1129.66   33.726  164.034   2.6526  166.300   2.4879 -2.266235 3.636746 
1 1 1   16    4  -31 o   35.108   3.1813   50.820   9.0055   45.733   15.731   53.300   10.983   32.777   6.1124   35.874   3.8144 -3.096481 7.204913 
1 1 1   16    4  -30 o  182.299   1.7057  1355.82   25.347  1339.36   39.961  1366.89   32.786  181.056   2.7076  182.984   2.1981 -1.927856 3.487496 
1 1 1   16    4  -29 o   55.074   2.2366  124.028   10.020  112.648   17.431  129.645   12.246   52.268   4.1246   56.270   2.6774 -4.002583 4.917414 
1 1 1   16    4  -28 o  108.074   1.5372  476.409   13.542  465.094   20.199  485.647   18.252  106.732   2.3217  109.085   2.0526 -2.353264 3.098969 
1 1 1   16    4  -27 o  113.141   1.5331  522.118   14.139  523.197   21.069  521.234   19.071  113.208   2.2831  113.011   2.0702 0.1961975 3.081949 
1 1 1   16    4  -26 o   76.957   1.7142  241.602   10.753  249.371   16.591  235.974   14.121   78.095   2.6099   75.995   2.2821 2.099968 3.466926 
1 1 1   16    4  -25 o  119.015   1.5190  577.713   14.737  574.825   21.964  580.077   19.874  118.666   2.2706  119.225   2.0450 -0.5583420 3.055757 
1 1 1   16    4  -24 o  146.757   1.6055  878.487   19.206  881.849   30.195  876.203   24.891  146.956   2.5207  146.528   2.0839 0.4276886 3.270541 
1 1 1   16    4  -23 o  160.188   1.5503  1046.57   20.244  1030.49   29.547  1060.80   27.791  158.887   2.2813  161.224   2.1147 -2.337006 3.110672 
1 1 1   16    4  -22 o  152.450   1.5410  947.889   19.150  927.765   27.840  965.958   26.382  150.763   2.2654  153.851   2.1036 -3.087555 3.091488 
1 1 1   16    4  -21 o   77.115   1.8780  242.612   11.805  226.655   20.295  250.773   14.514   74.379   3.3559   78.350   2.2749 -3.970497 4.054313 
1 1 1   16    4  -20 o   75.157   2.0036  230.640   12.264  232.885   23.574  229.807   14.360   75.338   3.8514   74.995   2.3519 0.3431244 4.512712 
1 1 1   16    4  -19 o  289.563   2.3111  3422.36   54.550  3340.50   94.502  3463.26   66.804  285.645   4.0586  291.186   2.8145 -5.540436 4.938989 
1 1 1   16    4  -18 o  165.791   1.9552  1121.43   26.423  1144.40   43.933  1108.42   33.073  167.334   3.2208  164.777   2.4623 2.556946 4.054224 
1 1 1   16    4  -17 o   36.496   2.9536   54.764   8.7118   49.176   13.818   58.451   11.224   34.252   5.1046   37.622   3.7080 -3.369511 6.309188 
1 1 1   16    4  -16 o  136.415   1.5339  758.922   17.057  746.353   25.195  769.557   23.176  135.231   2.2857  137.333   2.0702 -2.102707 3.083847 
1 1 1   16    4  -15 o  155.501   1.5448  986.133   19.581  971.760   28.593  998.826   26.871  154.308   2.2732  156.457   2.1069 -2.148804 3.099398 
1 1 1   16    4  -14 o   61.611   2.0691  155.055   10.377  156.240   17.107  154.365   13.052   61.730   3.4131   61.434   2.6123 0.2967148 4.298038 
1 1 1   16    4  -13 o  211.283   1.6936  1820.72   29.168  1811.14   42.002  1829.65   40.535  210.644   2.4462  211.730   2.3486 -1.085770 3.391151 
1 1 1   16    4  -12 o  164.995   1.6652  1110.30   22.397  1051.46   34.272  1154.17   29.589  160.482   2.6198  168.183   2.1583 -7.701096 3.394383 
1 1 1   16    4  -11 o  155.789   1.6855  989.874   21.404  930.896   33.720  1029.67   27.700  150.991   2.7397  158.856   2.1391 -7.865387 3.475902 
1 1 1   16    4  -10 o  143.265   1.6751  837.110   19.562  801.048   31.497  859.755   24.959  140.064   2.7587  145.161   2.1093 -5.097168 3.472707 
1 1 1   16    4   -9 o  229.167   1.9010  2142.33   35.512  2145.88   56.289  2139.98   45.770  229.207   3.0127  228.975   2.4522 0.2313080 3.884551 
1 1 1   16    4   -8 o   90.837   1.8269  336.574   13.527  335.298   23.444  337.211   16.562   90.537   3.1816   90.905   2.2351 -0.3687515 3.888221 
1 1 1   16    4   -7 o  247.603   1.9773  2501.03   39.909  2478.93   62.384  2516.35   51.924  246.340   3.1067  248.282   2.5656 -1.942123 4.029149 
1 1 1   16    4   -6 o   89.215   1.7145  324.628   12.469  336.173   19.196  316.201   16.399   90.710   2.5988   87.997   2.2882 2.713844 3.462584 
1 1 1   16    4   -5 o   42.482   2.8201   74.016   9.7106   84.260   16.683   68.767   11.942   45.127   4.5995   40.854   3.6235 4.272018 5.855315 
1 1 1   16    4   -4 o   21.585   5.0502   19.866   8.7272   27.862   14.235   15.051   11.047   25.554   6.7385   19.354   6.1942 6.200441 9.152902 
1 1 1   16    4   -3 o   38.691   2.9676   61.494   9.2879   73.158   14.804   53.922   11.928   42.049   4.3832   36.069   4.1312 5.980007 6.023221 
1 1 1   16    4   -2 o  143.143   1.5741  835.586   18.367  839.131   27.240  832.632   24.870  143.397   2.3304  142.855   2.1358 0.5420380 3.161056 
1 1 1   16    4   -1 o  189.659   1.8066  1467.17   27.930  1512.67   38.031  1413.89   41.153  192.520   2.4234  186.096   2.7128 6.423615 3.637635 
1 1 1   16    4    0 f  263.110   2.2278  2824.72   47.780  2825.81   59.267  2822.72   80.755  263.079   2.7637  262.737   3.7706 0.3423767 4.675011 
1 1 1   16    4    1 o   45.108   3.3164   83.587   12.109   77.178   15.876   92.500   18.724   43.173   4.5812   47.255   4.9334 -4.082317 6.732433 
1 1 1   16    4    2 o  178.084   1.9134  1293.66   27.775  1296.04   34.926  1289.56   45.812  178.204   2.4044  177.671   3.1632 0.5327606 3.973251 
1 1 1   16    4    3 o  133.625   1.6986  728.238   18.502  748.368   26.323  708.582   26.011  135.416   2.3847  131.764   2.4217 3.651398 3.398731 
1 1 1   16    4    4 o  139.463   1.8422  793.354   20.943  800.721   27.086  782.401   33.025  140.073   2.3722  138.414   2.9270 1.658875 3.767595 
1 1 1   16    4    5 o  134.771   1.8519  740.882   20.345  736.416   26.285  747.555   32.132  134.328   2.4005  135.297   2.9135 -0.9690094 3.775068 
1 1 1   16    4    6 o   60.499   2.5758  149.679   12.674  143.864   17.781  155.684   18.070   59.202   3.7030   61.605   3.6142 -2.403019 5.174392 
1 1 1   16    4    7 o   81.628   2.2150  272.084   14.725  285.713   20.833  258.479   20.814   83.578   3.0631   79.474   3.2196 4.104034 4.443904 
1 1 1   16    4    8 o   98.540   1.8751  396.090   15.062  392.970   22.913  398.465   19.987   98.054   2.8697   98.773   2.4844 -0.7182236 3.795707 
1 1 1   16    4    9 o   79.866   2.0437  260.405   13.294  238.218   20.343  276.945   17.564   76.283   3.2791   82.322   2.6208 -6.039444 4.197737 
1 1 1   16    4   10 o  177.249   1.8518  1281.55   26.756  1256.03   38.581  1305.20   37.138  175.394   2.6985  178.811   2.5479 -3.416840 3.711305 
1 1 1   16    4   11 o  160.659   1.8047  1052.84   23.635  1070.76   34.910  1037.68   32.114  161.947   2.6445  159.443   2.4709 2.504028 3.619221 
1 1 1   16    4   12 o  115.522   1.7986  544.354   16.937  564.591   25.762  528.948   22.478  117.592   2.6876  113.839   2.4223 3.753426 3.618130 
1 1 1   16    4   13 o   20.578   5.6027   17.957   9.6488   18.180   15.726   17.823   12.219   21.794   7.4091   20.866   6.4934 0.9287682 9.851887 
1 1 1   16    4   14 o  141.913   1.7772  821.480   20.558  809.731   30.245  831.571   28.029  140.827   2.6347  142.734   2.4090 -1.907028 3.569984 
1 1 1   16    4   15 o   30.176   4.5506   38.132   10.846   32.997   21.186   39.955   12.626   28.091   8.5155   30.787   5.2171 -2.696018 9.986569 
1 1 1   16    4   16 o   78.377   2.2276  250.895   14.217  237.643   19.845  264.867   20.377   76.191   3.2025   80.453   3.1131 -4.262344 4.466224 
1 1 1   16    4   17 o  205.376   2.1200  1721.14   35.492  1763.47   47.588  1668.09   53.280  207.793   2.8095  202.027   3.2353 5.765793 4.284912 
1 1 1   16    4   18 o  141.887   1.9471  821.352   22.520  804.763   30.190  842.161   33.813  140.387   2.6382  143.585   2.8889 -3.198288 3.912276 
1 1 1   16    4   19 o  124.455   1.9408  631.945   19.689  658.167   27.271  603.394   28.456  126.956   2.6352  121.537   2.8723 5.419006 3.897945 
1 1 1   16    4   20 o   61.097   2.5671  152.685   12.756  160.897   22.805  148.945   15.389   62.495   4.5069   60.288   3.1423 2.206753 5.494194 
1 1 1   16    4   21 o   53.247   2.9911  116.211   12.930  119.145   21.357  114.514   16.246   53.660   4.9379   52.763   3.8029 0.8973579 6.232611 
1 1 1   16    4   22 o  100.818   2.0102  414.753   16.520  411.425   28.764  416.391   20.181  100.231   3.5260  100.989   2.4515 -0.7578583 4.294518 
1 1 1   16    4   23 o  137.024   2.4618  766.593   27.496  708.430   46.535  797.793   34.083  131.406   4.3504  139.725   2.9924 -8.319275 5.280166 
1 1 1   16    4   24 o  103.057   1.9568  433.364   16.438  439.391   27.370  429.963   20.559  103.618   3.2444  102.618   2.4578 1.000046 4.070289 
1 1 1   16    4   25 o  127.736   1.8997  665.743   19.780  654.056   32.068  672.921   25.130  126.495   3.1100  128.381   2.4014 -1.886658 3.929209 
1 1 1   16    4   26 o  117.347   1.9218  561.879   18.383  591.899   30.592  544.911   22.999  120.289   3.1225  115.521   2.4423 4.767754 3.964224 
1 1 1   16    4   27 o  186.036   2.0235  1412.40   30.686  1395.97   48.951  1423.03   39.386  184.764   3.2502  186.659   2.5886 -1.894852 4.155019 
1 1 1   16    4   28 o  163.557   1.9529  1091.63   26.037  1077.82   41.929  1100.30   33.218  162.358   3.1681  164.144   2.4827 -1.785400 4.025012 
1 1 1   16    4   29 o  111.794   2.1309  510.135   19.419  534.742   40.558  502.817   22.119  114.105   4.3686  110.963   2.4454 3.142609 5.006428 
1 1 1   16    4   30 o  235.267   2.2396  2259.74   42.951  2353.98   70.512  2204.15   54.158  239.801   3.6072  232.231   2.8609 7.569458 4.604036 
1 1 1   16    4   31 o   48.424   2.7398   96.124   10.771   81.102   17.094  106.013   13.870   44.175   4.8256   50.791   3.3691 -6.616238 5.885343 
1 1 1   16    4   32 o  111.386   1.8112  506.262   16.445  503.910   24.791  508.111   21.975  111.044   2.7388  111.539   2.4170 -0.4946594 3.652826 
1 1 1   16    4   33 o   38.500   3.2334   61.064   10.054   57.027   15.739   63.847   13.067   36.832   5.4029   39.241   4.1477 -2.409668 6.811390 
1 1 1   16    4   34 o   99.828   1.8439  406.696   15.004  415.529   22.956  400.108   19.826  100.785   2.7970   98.967   2.4575 1.817017 3.723228 
1 1 1   16    4   35 o   36.337   3.3423   54.499   9.7893   65.322   15.976   47.992   12.387   39.524   5.0759   33.874   4.6052 5.649860 6.853620 
1 1 1   16    4   36 o   51.287   2.6957  107.809   11.230  108.541   18.943  107.413   13.945   51.192   4.5880   51.113   3.3658 0.7984161E-01 5.690195 
1 1 1   16    4   37 o   53.181   2.8907  115.998   12.484  108.859   28.087  117.755   13.937   50.739   6.9753   53.545   3.2077 -2.805847 7.677559 
1 1 1   16    4   38 o   64.264   2.5650  169.044   13.410  191.634   29.602  163.212   15.042   67.958   5.3878   63.101   2.9323 4.856201 6.134043 
1 1 1   16    4   39 o  134.127   2.4661  735.123   26.963  729.215   48.476  737.769   32.445  133.121   4.4736  134.291   2.9639 -1.170395 5.366389 
1 1 1   16    4   40 o   74.158   2.5087  225.014   15.143  184.151   21.694  263.846   21.148   66.867   3.9983   80.210   3.2412 -13.34270 5.147028 
1 1 1   16    4   41 o   29.303   5.1501   36.424   11.853   25.553   17.306   46.030   16.268   24.756   7.7314   32.782   6.3168 -8.026802 9.983812 
1 1 1   16    4   42 o   59.033   2.4507  142.678   11.767  123.239   19.404  153.985   14.799   54.569   4.3995   61.268   2.9721 -6.699280 5.309321 
1 1 1   16    4   43 o  120.617   2.1701  594.321   21.336  599.159   30.711  589.807   29.664  120.920   3.1183  119.989   3.0353 0.9311523 4.351667 
1 1 1   16    4   44 o  149.264   1.9224  909.762   23.391  928.513   38.143  898.461   29.612  150.569   3.1078  148.248   2.4504 2.320526 3.957614 
1 1 1   16    4   45 o  116.590   1.9095  555.083   18.147  579.546   30.223  541.291   22.694  118.901   3.1210  115.065   2.4195 3.835350 3.948986 
1 1 1   16    4   46 o   74.198   2.1886  225.168   13.223  222.993   22.345  226.340   16.403   73.594   3.7370   74.323   2.7120 -0.7280579 4.617400 
1 1 1   16    4   47 o  100.690   1.9700  414.132   16.169  407.760   26.428  417.945   20.442   99.670   3.2572  101.087   2.4808 -1.417488 4.094367 
1 1 1   16    4   48 o   52.169   2.7616  111.737   11.702  139.690   20.559   98.340   14.233   58.054   4.3766   48.802   3.6031 9.251999 5.668987 
1 1 1   16    4   49 o   22.449   5.6464   21.754   10.321   14.640   18.229   25.110   12.522   21.055   7.8799   24.085   6.3053 -3.030048 10.09202 
1 1 1   16    4   50 o   74.128   2.2884  224.946   13.811  230.441   23.563  222.070   17.046   74.725   3.8816   73.564   2.8481 1.161125 4.814438 
1 1 1   16    4   51 o   56.252   2.6413  129.872   12.078  127.511   20.207  131.184   15.065   55.367   4.5165   56.428   3.2894 -1.061073 5.587388 
1 1 1   16    4   52 o   60.607   2.9141  150.981   14.355  153.168   20.746  148.972   19.882   60.770   4.2141   59.958   4.0926 0.8125114 5.874365 
1 1 1   16    4   53 o   35.424   4.3940   52.656   12.416   50.812   17.659   54.460   17.461   34.221   6.5694   35.547   6.2543 -1.326447 9.070431 
1 1 1   16    4   54 o   74.343   2.5019  226.648   15.140  232.259   21.980  221.582   20.884   75.014   3.6052   73.291   3.5058 1.723282 5.028763 
1 1 1   16    4   55 o   37.839   3.7798   59.622   11.503   75.658   17.111   46.402   15.537   42.351   5.0564   32.766   6.0394 9.584774 7.876669 
1 1 1   16    4   56 o   52.799   2.4417  114.468   10.480  108.415   17.477  117.866   13.096   50.999   4.2424   53.476   3.0166 -2.477116 5.205539 
1 1 1   16    4   57 o  103.867   2.0754  441.502   17.572  460.110   35.852  435.619   20.159  105.299   4.1853  103.102   2.3986 2.197006 4.823869 
1 1 1   16    4   58 o   13.616   5.5984   2.8486   9.9843   0.0622   20.088   3.7627   11.506   17.718   7.6422   14.739   6.0294 2.978879 9.734330 
1 1 1   16    4   59 o   40.924   3.4307   69.583   11.339   93.794   21.589   60.359   13.325   46.828   5.7781   37.855   4.4003 8.973076 7.262850 
1 1 1   16    4   60 o   91.497   2.0939  342.906   15.617  331.448   23.832  351.530   20.674   89.580   3.2692   92.436   2.7469 -2.856056 4.270006 
1 1 1   16    4   61 o   93.727   1.9058  359.616   14.561  383.929   24.378  346.130   18.155   96.448   3.1048   91.797   2.4284 4.651207 3.941712 
1 1 1   16    4   62 o   46.711   2.6970   90.051   10.226  114.047   18.044   78.699   12.411   52.123   4.2847   43.458   3.5339 8.664684 5.554005 
1 1 1   16    4   63 o   77.691   2.0004  247.511   12.658  252.009   21.770  245.214   15.557   77.935   3.4353   77.204   2.4753 0.7305527 4.234172 
1 1 1   16    4   64 o   37.490   3.0821   58.443   9.3359   68.958   16.422   53.422   11.348   40.088   5.1438   35.595   3.9791 4.493206 6.503266 
1 1 1   16    4   65 o   76.554   2.0102  240.499   12.533  261.413   21.510  229.748   15.422   79.349   3.3330   74.671   2.5373 4.677589 4.188909 
1 1 1   16    4   66 o   20.891   5.0873   19.239   8.5812   31.429   15.724   14.069   10.241   26.238   7.1559   18.261   5.9737 7.976204 9.321593 
1 1 1   16    4   67 o   39.276   2.8516   64.076   9.0674   65.820   15.015   63.075   11.376   39.157   4.8046   38.738   3.6455 0.4188309 6.031020 
1 1 1   16    4   68 f   49.230   2.4208  100.071   9.6849  109.497   16.119   94.745   12.115   50.988   3.9081   47.691   3.1339 3.297318 5.009465 
1 1 1   16    4   69 o   18.150   5.2062   14.503   8.1026   8.8987   13.769   17.472   10.022   17.113   6.7323   19.831   5.8202 -2.717896 8.899358 
1 1 1   16    4   70 o   16.854   5.3034   12.224   8.1276   19.378   13.822   8.4425   10.048   20.988   6.9438   15.560   5.8449 5.427499 9.076324 
1 1 1   16    4   71 o   27.320   3.8983   31.958   8.4353   31.298   14.148   32.322   10.507   26.041   6.6443   27.109   4.9366 -1.068413 8.277493 
1 1 1   16    4   72 f   27.064   4.5687   31.966   9.7206   27.806   14.291   35.548   13.260   24.453   6.8812   27.984   5.9937 -3.531275 9.125560 
1 1 1   16    4   73 o   16.053   5.6956   10.270   9.3416   10.008   13.885   10.487   12.627   17.360   6.7810   17.132   6.5254 0.2285957 9.410808 
1 1 1   16    4   74 o   26.772   5.1912   32.008   10.920   26.319   19.679   34.539   13.126   23.789   8.2803   27.463   6.0289 -3.674440 10.24262 
1 1 1   16    4   75 o   14.677   5.5018   7.6956   8.8936   1.7039   18.625   9.4654   10.122   16.735   7.2875   15.874   5.8853 0.8615198 9.367239 
1 1 1   16    4   76 o   23.341   4.9854   24.443   9.1969   71.520   19.546   11.057   10.423   39.530   6.2754   16.614   6.0018 22.91617 8.683429 
1 1 1   16    4   77 o   13.534   5.2719   5.6773   8.3736  -0.6785   13.790   9.3893   10.539   14.123   6.2071   15.919   5.9845 -1.796600 8.622223 
1 1 1   16    4   78 o   52.113   2.3898  112.711   10.125   88.578   15.638  130.128   13.285   45.277   4.2881   55.753   2.9335 -10.47640 5.195540 
1 1 1   16    4   79 o   50.833   2.3946  107.324   9.8947   89.402   15.188  120.540   13.042   45.541   4.1363   53.600   2.9970 -8.059448 5.107983 
1 1 1   16    4   80 o   25.886   4.2248   29.424   8.6075   36.955   13.709   24.524   11.059   28.078   6.1595   22.912   5.8893 5.166727 8.521963 
1 1 1   16    4   81 o   23.492   4.2998   24.454   7.9305   14.801   11.403   33.497   11.037   18.254   6.3058   27.160   5.1740 -8.906046 8.156805 
1 1 1   16    4   82 f   37.841   2.7273   60.121   8.3561   59.464   12.045   60.729   11.602   36.991   4.0614   37.502   3.8500 -0.5109940 5.596154 
1 1 1   16    4   83 o   50.593   2.4179  106.755   9.9428  114.207   12.888   95.798   15.628   51.985   3.0548   46.910   4.1290 5.075031 5.136166 
1 1 1   16    4   84 o   16.883   5.1501   13.038   7.7329   10.359   11.257   15.431   10.641   16.205   6.1640   18.262   6.0942 -2.057066 8.667940 
1 1 1   16    4   85 o   19.484   5.1949   17.769   8.4011   10.720   13.731   21.987   10.621   16.889   6.6983   21.373   5.9021 -4.483696 8.927562 
1 1 1   16    4   86 o   28.329   4.0482   35.561   9.0827   35.009   16.547   35.799   10.866   25.825   7.4500   27.894   4.9606 -2.068745 8.950442 
1 1 1   16    4   87 o   17.369   5.5189   14.216   8.7822   3.9244   16.226   18.481   10.444   15.565   6.7896   19.470   5.9941 -3.904697 9.056862 
1 1 1   16    4   88 o   23.520   4.0476   24.863   7.4804   29.875   16.469   23.560   8.3965   23.475   7.5679   22.521   4.7248 0.9535370 8.921675 
1 1 1   16    4   89 o   18.635   4.8950   16.450   7.5303   19.307   15.931   15.628   8.5452   19.567   7.3574   18.009   5.3970 1.557732 9.124608 
1 1 1   16    4   90 o   11.005   4.8045   0.3748   8.1389   3.3519   15.017  -0.8633   9.6847   14.773   6.4856   11.493   5.1188 3.279553 8.262309 
1 1 1   16    4   91 o   21.421   6.0671   23.490   11.073   9.5071   15.555   37.855   15.766   16.318   6.8698   26.301   7.1621 -9.983391 9.924191 
1 1 1   16    4   92 o   20.864   6.2200   22.755   11.373   28.267   16.233   17.441   15.939   22.166   7.5276   18.493   7.2529 3.672688 10.45323 
1 1 1   16    4   93 f   43.948   3.6523   85.836   12.966   58.032   18.193  114.532   18.483   32.633   7.0460   49.608   4.6239 -16.97487 8.427756 
1 1 1   16    4   94 o   14.485   5.9678   7.6247   11.376   16.536   16.309  -0.8200   15.876   18.005   7.2462   13.812   6.3126 4.192503 9.610237 
1 1 1   16    4   95 o   13.166   5.4214   5.6529   9.3817  -0.7563   11.686   17.275   15.736   12.232   5.5209   18.114   7.1750 -5.882290 9.053220 
1 1 1   16    4   96 o   18.050   5.7829   16.845   9.6269   3.2343   11.825   43.588   16.576   13.255   5.7889   27.524   7.2781 -14.26896 9.299624 
1 1 1   16    4   97 o   17.559   5.7770   15.955   9.5714   13.842   12.020   19.618   15.823   16.625   6.3583   18.685   7.2557 -2.059807 9.647482 
1 1 1   16    4   98 o   19.290   5.8094   19.637   9.8830   36.431   12.707  -6.0763   15.723   26.245   6.0617   12.665   5.9544 13.58024 8.497041 
1 1 1   16    4   99 o   14.004   5.7877   7.3143   10.745   3.7965   12.329   18.426   21.912   13.441   5.8895   18.332   7.9443 -4.890598 9.889263 
1 1 1   16    4  100 o   12.936   5.8829  -0.0521   13.571  -3.4309   17.394   5.2048   21.696   13.548   6.3353   15.892   7.3064 -2.343965 9.670553 
1 1 1   16    4  101 o   13.853   6.1060   4.3888   13.433  -7.8560   16.970   24.939   21.984   12.717   6.0402   19.548   8.1944 -6.830890 10.17995 
1 1 1   16    4  102 o   16.061   6.8975   11.360   16.228  -0.1684   23.462   21.934   22.471   15.309   7.2208   18.779   8.0911 -3.470396 10.84459 
1 1 1   16    4  103 o   26.254   7.4997   42.705   16.847   26.441   23.890   58.796   23.762   19.573   8.3865   28.075   9.0937 -8.501751 12.37048 
1 1 1   16    4  104 o   17.394   7.1765   16.944   16.482   5.7287   24.193   26.659   22.516   16.068   7.4998   19.587   8.2569 -3.519295 11.15447 
1 1 1   16    4  105 o   15.233   6.6787   8.7536   15.877   14.833   24.432   4.3097   20.888   17.324   7.8842   15.286   7.0780 2.037478 10.59520 
1 1 1   16    4  106 o   15.667   6.7783   10.805   15.900   23.420   23.562   0.2586   21.545   18.692   8.1672   14.775   6.9536 3.917626 10.72645 
1 1 1   16    4  107 o   12.840   6.0069  -3.1138   15.665 -30.2409   23.077   20.068   21.333   12.092   6.0115   18.061   7.8328 -5.969314 9.873775 
1 1 1   16    4  108 o   21.260   8.5652   34.599   22.811   0.0000   0.0000   34.599   22.811  ?   ?    21.260   8.5652 0.000000 8.565178 
1 1 1   16    5 -105 o   19.999   8.6820   31.338   26.265   31.338   26.265   0.0000   0.0000   19.999   8.6820  ?   ?  0.000000 8.682035 
1 1 1   16    5 -104 o   22.983   9.1788   45.842   25.958   45.842   25.958   0.0000   0.0000   22.983   9.1788  ?   ?  0.000000 9.178829 
1 1 1   16    5 -103 o   14.354   6.9821 -10.7660   26.023 -10.7660   26.023   0.0000   0.0000   14.354   6.9821  ?   ?  0.000000 6.982097 
1 1 1   16    5 -102 o   27.018   8.3353   50.742   20.184   50.742   20.184   0.0000   0.0000   27.018   8.3353  ?   ?  0.000000 8.335277 
1 1 1   16    5 -101 o   13.849   6.4529  -0.8470   17.788  -0.8470   17.788   0.0000   0.0000   13.849   6.4529  ?   ?  0.000000 6.452942 
1 1 1   16    5 -100 o   12.966   6.1895  -8.2124   18.278  -8.2124   18.278   0.0000   0.0000   12.966   6.1895  ?   ?  0.000000 6.189452 
1 1 1   16    5  -99 o   12.673   5.9365  -4.2456   15.386 -12.0018   18.456   13.428   27.860   12.574   6.0589   17.563   8.1467 -4.988477 10.15276 
1 1 1   16    5  -98 o   17.557   7.5050   16.487   19.050   6.6258   26.487   27.054   27.420   16.659   7.7991   19.692   8.6998 -3.032331 11.68380 
1 1 1   16    5  -97 o   13.754   6.4869  -4.7212   18.927 -18.4861   26.668   9.2498   26.867   14.143   6.9202   17.121   7.9617 -2.978083 10.54884 
1 1 1   16    5  -96 o   16.846   7.3464   12.664   18.987  -7.4757   26.345   34.431   27.388   15.161   7.2884   21.243   9.0371 -6.081416 11.60993 
1 1 1   16    5  -95 o   11.224   5.4155 -13.5365   14.862  -4.1872   25.735 -18.2148   18.204   15.462   7.3706   11.920   5.8074 3.541782 9.383625 
1 1 1   16    5  -94 o   13.880   6.2933   1.2601   15.389   14.284   26.952  -5.0396   18.745   18.113   8.2578   13.804   6.4934 4.309188 10.50502 
1 1 1   16    5  -93 o   20.311   7.3056   24.244   15.423   3.0893   26.142   35.539   19.102   16.604   7.7651   23.419   8.1577 -6.814716 11.26251 
1 1 1   16    5  -92 o   16.795   6.4396   14.047   12.350   0.1915   16.946   29.742   18.036   14.240   6.5132   21.844   7.8945 -7.604801 10.23454 
1 1 1   16    5  -91 o   15.839   6.4006   10.975   12.781   15.021   17.636   6.4976   18.550   17.639   7.3630   15.881   7.0779 1.758202 10.21325 
1 1 1   16    5  -90 o   19.944   6.5912   21.601   12.455  -2.9648   17.254   48.331   17.997   13.890   6.4318   28.922   7.5531 -15.03236 9.920542 
1 1 1   16    5  -89 o   24.574   6.2606   31.642   12.574   16.225   17.012   50.205   18.668   18.125   7.3626   29.507   7.6860 -11.38187 10.64344 
1 1 1   16    5  -88 o   12.412   5.6188  -1.6672   12.209   2.1835   17.013  -5.7558   17.531   14.948   6.7115   13.704   6.3924 1.243559 9.268630 
1 1 1   16    5  -87 o   20.348   5.5361   20.466   9.4248  -9.1091   17.266   33.018   11.248   13.195   6.2148   26.039   5.4736 -12.84371 8.281520 
1 1 1   16    5  -86 o   11.653   5.0200   1.4731   8.6479  -2.1564   15.643   3.0706   10.378   13.847   6.3046   12.983   5.5443 0.8643818 8.395673 
1 1 1   16    5  -85 o   16.719   5.6001   13.171   8.9844  -5.5730   16.592   20.947   10.687   13.654   6.3174   20.495   6.0088 -6.840962 8.718699 
1 1 1   16    5  -84 o   19.456   5.4059   18.208   8.8802   7.8702   16.526   22.405   10.530   16.504   7.0204   21.338   5.8704 -4.833639 9.151428 
1 1 1   16    5  -83 o   26.603   4.6824   32.369   9.7835   35.719   26.617   31.846   10.520   24.545   9.4428   26.112   5.1255 -1.566912 10.74421 
1 1 1   16    5  -82 o   14.628   5.2492   8.9637   7.9574   1.8261   13.292   12.951   9.9343   14.105   6.1492   16.911   5.8834 -2.805781 8.510396 
1 1 1   16    5  -81 o   19.236   5.2684   17.346   8.5024   16.195   13.572   18.090   10.908   18.787   6.8398   19.444   6.1474 -0.6576023 9.196404 
1 1 1   16    5  -80 o   8.8042   4.1667  -8.0619   7.9354  -8.4990   12.845  -7.7921   10.091   11.744   5.4761   10.313   4.8234 1.431422 7.297461 
1 1 1   16    5  -79 o   12.469   5.0493   3.9461   7.9727  -9.7777   12.978   12.265   10.104   11.619   5.4456   16.808   5.9272 -5.189756 8.048956 
1 1 1   16    5  -78 o   27.790   3.9130   33.646   8.6189   22.883   13.546   40.968   11.172   21.777   6.8459   30.328   4.6687 -8.551361 8.286291 
1 1 1   16    5  -77 f   49.019   2.4513  100.087   9.7635  108.423   15.376   94.455   12.638   50.297   3.7780   47.203   3.3055 3.094189 5.019903 
1 1 1   16    5  -76 o   55.424   2.2756  127.417   10.259  117.940   15.871  134.218   13.445   52.553   3.7292   56.568   2.9257 -4.014511 4.739883 
1 1 1   16    5  -75 o   40.396   2.8195   68.391   9.2259   60.716   14.126   74.099   12.183   37.112   4.7805   41.693   3.6206 -4.581051 5.996832 
1 1 1   16    5  -74 o   26.730   3.6097   30.691   7.6644   24.135   10.670   37.679   11.016   22.852   5.7373   29.142   4.8047 -6.290075 7.483434 
1 1 1   16    5  -73 o   31.176   3.1701   41.111   7.9444   38.735   11.347   43.396   11.127   29.543   4.8821   31.507   4.4566 -1.963936 6.610303 
1 1 1   16    5  -72 f   20.049   4.6550   17.973   7.4612   16.918   10.556   19.026   10.547   19.326   6.0387   20.362   5.9695 -1.036077 8.491188 
1 1 1   16    5  -71 o   19.216   4.7712   16.534   7.4392   23.963   10.525   9.1166   10.516   22.883   5.6715   15.843   5.9733 7.039500 8.236853 
1 1 1   16    5  -70 o   20.066   4.4535   17.834   7.0943   4.6804   9.4692   34.665   10.711   13.698   5.5185   28.009   4.8679 -14.31107 7.358713 
1 1 1   16    5  -69 o   11.650   4.7589   2.6480   7.1555  -0.3326   9.2034   7.2034   11.378   11.847   5.1413   15.484   6.1111 -3.636502 7.986132 
1 1 1   16    5  -68 o   43.130   2.4543   77.103   8.5932   86.441   10.977   62.319   13.811   45.501   2.9758   37.979   4.5517 7.522392 5.438119 
1 1 1   16    5  -67 o   38.022   2.5795   60.037   7.9473   72.251   10.709   45.066   11.857   41.532   3.1876   32.219   4.6487 9.312401 5.636646 
1 1 1   16    5  -66 o   29.663   3.2050   37.024   7.6267   31.641   10.174   43.930   11.523   26.866   4.8231   31.867   4.5664 -5.000765 6.641799 
1 1 1   16    5  -65 o   40.664   2.2674   68.290   7.4861   59.766   11.710   74.182   9.7354   37.551   3.8814   42.231   2.8446 -4.680325 4.812181 
1 1 1   16    5  -64 o   64.203   1.6656  169.005   8.7095  155.100   12.836  180.867   11.856   61.249   2.5768   66.276   2.1976 -5.026180 3.386651 
1 1 1   16    5  -63 o   19.732   4.1402   16.933   6.4465   25.398   9.6572   10.129   8.6579   23.991   5.0956   15.915   5.4948 8.076508 7.493848 
1 1 1   16    5  -62 o   32.625   2.7153   44.224   7.1557   40.171   10.392   47.878   9.8678   30.650   4.2756   33.707   3.6496 -3.056667 5.621379 
1 1 1   16    5  -61 o   61.831   1.7795  156.745   8.9597  154.281   12.681  159.202   12.661   61.152   2.5495   62.134   2.5050 -0.9823151 3.574177 
1 1 1   16    5  -60 o   51.188   1.9634  107.577   8.1772  104.372   11.594  110.750   11.535   50.217   2.8440   51.760   2.7438 -1.543041 3.951757 
1 1 1   16    5  -59 o   32.637   2.6917   44.159   7.0974   37.668   10.034   50.659   10.040   29.734   4.2615   34.756   3.5958 -5.021395 5.575895 
1 1 1   16    5  -58 o   48.085   2.2342   95.087   8.7332   78.851   15.540  102.582   10.558   43.177   4.4804   49.869   2.6064 -6.691753 5.183339 
1 1 1   16    5  -57 o   73.304   1.7731  219.910   10.595  211.154   17.869  224.657   13.157   71.473   3.0743   73.981   2.1841 -2.508049 3.771158 
1 1 1   16    5  -56 o   56.268   1.8217  129.704   8.3444  117.768   12.261  140.004   11.389   53.418   2.8257   58.354   2.3994 -4.935360 3.707021 
1 1 1   16    5  -55 o   95.565   1.5795  373.303   12.304  351.892   16.993  396.895   17.838   92.646   2.2502   98.398   2.2240 -5.752556 3.163738 
1 1 1   16    5  -54 o   55.006   1.9420  123.983   8.6936  129.806   13.719  120.076   11.238   56.076   3.0123   54.024   2.5593 2.051910 3.952715 
1 1 1   16    5  -53 o   82.274   1.6286  276.653   10.922  262.556   17.125  286.319   14.180   79.929   2.6320   83.625   2.0802 -3.696175 3.354789 
1 1 1   16    5  -52 o   76.943   1.6751  241.968   10.506  226.131   16.323  253.169   13.728   74.169   2.7043   78.606   2.1444 -4.436256 3.451362 
1 1 1   16    5  -51 o   12.048   4.7484   3.5188   6.8604   12.779   10.705  -2.9357   8.9371   17.982   6.1128   11.115   4.9357 6.866603 7.856670 
1 1 1   16    5  -50 o   67.209   1.8333  184.791   10.034  184.377   16.393  185.039   12.689   66.923   3.0127   67.179   2.3207 -0.2564087 3.802933 
1 1 1   16    5  -49 o   14.538   5.0237   8.0144   7.2376   0.1961   10.977   14.028   9.6268   13.363   5.7041   18.361   5.7711 -4.998030 8.114305 
1 1 1   16    5  -48 o   90.895   1.7339  337.555   12.847  321.576   17.194  357.751   19.330   88.590   2.3831   93.410   2.5410 -4.820107 3.483683 
1 1 1   16    5  -47 o   35.135   3.2012   51.124   9.0678   42.965   12.606   59.871   13.053   31.792   5.0318   37.821   4.3108 -6.029339 6.625864 
1 1 1   16    5  -46 o   30.861   3.6818   39.748   9.0796   37.250   12.653   42.399   13.037   29.462   5.4699   31.533   5.2569 -2.071396 7.586427 
1 1 1   16    5  -45 o   90.263   1.7881  332.825   13.156  348.608   18.293  315.916   18.935   92.257   2.4347   87.782   2.6492 4.475464 3.598047 
1 1 1   16    5  -44 o   27.414   5.0795   32.116   10.933   44.625   13.560   8.8714   18.483   32.379   5.3222   19.410   7.7474 12.96938 9.399393 
1 1 1   16    5  -43 o   88.639   1.9845  321.045   14.339  292.412   20.753  347.197   19.834   84.398   3.0215   92.049   2.6461 -7.650772 4.016337 
1 1 1   16    5  -42 o   70.488   2.1994  203.310   12.622  201.438   18.899  204.818   16.958   69.984   3.3223   70.637   2.9517 -0.6527252 4.444147 
1 1 1   16    5  -41 o   66.113   2.0174  178.747   10.859  184.185   18.365  175.822   13.466   66.912   3.3779   65.507   2.5265 1.405449 4.218274 
1 1 1   16    5  -40 o   56.685   2.4593  131.661   11.336  139.220   17.259  125.926   15.034   58.108   3.6624   55.307   3.3505 2.801716 4.963761 
1 1 1   16    5  -39 o   62.389   2.0661  159.196   10.493  165.837   17.569  155.513   13.083   63.493   3.4070   61.599   2.6114 1.894455 4.292731 
1 1 1   16    5  -38 o   35.401   3.0847   51.722   8.8127   37.807   15.183   58.791   10.822   29.574   6.4778   37.686   3.5653 -8.112841 7.394179 
1 1 1   16    5  -37 o   71.710   1.8729  210.115   10.938  225.559   18.342  201.591   13.627   74.152   3.0409   70.185   2.3853 3.967522 3.864800 
1 1 1   16    5  -36 o   34.285   3.1690   48.556   8.7563   46.841   15.245   49.400   10.697   33.149   5.8560   34.473   3.8736 -1.323353 7.021183 
1 1 1   16    5  -35 o  100.627   1.8518  413.394   15.189  415.539   22.521  411.605   20.573  100.750   2.7448  100.306   2.5182 0.4434128 3.724911 
1 1 1   16    5  -34 o   47.098   2.6125   90.976   9.9904  102.112   16.178   84.113   12.701   49.703   4.0276   45.168   3.4765 4.535553 5.320491 
1 1 1   16    5  -33 o   71.098   2.0271  206.584   11.736  198.370   18.603  212.014   15.126   69.514   3.2923   71.967   2.5826 -2.453415 4.184404 
1 1 1   16    5  -32 o  170.854   1.8162  1191.51   25.295  1225.51   37.936  1164.31   33.941  173.121   2.6883  168.786   2.4669 4.335007 3.648600 
1 1 1   16    5  -31 o  116.006   1.7785  549.249   16.818  537.079   25.711  558.349   22.234  114.603   2.7523  116.905   2.3332 -2.301781 3.608166 
1 1 1   16    5  -30 o   71.177   2.1996  207.106   12.747  188.210   38.070  209.492   13.528   66.889   7.0901   71.574   2.3217 -4.684937 7.460576 
1 1 1   16    5  -29 o  134.989   1.7301  743.614   19.037  718.268   34.467  754.740   22.837  132.469   3.1919  135.959   2.0606 -3.490402 3.799262 
1 1 1   16    5  -28 o  116.343   1.7355  552.364   16.459  515.921   30.066  567.957   19.668  112.212   3.2906  117.945   2.0457 -5.733757 3.874648 
1 1 1   16    5  -27 o   94.532   1.9089  364.757   14.709  375.603   33.211  362.111   16.406   95.551   4.2748   94.171   2.1372 1.380119 4.779264 
1 1 1   16    5  -26 o  144.258   1.7441  849.210   20.509  808.366   36.770  867.655   24.710  140.543   3.2096  145.779   2.0794 -5.236282 3.824338 
1 1 1   16    5  -25 o  153.897   1.7994  966.532   22.573  974.995   43.886  963.487   26.322  154.299   3.4892  153.619   2.1021 0.6804810 4.073467 
1 1 1   16    5  -24 o   51.268   2.5691  107.666   10.702   86.438   24.162  112.848   11.937   45.184   6.7681   52.466   2.8014 -7.281807 7.324941 
1 1 1   16    5  -23 o   16.986   5.4628   11.591   8.5848  -4.1550   15.879   18.093   10.205   15.099   6.6477   20.657   5.8153 -5.557669 8.832326 
1 1 1   16    5  -22 o  114.950   1.6878  539.113   15.815  534.967   21.467  544.033   23.386  114.455   2.3010  115.402   2.4861 -0.9468079 3.387486 
1 1 1   16    5  -21 o  123.329   1.7806  620.639   17.901  610.329   27.145  628.572   23.812  122.206   2.7250  124.061   2.3546 -1.855392 3.601366 
1 1 1   16    5  -20 o  149.600   1.6517  913.043   20.141  931.099   32.936  902.257   25.456  150.953   2.6766  148.669   2.1006 2.283493 3.402460 
1 1 1   16    5  -19 o   51.354   2.3564  107.920   9.8377  113.547   17.629  105.375   11.855   52.462   4.1564   50.692   2.8809 1.769905 5.057163 
1 1 1   16    5  -18 o   16.074   5.4691   9.8279   8.5692   12.643   15.713   8.6362   10.223   19.752   7.3309   16.157   5.9279 3.594854 9.427741 
1 1 1   16    5  -17 o  152.279   1.6586  946.003   20.588  990.222   33.964  920.317   25.886  155.681   2.6764  150.154   2.1149 5.527435 3.411127 
1 1 1   16    5  -16 o  124.268   1.5350  629.897   15.549  628.743   23.216  630.835   20.939  124.094   2.2950  124.321   2.0663 -0.2269669 3.088143 
1 1 1   16    5  -15 o   97.838   1.6873  390.509   13.457  377.243   21.648  398.863   17.179   96.046   2.7679   98.852   2.1319 -2.805229 3.493799 
1 1 1   16    5  -14 o  204.626   1.7739  1708.35   29.589  1692.85   45.952  1719.32   38.674  203.546   2.7695  205.209   2.3120 -1.662659 3.607717 
1 1 1   16    5  -13 o   38.948   2.8610   62.320   9.0197   64.993   15.317   60.901   11.160   39.492   4.8603   38.408   3.6067 1.084263 6.052373 
1 1 1   16    5  -12 o  160.270   1.6498  1047.82   21.553  1028.08   33.748  1061.42   28.009  158.650   2.6096  161.260   2.1308 -2.610275 3.369018 
1 1 1   16    5  -11 o  108.390   1.5717  479.209   13.886  481.414   21.024  477.503   18.495  108.585   2.3753  108.164   2.0976 0.4208145 3.168939 
1 1 1   16    5  -10 o   75.465   1.7774  232.345   10.934  221.363   16.638  240.691   14.505   73.555   2.7800   76.747   2.3213 -3.191689 3.621698 
1 1 1   16    5   -9 o  104.946   1.5939  449.247   13.635  423.231   20.290  470.672   18.413  101.808   2.4449  107.388   2.1034 -5.580498 3.225220 
1 1 1   16    5   -8 o   41.484   2.6512   70.579   8.9183   71.332   14.222   70.090   11.449   41.503   4.2644   41.253   3.4359 0.2508392 5.476349 
1 1 1   16    5   -7 o   57.093   2.0777  133.203   9.6531  123.271   15.091  140.081   12.558   54.794   3.3954   58.504   2.6401 -3.709095 4.301083 
1 1 1   16    5   -6 o   94.491   1.8011  364.263   13.873  344.422   18.976  387.044   20.333   91.801   2.5383   97.317   2.5654 -5.515938 3.608874 
1 1 1   16    5   -5 o   69.018   2.1764  194.622   12.229  186.725   17.627  201.951   16.981   67.504   3.2126   70.234   2.9727 -2.730339 4.376984 
1 1 1   16    5   -4 o  173.505   1.8385  1228.23   26.002  1250.17   37.499  1207.91   36.087  174.954   2.6294  171.979   2.5742 2.975357 3.679702 
1 1 1   16    5   -3 o   69.737   2.0797  198.650   11.809  179.803   16.303  219.454   17.129   66.259   3.0264   73.230   2.8750 -6.971909 4.174306 
1 1 1   16    5   -2 o   78.172   1.7690  249.298   11.272  255.381   17.308  244.816   14.855   79.025   2.6908   77.402   2.3571 1.623222 3.577206 
1 1 1   16    5   -1 o   82.054   1.7378  274.668   11.624  280.067   17.757  270.621   15.375   82.766   2.6354   81.386   2.3200 1.380371 3.511063 
1 1 1   16    5    0 o   90.918   1.6702  337.190   12.378  321.424   18.564  349.810   16.609   88.679   2.5709   92.575   2.2010 -3.896271 3.384359 
1 1 1   16    5    1 o  155.773   1.5716  989.730   19.956  975.630   29.039  1002.35   27.472  154.593   2.3044  156.712   2.1505 -2.118912 3.151973 
1 1 1   16    5    2 o   75.274   1.8261  231.173   11.205  221.897   17.109  238.139   14.827   73.640   2.8557   76.335   2.3857 -2.695755 3.721107 
1 1 1   16    5    3 o  106.191   1.6129  459.967   13.962  462.912   21.138  457.687   18.595  106.477   2.4355  105.895   2.1542 0.5818634 3.251437 
1 1 1   16    5    4 o   97.197   1.6508  385.362   13.079  383.487   19.794  386.815   17.426   96.875   2.5087   97.349   2.1959 -0.4737854 3.334042 
1 1 1   16    5    5 o  160.038   1.5795  1044.68   20.605  1060.26   30.428  1031.48   28.002  161.156   2.3163  158.971   2.1609 2.185394 3.167744 
1 1 1   16    5    6 o   47.176   2.6039   91.173   9.9746   77.892   14.535  102.995   13.713   43.406   4.1587   50.069   3.3798 -6.663357 5.358948 
1 1 1   16    5    7 o   90.393   1.6884  333.316   12.441  330.890   18.893  335.173   16.531   89.974   2.5787   90.614   2.2380 -0.6402664 3.414430 
1 1 1   16    5    8 o   46.363   2.6907   88.098   10.125   78.591   14.846   96.366   13.845   43.590   4.2314   48.404   3.5332 -4.814392 5.512551 
1 1 1   16    5    9 o   97.858   1.9463  390.759   15.525  417.168   20.282  353.391   24.127  101.074   2.4617   92.914   3.1902 8.160316 4.029615 
1 1 1   16    5   10 o   34.420   3.7906   49.084   10.459   53.261   13.972   43.757   15.776   35.683   4.9354   32.033   6.2663 3.649799 7.976464 
1 1 1   16    5   11 o   74.736   2.3230  228.255   14.135  221.859   19.359  235.557   20.686   73.587   3.2353   75.814   3.3555 -2.227272 4.661204 
1 1 1   16    5   12 o  118.172   1.8151  569.763   17.484  575.520   25.730  564.823   23.831  118.697   2.6593  117.605   2.4859 1.091530 3.640273 
1 1 1   16    5   13 o   57.606   2.2348  135.671   10.474  136.058   17.521  135.456   13.066   57.526   3.7569   57.510   2.7956 0.1621628E-01 4.682903 
1 1 1   16    5   14 o   70.475   1.9849  202.849   11.391  211.429   19.337  198.289   14.097   71.820   3.3118   69.636   2.4874 2.184334 4.141903 
1 1 1   16    5   15 o   62.522   2.5178  159.913   12.806  179.238   43.212  158.052   13.408   65.081   8.3365   62.144   2.6529 2.936848 8.748480 
1 1 1   16    5   16 o   96.806   1.8849  382.405   14.874  347.617   29.130  394.675   17.299   92.039   3.8914   98.328   2.1583 -6.289726 4.449891 
1 1 1   16    5   17 o   90.130   1.9175  331.505   14.088  360.689   27.567  321.190   16.389   93.797   3.6122   88.666   2.2695 5.130699 4.265995 
1 1 1   16    5   18 o  101.615   1.8577  421.347   15.388  437.401   29.437  415.311   18.050  103.319   3.5003  100.861   2.1954 2.457382 4.131826 
1 1 1   16    5   19 o   82.415   1.8421  277.159   12.375  276.353   20.561  277.617   15.496   82.151   3.0759   82.423   2.3087 -0.2719193 3.845910 
1 1 1   16    5   20 o   32.931   3.4748   44.877   9.1872   39.160   15.766   47.816   11.305   30.196   6.5908   33.895   4.1801 -3.699200 7.804650 
1 1 1   16    5   21 o   19.642   5.9120   16.068   10.237   27.169   15.029   6.4574   13.983   25.226   7.0415   17.007   6.7549 8.218639 9.757648 
1 1 1   16    5   22 o   38.443   3.2951   60.914   10.226   49.902   16.275   68.096   13.145   34.273   6.0465   40.557   4.0293 -6.284218 7.266036 
1 1 1   16    5   23 o   81.482   1.9782  271.001   13.139  273.663   20.198  269.048   17.299   81.744   3.0366   81.101   2.6202 0.6429291 4.010774 
1 1 1   16    5   24 o  102.428   1.8427  428.166   15.386  406.113   22.988  446.060   20.707   99.627   2.8335  104.496   2.4310 -4.869225 3.733461 
1 1 1   16    5   25 o   56.821   2.4444  132.140   11.295  132.472   17.651  131.910   14.700   56.720   3.8403   56.688   3.1940 0.3181458E-01 4.994945 
1 1 1   16    5   26 o   23.218   5.8254   23.132   11.006   12.757   15.151   34.723   16.014   19.572   7.2103   28.362   6.9759 -8.789394 10.03254 
1 1 1   16    5   27 o   97.879   1.9763  391.089   15.768  410.621   26.448  380.318   19.640  100.107   3.2454   96.444   2.5003 3.663376 4.096878 
1 1 1   16    5   28 o  145.067   1.9170  859.017   22.669  877.690   37.011  847.806   28.678  146.456   3.1002  144.049   2.4423 2.406998 3.946658 
1 1 1   16    5   29 o   90.805   2.0039  336.636   14.833  333.605   24.291  338.438   18.730   90.205   3.3091   90.968   2.5283 -0.7631149 4.164474 
1 1 1   16    5   30 o   65.989   2.5544  178.241   13.714  186.249   30.142  176.150   15.401   66.933   5.5751   65.561   2.8888 1.371735 6.279060 
1 1 1   16    5   31 o   29.075   5.0368   35.806   11.505   47.344   28.319   33.525   12.591   33.086   9.8032   27.989   5.7125 5.097368 11.34612 
1 1 1   16    5   32 o   51.771   3.3021  110.215   13.862   0.0000   0.0000  110.215   13.862  ?   ?    51.771   3.3021 0.000000 3.302068 
1 1 1   16    5   33 o   25.691   6.3003   28.465   13.092   38.132   25.611   25.045   15.232   30.019   9.4098   24.299   7.1870 5.719595 11.84052 
1 1 1   16    5   34 o   19.603   6.2848   15.621   11.369   23.437   17.088   9.4135   15.228   23.911   7.7088   18.436   7.1292 5.474619 10.50010 
1 1 1   16    5   35 o   57.148   2.8891  133.990   13.415  111.961   19.837  152.555   18.210   51.919   4.7394   60.868   3.6875 -8.949711 6.004947 
1 1 1   16    5   36 o   88.053   2.2940  317.055   16.452  328.307   24.000  307.080   22.596   89.446   3.2973   86.518   3.2096 2.928299 4.601439 
1 1 1   16    5   37 o   50.659   2.7264  105.303   11.217  137.267   19.614   89.768   13.674   57.620   4.2050   46.634   3.6256 10.98626 5.552216 
1 1 1   16    5   38 o   92.061   1.9973  346.171   14.988  380.931   25.153  327.033   18.664   96.357   3.2068   89.382   2.5643 6.975655 4.106009 
1 1 1   16    5   39 o   12.906   5.4527   0.7025   9.8560  -0.0667   16.911   1.0981   12.129   16.494   7.0613   14.358   6.0567 2.136268 9.302999 
1 1 1   16    5   40 o   31.422   5.0390   41.805   12.471   34.801   18.366   47.796   16.987   28.276   7.7426   33.307   6.4901 -5.030634 10.10289 
1 1 1   16    5   41 o  108.852   2.0137  484.096   17.868  461.284   29.154  497.820   22.613  105.971   3.3793  110.309   2.5148 -4.338608 4.212387 
1 1 1   16    5   42 o   90.663   2.1070  335.941   15.571  367.966   26.460  318.974   19.260   94.608   3.4368   88.228   2.6811 6.379982 4.358842 
1 1 1   16    5   43 o   26.229   5.3714   29.564   11.098   5.7759   19.724   40.583   13.424   19.091   7.8610   30.803   5.5504 -11.71222 9.622973 
1 1 1   16    5   44 o  135.461   1.9820  749.888   21.885  772.292   36.356  737.156   27.407  137.160   3.2517  134.199   2.5054 2.961075 4.104951 
1 1 1   16    5   45 o   48.617   3.0177   97.327   11.900   94.479   20.482   98.778   14.621   47.370   5.4008   48.856   3.6988 -1.486496 6.545986 
1 1 1   16    5   46 o   79.707   2.1905  260.059   14.219  264.042   24.101  257.933   17.610   79.997   3.7060   79.286   2.7288 0.7109299 4.602289 
1 1 1   16    5   47 o   53.009   2.6851  115.457   11.564  131.223   20.032  107.576   14.163   56.153   4.4117   51.031   3.4245 5.121655 5.584876 
1 1 1   16    5   48 o  115.376   1.9287  544.188   18.139  562.732   30.113  533.628   22.724  116.988   3.1607  114.148   2.4422 2.839775 3.994243 
1 1 1   16    5   49 o   57.994   2.4514  138.016   11.563  143.800   19.474  134.867   14.370   58.849   4.0849   57.212   3.0928 1.637539 5.123621 
1 1 1   16    5   50 o   69.444   2.1906  197.586   12.385  192.001   20.285  200.905   15.638   68.134   3.6659   69.921   2.7491 -1.787117 4.582174 
1 1 1   16    5   51 o   93.844   1.9538  360.227   14.946  351.875   24.206  365.373   19.000   92.413   3.2182   94.379   2.4718 -1.965927 4.057930 
1 1 1   16    5   52 o   34.406   4.2257   49.794   11.603   49.434   20.951   49.954   13.935   33.207   7.8625   34.210   5.1572 -1.003368 9.402940 
1 1 1   16    5   53 o   39.800   3.6643   66.000   11.755   67.025   21.906   65.585   13.930   38.994   7.1553   39.486   4.4028 -0.4916763 8.401346 
1 1 1   16    5   54 o   58.920   2.7931  143.022   13.377  146.868   24.126  141.314   16.073   59.000   5.0655   58.419   3.3899 0.5812454 6.095141 
1 1 1   16    5   55 o   51.773   2.8765  110.628   12.092  111.402   17.437  109.912   16.783   51.600   4.1815   51.293   4.0466 0.3065262 5.818953 
1 1 1   16    5   56 o   45.654   3.1672   86.400   11.714   68.800   16.996  102.322   16.166   40.074   5.3355   49.452   4.0456 -9.378395 6.695849 
1 1 1   16    5   57 o   37.673   3.7272   59.437   11.296   60.648   16.285   58.315   15.682   37.495   5.4908   36.790   5.3891 0.7046890 7.693584 
1 1 1   16    5   58 o   36.901   3.2013   56.690   9.5343   23.471   16.479   73.405   11.690   23.247   7.5762   41.960   3.4480 -18.71358 8.323879 
1 1 1   16    5   59 o   26.250   4.4422   29.612   9.1665   19.691   16.517   34.027   11.019   21.814   7.5864   28.008   5.0105 -6.194466 9.091651 
1 1 1   16    5   60 o   53.707   2.4622  118.897   10.750  114.017   18.288  121.474   13.289   51.974   4.3567   54.134   3.0235 -2.160378 5.303047 
1 1 1   16    5   61 o   25.241   4.5506   27.578   9.0186   18.779   16.048   31.639   10.903   21.300   7.4731   26.884   5.1630 -5.583607 9.083205 
1 1 1   16    5   62 o   53.922   2.4521  119.970   10.750  132.476   18.917  114.005   13.064   56.038   4.1712   52.378   3.0733 3.659351 5.181115 
1 1 1   16    5   63 o   31.277   3.6713   41.361   9.1819   53.997   16.147   35.322   11.162   34.927   5.8803   28.436   4.9978 6.490704 7.717286 
1 1 1   16    5   64 o   36.514   3.2007   55.799   9.4304   57.708   16.775   54.918   11.403   36.070   5.9100   35.979   3.9531 0.9088135E-01 7.110164 
1 1 1   16    5   65 o  100.023   1.8234  410.467   14.866  396.230   22.838  420.936   19.584   97.758   2.8691  101.057   2.3773 -3.299248 3.726040 
1 1 1   16    5   66 o   83.136   1.9106  283.839   12.948  260.892   20.159  299.953   16.893   79.144   3.1309   85.229   2.4340 -6.085136 3.965671 
1 1 1   16    5   67 o   47.665   2.8363   94.536   10.970   84.574   15.679  104.090   15.355   44.442   4.3852   49.617   3.8260 -5.174706 5.819644 
1 1 1   16    5   68 o   19.847   5.6012   17.731   9.4550   20.329   13.938   15.516   12.869   21.252   6.9703   19.148   6.6939 2.104752 9.663993 
1 1 1   16    5   69 o   26.958   5.1675   32.383   10.942   37.411   19.232   29.976   13.306   27.737   8.0407   25.423   6.4202 2.313829 10.28941 
1 1 1   16    5   70 o   14.900   5.5107   8.1879   8.8646   8.7330   18.485   8.0251   10.102   18.361   7.5902   15.282   5.8329 3.079170 9.572561 
1 1 1   16    5   71 o   49.663   2.6234  102.600   10.582  107.135   20.872  101.030   12.278   49.291   5.2767   49.093   3.0836 0.1982040 6.111623 
1 1 1   16    5   72 f   47.541   2.4973   93.923   9.6438   90.100   15.623   96.277   12.258   45.748   4.2375   47.862   3.1596 -2.113834 5.285762 
1 1 1   16    5   73 o   21.094   4.8983   20.042   8.2606   45.317   14.245   7.2358   10.140   31.543   5.7519   14.905   5.8026 16.63777 8.170347 
1 1 1   16    5   74 o   43.156   2.7076   77.796   9.4770   75.274   15.227   79.391   12.108   41.536   4.5728   43.269   3.4616 -1.733025 5.735314 
1 1 1   16    5   75 o   44.070   2.9633   81.565   10.583   85.048   20.932   80.369   12.267   43.041   6.1400   43.499   3.4888 -0.4581833 7.061996 
1 1 1   16    5   76 o   44.510   2.7075   82.870   9.7768   77.401   16.072   86.082   12.318   41.894   4.7925   45.051   3.3789 -3.156620 5.863866 
1 1 1   16    5   77 f   61.826   2.3219  158.746   11.681  146.247   20.364  164.875   14.261   58.015   4.3375   62.750   2.7950 -4.735043 5.160031 
1 1 1   16    5   78 o   24.733   4.4549   27.259   8.6511   11.649   13.957   37.000   11.024   17.508   6.8100   28.679   4.8911 -11.17134 8.384442 
1 1 1   16    5   79 o   61.188   2.1763  155.391   10.837  132.081   16.786  172.052   14.191   55.439   3.7363   64.066   2.7236 -8.626904 4.623620 
1 1 1   16    5   80 o   12.463   5.1095   3.6104   8.2857   2.2640   13.290   4.4664   10.597   14.345   6.2017   13.850   5.7382 0.4946184 8.449141 
1 1 1   16    5   81 o   45.228   2.5886   85.886   9.5038   70.142   12.801  105.224   14.187   40.068   3.9714   49.464   3.5419 -9.395733 5.321396 
1 1 1   16    5   82 o   15.995   5.3321   11.547   8.1465   3.3348   12.660   17.351   10.643   14.249   6.1052   19.022   6.0790 -4.772656 8.615527 
1 1 1   16    5   83 o   37.865   2.9596   61.082   9.0623   51.812   13.588   68.509   12.162   33.448   5.1486   39.562   3.8188 -6.113445 6.410240 
1 1 1   16    5   84 o   15.545   5.7942   10.257   9.8356   3.0337   12.560   21.710   15.815   13.980   6.0365   20.548   7.3970 -6.567754 9.547476 
1 1 1   16    5   85 o   16.186   6.3254   10.812   12.086   10.812   12.086   0.0000   0.0000   16.186   6.3254  ?   ?  0.000000 6.325416 
1 1 1   16    5   86 o   21.541   4.8947   21.970   8.3987   16.312   12.134   27.175   11.637   18.215   6.4881   23.211   6.0794 -4.996778 8.891307 
1 1 1   16    5   87 o   11.712   4.8662   3.1905   7.6518   1.8447   11.486   4.2643   10.260   13.042   5.7003   13.254   5.5797 -0.2125721 7.976612 
1 1 1   16    5   88 o   13.042   5.6823   2.3578   11.336   4.9271   13.240  -4.6955   21.938   14.421   6.2120   15.187   7.1059 -0.7662764 9.438354 
1 1 1   16    5   89 o   21.923   5.7916   24.532   10.503   23.175   11.967   29.084   21.914   20.848   6.4157   21.595   8.4940 -0.7470245 10.64468 
1 1 1   16    5   90 o   37.978   3.6932   64.451   11.289   58.626   12.830   84.429   23.761   35.439   4.5457   38.237   7.8854 -2.797642 9.101788 
1 1 1   16    5   91 o   19.292   6.0818   19.644   10.684   27.844   12.031 -10.9531   23.239   22.815   6.2742   14.432   6.9136 8.382035 9.336149 
1 1 1   16    5   92 o   17.964   6.1280   16.922   10.759   20.626   12.065   2.5358   23.779   19.448   6.4891   16.196   7.5173 3.252131 9.930721 
1 1 1   16    5   93 o   24.594   5.1903   29.958   10.078   26.358   12.336   37.182   17.475   21.896   6.4656   24.533   7.7837 -2.637012 10.11880 
1 1 1   16    5   94 o   8.8065   4.2668 -11.9969   9.4686  -6.2686   11.483 -24.1632   16.735   10.900   5.1131   10.799   5.3234 0.1004105 7.381258 
1 1 1   16    5   95 o   14.929   5.8862   10.032   10.546  -3.6045   11.777   65.240   23.696   11.526   5.3291   30.886   8.9169 -19.35967 10.38797 
1 1 1   16    5   96 o   16.628   6.1319   14.349   10.962   7.1421   12.382   40.474   23.574   14.339   6.0873   23.246   8.9010 -8.906590 10.78346 
1 1 1   16    5   97 o   23.569   5.8970   29.556   11.301   20.737   12.801   60.702   24.056   19.054   6.6752   28.882   9.1289 -9.827856 11.30903 
1 1 1   16    5   98 o   18.408   7.0442   19.711   14.758   18.214   18.913   22.042   23.598   17.952   7.5675   18.843   8.2042 -0.8904037 11.16135 
1 1 1   16    5   99 o   13.039   6.0389  -1.7884   15.219   27.365   20.069 -41.2404   23.346   20.091   8.0547   11.507   5.7699 8.583277 9.908037 
1 1 1   16    5  100 o   13.934   6.7102  -9.4600   22.561   0.0000   0.0000  -9.4600   22.561  ?   ?    13.934   6.7102 0.000000 6.710247 
1 1 1   16    5  101 o   14.080   6.7303  -6.1256   21.769   0.0000   0.0000  -6.1256   21.769  ?   ?    14.080   6.7303 0.000000 6.730284 
1 1 1   16    5  102 o   15.368   6.7130   9.4867   15.910   21.787   23.782  -0.4774   21.405   18.403   8.1174   14.658   6.9085 3.745140 10.65925 
1 1 1   16    5  103 o   23.609   7.5899   36.551   16.573   31.485   24.805   40.637   22.274   20.088   8.5748   22.756   8.6670 -2.667299 12.19202 
1 1 1   16    5  104 o   12.800   6.0055  -3.5322   15.854   17.292   23.459 -21.0379   21.509   17.531   7.8753   12.385   6.0913 5.145684 9.956113 
1 1 1   16    5  105 o   13.063   6.1143  -2.8068   16.266 -14.1251   24.612   5.9710   21.675   13.800   6.7297   15.601   7.2188 -1.800942 9.869115 
1 1 1   16    6 -102 o   16.510   7.6657   10.047   24.758   10.047   24.758   0.0000   0.0000   16.510   7.6657  ?   ?  0.000000 7.665703 
1 1 1   16    6 -101 o   16.316   7.6685   8.0129   26.048   8.0129   26.048   0.0000   0.0000   16.316   7.6685  ?   ?  0.000000 7.668549 
1 1 1   16    6 -100 o   17.649   8.0595   18.031   25.808   18.031   25.808   0.0000   0.0000   17.649   8.0595  ?   ?  0.000000 8.059531 
1 1 1   16    6  -99 o   27.085   9.7230   64.460   27.304   64.460   27.304   0.0000   0.0000   27.085   9.7230  ?   ?  0.000000 9.723020 
1 1 1   16    6  -98 o   28.170   9.8234   68.537   27.704   68.537   27.704   0.0000   0.0000   28.170   9.8234  ?   ?  0.000000 9.823431 
1 1 1   16    6  -97 o   22.386   8.0704   34.976   18.834   34.976   18.834   0.0000   0.0000   22.386   8.0704  ?   ?  0.000000 8.070429 
1 1 1   16    6  -96 o   15.166   6.8639   6.0921   18.205   6.0921   18.205   0.0000   0.0000   15.166   6.8639  ?   ?  0.000000 6.863874 
1 1 1   16    6  -95 o   13.151   6.2512  -6.9760   18.245  -6.9760   18.245   0.0000   0.0000   13.151   6.2512  ?   ?  0.000000 6.251209 
1 1 1   16    6  -94 o   15.205   6.8503   5.9968   17.895   5.9968   17.895   0.0000   0.0000   15.205   6.8503  ?   ?  0.000000 6.850254 
1 1 1   16    6  -93 o   18.604   7.6491   20.609   18.639   20.609   18.639   0.0000   0.0000   18.604   7.6491  ?   ?  0.000000 7.649102 
1 1 1   16    6  -92 o   19.700   8.5532   25.923   25.498   25.923   25.498   0.0000   0.0000   19.700   8.5532  ?   ?  0.000000 8.553219 
1 1 1   16    6  -91 o   13.962   6.7922 -16.3770   24.645 -16.3770   24.645   0.0000   0.0000   13.962   6.7922  ?   ?  0.000000 6.792240 
1 1 1   16    6  -90 o   19.642   7.1599   22.498   14.878   1.5525   25.062   33.897   18.489   16.114   7.5573   22.876   8.0217 -6.762074 11.02089 
1 1 1   16    6  -89 o   16.595   6.8521   12.757   15.041  -5.2445   25.792   22.033   18.515   15.516   7.3915   19.349   7.7437 -3.832733 10.70508 
1 1 1   16    6  -88 o   17.838   7.0447   16.738   15.128   19.621   26.101   15.279   18.564   19.084   8.4568   17.689   7.4791 1.394545 11.28959 
1 1 1   16    6  -87 o   22.512   7.2325   29.479   15.050   23.698   26.358   32.276   18.332   19.934   8.6752   22.698   7.9854 -2.763113 11.79096 
1 1 1   16    6  -86 o   12.165   5.5336  -1.8343   12.017   5.2160   16.410  -9.9856   17.645   15.189   6.7195   12.941   6.1503 2.248376 9.109274 
1 1 1   16    6  -85 o   14.211   5.6254   7.9519   9.6667   18.374   16.664   2.6664   11.867   18.708   7.3920   13.256   5.7940 5.452125 9.392108 
1 1 1   16    6  -84 o   19.739   5.6647   19.597   9.5902   31.810   17.260   14.142   11.535   23.327   7.7609   17.073   6.2910 6.254528 9.990434 
1 1 1   16    6  -83 o   22.351   5.7231   24.917   10.471   25.836   17.341   24.389   13.136   21.444   7.7423   21.431   6.7422 0.1322937E-01 10.26645 
1 1 1   16    6  -82 o   28.795   4.4180   37.894   10.039   37.089   16.936   38.331   12.466   25.833   7.5617   28.047   5.6481 -2.213625 9.438232 
1 1 1   16    6  -81 o   31.172   4.0271   43.402   9.9939   28.945   17.299   50.644   12.244   22.844   7.7708   33.250   4.6439 -10.40614 9.052645 
1 1 1   16    6  -80 o   21.875   5.7920   23.496   10.489   33.939   25.753   21.419   11.485   23.795   9.2520   20.663   6.2711 3.132034 11.17699 
1 1 1   16    6  -79 o   11.224   4.9418  -0.4395   8.7758   19.398   15.641  -9.5539   10.602   19.844   7.3233   10.176   4.8161 9.667596 8.765025 
1 1 1   16    6  -78 o   14.931   5.5238   9.1196   8.9081   18.074   15.475   4.6820   10.894   19.515   7.2690   13.920   5.7968 5.595487 9.297359 
1 1 1   16    6  -77 o   34.462   3.5171   51.312   9.7417   49.548   17.394   52.119   11.759   31.439   6.9700   34.268   4.3044 -2.828283 8.192017 
1 1 1   16    6  -76 o   24.903   4.5500   27.970   8.8961   37.205   14.386   22.252   11.320   27.573   6.5064   21.455   6.1534 6.118393 8.955305 
1 1 1   16    6  -75 o   27.234   3.4534   31.993   7.4943   38.697   9.8599   22.821   11.533   29.625   4.2007   21.778   6.1997 7.846739 7.488828 
1 1 1   16    6  -74 o   29.915   3.2538   38.217   7.8068   30.964   10.399   47.582   11.817   26.061   5.0779   32.759   4.5476 -6.698519 6.816589 
1 1 1   16    6  -73 o   8.8849   4.1235  -5.3420   7.1513 -11.6568   9.8783   1.6122   10.366   9.4920   4.5363   12.925   5.5309 -3.433045 7.153235 
1 1 1   16    6  -72 o   32.479   3.0110   44.590   7.8808   61.535   10.915   26.135   11.391   37.938   3.5714   23.591   5.9307 14.34727 6.922984 
1 1 1   16    6  -71 o   44.179   2.4107   81.206   8.6487   77.719   11.712   85.388   12.827   42.797   3.3846   44.788   3.5421 -1.990726 4.899164 
1 1 1   16    6  -70 o   27.138   3.6199   31.663   7.8081   26.710   10.755   37.182   11.353   24.084   5.5869   28.815   5.0157 -4.731287 7.508059 
1 1 1   16    6  -69 o   57.705   2.0371  137.512   9.5670  153.554   13.061  118.938   14.054   60.714   2.6453   53.117   3.2615 7.596451 4.199395 
1 1 1   16    6  -68 o   8.8141   4.0204  -3.5756   6.3986 -10.7556   9.9648   1.4619   8.3466   9.7715   4.6376   11.856   5.0139 -2.084433 6.829842 
1 1 1   16    6  -67 o   34.964   2.6097   51.017   7.3842   53.931   12.050   49.265   9.3440   35.288   4.2764   34.077   3.4096 1.211590 5.469265 
1 1 1   16    6  -66 o   8.3159   3.8867  -5.8304   6.5335 -13.3250   10.480  -1.0663   8.3559   9.6768   4.6374   11.048   4.8444 -1.370933 6.706290 
1 1 1   16    6  -65 o   35.681   2.5601   53.004   7.3967   55.474   11.848   51.426   9.4688   35.927   4.1200   34.875   3.3728 1.051506 5.324447 
1 1 1   16    6  -64 o   22.880   4.1045   22.797   7.3738   10.907   11.387   31.384   9.6768   16.892   6.2460   26.747   4.6044 -9.855024 7.759677 
1 1 1   16    6  -63 o   36.003   2.5762   53.907   7.5108   54.234   10.844   53.606   10.412   35.709   3.7830   35.553   3.6444 0.1568336 5.252887 
1 1 1   16    6  -62 o   36.608   2.5392   55.655   7.5301   62.762   10.748   48.805   10.553   38.592   3.4531   33.838   3.8968 4.753849 5.206666 
1 1 1   16    6  -61 o   49.605   2.4450  101.801   9.8560   87.612   15.251  111.977   12.915   45.362   4.1713   51.813   3.0717 -6.450779 5.180243 
1 1 1   16    6  -60 o   41.928   2.7680   73.074   9.4074   83.091   14.993   66.569   12.082   44.178   4.2143   39.674   3.7815 4.503582 5.662191 
1 1 1   16    6  -59 o   32.162   3.4722   43.620   8.9588   47.828   14.277   40.887   11.506   32.918   5.5158   30.687   4.7533 2.230556 7.281318 
1 1 1   16    6  -58 o   50.930   2.2158  106.891   9.1771   96.784   12.446  118.932   13.585   48.173   3.1875   53.442   3.1322 -5.268646 4.468887 
1 1 1   16    6  -57 o   38.401   2.8581   61.301   8.8824   57.505   11.598   66.685   13.813   36.869   3.9192   39.570   4.3542 -2.701351 5.858254 
1 1 1   16    6  -56 o   38.285   2.7326   60.794   8.4719   47.204   11.547   76.640   12.468   33.241   4.3670   42.749   3.6118 -9.508240 5.667071 
1 1 1   16    6  -55 o   55.592   1.8826  126.824   8.5188  119.538   12.789  132.635   11.421   53.708   2.9324   56.713   2.4765 -3.005447 3.838254 
1 1 1   16    6  -54 o   85.095   1.5675  296.241   10.873  287.554   16.150  303.444   14.705   83.602   2.3723   85.995   2.0977 -2.392761 3.166706 
1 1 1   16    6  -53 o   15.576   4.8402   10.226   6.7919  -0.2102   10.452   17.853   8.9353   12.803   5.5173   20.152   5.3504 -7.349344 7.685556 
1 1 1   16    6  -52 o   23.477   3.9205   23.522   7.2384   30.356   10.654   17.664   9.8645   26.398   5.1362   20.089   5.7387 6.309464 7.701531 
1 1 1   16    6  -51 f   15.457   4.9250   9.9169   6.9897   26.381   10.577  -2.8493   9.3133   24.517   5.4351   11.341   5.0372 13.17565 7.410349 
1 1 1   16    6  -50 o   95.305   1.5914  371.389   12.364  353.324   17.294  390.272   17.682   92.801   2.2862   97.550   2.2236 -4.748932 3.189217 
1 1 1   16    6  -49 o   78.802   1.6677  253.937   10.712  244.713   15.062  263.379   15.238   77.185   2.3969   80.092   2.3365 -2.907692 3.347308 
1 1 1   16    6  -48 o   22.147   4.9121   21.306   8.6355   21.958   11.668   20.516   12.841   22.371   6.1894   21.774   6.6355 0.5960197 9.074064 
1 1 1   16    6  -47 o   91.182   1.9298  340.240   14.344  366.003   22.914  323.641   18.393   94.260   2.9860   88.762   2.5447 5.498016 3.923223 
1 1 1   16    6  -46 o   56.006   2.3731  128.818   10.810   89.435   16.429  158.883   14.354   46.179   4.4181   62.112   2.8427 -15.93255 5.253641 
1 1 1   16    6  -45 o   57.034   2.0175  133.281   9.3650  108.374   15.406  147.877   11.794   51.084   3.7254   60.013   2.4159 -8.928799 4.440141 
1 1 1   16    6  -44 o   37.410   2.7658   57.757   8.3746   53.245   14.493   60.020   10.261   35.354   5.1829   38.032   3.3439 -2.678581 6.167948 
1 1 1   16    6  -43 o   72.271   1.8198  213.653   10.712  232.737   17.908  203.020   13.367   75.220   2.9263   70.367   2.3337 4.853874 3.742866 
1 1 1   16    6  -42 o   25.540   4.0438   27.591   8.1386   26.452   13.859   28.191   10.055   24.594   6.7222   25.609   4.9963 -1.014269 8.375601 
1 1 1   16    6  -41 o   25.237   4.0723   26.955   8.0923   26.148   13.856   27.373   9.9694   24.476   6.7341   25.228   5.0244 -0.7522545 8.401969 
1 1 1   16    6  -40 o   80.601   1.7900  265.462   11.761  263.096   19.642  266.785   14.684   79.995   3.0175   80.713   2.2340 -0.7172089 3.754512 
1 1 1   16    6  -39 o   77.242   1.8507  243.821   11.653  258.765   19.532  235.563   14.519   79.342   3.0256   75.825   2.3519 3.516953 3.832201 
1 1 1   16    6  -38 o   60.019   2.3725  147.664   11.584  157.424   17.890  140.616   15.202   61.755   3.5691   58.428   3.2041 3.327351 4.796329 
1 1 1   16    6  -37 o   47.728   2.5742   93.556   9.9780   91.051   17.523   94.758   12.138   46.678   4.6679   47.950   3.1224 -1.271942 5.615919 
1 1 1   16    6  -36 o   58.455   2.3788  140.042   11.311  147.185   18.610  135.858   14.244   59.667   3.8468   57.470   3.0516 2.197411 4.910164 
1 1 1   16    6  -35 o   32.249   3.7349   43.339   9.6369   31.037   17.023   49.140   11.691   26.706   7.5084   34.258   4.2795 -7.551752 8.642324 
1 1 1   16    6  -34 o  196.749   1.8000  1581.04   28.869  1550.16   45.370  1602.04   37.422  194.508   2.8615  197.915   2.3196 -3.407318 3.683591 
1 1 1   16    6  -33 o  120.574   1.6797  593.575   16.509  584.487   27.094  598.942   20.820  119.464   2.7822  121.056   2.1099 -1.592216 3.491783 
1 1 1   16    6  -32 o   97.849   1.9495  391.129   15.549  358.014   22.842  419.725   21.227   93.421   3.0034  101.244   2.5741 -7.823647 3.955581 
1 1 1   16    6  -31 o   51.010   2.3717  106.628   9.8347  112.101   17.387  104.054   11.926   52.025   4.1340   50.318   2.9201 1.706985 5.061310 
1 1 1   16    6  -30 o   58.845   2.4634  141.866   11.790  124.764   35.969  143.925   12.479   53.654   8.5077   59.255   2.5899 -5.601227 8.893154 
1 1 1   16    6  -29 o   13.902   5.4474   4.8083   8.9843   3.5114   22.074   5.0658   9.8359   19.537   8.2020   14.457   5.6893 5.080789 9.981976 
1 1 1   16    6  -28 o  131.597   1.9633  707.308   21.060  639.026   36.329  741.870   25.846  124.731   3.5768  134.712   2.3537 -9.981018 4.281722 
1 1 1   16    6  -27 o  133.424   1.9608  727.043   21.325  718.012   38.102  731.162   25.733  132.242   3.5377  133.740   2.3605 -1.497574 4.252939 
1 1 1   16    6  -26 o   59.932   2.2443  146.979   10.945  191.888   18.451  122.598   13.595   68.341   3.3221   54.628   3.0653 13.71302 4.520218 
1 1 1   16    6  -25 o   85.858   1.8976  300.993   13.280  271.793   20.431  322.359   17.476   81.407   3.0844   88.770   2.4174 -7.362244 3.918869 
1 1 1   16    6  -24 o   98.980   1.8172  399.960   14.662  405.178   22.889  396.329   19.093   99.469   2.8258   98.472   2.3786 0.9962845 3.693593 
1 1 1   16    6  -23 f   33.822   3.2183   47.276   8.7662   48.505   15.613   46.710   10.594   33.748   5.8895   33.499   3.9558 0.2492943 7.094628 
1 1 1   16    6  -22 o   77.078   1.8474  242.535   11.607  222.264   19.759  253.216   14.343   73.582   3.3026   78.695   2.2381 -5.113014 3.989560 
1 1 1   16    6  -21 o   51.778   2.3236  109.766   9.7820  122.222   17.404  104.014   11.827   54.422   3.9501   50.336   2.8946 4.085423 4.897141 
1 1 1   16    6  -20 o  142.411   1.7491  827.765   20.305  762.312   35.839  858.706   24.641  136.434   3.2225  145.005   2.0847 -8.571045 3.838053 
1 1 1   16    6  -19 o  125.588   1.9258  643.927   19.715  657.528   32.751  636.197   24.689  126.686   3.1740  124.771   2.4275 1.915291 3.995876 
1 1 1   16    6  -18 o   74.910   1.8259  229.054   11.149  218.643   18.075  235.449   14.165   73.029   3.0430   75.882   2.2927 -2.853065 3.810056 
1 1 1   16    6  -17 f   47.192   2.4085   91.237   9.2344   89.020   15.437   92.472   11.523   46.382   4.1261   47.445   2.9949 -1.063366 5.098457 
1 1 1   16    6  -16 o   64.370   1.9724  169.322   10.337  177.375   17.326  164.872   12.881   65.740   3.2432   63.467   2.4946 2.272797 4.091636 
1 1 1   16    6  -15 o   9.4609   4.3517  -5.8104   7.7101   4.6740   12.754 -11.8479   9.6787   15.831   6.3951   9.6340   4.5718 6.196798 7.861229 
1 1 1   16    6  -14 o   29.800   3.4398   36.853   8.2027   38.654   13.238   35.730   10.450   30.130   5.5960   29.143   4.5476 0.9879723 7.210857 
1 1 1   16    6  -13 o   68.461   1.8364  191.437   10.239  199.070   15.976  186.116   13.339   69.714   2.8171   67.448   2.4301 2.266464 3.720440 
1 1 1   16    6  -12 o   44.190   2.4690   80.040   8.8585   74.724   14.111   83.498   11.381   42.471   4.1279   45.064   3.1174 -2.593121 5.172745 
1 1 1   16    6  -11 o   83.268   1.8697  283.004   12.691  263.273   17.473  305.034   18.463   80.207   2.6763   86.347   2.6262 -6.140053 3.749586 
1 1 1   16    6  -10 o   25.870   4.6475   28.340   9.4404   23.355   13.407   33.242   13.296   23.430   6.6892   27.828   6.0353 -4.397799 9.009432 
1 1 1   16    6   -9 o   48.490   2.7850   96.454   10.962   96.741   16.122   96.206   14.949   48.378   4.1277   48.290   3.8289 0.8779907E-01 5.630161 
1 1 1   16    6   -8 o   77.042   1.8603  242.258   11.683  215.923   19.060  258.106   14.786   72.560   3.2306   79.461   2.2851 -6.901192 3.957082 
1 1 1   16    6   -7 o  172.231   1.6817  1210.40   23.610  1248.75   37.637  1185.52   30.317  174.790   2.6416  170.384   2.1829 4.405624 3.426800 
1 1 1   16    6   -6 f   41.438   2.7809   70.518   9.3389   65.899   15.622   73.086   11.649   39.719   4.9310   42.109   3.4234 -2.389774 6.002852 
1 1 1   16    6   -5 o  123.638   1.6293  623.703   16.420  598.367   25.722  641.130   21.333  120.999   2.6078  125.310   2.0884 -4.310928 3.341001 
1 1 1   16    6   -4 o  145.630   1.6366  865.328   19.428  884.129   30.838  852.956   25.016  147.087   2.5720  144.532   2.1233 2.554764 3.335239 
1 1 1   16    6   -3 o   69.841   1.8933  199.239   10.769  185.277   16.404  209.811   14.275   67.235   3.0007   71.620   2.4488 -4.385300 3.873060 
1 1 1   16    6   -2 o   64.225   2.0079  168.557   10.499  169.191   16.118  168.090   13.838   64.233   3.0874   64.074   2.6552 0.1589127 4.072112 
1 1 1   16    6   -1 o  126.872   1.6943  656.811   17.522  641.450   24.139  673.919   25.476  125.312   2.3631  128.435   2.4333 -3.123680 3.391984 
1 1 1   16    6    0 o  217.509   1.8702  1930.95   33.159  1886.52   44.216  1988.06   50.127  214.868   2.5245  220.512   2.7887 -5.644333 3.761621 
1 1 1   16    6    1 o  228.348   1.9066  2128.31   35.489  2129.47   47.815  2126.90   52.957  228.274   2.5697  228.067   2.8486 0.2066498 3.836333 
1 1 1   16    6    2 o   47.110   2.7005   91.018   10.327   86.360   14.989   95.226   14.249   45.703   4.0657   48.070   3.6639 -2.366863 5.473091 
1 1 1   16    6    3 o   70.701   2.0235  204.233   11.650  210.641   17.106  198.688   15.910   71.706   2.9327   69.654   2.8080 2.052658 4.060186 
1 1 1   16    6    4 o   76.079   1.8147  236.219   11.254  254.789   17.713  223.649   14.574   78.896   2.7585   73.950   2.4210 4.946884 3.670222 
1 1 1   16    6    5 o   86.169   1.8028  303.028   12.663  270.417   20.457  323.286   16.123   81.238   3.0948   88.972   2.2231 -7.734169 3.810505 
1 1 1   16    6    6 f   61.822   2.0549  156.214   10.341  132.599   16.075  172.887   13.507   56.792   3.4891   64.994   2.5545 -8.201256 4.324290 
1 1 1   16    6    7 o   55.206   2.2299  124.670   10.014  125.784   15.927  123.942   12.878   55.299   3.5522   54.977   2.8837 0.3217125 4.575383 
1 1 1   16    6    8 o  113.045   1.6010  521.393   14.753  516.299   22.304  525.355   19.671  112.414   2.4340  113.428   2.1275 -1.014061 3.232752 
1 1 1   16    6    9 o  107.432   1.6263  470.922   14.242  471.536   21.659  470.454   18.904  107.425   2.4734  107.334   2.1607 0.9130096E-01 3.284236 
1 1 1   16    6   10 o  147.334   1.6943  885.785   20.348  872.609   33.139  893.758   25.780  146.087   2.7828  147.943   2.1377 -1.856812 3.509141 
1 1 1   16    6   11 o   79.131   1.9348  255.611   12.480  262.394   21.898  252.347   15.188   79.978   3.3664   78.558   2.3746 1.420479 4.119578 
1 1 1   16    6   12 o   57.391   2.3239  134.765   10.849  149.607   19.555  128.165   13.040   60.253   4.0041   55.907   2.8710 4.346367 4.927015 
1 1 1   16    6   13 o   49.679   2.3739  101.057   9.5852  107.347   15.503   97.164   12.196   51.034   3.7529   48.630   3.0926 2.403141 4.862953 
1 1 1   16    6   14 o   68.938   1.9222  194.151   10.791  223.871   17.315  175.275   13.799   73.927   2.8788   65.433   2.5922 8.493980 3.873882 
1 1 1   16    6   15 o  121.240   1.7212  599.863   17.011  606.841   23.652  592.386   24.484  121.872   2.3808  120.397   2.4947 1.474686 3.448466 
1 1 1   16    6   16 o   97.745   2.1940  390.214   17.481  356.422   32.367  404.130   20.771   93.048   4.2788   99.401   2.5656 -6.353416 4.989036 
1 1 1   16    6   17 f   95.596   1.9223  373.073   14.979  369.149   22.259  376.322   20.251   94.953   2.8791   95.913   2.5926 -0.9600906 3.874350 
1 1 1   16    6   18 o   18.496   5.8235   13.997   9.7985  -3.0508   15.194   26.134   12.820   14.967   6.5485   24.640   6.3449 -9.673212 9.118169 
1 1 1   16    6   19 o   53.948   2.3383  119.134   10.258  113.367   17.163  122.339   12.795   52.392   4.0501   54.609   2.8846 -2.216492 4.972326 
1 1 1   16    6   20 o  114.824   1.7590  538.140   16.464  562.866   29.140  526.545   19.955  117.225   3.0521  113.540   2.1561 3.685265 3.736872 
1 1 1   16    6   21 o   48.736   2.5949   97.387   10.272   95.734   18.910   98.079   12.234   47.953   4.9069   48.849   3.0881 -0.8966026 5.797748 
1 1 1   16    6   22 o   45.568   3.2878   85.502   12.130  109.524   26.900   79.370   13.591   50.903   6.6411   43.810   3.8446 7.093472 7.673645 
1 1 1   16    6   23 f   74.478   2.1810  226.796   13.226  234.586   31.237  225.094   14.600   75.218   5.1252   74.171   2.4180 1.047340 5.666969 
1 1 1   16    6   24 o   45.667   2.9950   85.740   11.088   79.973   26.841   86.926   12.175   43.000   7.9506   45.945   3.2722 -2.945511 8.597605 
1 1 1   16    6   25 o   69.914   2.2758  199.952   12.952  224.085   30.279  194.547   14.330   73.499   5.0853   68.928   2.5548 4.570877 5.690976 
1 1 1   16    6   26 o   67.771   2.0933  187.799   11.550  165.930   20.358  198.181   14.026   63.428   3.9571   69.577   2.4771 -6.148685 4.668460 
1 1 1   16    6   27 o   48.770   2.6101   97.570   10.339  121.340   18.753   87.190   12.392   54.135   4.2845   45.999   3.3275 8.136505 5.424901 
1 1 1   16    6   28 o   98.909   2.0161  399.609   16.255  410.675   26.078  392.578   20.787  100.051   3.2017   97.928   2.6064 2.122688 4.128468 
1 1 1   16    6   29 o   72.627   2.3119  215.837   13.670  238.493   21.914  201.406   17.489   76.149   3.5401   70.046   3.0705 6.102783 4.686149 
1 1 1   16    6   30 o   65.331   2.4554  174.801   13.053  179.302   20.827  171.889   16.751   65.930   3.8927   64.677   3.1870 1.253319 5.030971 
1 1 1   16    6   31 o  105.116   1.8282  451.226   15.665  491.596   28.199  433.207   18.839  109.458   3.1638  102.944   2.2451 6.514046 3.879442 
1 1 1   16    6   32 o   73.427   2.0804  220.498   12.440  216.708   22.063  222.264   15.062   72.516   3.7452   73.664   2.5120 -1.147499 4.509611 
1 1 1   16    6   33 o   99.114   2.0172  401.404   16.298  411.004   26.770  395.751   20.543  100.029   3.2876   98.304   2.5659 1.725807 4.170392 
1 1 1   16    6   34 o  134.408   2.1716  738.554   23.793  742.227   49.026  737.422   27.213  134.001   4.4946  134.242   2.4868 -0.2401733 5.136726 
1 1 1   16    6   35 o   18.230   6.1152   13.128   10.713  -0.3288   18.289   20.156   13.217   17.022   7.3163   21.878   6.7443 -4.856236 9.950554 
1 1 1   16    6   36 o   47.862   3.5424   94.682   13.723   87.815   20.238  100.527   18.670   45.616   5.5572   49.067   4.7263 -3.451424 7.295186 
1 1 1   16    6   37 o   31.748   4.3124   42.360   10.872   49.542   18.987   38.856   13.261   33.661   7.1412   30.080   5.6148 3.580805 9.084179 
1 1 1   16    6   38 o   36.369   3.6471   54.975   10.666   58.081   18.322   53.383   13.119   36.721   6.3508   35.623   4.6269 1.097908 7.857564 
1 1 1   16    6   39 o   80.338   2.1494  264.188   14.063  269.410   23.470  261.262   17.565   80.827   3.5711   79.792   2.7045 1.034470 4.479613 
1 1 1   16    6   40 o  151.373   1.9539  936.773   24.109  970.088   39.603  917.159   30.389  153.660   3.1618  149.636   2.4914 4.023865 4.025414 
1 1 1   16    6   41 o   54.040   2.5851  119.956   11.354  124.988   18.971  117.147   14.173   54.801   4.2808   53.275   3.2796 1.525181 5.392668 
1 1 1   16    6   42 o   14.050   5.5159   5.0115   9.2266   30.939   16.261  -7.3000   11.205   26.517   7.2950   11.560   5.2908 14.95709 9.011696 
1 1 1   16    6   43 o   55.283   2.4782  125.503   11.139  138.306   19.129  118.933   13.702   57.679   4.0952   53.690   3.1446 3.988483 5.163289 
1 1 1   16    6   44 o   32.346   3.7601   43.768   9.7296   36.355   16.849   47.476   11.917   28.629   7.2218   33.537   4.4706 -4.907640 8.493575 
1 1 1   16    6   45 o   59.280   2.5589  144.421   12.336  142.259   19.242  145.930   16.074   58.468   4.0627   59.420   3.3319 -0.9519157 5.254209 
1 1 1   16    6   46 o   25.102   5.1315   27.282   10.145   16.778   15.885   34.519   13.184   20.874   7.4249   28.100   5.9419 -7.226015 9.509775 
1 1 1   16    6   47 o   52.246   3.0982  112.801   13.136   96.406   24.819  119.180   15.482   47.119   6.6460   53.592   3.5642 -6.472076 7.541363 
1 1 1   16    6   48 o   42.374   3.5104   74.696   12.017   52.281   22.299   83.870   14.265   33.922   8.1635   44.801   3.9464 -10.87969 9.067386 
1 1 1   16    6   49 o   73.813   2.3023  223.681   13.835  197.671   27.882  232.177   15.936   68.443   5.0328   75.126   2.6061 -6.683632 5.667553 
1 1 1   16    6   50 o   11.944   5.1145   0.0484   8.8750  -7.1232   14.993   3.9168   11.011   13.725   6.2186   14.473   5.9067 -0.7479973 8.576713 
1 1 1   16    6   51 f   21.604   5.2009   20.459   9.0483   20.499   15.338   20.438   11.206   21.990   7.3161   21.554   6.1030 0.4360847 9.527435 
1 1 1   16    6   52 o   28.909   4.0941   35.495   9.3782   35.074   16.053   35.714   11.555   27.861   7.0608   28.690   5.1291 -0.8298435 8.727127 
1 1 1   16    6   53 o   68.229   2.1755  191.235   12.084  201.756   20.063  185.245   15.137   69.635   3.5461   66.984   2.7783 2.650238 4.504914 
1 1 1   16    6   54 o   14.929   5.4601   7.9573   8.6631   26.136   15.049  -1.0528   10.595   24.115   7.1465   12.627   5.4976 11.48755 9.016472 
1 1 1   16    6   55 o   43.750   2.8539   79.359   10.122   86.142   17.366   75.869   12.457   44.911   4.8188   42.551   3.6259 2.359631 6.030623 
1 1 1   16    6   56 o   24.440   4.6822   26.011   8.9884   43.665   15.897   17.716   10.897   31.148   6.4728   20.081   6.1114 11.06685 8.902035 
1 1 1   16    6   57 o   32.824   4.1817   45.936   10.935   37.640   16.224   52.842   14.802   28.632   7.0089   34.768   5.3979 -6.135723 8.846605 
1 1 1   16    6   58 o   24.531   5.4633   26.806   10.644   22.607   15.722   30.359   14.462   22.538   7.4035   25.729   6.7958 -3.191536 10.04959 
1 1 1   16    6   59 o   42.079   3.4068   74.262   11.586   70.347   17.324   77.429   15.583   40.095   5.4409   42.508   4.5690 -2.413223 7.104872 
1 1 1   16    6   60 o   35.585   3.4757   53.347   9.9535   47.158   17.421   56.346   12.128   31.999   6.8832   36.329   4.1711 -4.329651 8.048372 
1 1 1   16    6   61 o   62.230   2.3183  159.856   11.739  170.692   20.280  154.395   14.397   63.567   3.9331   60.937   2.9067 2.630375 4.890628 
1 1 1   16    6   62 o   55.377   2.6475  127.206   11.916  113.421   16.643  141.709   17.070   51.715   3.9785   58.020   3.6274 -6.305515 5.383970 
1 1 1   16    6   63 o   51.002   3.0783  108.719   12.738   90.172   20.780  119.883   16.122   45.029   5.7955   53.258   3.7375 -8.228310 6.896108 
1 1 1   16    6   64 o   20.938   6.1327   20.007   11.136   13.916   19.007   23.191   13.742   19.926   7.8879   22.381   6.8729 -2.454742 10.46212 
1 1 1   16    6   65 o   46.652   2.8265   90.802   10.698   74.648   20.082   97.203   12.641   40.488   6.2888   48.100   3.2431 -7.612823 7.075809 
1 1 1   16    6   66 o   16.298   5.4154   11.355   8.4044   9.6292   14.021   12.323   10.500   17.168   6.7815   17.203   6.0440 -0.3462219E-01 9.083997 
1 1 1   16    6   67 o   26.695   4.1445   31.009   8.7261   15.200   14.313   40.361   11.009   19.113   7.0138   30.325   4.5975 -11.21179 8.386289 
1 1 1   16    6   68 o   11.688   4.9332   1.4836   8.0544   7.9962   13.703  -1.9537   9.9555   16.468   6.6371   11.762   5.2170 4.705632 8.442070 
1 1 1   16    6   69 o   23.320   4.7068   24.292   8.6384   7.2328   14.138   34.454   10.912   16.358   6.6865   27.743   5.0096 -11.38524 8.354980 
1 1 1   16    6   70 o   24.232   4.6504   26.175   8.8518   36.253   14.881   20.656   11.012   27.561   6.6915   21.055   6.0787 6.506361 9.040234 
1 1 1   16    6   71 o   21.076   5.1224   20.271   8.7129   36.934   14.700   11.245   10.818   27.828   6.5838   16.672   6.1009 11.15598 8.975928 
1 1 1   16    6   72 o   31.392   3.6621   42.381   9.1951   43.741   15.525   41.646   11.412   30.349   6.4732   30.605   4.7265 -0.2564583 8.015057 
1 1 1   16    6   73 o   41.374   2.9508   72.139   9.8866   55.842   15.875   82.465   12.636   34.783   5.8032   43.930   3.5592 -9.146881 6.807711 
1 1 1   16    6   74 o   15.595   5.5115   10.219   8.7404   3.3564   14.449   14.179   10.976   15.184   6.5143   17.834   6.1854 -2.650598 8.983096 
1 1 1   16    6   75 o   52.614   2.5606  115.822   10.949  132.413   19.702  108.408   13.170   54.885   4.4416   50.524   3.2146 4.361332 5.482790 
1 1 1   16    6   76 o   17.434   5.7077   13.953   9.3480  -0.1321   18.630   18.693   10.807   15.778   7.0583   19.782   6.0985 -4.004062 9.327995 
1 1 1   16    6   77 o   22.903   5.1327   24.444   9.3448   4.1118   17.410   32.673   11.075   16.164   7.0423   26.461   5.3194 -10.29628 8.825559 
1 1 1   16    6   78 o   35.912   3.4516   55.706   9.9796   47.038   18.037   59.529   11.980   30.083   7.4060   36.743   4.0680 -6.660603 8.449691 
1 1 1   16    6   79 o   32.675   4.0944   47.423   10.667   46.485   18.000   47.930   13.242   29.677   7.4524   32.049   5.2506 -2.372856 9.116299 
1 1 1   16    6   80 o   29.369   4.5099   39.248   10.452   39.655   18.318   39.051   12.727   26.747   7.8739   28.461   5.6849 -1.713978 9.711664 
1 1 1   16    6   81 o   13.983   5.4044   7.4469   8.7476  -9.9032   12.329   25.033   12.413   10.997   5.2014   22.082   6.4766 -11.08431 8.306653 
1 1 1   16    6   82 o   22.360   4.8607   23.610   8.6062   39.908   12.357   8.2562   11.993   28.780   5.4670   15.197   6.1786 13.58312 8.250004 
1 1 1   16    6   83 o   24.321   4.4328   27.333   8.4645   19.039   11.932   35.733   12.009   19.257   6.4539   26.971   5.6439 -7.714182 8.573565 
1 1 1   16    6   84 o   17.424   5.9791   15.079   10.246   21.920   11.700  -7.4397   21.226   20.446   6.3525   14.607   6.8833 5.838974 9.366659 
1 1 1   16    6   85 o   12.677   5.4702   2.8128   10.301   0.7070   11.647   10.371   22.067   12.663   5.6282   17.458   7.7540 -4.795428 9.581260 
1 1 1   16    6   86 o   22.235   6.4699   26.748   12.431   13.595   14.499   63.238   24.149   16.970   6.8315   30.949   9.0214 -13.97865 11.31618 
1 1 1   16    6   87 o   11.513   5.4640  -9.3529   13.828  -9.3529   13.828   0.0000   0.0000   11.513   5.4640  ?   ?  0.000000 5.463993 
1 1 1   16    6   88 o   19.982   6.5395   21.993   12.271   17.830   14.007   35.743   25.454   18.176   6.8845   22.292   9.0238 -4.115385 11.35014 
1 1 1   16    6   89 o   14.254   5.9687   7.0575   11.644   5.0085   13.352   13.566   23.798   14.160   6.1683   17.802   7.9695 -3.641234 10.07775 
1 1 1   16    6   90 o   16.264   6.3466   12.958   12.153   12.958   12.153   0.0000   0.0000   16.264   6.3466  ?   ?  0.000000 6.346584 
1 1 1   16    6   91 o   18.897   6.5326   19.910   12.239   19.910   12.239   0.0000   0.0000   18.897   6.5326  ?   ?  0.000000 6.532595 
1 1 1   16    6   92 o   22.789   6.4162   28.943   12.422   28.943   12.422   0.0000   0.0000   22.789   6.4162  ?   ?  0.000000 6.416221 
1 1 1   16    6   93 o   13.803   6.1566   3.4043   14.062   3.4043   14.062   0.0000   0.0000   13.803   6.1566  ?   ?  0.000000 6.156555 
1 1 1   16    6   94 o   19.204   7.2159   22.272   15.318   22.272   15.318   0.0000   0.0000   19.204   7.2159  ?   ?  0.000000 7.215912 
1 1 1   16    6   95 o   16.813   6.8088   14.954   14.499   14.954   14.499   0.0000   0.0000   16.813   6.8088  ?   ?  0.000000 6.808824 
1 1 1   16    6   96 o   25.311   6.4016   35.889   13.215   23.604   15.328   71.459   26.081   19.505   7.2403   30.414   9.4902 -10.90919 11.93670 
1 1 1   16    6   97 o   15.481   6.2909   11.545   12.426   17.529   14.628  -3.9631   23.550   17.503   6.9226   14.703   7.0204 2.800496 9.859442 
1 1 1   16    6   98 o   17.224   6.5346   16.735   12.631   19.196   14.913   10.485   23.763   17.948   7.0226   16.541   7.6197 1.407080 10.36230 
1 1 1   16    6   99 o   12.638   5.9741  -5.2324   16.221 -15.5775   23.030   4.9524   22.850   13.264   6.4774   15.570   7.2742 -2.305721 9.740145 
1 1 1   16    6  100 o   14.733   6.6335   6.2794   16.750   4.3230   24.092   8.1099   23.305   15.614   7.3500   16.021   7.4383 -0.4075890 10.45714 
1 1 1   16    6  101 o   14.429   6.5213   5.1085   16.365 -10.9249   23.239   20.881   23.049   13.734   6.6612   18.072   7.9805 -4.337870 10.39521 
1 1 1   16    6  102 o   18.297   8.0968   21.745   23.846   0.0000   0.0000   21.745   23.846  ?   ?    18.297   8.0968 0.000000 8.096832 
1 1 1   16    7  -98 o   13.644   6.6935 -16.5732   25.448 -16.5732   25.448   0.0000   0.0000   13.644   6.6935  ?   ?  0.000000 6.693549 
1 1 1   16    7  -97 o   13.521   6.6107 -14.8209   24.194 -14.8209   24.194   0.0000   0.0000   13.521   6.6107  ?   ?  0.000000 6.610653 
1 1 1   16    7  -96 o   17.966   8.1900   20.690   26.505   20.690   26.505   0.0000   0.0000   17.966   8.1900  ?   ?  0.000000 8.190039 
1 1 1   16    7  -95 o   16.041   7.5573   6.1451   25.568   6.1451   25.568   0.0000   0.0000   16.041   7.5573  ?   ?  0.000000 7.557328 
1 1 1   16    7  -94 o   23.144   9.3125   47.595   26.929   47.595   26.929   0.0000   0.0000   23.144   9.3125  ?   ?  0.000000 9.312525 
1 1 1   16    7  -93 o   17.064   7.7912   13.512   24.107   13.512   24.107   0.0000   0.0000   17.064   7.7912  ?   ?  0.000000 7.791195 
1 1 1   16    7  -92 o   11.193   5.4811 -18.8301   16.829 -18.8301   16.829   0.0000   0.0000   11.193   5.4811  ?   ?  0.000000 5.481109 
1 1 1   16    7  -91 o   18.132   7.4998   19.570   18.062   19.570   18.062   0.0000   0.0000   18.132   7.4998  ?   ?  0.000000 7.499786 
1 1 1   16    7  -90 o   12.338   5.9218 -10.8185   17.231 -10.8185   17.231   0.0000   0.0000   12.338   5.9218  ?   ?  0.000000 5.921780 
1 1 1   16    7  -89 o   14.843   6.7172   4.5199   17.434   4.5199   17.434   0.0000   0.0000   14.843   6.7172  ?   ?  0.000000 6.717224 
1 1 1   16    7  -88 o   21.615   7.7624   30.291   17.404   30.291   17.404   0.0000   0.0000   21.615   7.7624  ?   ?  0.000000 7.762366 
1 1 1   16    7  -87 o   24.641   7.9198   39.119   18.045   39.119   18.045   0.0000   0.0000   24.641   7.9198  ?   ?  0.000000 7.919798 
1 1 1   16    7  -86 o   17.897   7.3685   17.269   17.327   17.269   17.327   0.0000   0.0000   17.897   7.3685  ?   ?  0.000000 7.368472 
1 1 1   16    7  -85 o   18.399   7.4171   18.829   17.117   18.829   17.117   0.0000   0.0000   18.399   7.4171  ?   ?  0.000000 7.417108 
1 1 1   16    7  -84 o   13.678   6.0105   3.6062   12.924   48.749   26.101 -11.0583   14.876   25.216   9.4308   11.639   5.5635 13.57757 10.94952 
1 1 1   16    7  -83 o   16.410   6.4889   12.849   12.850   37.360   26.335   5.1895   14.722   22.569   9.1631   14.631   6.4226 7.937788 11.18983 
1 1 1   16    7  -82 f   14.519   6.2042   6.3554   13.011   6.2645   27.263   6.3822   14.805   17.353   8.0528   15.001   6.5153 2.352358 10.35841 
1 1 1   16    7  -81 o   18.556   6.3007   18.047   11.373   9.2236   26.309   20.074   12.612   17.788   8.1285   19.308   6.6332 -1.519316 10.49149 
1 1 1   16    7  -80 o   16.588   6.1575   13.180   11.086   0.3745   25.226   16.246   12.342   16.543   7.7004   17.886   6.5209 -1.343138 10.09048 
1 1 1   16    7  -79 o   10.333   4.8801  -8.4252   10.782  -2.5595   24.376  -9.8520   12.022   16.136   7.5304   10.740   5.0961 5.396634 9.092713 
1 1 1   16    7  -78 o   9.9798   4.7625 -10.6696   10.805   16.044   25.108 -16.7408   11.970   19.365   8.4466   9.7034   4.7234 9.661384 9.677539 
1 1 1   16    7  -77 o   19.291   6.3099   18.781   11.426   32.452   26.679   15.710   12.644   22.984   9.2617   18.005   6.5947 4.978514 11.36966 
1 1 1   16    7  -76 o   17.665   5.8068   15.041   9.6713   27.934   16.237   7.9523   12.040   22.649   7.5273   15.195   6.1858 7.454021 9.742887 
1 1 1   16    7  -75 o   16.362   5.7615   12.203   9.5448  -6.0797   15.625   23.088   12.056   13.249   6.1301   21.378   6.4113 -8.128522 8.870316 
1 1 1   16    7  -74 o   17.138   6.2719   13.211   11.433   22.977   15.943   2.8699   16.405   21.132   7.4457   15.393   6.7675 5.739688 10.06171 
1 1 1   16    7  -73 o   16.396   5.6853   12.084   9.2727   14.538   11.125   6.4974   16.784   17.737   6.2221   16.442   7.0368 1.295431 9.393127 
1 1 1   16    7  -72 o   19.393   5.6200   17.863   9.3967   22.574   11.438   8.0824   16.482   21.511   6.1904   16.838   7.0792 4.672247 9.404005 
1 1 1   16    7  -71 o   40.245   2.5286   67.911   8.2531   50.200   11.198   88.972   12.211   33.770   4.1555   45.651   3.3037 -11.88129 5.308731 
1 1 1   16    7  -70 o   9.1974   4.2169  -4.0692   7.1594  -2.3336   9.9191  -5.9566   10.344   11.489   5.1443   10.868   5.0140 0.6213140 7.183597 
1 1 1   16    7  -69 o   28.728   3.0597   35.100   7.0550   37.203   10.795   33.532   9.3208   28.785   4.7676   27.537   4.2923 1.247921 6.415119 
1 1 1   16    7  -68 o   18.516   4.6090   15.532   6.9291   13.721   10.850   16.779   9.0045   17.644   6.1480   19.041   5.4965 -1.397053 8.246809 
1 1 1   16    7  -67 o   15.564   4.8718   10.706   6.8674   2.0971   10.680   16.776   8.9672   13.249   5.6400   19.078   5.4784 -5.829084 7.862699 
1 1 1   16    7  -66 o   17.727   4.6873   14.179   6.8755   13.866   10.691   14.400   8.9788   17.767   6.1070   17.840   5.5685 -0.7348061E-01 8.264635 
1 1 1   16    7  -65 o   72.830   1.6722  218.028   9.9271  208.235   14.744  226.150   13.426   70.731   2.5615   73.899   2.2314 -3.167755 3.397116 
1 1 1   16    7  -64 o   17.535   4.9124   13.844   7.3005   18.278   12.022   11.253   9.1888   19.951   6.4688   16.327   5.6596 3.623480 8.595119 
1 1 1   16    7  -63 o   26.699   3.6667   30.670   7.7695   36.268   13.679   28.003   9.4400   27.886   6.1802   25.042   4.7992 2.844343 7.824779 
1 1 1   16    7  -62 o   43.987   2.4337   80.405   8.6924   67.599   14.725   87.254   10.769   39.304   4.6884   45.643   2.9095 -6.338577 5.517852 
1 1 1   16    7  -61 o   20.626   4.2654   18.788   6.9347   16.049   10.551   20.871   9.2012   18.906   6.0539   21.427   5.2982 -2.521322 8.044895 
1 1 1   16    7  -60 o   36.700   2.7926   56.319   8.2914   59.726   12.716   53.799   10.936   37.193   4.2716   35.468   3.8439 1.725090 5.746517 
1 1 1   16    7  -59 o   49.139   2.1577   99.760   8.6217   90.934   13.864  105.326   11.009   46.304   3.7040   50.306   2.6946 -4.002144 4.580437 
1 1 1   16    7  -58 o   44.128   2.4748   80.794   8.8663   75.027   13.506   85.162   11.754   41.926   4.0002   45.037   3.2230 -3.110878 5.137060 
1 1 1   16    7  -57 o   92.356   1.6625  349.897   12.516  335.817   17.413  364.946   18.002   90.149   2.3717   94.020   2.3488 -3.871231 3.337948 
1 1 1   16    7  -56 o   18.229   4.9296   14.768   7.4997   15.357   10.878   14.234   10.354   18.772   6.1577   18.168   6.0099 0.6036491 8.604429 
1 1 1   16    7  -55 o   19.464   4.5547   16.733   7.0976   11.962   10.733   20.441   9.4618   17.239   6.1060   21.327   5.4294 -4.087862 8.170807 
1 1 1   16    7  -54 o   33.722   2.7803   47.399   7.5748   52.417   11.384   43.413   10.147   35.055   4.0589   31.888   3.9909 3.166843 5.692236 
1 1 1   16    7  -53 o   46.816   2.1319   90.332   8.1144   91.797   12.240   89.183   10.838   46.865   3.2238   46.304   2.8857 0.5603905 4.326701 
1 1 1   16    7  -52 o   15.516   4.9377   10.187   7.0277   8.0186   10.523   11.933   9.4418   15.587   5.9523   16.976   5.7412 -1.389300 8.269867 
1 1 1   16    7  -51 o   16.928   5.1575   12.389   7.7581   7.6407   10.468   18.174   11.555   15.436   5.9261   20.295   6.3144 -4.859473 8.659747 
1 1 1   16    7  -50 o   27.716   3.9387   32.754   8.6482   37.779   12.565   28.232   11.921   29.269   5.4675   25.082   5.9254 4.187027 8.062502 
1 1 1   16    7  -49 o   21.863   4.3364   20.753   7.4553   27.033   12.261   17.068   9.3908   24.517   6.1471   19.666   5.5931 4.850428 8.310812 
1 1 1   16    7  -48 o   12.389   4.9123   3.7930   7.3830   8.4192   12.258   1.1592   9.2489   16.501   6.3921   12.488   5.2795 4.012874 8.290462 
1 1 1   16    7  -47 o   71.200   1.8167  207.813   10.535  206.714   17.182  208.475   13.337   70.666   2.9895   71.190   2.3012 -0.5240555 3.772631 
1 1 1   16    7  -46 o   63.600   1.9177  165.915   9.9308  154.469   16.224  172.774   12.558   60.993   3.2752   64.792   2.3818 -3.798954 4.049717 
1 1 1   16    7  -45 o   28.294   3.4836   33.667   7.8651   38.140   13.489   31.363   9.6809   29.425   5.8301   27.002   4.5606 2.423267 7.401957 
1 1 1   16    7  -44 o   17.975   5.0446   14.025   7.6916   11.874   13.187   15.134   9.4692   18.183   6.7218   18.752   5.6949 -0.5690231 8.809918 
1 1 1   16    7  -43 o   43.695   2.4306   78.657   8.6229   79.354   14.830   78.301   10.599   43.420   4.2442   43.472   3.0095 -0.5134964E-01 5.202914 
1 1 1   16    7  -42 o   38.861   2.7809   62.459   8.7510   52.785   16.538   66.221   10.313   34.757   6.0573   39.930   3.1952 -5.172882 6.848320 
1 1 1   16    7  -41 o   17.779   5.3251   13.509   8.3208   10.085   15.009   15.029   9.9978   18.241   7.0713   18.821   5.8762 -0.5800381 9.194192 
1 1 1   16    7  -40 o   57.066   2.2377  133.699   10.389  137.801   18.220  131.723   12.646   57.513   3.9097   56.537   2.7523 0.9764786 4.781317 
1 1 1   16    7  -39 o   26.634   3.9942   30.037   8.4043   19.361   13.686   36.501   10.649   21.395   6.8990   29.250   4.6193 -7.855532 8.302666 
1 1 1   16    7  -38 o   75.710   2.1126  234.921   13.025  187.979   24.634  253.137   15.346   67.034   4.5350   78.530   2.4001 -11.49674 5.130956 
1 1 1   16    7  -37 o  113.836   1.8913  530.106   17.550  526.983   24.169  533.588   25.524  113.310   2.6168  113.977   2.7472 -0.6670685 3.794026 
1 1 1   16    7  -36 o   49.794   2.3400  101.825   9.4713   89.611   15.390  109.272   12.016   46.328   4.1181   51.490   2.8743 -5.161564 5.022046 
1 1 1   16    7  -35 o   65.078   1.9049  173.359   10.094  159.534   16.879  181.055   12.594   62.146   3.3443   66.439   2.3291 -4.292191 4.075423 
1 1 1   16    7  -34 o   75.209   2.0729  231.623   12.696  259.261   36.418  227.799   13.546   78.385   5.7394   74.557   2.2314 3.828110 6.157918 
1 1 1   16    7  -33 o   12.357   5.1102   1.9402   8.3837   11.424   21.420   0.2245   9.1105   20.971   8.3503   12.216   5.2051 8.754769 9.839722 
1 1 1   16    7  -32 o   90.546   1.9008  335.197   14.029  366.631   29.754  326.210   15.909   94.156   3.8850   89.279   2.1860 4.876205 4.457767 
1 1 1   16    7  -31 o  124.189   1.6458  630.024   16.661  612.614   26.764  641.040   21.289  122.230   2.6862  125.183   2.0862 -2.953468 3.401144 
1 1 1   16    7  -30 o   65.302   2.0025  174.536   10.647  188.819   18.300  167.227   13.091   67.679   3.3273   63.840   2.5205 3.838978 4.174170 
1 1 1   16    7  -29 o   68.819   2.2261  193.993   12.472  178.779   18.669  206.254   16.760   65.821   3.4921   70.841   2.9086 -5.019363 4.544738 
1 1 1   16    7  -28 o   99.011   1.8975  400.665   15.314  377.834   23.196  418.306   20.390   95.910   2.9705  101.068   2.4749 -5.158310 3.866388 
1 1 1   16    7  -27 o   89.329   1.8113  326.034   13.189  343.792   22.434  316.653   16.305   91.482   3.0125   87.942   2.2764 3.539246 3.775840 
1 1 1   16    7  -26 o   88.126   1.8507  317.327   13.295  301.794   22.009  326.250   16.682   85.680   3.1567   89.267   2.2945 -3.587196 3.902469 
1 1 1   16    7  -25 o  121.171   1.7273  599.696   17.061  597.041   27.971  601.269   21.530  120.682   2.8433  121.253   2.1783 -0.5710297 3.581835 
1 1 1   16    7  -24 o   77.592   2.1584  246.366   13.638  250.781   29.917  245.208   15.323   77.693   4.7465   77.367   2.4328 0.3262177 5.333661 
1 1 1   16    7  -23 o   65.685   2.1565  176.596   11.531  169.615   19.670  180.251   14.233   64.090   3.7820   66.293   2.6392 -2.203011 4.611798 
1 1 1   16    7  -22 o   25.577   5.0743   28.033   10.206   25.166   16.915   29.674   12.797   24.412   7.6467   26.153   6.1133 -1.740992 9.789985 
1 1 1   16    7  -21 o   51.346   2.7200  108.269   11.344  119.167   18.322  101.494   14.445   53.600   4.2276   49.566   3.5999 4.034435 5.552595 
1 1 1   16    7  -20 o   41.115   3.1738   69.745   10.555   70.903   16.885   69.002   13.522   41.056   5.1589   40.723   4.1306 0.3335571 6.608724 
1 1 1   16    7  -19 o   39.716   3.2897   65.159   10.555   59.528   17.021   68.678   13.454   37.423   5.7644   40.633   4.1189 -3.209991 7.084786 
1 1 1   16    7  -18 o   16.534   5.5184   10.755   8.7252   21.319   16.015   6.2959   10.405   22.833   7.4706   15.207   5.8897 7.626216 9.513058 
1 1 1   16    7  -17 o  110.849   1.8958  501.900   17.130  477.398   25.395  522.357   23.205  107.917   2.8894  112.992   2.5194 -5.075172 3.833523 
1 1 1   16    7  -16 o   88.643   2.0325  321.040   14.686  324.289   22.283  318.545   19.527   88.896   3.0797   88.171   2.7202 0.7257538 4.109023 
1 1 1   16    7  -15 o   66.890   2.3001  183.139   12.523  175.505   19.000  189.002   16.651   65.279   3.5844   67.850   3.0182 -2.571075 4.685915 
1 1 1   16    7  -14 o   12.289   5.3403  -1.4761   9.9592   4.8746   15.480  -5.9616   13.009   17.113   6.9961   13.035   5.8593 4.078708 9.125645 
1 1 1   16    7  -13 o   17.693   5.5273   12.899   8.8442   11.300   16.024   13.599   10.606   19.296   7.3508   18.453   6.0817 0.8438244 9.540507 
1 1 1   16    7  -12 o  106.622   1.7181  464.114   14.932  473.931   20.830  453.736   21.417  107.662   2.3735  105.325   2.4945 2.336357 3.443254 
1 1 1   16    7  -11 o   69.218   2.0353  195.894   11.471  181.475   16.064  210.896   16.386   66.497   2.9711   71.721   2.8082 -5.223083 4.088243 
1 1 1   16    7  -10 o  110.554   1.7040  498.951   15.356  491.721   21.278  506.809   22.184  109.666   2.3803  111.326   2.4446 -1.660156 3.412009 
1 1 1   16    7   -9 o   78.444   1.9253  251.313   12.311  264.456   17.717  239.044   17.119   80.344   2.7091   76.375   2.7542 3.968964 3.863315 
1 1 1   16    7   -8 o   46.045   2.7889   87.095   10.419   89.835   16.010   85.082   13.721   46.527   4.2689   45.365   3.7439 1.162441 5.678070 
1 1 1   16    7   -7 o   90.274   1.7453  332.700   12.843  338.343   20.710  329.175   16.370   90.876   2.7991   89.747   2.2377 1.129013 3.583640 
1 1 1   16    7   -6 o   87.885   1.7642  315.334   12.639  287.127   19.939  334.278   16.341   83.689   2.9273   90.443   2.2164 -6.753952 3.671771 
1 1 1   16    7   -5 o  114.970   1.6563  539.532   15.523  528.047   24.683  547.047   19.965  113.606   2.6653  115.714   2.1166 -2.107430 3.403536 
1 1 1   16    7   -4 o   83.608   1.7973  285.402   12.249  340.290   20.531  255.067   15.263   91.145   2.7666   78.954   2.3743 12.19134 3.645705 
1 1 1   16    7   -3 o   11.409   4.9917  -1.8808   8.8274   14.456   16.348  -8.6044   10.488   20.473   7.4986   10.848   5.0204 9.624772 9.024040 
1 1 1   16    7   -2 o  142.012   1.6719  823.197   19.354  771.196   30.617  857.807   24.978  137.282   2.7360  144.902   2.1147 -7.619934 3.457938 
1 1 1   16    7   -1 o   66.861   2.0293  182.770   11.048  194.381   18.561  176.401   13.748   68.779   3.3205   65.622   2.5751 3.156860 4.201961 
1 1 1   16    7    0 o  157.064   1.8072  1007.20   23.138  1003.98   34.377  1009.86   31.286  156.648   2.6922  157.159   2.4422 -0.5111084 3.634844 
1 1 1   16    7    1 o   20.530   5.1065   18.096   8.5103   25.317   13.699   13.558   10.860   24.259   6.7043   18.512   6.1562 5.747427 9.101965 
1 1 1   16    7    2 o   11.843   4.9962   0.6226   8.2548 -13.4893   13.458   9.1339   10.452   11.819   5.5414   16.410   5.9981 -4.591508 8.166081 
1 1 1   16    7    3 o   94.915   1.6608  367.720   12.849  354.001   19.539  378.174   17.056   92.996   2.5800   96.204   2.1750 -3.208611 3.374434 
1 1 1   16    7    4 o  126.028   1.6912  648.343   17.374  654.273   29.307  645.130   21.573  126.426   2.8438  125.662   2.1061 0.7637100 3.538783 
1 1 1   16    7    5 o   11.936   5.1225  -0.4576   8.9393  -9.1115   16.826   2.9454   10.552   14.521   6.5828   14.072   5.7672 0.4489155 8.751758 
1 1 1   16    7    6 o   34.499   3.4453   49.295   9.5591   39.712   17.775   53.194   11.338   30.197   7.3021   35.763   3.9554 -5.566603 8.304501 
1 1 1   16    7    7 o   35.890   3.1331   53.175   9.0744   61.565   14.785   48.105   11.494   38.330   4.8396   33.933   4.2483 4.397839 6.439703 
1 1 1   16    7    8 o  127.669   1.5868  665.240   16.514  684.909   25.055  650.131   21.959  129.432   2.3747  126.141   2.1356 3.291740 3.193758 
1 1 1   16    7    9 o  126.865   1.5954  656.902   16.499  627.918   24.577  680.680   22.261  123.920   2.4330  129.072   2.1158 -5.152557 3.224299 
1 1 1   16    7   10 o   91.215   1.7173  339.667   12.769  329.720   19.545  347.074   16.865   89.725   2.6753   92.151   2.2452 -2.425568 3.492594 
1 1 1   16    7   11 o   79.233   1.8305  256.349   11.822  258.226   18.457  255.043   15.395   79.364   2.8576   78.942   2.3952 0.4225616 3.728642 
1 1 1   16    7   12 o   61.434   2.1152  154.398   10.577  164.632   16.729  147.582   13.652   63.284   3.2539   59.977   2.8001 3.306652 4.292799 
1 1 1   16    7   13 o   65.103   2.1772  173.409   11.538  146.798   20.283  186.139   14.029   59.570   4.2041   67.405   2.5579 -7.835423 4.921114 
1 1 1   16    7   14 o   28.904   4.3583   35.169   9.9498   40.570   19.516   33.272   11.566   30.445   7.8224   27.908   5.2774 2.537401 9.436156 
1 1 1   16    7   15 o   20.666   5.6232   18.308   9.7229   23.863   19.443   16.456   11.228   24.400   8.2387   19.924   6.2281 4.476543 10.32790 
1 1 1   16    7   16 o   44.332   2.9784   80.880   10.700   98.177   21.270   75.019   12.381   48.354   5.4936   42.590   3.6000 5.763588 6.568125 
1 1 1   16    7   17 o   40.187   3.2129   66.647   10.437   57.970   20.409   69.720   12.145   36.583   7.0999   41.033   3.6699 -4.449596 7.992319 
1 1 1   16    7   18 o  142.461   1.6777  828.606   19.483  861.660   31.152  807.371   24.969  145.091   2.6340  140.540   2.1795 4.550827 3.418806 
1 1 1   16    7   19 o   74.410   1.9929  226.387   12.077  250.081   19.770  212.283   15.254   78.034   3.1143   71.970   2.6044 6.063614 4.059782 
1 1 1   16    7   20 o   89.573   2.0224  327.866   14.767  321.733   21.610  333.238   20.226   88.544   2.9984   90.162   2.7552 -1.618515 4.072057 
1 1 1   16    7   21 o   23.717   5.7241   24.329   10.939   43.090   17.591   12.501   13.968   31.424   7.0421   18.968   6.9338 12.45654 9.882764 
1 1 1   16    7   22 o   35.876   4.8121   54.169   13.718   75.796   18.849   29.816   20.002   42.341   5.5984   26.477   8.3183 15.86405 10.02678 
1 1 1   16    7   23 o   37.317   5.4562   59.048   16.107   42.753   18.734  105.225   31.537   31.202   7.4659   49.141   8.1591 -17.93898 11.05940 
1 1 1   16    7   24 o  111.362   2.0463  506.929   18.575  501.184   29.365  510.761   23.983  110.432   3.2656  111.674   2.6346 -1.242035 4.195909 
1 1 1   16    7   25 o   71.100   2.6886  207.398   15.554   0.0000   0.0000  207.398   15.554  ?   ?    71.100   2.6886 0.000000 2.688580 
1 1 1   16    7   26 o   56.655   2.5471  131.711   11.733  148.993   21.060  123.932   14.129   59.897   4.3429   54.850   3.1737 5.046547 5.378928 
1 1 1   16    7   27 o   57.812   2.4707  137.092   11.616  130.049   20.741  140.312   14.022   55.865   4.5952   58.409   2.9547 -2.543880 5.463128 
1 1 1   16    7   28 o   70.001   2.1611  200.629   12.317  196.323   21.759  202.659   14.941   68.895   3.8903   70.281   2.6125 -1.386559 4.686078 
1 1 1   16    7   29 o   75.334   2.0809  232.279   12.766  230.397   23.101  233.106   15.318   74.662   3.8082   75.399   2.4958 -0.7369385 4.553194 
1 1 1   16    7   30 o   25.064   4.7804   26.907   9.4103   27.761   17.487   26.559   11.165   25.358   7.7465   24.732   5.6606 0.6255817 9.594349 
1 1 1   16    7   31 o   20.896   5.3850   18.910   9.2299   36.714   16.918   11.365   11.013   28.841   7.2150   17.477   6.1858 11.36380 9.503678 
1 1 1   16    7   32 o   88.240   2.0820  318.536   14.975  357.410   24.656  295.811   18.851   93.164   3.2516   84.878   2.7281 8.286758 4.244472 
1 1 1   16    7   33 o   37.500   3.6101   58.495   10.899   73.587   17.864   49.546   13.757   41.639   5.3893   34.125   5.1018 7.513550 7.421115 
1 1 1   16    7   34 o   50.543   2.5057  104.972   10.291  101.262   18.730  106.577   12.317   49.127   4.7358   50.843   2.9852 -1.715923 5.598110 
1 1 1   16    7   35 o   43.604   2.7277   78.339   9.6467   57.121   17.416   87.729   11.586   36.359   6.0917   46.082   3.1025 -9.723595 6.836225 
1 1 1   16    7   36 o   91.454   1.8396  342.034   13.714  347.009   24.676  339.811   16.496   91.718   3.3059   91.087   2.2217 0.6312485 3.983078 
1 1 1   16    7   37 o  147.853   2.1344  895.165   25.725  943.568   54.170  881.070   29.231  150.585   4.4178  146.577   2.4465 4.007767 5.049992 
1 1 1   16    7   38 o   65.507   2.2058  176.009   11.762  163.807   19.589  182.887   14.708   62.788   3.8458   66.670   2.7120 -3.882576 4.705897 
1 1 1   16    7   39 o   45.846   2.7408   86.682   10.196   91.585   17.434   84.134   12.569   46.631   4.6485   45.009   3.4522 1.621799 5.790181 
1 1 1   16    7   40 o   19.797   5.3745   17.057   8.8938   22.879   15.659   14.285   10.806   23.061   7.3742   18.627   6.1387 4.434196 9.594925 
1 1 1   16    7   41 o   71.146   2.1588  207.650   12.505  241.451   29.435  200.205   13.814   75.789   4.7890   69.797   2.4317 5.992447 5.371002 
1 1 1   16    7   42 o   79.864   2.0517  261.510   13.346  237.313   30.902  267.057   14.797   74.937   5.0891   80.658   2.2527 -5.720993 5.565415 
1 1 1   16    7   43 o   64.358   2.2588  170.153   11.831  169.225   28.040  170.354   13.050   62.972   5.5182   64.340   2.4929 -1.368340 6.055161 
1 1 1   16    7   44 o   30.848   3.4841   39.904   8.6079   36.679   16.294   41.152   10.138   28.507   7.0513   31.173   4.0882 -2.665405 8.150660 
1 1 1   16    7   45 o   16.965   5.2956   12.193   8.1202   24.400   15.585   7.6451   9.5134   23.492   7.3371   15.156   5.6884 8.336614 9.283890 
1 1 1   16    7   46 o   44.185   2.6651   80.694   9.5543  102.595   18.274   72.456   11.208   49.204   4.6098   41.695   3.3253 7.508823 5.684003 
1 1 1   16    7   47 o   42.343   2.7244   74.214   9.3536   81.339   17.196   71.220   11.147   43.614   4.9227   41.318   3.3380 2.296494 5.947745 
1 1 1   16    7   48 o   52.481   2.3494  113.481   10.025  122.009   18.566  109.972   11.911   53.769   4.2711   51.531   2.8466 2.237720 5.132802 
1 1 1   16    7   49 o   77.582   2.1158  247.368   13.368  278.076   22.936  231.570   16.451   81.706   3.4516   74.866   2.7001 6.839577 4.382213 
1 1 1   16    7   50 o   57.166   2.4459  134.851   11.371  137.379   19.046  133.451   14.174   57.065   4.1223   56.665   3.0803 0.3997650 5.146036 
1 1 1   16    7   51 o   90.375   1.9945  335.362   14.693  334.003   24.143  336.162   18.517   89.557   3.3129   90.252   2.5194 -0.6946716 4.162043 
1 1 1   16    7   52 o   62.581   2.2897  161.453   11.660  186.929   19.744  147.807   14.450   66.778   3.6409   59.638   2.9818 7.140182 4.706118 
1 1 1   16    7   53 o   41.216   2.9671   70.811   9.9018   78.096   16.473   66.689   12.390   42.546   4.8354   39.680   3.8801 2.866463 6.199732 
1 1 1   16    7   54 o   23.540   4.8263   24.445   8.9499   23.409   15.379   24.976   11.006   22.703   7.3127   23.508   5.7836 -0.8048477 9.323355 
1 1 1   16    7   55 o   14.920   5.4465   8.2649   8.6139   2.5197   14.368   11.489   10.763   15.378   6.5438   17.041   6.1061 -1.663430 8.950212 
1 1 1   16    7   56 o   19.772   6.4304   17.284   11.875  -7.0415   22.270   26.948   14.037   16.610   7.5467   24.085   6.8341 -7.475515 10.18125 
1 1 1   16    7   57 o   21.368   6.3923   20.853   11.996   15.647   23.780   22.630   13.893   21.522   8.7185   22.185   6.9270 -0.6627617 11.13534 
1 1 1   16    7   58 o   48.919   3.4845  100.883   13.804   88.324   26.375  105.620   16.199   43.057   7.8021   49.788   4.0258 -6.730865 8.779503 
1 1 1   16    7   59 o   40.290   3.0268   68.050   9.8680   53.185   15.761   77.634   12.656   34.310   5.8446   42.782   3.6643 -8.471714 6.898290 
1 1 1   16    7   60 o   45.597   3.0614   87.178   11.313   91.252   15.661   82.733   16.358   46.090   4.2151   43.616   4.6738 2.473694 6.293809 
1 1 1   16    7   61 o   35.519   3.7621   53.918   10.727   57.762   14.911   49.795   15.445   36.041   5.2277   33.021   5.9569 3.020390 7.925547 
1 1 1   16    7   62 o   34.234   3.8898   50.344   10.663   51.817   14.727   48.722   15.457   33.908   5.5178   32.559   6.0466 1.349770 8.185784 
1 1 1   16    7   63 o   29.409   3.8401   37.283   8.9861   47.318   14.501   31.027   11.449   32.220   5.7314   26.041   5.5627 6.179188 7.986997 
1 1 1   16    7   64 o   20.215   5.3022   18.682   8.8435   15.407   14.460   20.639   11.178   19.110   7.0433   21.045   6.1386 -1.934500 9.342927 
1 1 1   16    7   65 o   17.822   5.5162   14.330   8.8315  -4.2806   14.155   26.192   11.301   13.408   6.0619   23.702   5.8781 -10.29358 8.443834 
1 1 1   16    7   66 o   17.907   5.5044   14.542   8.8117   11.738   14.465   16.196   11.111   17.767   6.9267   18.876   6.2251 -1.108393 9.312920 
1 1 1   16    7   67 o   46.658   2.6888   91.109   10.183   95.587   16.479   88.342   12.952   46.821   4.3680   45.523   3.5176 1.297890 5.608356 
1 1 1   16    7   68 o   10.703   4.7951  -2.4882   8.6316  -4.1289   14.371  -1.5623   10.796   13.447   6.0909   12.242   5.4312 1.204622 8.160717 
1 1 1   16    7   69 o   13.605   5.3385   5.9156   8.6385   9.2233   14.013   3.8879   10.971   16.685   6.7162   13.887   5.8029 2.797666 8.875881 
1 1 1   16    7   70 o   20.374   5.2290   19.310   8.7270   29.429   14.045   12.946   11.138   24.379   6.8077   17.252   6.2080 7.126577 9.213287 
1 1 1   16    7   71 o   11.759   5.0405   1.1789   8.6357  -9.3997   13.987   7.6951   10.978   12.141   5.6784   15.094   5.9884 -2.953567 8.252567 
1 1 1   16    7   72 o   30.273   4.1620   40.586   9.9990   57.599   18.438   33.498   11.901   34.060   6.8782   26.586   5.6650 7.473953 8.910794 
1 1 1   16    7   73 o   34.296   4.4470   52.664   12.140   87.060   25.819   42.902   13.755   40.524   8.0994   29.967   5.8408 10.55698 9.985715 
1 1 1   16    7   74 o   51.472   3.1450  113.231   13.133  123.005   26.719  110.118   15.080   49.804   6.7554   50.312   3.7029 -0.5086288 7.703686 
1 1 1   16    7   75 o   23.417   5.8626   26.923   11.164   30.391   23.246   25.884   12.728   23.054   8.8360   22.532   6.5442 0.5222206 10.99551 
1 1 1   16    7   76 o   27.488   5.8256   36.950   12.647   0.0000   0.0000   36.950   12.647  ?   ?    27.488   5.8256 0.000000 5.825552 
1 1 1   16    7   77 o   18.817   6.1420   17.669   10.828   13.693   22.556   18.860   12.344   18.745   8.0916   19.276   6.5640 -0.5312309 10.41924 
1 1 1   16    7   78 o   13.447   5.5489   5.2773   9.8557 -13.7612   16.578   15.685   12.257   12.273   5.8684   17.882   6.5017 -5.609527 8.758376 
1 1 1   16    7   79 o   16.913   5.9003   13.888   9.9952   26.008   16.734   7.1660   12.462   21.438   7.6213   14.854   6.1942 6.583376 9.820964 
1 1 1   16    7   80 o   29.418   4.5472   40.304   10.553   30.347   17.101   46.427   13.411   22.712   7.7261   30.715   5.5611 -8.003010 9.519313 
1 1 1   16    7   81 o   20.394   5.9619   21.634   10.534   23.189   12.008   16.444   21.942   20.770   6.4327   18.524   7.9885 2.245663 10.25648 
1 1 1   16    7   82 f   18.783   6.0582   18.519   10.553   19.610   12.001   14.799   22.159   19.079   6.4726   18.065   7.9061 1.014091 10.21768 
1 1 1   16    7   83 o   28.801   4.8859   39.936   11.061   31.842   12.299   74.179   25.298   24.504   6.1640   33.432   9.0592 -8.928766 10.95740 
1 1 1   16    7   84 o   12.887   5.6640   2.4635   11.483   2.4635   11.483   0.0000   0.0000   12.887   5.6640  ?   ?  0.000000 5.663982 
1 1 1   16    7   85 o   14.404   5.9617   7.8136   11.424   7.8136   11.424   0.0000   0.0000   14.404   5.9617  ?   ?  0.000000 5.961743 
1 1 1   16    7   86 o   11.723   5.3552  -1.9687   11.407  -1.9687   11.407   0.0000   0.0000   11.723   5.3552  ?   ?  0.000000 5.355173 
1 1 1   16    7   87 o   15.192   6.1983   10.101   12.121   10.101   12.121   0.0000   0.0000   15.192   6.1983  ?   ?  0.000000 6.198308 
1 1 1   16    7   88 o   12.204   5.6928  -4.2971   13.907  -4.2971   13.907   0.0000   0.0000   12.204   5.6928  ?   ?  0.000000 5.692833 
1 1 1   16    7   89 o   15.525   6.5980   10.120   14.574   10.120   14.574   0.0000   0.0000   15.525   6.5980  ?   ?  0.000000 6.597955 
1 1 1   16    7   90 o   12.303   5.9275 -12.2015   17.653 -12.2015   17.653   0.0000   0.0000   12.303   5.9275  ?   ?  0.000000 5.927472 
1 1 1   16    7   92 o   23.525   7.2553   34.357   15.294   34.357   15.294   0.0000   0.0000   23.525   7.2553  ?   ?  0.000000 7.255341 
1 1 1   16    7   93 o   12.667   5.8720  -1.9479   14.441  -1.9479   14.441   0.0000   0.0000   12.667   5.8720  ?   ?  0.000000 5.872014 
1 1 1   16    7   94 o   15.944   6.7441   12.400   15.106   12.400   15.106   0.0000   0.0000   15.944   6.7441  ?   ?  0.000000 6.744122 
1 1 1   16    7   95 o   12.062   5.6664  -4.5339   14.190  -4.5339   14.190   0.0000   0.0000   12.062   5.6664  ?   ?  0.000000 5.666403 
1 1 1   16    7   96 o   10.933   5.2807 -11.9226   14.226 -11.9226   14.226   0.0000   0.0000   10.933   5.2807  ?   ?  0.000000 5.280650 
1 1 1   16    7   97 o   18.730   7.1282   22.171   15.059   22.171   15.059   0.0000   0.0000   18.730   7.1282  ?   ?  0.000000 7.128167 
1 1 1   16    7   98 o   16.032   6.9865   12.358   17.146   1.2397   24.264   23.447   24.231   15.216   7.2261   18.454   8.1643 -3.237078 10.90284 
1 1 1   16    8  -94 o   15.494   7.3007   4.5879   23.872   4.5879   23.872   0.0000   0.0000   15.494   7.3007  ?   ?  0.000000 7.300650 
1 1 1   16    8  -93 f   12.991   6.3702 -17.0487   22.959 -17.0487   22.959   0.0000   0.0000   12.991   6.3702  ?   ?  0.000000 6.370152 
1 1 1   16    8  -92 o   20.017   8.5782   32.899   25.004   32.899   25.004   0.0000   0.0000   20.017   8.5782  ?   ?  0.000000 8.578250 
1 1 1   16    8  -91 o   18.438   8.1402   23.453   23.968   23.453   23.968   0.0000   0.0000   18.438   8.1402  ?   ?  0.000000 8.140232 
1 1 1   16    8  -90 o   14.070   6.7751  -7.2134   22.982  -7.2134   22.982   0.0000   0.0000   14.070   6.7751  ?   ?  0.000000 6.775096 
1 1 1   16    8  -89 f   14.487   6.9460  -4.9884   23.574  -4.9884   23.574   0.0000   0.0000   14.487   6.9460  ?   ?  0.000000 6.945991 
1 1 1   16    8  -88 o   13.901   6.7234 -10.1878   23.250 -10.1878   23.250   0.0000   0.0000   13.901   6.7234  ?   ?  0.000000 6.723437 
1 1 1   16    8  -87 o   16.946   7.7925   12.008   24.701   12.008   24.701   0.0000   0.0000   16.946   7.7925  ?   ?  0.000000 7.792542 
1 1 1   16    8  -86 o   13.323   6.4638 -13.6647   21.920 -13.6647   21.920   0.0000   0.0000   13.323   6.4638  ?   ?  0.000000 6.463835 
1 1 1   16    8  -85 o   18.897   7.4924   22.053   17.175   22.053   17.175   0.0000   0.0000   18.897   7.4924  ?   ?  0.000000 7.492391 
1 1 1   16    8  -84 o   18.124   7.2305   19.113   16.091   19.113   16.091   0.0000   0.0000   18.124   7.2305  ?   ?  0.000000 7.230491 
1 1 1   16    8  -83 o   14.655   6.5796   4.6890   16.349   4.6890   16.349   0.0000   0.0000   14.655   6.5796  ?   ?  0.000000 6.579639 
1 1 1   16    8  -82 o   10.633   5.0658  -9.2169   12.122 -11.6558   15.858  -5.7894   18.800   11.835   5.6805   13.604   6.4309 -1.768665 8.580436 
1 1 1   16    8  -81 o   13.324   5.8628   3.2741   12.334  -1.3255   16.010   9.9911   19.347   13.536   6.2423   16.430   7.2809 -2.894320 9.590482 
1 1 1   16    8  -80 o   21.198   6.6637   25.382   12.835   41.457   16.998   4.0628   19.575   26.216   7.5473   15.439   7.0382 10.77716 10.31976 
1 1 1   16    8  -79 o   11.299   5.2971  -6.2313   12.295  -3.2116   16.120 -10.4306   19.010   13.309   6.1816   13.173   6.2947 0.1365175 8.822500 
1 1 1   16    8  -78 o   11.645   5.3310  -2.5979   11.386   12.099   16.582 -15.7065   15.661   16.674   7.0602   11.355   5.4981 5.319478 8.948451 
1 1 1   16    8  -77 o   9.5153   4.6203 -14.3337   11.262  -4.3606   16.011 -24.1007   15.845   13.176   6.1334   10.516   5.1830 2.659382 8.030121 
1 1 1   16    8  -76 o   28.748   5.3573   40.610   12.092   27.265   16.970   54.376   17.236   21.428   7.6686   31.690   6.8706 -10.26191 10.29626 
1 1 1   16    8  -75 o   37.043   4.2689   62.765   12.655   47.304   17.720   78.858   18.079   28.912   7.4670   39.965   5.7117 -11.05304 9.401059 
1 1 1   16    8  -74 o   17.599   6.7909   14.929   13.795   32.318   25.348   7.6106   16.444   22.483   9.0390   15.996   6.9068 6.487335 11.37573 
1 1 1   16    8  -73 o   16.347   5.6268   12.693   9.0764 -21.9813   25.067   17.925   9.7371   14.191   6.8914   18.946   5.7791 -4.754641 8.993810 
1 1 1   16    8  -72 o   28.263   4.0624   35.965   9.0904   41.280   26.059   35.229   9.6997   25.083   9.4144   27.721   4.4425 -2.637938 10.40998 
1 1 1   16    8  -71 o   28.610   4.1092   36.801   9.3086   33.134   26.667   37.310   9.9335   23.263   9.2990   28.624   4.3978 -5.361149 10.28645 
1 1 1   16    8  -70 o   16.161   5.1594   12.181   7.6679   23.111   14.023   7.5197   9.1582   21.083   6.9949   14.178   5.5160 6.905135 8.908106 
1 1 1   16    8  -69 o   11.737   4.8574   3.0383   7.5819  -2.9946   13.980   5.5521   9.0243   13.173   5.9829   13.390   5.3898 -0.2172337 8.052615 
1 1 1   16    8  -68 o   19.284   4.9608   17.420   7.8423   12.556   14.244   19.536   9.3943   17.438   6.8514   20.181   5.5421 -2.742342 8.812269 
1 1 1   16    8  -67 o   37.441   2.8826   59.477   8.7301   95.359   15.843   43.831   10.462   46.476   4.2281   31.422   4.1886 15.05349 5.951579 
1 1 1   16    8  -66 o   39.965   2.7350   67.364   8.8562   75.323   15.943   63.811   10.651   40.844   4.8852   38.526   3.4272 2.317799 5.967462 
1 1 1   16    8  -65 o   12.196   5.0671   2.9305   8.2961  -2.0961   17.631   4.3598   9.4020   15.053   6.7892   13.266   5.4411 1.787576 8.700542 
1 1 1   16    8  -64 o   13.062   5.1721   5.1835   8.1740   16.431   17.897   2.2188   9.1884   19.649   7.6917   12.443   5.2614 7.205850 9.319048 
1 1 1   16    8  -63 o   11.065   4.7118   1.0575   7.4581  -2.0378   12.325   2.8457   9.3679   12.891   5.7558   12.779   5.3525 0.1123943 7.859948 
1 1 1   16    8  -62 o   14.232   5.1513   8.0202   7.6828   10.424   11.023   5.7495   10.713   16.285   6.1209   14.426   5.8489 1.858951 8.466110 
1 1 1   16    8  -61 o   13.467   4.9928   6.7330   7.2849  -3.0875   11.288   13.744   9.5371   12.146   5.4591   17.510   5.7669 -5.363505 7.941000 
1 1 1   16    8  -60 o   15.332   5.0263   10.192   7.2481   19.507   11.531   4.1071   9.3192   20.405   6.3010   13.271   5.4272 7.134377 8.316091 
1 1 1   16    8  -59 o   15.441   5.0472   10.331   7.3109   11.340   11.725   9.6894   9.3515   16.936   6.3235   15.601   5.6780 1.335566 8.498603 
1 1 1   16    8  -58 o   33.065   2.8582   45.973   7.6282   42.681   11.950   48.236   9.9099   30.963   4.8975   33.545   3.6847 -2.582136 6.128895 
1 1 1   16    8  -57 o   38.588   2.5640   62.125   8.0194   67.228   12.466   58.523   10.474   39.559   3.9172   37.077   3.5074 2.482014 5.258006 
1 1 1   16    8  -56 o   49.172   2.1322  100.020   8.5262  105.902   13.098   95.695   11.232   50.134   3.2222   47.799   2.8962 2.335312 4.332504 
1 1 1   16    8  -55 o   17.528   5.2922   13.751   8.1941   14.677   11.349   12.744   11.844   18.341   6.2925   17.621   6.3934 0.7200394 8.970577 
1 1 1   16    8  -54 o   32.370   3.3186   44.397   8.6327   41.984   11.728   47.251   12.753   30.837   4.8237   32.690   4.9400 -1.852808 6.904451 
1 1 1   16    8  -53 o   29.104   3.5236   36.113   8.1894   49.133   14.065   29.435   10.073   33.145   5.3907   25.675   4.9928 7.470379 7.347651 
1 1 1   16    8  -52 o   16.431   5.4791   11.508   8.6015   7.1697   14.729   13.753   10.596   16.676   6.8218   17.889   6.0817 -1.212294 9.139127 
1 1 1   16    8  -51 o   42.693   2.8394   76.079   9.8252  107.577   17.048   60.414   12.023   50.136   4.2104   37.585   3.9848 12.55074 5.797085 
1 1 1   16    8  -50 o   27.715   4.0207   33.098   8.8186   31.567   15.450   33.838   10.740   25.852   7.1104   27.669   4.9432 -1.817196 8.659845 
1 1 1   16    8  -49 o   52.038   2.2961  111.915   9.7158  122.998   17.891  107.279   11.571   53.760   4.1138   50.773   2.8066 2.986500 4.980023 
1 1 1   16    8  -48 o   12.689   4.9946   4.4268   7.5819 -12.6931   13.080   13.089   9.3044   11.419   5.3877   17.446   5.6933 -6.027375 7.838464 
1 1 1   16    8  -47 o   41.645   2.5232   71.905   8.5254   57.350   14.328   79.882   10.608   36.276   4.9762   43.756   2.9921 -7.479382 5.806507 
1 1 1   16    8  -46 o   17.931   5.0414   14.211   7.6744   13.955   13.304   14.338   9.3951   18.709   6.7778   18.130   5.7015 0.5786648 8.856983 
1 1 1   16    8  -45 o   52.309   2.5229  113.210   10.726  138.441   16.182   93.442   14.324   57.487   3.4694   47.073   3.7642 10.41418 5.119230 
1 1 1   16    8  -44 o   17.865   5.1291   14.036   7.8609   33.846   13.737   4.3912   9.5853   27.291   6.3023   13.761   5.5493 13.53014 8.397248 
1 1 1   16    8  -43 o   20.969   4.7110   19.353   7.8555   28.912   13.653   14.623   9.6044   25.161   6.5826   18.358   5.7635 6.803165 8.749227 
1 1 1   16    8  -42 o   43.621   2.4864   78.671   8.8044   89.539   15.109   73.083   10.834   46.019   4.0696   41.841   3.2007 4.177818 5.177511 
1 1 1   16    8  -41 o   71.317   1.8402  208.665   10.689  208.680   17.972  208.657   13.296   70.887   3.1178   71.186   2.2944 -0.2993546 3.871052 
1 1 1   16    8  -40 o   28.751   3.4578   34.832   7.9415   33.169   14.162   35.595   9.5913   27.078   6.4991   28.852   4.2015 -1.773930 7.738928 
1 1 1   16    8  -39 o   12.725   5.1473   3.3681   8.2756   26.934   19.367  -1.8959   9.1534   24.619   8.2217   11.464   5.0472 13.15493 9.647345 
1 1 1   16    8  -38 o   17.604   5.3844   13.319   8.4450   9.1963   19.479   14.273   9.3715   19.320   7.8670   18.239   5.6884 1.081690 9.708101 
1 1 1   16    8  -37 o   16.563   5.6037   11.097   8.9949 -14.6823   27.016   14.311   9.5392   17.632   8.1231   18.297   5.7438 -0.6657295 9.948696 
1 1 1   16    8  -36 o   33.842   3.4530   47.962   9.3923   45.603   15.598   49.304   11.764   32.092   6.1868   34.063   4.3349 -1.970493 7.554341 
1 1 1   16    8  -35 o   42.984   2.5788   76.282   8.9943   72.134   16.486   78.040   10.732   41.065   5.0299   43.367   3.0555 -2.302025 5.885182 
1 1 1   16    8  -34 o   72.900   1.9289  217.862   11.452  226.313   20.971  214.271   13.670   73.819   3.4950   72.202   2.3258 1.617737 4.198122 
1 1 1   16    8  -33 o   84.974   1.7178  295.452   11.899  280.440   19.415  304.483   15.058   82.442   2.8935   86.169   2.1438 -3.726959 3.601100 
1 1 1   16    8  -32 o   43.354   2.4893   77.463   8.7600   71.261   14.918   80.727   10.822   41.046   4.5341   44.146   3.0257 -3.099968 5.450998 
1 1 1   16    8  -31 o   15.966   5.3452   10.239   8.1852   11.893   13.232   9.2136   10.418   18.256   6.7361   16.230   5.9790 2.026196 9.006842 
1 1 1   16    8  -30 o   26.502   3.7791   29.670   7.9329   24.379   13.572   32.416   9.7770   23.502   6.7368   27.534   4.5123 -4.032038 8.108385 
1 1 1   16    8  -29 o   64.520   2.0476  170.668   10.755  177.950   17.069  165.874   13.851   65.608   3.2013   63.472   2.6832 2.135757 4.177034 
1 1 1   16    8  -28 o   40.303   2.7848   67.097   9.0926   58.321   14.570   72.695   11.637   37.014   4.9532   41.815   3.4445 -4.801132 6.033125 
1 1 1   16    8  -27 o   20.857   5.0816   18.942   8.5588   3.2888   13.954   28.383   10.837   15.759   6.5615   25.535   5.3766 -9.775409 8.482973 
1 1 1   16    8  -26 o   30.092   4.3551   38.386   10.372   28.445   14.297   49.434   15.072   25.350   6.7849   33.835   5.6647 -8.485697 8.838763 
1 1 1   16    8  -25 o   33.852   3.7096   47.920   10.069   37.665   14.538   57.376   13.959   29.285   6.2785   36.800   4.7652 -7.514990 7.882071 
1 1 1   16    8  -24 o   35.925   3.4936   53.743   10.102   59.794   14.628   48.226   13.967   37.552   4.8954   33.552   5.2813 3.999886 7.201136 
1 1 1   16    8  -23 o   51.633   2.4982  109.586   10.483  111.863   15.906  107.838   13.939   51.887   3.7869   51.042   3.3691 0.8447533 5.068623 
1 1 1   16    8  -22 f   36.750   3.8710   56.435   11.422   52.317   14.926   62.255   17.744   34.959   5.4124   38.038   5.9150 -3.079140 8.017550 
1 1 1   16    8  -21 o   22.511   6.6180   21.951   12.948   6.8206   20.054   32.767   16.956   19.294   7.9337   27.191   7.4369 -7.897427 10.87437 
1 1 1   16    8  -20 o   27.334   5.2157   32.192   11.197   32.797   14.698   31.356   17.285   27.285   6.6663   26.653   7.5909 0.6325321 10.10253 
1 1 1   16    8  -19 o   10.846   4.7719  -2.0147   8.1697   3.6542   14.060  -4.9041   10.038   15.983   6.6147   11.347   5.1197 4.636224 8.364524 
1 1 1   16    8  -18 o   10.950   4.8149  -2.0041   8.3062 -17.6329   14.745   5.2609   10.053   11.830   5.6222   14.564   5.7455 -2.733866 8.038642 
1 1 1   16    8  -17 o   62.984   2.0833  162.478   10.681  162.569   18.413  162.432   13.113   62.694   3.6183   62.896   2.5631 -0.2019806 4.434123 
1 1 1   16    8  -16 o   50.628   2.4399  105.248   10.039   84.376   16.974  116.478   12.451   44.835   4.7148   53.190   2.8824 -8.355106 5.526058 
1 1 1   16    8  -15 o   21.437   5.4897   19.936   9.6338   41.312   16.044   7.8830   12.047   30.721   6.6034   16.473   6.3488 14.24810 9.160413 
1 1 1   16    8  -14 o  126.360   1.8428  652.643   18.982  600.514   27.824  698.023   25.961  120.975   2.8216  130.538   2.4397 -9.563034 3.730098 
1 1 1   16    8  -13 o   59.615   2.4430  145.817   11.847  148.365   18.558  144.064   15.391   59.851   3.8239   59.114   3.2060 0.7363930 4.990033 
1 1 1   16    8  -12 o  104.647   1.7510  447.473   14.936  423.446   24.385  461.901   18.896  101.521   2.9498  106.247   2.1818 -4.725746 3.668996 
1 1 1   16    8  -11 o   31.209   3.7373   40.703   9.3187   50.181   16.184   36.002   11.398   34.118   6.0400   29.039   4.9953 5.079586 7.838000 
1 1 1   16    8  -10 o   35.173   3.3746   51.340   9.5566   38.184   16.692   57.756   11.656   29.457   7.0463   37.219   3.8998 -7.761602 8.053504 
1 1 1   16    8   -9 o  127.917   1.7168  668.486   17.901  663.231   29.592  671.518   22.482  127.148   2.8551  128.120   2.1526 -0.9723282 3.575699 
1 1 1   16    8   -8 o   63.140   2.2052  163.312   11.333  167.256   19.636  161.343   13.877   63.584   3.8060   62.674   2.7227 0.9092178 4.679612 
1 1 1   16    8   -7 o   40.316   3.0288   67.096   9.8811   73.405   17.403   64.096   12.003   41.683   5.2373   39.255   3.7986 2.427635 6.469829 
1 1 1   16    8   -6 o  102.032   1.7854  425.373   14.849  417.370   24.769  429.864   18.553  100.789   3.0182  102.499   2.2206 -1.710022 3.747064 
1 1 1   16    8   -5 o   81.285   1.8158  269.993   12.031  256.913   18.546  279.499   15.810   79.086   2.8817   82.599   2.3505 -3.513329 3.718706 
1 1 1   16    8   -4 o   32.330   3.6160   43.554   9.3664   6.8698   15.375   65.203   11.811   17.566   7.0474   39.619   3.7000 -22.05356 7.959650 
1 1 1   16    8   -3 o   62.089   2.2377  157.937   11.307  130.372   16.613  181.723   15.433   56.152   3.6494   66.503   2.8535 -10.35041 4.632545 
1 1 1   16    8   -2 o   36.247   3.3907   54.485   9.9023   72.912   19.662   48.223   11.462   41.327   6.0128   33.910   4.2390 7.416729 7.356855 
1 1 1   16    8   -1 o   10.010   4.6553  -8.0992   9.1908  -9.7979   18.211  -7.5188   10.646   15.016   6.8234   11.158   5.1254 3.858651 8.533974 
1 1 1   16    8    0 o   66.348   2.1851  180.272   11.802  183.225   21.756  179.041   14.048   66.514   4.0315   66.053   2.6143 0.4606247 4.804981 
1 1 1   16    8    1 o   58.742   2.1653  141.337   10.351  159.291   16.451  129.572   13.317   62.178   3.2571   56.124   2.9209 6.054020 4.374978 
1 1 1   16    8    2 o   20.923   5.3894   18.926   9.2480   3.5215   16.694   25.747   11.108   17.197   7.1698   24.358   5.6968 -7.160397 9.157546 
1 1 1   16    8    3 o   41.377   3.1391   70.709   10.509   42.707   21.646   79.344   12.020   30.999   8.3714   43.798   3.3933 -12.79968 9.032998 
1 1 1   16    8    4 o   22.617   5.3547   22.144   9.7181   38.059   20.069   17.269   11.107   29.340   8.1172   20.219   6.1732 9.121220 10.19794 
1 1 1   16    8    5 o   46.712   2.8135   89.804   10.663   78.666   21.724   93.339   12.239   42.820   6.4217   47.564   3.1749 -4.744019 7.163644 
1 1 1   16    8    6 o   32.441   3.8668   43.989   10.024   46.237   20.799   43.308   11.441   32.273   7.9574   32.045   4.5040 0.2280998 9.143619 
1 1 1   16    8    7 o   30.993   3.6204   40.075   8.9743   34.484   14.585   43.483   11.385   28.087   6.4992   32.117   4.4696 -4.030685 7.887782 
1 1 1   16    8    8 o   63.934   2.1023  167.363   10.941  184.316   18.421  158.121   13.601   66.858   3.3911   62.049   2.6954 4.809132 4.331821 
1 1 1   16    8    9 o   10.663   4.7918  -3.9862   8.6934   0.4502   14.621  -6.4125   10.812   15.413   6.5814   11.515   5.2423 3.897904 8.414076 
1 1 1   16    8   10 o   14.108   5.3851   5.8706   8.6108   12.748   14.584   2.1903   10.669   19.185   7.0731   13.821   5.7445 5.364034 9.111989 
1 1 1   16    8   11 o   65.789   2.0566  177.191   11.016  163.159   17.647  186.149   14.100   62.871   3.4567   67.350   2.5730 -4.479225 4.309150 
1 1 1   16    8   12 o   58.673   2.2142  141.079   10.571  167.425   17.593  126.192   13.225   63.700   3.4005   55.369   2.9407 8.330849 4.495680 
1 1 1   16    8   13 o   27.864   4.1256   32.756   9.0876   29.064   15.395   34.730   11.258   25.752   7.1037   28.494   5.0310 -2.742718 8.704759 
1 1 1   16    8   14 o   72.997   1.9330  218.015   11.492  234.913   19.012  208.287   14.426   75.551   3.0936   71.258   2.4873 4.293365 3.969558 
1 1 1   16    8   15 o   61.874   2.1185  156.818   10.669  158.267   17.760  156.000   13.345   61.886   3.5354   61.623   2.6631 0.2625580 4.426178 
1 1 1   16    8   16 o   65.140   2.2778  173.932   12.076  161.471   17.729  184.718   16.494   62.517   3.4928   66.987   3.0285 -4.470371 4.622955 
1 1 1   16    8   17 o  105.821   1.8709  457.817   16.139  443.164   23.292  471.347   22.382  103.892   2.7528  107.229   2.5606 -3.337318 3.759618 
1 1 1   16    8   18 o  123.740   1.9914  626.282   20.086  651.961   33.652  612.070   25.035  125.827   3.2838  122.200   2.5133 3.627502 4.135183 
1 1 1   16    8   19 o   40.006   2.8707   66.053   9.2995   71.493   15.477   62.980   11.634   41.221   4.6894   38.895   3.7144 2.325783 5.982222 
1 1 1   16    8   20 o   48.437   2.4740   96.414   9.7358  100.732   15.860   93.802   12.333   49.196   3.9891   47.644   3.1941 1.552559 5.110281 
1 1 1   16    8   21 o   72.094   1.9105  212.724   11.218  212.736   18.022  212.717   14.333   71.857   3.0839   71.998   2.4457 -0.1403732 3.935987 
1 1 1   16    8   22 f   64.771   2.1715  171.962   11.449  184.873   17.508  162.314   15.133   66.938   3.2180   62.770   2.9660 4.167671 4.376418 
1 1 1   16    8   23 o   38.625   2.9536   61.684   9.2289   64.407   14.776   59.942   11.817   39.051   4.7387   37.876   3.8824 1.174606 6.126071 
1 1 1   16    8   24 o   64.633   2.2857  171.382   12.024  163.933   19.173  176.210   15.436   62.859   3.7591   65.408   2.9023 -2.548534 4.749105 
1 1 1   16    8   25 o   33.612   3.2083   46.952   8.6838   37.962   14.100   52.445   11.022   29.458   6.0738   35.390   3.8845 -5.931978 7.209789 
1 1 1   16    8   26 o  101.745   1.9668  423.685   16.312  439.910   25.833  412.925   21.037  103.322   3.0706  100.263   2.5761 3.058952 4.008077 
1 1 1   16    8   27 o   63.835   2.3512  167.322   12.213  158.650   19.130  173.289   15.868   61.780   3.8173   64.812   3.0118 -3.031368 4.862422 
1 1 1   16    8   28 o   92.701   2.0099  351.860   15.188  367.335   24.245  341.866   19.484   94.350   3.1569   91.191   2.6239 3.158867 4.104934 
1 1 1   16    8   29 o   30.494   4.6467   39.670   11.186   50.786   16.305   29.784   15.375   34.116   6.0862   25.850   7.0866 8.266003 9.341434 
1 1 1   16    8   30 o   20.362   5.5509   18.102   9.4642   16.902   15.449   18.823   11.974   20.725   7.3271   20.893   6.4155 -0.1679916 9.738842 
1 1 1   16    8   31 o   20.565   5.4298   18.505   9.2349   15.488   15.160   20.285   11.645   20.124   7.2423   21.534   6.2610 -1.410114 9.573494 
1 1 1   16    8   32 o   26.342   4.5213   29.777   9.3589   28.692   15.446   30.405   11.764   25.327   7.1632   26.314   5.6531 -0.9879150 9.125210 
1 1 1   16    8   33 o   79.401   2.2876  258.954   14.791   0.0000   0.0000  258.954   14.791  ?   ?    79.401   2.2876 0.000000 2.287602 
1 1 1   16    8   34 o   27.579   4.0280   32.308   8.7880   45.569   16.361   26.931   10.418   32.020   6.4910   24.790   5.3153 7.229773 8.389645 
1 1 1   16    8   35 o   46.636   3.2030   90.342   12.103  128.510   25.316   79.035   13.779   54.612   5.7742   43.393   3.9383 11.21850 6.989426 
1 1 1   16    8   36 o   9.8392   4.5533  -6.7014   8.6266 -16.4219   20.597  -4.6336   9.5000   14.808   6.9144   10.968   4.9618 3.839476 8.510461 
1 1 1   16    8   37 o   45.579   2.7894   85.977   10.314   91.452   24.345   84.779   11.386   45.420   6.7831   45.175   3.1110 0.2444115 7.462538 
1 1 1   16    8   38 o   10.977   4.7984  -1.2675   8.1409  -0.2483   14.841  -1.7062   9.7363   15.088   6.5383   11.906   5.2248 3.182215 8.369437 
1 1 1   16    8   39 o   35.618   3.1995   52.965   9.1904   62.871   16.780   48.720   10.984   37.984   5.5862   33.903   4.0550 4.080616 6.902824 
1 1 1   16    8   40 o   49.698   2.6523  102.141   10.706   67.200   23.789  111.015   11.989   38.086   7.9210   51.760   2.8525 -13.67406 8.418959 
1 1 1   16    8   41 o   41.752   2.7552   72.296   9.3246   93.795   16.982   63.015   11.157   46.956   4.4912   38.735   3.5738 8.220905 5.739636 
1 1 1   16    8   42 o   24.514   4.4150   26.052   8.4977   38.131   15.907   21.228   10.052   28.854   6.8636   21.799   5.6209 7.055065 8.871490 
1 1 1   16    8   43 o   46.649   2.5626   90.052   9.7068  124.857   18.889   77.563   11.315   54.252   4.3066   43.082   3.2459 11.17002 5.392818 
1 1 1   16    8   44 o   75.543   1.9592  234.492   12.054  225.967   21.710  238.292   14.494   73.431   3.6383   76.021   2.3416 -2.590172 4.326762 
1 1 1   16    8   45 o   41.077   2.8207   70.191   9.3876   73.540   17.222   68.776   11.197   41.063   5.2664   40.465   3.4268 0.5975456 6.283127 
1 1 1   16    8   46 o   23.627   4.7865   24.598   8.9025   22.917   16.569   25.279   10.556   22.604   7.6054   23.715   5.5579 -1.110413 9.419759 
1 1 1   16    8   47 o   37.241   3.0985   58.063   9.3208   49.707   17.054   61.622   11.130   32.964   6.5775   38.193   3.6182 -5.229080 7.506973 
1 1 1   16    8   48 o   48.033   2.5572   95.659   9.9762   79.059   18.054  102.954   11.969   42.452   5.3349   49.691   2.9685 -7.239647 6.105193 
1 1 1   16    8   49 o   36.468   3.4080   56.093   10.014   59.864   24.922   55.367   10.935   34.740   8.7941   36.095   3.7722 -1.354855 9.568984 
1 1 1   16    8   50 o   36.109   3.5294   55.188   10.256   58.334   24.454   54.516   11.297   34.229   8.7361   35.724   3.9452 -1.494934 9.585608 
1 1 1   16    8   51 o   41.770   3.5047   73.732   11.823  118.009   26.722   62.954   13.184   50.855   6.6018   38.228   4.3056 12.62661 7.881693 
1 1 1   16    8   52 o   27.627   4.6134   33.526   10.023   33.837   16.257   33.336   12.731   26.580   7.2869   26.960   5.9524 -0.3801956 9.409028 
1 1 1   16    8   53 o   15.655   5.4778   10.000   8.6189   5.0210   16.277   11.940   10.160   16.617   7.0133   16.951   5.9463 -0.3341560 9.194827 
1 1 1   16    8   54 o   48.164   2.7516   96.785   10.758  107.862   18.018   90.649   13.411   49.935   4.4739   46.235   3.5864 3.700893 5.733951 
1 1 1   16    8   55 o   38.324   2.9751   61.689   9.2213   65.696   15.465   59.478   11.487   38.539   5.0438   37.266   3.8361 1.272915 6.336819 
1 1 1   16    8   56 o   49.586   2.4490  102.182   9.8680  116.567   16.476   94.136   12.323   52.219   3.8988   47.258   3.2181 4.961449 5.055353 
1 1 1   16    8   57 o   60.342   2.1706  150.658   10.659  152.851   17.827  149.438   13.298   59.961   3.6649   59.836   2.7336 0.1251221 4.572115 
1 1 1   16    8   58 o   28.391   3.9402   34.942   8.8733   35.289   15.127   34.760   10.956   27.078   6.8496   27.828   5.0143 -0.7503567 8.488832 
1 1 1   16    8   59 o   53.576   2.3657  119.238   10.306  116.218   17.579  120.819   12.722   51.861   4.1940   53.668   2.9191 -1.807026 5.109881 
1 1 1   16    8   60 o   16.018   5.5711   10.864   8.9074   19.233   16.363   7.3397   10.619   20.613   7.5095   15.026   5.9119 5.587056 9.557334 
1 1 1   16    8   61 o   49.694   2.5639  103.093   10.351  103.734   19.043  102.824   12.331   48.378   4.8963   49.372   3.0794 -0.9933167 5.784161 
1 1 1   16    8   62 o   11.350   5.1017  -2.9121   9.8594 -19.6959   15.955   7.4561   12.540   11.663   5.6232   15.686   6.3396 -4.023251 8.474081 
1 1 1   16    8   63 o   48.634   3.0194   99.870   11.911  107.537   19.528   95.327   15.031   49.091   4.9474   46.928   3.9665 2.163013 6.341163 
1 1 1   16    8   64 o   46.424   3.1252   91.391   11.757  117.232   19.544   76.734   14.719   51.384   4.7187   41.740   4.3918 9.644493 6.446215 
1 1 1   16    8   65 o   27.701   3.9930   33.754   8.7564   35.613   15.033   32.799   10.772   26.722   6.8654   26.692   5.1375 0.3045273E-01 8.574785 
1 1 1   16    8   66 o   24.893   4.7129   28.218   9.2132   8.2145   17.924   35.401   10.741   17.284   7.3302   27.834   4.9136 -10.54942 8.824727 
1 1 1   16    8   67 o   35.266   3.7385   54.200   10.583   60.747   19.888   51.614   12.500   34.499   7.3002   33.824   4.6573 0.6748314 8.659286 
1 1 1   16    8   68 o   39.715   3.3199   67.850   10.649   60.085   18.966   71.425   12.870   34.476   6.9882   40.312   3.9678 -5.836487 8.036045 
1 1 1   16    8   69 o   23.727   5.2609   26.698   9.9084   40.045   18.268   21.134   11.794   27.039   7.8360   20.556   6.3767 6.483175 10.10271 
1 1 1   16    8   70 o   27.889   4.5521   35.564   9.9918   17.414   17.524   44.307   12.162   19.189   7.5809   30.856   5.0070 -11.66683 9.085151 
1 1 1   16    8   71 o   24.160   5.1649   27.801   9.8637   22.796   18.630   29.750   11.627   20.708   7.9168   24.499   5.8941 -3.791479 9.869988 
1 1 1   16    8   72 o   50.227   2.7169  107.195   11.082  116.638   20.213  103.136   13.252   50.040   5.0232   48.747   3.3554 1.292969 6.040765 
1 1 1   16    8   73 o   53.964   2.9474  124.808   12.916   87.673   20.119  150.842   16.846   42.093   6.0361   58.719   3.5358 -16.62618 6.995502 
1 1 1   16    8   74 o   28.964   7.5584   47.176   18.031   47.176   18.031   0.0000   0.0000   28.964   7.5584  ?   ?  0.000000 7.558356 
1 1 1   16    8   75 o   17.378   5.9232   15.126   10.052   23.162   16.924   10.746   12.495   20.240   7.5890   15.883   6.3596 4.357468 9.901361 
1 1 1   16    8   76 o   10.839   5.0518  -5.6760   10.913 -49.0515   23.376   6.4111   12.340   11.342   5.6990   14.403   6.0941 -3.061000 8.343671 
1 1 1   16    8   77 o   13.786   5.6904   6.5281   10.368  -8.0918   17.416   14.554   12.904   13.074   6.1833   17.051   6.5709 -3.976360 9.022689 
1 1 1   16    8   78 o   27.621   6.4704   41.094   14.311   39.243   17.666   44.630   24.411   25.271   7.7983   24.719   9.1442 0.5522652 12.01790 
1 1 1   16    8   79 o   20.282   7.6033   24.960   16.986   24.960   16.986   0.0000   0.0000   20.282   7.6033  ?   ?  0.000000 7.603302 
1 1 1   16    8   80 o   14.118   5.9161   6.9351   11.453   6.9351   11.453   0.0000   0.0000   14.118   5.9161  ?   ?  0.000000 5.916137 
1 1 1   16    8   81 o   14.477   6.0288   7.9275   11.783   7.9275   11.783   0.0000   0.0000   14.477   6.0288  ?   ?  0.000000 6.028778 
1 1 1   16    8   82 o   14.586   6.3673   6.3158   14.292   6.3158   14.292   0.0000   0.0000   14.586   6.3673  ?   ?  0.000000 6.367257 
1 1 1   16    8   83 o   18.104   6.8849   18.616   14.042   18.616   14.042   0.0000   0.0000   18.104   6.8849  ?   ?  0.000000 6.884865 
1 1 1   16    8   84 o   20.434   7.0974   25.334   14.454   25.334   14.454   0.0000   0.0000   20.434   7.0974  ?   ?  0.000000 7.097365 
1 1 1   16    8   85 o   15.399   6.5534   9.9709   14.412   9.9709   14.412   0.0000   0.0000   15.399   6.5534  ?   ?  0.000000 6.553352 
1 1 1   16    8   86 o   12.977   5.9631  -0.5669   14.425  -0.5669   14.425   0.0000   0.0000   12.977   5.9631  ?   ?  0.000000 5.963127 
1 1 1   16    8   87 o   12.403   5.7772  -3.1636   14.238  -3.1636   14.238   0.0000   0.0000   12.403   5.7772  ?   ?  0.000000 5.777235 
1 1 1   16    8   88 o   14.407   6.4029   5.9306   15.071   5.9306   15.071   0.0000   0.0000   14.407   6.4029  ?   ?  0.000000 6.402860 
1 1 1   16    8   89 f   13.151   5.9985   1.1183   14.245   1.1183   14.245   0.0000   0.0000   13.151   5.9985  ?   ?  0.000000 5.998477 
1 1 1   16    8   90 o   17.515   6.9958   18.166   15.081   18.166   15.081   0.0000   0.0000   17.515   6.9958  ?   ?  0.000000 6.995796 
1 1 1   16    8   91 o   13.572   6.1395   3.1649   14.543   3.1649   14.543   0.0000   0.0000   13.572   6.1395  ?   ?  0.000000 6.139488 
1 1 1   16    8   92 o   30.288   8.1043   61.739   20.401   61.739   20.401   0.0000   0.0000   30.288   8.1043  ?   ?  0.000000 8.104277 
1 1 1   16    8   93 f   13.881   6.2164   4.8866   14.493   4.8866   14.493   0.0000   0.0000   13.881   6.2164  ?   ?  0.000000 6.216393 
1 1 1   16    8   94 o   12.187   5.7269  -4.0769   14.516  -4.0769   14.516   0.0000   0.0000   12.187   5.7269  ?   ?  0.000000 5.726909 
1 1 1   16    9  -90 o   11.218   5.6292 -38.0783   22.425 -38.0783   22.425   0.0000   0.0000   11.218   5.6292  ?   ?  0.000000 5.629205 
1 1 1   16    9  -89 o   13.358   6.4588  -9.1719   21.420  -9.1719   21.420   0.0000   0.0000   13.358   6.4588  ?   ?  0.000000 6.458758 
1 1 1   16    9  -88 o   14.572   6.8702   1.3230   21.195   1.3230   21.195   0.0000   0.0000   14.572   6.8702  ?   ?  0.000000 6.870183 
1 1 1   16    9  -87 o   17.133   7.5943   17.156   21.062   17.156   21.062   0.0000   0.0000   17.133   7.5943  ?   ?  0.000000 7.594327 
1 1 1   16    9  -86 o   15.863   7.3209   8.7635   22.077   8.7635   22.077   0.0000   0.0000   15.863   7.3209  ?   ?  0.000000 7.320884 
1 1 1   16    9  -85 o   15.225   7.1024   4.2979   21.651   4.2979   21.651   0.0000   0.0000   15.225   7.1024  ?   ?  0.000000 7.102386 
1 1 1   16    9  -84 o   16.577   7.4763   12.804   21.381   12.804   21.381   0.0000   0.0000   16.577   7.4763  ?   ?  0.000000 7.476310 
1 1 1   16    9  -83 o   12.093   5.9272 -18.9939   19.812 -18.9939   19.812   0.0000   0.0000   12.093   5.9272  ?   ?  0.000000 5.927226 
1 1 1   16    9  -82 o   20.834   8.4693   32.818   22.531   32.818   22.531   0.0000   0.0000   20.834   8.4693  ?   ?  0.000000 8.469332 
1 1 1   16    9  -81 o   13.351   6.1674  -0.5028   15.725   10.365   22.021 -11.8090   22.461   16.428   7.4799   13.610   6.5885 2.818933 9.967872 
1 1 1   16    9  -80 o   16.372   6.8820   13.263   15.573   15.219   21.361   11.044   22.751   17.288   7.6561   16.689   7.6003 0.5981121 10.78802 
1 1 1   16    9  -79 o   15.856   6.7125   11.453   14.986   16.692   20.791   5.7895   21.619   17.578   7.6763   15.750   7.2600 1.827867 10.56567 
1 1 1   16    9  -78 o   12.851   5.7921   1.1280   12.807   4.9723   16.594  -4.5353   20.141   14.721   6.6174   14.026   6.6381 0.6945581 9.373084 
1 1 1   16    9  -77 o   13.142   5.8674   2.2118   12.806 -11.2498   16.071   25.627   21.195   11.938   5.7266   19.747   8.1419 -7.809659 9.954139 
1 1 1   16    9  -76 o   15.924   6.3877   12.099   12.629   9.7075   15.967   16.095   20.638   15.761   6.8058   17.729   7.6964 -1.968029 10.27391 
1 1 1   16    9  -75 o   10.423   4.9810 -10.0143   11.905  -4.2850   14.890 -20.1662   19.821   12.638   5.8939   12.258   5.9911 0.3805046 8.404217 
1 1 1   16    9  -74 o   20.730   8.2771   28.412   21.104   0.0000   0.0000   28.412   21.104  ?   ?    20.730   8.2771 0.000000 8.277090 
1 1 1   16    9  -73 o   19.437   6.7908   21.285   13.242   29.667   17.034   8.4812   21.053   21.855   7.6968   16.526   7.4391 5.329342 10.70424 
1 1 1   16    9  -72 o   18.719   6.4029   18.927   11.748   32.867   16.595   4.9228   16.633   23.246   7.6046   15.042   6.7031 8.204602 10.13719 
1 1 1   16    9  -71 o   15.655   5.7980   11.655   9.8191   12.664   24.997   11.471   10.677   17.980   8.0989   15.685   5.9943 2.294778 10.07586 
1 1 1   16    9  -70 o   15.967   5.6261   12.325   9.1026   5.5709   16.228   15.425   10.995   15.259   6.7190   17.425   6.1794 -2.165726 9.128525 
1 1 1   16    9  -69 o   12.951   5.2946   5.2784   8.8663   15.265   15.768   0.6608   10.722   17.779   7.1355   12.275   5.4308 5.503571 8.967083 
1 1 1   16    9  -68 o   11.490   5.0030   1.0220   8.7767   4.2036   15.736  -0.4146   10.574   15.023   6.6157   11.977   5.3405 3.045905 8.502229 
1 1 1   16    9  -67 o   17.105   5.6970   14.235   9.3000   21.103   16.032   10.752   11.417   19.885   7.4003   15.841   6.1600 4.043979 9.628572 
1 1 1   16    9  -66 o   18.050   5.2430   15.766   8.1696   17.847   11.814   13.859   11.309   18.802   6.4212   17.102   6.2411 1.700254 8.954531 
1 1 1   16    9  -65 o   9.8557   4.4999  -3.3964   8.0412  -0.7614   11.928  -5.5917   10.887   12.642   5.6522   11.032   5.1086 1.610565 7.618786 
1 1 1   16    9  -64 o   31.838   3.5041   44.285   8.9439   45.541   13.484   43.299   11.951   30.824   5.5716   30.494   4.9797 0.3303204 7.472621 
1 1 1   16    9  -63 o   21.371   5.1156   21.652   8.7932   18.074   13.574   24.238   11.542   19.169   6.8587   22.022   6.1795 -2.853212 9.231867 
1 1 1   16    9  -62 o   29.977   3.4822   39.082   8.3509   52.270   14.059   31.892   10.381   33.438   5.3373   26.167   5.0495 7.270555 7.347423 
1 1 1   16    9  -61 o   37.147   2.8407   58.532   8.5364   77.722   14.416   48.170   10.593   41.847   4.2866   33.039   4.0158 8.808277 5.873837 
1 1 1   16    9  -60 o   11.346   4.8165   1.5730   7.7511  -9.8852   13.202   7.6007   9.5752   11.606   5.4562   14.513   5.6419 -2.907618 7.848648 
1 1 1   16    9  -59 o   35.247   3.1956   53.098   9.0819   67.796   12.452   36.393   13.275   39.415   3.9278   27.491   6.0850 11.92468 7.242525 
1 1 1   16    9  -58 o   16.727   5.4489   12.696   8.5246   9.1628   11.645   16.775   12.513   15.847   6.2042   18.972   6.6027 -3.125631 9.060231 
1 1 1   16    9  -57 o   17.068   5.4410   13.262   8.5303   14.390   11.597   11.932   12.591   17.940   6.3478   17.159   6.5210 0.7812710 9.100398 
1 1 1   16    9  -56 f   27.071   3.8430   31.962   8.2425   25.568   14.418   35.066   10.046   22.764   7.0486   28.030   4.5529 -5.265270 8.391172 
1 1 1   16    9  -55 o   20.307   4.9656   18.898   8.1501   16.763   14.149   19.958   9.9702   19.320   6.9910   20.623   5.7273 -1.303055 9.037511 
1 1 1   16    9  -54 o   17.761   5.1931   14.393   7.9914   17.223   13.929   13.004   9.7570   19.516   6.9516   17.164   5.8359 2.352402 9.076512 
1 1 1   16    9  -53 o   20.785   4.8260   19.607   8.0190   52.130   14.117   4.1122   9.7438   33.966   5.2692   13.462   5.5323 20.50375 7.640099 
1 1 1   16    9  -52 o   14.287   5.2114   7.9008   7.8839  -6.0214   13.787   14.665   9.6101   12.839   5.8733   18.014   5.7786 -5.175030 8.239384 
1 1 1   16    9  -51 o   41.730   2.5993   72.723   8.7979   72.779   15.178   72.695   10.797   40.697   4.6593   41.458   3.2200 -0.7606049 5.663680 
1 1 1   16    9  -50 o   13.681   5.1527   6.6441   7.8204   7.5008   13.325   6.1940   9.6590   16.103   6.5252   14.249   5.6285 1.854313 8.617311 
1 1 1   16    9  -49 o   20.600   4.8543   19.174   8.0167   20.500   14.203   18.554   9.7115   20.999   7.0413   20.066   5.6815 0.9333096 9.047650 
1 1 1   16    9  -48 o   51.501   2.2465  109.893   9.4082  122.731   15.992  103.099   11.635   53.716   3.6744   49.616   2.8892 4.099838 4.674271 
1 1 1   16    9  -47 o   35.170   2.9791   52.025   8.4604   58.673   14.510   48.601   10.414   36.390   5.0255   33.631   3.8692 2.759010 6.342469 
1 1 1   16    9  -46 o   37.565   2.8125   59.078   8.5496   65.671   14.617   55.650   10.541   38.729   4.7279   36.138   3.6272 2.591148 5.959042 
1 1 1   16    9  -45 o   26.084   4.1074   29.586   8.4448   36.970   14.068   25.426   10.559   28.200   6.2810   23.582   5.5805 4.617941 8.401970 
1 1 1   16    9  -44 o   24.625   4.4039   26.634   8.5154   29.574   14.115   24.952   10.677   25.021   6.7613   23.350   5.6677 1.671513 8.822550 
1 1 1   16    9  -43 o   11.550   5.0281  -0.5260   8.8600   20.572   18.618  -6.7032   10.074   21.746   7.9960   10.703   4.9414 11.04349 9.399675 
1 1 1   16    9  -42 o   9.9515   4.5858  -5.7419   8.6167   33.336   25.034 -10.9936   9.1774   26.169   9.3197   9.2270   4.3994 16.94186 10.30590 
1 1 1   16    9  -41 o   13.481   5.1882   5.7614   8.0369   6.1624   14.490   5.5833   9.6588   16.351   6.7358   14.152   5.6163 2.198630 8.770047 
1 1 1   16    9  -40 o   11.340   5.0175  -1.9568   9.1536  -2.3839   18.199  -1.8122   10.591   15.817   7.0324   12.261   5.4122 3.556392 8.873951 
1 1 1   16    9  -39 o   47.884   2.6900   95.272   10.457   91.374   17.496   97.439   13.044   45.985   4.7351   48.179   3.3421 -2.194427 5.795743 
1 1 1   16    9  -38 o   25.081   4.5130   27.499   8.8875   0.7128   13.566   47.643   11.764   14.523   6.2721   33.211   4.4578 -18.68882 7.694847 
1 1 1   16    9  -37 o   49.922   2.5166  103.218   10.208   99.811   15.715  105.705   13.426   48.501   4.0109   50.239   3.2966 -1.737766 5.191803 
1 1 1   16    9  -36 o   26.009   4.3403   29.340   8.8778   10.431   13.722   42.954   11.643   17.539   6.7715   31.447   4.6847 -13.90864 8.233994 
1 1 1   16    9  -35 o   22.654   4.8303   22.665   8.6473   42.214   13.575   9.3142   11.218   30.804   5.6129   16.320   6.1657 14.48455 8.337878 
1 1 1   16    9  -34 o   22.316   4.9259   22.036   8.7205   12.128   13.741   28.717   11.284   18.183   6.8340   25.313   5.6157 -7.129448 8.845307 
1 1 1   16    9  -33 f   26.165   3.9371   29.324   8.1373   26.510   14.022   30.752   9.9920   24.049   6.8328   26.520   4.7987 -2.471163 8.349544 
1 1 1   16    9  -32 o   23.481   4.4020   23.975   8.1162   11.585   13.840   30.470   10.020   18.064   6.8432   26.398   4.8345 -8.334087 8.378644 
1 1 1   16    9  -31 o   75.152   1.8411  231.635   11.279  232.612   18.548  231.061   14.207   74.848   3.0465   74.884   2.3303 -0.3599548E-01 3.835540 
1 1 1   16    9  -30 o   18.813   5.1567   15.607   8.1420   13.349   15.942   16.404   9.4702   19.312   7.3379   19.292   5.6567 0.2049446E-01 9.265096 
1 1 1   16    9  -29 o   10.832   4.7265  -1.0537   7.8680  -7.4604   15.165   1.3062   9.2037   13.614   6.2018   12.489   5.2725 1.124780 8.140130 
1 1 1   16    9  -28 o   20.938   5.6913   19.484   9.9659   9.1981   16.056   25.930   12.711   18.103   7.2224   23.974   6.3889 -5.871534 9.642717 
1 1 1   16    9  -27 o   24.409   5.2107   26.244   10.052   30.522   15.992   23.449   12.924   25.837   7.2822   22.859   6.5810 2.978273 9.815282 
1 1 1   16    9  -26 o   53.612   2.4979  118.578   10.886  113.187   15.871  123.368   14.960   51.976   3.7717   54.414   3.3897 -2.438019 5.071105 
1 1 1   16    9  -25 o   55.336   2.1657  125.914   9.7502  132.204   16.402  122.477   12.125   56.275   3.5943   54.430   2.7417 1.844971 4.520617 
1 1 1   16    9  -24 o   53.379   2.2265  117.219   9.6667  121.342   16.050  114.873   12.109   53.886   3.6760   52.691   2.8297 1.195221 4.639014 
1 1 1   16    9  -23 o   31.012   3.4292   40.352   8.5242   40.112   14.467   40.480   10.550   30.057   6.1130   30.810   4.3193 -0.7527447 7.484961 
1 1 1   16    9  -22 o   53.697   2.4943  118.857   10.888  125.278   16.175  113.538   14.723   54.789   3.6425   52.201   3.4800 2.587463 5.037650 
1 1 1   16    9  -21 f   19.913   5.0781   17.394   8.2671   4.1570   13.957   24.550   10.261   15.892   6.5847   23.596   5.4453 -7.704512 8.544573 
1 1 1   16    9  -20 o   40.221   2.8145   66.993   9.1692   46.475   15.595   77.833   11.335   32.453   6.1194   43.262   3.2379 -10.80820 6.923266 
1 1 1   16    9  -19 o   41.205   2.7438   70.231   9.1634   79.958   15.962   65.449   11.191   43.440   4.5764   39.586   3.5043 3.853756 5.763971 
1 1 1   16    9  -18 o   34.660   3.5764   50.323   9.9594   11.414   22.437   59.870   11.114   20.922   8.4711   37.815   3.6510 -16.89329 9.224370 
1 1 1   16    9  -17 o   61.759   2.1253  156.588   10.684  156.622   18.249  156.571   13.178   61.331   3.6670   61.638   2.6288 -0.3069382 4.511916 
1 1 1   16    9  -16 o   86.749   1.8230  308.072   12.891  330.837   21.705  295.666   16.023   89.521   2.9785   84.838   2.3192 4.682968 3.774951 
1 1 1   16    9  -15 o  136.844   1.8028  766.476   20.110  755.092   30.090  775.665   27.034  135.456   2.7251  137.432   2.4132 -1.975616 3.640009 
1 1 1   16    9  -14 o   44.769   2.7571   82.790   10.013  123.441   17.004   61.213   12.389   54.386   3.8607   38.155   4.0447 16.23063 5.591476 
1 1 1   16    9  -13 o   59.755   2.5085  146.943   12.191  125.732   17.414  167.333   17.074   54.879   3.9185   63.553   3.3071 -8.674698 5.127506 
1 1 1   16    9  -12 o   17.955   5.4429   13.769   8.6554 -16.0957   14.475   30.391   10.799   11.841   5.6110   26.443   5.1953 -14.60158 7.646847 
1 1 1   16    9  -11 o   41.416   2.8652   70.945   9.6133   75.953   15.926   68.075   12.058   42.359   4.6908   40.366   3.7059 1.992798 5.978042 
1 1 1   16    9  -10 o   22.003   5.0060   21.103   8.7755   11.173   14.477   26.870   11.034   18.411   6.9933   24.744   5.6012 -6.333080 8.959853 
1 1 1   16    9   -9 o   83.193   1.9759  283.427   13.400  287.136   20.511  280.665   17.699   83.420   3.0213   82.595   2.6321 0.8245621 4.007074 
1 1 1   16    9   -8 o   58.660   2.6092  141.671   12.445  163.903   24.604  134.028   14.426   62.352   4.8797   56.929   3.1207 5.422607 5.792291 
1 1 1   16    9   -7 o   10.273   4.8537 -11.6908   10.684 -23.8196   20.838  -7.3652   12.444   14.013   6.6666   12.256   5.5965 1.757239 8.704288 
1 1 1   16    9   -6 o   23.816   5.0287   24.650   9.4558 -20.2198   21.926   34.902   10.480   14.979   7.0389   28.556   4.6632 -13.57686 8.443435 
1 1 1   16    9   -5 o   48.838   2.4178   98.120   9.5953  115.022   16.492   89.470   11.798   52.523   3.8793   46.482   3.1320 6.040447 4.985847 
1 1 1   16    9   -4 o   63.023   2.1570  162.959   11.065  206.635   20.835  145.802   13.058   70.566   3.6343   59.496   2.6996 11.07045 4.527256 
1 1 1   16    9   -3 o   42.271   2.7450   73.773   9.4075   71.164   16.314   75.073   11.515   40.914   4.9951   42.512   3.3499 -1.597435 6.014360 
1 1 1   16    9   -2 o   82.618   2.0243  279.538   13.633  217.482   27.806  299.175   15.642   71.950   4.7680   85.394   2.2491 -13.44403 5.271817 
1 1 1   16    9   -1 o  144.471   1.7731  853.815   20.880  880.838   37.693  841.851   25.080  146.156   3.1638  143.333   2.1466 2.822449 3.823305 
1 1 1   16    9    0 o   76.414   1.9312  239.173   12.020  240.778   20.665  238.352   14.776   76.297   3.3308   76.184   2.3823 0.1137695 4.095022 
1 1 1   16    9    1 o   27.312   4.1175   31.652   8.8823   31.400   16.121   31.762   10.644   26.505   7.2525   27.127   4.9974 -0.6225433 8.807495 
1 1 1   16    9    2 o   38.424   2.7692   61.020   8.6152   54.997   13.297   65.377   11.310   36.010   4.6376   39.610   3.5402 -3.600239 5.834402 
1 1 1   16    9    3 o   36.227   2.9304   54.370   8.5797   51.334   13.471   56.443   11.129   34.691   4.8999   36.725   3.7711 -2.033253 6.183055 
1 1 1   16    9    4 o   89.056   1.7353  324.394   12.597  339.316   20.097  314.737   16.167   90.808   2.7181   87.582   2.2665 3.225975 3.539040 
1 1 1   16    9    5 o   55.010   2.1835  124.225   9.7716  104.155   15.632  137.099   12.519   49.970   3.8677   57.695   2.6692 -7.725357 4.699300 
1 1 1   16    9    6 o   40.435   2.7035   67.510   8.8597   58.053   14.225   73.503   11.324   36.943   4.8399   42.064   3.3298 -5.121487 5.874728 
1 1 1   16    9    7 o   27.208   3.8176   31.261   8.2344   19.509   13.470   38.273   10.405   21.387   6.8395   30.008   4.3829 -8.621075 8.123321 
1 1 1   16    9    8 o   52.193   2.2316  111.894   9.4725  104.697   15.202  116.461   12.111   50.128   3.7476   53.131   2.8063 -3.003395 4.681841 
1 1 1   16    9    9 o   37.190   3.4160   57.630   10.240   49.462   16.289   62.968   13.167   33.603   6.1744   38.667   4.2474 -5.064430 7.494189 
1 1 1   16    9   10 o   57.262   2.4893  134.904   11.592  147.272   18.395  126.759   14.929   59.467   3.8148   55.298   3.3273 4.169331 5.061975 
1 1 1   16    9   11 o   34.482   3.6242   49.761   10.035   52.163   16.355   48.310   12.708   34.572   6.0222   33.655   4.7655 0.9169731 7.679632 
1 1 1   16    9   12 o   63.376   2.3500  165.055   12.119  163.819   19.377  165.849   15.532   62.722   3.8078   63.361   3.0159 -0.6384544 4.857474 
1 1 1   16    9   13 o   67.424   1.9352  186.314   10.625  185.437   17.127  186.863   13.546   66.962   3.1466   67.407   2.4696 -0.4446945 4.000001 
1 1 1   16    9   14 o   40.258   2.7670   67.011   9.0251   77.445   14.847   60.896   11.366   42.883   4.3055   38.150   3.7015 4.733238 5.677899 
1 1 1   16    9   15 o   40.344   2.7242   67.278   8.9064   77.413   14.746   61.458   11.175   42.875   4.2763   38.344   3.6180 4.531395 5.601540 
1 1 1   16    9   16 o   45.366   2.5268   84.849   9.3072   86.140   15.456   84.115   11.658   45.252   4.2394   45.015   3.1979 0.2363892 5.310263 
1 1 1   16    9   17 o   57.636   2.1372  136.413   10.024  144.916   16.117  131.051   12.800   59.088   3.3601   56.340   2.7959 2.747940 4.371209 
1 1 1   16    9   18 o   30.736   3.5473   39.661   8.7247   24.027   14.251   49.033   11.034   23.288   6.9675   34.079   4.0513 -10.79064 8.059733 
1 1 1   16    9   19 o   29.997   3.9698   38.088   9.4691   31.568   18.840   40.292   10.953   26.415   8.0349   30.710   4.5098 -4.294554 9.214019 
1 1 1   16    9   20 o   52.913   3.3488  116.380   14.370   0.0000   0.0000  116.380   14.370  ?   ?    52.913   3.3488 0.000000 3.348787 
1 1 1   16    9   21 f   30.700   3.8722   39.826   9.4749   36.915   14.346   42.077   12.618   28.776   6.2919   31.171   5.1454 -2.395021 8.127875 
1 1 1   16    9   22 o   31.029   3.8078   40.645   9.4297   37.243   14.282   43.275   12.556   28.907   6.2439   31.647   5.0356 -2.740246 8.021419 
1 1 1   16    9   23 o   12.112   5.1577   0.5566   8.9363   3.4238   13.900  -1.4633   11.667   15.636   6.5324   13.142   5.7444 2.493868 8.698918 
1 1 1   16    9   24 o   59.977   2.2763  147.998   11.109  169.861   16.908  131.396   14.735   63.957   3.2539   56.239   3.2277 7.717293 4.583224 
1 1 1   16    9   25 o   24.160   4.8764   25.483   9.2719   32.007   13.973   20.349   12.394   26.653   6.4922   21.472   6.5140 5.180717 9.196789 
1 1 1   16    9   26 o   8.0459   3.8994 -12.7923   7.9227 -25.9197   12.973  -4.9833   10.005   9.5935   4.7208   11.197   5.0759 -1.603549 6.931870 
1 1 1   16    9   27 o   27.096   4.0076   31.321   8.5850   22.741   13.821   36.711   10.954   22.574   6.8852   29.129   4.7790 -6.555443 8.381247 
1 1 1   16    9   28 o   35.069   3.1303   51.344   8.8546   34.979   14.597   60.873   11.138   27.792   6.5509   38.060   3.6342 -10.26801 7.491446 
1 1 1   16    9   29 o   46.761   2.6626   90.505   10.107  103.318   19.378   85.717   11.846   49.114   4.9059   45.341   3.2263 3.772835 5.871752 
1 1 1   16    9   30 o   25.900   4.7538   29.238   9.6666   21.952   21.910   30.999   10.772   23.252   8.6515   26.549   5.1633 -3.296976 10.07514 
1 1 1   16    9   31 o   31.544   4.5719   42.877   11.413   38.167   23.294   44.365   13.093   28.311   8.9873   31.846   5.2245 -3.534792 10.39557 
1 1 1   16    9   32 o   70.021   2.2935  202.037   13.073  203.176   20.942  201.310   16.734   69.613   3.7040   69.645   2.9544 -0.3250122E-01 4.737898 
1 1 1   16    9   33 f   14.238   5.6345   5.5024   9.6954   14.352   15.657  -0.0013   12.347   19.490   7.3012   13.800   5.9719 5.690177 9.432435 
1 1 1   16    9   34 o   41.356   3.1512   71.483   10.543   66.529   16.969   74.599   13.456   38.926   5.5009   41.949   3.9827 -3.023537 6.791352 
1 1 1   16    9   35 o   45.442   2.6841   85.694   9.8981  100.849   18.005   79.130   11.849   48.504   4.6092   43.435   3.3731 5.069084 5.711644 
1 1 1   16    9   36 o   68.881   2.0529  195.269   11.514  200.884   20.874  192.813   13.804   69.109   3.7190   68.292   2.4837 0.8166580 4.472140 
1 1 1   16    9   37 o   16.770   5.4586   11.999   8.5558   16.360   15.870   10.212   10.158   20.114   7.3847   16.314   5.9208 3.800362 9.465142 
1 1 1   16    9   38 o   16.504   5.7122   11.145   9.3590   18.826   15.838   7.0235   11.601   20.950   7.4176   15.562   6.1617 5.387897 9.643030 
1 1 1   16    9   39 o   10.359   4.6796  -3.7087   8.4160  -6.8960   15.696  -2.4227   9.9703   13.838   6.3061   11.734   5.2117 2.104283 8.181021 
1 1 1   16    9   40 o   31.927   3.6822   43.366   9.4075   2.5422   17.316   60.461   11.205   16.529   7.1119   37.758   3.6876 -21.22927 8.011096 
1 1 1   16    9   41 o   41.125   3.1515   70.962   10.484   68.367   26.354   71.450   11.428   37.016   8.8535   41.157   3.4376 -4.140457 9.497489 
1 1 1   16    9   42 o   36.213   3.5513   55.597   10.349   77.592   25.908   51.422   11.288   39.918   8.2355   34.602   4.0805 5.315159 9.190993 
1 1 1   16    9   43 o   38.302   3.6713   62.352   11.323   0.0000   0.0000   62.352   11.323  ?   ?    38.302   3.6713 0.000000 3.671338 
1 1 1   16    9   44 o   52.300   2.7667  114.020   11.753  136.283   20.092  102.439   14.491   56.256   4.4168   49.164   3.6418 7.091366 5.724598 
1 1 1   16    9   45 o   27.123   4.7836   32.591   10.190   4.4862   17.440   47.157   12.556   16.877   7.1966   32.706   4.8567 -15.82958 8.682055 
1 1 1   16    9   46 o   21.900   5.5800   21.994   9.9882   20.655   16.804   22.725   12.420   21.407   7.6344   22.044   6.4820 -0.6372070 10.01500 
1 1 1   16    9   47 o   39.093   3.0445   64.285   9.6255   66.791   18.025   63.285   11.385   38.268   5.9736   38.519   3.6701 -0.2516785 7.010915 
1 1 1   16    9   48 o   14.961   5.5321   8.4708   8.9328   19.807   17.218   4.2954   10.449   21.076   7.6993   13.931   5.7275 7.145295 9.595974 
1 1 1   16    9   49 o   23.763   4.7793   25.308   8.9364   3.7486   15.862   35.334   10.816   16.002   6.8445   28.130   4.8949 -12.12742 8.414699 
1 1 1   16    9   50 o   19.642   5.7234   17.772   9.7215   20.740   16.784   16.274   11.926   21.269   7.6247   19.030   6.4522 2.238079 9.988315 
1 1 1   16    9   51 o   12.445   5.1923   2.5710   8.7644  -7.9919   15.966   7.1270   10.486   13.526   6.2363   14.921   5.8735 -1.394549 8.566769 
1 1 1   16    9   52 o   17.970   5.4100   14.683   8.5719   30.070   14.917   7.0975   10.474   24.824   7.0457   14.888   5.8672 9.935954 9.168759 
1 1 1   16    9   53 o   16.863   5.4321   12.683   8.4860   29.590   14.682   4.2017   10.399   24.602   6.9925   13.797   5.6972 10.80506 9.019584 
1 1 1   16    9   54 o   34.504   3.2616   50.653   9.0648   59.991   15.740   46.019   11.088   36.286   5.4933   32.378   4.3080 3.907440 6.981035 
1 1 1   16    9   55 o   19.073   5.3190   16.815   8.5797   34.480   15.251   8.6359   10.378   26.442   6.9759   15.372   5.9007 11.07054 9.136825 
1 1 1   16    9   56 f   45.774   2.5867   87.700   9.6122   95.370   16.490   83.752   11.830   46.626   4.3902   44.368   3.2945 2.257797 5.488839 
1 1 1   16    9   57 o   50.756   2.4282  107.527   10.017  106.422   16.718  108.147   12.512   49.367   4.1940   50.562   3.0499 -1.194954 5.185721 
1 1 1   16    9   58 o   39.110   2.9974   64.853   9.4831   77.885   16.031   57.838   11.762   41.683   4.8061   36.357   4.0365 5.325630 6.276326 
1 1 1   16    9   59 o   13.087   5.2869   4.7843   8.7174   5.8707   14.902   4.2191   10.748   15.816   6.6946   13.780   5.7497 2.036283 8.824797 
1 1 1   16    9   60 o   11.763   5.2254  -1.2506   10.027  -8.9450   18.048   2.1847   12.059   13.922   6.4911   13.697   5.9146 0.2241516 8.781621 
1 1 1   16    9   61 o   14.620   5.6883   7.8353   9.7400   20.709   18.668   3.0198   11.417   20.591   7.9116   13.615   5.8147 6.976610 9.818587 
1 1 1   16    9   62 o   20.398   5.7528   20.201   9.9770   12.976   18.403   23.209   11.873   18.315   7.5725   21.563   6.3368 -3.247547 9.874144 
1 1 1   16    9   63 o   19.119   5.8841   17.851   10.066   17.244   18.554   18.104   11.982   19.338   7.7476   19.153   6.4676 0.1852169 10.09230 
1 1 1   16    9   64 o   12.259   5.2695   1.8950   9.4881   1.3138   18.159   2.1132   11.128   15.455   6.9369   13.083   5.6655 2.371976 8.956518 
1 1 1   16    9   65 o   38.651   4.2529   67.217   13.178   67.327   19.576   67.127   17.821   36.129   6.8985   36.870   6.1460 -0.7408829 9.239202 
1 1 1   16    9   66 o   18.638   6.4348   17.468   11.874   25.923   18.282   11.299   15.615   21.503   7.9207   16.927   6.9847 4.575422 10.56052 
1 1 1   16    9   67 o   11.649   5.0911   0.7897   9.1599 -16.9006   16.656   8.4600   10.967   11.869   5.7283   14.902   5.9613 -3.033177 8.267454 
1 1 1   16    9   68 o   26.277   4.6537   32.314   9.6033   29.569   17.329   33.531   11.537   22.562   7.7744   26.049   5.6000 -3.486967 9.581260 
1 1 1   16    9   69 o   27.960   4.3396   36.088   9.5702   34.112   17.333   36.954   11.478   24.016   7.7658   27.540   5.3055 -3.523746 9.405097 
1 1 1   16    9   70 o   36.868   3.4436   60.029   10.229   55.482   18.207   62.126   12.365   31.602   7.2255   36.851   4.1906 -5.249254 8.352800 
1 1 1   16    9   71 o   12.827   5.3471   4.7894   9.2828   6.0482   17.082   4.2619   11.058   15.467   6.8484   13.306   5.7035 2.161308 8.912374 
1 1 1   16    9   72 o   8.6119   4.1761 -12.0202   9.1212 -18.9386   16.889  -9.1712   10.838   11.455   5.5836   10.080   4.7991 1.374275 7.362586 
1 1 1   16    9   73 o   21.253   5.8943   23.842   10.568   20.523   17.866   25.628   13.107   18.900   7.5921   21.275   6.7399 -2.375727 10.15216 
1 1 1   16    9   74 o   24.464   6.5544   33.193   13.333   55.068   17.955   6.3003   19.908   30.952   7.2452   15.871   7.1809 15.08030 10.20092 
1 1 1   16    9   75 o   12.784   5.9142  -2.7589   14.538 -47.3437   23.964   23.202   18.287   11.435   5.7490   19.486   7.7294 -8.050517 9.632997 
1 1 1   16    9   76 o   24.702   7.3394   36.786   15.856   57.453   26.247   24.910   19.897   26.983   9.5494   19.769   7.9869 7.213743 12.44919 
1 1 1   16    9   77 o   12.852   5.9653  -2.8097   14.976 -35.7264   23.676   19.143   19.335   12.039   6.0021   18.244   7.6687 -6.204743 9.738322 
1 1 1   16    9   78 o   20.103   7.2887   24.942   15.390   42.742   25.873   15.196   19.145   22.935   9.1623   17.242   7.4488 5.693247 11.80810 
1 1 1   16    9   79 o   20.908   7.4085   27.685   15.801   46.050   26.195   17.180   19.811   23.473   9.2700   17.631   7.5969 5.841726 11.98525 
1 1 1   16    9   80 o   11.863   5.4268  -1.3764   11.768  -4.9883   14.607   5.3049   19.866   12.253   5.7540   15.347   7.0318 -3.093404 9.085936 
1 1 1   16    9   81 o   10.584   5.0241  -7.7272   11.704 -13.5900   14.684   2.4865   19.382   10.995   5.3239   14.743   6.8235 -3.748183 8.654727 
1 1 1   16    9   82 o   14.788   6.1485   9.5439   12.228   11.139   15.266   6.6872   20.426   15.688   6.7125   15.558   7.1292 0.1297455 9.791958 
1 1 1   16    9   83 o   9.1310   4.4749 -15.8505   11.285 -18.9689   13.866  -9.7329   19.422   9.9643   4.8988   12.979   6.2441 -3.014544 7.936433 
1 1 1   16    9   84 o   10.139   4.8464  -8.8819   11.289 -24.0719   13.814   21.661   19.588   9.3942   4.6671   18.306   7.7080 -8.911510 9.010824 
1 1 1   16    9   85 o   13.170   5.7439   4.7784   11.609   6.9367   14.386   0.7479   19.659   14.388   6.3312   14.353   6.7192 0.3475571E-01 9.232095 
1 1 1   16    9   86 o   14.788   6.0751   10.273   11.745   11.988   14.565   7.0869   19.858   15.627   6.6168   15.309   7.0204 0.3184519 9.647177 
1 1 1   16    9   87 o   11.450   5.2803  -1.9258   11.456  -1.9959   14.392  -1.8047   18.927   12.480   5.8115   13.725   6.4775 -1.245273 8.702394 
1 1 1   16    9   88 o   13.979   5.9330   7.8647   11.758  -4.4523   14.530   31.236   20.015   12.084   5.6945   20.338   8.0803 -8.253718 9.885237 
1 1 1   16    9   89 o   13.992   6.3085   4.8961   15.208   4.8961   15.208   0.0000   0.0000   13.992   6.3085  ?   ?  0.000000 6.308479 
1 1 1   16    9   90 o   13.246   6.0935   1.0904   15.122   1.0904   15.122   0.0000   0.0000   13.246   6.0935  ?   ?  0.000000 6.093485 
1 1 1   16   10  -85 o   18.790   8.0830   26.442   22.358   26.442   22.358   0.0000   0.0000   18.790   8.0830  ?   ?  0.000000 8.083012 
1 1 1   16   10  -84 o   17.180   7.5928   18.186   20.906   18.186   20.906   0.0000   0.0000   17.180   7.5928  ?   ?  0.000000 7.592799 
1 1 1   16   10  -83 o   15.465   7.0739   9.0040   19.991   9.0040   19.991   0.0000   0.0000   15.465   7.0739  ?   ?  0.000000 7.073867 
1 1 1   16   10  -82 o   12.040   5.9528 -22.9088   21.478 -22.9088   21.478   0.0000   0.0000   12.040   5.9528  ?   ?  0.000000 5.952783 
1 1 1   16   10  -81 f   15.458   7.0770   8.2781   20.068   8.2781   20.068   0.0000   0.0000   15.458   7.0770  ?   ?  0.000000 7.076974 
1 1 1   16   10  -80 o   12.853   6.1886  -9.2653   19.170  -9.2653   19.170   0.0000   0.0000   12.853   6.1886  ?   ?  0.000000 6.188578 
1 1 1   16   10  -79 o   14.407   6.4065   6.4950   15.109   10.958   19.842   0.3365   23.307   16.011   7.2133   14.934   7.0891 1.076559 10.11375 
1 1 1   16   10  -78 o   12.065   5.7586  -8.0246   15.814  -8.2147   20.849  -7.7670   24.266   13.461   6.4744   14.244   6.8841 -0.7824593 9.450335 
1 1 1   16   10  -77 o   16.029   6.8912   12.402   16.232   5.4840   21.721   21.152   24.427   15.477   7.1840   18.180   8.1110 -2.702941 10.83502 
1 1 1   16   10  -76 o   16.421   6.9345   13.877   15.927   37.808   21.518 -15.1228   23.687   22.283   8.5110   13.500   6.5875 8.783154 10.76253 
1 1 1   16   10  -75 o   13.261   6.1162  -0.3105   15.375   0.3524   20.119  -1.2410   23.836   14.542   6.8043   15.046   7.1501 -0.5041800 9.870288 
1 1 1   16   10  -74 o   18.042   7.0998   19.283   15.317   13.451   19.813   27.945   24.147   16.756   7.3993   19.679   8.4316 -2.922758 11.21797 
1 1 1   16   10  -73 o   19.978   7.3276   25.083   15.620   17.507   20.497   35.576   24.122   17.682   7.6729   21.408   8.7404 -3.726870 11.63047 
1 1 1   16   10  -72 o   17.961   7.0817   18.615   15.266   21.828   20.012   14.143   23.609   18.725   7.8317   17.349   7.8376 1.376251 11.07985 
1 1 1   16   10  -71 o   12.914   5.8397   0.8052   13.145   21.811   16.181 -39.9676   22.543   18.993   7.3477   11.396   5.7076 7.597290 9.304061 
1 1 1   16   10  -70 o   13.078   5.8715   1.5652   13.019  -0.4065   15.752   5.8158   23.127   13.546   6.2268   16.176   7.4749 -2.629824 9.728727 
1 1 1   16   10  -69 o   26.448   6.4039   38.285   13.657   30.193   16.608   55.188   24.002   21.902   7.6078   27.344   9.1532 -5.441542 11.90211 
1 1 1   16   10  -68 o   19.079   7.5153   21.656   17.177   24.332   25.652   19.481   23.127   19.538   8.5295   18.592   8.1079 0.9461021 11.76823 
1 1 1   16   10  -67 o   20.723   5.9879   22.962   10.681   18.172   17.664   25.723   13.411   18.181   7.4577   21.162   6.8298 -2.981247 10.11252 
1 1 1   16   10  -66 o   34.744   3.8769   54.911   10.793   33.284   18.620   65.854   13.245   22.710   8.0427   37.522   4.4148 -14.81221 9.174735 
1 1 1   16   10  -65 o   30.915   4.2632   44.338   10.458   25.951   17.959   53.772   12.864   20.611   7.7981   33.518   4.8488 -12.90686 9.182639 
1 1 1   16   10  -64 o   13.424   5.2552   7.1115   8.3548   6.3982   12.122   7.7571   11.532   14.293   6.0433   14.549   6.0028 -0.2565241 8.517941 
1 1 1   16   10  -63 o   33.159   3.3542   48.416   8.9417   47.855   12.798   48.951   12.498   31.465   5.1690   32.034   4.9454 -0.5692425 7.153683 
1 1 1   16   10  -62 o   12.654   5.5068   2.1617   10.620   17.026   13.320 -23.7796   17.596   18.218   6.7518   11.376   5.5778 6.841719 8.757757 
1 1 1   16   10  -61 o   15.876   5.8438   11.627   9.9484   15.595   12.126   3.4577   17.401   17.711   6.4626   15.328   6.8416 2.383623 9.411329 
1 1 1   16   10  -60 o   16.344   5.4730   12.767   8.5811   12.723   12.393   12.808   11.893   16.718   6.4404   16.679   6.3378 0.3938484E-01 9.035804 
1 1 1   16   10  -59 o   36.177   3.4320   57.207   10.000   47.870   16.748   62.380   12.466   30.085   6.9669   37.202   4.1831 -7.117632 8.126240 
1 1 1   16   10  -58 o   8.2234   4.0586 -18.7315   9.8293   0.0586   15.692 -30.8647   12.610   14.299   6.4310   8.5168   4.2661 5.782691 7.717308 
1 1 1   16   10  -57 o   11.915   5.2653  -0.1687   10.049  -5.0082   16.002   2.9825   12.913   13.508   6.2336   14.021   6.0871 -0.5122213 8.712642 
1 1 1   16   10  -56 o   21.197   5.9587   22.280   10.722   17.149   17.614   25.301   13.514   19.139   7.5879   22.080   6.8219 -2.940851 10.20368 
1 1 1   16   10  -55 o   14.179   5.7568   6.2707   10.395   31.818   17.617  -7.3762   12.876   24.110   7.8316   11.797   5.4945 12.31289 9.566818 
1 1 1   16   10  -54 o   31.435   4.4868   44.569   11.171   49.867   18.352   41.450   14.080   30.895   7.3873   29.142   6.1222 1.753796 9.594435 
1 1 1   16   10  -53 o   20.623   5.9605   20.696   10.583   22.899   17.428   19.409   13.319   21.224   7.7473   19.879   6.8171 1.344660 10.31955 
1 1 1   16   10  -52 o   13.695   5.3756   6.3268   8.7618   9.8284   13.816   3.9709   11.332   16.567   6.6687   13.906   5.8595 2.661060 8.877283 
1 1 1   16   10  -51 o   10.615   4.6640  -0.6702   7.7809  -2.1545   13.805   0.0208   9.4196   13.439   6.0389   11.811   5.1621 1.627913 7.944534 
1 1 1   16   10  -50 o   21.159   4.8751   20.618   8.2352   17.824   14.376   21.983   10.047   19.527   7.0494   21.514   5.6556 -1.986801 9.037711 
1 1 1   16   10  -49 f   27.464   3.8428   32.966   8.3678   43.309   15.336   28.581   9.9852   29.897   6.4800   24.934   5.0854 4.963697 8.237223 
1 1 1   16   10  -48 o   28.921   4.0285   36.669   9.2396   10.249   19.158   44.678   10.547   18.295   7.6581   31.899   4.1550 -13.60379 8.712633 
1 1 1   16   10  -47 o   22.697   4.8875   23.501   8.7750   25.315   19.967   23.066   9.7689   22.619   8.2868   22.242   5.4351 0.3770885 9.910111 
1 1 1   16   10  -46 o   28.789   4.0085   36.222   9.1521   29.678   19.653   38.034   10.342   24.089   8.2803   29.281   4.4748 -5.191734 9.412056 
1 1 1   16   10  -45 o   45.484   2.5138   86.366   9.2838   82.617   15.925   88.295   11.426   43.323   4.5786   45.720   3.0840 -2.397133 5.520389 
1 1 1   16   10  -44 o   48.127   2.5771   96.730   10.073  105.413   20.164   93.842   11.628   48.555   5.1743   47.181   3.0398 1.373917 6.001082 
1 1 1   16   10  -43 o   39.689   2.8450   66.189   9.1433   67.002   16.021   65.796   11.135   38.625   5.2220   39.264   3.5162 -0.6388664 6.295453 
1 1 1   16   10  -42 o   35.470   3.0834   53.181   8.8264   42.863   15.299   58.329   10.806   30.083   6.4336   36.906   3.6393 -6.823202 7.391548 
1 1 1   16   10  -41 o   12.505   5.0564   3.8288   7.9822  -6.1915   14.094   8.5609   9.6853   12.970   5.9353   15.205   5.7325 -2.234559 8.251601 
1 1 1   16   10  -40 o   29.001   3.6519   36.164   8.4419   33.635   14.566   37.442   10.359   26.461   6.7366   29.139   4.5066 -2.677671 8.105010 
1 1 1   16   10  -39 o   20.922   5.1447   19.960   8.7118   25.325   14.345   16.826   10.965   22.966   7.0164   19.203   6.1738 3.763561 9.345856 
1 1 1   16   10  -38 o   11.823   5.0207   1.2921   8.4273   8.7867   14.032  -2.9359   10.540   16.772   6.7315   11.824   5.2978 4.948618 8.566190 
1 1 1   16   10  -37 o   37.891   3.1262   60.549   9.5700   57.278   14.987   62.802   12.436   35.766   5.3006   38.167   4.0592 -2.400719 6.676312 
1 1 1   16   10  -36 o   53.051   2.2934  116.630   9.8942  121.023   16.543  114.184   12.346   53.268   3.8355   52.229   2.9114 1.039574 4.815279 
1 1 1   16   10  -35 o   12.767   5.1143   4.2046   8.0841  -5.0008   13.632   9.1974   10.040   13.063   5.9231   15.674   5.8517 -2.610798 8.326203 
1 1 1   16   10  -34 o   40.611   3.2074   69.495   10.532   63.523   15.313   74.856   14.507   37.901   5.0847   41.609   4.3410 -3.708324 6.685667 
1 1 1   16   10  -33 o   46.895   3.1347   92.360   11.914  101.665   15.461   78.758   18.693   48.814   3.9184   41.956   5.6059 6.857967 6.839645 
1 1 1   16   10  -32 o   18.916   5.7009   16.133   9.5150   25.723   14.144   8.2064   12.860   23.357   6.9300   16.313   6.4784 7.043474 9.486552 
1 1 1   16   10  -31 o   33.933   3.3009   48.655   9.0152   46.429   16.192   49.655   10.853   31.636   6.4965   34.013   3.9902 -2.376417 7.624037 
1 1 1   16   10  -30 o   41.194   2.8443   70.884   9.4924   75.256   17.155   68.955   11.396   41.326   5.2080   40.378   3.4967 0.9476013 6.273000 
1 1 1   16   10  -29 o   45.627   2.6438   86.581   9.7911   66.700   17.471   95.685   11.822   38.614   5.7234   47.819   3.0488 -9.204750 6.484821 
1 1 1   16   10  -28 o   60.933   2.1973  153.276   10.896  173.535   19.957  144.672   13.006   64.019   3.8419   58.999   2.7115 5.020565 4.702441 
1 1 1   16   10  -27 o   65.599   2.2685  177.720   12.112  189.495   20.286  171.197   15.099   67.002   3.7289   64.117   2.8963 2.884529 4.721614 
1 1 1   16   10  -26 o   23.939   4.4622   25.116   8.3871   17.714   13.996   29.263   10.476   20.197   6.9857   25.608   5.1967 -5.410212 8.706692 
1 1 1   16   10  -25 o   11.351   4.8448   0.5729   7.9171   1.8352   13.633  -0.0695   9.7250   14.830   6.3444   12.262   5.3033 2.567918 8.268975 
1 1 1   16   10  -24 o   28.024   3.7042   33.504   8.2549   10.988   13.905   45.759   10.258   17.737   6.8247   32.739   3.9218 -15.00222 7.871263 
1 1 1   16   10  -23 o   28.087   4.0531   33.919   9.0115   57.673   17.393   25.203   10.536   35.742   6.1943   23.640   5.5611 12.10227 8.324378 
1 1 1   16   10  -22 o   21.130   5.1064   19.942   8.6966   17.856   16.637   20.726   10.201   20.767   7.5711   21.415   5.7311 -0.6481609 9.495667 
1 1 1   16   10  -21 o   17.664   5.4736   13.636   8.6926   21.816   16.905   10.695   10.135   22.203   7.6776   16.523   5.9248 5.680080 9.697845 
1 1 1   16   10  -20 o   24.637   4.4210   26.446   8.5523   22.338   14.732   28.534   10.503   22.220   7.1573   25.317   5.2615 -3.097069 8.883116 
1 1 1   16   10  -19 o   57.636   2.5091  137.418   11.760  158.895   17.961  121.300   15.559   61.518   3.5974   53.736   3.5724 7.782791 5.069804 
1 1 1   16   10  -18 o   23.892   4.5621   24.973   8.5611   13.397   14.841   30.745   10.481   18.908   7.1031   26.397   5.0547 -7.489759 8.718008 
1 1 1   16   10  -17 o   30.476   3.5981   39.337   8.7662   52.059   15.318   33.142   10.690   34.267   5.6828   27.477   4.9549 6.790037 7.539599 
1 1 1   16   10  -16 o   64.859   2.0485  173.066   10.817  159.928   18.237  180.196   13.435   61.727   3.6406   66.034   2.5005 -4.306278 4.416569 
1 1 1   16   10  -15 o   49.208   2.6724  100.367   10.679  127.261   23.982   93.716   11.927   54.043   5.5213   47.406   3.1035 6.636650 6.333789 
1 1 1   16   10  -14 o   37.026   3.2893   57.471   9.8244   60.498   22.110   56.727   10.967   35.924   7.7762   36.642   3.7233 -0.7175026 8.621635 
1 1 1   16   10  -13 o   39.965   3.0930   66.669   9.9979   81.205   22.862   63.232   11.117   42.366   6.8541   38.768   3.5576 3.598415 7.722383 
1 1 1   16   10  -12 o   51.232   2.6203  108.649   10.907  101.187   24.390  110.514   12.194   47.651   6.4443   51.579   2.9120 -3.927528 7.071678 
1 1 1   16   10  -11 o   38.370   2.9756   61.354   9.2342   60.446   16.024   61.806   11.299   37.156   5.4526   38.298   3.6640 -1.141300 6.569273 
1 1 1   16   10  -10 o   17.311   5.6269   12.713   9.0931   16.241   14.915   10.626   11.472   20.023   7.1864   16.983   6.2710 3.039976 9.537827 
1 1 1   16   10   -9 o   61.599   2.1307  156.137   10.682  180.615   18.470  143.834   13.095   65.758   3.4580   58.937   2.7331 6.820599 4.407651 
1 1 1   16   10   -8 o   10.325   4.6558  -3.6792   8.2855  -5.2060   14.406  -2.9245   10.128   13.656   6.1500   11.769   5.2387 1.886830 8.078745 
1 1 1   16   10   -7 o   32.364   3.4617   44.086   8.9908   44.488   15.625   43.888   10.993   31.444   6.3154   32.014   4.3230 -0.5699329 7.653288 
1 1 1   16   10   -6 o   50.079   2.4363  103.555   9.9157   99.018   16.738  106.008   12.308   48.314   4.2948   50.502   3.0033 -2.187653 5.240702 
1 1 1   16   10   -5 o   51.761   2.3958  110.558   10.081  107.632   17.239  112.079   12.427   50.417   4.2336   51.953   2.9466 -1.536217 5.158075 
1 1 1   16   10   -4 o   49.116   2.5811   99.765   10.298   89.287   18.662  104.352   12.347   45.497   5.1209   50.097   3.0379 -4.599876 5.954164 
1 1 1   16   10   -3 o   13.310   5.2928   4.4547   8.5951   6.6983   14.839   3.3218   10.544   16.879   6.8687   13.905   5.7388 2.973657 8.950588 
1 1 1   16   10   -2 o   14.883   5.5909   7.5075   9.1945   20.574   14.765  -0.7691   11.751   21.694   7.1768   13.314   5.7933 8.379502 9.223285 
1 1 1   16   10   -1 o   33.170   3.8012   46.548   10.093   37.311   15.732   53.009   13.157   28.566   6.8459   35.099   4.7179 -6.532896 8.314120 
1 1 1   16   10    0 o   34.643   4.1484   51.057   11.482   59.863   17.661   44.611   15.111   36.724   6.1147   31.611   6.0852 5.113174 8.626640 
1 1 1   16   10    1 o   12.120   5.2201  -0.0646   9.3461   6.9820   16.371  -3.4715   11.383   17.542   7.1858   12.402   5.5349 5.140324 9.070350 
1 1 1   16   10    2 o   46.318   2.8962   89.079   10.880   94.632   18.849   86.304   13.324   46.917   5.0059   45.349   3.6349 1.567768 6.186368 
1 1 1   16   10    3 o   18.420   6.2526   14.120   11.200 -10.6876   16.413   35.734   15.320   13.637   6.3001   27.963   6.7900 -14.32600 9.262599 
1 1 1   16   10    4 o   24.840   5.7675   27.613   11.453   36.173   17.309   20.946   15.276   27.917   7.4627   21.893   7.3016 6.023966 10.44057 
1 1 1   16   10    5 o   14.111   5.8415   3.3006   10.970   13.425   16.329  -5.0269   14.810   19.437   7.4166   13.909   6.2522 5.528062 9.700335 
1 1 1   16   10    6 o   36.711   3.4743   56.598   10.273   38.182   16.957   67.276   12.912   28.736   7.2425   39.859   4.0294 -11.12275 8.287989 
1 1 1   16   10    7 o   40.348   2.9537   67.752   9.6474  100.320   18.287   55.193   11.356   48.449   4.6889   36.101   3.9220 12.34800 6.112950 
1 1 1   16   10    8 o   51.703   2.5084  110.466   10.540  107.901   18.967  111.612   12.678   50.256   4.6838   51.815   3.0147 -1.558609 5.570131 
1 1 1   16   10    9 o   21.758   5.5598   21.150   9.8962   27.275   16.973   17.996   12.181   24.421   7.6611   20.279   6.5058 4.141876 10.05075 
1 1 1   16   10   10 o   62.204   2.2338  159.378   11.308  170.503   16.580  149.702   15.463   63.998   3.1882   59.963   3.1748 4.034901 4.499339 
1 1 1   16   10   11 o   14.294   5.4798   6.4467   8.9421  -3.2273   13.340   14.340   12.050   13.528   6.0175   18.660   6.4804 -5.131505 8.843378 
1 1 1   16   10   12 o   61.147   2.2593  154.073   11.242  144.176   16.450  162.747   15.399   58.719   3.4519   62.577   3.0278 -3.858311 4.591660 
1 1 1   16   10   13 o   47.104   2.4697   91.735   9.4498   83.357   14.991   97.260   12.173   44.299   4.2016   48.308   3.1078 -4.009262 5.226053 
1 1 1   16   10   14 o   52.334   2.2954  112.984   9.7685  130.360   15.784  102.196   12.437   55.795   3.4878   49.522   3.0963 6.273418 4.663883 
1 1 1   16   10   15 o   13.164   5.2607   4.2594   8.5329   12.773   15.110   0.2731   10.339   18.805   7.1440   12.780   5.4972 6.024748 9.014211 
1 1 1   16   10   16 o   48.213   2.5457   96.228   9.9693   89.533   18.178   99.108   11.922   45.521   4.9800   48.782   3.0129 -3.260696 5.820498 
1 1 1   16   10   17 o   26.873   4.1869   31.117   8.8729   51.274   16.130   22.371   10.625   33.817   6.0746   22.272   5.7971 11.54553 8.396857 
1 1 1   16   10   18 o   28.400   3.9335   34.493   8.8621   28.866   15.841   37.057   10.692   24.917   7.3185   29.200   4.6476 -4.282248 8.669538 
1 1 1   16   10   19 o   59.532   2.2790  146.214   11.039  165.689   21.110  138.884   12.951   62.516   4.1662   57.857   2.7539 4.658890 4.994112 
1 1 1   16   10   20 o   46.551   2.5043   89.742   9.4680   79.617   15.389   95.909   12.010   43.107   4.4431   47.934   3.0902 -4.826981 5.412117 
1 1 1   16   10   21 o   51.233   2.5735  108.765   10.713  112.699   15.620  105.270   14.721   51.693   3.7320   49.994   3.6371 1.698677 5.211225 
1 1 1   16   10   22 o   20.791   5.3825   19.409   9.1927   12.666   17.482   21.986   10.807   19.322   7.5906   22.012   5.9024 -2.690876 9.615414 
1 1 1   16   10   23 o   22.448   5.2073   22.551   9.3434   20.748   18.243   23.192   10.878   21.979   7.9403   22.595   5.8580 -0.6168537 9.867373 
1 1 1   16   10   24 o   36.556   3.3234   56.234   9.7950   56.807   18.794   56.020   11.477   35.104   6.8135   36.256   3.9471 -1.151627 7.874187 
1 1 1   16   10   25 o   57.673   2.3901  137.558   11.212  128.422   16.478  145.435   15.300   55.174   3.6850   58.973   3.1947 -3.799099 4.877059 
1 1 1   16   10   26 o  130.325   1.8075  697.495   19.202  686.447   27.592  707.871   26.740  128.749   2.6291  130.836   2.5073 -2.087250 3.632958 
1 1 1   16   10   27 o   42.418   2.7235   74.908   9.3672   91.890   15.347   64.825   11.825   46.412   4.0986   39.073   3.7592 7.339287 5.561470 
1 1 1   16   10   28 o   56.976   2.2227  134.078   10.303  126.167   16.427  139.209   13.228   54.625   3.7112   57.829   2.8147 -3.203606 4.657853 
1 1 1   16   10   29 o   60.530   2.1465  151.205   10.574  137.376   16.726  160.410   13.647   57.043   3.6158   62.125   2.7014 -5.081566 4.513476 
1 1 1   16   10   30 o   40.650   2.8252   69.010   9.3031   70.547   14.995   68.048   11.862   40.300   4.6496   40.035   3.6759 0.2655182 5.927191 
1 1 1   16   10   31 o   25.404   4.6903   28.524   9.3552   67.378   18.337   14.852   10.877   38.567   6.0300   18.432   6.1617 20.13452 8.621356 
1 1 1   16   10   32 o   64.485   2.1967  171.813   11.530  182.404   21.437  167.503   13.677   65.405   4.0406   63.474   2.6491 1.930847 4.831583 
1 1 1   16   10   33 o   50.047   2.7327  104.413   11.106   92.604   25.037  107.305   12.392   44.378   7.1651   50.615   3.0171 -6.236790 7.774409 
1 1 1   16   10   34 o   29.946   4.2335   38.965   10.046   46.727   23.644   37.255   11.098   30.114   8.9663   28.991   4.8684 1.122414 10.20271 
1 1 1   16   10   35 o   45.059   2.7399   84.769   10.016   98.868   18.316   78.755   11.963   47.562   4.7894   43.134   3.4306 4.428589 5.891303 
1 1 1   16   10   36 o   20.119   5.8545   18.608   10.178   18.796   16.137   18.484   13.116   20.634   7.4661   20.167   6.7665 0.4671288 10.07613 
1 1 1   16   10   37 o   23.232   5.4694   24.737   10.185   32.463   16.423   19.910   12.983   25.774   7.4180   20.732   6.7223 5.041761 10.01077 
1 1 1   16   10   38 o   23.275   6.0740   25.359   11.644   24.911   16.767   25.776   16.184   22.804   7.6504   23.125   7.5059 -0.3210621 10.71763 
1 1 1   16   10   39 o   10.242   4.8492 -10.8667   10.769   1.2740   15.788 -21.4292   14.726   15.368   6.7006   10.905   5.2921 4.463445 8.538444 
1 1 1   16   10   40 o   29.335   4.3969   37.810   10.191   49.106   16.833   31.275   12.804   32.178   6.6378   25.782   6.1740 6.396063 9.065207 
1 1 1   16   10   41 o   62.107   2.4585  160.412   12.422  169.979   20.198  154.593   15.753   62.955   3.9559   60.549   3.2031 2.405502 5.090089 
1 1 1   16   10   42 o   36.002   3.3380   55.108   9.6845   55.433   17.936   54.974   11.506   34.144   6.6838   35.627   4.0327 -1.483643 7.806165 
1 1 1   16   10   43 o   33.908   3.5731   49.257   9.7276   53.227   17.242   47.403   11.782   33.502   6.5486   32.789   4.5288 0.7129745 7.962063 
1 1 1   16   10   44 o   11.967   5.1224   1.0670   8.8959   5.7595   16.635  -0.8124   10.528   16.649   7.0613   12.318   5.4184 4.330689 8.900606 
1 1 1   16   10   45 o   31.163   3.9284   42.186   9.7578   25.058   17.678   49.691   11.702   22.601   7.8493   33.621   4.3734 -11.01989 8.985393 
1 1 1   16   10   46 o   13.191   5.4990   3.3553   9.8187  -8.2051   23.887   5.7056   10.771   16.376   7.5777   14.423   5.8584 1.952667 9.578206 
1 1 1   16   10   47 o   18.298   5.9015   15.426   10.014   13.539   16.960   16.436   12.408   18.707   7.4363   18.944   6.5761 -0.2368774 9.926906 
1 1 1   16   10   48 o   9.4860   4.4336  -6.8542   8.5014   1.6737   14.415 -11.4023   10.527   14.698   6.4056   9.9154   4.7232 4.782219 7.958611 
1 1 1   16   10   49 f   16.932   5.5171   13.003   8.7390   26.898   14.619   5.2757   10.901   23.191   7.0825   14.255   5.8542 8.936185 9.188735 
1 1 1   16   10   50 o   25.472   4.5094   29.197   9.0203   33.368   15.186   26.924   11.213   25.718   7.0398   23.741   5.8358 1.976357 9.144193 
1 1 1   16   10   51 o   17.728   5.4849   14.644   8.7326   6.4371   14.423   19.394   10.972   15.803   6.6317   20.054   6.1382 -4.251133 9.036380 
1 1 1   16   10   52 o   47.766   2.7793   96.314   10.775  126.220   16.961   76.079   13.952   53.842   3.8908   41.540   4.1770 12.30241 5.708388 
1 1 1   16   10   53 o   17.180   5.7812   13.664   9.5739   14.801   14.993   12.881   12.440   18.345   7.0793   17.243   6.4978 1.101257 9.609240 
1 1 1   16   10   54 o   12.785   5.4800   2.1815   10.207  -2.2051   18.594   4.0732   12.211   15.132   6.8832   14.207   6.0386 0.9253473 9.156596 
1 1 1   16   10   55 o   25.429   5.2639   30.562   10.552   28.162   19.170   31.605   12.638   22.677   8.1462   25.228   6.1924 -2.551596 10.23261 
1 1 1   16   10   56 o   11.784   5.2320  -0.7517   10.039   13.771   18.387  -6.9191   11.982   18.332   7.5734   11.394   5.3047 6.938206 9.246399 
1 1 1   16   10   57 o   26.214   5.0821   32.416   10.467   71.535   19.048   15.492   12.529   37.887   6.3950   17.980   6.5678 19.90765 9.166856 
1 1 1   16   10   58 o   13.430   5.6038   4.6968   10.209  -2.7691   17.869   8.3146   12.439   14.509   6.6559   15.348   6.2726 -0.8383713 9.145828 
1 1 1   16   10   59 o   18.455   5.9347   16.953   10.132   10.894   17.660   19.927   12.371   17.196   7.2837   19.648   6.5711 -2.451229 9.809817 
1 1 1   16   10   60 o   17.078   5.9111   14.172   10.022   11.717   17.378   15.396   12.268   17.260   7.2636   17.712   6.4944 -0.4520149 9.743557 
1 1 1   16   10   61 o   18.423   5.9094   17.115   10.050   14.591   17.003   18.471   12.460   17.856   7.3197   18.876   6.5877 -1.020205 9.847600 
1 1 1   16   10   62 o   10.611   4.8515  -3.2421   9.3887 -12.2589   16.575   1.0181   11.393   12.344   5.8930   12.670   5.6023 -0.3262510 8.130987 
1 1 1   16   10   63 o   27.960   4.5430   36.618   9.9992   11.366   17.056   49.842   12.343   16.801   7.1388   32.449   4.8119 -15.64858 8.609145 
1 1 1   16   10   64 o   16.256   5.8374   12.972   9.8424  -8.8087   16.956   24.041   12.087   12.841   6.0813   21.054   6.4421 -8.212951 8.859074 
1 1 1   16   10   65 o   12.447   5.3271   3.3627   9.6186  -9.7005   17.059   9.4512   11.646   12.685   6.0339   15.064   6.1018 -2.379528 8.581333 
1 1 1   16   10   66 o   13.819   5.5583   7.4615   9.5891   24.835   16.874  -0.8247   11.654   20.259   7.5816   12.129   5.4902 8.129960 9.360756 
1 1 1   16   10   67 o   15.453   6.3118   10.425   12.586   15.732   16.300   2.5922   19.805   17.453   7.1621   15.224   6.9924 2.229144 10.00945 
1 1 1   16   10   68 o   15.837   6.8956   9.3603   16.671  -8.8541   26.109   21.897   21.661   15.025   7.2312   19.057   8.0690 -4.032112 10.83511 
1 1 1   16   10   69 o   18.103   6.3486   17.925   11.581   1.5103   26.315   21.868   12.897   16.162   7.6305   19.561   6.7082 -3.398975 10.15993 
1 1 1   16   10   70 o   16.720   7.0112   13.655   16.102 -24.0833   25.097   40.057   20.991   13.319   6.5564   23.782   8.5268 -10.46321 10.75606 
1 1 1   16   10   71 o   13.287   6.1312  -1.1331   15.479 -52.8063   24.452   33.422   19.996   11.176   5.6422   21.926   8.2431 -10.75049 9.989189 
1 1 1   16   10   72 o   9.6989   4.8362 -29.0062   15.402 -13.3442   24.788 -38.8547   19.656   14.087   6.8433   10.522   5.2786 3.564160 8.642635 
1 1 1   16   10   73 o   11.820   5.6490  -9.4657   15.321 -14.2709   24.902  -6.5388   19.435   13.965   6.8013   13.501   6.4272 0.4647474 9.357661 
1 1 1   16   10   74 o   25.223   7.6277   40.750   17.013   23.002   26.241   53.620   22.346   18.721   8.3757   26.934   8.8251 -8.213385 12.16694 
1 1 1   16   10   75 o   21.217   7.7084   30.140   17.225   67.612   27.957   7.2102   21.869   27.912   9.8577   15.872   7.3108 12.04070 12.27282 
1 1 1   16   10   76 o   16.659   6.9801   14.787   15.939   22.810   25.826   9.8510   20.258   18.541   8.3012   16.032   7.2496 2.508785 11.02115 
1 1 1   16   10   77 o   9.8119   4.8941 -28.7320   15.826 -13.4018   24.747 -39.3406   20.586   13.848   6.7521   10.686   5.3662 3.162449 8.624797 
1 1 1   16   10   78 o   12.886   6.0515  -3.2642   16.163  -7.5574   25.673  -0.4451   20.804   14.525   7.0346   14.421   6.8014 0.1034994 9.784859 
1 1 1   16   10   79 o   12.216   5.5450   0.4933   11.986  -3.0188   14.701   7.4565   20.700   12.452   5.8232   15.523   7.1367 -3.071016 9.210981 
1 1 1   16   10   80 o   21.458   6.6038   27.581   12.679   15.768   15.692   49.790   21.516   16.707   6.9573   25.460   8.6662 -8.753201 11.11337 
1 1 1   16   10   81 f   11.222   5.2219  -3.2658   11.588   0.2068   14.217 -10.1398   20.003   12.820   5.9014   12.924   6.2472 -0.1038847 8.593843 
1 1 1   16   10   82 o   13.443   6.0268   4.1328   13.662   5.0965   18.266   2.9093   20.582   14.599   6.7088   14.658   6.8663 -0.5961704E-01 9.599710 
1 1 1   16   10   83 o   15.567   6.5002   12.582   13.751 -11.1506   18.134   44.697   21.095   12.239   5.9238   23.706   8.5418 -11.46721 10.39483 
1 1 1   16   10   84 o   11.440   5.6006 -16.7604   17.534 -16.7604   17.534   0.0000   0.0000   11.440   5.6006  ?   ?  0.000000 5.600614 
1 1 1   16   10   85 o   14.554   6.6638   5.4288   17.798   5.4288   17.798   0.0000   0.0000   14.554   6.6638  ?   ?  0.000000 6.663814 
1 1 1   16   11  -80 o   15.677   7.1923   9.9275   20.876   9.9275   20.876   0.0000   0.0000   15.677   7.1923  ?   ?  0.000000 7.192308 
1 1 1   16   11  -79 o   13.384   6.4408  -6.4198   20.701  -6.4198   20.701   0.0000   0.0000   13.384   6.4408  ?   ?  0.000000 6.440785 
1 1 1   16   11  -78 o   16.680   7.4116   16.204   20.184   16.204   20.184   0.0000   0.0000   16.680   7.4116  ?   ?  0.000000 7.411630 
1 1 1   16   11  -77 o   13.913   6.5713  -0.3142   19.554  -0.3142   19.554   0.0000   0.0000   13.913   6.5713  ?   ?  0.000000 6.571344 
1 1 1   16   11  -76 o   11.561   5.7003 -20.7748   19.231 -20.7748   19.231   0.0000   0.0000   11.561   5.7003  ?   ?  0.000000 5.700263 
1 1 1   16   11  -75 o   10.655   5.3146 -29.5853   18.657 -29.5853   18.657   0.0000   0.0000   10.655   5.3146  ?   ?  0.000000 5.314553 
1 1 1   16   11  -74 o   14.254   6.7174   0.1222   20.227   0.1222   20.227   0.0000   0.0000   14.254   6.7174  ?   ?  0.000000 6.717446 
1 1 1   16   11  -73 o   16.514   7.3203   14.193   19.572   14.193   19.572   0.0000   0.0000   16.514   7.3203  ?   ?  0.000000 7.320300 
1 1 1   16   11  -72 o   14.749   6.8970   2.6402   20.619   2.6402   20.619   0.0000   0.0000   14.749   6.8970  ?   ?  0.000000 6.897020 
1 1 1   16   11  -71 o   18.236   7.3044   21.012   16.488   23.443   21.321   17.396   26.005   18.558   7.9364   17.511   8.0315 1.046600 11.29125 
1 1 1   16   11  -70 o   14.247   6.4239   4.7907   15.772 -12.9093   20.570   30.040   24.568   12.896   6.2577   19.757   8.4856 -6.860803 10.54350 
1 1 1   16   11  -69 o   13.360   6.1718  -0.0481   15.749 -11.9562   20.989   15.293   23.823   13.141   6.3635   17.227   7.8186 -4.086072 10.08092 
1 1 1   16   11  -68 o   11.036   5.3473 -13.6072   14.876 -23.5152   19.678  -0.3948   22.724   11.653   5.7496   14.909   7.0545 -3.255859 9.100738 
1 1 1   16   11  -67 o   12.240   5.7947  -6.3918   15.369   1.2493   20.413 -16.3915   23.352   14.724   6.8779   13.337   6.5152 1.387161 9.473824 
1 1 1   16   11  -66 o   12.270   5.7863  -5.6961   15.050 -15.4998   19.812   7.6780   23.141   12.529   6.0937   16.169   7.4736 -3.640111 9.643012 
1 1 1   16   11  -65 o   22.693   8.9186   40.700   24.143   0.0000   0.0000   40.700   24.143  ?   ?    22.693   8.9186 0.000000 8.918638 
1 1 1   16   11  -64 o   17.559   7.0805   17.192   15.604   26.357   21.330   6.6421   22.886   19.776   8.1622   16.135   7.4490 3.641071 11.05026 
1 1 1   16   11  -63 o   16.125   6.1622   13.232   11.284   5.3216   19.339   17.316   13.895   15.390   7.0080   17.648   6.8139 -2.258574 9.774571 
1 1 1   16   11  -62 o   14.628   6.0673   8.6147   11.866   17.584   27.264   6.5185   13.180   18.307   8.3305   14.331   6.1858 3.976306 10.37600 
1 1 1   16   11  -61 o   15.060   6.3787   8.8116   13.543   0.0000   0.0000   8.8116   13.543  ?   ?    15.060   6.3787 0.000000 6.378680 
1 1 1   16   11  -60 o   12.909   5.4029   5.1548   9.5342   3.2396   15.214   6.3934   12.235   14.166   6.3546   14.116   6.0237 0.4988766E-01 8.755906 
1 1 1   16   11  -59 o   7.7350   3.8357 -18.2737   9.1664 -23.7986   14.914 -14.9197   11.620   10.073   4.9766   9.5623   4.6545 0.5108061 6.814058 
1 1 1   16   11  -58 o   25.624   4.8340   31.790   9.7270   54.939   16.033   18.306   12.236   32.177   6.3382   18.347   6.5176 13.83032 9.091274 
1 1 1   16   11  -57 o   28.288   4.4125   37.503   9.8427   34.753   16.358   39.064   12.323   24.086   7.5158   27.792   5.6328 -3.706306 9.392322 
1 1 1   16   11  -56 o   37.801   3.4146   63.148   10.408   40.605   16.609   77.725   13.356   26.458   7.4087   41.374   4.0104 -14.91619 8.424441 
1 1 1   16   11  -55 o   16.599   5.7122   13.606   9.3538   9.0912   15.409   16.241   11.771   15.917   6.7752   17.778   6.3837 -1.861456 9.308899 
1 1 1   16   11  -54 o   12.658   5.3071   4.0727   9.2242  -9.4810   15.245   11.900   11.585   12.209   5.7773   16.144   6.2249 -3.935645 8.492722 
1 1 1   16   11  -53 o   20.976   5.5471   21.983   9.6285   19.237   16.518   23.397   11.850   19.115   7.4160   21.087   6.3636 -1.971905 9.771970 
1 1 1   16   11  -52 o   31.440   4.7297   46.113   11.746  -2.5212   28.499   56.065   12.892   16.998   7.9993   34.761   4.6677 -17.76273 9.261506 
1 1 1   16   11  -51 f   41.386   3.6374   75.468   12.146   15.311   31.276   86.152   13.181   19.805   8.9766   44.184   3.6934 -24.37935 9.706707 
1 1 1   16   11  -50 o   19.488   5.7470   18.898   9.7515   22.903   17.435   17.075   11.764   20.559   7.7039   18.464   6.4035 2.094711 10.01771 
1 1 1   16   11  -49 o   19.329   5.7487   18.491   9.7236   19.444   18.385   18.121   11.457   19.636   7.7625   18.985   6.3233 0.6513557 10.01202 
1 1 1   16   11  -48 o   11.339   5.0407  -0.8962   9.3466   9.1288   17.771  -4.7297   10.989   16.973   7.2518   11.289   5.1935 5.683943 8.919682 
1 1 1   16   11  -47 o   19.659   5.7733   18.959   9.8582   21.314   18.683   18.051   11.605   20.409   7.8954   19.079   6.3643 1.329964 10.14111 
1 1 1   16   11  -46 o   40.609   3.0334   70.509   9.9690   67.900   15.901   72.199   12.796   38.160   5.2509   40.472   3.9281 -2.311153 6.557556 
1 1 1   16   11  -45 f   23.633   4.9395   26.036   9.2087   31.559   15.008   22.701   11.662   24.585   7.0960   21.336   6.2830 3.249556 9.477784 
1 1 1   16   11  -44 o   38.151   3.1536   62.342   9.7200   65.555   15.413   60.221   12.524   37.693   5.1511   36.783   4.2555 0.9100723 6.681533 
1 1 1   16   11  -43 o   20.055   5.3523   19.087   8.9123   45.068   14.728   4.0765   11.195   30.492   6.1380   13.847   5.8287 16.64525 8.464559 
1 1 1   16   11  -42 o   28.914   4.0346   36.959   9.2506   35.570   14.875   37.834   11.813   26.550   6.8332   28.517   5.2760 -1.966585 8.633021 
1 1 1   16   11  -41 o   35.608   3.3398   54.449   9.5808   60.690   15.458   50.556   12.209   36.223   5.3997   33.573   4.5804 2.650421 7.080762 
1 1 1   16   11  -40 f   41.080   2.7901   71.215   9.2877   60.201   15.569   77.300   11.572   36.078   5.4649   42.480   3.3695 -6.402752 6.420190 
1 1 1   16   11  -39 o   25.760   4.8884   30.278   9.8894   51.357   14.626   12.522   13.423   33.236   5.5971   17.492   6.7119 15.74359 8.739396 
1 1 1   16   11  -38 o   14.505   5.6717   7.2083   9.7218   31.523   14.379 -13.2669   13.195   25.198   6.8306   11.118   5.2939 14.07969 8.641883 
1 1 1   16   11  -37 o   32.790   3.9055   46.825   10.234   54.814   15.189   40.183   13.849   34.430   5.6046   29.107   6.0352 5.322886 8.236212 
1 1 1   16   11  -36 o   17.370   5.3256   13.802   8.2553   2.6013   14.092   19.655   10.186   14.811   6.3946   20.397   5.8332 -5.585701 8.655419 
1 1 1   16   11  -35 o   16.345   5.3690   11.884   8.2686   40.980   14.751  -1.4477   9.9848   29.250   6.3677   11.795   5.2284 17.45472 8.239205 
1 1 1   16   11  -34 o   33.414   3.3279   47.662   8.9439   58.904   15.263   41.783   11.037   35.983   5.3675   30.674   4.5523 5.309071 7.038009 
1 1 1   16   11  -33 o   13.994   5.2995   7.0660   8.2984  -7.9618   14.350   14.616   10.172   12.688   5.8719   17.968   5.9572 -5.279963 8.364648 
1 1 1   16   11  -32 o   35.056   3.8371   53.081   10.786   55.442   15.429   50.824   15.084   34.772   5.6361   33.167   5.7900 1.605831 8.080156 
1 1 1   16   11  -31 o   30.161   3.9327   39.511   9.4389   55.653   14.920   28.740   12.188   35.015   5.4008   24.641   6.1006 10.37431 8.147758 
1 1 1   16   11  -30 o   36.809   3.2892   57.571   9.7653   68.520   15.441   50.271   12.607   39.242   4.9360   33.664   4.7239 5.577572 6.832231 
1 1 1   16   11  -29 o   25.810   4.2124   29.301   8.5572   38.322   14.397   24.374   10.641   28.421   6.3721   22.862   5.7235 5.559649 8.565156 
1 1 1   16   11  -28 o   10.910   4.7837  -0.8328   8.1463   3.2278   14.114  -2.8612   9.9756   15.124   6.4623   11.473   5.1464 3.650311 8.261135 
1 1 1   16   11  -27 o   18.712   5.2536   16.001   8.3402   22.416   14.112   12.557   10.339   21.694   7.0065   17.117   5.9989 4.577013 9.223734 
1 1 1   16   11  -26 o   15.501   5.3681   10.084   8.2658   11.095   13.989   9.5417   10.246   17.442   6.8084   15.793   5.9082 1.649357 9.014512 
1 1 1   16   11  -25 o   26.398   4.0888   30.443   8.5141   35.483   14.288   27.669   10.602   27.309   6.5106   24.554   5.4404 2.755260 8.484428 
1 1 1   16   11  -24 o   26.178   4.2048   30.041   8.6688   29.309   14.452   30.452   10.834   24.635   6.9153   25.857   5.3180 -1.221626 8.723648 
1 1 1   16   11  -23 o   30.298   3.5640   39.308   8.6340   43.302   14.796   37.246   10.632   30.488   6.1659   29.007   4.6538 1.480751 7.725015 
1 1 1   16   11  -22 o   13.211   5.2182   5.0878   8.3017   11.405   14.299   1.8754   10.196   17.689   6.8894   12.997   5.5211 4.691658 8.828682 
1 1 1   16   11  -21 o   17.079   5.6628   12.768   9.1910  -4.1078   20.558   16.984   10.275   16.146   7.3021   19.275   5.9473 -3.128258 9.417576 
1 1 1   16   11  -20 o   17.109   5.6479   12.821   9.1456   27.918   19.898   8.7770   10.298   23.969   8.3272   15.554   5.9004 8.414905 10.20574 
1 1 1   16   11  -19 o   23.784   5.0988   25.561   9.5883   10.315   19.790   30.237   10.961   18.925   7.8412   25.788   5.3880 -6.863333 9.513992 
1 1 1   16   11  -18 o   17.437   5.4049   13.563   8.4750   22.419   14.555   9.0204   10.424   21.864   7.1198   15.713   5.9420 6.151588 9.273601 
1 1 1   16   11  -17 o   17.658   5.5455   13.897   8.8907  -1.1156   16.440   20.102   10.570   15.177   6.7192   20.867   5.9335 -5.690283 8.964021 
1 1 1   16   11  -16 o   35.182   3.6244   52.773   10.246   63.603   22.929   50.072   11.452   35.905   8.0353   33.997   4.2233 1.907402 9.077618 
1 1 1   16   11  -15 o   45.688   3.4705   88.350   12.828   97.977   24.832   84.846   14.983   45.843   6.8553   44.396   4.1896 1.446442 8.034174 
1 1 1   16   11  -14 o   45.871   2.9740   88.170   11.060  119.369   25.104   80.655   12.320   51.305   6.1236   43.638   3.4927 7.666336 7.049630 
1 1 1   16   11  -13 o   20.843   5.5779   19.868   9.6633   12.929   16.557   23.453   11.901   18.878   7.3957   22.440   6.2667 -3.562000 9.693667 
1 1 1   16   11  -12 o   13.955   5.4278   6.1151   8.8660 -13.0245   16.134   14.395   10.612   12.872   6.0454   18.146   6.0864 -5.273427 8.578527 
1 1 1   16   11  -11 o   10.681   4.8933  -5.4380   9.6152 -25.1098   24.657  -1.9102   10.442   14.893   7.1307   12.087   5.3530 2.805249 8.916394 
1 1 1   16   11  -10 o   16.663   5.5273   11.944   8.7561   11.571   14.815   12.145   10.855   18.023   7.0146   17.198   6.1356 0.8253326 9.319334 
1 1 1   16   11   -9 o   26.741   4.3475   31.250   9.1513   44.723   15.598   24.178   11.300   31.069   6.3730   22.879   5.9901 8.189894 8.746221 
1 1 1   16   11   -8 o   78.447   2.0502  253.746   13.099  275.971   23.256  243.418   15.853   80.904   3.5349   76.596   2.5426 4.308678 4.354300 
1 1 1   16   11   -7 o   25.310   4.6376   28.292   9.2156   32.892   15.408   25.730   11.499   26.274   7.0487   23.616   5.9709 2.658241 9.237753 
1 1 1   16   11   -6 f   40.240   2.9780   67.856   9.6990   77.423   16.014   62.313   12.189   42.154   4.7427   38.144   3.9785 4.009270 6.190426 
1 1 1   16   11   -5 o   24.113   4.7255   25.796   8.9558   30.707   14.497   22.764   11.389   25.484   6.8374   22.201   6.1042 3.282963 9.165783 
1 1 1   16   11   -4 o   33.367   4.6772   48.686   12.373   31.375   17.140   67.523   17.879   25.500   7.6438   38.715   5.8475 -13.21495 9.623979 
1 1 1   16   11   -3 o   82.707   2.4783  283.444   16.690  275.174   23.371  292.049   23.842   80.793   3.5574   83.266   3.5206 -2.472870 5.004978 
1 1 1   16   11   -2 o   32.876   4.7643   47.388   12.396   47.132   17.462   47.648   17.600   31.611   6.9651   31.776   6.9856 -0.1648407 9.864626 
1 1 1   16   11   -1 f   13.617   5.5825   3.9312   9.8911   1.0392   15.946   5.7397   12.610   15.543   6.7560   15.434   6.3126 0.1081972 9.246210 
1 1 1   16   11    0 o   32.227   4.1142   44.773   10.562   57.096   17.792   38.067   13.125   35.211   6.4359   28.944   5.7656 6.266842 8.640754 
1 1 1   16   11    1 f   15.408   5.5589   9.2610   8.9379   0.1393   16.378   13.130   10.666   15.515   6.7934   17.617   6.0981 -2.101839 9.128923 
1 1 1   16   11    2 o   54.474   2.4295  123.007   10.761  130.414   19.155  119.591   13.007   55.133   4.2961   53.478   2.9958 1.654568 5.237503 
1 1 1   16   11    3 o   33.321   3.6468   47.293   9.7439   57.513   17.723   42.866   11.665   35.369   6.3820   31.257   4.7257 4.111994 7.941172 
1 1 1   16   11    4 o   36.108   3.7157   55.539   10.780   60.793   17.806   52.498   13.545   36.487   6.2089   34.532   4.9536 1.954372 7.942811 
1 1 1   16   11    5 o   33.484   4.0232   48.194   10.761   46.427   17.121   49.348   13.836   31.405   6.8788   33.301   5.2727 -1.896116 8.667113 
1 1 1   16   11    6 f   13.044   5.5123   1.9804   10.076 -18.0137   16.517   13.834   12.717   12.342   5.8894   18.327   6.6283 -5.985186 8.866750 
1 1 1   16   11    7 o   12.363   5.3640  -0.0966   10.014   0.4661   16.602  -0.4183   12.554   15.664   6.8496   13.632   5.9588 2.032047 9.078767 
1 1 1   16   11    8 o   32.493   3.7512   45.131   9.7533   45.056   17.557   45.164   11.730   30.755   7.1409   32.138   4.6093 -1.383045 8.499262 
1 1 1   16   11    9 o   69.796   2.1684  201.193   12.322  232.580   22.720  188.115   14.666   74.078   3.7750   67.253   2.6806 6.824715 4.629947 
1 1 1   16   11   10 o   49.091   2.7143  100.425   10.820  102.683   19.637   99.441   12.965   48.375   5.0544   48.600   3.2921 -0.2254639 6.031981 
1 1 1   16   11   11 o   59.327   2.3643  145.813   11.411  165.471   20.961  137.533   13.604   62.180   4.1594   57.373   2.9184 4.806740 5.081082 
1 1 1   16   11   12 o   24.546   5.1241   27.101   9.9209   37.656   22.915   24.666   11.006   27.276   8.9369   23.137   5.8368 4.139038 10.67409 
1 1 1   16   11   13 o   38.300   3.2111   61.848   9.9330   75.379   18.505   56.371   11.773   40.958   5.6965   36.195   4.0601 4.762474 6.995333 
1 1 1   16   11   14 o   43.911   2.9040   80.720   10.336  102.509   19.401   72.084   12.214   48.326   4.9970   41.155   3.6796 7.170586 6.205541 
1 1 1   16   11   15 o   51.697   2.8198  111.621   11.838  112.719   30.848  111.432   12.819   48.023   8.1726   51.541   3.0651 -3.517361 8.728462 
1 1 1   16   11   16 o   40.246   3.4505   68.645   11.211   75.336   29.252   67.493   12.137   37.867   9.4953   39.748   3.7919 -1.881470 10.22442 
1 1 1   16   11   17 o   15.314   6.3545   5.0480   13.024 -10.7831   26.675   10.003   14.924   17.270   7.9971   17.490   6.9681 -0.2202759 10.60694 
1 1 1   16   11   18 o   12.189   5.4371  -2.5622   10.970   21.483   27.157  -7.2508   11.992   23.017   9.3196   11.702   5.3986 11.31528 10.77030 
1 1 1   16   11   19 o   59.356   2.3465  146.074   11.331  144.142   16.700  147.722   15.424   58.342   3.5281   59.258   3.2050 -0.9157867 4.766490 
1 1 1   16   11   20 o   91.454   2.0889  345.206   15.572  349.457   25.419  342.651   19.703   90.996   3.4330   90.722   2.6672 0.2737274 4.347313 
1 1 1   16   11   21 o   18.521   6.0765   15.379   10.592   18.523   21.169   14.329   12.234   21.276   8.3544   18.298   6.5153 2.977867 10.59462 
1 1 1   16   11   22 o   21.509   5.9591   21.544   10.808   44.118   22.056   14.411   12.398   29.215   8.6503   18.347   6.5560 10.86769 10.85396 
1 1 1   16   11   23 o   16.342   6.0674   10.427   10.765   32.251   23.020   4.3184   12.179   25.272   8.9432   14.682   6.1229 10.59007 10.83840 
1 1 1   16   11   24 o   64.457   2.6400  173.200   13.842  204.028   28.980  164.088   15.755   67.770   5.2878   62.470   3.1037 5.299988 6.131340 
1 1 1   16   11   25 o   19.830   5.5677   18.117   9.3670   14.049   14.090   21.338   12.539   18.500   6.9271   21.276   6.5707 -2.776604 9.547725 
1 1 1   16   11   26 o   35.748   3.8164   54.976   10.949   39.639   14.889   73.034   16.157   28.897   6.4811   40.550   4.9933 -11.65252 8.181545 
1 1 1   16   11   27 o   41.291   2.8709   71.609   9.6028   87.063   15.600   62.179   12.185   44.744   4.3312   37.937   4.0005 6.806969 5.896054 
1 1 1   16   11   28 o   25.661   4.4341   29.170   8.9398   16.222   14.745   36.697   11.242   19.347   7.1155   28.562   5.0112 -9.214991 8.703021 
1 1 1   16   11   29 o   26.231   4.3587   30.392   8.9931   22.370   14.844   35.044   11.303   21.651   7.1972   27.802   5.1782 -6.151110 8.866434 
1 1 1   16   11   30 o   28.730   4.0197   35.973   9.1566   52.708   15.292   26.619   11.433   33.861   5.7453   23.803   5.9176 10.05865 8.247842 
1 1 1   16   11   31 o   24.893   4.9142   28.018   9.6175   25.641   14.382   29.941   12.935   22.947   7.0283   25.041   6.3336 -2.093822 9.461057 
1 1 1   16   11   32 o   13.256   5.4419   4.0218   9.4147   9.1027   14.158  -0.0060   12.606   16.763   6.7497   13.577   5.9519 3.185620 8.999105 
1 1 1   16   11   33 o   37.500   3.3794   59.971   10.220   58.158   15.339   61.418   13.704   35.731   5.4378   37.270   4.6088 -1.539906 7.128163 
1 1 1   16   11   34 o   22.201   5.0232   22.574   8.8773   34.186   14.558   15.700   11.201   26.472   6.7320   18.547   6.2532 7.925129 9.188202 
1 1 1   16   11   35 o   33.357   3.4610   47.715   9.2742   74.520   15.235   31.936   11.689   41.019   4.6377   26.150   5.6491 14.86912 7.308970 
1 1 1   16   11   36 o   20.562   5.4797   19.780   9.3504   41.861   17.252   10.596   11.126   28.849   7.3243   16.323   6.1463 12.52576 9.561497 
1 1 1   16   11   37 o   14.478   5.5608   7.5409   9.2198   31.516   16.907  -2.6058   10.999   24.801   7.6248   12.032   5.4000 12.76830 9.343274 
1 1 1   16   11   38 o   36.877   3.3382   58.166   9.9262   71.995   18.208   52.317   11.840   39.291   5.8643   34.428   4.3136 4.862751 7.279858 
1 1 1   16   11   39 o   48.227   2.7149   97.788   10.630   93.288   19.307   99.746   12.733   45.192   5.3444   48.394   3.2466 -3.201374 6.253272 
1 1 1   16   11   40 f   30.053   4.1270   39.882   9.8435   42.714   17.843   38.643   11.802   28.742   7.5278   28.959   5.1902 -0.2177429 9.143598 
1 1 1   16   11   41 o   19.778   5.6564   18.625   9.5781   4.9306   17.481   24.500   11.450   16.376   7.0962   22.440   6.1005 -6.064137 9.358017 
1 1 1   16   11   42 o   41.192   3.4522   73.072   11.485  112.227   19.532   52.377   14.199   49.866   4.8670   33.590   5.3664 16.27562 7.244724 
1 1 1   16   11   43 o   37.226   5.1754   63.815   15.280   73.917   19.040   45.537   25.611   39.220   6.1583   27.517   9.4526 11.70355 11.28170 
1 1 1   16   11   44 o   27.027   6.1242   35.768   13.179   44.385   15.848   16.454   23.727   29.719   6.7023   20.022   8.4599 9.697412 10.79307 
1 1 1   16   11   45 f   13.747   5.5882   5.6321   9.8093 -17.3624   15.204   22.029   12.839   11.377   5.4865   20.884   6.6771 -9.506222 8.642008 
1 1 1   16   11   46 o   10.895   4.9509  -3.2963   9.5901  -8.5011   15.323   0.0553   12.296   12.716   5.9461   13.107   5.8066 -0.3914948 8.311005 
1 1 1   16   11   47 o   14.277   5.7776   6.6764   10.431   25.283   17.984  -2.7560   12.804   21.633   7.8739   12.645   5.7361 8.988521 9.741709 
1 1 1   16   11   48 o   26.392   5.2618   33.161   10.923   40.255   20.114   30.194   13.008   26.261   8.3531   24.276   6.4602 1.984634 10.55977 
1 1 1   16   11   49 o   21.775   5.9113   23.739   10.760   16.783   19.174   26.936   12.999   18.991   7.7777   22.717   6.6179 -3.725307 10.21225 
1 1 1   16   11   50 o   33.110   4.2799   49.707   11.281   72.132   20.584   40.079   13.487   37.068   7.0703   28.329   6.0261 8.739313 9.289938 
1 1 1   16   11   51 f   20.237   5.9800   20.780   10.549 -13.2113   18.036   38.456   13.006   12.886   6.1505   27.747   5.9302 -14.86106 8.543790 
1 1 1   16   11   52 o   21.598   5.8533   23.618   10.560   11.959   17.964   29.774   13.054   17.366   7.3506   23.750   6.5372 -6.383068 9.836986 
1 1 1   16   11   53 o   25.768   5.2650   32.256   10.685   38.540   18.162   28.930   13.214   25.532   7.9120   23.234   6.6434 2.298706 10.33122 
1 1 1   16   11   54 o   12.171   5.4547  -0.5546   11.181   22.177   17.121 -17.4611   14.765   19.937   7.5974   10.894   5.2898 9.043415 9.257587 
1 1 1   16   11   55 o   15.186   5.8354   10.220   10.156   13.067   17.248   8.7093   12.566   17.244   7.2453   15.174   6.2639 2.069928 9.577650 
1 1 1   16   11   56 o   18.160   5.9834   17.104   10.266   37.417   17.674   6.7597   12.612   24.790   7.8232   14.535   6.1559 10.25529 9.954793 
1 1 1   16   11   57 o   8.8585   4.3104 -13.6632   9.9424  -8.8636   16.595 -16.3504   12.418   12.644   5.9963   9.8222   4.7878 2.821928 7.673243 
1 1 1   16   11   58 o   15.361   5.8665   11.082   10.223   24.812   17.702   4.2130   12.522   20.159   7.7148   13.686   5.9673 6.473667 9.753246 
1 1 1   16   11   59 o   46.880   3.0892   96.140   11.739   92.889   19.707   97.927   14.615   42.640   5.8217   46.396   3.9006 -3.755684 7.007635 
1 1 1   16   11   60 o   12.633   5.5851   2.0414   11.319   12.035   26.119  -0.2693   12.559   17.564   8.0535   12.550   5.6883 5.014531 9.859789 
1 1 1   16   11   61 o   12.787   5.7068   1.6249   12.102   7.4473   24.942  -0.1677   13.840   16.699   7.7329   12.998   5.9227 3.700849 9.740395 
1 1 1   16   11   62 o   22.846   6.4409   29.210   12.509   35.678   26.432   27.343   14.199   21.485   8.9944   21.414   7.0359 0.7034874E-01 11.41938 
1 1 1   16   11   63 o   14.744   6.0944   9.0428   11.916   41.500   26.181   0.5629   13.382   22.684   9.1627   12.948   5.8699 9.735642 10.88173 
1 1 1   16   11   64 o   21.825   6.5229   27.191   12.495   27.769   27.189   27.036   14.069   19.750   8.6967   21.212   7.0052 -1.462408 11.16715 
1 1 1   16   11   65 o   22.441   6.5499   28.910   12.723   12.921   27.223   33.378   14.391   17.404   8.0661   23.648   6.9835 -6.244156 10.66916 
1 1 1   16   11   66 o   14.531   6.1390   8.3687   12.492   26.664   26.354   3.0667   14.187   19.349   8.5394   13.621   6.1214 5.727263 10.50680 
1 1 1   16   11   67 o   13.872   6.3636   1.6449   16.336  -8.2224   25.890   8.1716   21.056   14.655   7.0894   15.900   7.2681 -1.245968 10.15307 
1 1 1   16   11   68 o   19.597   7.5743   25.238   17.182   56.206   27.365   5.0846   22.076   25.106   9.5958   15.540   7.2233 9.565619 12.01064 
1 1 1   16   11   69 o   14.500   6.8344  -0.6284   20.949   0.0000   0.0000  -0.6284   20.949  ?   ?    14.500   6.8344 0.000000 6.834382 
1 1 1   16   11   70 o   13.469   6.5310 -11.5145   22.294   0.0000   0.0000 -11.5145   22.294  ?   ?    13.469   6.5310 0.000000 6.530982 
1 1 1   16   11   71 o   12.167   5.9752 -19.5333   20.443   0.0000   0.0000 -19.5333   20.443  ?   ?    12.167   5.9752 0.000000 5.975153 
1 1 1   16   11   72 o   25.453   8.8869   51.620   22.677   0.0000   0.0000   51.620   22.677  ?   ?    25.453   8.8869 0.000000 8.886871 
1 1 1   16   11   73 o   18.973   8.1789   26.686   22.983   0.0000   0.0000   26.686   22.983  ?   ?    18.973   8.1789 0.000000 8.178864 
1 1 1   16   11   74 o   14.944   6.9577   4.4722   20.616   0.0000   0.0000   4.4722   20.616  ?   ?    14.944   6.9577 0.000000 6.957745 
1 1 1   16   11   75 o   14.023   6.6856  -2.6773   21.190   0.0000   0.0000  -2.6773   21.190  ?   ?    14.023   6.6856 0.000000 6.685591 
1 1 1   16   11   76 o   12.916   6.2704 -11.1132   20.716   0.0000   0.0000 -11.1132   20.716  ?   ?    12.916   6.2704 0.000000 6.270426 
1 1 1   16   11   77 o   13.758   6.5935  -4.0882   21.184   0.0000   0.0000  -4.0882   21.184  ?   ?    13.758   6.5935 0.000000 6.593464 
1 1 1   16   11   78 o   17.215   7.6247   18.933   21.189   0.0000   0.0000   18.933   21.189  ?   ?    17.215   7.6247 0.000000 7.624655 
1 1 1   16   12  -74 o   16.491   7.4212   15.292   20.934   15.292   20.934   0.0000   0.0000   16.491   7.4212  ?   ?  0.000000 7.421235 
1 1 1   16   12  -73 o   16.657   7.4067   16.627   20.195   16.627   20.195   0.0000   0.0000   16.657   7.4067  ?   ?  0.000000 7.406699 
1 1 1   16   12  -72 o   11.512   5.5365  -9.0955   15.236 -17.5673   19.336   4.7801   24.746   11.812   5.8026   15.268   7.2639 -3.456269 9.297019 
1 1 1   16   12  -71 o   8.7738   4.4271 -35.7295   14.932 -32.7236   19.311 -40.1981   23.546   10.540   5.2794   11.244   5.6590 -0.7044067 7.739208 
1 1 1   16   12  -70 o   10.764   5.2464 -14.1737   14.897 -15.9882   19.219 -11.4430   23.577   11.955   5.8549   13.428   6.5569 -1.473451 8.790477 
1 1 1   16   12  -69 o   17.083   7.0551   18.080   15.949   9.7265   20.632   30.486   25.143   15.579   7.1486   19.140   8.3978 -3.560733 11.02843 
1 1 1   16   12  -68 o   13.002   6.0708  -0.9694   15.873 -21.7238   20.399   30.886   25.272   11.808   5.8314   19.295   8.4437 -7.486103 10.26166 
1 1 1   16   12  -67 f   13.371   6.1964   0.7329   16.060 -20.1250   21.114   29.363   24.737   12.173   5.9964   19.156   8.3691 -6.983163 10.29558 
1 1 1   16   12  -66 o   13.728   6.2896   2.8245   15.889   1.0399   20.903   5.2668   24.453   14.471   6.8226   15.543   7.3437 -1.072313 10.02385 
1 1 1   16   12  -65 o   12.994   6.0356  -0.6651   15.371 -12.8360   19.702   18.265   24.570   12.550   6.0978   17.398   7.9136 -4.848400 9.990399 
1 1 1   16   12  -64 o   22.330   9.1297   45.253   26.365   0.0000   0.0000   45.253   26.365  ?   ?    22.330   9.1297 0.000000 9.129748 
1 1 1   16   12  -63 o   21.188   8.9368   39.369   26.401   0.0000   0.0000   39.369   26.401  ?   ?    21.188   8.9368 0.000000 8.936796 
1 1 1   16   12  -62 o   27.190   9.5645   63.592   26.299   0.0000   0.0000   63.592   26.299  ?   ?    27.190   9.5645 0.000000 9.564501 
1 1 1   16   12  -61 f   11.307   5.6774 -40.5994   22.990   0.0000   0.0000 -40.5994   22.990  ?   ?    11.307   5.6774 0.000000 5.677435 
1 1 1   16   12  -60 o   34.698   5.9146   64.213   16.129   0.0000   0.0000   64.213   16.129  ?   ?    34.698   5.9146 0.000000 5.914563 
1 1 1   16   12  -59 o   13.803   6.1428   4.5237   13.918   0.0000   0.0000   4.5237   13.918  ?   ?    13.803   6.1428 0.000000 6.142786 
1 1 1   16   12  -58 o   13.460   6.0030   3.5188   13.366   0.0000   0.0000   3.5188   13.366  ?   ?    13.460   6.0030 0.000000 6.002983 
1 1 1   16   12  -57 o   10.391   4.9172  -7.0892   11.044 -24.9446   19.245   1.6781   13.485   11.438   5.6514   13.120   5.9256 -1.681835 8.188428 
1 1 1   16   12  -56 o   28.776   6.4763   45.985   14.823   0.0000   0.0000   45.985   14.823  ?   ?    28.776   6.4763 0.000000 6.476262 
1 1 1   16   12  -55 o   16.573   6.6614   14.248   13.764   0.0000   0.0000   14.248   13.764  ?   ?    16.573   6.6614 0.000000 6.661438 
1 1 1   16   12  -54 o   17.079   6.2466   15.697   11.338   41.547   19.479   2.4490   13.944   24.655   8.2456   13.516   6.0717 11.13906 10.23989 
1 1 1   16   12  -53 o   19.291   6.1806   20.551   10.996   17.902   19.963   21.705   13.175   17.938   7.6757   19.337   6.7722 -1.398859 10.23621 
1 1 1   16   12  -52 o   30.590   4.7940   45.360   11.562   24.752   20.931   54.409   13.870   19.577   8.0833   32.933   5.3501 -13.35555 9.693417 
1 1 1   16   12  -51 o   24.005   5.4058   29.354   10.323   11.112   16.585   40.889   13.189   16.193   6.9638   27.854   5.9871 -11.66034 9.183626 
1 1 1   16   12  -50 o   15.817   5.8553   12.399   10.012  -0.6930   16.498   20.033   12.598   13.786   6.3501   18.908   6.6222 -5.122108 9.174773 
1 1 1   16   12  -49 o   38.951   3.4719   67.620   10.908   50.329   17.720   78.172   13.842   29.306   7.4134   41.126   4.1873 -11.82030 8.514229 
1 1 1   16   12  -48 o   34.152   3.9375   53.181   10.761   27.507   17.870   67.790   13.480   21.034   7.8157   38.089   4.4237 -17.05567 8.980781 
1 1 1   16   12  -47 o   14.829   5.7590   9.6733   9.9690  -0.5269   16.606   15.421   12.465   14.018   6.4251   17.319   6.5090 -3.301519 9.146008 
1 1 1   16   12  -46 o   9.3408   4.4781 -10.2632   9.7919 -24.7468   16.598  -2.5317   12.127   10.783   5.3127   12.046   5.5097 -1.262599 7.653879 
1 1 1   16   12  -45 o   16.370   6.6200   11.843   13.684   16.533   16.851   2.7621   23.447   18.122   7.3400   16.387   7.5561 1.735590 10.53419 
1 1 1   16   12  -44 o   15.191   6.2132   8.8464   12.216  -3.3238   16.934   22.053   17.640   13.815   6.3885   19.850   7.6739 -6.034992 9.985092 
1 1 1   16   12  -43 o   18.949   6.6122   18.845   12.553   34.942   17.539   1.9406   17.973   24.320   7.8071   15.119   6.8333 9.201517 10.37523 
1 1 1   16   12  -42 o   15.743   5.9118   11.230   10.278   6.2684   17.899   13.671   12.554   16.014   7.0538   16.997   6.4988 -0.9836063 9.591142 
1 1 1   16   12  -41 o   13.478   5.6016   5.2233   10.143   7.0471   18.024   4.3781   12.271   16.263   7.1235   13.983   6.0013 2.279509 9.314478 
1 1 1   16   12  -40 o   39.198   3.6092   67.685   11.403   64.546   20.241   69.144   13.801   34.459   7.4252   38.911   4.4300 -4.451317 8.646347 
1 1 1   16   12  -39 o   54.001   2.8337  124.441   12.430  105.584   17.011  146.043   18.207   48.267   4.3709   57.367   3.9169 -9.099842 5.869155 
1 1 1   16   12  -38 o   33.565   3.7439   49.855   10.069   59.082   15.658   43.349   13.148   34.902   5.7003   29.891   5.6019 5.010326 7.992158 
1 1 1   16   12  -37 o   20.726   5.6356   21.155   9.7700   3.5008   15.047   34.023   12.846   14.857   6.5082   26.014   6.1549 -11.15654 8.957661 
1 1 1   16   12  -36 o   16.176   5.7214   12.005   9.4204  -9.7844   14.642   27.396   12.306   12.128   5.7154   23.197   6.3320 -11.06873 8.529988 
1 1 1   16   12  -35 o   22.917   5.2011   25.020   9.4927   7.1907   14.666   37.875   12.453   15.759   6.6545   28.009   5.6495 -12.25024 8.729225 
1 1 1   16   12  -34 o   20.815   5.5197   20.985   9.5171   34.825   14.676   10.943   12.502   25.936   6.8437   16.390   6.4250 9.546259 9.387009 
1 1 1   16   12  -33 o   13.214   5.3978   4.9061   9.2061   7.9867   14.190   2.6671   12.098   15.927   6.6228   13.713   5.9226 2.213933 8.884802 
1 1 1   16   12  -32 o   34.999   3.5475   53.282   9.9810   62.337   15.387   46.704   13.114   36.544   5.3215   31.596   5.2779 4.947701 7.494971 
1 1 1   16   12  -31 o   18.886   5.6750   17.134   9.4389   1.4803   14.584   28.418   12.382   14.447   6.3652   23.907   6.2756 -9.459454 8.938648 
1 1 1   16   12  -30 f   13.352   5.4384   4.9969   9.3123   3.9939   14.179   5.7579   12.349   14.944   6.4328   14.784   6.1654 0.1601639 8.910233 
1 1 1   16   12  -29 o   8.2613   4.0132 -12.9943   8.5223  -9.6025   14.040 -14.9731   10.724   12.041   5.6501   9.3778   4.5429 2.663158 7.249945 
1 1 1   16   12  -28 o   13.394   5.3205   5.7026   8.6761  -7.3270   14.331   13.242   10.901   12.597   5.8430   17.171   6.1460 -4.574129 8.480245 
1 1 1   16   12  -27 o   19.189   5.7401   17.555   9.6731   14.925   18.940   18.483   11.251   19.132   7.7696   19.567   6.2500 -0.4347572 9.971402 
1 1 1   16   12  -26 o   18.467   5.7305   16.094   9.5239   21.879   19.133   14.189   10.981   21.151   8.0382   17.641   6.1823 3.509920 10.14067 
1 1 1   16   12  -25 o   37.819   3.6990   61.987   11.258   54.506   20.379   65.273   13.505   32.299   7.8238   38.359   4.3986 -6.060471 8.975554 
1 1 1   16   12  -24 o   18.514   5.7619   16.101   9.6209   19.154   15.244   14.080   12.403   20.070   7.2572   17.848   6.5325 2.221767 9.764240 
1 1 1   16   12  -23 o   12.352   5.2914   1.5232   9.5072  -7.8178   14.864   7.9907   12.368   12.845   5.9557   15.663   6.3080 -2.817616 8.675345 
1 1 1   16   12  -22 f   13.226   5.3350   4.8752   8.8621   10.661   15.064   1.8132   10.959   17.295   6.9630   13.178   5.6637 4.117582 8.975585 
1 1 1   16   12  -21 o   13.344   5.3616   5.1003   8.9128   19.473   15.356  -2.2008   10.945   20.275   7.2901   12.087   5.4084 8.188196 9.077296 
1 1 1   16   12  -20 o   8.6955   4.2236 -14.4479   9.4320 -25.3967   14.880  -7.0941   12.195   10.399   5.1048   11.678   5.4075 -1.279236 7.436423 
1 1 1   16   12  -19 o   17.659   5.8172   14.244   9.7039   22.644   15.277   8.5615   12.564   21.492   7.3025   15.971   6.3832 5.521395 9.699103 
1 1 1   16   12  -18 o   10.888   4.9392  -3.7157   9.4937  -5.7440   14.948  -2.3443   12.291   13.322   6.1025   12.775   5.7228 0.5469294 8.366020 
1 1 1   16   12  -17 o   17.809   6.1106   14.299   10.702   20.227   15.395   8.7553   14.887   20.634   7.3124   16.764   6.8580 3.870096 10.02519 
1 1 1   16   12  -16 o   28.918   4.4930   37.213   10.247   27.330   15.592   44.727   13.596   23.375   7.3443   31.110   5.5658 -7.734472 9.215054 
1 1 1   16   12  -15 f   11.463   5.0976  -1.7718   9.5687   5.8510   14.598  -7.5140   12.670   15.880   6.6685   11.886   5.5066 3.994193 8.648186 
1 1 1   16   12  -14 o   30.183   3.8894   39.643   9.3473   16.233   15.358   53.416   11.780   19.277   7.2292   34.912   4.2254 -15.63527 8.373441 
1 1 1   16   12  -13 o   14.129   5.4598   6.8731   8.9265  -5.5912   14.768   14.049   11.205   13.311   6.0853   17.808   6.2448 -4.496826 8.719408 
1 1 1   16   12  -12 o   19.326   5.9208   17.442   10.206   41.175   15.247  -1.8227   13.737   29.225   6.5616   13.633   6.0824 15.59188 8.947076 
1 1 1   16   12  -11 o   40.737   3.3705   70.716   11.092   94.619   16.989   52.953   14.645   46.371   4.5531   34.031   5.4642 12.33962 7.112518 
1 1 1   16   12  -10 o   19.827   5.9009   18.418   10.243   20.351   15.473   16.910   13.665   20.791   7.3344   19.329   6.8855 1.461697 10.05997 
1 1 1   16   12   -9 o   28.986   4.9599   37.892   11.298   44.005   19.447   34.777   13.881   29.272   7.9473   26.920   6.4169 2.352079 10.21453 
1 1 1   16   12   -8 o   57.413   2.9544  138.673   13.780   0.0000   0.0000  138.673   13.780  ?   ?    57.413   2.9544 0.000000 2.954352 
1 1 1   16   12   -7 o   24.738   5.8239   28.729   11.548   0.0000   0.0000   28.729   11.548  ?   ?    24.738   5.8239 0.000000 5.823874 
1 1 1   16   12   -6 o   22.524   5.3049   23.421   9.5782   35.492   17.463   18.227   11.455   26.480   7.6578   19.742   6.3064 6.737955 9.920295 
1 1 1   16   12   -5 o   38.526   3.2490   63.045   10.108   84.572   18.752   54.227   12.002   43.203   5.4454   35.199   4.2701 8.003922 6.919960 
1 1 1   16   12   -4 f   12.631   5.2886   2.6618   9.1405   22.638   16.980  -5.4882   10.846   21.741   7.6821   11.326   5.1917 10.41501 9.271957 
1 1 1   16   12   -3 o   42.390   2.9817   75.766   10.237   79.393   18.977   74.277   12.158   41.623   5.7462   41.646   3.6174 -0.2289963E-01 6.790043 
1 1 1   16   12   -2 o   26.708   4.5674   31.791   9.5867   18.461   17.398   37.603   11.488   20.398   7.6846   28.830   5.0737 -8.432135 9.208442 
1 1 1   16   12   -1 o   13.990   5.5162   6.1300   9.2626   0.2574   17.317   8.4834   10.963   15.608   6.9038   15.534   6.0374 0.7354355E-01 9.171264 
1 1 1   16   12    0 o   15.925   5.7100   10.505   9.4132  -1.8545   17.215   15.776   11.243   15.137   6.7772   18.625   6.2649 -3.488637 9.229267 
1 1 1   16   12    1 o   16.440   5.7323   11.596   9.4334   0.2789   17.168   16.492   11.291   15.556   6.8777   18.951   6.2761 -3.395015 9.310913 
1 1 1   16   12    2 o   13.699   5.4940   5.3050   9.3401   9.9728   16.982   3.2805   11.184   17.818   7.3109   13.833   5.8245 3.984909 9.347457 
1 1 1   16   12    3 o   20.373   5.5911   19.331   9.5647   4.2652   17.484   25.765   11.426   16.545   7.1330   23.348   5.9783 -6.802786 9.306952 
1 1 1   16   12    4 f   15.232   5.6203   9.1051   9.2114  -5.3031   17.667   14.484   10.795   14.658   6.6838   17.990   6.1380 -3.332083 9.074630 
1 1 1   16   12    5 o   39.131   3.1851   64.925   10.072   91.864   19.032   54.446   11.870   45.187   5.2654   35.305   4.2074 9.882259 6.739879 
1 1 1   16   12    6 o   23.751   5.0242   25.714   9.4230   18.537   17.563   28.615   11.166   20.429   7.7156   24.775   5.6542 -4.345934 9.565544 
1 1 1   16   12    7 o   15.741   5.6668   10.194   9.2822   41.043   17.396  -2.0858   10.975   28.658   7.3967   12.208   5.4423 16.45046 9.183145 
1 1 1   16   12    8 o   11.406   5.1508  -3.4806   10.187   24.164   28.528  -7.5208   10.906   23.176   9.4887   10.920   5.0761 12.25630 10.76116 
1 1 1   16   12    9 o   27.118   5.4223   33.854   11.567   0.0000   0.0000   33.854   11.567  ?   ?    27.118   5.4223 0.000000 5.422322 
1 1 1   16   12   10 o   51.481   2.8977  111.459   12.111  156.989   31.995  103.844   13.085   57.203   7.0077   49.482   3.2622 7.721184 7.729793 
1 1 1   16   12   11 o   37.168   4.2048   60.357   12.516   82.085   29.049   55.403   13.870   38.894   9.2904   35.133   4.9826 3.760883 10.54220 
1 1 1   16   12   12 o   50.812   2.8980  108.631   11.953  121.006   19.502  101.185   15.128   52.420   4.6110   48.451   3.8624 3.969463 6.014967 
1 1 1   16   12   13 o   8.3576   4.1164 -19.3038   9.9370 -10.8246   16.470 -24.1569   12.460   13.164   6.1586   9.2868   4.5808 3.877189 7.675367 
1 1 1   16   12   14 o   57.693   2.6478  139.292   12.419  160.924   20.389  126.533   15.659   60.909   4.1310   54.419   3.5494 6.490612 5.446383 
1 1 1   16   12   15 f   45.980   2.8411   88.952   10.597   77.899   18.686   94.192   12.865   41.124   5.7295   47.019   3.3792 -5.894619 6.651778 
1 1 1   16   12   16 o   21.204   5.4431   20.996   9.4552   5.9905   16.783   27.974   11.444   16.628   7.0740   24.321   5.8453 -7.693773 9.176494 
1 1 1   16   12   17 o   27.973   4.4174   34.793   9.7387   40.532   17.604   32.262   11.691   28.227   7.5171   26.268   5.6290 1.958275 9.391109 
1 1 1   16   12   18 o   46.316   2.8498   90.347   10.707   85.363   19.056   92.647   12.943   43.161   5.5442   46.569   3.4338 -3.408104 6.521449 
1 1 1   16   12   19 o   16.445   5.6998   11.842   9.3196   15.241   17.482   10.493   11.015   19.232   7.5798   16.228   6.1145 3.004126 9.738597 
1 1 1   16   12   20 o   36.056   3.4674   55.815   10.066   62.742   18.121   52.724   12.105   36.259   6.3628   34.515   4.4026 1.744350 7.737458 
1 1 1   16   12   21 o   43.433   3.0268   79.903   10.649   95.796   19.213   72.855   12.794   45.956   5.2212   40.974   3.8767 4.982410 6.503022 
1 1 1   16   12   22 f   51.811   2.6085  112.526   10.981  127.302   19.931  106.085   13.158   53.596   4.6066   49.922   3.2512 3.674469 5.638353 
1 1 1   16   12   23 o   11.169   4.9805  -1.8577   9.1982 -19.2376   17.069   5.2549   10.919   12.141   5.8443   14.228   5.8529 -2.087127 8.271167 
1 1 1   16   12   24 o   42.555   3.3326   77.458   11.468   81.590   19.002   75.090   14.383   41.881   5.7151   41.233   4.3444 0.6481323 7.178819 
1 1 1   16   12   25 o   37.275   3.7641   60.354   11.280   70.409   18.322   54.216   14.315   38.575   6.0236   34.326   5.2854 4.248997 8.013720 
1 1 1   16   12   26 o   28.089   4.9785   36.167   10.982   43.333   18.155   32.032   13.791   28.798   7.6176   25.380   6.6037 3.418613 10.08150 
1 1 1   16   12   27 o   21.801   6.2631   23.326   11.718   29.763   22.998   21.070   13.618   23.455   8.8356   20.640   6.8943 2.814926 11.20706 
1 1 1   16   12   28 o   14.641   5.7700   7.4879   10.130   50.513   23.183  -2.6649   11.262   29.746   8.8835   12.053   5.4320 17.69241 10.41268 
1 1 1   16   12   29 o   23.246   5.5732   25.817   10.423   42.587   23.408   21.669   11.641   27.038   9.0391   20.965   6.3030 6.072788 11.01964 
1 1 1   16   12   30 f   14.304   5.4576   7.8003   8.8420   3.4013   14.191   10.592   11.305   14.797   6.4029   16.120   6.1660 -1.322567 8.889093 
1 1 1   16   12   31 o   23.183   4.9975   25.098   9.1657   55.607   14.863   6.3757   11.643   34.404   5.4838   14.701   6.0451 19.70288 8.161803 
1 1 1   16   12   32 o   14.637   5.5125   8.5865   8.9508   27.974   14.585  -3.1256   11.336   23.169   7.0741   11.913   5.4016 11.25548 8.900586 
1 1 1   16   12   33 o   26.440   4.8730   32.384   10.116   32.841   15.155   32.017   13.585   25.020   7.1016   25.107   6.5648 -0.8704567E-01 9.671094 
1 1 1   16   12   34 o   25.618   5.0044   30.703   10.075   29.586   15.029   31.615   13.579   23.636   7.1736   24.876   6.5917 -1.239878 9.742262 
1 1 1   16   12   35 o   41.619   3.1760   74.506   10.694   87.297   16.084   64.375   14.316   43.896   4.5616   37.452   4.7993 6.444202 6.621290 
1 1 1   16   12   36 o   16.077   5.8080   11.686   9.7607   24.659   14.792   1.6807   12.990   21.538   7.1852   13.718   6.0270 7.819686 9.378269 
1 1 1   16   12   37 o   30.594   4.1780   42.180   10.147   58.103   15.022   28.817   13.762   34.893   5.4604   23.389   6.8080 11.50402 8.727207 
1 1 1   16   12   38 o   31.443   4.4544   45.190   11.098   48.709   14.983   40.914   16.519   31.279   6.0956   27.470   7.2662 3.808548 9.484434 
1 1 1   16   12   39 o   23.957   5.8650   28.723   11.360   40.513   15.903   16.441   16.232   27.461   7.0642   18.467   7.2960 8.993418 10.15554 
1 1 1   16   12   40 o   38.955   3.7960   67.372   11.901   77.418   16.445   56.323   17.246   40.527   5.0898   32.991   6.6431 7.536491 8.368772 
1 1 1   16   12   41 o   31.245   5.1998   46.691   12.779   23.816   19.074   65.319   17.212   20.600   7.9753   36.160   6.0532 -15.56055 10.01235 
1 1 1   16   12   42 o   22.224   6.4602   26.118   12.399   11.807   18.313   38.231   16.848   17.326   7.3809   25.909   7.5304 -8.582750 10.54438 
1 1 1   16   12   43 o   16.394   6.2906   12.424   11.791   11.892   17.344   12.881   16.079   17.118   7.2329   17.175   7.0874 -0.5685425E-01 10.12652 
1 1 1   16   12   44 o   15.042   6.1142   8.7439   11.741   16.769   17.536   2.2234   15.807   18.335   7.4649   14.500   6.4929 3.835275 9.893553 
1 1 1   16   12   45 o   29.933   5.2501   43.598   12.343   24.815   17.925   60.535   17.022   20.570   7.7890   34.168   6.3450 -13.59759 10.04627 
1 1 1   16   12   46 o   19.172   6.9714   20.250   14.093   15.250   17.205   30.445   24.567   17.696   7.3197   21.433   8.7938 -3.736898 11.44152 
1 1 1   16   12   47 o   15.923   6.9891   8.0384   17.431   8.0384   17.431   0.0000   0.0000   15.923   6.9891  ?   ?  0.000000 6.989069 
1 1 1   16   12   48 o   16.379   6.6753   12.444   14.040   6.3848   16.741   26.811   25.778   15.343   6.7873   20.297   8.7044 -4.953305 11.03785 
1 1 1   16   12   49 o   12.287   5.5452  -0.2773   11.785   9.0894   17.936  -7.3930   15.633   16.076   7.0719   12.437   5.8747 3.639366 9.193656 
1 1 1   16   12   50 o   12.869   5.7020   2.1454   11.863  -4.6971   17.009   8.6262   16.553   13.278   6.2269   15.662   6.8443 -2.383895 9.253020 
1 1 1   16   12   51 o   14.994   5.8785   10.320   10.467   16.302   16.937   6.6246   13.314   17.533   7.2584   14.434   6.2236 3.099052 9.561206 
1 1 1   16   12   52 o   13.564   5.8325   5.2551   11.632 -14.4524   26.723   9.8617   12.920   14.513   7.0628   15.218   6.3231 -0.7054071 9.479735 
1 1 1   16   12   53 o   12.529   5.6094   1.1957   11.793 -33.3850   26.866   9.4481   13.125   13.011   6.4713   15.098   6.3305 -2.087685 9.052794 
1 1 1   16   12   54 o   13.106   5.8789   1.9067   13.020 -13.3734   26.857   6.6012   14.886   14.561   7.0852   14.699   6.4552 -0.1378880 9.584845 
1 1 1   16   12   55 o   22.467   6.8360   29.713   13.636   52.539   27.695   22.409   15.666   24.660   9.5926   19.161   7.2755 5.498970 12.03960 
1 1 1   16   12   56 o   13.089   6.0233  -0.6883   14.793   0.0000   0.0000  -0.6883   14.793  ?   ?    13.089   6.0233 0.000000 6.023269 
1 1 1   16   12   57 o   29.375   6.9705   50.220   16.438   0.0000   0.0000   50.220   16.438  ?   ?    29.375   6.9705 0.000000 6.970525 
1 1 1   16   12   58 o   13.730   6.2214   2.6709   15.010   0.0000   0.0000   2.6709   15.010  ?   ?    13.730   6.2214 0.000000 6.221439 
1 1 1   16   12   59 o   12.605   5.8655  -2.4876   14.622   0.0000   0.0000  -2.4876   14.622  ?   ?    12.605   5.8655 0.000000 5.865510 
1 1 1   16   12   60 o   12.559   5.8827  -3.5092   15.106   0.0000   0.0000  -3.5092   15.106  ?   ?    12.559   5.8827 0.000000 5.882699 
1 1 1   16   12   61 f   20.691   7.3956   28.003   15.778   0.0000   0.0000   28.003   15.778  ?   ?    20.691   7.3956 0.000000 7.395580 
1 1 1   16   12   62 o   20.088   7.4380   26.716   16.158   0.0000   0.0000   26.716   16.158  ?   ?    20.088   7.4380 0.000000 7.437961 
1 1 1   16   12   63 o   18.375   8.0258   23.053   22.734   0.0000   0.0000   23.053   22.734  ?   ?    18.375   8.0258 0.000000 8.025760 
1 1 1   16   12   64 o   22.261   8.7894   41.554   23.544   0.0000   0.0000   41.554   23.544  ?   ?    22.261   8.7894 0.000000 8.789362 
1 1 1   16   12   65 o   18.983   8.1854   27.048   23.032   0.0000   0.0000   27.048   23.032  ?   ?    18.983   8.1854 0.000000 8.185393 
1 1 1   16   12   66 o   13.684   6.5949  -7.0140   21.896   0.0000   0.0000  -7.0140   21.896  ?   ?    13.684   6.5949 0.000000 6.594921 
1 1 1   16   12   67 f   17.489   7.8195   19.612   22.833   0.0000   0.0000   19.612   22.833  ?   ?    17.489   7.8195 0.000000 7.819533 
1 1 1   16   12   68 o   10.172   5.1423 -46.0808   20.713   0.0000   0.0000 -46.0808   20.713  ?   ?    10.172   5.1423 0.000000 5.142300 
1 1 1   16   12   69 o   14.176   6.7983  -2.7991   22.610   0.0000   0.0000  -2.7991   22.610  ?   ?    14.176   6.7983 0.000000 6.798346 
1 1 1   16   12   70 o   15.431   7.1880   8.0850   22.046   0.0000   0.0000   8.0850   22.046  ?   ?    15.431   7.1880 0.000000 7.187998 
1 1 1   16   12   71 o   19.134   8.1922   29.863   22.765   0.0000   0.0000   29.863   22.765  ?   ?    19.134   8.1922 0.000000 8.192171 
1 1 1   16   12   72 o   14.721   6.9970   2.2204   22.848   0.0000   0.0000   2.2204   22.848  ?   ?    14.721   6.9970 0.000000 6.997042 
1 1 1   16   13  -67 o   13.282   6.3284  -3.2131   18.920  -3.2131   18.920   0.0000   0.0000   13.282   6.3284  ?   ?  0.000000 6.328394 
1 1 1   16   13  -65 o   19.629   8.7375   37.607   28.181   0.0000   0.0000   37.607   28.181  ?   ?    19.629   8.7375 0.000000 8.737550 
1 1 1   16   13  -64 o   15.679   7.4575   8.2708   26.046   0.0000   0.0000   8.2708   26.046  ?   ?    15.679   7.4575 0.000000 7.457540 
1 1 1   16   13  -63 o   13.171   6.4869 -15.7779   24.665   0.0000   0.0000 -15.7779   24.665  ?   ?    13.171   6.4869 0.000000 6.486913 
1 1 1   16   13  -62 o   17.747   8.0575   23.323   25.330   0.0000   0.0000   23.323   25.330  ?   ?    17.747   8.0575 0.000000 8.057500 
1 1 1   16   13  -61 o   25.100   9.4768   60.437   26.491   0.0000   0.0000   60.437   26.491  ?   ?    25.100   9.4768 0.000000 9.476789 
1 1 1   16   13  -60 o   20.238   8.7500   37.691   26.458   0.0000   0.0000   37.691   26.458  ?   ?    20.238   8.7500 0.000000 8.749992 
1 1 1   16   13  -59 o   22.412   9.3222   50.468   28.126   0.0000   0.0000   50.468   28.126  ?   ?    22.412   9.3222 0.000000 9.322203 
1 1 1   16   13  -58 o   18.922   8.4200   29.238   26.145   0.0000   0.0000   29.238   26.145  ?   ?    18.922   8.4200 0.000000 8.420049 
1 1 1   16   13  -57 o   10.543   5.1779 -18.1288   15.363   0.0000   0.0000 -18.1288   15.363  ?   ?    10.543   5.1779 0.000000 5.177896 
1 1 1   16   13  -56 o   16.399   6.9686   14.931   16.253   0.0000   0.0000   14.931   16.253  ?   ?    16.399   6.9686 0.000000 6.968585 
1 1 1   16   13  -55 o   13.981   6.3739   3.8197   16.056   0.0000   0.0000   3.8197   16.056  ?   ?    13.981   6.3739 0.000000 6.373909 
1 1 1   16   13  -54 o   11.045   5.3691 -14.0562   15.319   0.0000   0.0000 -14.0562   15.319  ?   ?    11.045   5.3691 0.000000 5.369050 
1 1 1   16   13  -53 o   18.492   6.6847   20.662   12.932   44.436   21.856   7.8546   16.042   23.685   8.6710   14.852   6.6029 8.833290 10.89881 
1 1 1   16   13  -52 o   15.153   6.2566   11.020   12.541  -1.4581   21.013   17.923   15.629   14.294   6.7694   17.357   7.0546 -3.063272 9.777111 
1 1 1   16   13  -51 o   10.745   5.1006  -7.2726   12.067 -24.5657   20.429   1.9951   14.955   11.712   5.7932   13.456   6.1409 -1.743999 8.442266 
1 1 1   16   13  -50 o   21.164   7.4804   29.651   16.101   4.6260   20.778   67.265   25.473   15.164   7.0345   28.858   9.4205 -13.69409 11.75712 
1 1 1   16   13  -49 o   16.391   6.9456   13.880   16.070   8.8745   20.817   21.263   25.280   15.890   7.2495   18.220   8.1810 -2.329562 10.93081 
1 1 1   16   13  -48 o   16.285   6.9006   13.337   15.861   11.034   20.116   17.122   25.787   16.236   7.2932   17.668   8.0634 -1.432125 10.87242 
1 1 1   16   13  -47 o   12.865   5.7627   2.1305   12.463  -7.6996   20.162   8.2086   15.854   13.483   6.4538   15.101   6.6457 -1.618021 9.263732 
1 1 1   16   13  -46 f   14.044   5.8847   7.5786   11.330   33.075   20.824  -3.1420   13.504   21.348   8.3143   12.159   5.6509 9.189094 10.05283 
1 1 1   16   13  -45 o   14.578   5.9787   9.1600   11.350   5.4868   20.486   10.787   13.634   15.480   7.1104   15.456   6.4644 0.2374458E-01 9.609718 
1 1 1   16   13  -44 o   15.761   6.1854   12.413   11.598   43.661   21.055  -1.1988   13.897   24.541   8.5635   12.702   5.8425 11.83879 10.36667 
1 1 1   16   13  -43 o   16.070   6.1969   13.226   11.482   19.760   20.895   10.400   13.743   18.249   7.8318   15.409   6.4705 2.840584 10.15890 
1 1 1   16   13  -42 f   28.735   5.2669   41.582   11.882   36.654   22.353   43.523   14.028   22.212   8.6243   28.310   6.2467 -6.097584 10.64896 
1 1 1   16   13  -41 o   25.502   5.8900   34.479   11.997   55.666   22.473   26.034   14.188   27.994   8.8200   20.827   7.0379 7.166550 11.28376 
1 1 1   16   13  -40 o   17.679   6.7308   17.274   13.430 -17.0230   22.510   36.231   16.735   13.276   6.4656   23.997   7.6177 -10.72091 9.991633 
1 1 1   16   13  -39 o   21.682   6.3114   26.034   11.827   31.400   17.645   21.657   15.937   22.011   7.8258   19.073   7.3147 2.937582 10.71206 
1 1 1   16   13  -38 o   24.827   6.2228   33.369   12.568   27.067   18.520   38.749   17.111   20.532   7.8824   24.942   7.6709 -4.410316 10.99887 
1 1 1   16   13  -37 o   25.633   5.9582   34.568   12.213   30.694   18.284   37.688   16.410   21.806   7.9389   24.947   7.4796 -3.141886 10.90738 
1 1 1   16   13  -36 o   14.117   5.9558   6.6175   11.731   4.7847   17.781   8.0300   15.610   15.211   6.8427   15.428   6.6954 -0.2172756 9.573445 
1 1 1   16   13  -35 o   12.350   5.5520  -0.0295   11.683   11.175   17.577  -8.8966   15.637   16.575   7.1488   12.263   5.8170 4.311445 9.216448 
1 1 1   16   13  -34 o   35.105   4.5280   57.809   12.656   32.352   18.618   79.676   17.255   22.590   8.0380   40.225   5.3986 -17.63534 9.682656 
1 1 1   16   13  -33 o   11.890   5.4268  -2.3000   11.682   2.8374   26.113  -3.5855   13.062   16.735   7.8045   12.217   5.6357 4.517545 9.626616 
1 1 1   16   13  -32 o   18.632   6.1725   18.182   10.920   14.576   18.242   20.195   13.633   17.687   7.4424   19.230   6.8744 -1.543081 10.13150 
1 1 1   16   13  -31 o   16.294   6.0865   12.706   10.865   17.555   17.859   9.8565   13.690   18.479   7.5297   15.773   6.5272 2.706835 9.964980 
1 1 1   16   13  -30 o   14.489   5.6949   8.5552   9.8449   17.024   14.389   1.1016   13.499   18.175   6.9554   13.471   6.0185 4.704310 9.197829 
1 1 1   16   13  -29 f   30.274   4.7721   43.203   11.387   47.682   15.318   37.671   17.024   30.263   6.4095   25.449   7.6154 4.813215 9.953707 
1 1 1   16   13  -28 o   12.222   5.2887   2.0795   9.6825  -0.3226   14.092   4.2278   13.327   13.427   6.0615   14.222   6.1791 -0.7944021 8.655809 
1 1 1   16   13  -27 o   11.786   5.1818   0.6630   9.6176  -0.5927   14.017   1.7802   13.221   13.365   6.0382   13.603   6.0238 -0.2382421 8.529130 
1 1 1   16   13  -26 o   15.395   5.7929   10.541   9.8798  -5.1436   14.340   24.714   13.631   12.620   5.8506   21.332   6.8858 -8.712642 9.035699 
1 1 1   16   13  -25 o   16.691   5.8524   13.432   9.8411   7.1881   14.357   18.967   13.516   15.381   6.5431   19.071   6.8416 -3.690509 9.466763 
1 1 1   16   13  -24 o   16.585   5.8459   13.150   9.8284   16.278   14.686   10.614   13.227   18.188   7.0097   16.137   6.5147 2.051649 9.569628 
1 1 1   16   13  -23 o   28.830   4.5001   38.331   10.230   60.074   15.348   20.948   13.723   35.253   5.5221   19.904   6.9155 15.34888 8.849716 
1 1 1   16   13  -22 o   31.398   4.1575   44.583   10.380   45.056   15.670   44.213   13.855   29.393   6.6908   29.861   5.9013 -0.4678326 8.921462 
1 1 1   16   13  -21 o   16.903   5.9100   13.670   10.031   13.849   15.162   13.531   13.378   17.574   7.0161   17.215   6.6752 0.3586445 9.684233 
1 1 1   16   13  -20 o   13.545   5.5575   5.5272   9.8124   8.2866   14.887   3.4073   13.048   15.957   6.7194   14.103   6.1209 1.853995 9.089280 
1 1 1   16   13  -19 o   26.859   4.8412   33.728   10.209   21.051   15.115   44.363   13.845   20.044   7.2293   30.048   5.8631 -10.00456 9.308022 
1 1 1   16   13  -18 o   12.197   5.5742  -3.6063   12.376   7.1319   14.666 -30.1652   23.065   15.638   6.6314   12.936   6.3513 2.702772 9.182317 
1 1 1   16   13  -17 o   16.064   6.1442   11.089   11.224   28.318   15.139  -9.9453   16.727   22.898   7.2423   12.962   6.1087 9.936119 9.474553 
1 1 1   16   13  -16 o   13.329   5.7103   3.1324   11.072  -4.0938   14.683   12.658   16.858   13.143   6.0307   17.669   7.2707 -4.525930 9.446329 
1 1 1   16   13  -15 o   32.438   3.8122   46.527   9.8881   32.365   15.718   55.804   12.721   24.481   7.3155   34.994   4.5685 -10.51290 8.624865 
1 1 1   16   13  -14 o   23.230   5.0826   25.557   9.3562   29.765   15.262   23.023   11.843   23.565   7.2441   21.304   6.3463 2.261293 9.630766 
1 1 1   16   13  -13 o   14.594   5.5614   8.5064   9.1739   20.438   15.208   1.6807   11.503   20.011   7.2468   13.139   5.7242 6.871778 9.234863 
1 1 1   16   13  -12 o   27.207   4.4153   33.654   9.4567   32.273   15.389   34.491   11.987   24.615   7.2091   26.687   5.6844 -2.072031 9.180653 
1 1 1   16   13  -11 o   19.218   5.5811   17.913   9.2582   32.281   14.966   9.0069   11.783   24.752   7.0678   15.529   6.1901 9.222900 9.395288 
1 1 1   16   13  -10 o   25.939   4.8979   31.298   9.9765   35.293   17.447   29.358   12.161   25.346   7.7368   24.272   6.1422 1.074049 9.878470 
1 1 1   16   13   -9 o   49.107   2.7940  102.276   11.138   91.920   19.274  107.468   13.648   44.222   5.4627   49.901   3.3750 -5.678326 6.421164 
1 1 1   16   13   -8 o   39.468   3.6943   68.106   11.747   45.799   18.075   84.417   15.456   29.247   7.5351   43.347   4.4369 -14.10033 8.744321 
1 1 1   16   13   -7 o   44.259   3.0222   83.655   10.838   65.348   18.502   93.218   13.372   36.290   6.4929   46.322   3.5690 -10.03220 7.409107 
1 1 1   16   13   -6 o   24.797   5.1579   28.973   10.086   37.273   17.565   24.891   12.319   26.145   7.7138   22.189   6.4362 3.955833 10.04628 
1 1 1   16   13   -5 o   43.816   3.0351   82.004   10.773   82.627   18.680   81.694   13.188   41.789   5.6266   43.194   3.7836 -1.405689 6.780473 
1 1 1   16   13   -4 o   32.031   3.9583   45.425   10.116   59.230   17.819   38.860   12.287   34.455   6.5844   28.607   5.4686 5.847754 8.559151 
1 1 1   16   13   -3 o   14.642   5.8615   7.3552   10.611 -42.0960   24.220   19.102   11.804   12.510   6.2091   19.633   6.4131 -7.123267 8.926418 
1 1 1   16   13   -2 o   38.045   3.6450   63.135   11.166   89.466   24.470   56.211   12.548   41.440   7.5210   35.323   4.4570 6.116726 8.742419 
1 1 1   16   13   -1 o   37.150   3.7397   60.421   11.171   72.726   24.729   57.267   12.521   36.041   8.5475   35.704   4.3949 0.3370171 9.611125 
1 1 1   16   13    0 o   12.931   5.4960   2.8858   10.114   33.262   22.589  -4.7295   11.310   24.004   8.8108   11.531   5.2919 12.47209 10.27781 
1 1 1   16   13    1 o   19.674   6.0109   18.983   10.528   29.029   26.461   17.094   11.476   22.808   9.2122   18.752   6.3295 4.056402 11.17703 
1 1 1   16   13    2 o   15.492   5.9626   9.5999   10.616   21.736   25.607   7.0810   11.666   21.180   8.8587   14.896   6.0795 6.283895 10.74422 
1 1 1   16   13    3 o   25.877   5.3613   31.771   10.937   27.750   27.380   32.535   11.930   22.533   9.2684   25.894   5.7967 -3.360416 10.93183 
1 1 1   16   13    4 o   15.698   5.8691   10.423   10.107   31.533   22.538   5.1086   11.308   23.486   8.7676   14.125   5.8960 9.360425 10.56567 
1 1 1   16   13    5 o   10.882   4.9209  -2.7791   9.3347  -2.3859   15.986  -2.9826   11.499   14.099   6.4012   12.012   5.4437 2.087227 8.402941 
1 1 1   16   13    6 o   11.871   5.1657   0.7310   9.3441  -1.6853   16.101   1.9582   11.474   14.273   6.4579   13.250   5.7454 1.023267 8.643708 
1 1 1   16   13    7 o   10.863   4.9185  -2.8890   9.3588 -38.1585   16.193   14.802   11.468   9.6881   4.8501   17.734   6.3087 -8.046163 7.957614 
1 1 1   16   13    8 o   9.0285   4.3335 -11.0863   9.2315  -2.8986   16.210 -15.0166   11.231   14.071   6.4107   9.6218   4.6582 4.448697 7.924393 
1 1 1   16   13    9 o   9.1374   4.4293 -14.2873   10.237   10.040   16.478 -29.5766   13.064   17.043   7.1158   8.9172   4.4476 8.125476 8.391445 
1 1 1   16   13   10 o   22.018   5.4208   23.334   9.6632   29.760   16.990   20.262   11.748   23.354   7.6975   20.105   6.3826 3.248371 9.999466 
1 1 1   16   13   11 o   14.762   5.6498   8.6492   9.4949   4.3335   16.475   10.796   11.619   15.624   6.8279   16.132   6.2301 -0.5073462 9.243123 
1 1 1   16   13   12 o   13.443   5.4914   5.2712   9.5277  -5.0427   16.425   10.501   11.697   13.721   6.3257   16.028   6.2343 -2.307823 8.881540 
1 1 1   16   13   13 o   29.601   4.2778   39.520   10.023   32.329   17.252   43.184   12.314   24.189   7.7406   30.334   5.1651 -6.144936 9.305668 
1 1 1   16   13   14 o   14.629   5.6250   8.4388   9.4413   24.881   16.865   0.9341   11.394   21.511   7.6506   12.878   5.6518 8.632246 9.511822 
1 1 1   16   13   15 o   26.148   4.7503   31.700   9.7521   55.019   17.632   21.423   11.705   32.739   6.8283   20.559   6.3484 12.17999 9.323547 
1 1 1   16   13   16 o   20.558   5.5179   20.627   9.4393   40.235   17.067   11.985   11.330   27.179   7.4723   16.451   6.2006 10.72794 9.709915 
1 1 1   16   13   17 o   12.640   5.4644   1.9606   10.317 -14.5379   16.469   12.617   13.236   12.198   5.8371   16.989   6.6250 -4.790314 8.829614 
1 1 1   16   13   18 o   13.844   5.8858   4.2656   11.605 -16.9022   16.567   24.658   16.261   11.913   5.7405   21.319   7.5190 -9.405190 9.459860 
1 1 1   16   13   19 o   21.555   6.3305   23.841   11.853   26.271   16.977   21.530   16.555   21.790   7.6830   20.197   7.5193 1.593208 10.75028 
1 1 1   16   13   20 o   23.637   5.6913   27.592   10.834   31.980   17.383   24.805   13.853   23.732   7.7841   21.577   6.9396 2.154873 10.42831 
1 1 1   16   13   21 o   40.913   3.1648   72.335   10.473   70.460   18.366   73.239   12.748   37.572   6.2137   40.584   3.9016 -3.011761 7.337053 
1 1 1   16   13   22 o   11.170   5.0821  -2.9516   10.142   1.7596   16.644  -5.7340   12.791   14.874   6.6614   11.900   5.5199 2.973722 8.651211 
1 1 1   16   13   23 o   14.508   5.7790   7.9195   10.263   6.7588   16.330   8.6773   13.195   15.846   6.8625   15.552   6.4193 0.2939997 9.396885 
1 1 1   16   13   24 o   25.032   5.3601   30.489   10.607   23.757   16.736   35.008   13.714   20.710   7.5868   25.886   6.5072 -5.176210 9.995170 
1 1 1   16   13   25 o   11.187   5.1029  -3.1042   10.310   11.174   16.313 -12.6006   13.303   16.870   7.0644   10.936   5.2365 5.934393 8.793586 
1 1 1   16   13   26 o   15.536   5.8839   10.730   10.230   9.4734   16.012   11.596   13.298   16.336   6.9282   16.403   6.5634 -0.6788445E-01 9.543437 
1 1 1   16   13   27 o   12.142   5.3240   1.1162   10.091   11.986   15.570  -6.7566   13.251   16.881   6.9711   11.840   5.5342 5.041061 8.900766 
1 1 1   16   13   28 o   12.634   5.4246   2.9184   10.034 -14.1519   15.274   15.881   13.310   11.560   5.5551   17.807   6.7186 -6.246964 8.717725 
1 1 1   16   13   29 f   14.157   5.7645   7.1382   10.459   17.283   16.094  -0.2786   13.761   18.394   7.2655   13.288   5.9951 5.106335 9.419565 
1 1 1   16   13   30 o   23.784   5.4952   28.204   10.440   27.659   15.510   28.656   14.116   21.945   7.3582   22.687   6.9655 -0.7422352 10.13217 
1 1 1   16   13   31 o   13.038   5.5458   4.0560   10.312   11.462   15.903  -1.3170   13.546   16.631   6.9706   12.935   5.8804 3.696454 9.119670 
1 1 1   16   13   32 o   19.549   6.0698   20.043   10.683   30.552   16.396   12.289   14.084   22.700   7.5645   16.526   6.7040 6.173769 10.10772 
1 1 1   16   13   33 o   14.267   5.9911   6.6699   11.783  -7.6626   22.524   12.069   13.825   14.651   6.9588   16.362   6.6404 -1.710932 9.618771 
1 1 1   16   13   34 o   19.471   6.9371   21.257   13.872   0.0000   0.0000   21.257   13.872  ?   ?    19.471   6.9371 0.000000 6.937091 
1 1 1   16   13   35 o   20.010   6.6298   22.280   12.599   3.5251   27.583   27.224   14.162   16.876   7.9190   21.715   7.0195 -4.838966 10.58225 
1 1 1   16   13   36 o   22.494   6.4814   27.963   12.531   22.220   17.995   33.370   17.461   19.359   7.6713   23.035   7.8073 -3.676203 10.94543 
1 1 1   16   13   37 o   16.434   6.0976   13.710   10.870   17.322   17.533   11.456   13.853   17.934   7.4007   15.959   6.5814 1.974734 9.903763 
1 1 1   16   13   38 o   47.564   3.2139   99.680   12.388   70.513   19.242  120.326   16.189   35.627   6.8746   51.396   3.8931 -15.76938 7.900425 
1 1 1   16   13   39 o   43.276   3.9002   85.591   13.611   53.386   19.092  118.872   19.409   29.371   7.8316   49.617   4.8611 -20.24605 9.217558 
1 1 1   16   13   40 o   18.935   6.2462   19.804   11.187   13.074   17.662   24.313   14.456   16.722   7.1888   20.153   7.0910 -3.430359 10.09757 
1 1 1   16   13   41 o   29.858   5.2548   44.693   12.323   38.799   23.108   47.036   14.566   22.693   8.7803   29.515   6.2493 -6.822376 10.77719 
1 1 1   16   13   42 f   14.102   6.2001   5.2839   13.768   0.0000   0.0000   5.2839   13.768  ?   ?    14.102   6.2001 0.000000 6.200108 
1 1 1   16   13   43 o   10.622   5.1171 -11.9291   13.149   0.0000   0.0000 -11.9291   13.149  ?   ?    10.622   5.1171 0.000000 5.117069 
1 1 1   16   13   44 o   12.932   5.9017   0.1058   13.811   0.0000   0.0000   0.1058   13.811  ?   ?    12.932   5.9017 0.000000 5.901670 
1 1 1   16   13   45 o   11.288   5.3602  -7.9227   13.345   0.0000   0.0000  -7.9227   13.345  ?   ?    11.288   5.3602 0.000000 5.360228 
1 1 1   16   13   46 f   24.311   6.9203   35.094   14.370   0.0000   0.0000   35.094   14.370  ?   ?    24.311   6.9203 0.000000 6.920349 
1 1 1   16   13   47 o   18.912   6.9377   21.582   14.002   0.0000   0.0000   21.582   14.002  ?   ?    18.912   6.9377 0.000000 6.937675 
1 1 1   16   13   48 o   13.549   6.2407   0.5818   15.932   0.0000   0.0000   0.5818   15.932  ?   ?    13.549   6.2407 0.000000 6.240674 
1 1 1   16   13   49 o   18.073   7.2909   20.094   16.553   0.0000   0.0000   20.094   16.553  ?   ?    18.073   7.2909 0.000000 7.290883 
1 1 1   16   13   50 o   24.873   7.7023   40.915   17.216   0.0000   0.0000   40.915   17.216  ?   ?    24.873   7.7023 0.000000 7.702282 
1 1 1   16   13   51 o   18.124   8.1489   21.555   25.178   0.0000   0.0000   21.555   25.178  ?   ?    18.124   8.1489 0.000000 8.148908 
1 1 1   16   13   52 o   20.100   8.5977   32.734   25.030   0.0000   0.0000   32.734   25.030  ?   ?    20.100   8.5977 0.000000 8.597667 
1 1 1   16   13   53 o   13.561   6.6251 -13.9618   24.155   0.0000   0.0000 -13.9618   24.155  ?   ?    13.561   6.6251 0.000000 6.625062 
1 1 1   16   13   54 o   11.143   5.4134 -13.8465   15.515   0.0000   0.0000 -13.8465   15.515  ?   ?    11.143   5.4134 0.000000 5.413379 
1 1 1   16   13   55 o   11.907   5.7128  -9.0601   16.008   0.0000   0.0000  -9.0601   16.008  ?   ?    11.907   5.7128 0.000000 5.712803 
1 1 1   16   13   56 o   14.137   6.4288   4.6524   16.204   0.0000   0.0000   4.6524   16.204  ?   ?    14.137   6.4288 0.000000 6.428756 
1 1 1   16   13   57 o   11.872   5.6917  -8.4948   15.818   0.0000   0.0000  -8.4948   15.818  ?   ?    11.872   5.6917 0.000000 5.691719 
1 1 1   16   13   58 o   20.077   7.4874   27.988   16.429   0.0000   0.0000   27.988   16.429  ?   ?    20.077   7.4874 0.000000 7.487383 
1 1 1   16   13   59 o   14.437   6.9144  -1.5552   23.214   0.0000   0.0000  -1.5552   23.214  ?   ?    14.437   6.9144 0.000000 6.914369 
1 1 1   16   13   60 o   14.020   6.7710  -5.3220   23.375   0.0000   0.0000  -5.3220   23.375  ?   ?    14.020   6.7710 0.000000 6.770997 
1 1 1   16   13   61 o   16.223   7.5230   12.833   23.733   0.0000   0.0000   12.833   23.733  ?   ?    16.223   7.5230 0.000000 7.523047 
1 1 1   16   13   62 o   12.674   6.2116 -14.8007   21.751   0.0000   0.0000 -14.8007   21.751  ?   ?    12.674   6.2116 0.000000 6.211603 
1 1 1   16   13   63 o   17.557   8.0092   22.596   25.405   0.0000   0.0000   22.596   25.405  ?   ?    17.557   8.0092 0.000000 8.009209 
1 1 1   16   14  -56 o   11.359   5.7389 -45.2022   25.578   0.0000   0.0000 -45.2022   25.578  ?   ?    11.359   5.7389 0.000000 5.738894 
1 1 1   16   14  -55 o   16.207   7.6031   14.091   25.396   0.0000   0.0000   14.091   25.396  ?   ?    16.207   7.6031 0.000000 7.603117 
1 1 1   16   14  -54 o   18.365   8.3154   29.381   26.754   0.0000   0.0000   29.381   26.754  ?   ?    18.365   8.3154 0.000000 8.315415 
1 1 1   16   14  -53 o   16.950   7.8924   18.786   26.539   0.0000   0.0000   18.786   26.539  ?   ?    16.950   7.8924 0.000000 7.892437 
1 1 1   16   14  -52 o   14.044   6.4053   5.3933   16.236   0.0000   0.0000   5.3933   16.236  ?   ?    14.044   6.4053 0.000000 6.405282 
1 1 1   16   14  -51 o   23.096   7.8554   39.018   17.678   0.0000   0.0000   39.018   17.678  ?   ?    23.096   7.8554 0.000000 7.855397 
1 1 1   16   14  -50 o   14.205   6.4817   5.4826   16.650   0.0000   0.0000   5.4826   16.650  ?   ?    14.205   6.4817 0.000000 6.481690 
1 1 1   16   14  -49 o   14.834   6.2985   10.540   13.259   10.762   21.938   10.413   16.643   15.797   7.2928   15.201   6.7438 0.5953283 9.932970 
1 1 1   16   14  -48 o   16.504   6.6121   16.007   13.515 -15.8471   22.401   34.236   16.946   12.782   6.2724   21.905   7.6798 -9.123413 9.915725 
1 1 1   16   14  -47 o   13.874   6.0891   6.7499   13.227   10.413   22.078   4.6989   16.521   15.820   7.3079   14.100   6.4424 1.719631 9.742198 
1 1 1   16   14  -46 o   10.589   5.1113 -10.9260   13.276  -1.5800   21.822 -16.4181   16.728   14.206   6.7763   11.189   5.4760 3.017530 8.712396 
1 1 1   16   14  -45 o   18.609   6.9142   22.011   13.985   5.0518   22.526   32.646   17.838   15.200   7.1402   21.210   7.8220 -6.009949 10.59088 
1 1 1   16   14  -44 o   10.222   4.9767 -13.9565   13.305 -16.4534   22.038 -12.5243   16.690   12.739   6.2452   11.653   5.6502 1.086249 8.421868 
1 1 1   16   14  -43 o   12.307   5.6801  -0.8473   13.294   19.797   22.388 -12.0906   16.522   17.564   7.8050   11.666   5.6484 5.897715 9.634415 
1 1 1   16   14  -42 o   12.892   5.8618   1.6963   13.465   18.940   22.063  -8.5394   16.998   17.452   7.7521   12.282   5.8913 5.170071 9.736688 
1 1 1   16   14  -41 o   10.432   5.0447 -11.9058   13.079 -11.5324   21.287 -12.1322   16.578   13.104   6.3605   11.710   5.6668 1.394624 8.518670 
1 1 1   16   14  -40 o   10.453   5.0624 -12.4570   13.295  -1.0384   21.415 -19.6185   16.960   14.357   6.8095   11.015   5.4157 3.342592 8.700505 
1 1 1   16   14  -39 o   26.388   6.8206   41.503   14.777   0.0000   0.0000   41.503   14.777  ?   ?    26.388   6.8206 0.000000 6.820584 
1 1 1   16   14  -38 o   15.001   6.4058   9.9094   13.853   0.0000   0.0000   9.9094   13.853  ?   ?    15.001   6.4058 0.000000 6.405805 
1 1 1   16   14  -37 o   13.544   6.1165   3.1959   14.365   0.0000   0.0000   3.1959   14.365  ?   ?    13.544   6.1165 0.000000 6.116497 
1 1 1   16   14  -36 o   24.218   6.2727   33.138   12.481   29.641   23.291   34.547   14.783   19.782   8.3713   23.598   7.1046 -3.815266 10.97974 
1 1 1   16   14  -35 o   23.598   6.3952   31.856   12.606   26.608   23.305   34.027   14.988   19.219   8.2598   23.335   7.1799 -4.115492 10.94419 
1 1 1   16   14  -34 o   32.793   4.9744   53.516   12.880   87.532   24.386   40.355   15.169   36.465   8.3802   25.925   7.0106 10.53956 10.92591 
1 1 1   16   14  -33 o   23.191   6.2947   30.354   12.202   17.070   22.424   35.941   14.543   17.521   7.7970   24.462   6.9614 -6.941898 10.45247 
1 1 1   16   14  -32 o   15.364   6.2274   11.378   12.140   3.6157   23.222   14.298   14.241   15.548   7.2863   16.463   6.7180 -0.9156160 9.910694 
1 1 1   16   14  -31 o   12.714   5.6566   2.4035   11.795   48.164   22.711 -14.4985   13.803   24.999   8.8795   10.508   5.1053 14.49091 10.24257 
1 1 1   16   14  -30 o   15.164   6.1874   10.685   12.080 -13.8774   22.583   20.529   14.297   13.431   6.5263   18.533   6.9696 -5.102792 9.548192 
1 1 1   16   14  -29 o   28.557   5.6318   42.478   12.644   54.967   24.630   38.009   14.733   26.228   9.2536   25.363   6.9305 0.8652477 11.56118 
1 1 1   16   14  -28 o   19.818   6.6099   22.916   12.519   22.464   23.704   23.091   14.742   18.696   8.1798   19.419   7.1195 -0.7233315 10.84416 
1 1 1   16   14  -27 o   14.877   6.3666   8.6008   13.738   11.072   23.227   7.2711   17.037   16.751   7.6479   15.197   6.7774 1.553876 10.21877 
1 1 1   16   14  -26 o   17.325   6.4611   16.567   12.234   20.304   23.807   15.226   14.260   18.378   8.1134   16.871   6.7808 1.506670 10.57390 
1 1 1   16   14  -25 o   17.796   6.5497   17.757   12.497   19.813   16.963   15.318   18.481   18.279   7.3783   17.182   7.3694 1.096985 10.42820 
1 1 1   16   14  -24 o   22.218   6.5935   28.320   12.803   38.292   17.535   16.936   18.736   24.292   7.8070   17.604   7.4813 6.687973 10.81290 
1 1 1   16   14  -23 o   9.9841   4.7819  -9.9087   11.106   2.6136   14.230 -29.4235   17.764   13.640   6.1299   10.602   5.2712 3.037910 8.084677 
1 1 1   16   14  -22 o   11.124   5.0508  -1.3962   9.9559   2.1113   14.245  -4.7458   13.920   13.554   6.1087   12.117   5.6665 1.436890 8.332133 
1 1 1   16   14  -21 o   14.531   5.7353   9.4340   10.022   0.0336   14.073   19.106   14.275   13.082   5.9653   18.271   6.9432 -5.189092 9.153844 
1 1 1   16   14  -20 o   22.888   5.5420   27.125   10.228   27.605   14.536   26.654   14.394   21.436   7.1220   21.098   7.0887 0.3380356 10.04853 
1 1 1   16   14  -19 o   31.228   4.2405   45.612   10.516   37.138   15.017   53.765   14.730   25.225   7.0379   32.247   5.8176 -7.022383 9.131096 
1 1 1   16   14  -18 f   19.094   5.9376   19.542   10.219   19.023   14.629   20.036   14.280   18.333   7.0138   18.702   6.9795 -0.3696537 9.894752 
1 1 1   16   14  -17 o   12.716   5.4520   3.9086   10.109  -1.2343   14.273   9.0855   14.320   12.976   5.9510   15.345   6.5314 -2.368402 8.835987 
1 1 1   16   14  -16 o   18.706   5.9584   18.654   10.232   19.093   14.599   18.231   14.343   18.429   7.0173   18.143   6.9441 0.2859116 9.872349 
1 1 1   16   14  -15 o   18.055   5.9816   17.269   10.256   27.759   14.688   7.2901   14.326   21.655   7.1579   14.929   6.4466 6.725545 9.632957 
1 1 1   16   14  -14 f   11.029   5.0226  -2.0953   9.9349   7.6402   14.220 -11.3788   13.886   15.015   6.4526   11.152   5.3428 3.863343 8.377411 
1 1 1   16   14  -13 o   10.945   5.0037  -2.5860   9.9842   3.2700   14.387  -8.0255   13.866   14.026   6.2434   11.671   5.5189 2.354909 8.332964 
1 1 1   16   14  -12 o   10.847   5.0383  -4.7192   10.712  -4.6082   16.717  -4.7965   13.953   13.287   6.2124   12.268   5.7157 1.019424 8.441759 
1 1 1   16   14  -11 o   21.518   6.5816   25.749   12.618   36.048   17.788   15.318   17.901   23.984   7.8747   17.591   7.3855 6.393877 10.79613 
1 1 1   16   14  -10 o   17.120   6.4494   15.049   12.254   4.0179   17.165   26.514   17.499   14.980   6.7324   20.805   7.7336 -5.824874 10.25346 
1 1 1   16   14   -9 o   9.0936   4.4747 -18.9823   11.651 -24.9125   16.248 -12.7046   16.717   10.575   5.2191   12.150   5.8319 -1.574999 7.826207 
1 1 1   16   14   -8 o   13.130   5.6346   4.0786   10.815 -17.8199   16.543   20.425   14.293   11.462   5.5734   19.110   7.0094 -7.647596 8.955145 
1 1 1   16   14   -7 o   12.951   5.5971   3.4399   10.817   12.672   16.765  -3.1447   14.158   16.886   7.1218   12.703   5.8623 4.183725 9.224290 
1 1 1   16   14   -6 o   20.426   6.5628   22.954   12.392   79.813   25.241   4.8963   14.224   35.411   8.7864   14.450   6.3290 20.96001 10.82856 
1 1 1   16   14   -5 o   22.173   6.4837   26.851   12.457  -2.6167   24.499   37.125   14.466   15.689   7.3936   25.922   6.7727 -10.23320 10.02666 
1 1 1   16   14   -4 o   17.853   6.9527   16.641   14.561   33.081   25.206   8.4061   17.839   21.863   8.9314   16.110   7.0708 5.753155 11.39154 
1 1 1   16   14   -3 o   13.053   5.5202   4.5543   10.117   12.567   17.077   0.2205   12.559   16.946   7.1695   12.811   5.7581 4.135434 9.195519 
1 1 1   16   14   -2 o   29.757   4.4171   41.345   10.390   53.807   17.536   34.603   12.897   31.131   7.0717   25.572   6.2427 5.559742 9.432928 
1 1 1   16   14   -1 o   11.333   5.0953  -0.9822   9.8426 -11.7459   16.266   5.2352   12.363   12.157   5.8129   14.014   6.0193 -1.857491 8.367909 
1 1 1   16   14    0 o   12.563   5.5163   1.8956   10.868   23.379   23.039  -4.2534   12.326   19.858   8.3605   11.762   5.4431 8.095524 9.976221 
1 1 1   16   14    1 o   20.412   6.2575   22.334   11.398   28.689   25.439   20.737   12.749   20.937   8.7982   19.452   6.6696 1.484804 11.04048 
1 1 1   16   14    2 o   15.379   5.8123   10.963   9.9707   2.6559   17.223   15.151   12.228   14.818   6.6941   17.245   6.4540 -2.426423 9.298659 
1 1 1   16   14    3 o   24.350   5.3064   29.454   10.234   33.717   17.328   27.170   12.683   23.475   7.7752   22.261   6.5512 1.213453 10.16718 
1 1 1   16   14    4 o   14.671   5.7407   9.2318   9.9661   9.3534   16.880   9.1668   12.348   16.137   6.9829   15.163   6.2293 0.9737949 9.357615 
1 1 1   16   14    5 o   19.667   6.6173   21.243   12.544   1.9522   23.972   28.515   14.719   16.187   7.5249   22.201   7.1544 -6.014097 10.38315 
1 1 1   16   14    6 o   21.925   6.0319   25.368   11.117   12.529   23.642   29.013   12.596   17.749   7.9449   23.103   6.4456 -5.353962 10.23071 
1 1 1   16   14    7 o   32.925   4.4693   50.741   11.686   38.227   24.773   54.322   13.253   23.062   9.0430   33.568   4.9954 -10.50607 10.33105 
1 1 1   16   14    8 o   25.592   5.6054   33.212   11.369   59.223   17.699   14.939   14.835   32.976   6.8100   17.282   6.9264 15.69364 9.713470 
1 1 1   16   14    9 o   13.348   5.8680   2.9620   12.331   11.163   17.042  -6.0498   17.865   16.520   7.0809   13.474   6.3385 3.046165 9.503422 
1 1 1   16   14   10 o   28.638   5.6515   41.548   12.724   38.268   17.806   44.971   18.190   24.826   7.8547   27.181   7.8019 -2.355141 11.07093 
1 1 1   16   14   11 o   19.916   6.5760   21.991   12.398   30.547   17.280   12.913   17.799   22.171   7.7564   16.999   7.2601 5.171455 10.62409 
1 1 1   16   14   12 o   20.615   6.1288   22.839   11.054   11.867   16.914   31.019   14.604   16.607   7.0846   23.105   7.0832 -6.498466 10.01810 
1 1 1   16   14   13 o   20.912   6.1021   23.486   11.044   16.643   17.210   28.276   14.400   17.826   7.3418   22.011   7.0747 -4.185772 10.19572 
1 1 1   16   14   14 f   12.393   5.4516   1.9230   10.658  -3.1049   16.233   5.7331   14.131   13.346   6.2003   14.514   6.3336 -1.168062 8.863296 
1 1 1   16   14   15 o   15.141   5.9520   10.404   10.755   10.860   16.122   10.038   14.436   16.168   6.9076   15.672   6.6092 0.4962187 9.560130 
1 1 1   16   14   16 o   20.055   6.0527   21.660   10.720   21.943   16.527   21.454   14.085   19.260   7.4326   19.309   6.9767 -0.4967117E-01 10.19405 
1 1 1   16   14   17 o   16.176   6.0614   13.153   10.793   15.584   16.672   11.399   14.160   17.381   7.1989   15.955   6.6237 1.425560 9.782535 
1 1 1   16   14   18 f   13.845   5.7272   7.0414   10.534   3.5450   15.786   9.8484   14.144   14.369   6.4572   15.492   6.5381 -1.123294 9.189205 
1 1 1   16   14   19 o   14.038   5.7664   7.6252   10.580  -7.2428   15.739   19.883   14.291   12.424   5.8764   18.615   6.9750 -6.190860 9.120456 
1 1 1   16   14   20 o   13.107   5.6253   4.5824   10.782  -2.5152   16.125   10.321   14.500   13.290   6.1760   15.627   6.6085 -2.336831 9.045174 
1 1 1   16   14   21 o   30.659   4.6894   45.310   11.348   28.678   16.792   59.289   15.394   21.204   7.6235   33.856   5.7858 -12.65177 9.570438 
1 1 1   16   14   22 o   31.636   4.5395   47.806   11.371   49.594   17.021   46.365   15.282   29.045   7.2203   28.813   6.6426 0.2311916 9.811074 
1 1 1   16   14   23 o   17.519   6.1273   16.632   10.783   16.742   15.973   16.540   14.615   17.467   7.1196   17.372   6.9039 0.9518623E-01 9.917308 
1 1 1   16   14   24 o   11.499   5.3257  -3.4464   11.837   1.9722   15.770 -10.4376   17.913   13.926   6.3363   12.623   6.0531 1.302165 8.762895 
1 1 1   16   14   25 o   11.132   5.2126  -5.2801   11.842   7.1391   15.877 -20.8507   17.778   14.995   6.6226   11.378   5.5845 3.616995 8.662927 
1 1 1   16   14   26 o   15.263   6.4662   9.8305   13.923   7.1318   21.546   11.765   18.243   15.950   7.3138   16.344   7.1626 -0.3931684 10.23696 
1 1 1   16   14   27 o   18.873   6.5880   20.583   12.462   45.769   22.759   9.7972   14.893   24.459   8.8642   15.392   6.6088 9.066767 11.05670 
1 1 1   16   14   28 o   17.048   6.4516   15.955   12.294   24.376   21.933   12.097   14.845   19.123   8.1093   15.967   6.7160 3.155950 10.52929 
1 1 1   16   14   29 o   14.634   6.1045   8.9518   12.111  -6.7776   21.594   16.171   14.629   13.981   6.6886   17.106   6.8704 -3.124424 9.588500 
1 1 1   16   14   30 o   21.563   6.4761   26.766   12.294   32.301   22.975   24.546   14.553   20.744   8.5068   19.945   7.1055 0.7996998 11.08390 
1 1 1   16   14   31 o   15.752   6.2614   12.508   12.024   26.309   21.786   6.4625   14.419   19.465   8.1583   14.423   6.3428 5.041831 10.33387 
1 1 1   16   14   32 o   24.559   6.7832   35.445   14.028   35.064   22.483   35.688   17.950   21.408   8.5447   22.862   7.9110 -1.454140 11.64460 
1 1 1   16   14   33 o   11.256   5.2461  -4.0630   11.768 -37.0323   20.844   11.360   14.257   10.955   5.4869   15.600   6.5728 -4.645814 8.562020 
1 1 1   16   14   34 o   13.253   5.8015   4.5177   11.939   31.898   22.234  -6.5762   14.153   20.563   8.3929   11.747   5.5611 8.816100 10.06811 
1 1 1   16   14   35 o   21.825   6.4855   27.756   12.380   21.948   22.461   30.290   14.838   18.330   7.9921   21.890   7.1923 -3.560568 10.75187 
1 1 1   16   14   36 o   14.022   5.9828   7.3622   12.065   30.440   22.394  -2.0766   14.322   20.067   8.3301   12.530   5.8219 7.537770 10.16296 
1 1 1   16   14   37 o   32.877   4.9463   53.970   12.846   53.550   24.277   54.133   15.139   25.370   9.1605   31.460   6.1235 -6.090839 11.01872 
1 1 1   16   14   38 o   12.556   5.8021  -1.0186   13.933   0.0000   0.0000  -1.0186   13.933  ?   ?    12.556   5.8021 0.000000 5.802094 
1 1 1   16   14   39 o   11.261   5.3903  -8.9960   14.069   0.0000   0.0000  -8.9960   14.069  ?   ?    11.261   5.3903 0.000000 5.390270 
1 1 1   16   14   40 o   14.410   6.5706   4.8532   17.073   0.0000   0.0000   4.8532   17.073  ?   ?    14.410   6.5706 0.000000 6.570568 
1 1 1   16   14   41 o   37.437   4.9681   70.340   14.787   58.309   23.824   77.880   18.859   26.713   9.1185   37.192   6.4546 -10.47922 11.17183 
1 1 1   16   14   42 o   13.602   6.0885   4.4578   13.884   10.760   23.205   0.9441   17.327   16.181   7.4808   13.757   6.3960 2.423900 9.842368 
1 1 1   16   14   43 o   11.869   5.5589  -3.5618   13.482 -26.4836   22.696   8.9364   16.759   12.082   5.9988   15.087   6.7255 -3.005245 9.012121 
1 1 1   16   14   44 o   12.534   5.7637   0.0394   13.513   13.734   23.158  -7.0317   16.640   16.541   7.5838   12.339   5.8943 4.202076 9.605026 
1 1 1   16   14   45 o   17.644   7.3319   20.100   17.374   0.0000   0.0000   20.100   17.374  ?   ?    17.644   7.3319 0.000000 7.331885 
1 1 1   16   14   46 o   20.135   7.6630   29.051   17.404   0.0000   0.0000   29.051   17.404  ?   ?    20.135   7.6630 0.000000 7.663044 
1 1 1   16   14   47 o   15.898   6.9902   13.057   17.505   0.0000   0.0000   13.057   17.505  ?   ?    15.898   6.9902 0.000000 6.990167 
1 1 1   16   14   48 o   16.815   7.1360   17.274   17.005   0.0000   0.0000   17.274   17.005  ?   ?    16.815   7.1360 0.000000 7.136024 
1 1 1   16   14   49 o   16.517   7.0360   16.185   16.640   0.0000   0.0000   16.185   16.640  ?   ?    16.517   7.0360 0.000000 7.036015 
1 1 1   16   14   50 o   12.513   5.9596  -5.1516   16.745   0.0000   0.0000  -5.1516   16.745  ?   ?    12.513   5.9596 0.000000 5.959590 
1 1 1   16   14   51 o   12.301   5.8609  -5.4421   16.227   0.0000   0.0000  -5.4421   16.227  ?   ?    12.301   5.8609 0.000000 5.860943 
1 1 1   16   14   52 o   19.153   7.4704   26.365   16.831   0.0000   0.0000   26.365   16.831  ?   ?    19.153   7.4704 0.000000 7.470406 
1 1 1   16   14   53 o   12.454   5.9083  -3.8818   16.139   0.0000   0.0000  -3.8818   16.139  ?   ?    12.454   5.9083 0.000000 5.908317 
1 1 1   16   14   54 o   14.582   7.0249   0.1179   24.784   0.0000   0.0000   0.1179   24.784  ?   ?    14.582   7.0249 0.000000 7.024943 
1 1 1   16   14   55 o   15.252   7.2596   6.5723   24.771   0.0000   0.0000   6.5723   24.771  ?   ?    15.252   7.2596 0.000000 7.259616 
1 1 1   16   14   56 o   20.211   8.7020   39.860   25.956   0.0000   0.0000   39.860   25.956  ?   ?    20.211   8.7020 0.000000 8.701963 
1 1 1   16   15  -48 o   16.761   7.5971   19.074   22.402   0.0000   0.0000   19.074   22.402  ?   ?    16.761   7.5971 0.000000 7.597076 
1 1 1   16   15  -47 o   14.591   6.9160   4.4489   22.022   0.0000   0.0000   4.4489   22.022  ?   ?    14.591   6.9160 0.000000 6.916004 
1 1 1   16   15  -46 o   13.712   6.3528   3.7877   16.865   0.0000   0.0000   3.7877   16.865  ?   ?    13.712   6.3528 0.000000 6.352797 
1 1 1   16   15  -45 o   13.057   6.1500  -0.3528   16.910   0.0000   0.0000  -0.3528   16.910  ?   ?    13.057   6.1500 0.000000 6.150019 
1 1 1   16   15  -44 o   13.489   6.2814   2.5531   16.812   0.0000   0.0000   2.5531   16.812  ?   ?    13.489   6.2814 0.000000 6.281406 
1 1 1   16   15  -43 o   15.461   6.8724   12.737   17.368   0.0000   0.0000   12.737   17.368  ?   ?    15.461   6.8724 0.000000 6.872377 
1 1 1   16   15  -42 o   9.7879   4.8100 -16.3883   13.322   4.2093   21.784 -28.6919   16.837   14.586   6.9034   9.9438   4.9733 4.642633 8.508257 
1 1 1   16   15  -41 o   10.894   5.2380  -8.7800   13.624   7.2234   21.839 -18.9753   17.431   15.022   7.0482   11.002   5.4251 4.019905 8.894287 
1 1 1   16   15  -40 o   18.310   6.8693   22.160   13.870   23.922   22.687   21.108   17.527   17.717   7.8659   17.471   7.3199 0.2457428 10.74489 
1 1 1   16   15  -39 o   11.816   5.5608  -3.3669   13.774 -17.0192   22.162   5.2244   17.581   12.486   6.1494   14.200   6.5461 -1.713970 8.981429 
1 1 1   16   15  -38 o   11.406   5.4209  -5.8682   13.711 -18.9835   22.374   2.0196   17.351   12.392   6.1171   13.658   6.3669 -1.265961 8.829327 
1 1 1   16   15  -37 o   13.916   6.1649   6.8986   13.861   9.5386   22.689   5.3265   17.508   15.555   7.2612   14.252   6.5564 1.303030 9.783284 
1 1 1   16   15  -36 o   12.711   5.8417   1.2022   13.853 -20.2286   21.925   15.442   17.872   12.207   6.0315   16.271   7.1111 -4.064174 9.324506 
1 1 1   16   15  -35 o   14.491   6.3234   9.0219   14.086  -0.5410   23.026   14.741   17.806   14.373   6.8841   16.139   7.0746 -1.766718 9.871237 
1 1 1   16   15  -34 o   10.684   5.1664 -11.0649   13.713 -20.2913   22.216  -5.3864   17.429   12.298   6.0756   12.647   6.0390 -0.3486013 8.566322 
1 1 1   16   15  -33 f   25.582   6.8586   40.429   14.594   75.378   23.993   19.908   18.386   31.238   8.9584   17.350   7.3935 13.88812 11.61537 
1 1 1   16   15  -32 o   12.933   5.9751   0.7564   14.767   11.870   23.321  -6.6813   19.078   16.071   7.4542   12.934   6.2139 3.136354 9.704478 
1 1 1   16   15  -31 o   12.915   5.9874   0.1833   15.017   14.382   22.472 -11.2732   20.185   16.430   7.5095   12.705   6.1727 3.725425 9.720838 
1 1 1   16   15  -30 o   15.283   6.5758   11.435   14.804   33.820   22.839  -4.7841   19.441   20.120   8.3872   13.291   6.3552 6.828773 10.52305 
1 1 1   16   15  -29 o   28.096   6.1187   44.313   13.615   58.169   25.405   38.730   16.127   25.298   9.3339   24.066   7.4551 1.232708 11.94570 
1 1 1   16   15  -28 o   9.4915   4.6674 -17.2485   12.609 -26.4483   23.192 -13.3877   15.024   12.144   6.0356   10.939   5.3174 1.204829 8.043813 
1 1 1   16   15  -27 o   15.812   6.4481   13.588   13.109   11.575   24.147   14.429   15.610   16.232   7.5482   16.163   6.8470 0.6962585E-01 10.19105 
1 1 1   16   15  -26 o   17.159   6.6266   17.602   13.144 -11.6366   24.014   30.106   15.705   13.597   6.6346   21.072   7.3928 -7.474969 9.933326 
1 1 1   16   15  -25 o   15.662   6.5984   12.689   14.366   0.8415   23.989   19.314   17.939   14.905   7.1084   17.450   7.3637 -2.544895 10.23487 
1 1 1   16   15  -24 o   11.675   5.4373  -2.8109   12.606   6.0147   22.880  -6.6578   15.106   15.406   7.2240   11.909   5.6684 3.497685 9.182433 
1 1 1   16   15  -23 o   29.176   5.8477   46.235   13.423   37.729   24.362   49.942   16.084   20.907   8.6845   28.795   6.9354 -7.887859 11.11398 
1 1 1   16   15  -22 o   11.300   5.3321  -5.3801   12.816   28.757   24.543 -18.1778   15.027   19.092   8.3389   10.424   5.1198 8.668477 9.785138 
1 1 1   16   15  -21 o   16.729   6.5605   16.161   13.040   28.842   24.416   11.101   15.423   19.152   8.3419   15.400   6.6693 3.752352 10.68020 
1 1 1   16   15  -20 o   18.838   6.7052   21.803   12.956   1.8841   24.534   29.507   15.258   15.174   7.2231   21.128   7.2944 -5.954384 10.26553 
1 1 1   16   15  -19 o   20.703   6.6524   26.074   12.733   27.527   23.874   25.497   15.052   19.011   8.2651   19.744   7.2009 -0.7326527 10.96196 
1 1 1   16   15  -18 o   21.036   6.1763   25.430   11.283   2.3321   17.153   43.047   14.981   13.969   6.4490   26.848   6.8300 -12.87860 9.393527 
1 1 1   16   15  -17 f   11.915   5.3674   0.9070   10.983   15.496   16.729 -10.1460   14.561   16.643   7.0709   11.271   5.4185 5.371774 8.908322 
1 1 1   16   15  -16 o   12.431   5.4913   2.9916   10.921   11.235   16.158  -3.9409   14.818   15.599   6.7904   12.307   5.7842 3.292322 8.920051 
1 1 1   16   15  -15 o   24.794   5.8215   33.426   11.563   36.462   17.644   31.140   15.309   22.858   7.8460   21.853   7.3101 1.004934 10.72363 
1 1 1   16   15  -14 o   12.240   5.4599   2.0110   11.062   2.0202   16.682   2.0037   14.779   13.860   6.3847   13.382   6.1062 0.4787226 8.834623 
1 1 1   16   15  -13 o   14.933   6.2078   10.359   12.461  -1.0657   23.359   14.904   14.733   14.769   7.0353   16.473   6.7896 -1.703738 9.777225 
1 1 1   16   15  -12 o   15.429   6.3037   11.884   12.557   46.125   24.046  -0.9570   14.725   23.400   8.9821   12.826   5.9402 10.57349 10.76864 
1 1 1   16   15  -11 o   17.867   6.5730   18.783   12.584  -1.4570   23.590   26.833   14.877   14.789   7.0517   20.439   7.1933 -5.650008 10.07327 
1 1 1   16   15  -10 f   10.616   4.9637  -4.5584   10.673   7.1658   15.839 -14.3110   14.446   14.719   6.5514   10.723   5.2126 3.996221 8.372053 
1 1 1   16   15   -9 o   11.200   5.2353  -4.2860   11.863  -6.6457   16.042  -1.4388   17.622   12.337   5.8634   13.567   6.3546 -1.230280 8.646401 
1 1 1   16   15   -8 o   14.377   6.5367   4.4760   16.745   4.4760   16.745   0.0000   0.0000   14.377   6.5367  ?   ?  0.000000 6.536687 
1 1 1   16   15   -7 o   12.863   5.7001   3.2635   11.858   9.9526   16.231  -4.3935   17.366   15.419   6.7569   13.070   6.1793 2.348684 9.156355 
1 1 1   16   15   -6 o   12.803   5.7212   2.5577   12.205  -6.0787   16.365   13.379   18.319   12.536   5.9477   16.409   7.1848 -3.873331 9.327240 
1 1 1   16   15   -5 o   16.936   6.4222   16.121   12.197   16.274   16.785   15.951   17.755   16.995   7.1445   16.953   7.2461 0.4197311E-01 10.17598 
1 1 1   16   15   -4 o   15.120   6.4447   10.021   13.975  -8.0380   22.802   20.884   17.685   13.951   6.7254   18.191   7.4621 -4.240132 10.04560 
1 1 1   16   15   -3 o   20.789   7.0645   27.088   14.297   10.195   16.919   69.276   26.738   15.588   6.8623   28.693   9.6614 -13.10538 11.85046 
1 1 1   16   15   -2 o   12.383   5.7191  -1.4706   13.510   16.330   16.273 -40.9598   24.237   17.007   7.0838   11.626   5.8363 5.381270 9.178375 
1 1 1   16   15   -1 o   12.422   5.7474  -1.6692   13.734   1.2886   16.432  -8.5228   25.013   13.750   6.3349   14.352   6.9493 -0.6023693 9.403388 
1 1 1   16   15    0 o   10.984   5.2801 -10.6401   13.821 -14.0508   16.473  -2.5305   25.401   11.532   5.5970   15.038   7.2103 -3.505969 9.127694 
1 1 1   16   15    1 o   16.376   6.7237   14.329   14.376   14.849   16.812   12.913   27.728   16.655   7.0827   17.094   7.9950 -0.4390182 10.68103 
1 1 1   16   15    2 o   17.129   6.8159   16.814   14.262   20.530   17.044   8.1374   26.045   18.136   7.3684   16.355   7.6812 1.780392 10.64399 
1 1 1   16   15    3 o   23.257   6.9830   33.098   14.295   42.348   17.141   11.965   25.908   25.492   7.6447   16.832   7.8242 8.659819 10.93893 
1 1 1   16   15    4 o   18.418   7.5483   21.824   18.076   25.271   24.723   17.865   26.495   18.854   8.2981   17.674   8.1066 1.180077 11.60070 
1 1 1   16   15    5 o   27.110   5.9002   39.689   12.668   27.122   17.613   53.156   18.233   19.967   7.6815   28.959   7.6215 -8.991920 10.82096 
1 1 1   16   15    6 o   12.355   5.5848   0.9229   12.008  -8.7376   16.328   12.302   17.722   12.150   5.8134   16.123   7.0629 -3.973690 9.147703 
1 1 1   16   15    7 o   16.444   6.3949   14.811   12.305   7.6721   17.269   22.175   17.538   15.099   6.7720   18.527   7.4938 -3.427849 10.10031 
1 1 1   16   15    8 o   14.030   5.9822   7.4271   12.049 -13.1813   16.413   31.517   17.746   11.599   5.6191   21.288   7.8100 -9.689334 9.621315 
1 1 1   16   15    9 o   15.509   6.2305   12.196   12.033   16.386   16.720   7.6945   17.331   16.987   7.1353   15.097   6.7765 1.890697 9.840443 
1 1 1   16   15   10 f   10.696   5.0690  -6.9354   11.819 -13.4910   16.114   0.6981   17.388   11.447   5.5509   13.842   6.4260 -2.394838 8.491508 
1 1 1   16   15   11 o   10.430   4.9798  -8.5645   11.844  -1.0788   16.052 -17.5086   17.546   13.197   6.1426   11.477   5.6153 1.719602 8.322416 
1 1 1   16   15   12 o   11.204   5.3775  -9.9467   14.215 -19.6742   23.218  -4.1146   17.978   12.869   6.3293   13.240   6.2676 -0.3706312 8.907480 
1 1 1   16   15   13 o   17.548   6.5963   18.070   12.803   7.7239   23.342   22.521   15.312   15.893   7.4010   18.795   7.1792 -2.901231 10.31098 
1 1 1   16   15   14 o   16.001   6.3969   13.698   12.621   33.737   23.696   5.7618   14.912   20.457   8.5366   14.191   6.3339 6.266290 10.62971 
1 1 1   16   15   15 o   13.854   5.8319   7.6328   11.208   8.3957   16.705   7.0082   15.115   15.068   6.7161   14.494   6.4285 0.5738592 9.296883 
1 1 1   16   15   16 o   12.483   5.5109   3.1091   10.984   6.6199   16.552   0.3464   14.683   14.668   6.6000   13.017   5.9940 1.650967 8.915603 
1 1 1   16   15   17 f   13.160   5.7112   5.2170   11.357   4.9394   16.875   5.4469   15.355   14.391   6.5504   14.180   6.3708 0.2100897 9.137605 
1 1 1   16   15   18 o   14.886   6.0341   10.817   11.399   16.214   16.837   6.2484   15.489   16.805   7.1147   14.361   6.4294 2.443741 9.589359 
1 1 1   16   15   19 o   11.698   5.4347  -2.6057   12.472   38.538   22.751 -20.2805   14.912   21.616   8.6062   10.175   5.0176 11.44050 9.962039 
1 1 1   16   15   20 o   11.057   5.2263  -5.9492   12.410   7.8516   23.693 -11.1669   14.568   15.812   7.3940   11.111   5.3612 4.701343 9.133099 
1 1 1   16   15   21 o   16.982   6.5217   16.836   12.680   39.933   23.348   7.1735   15.102   21.723   8.6952   14.444   6.4150 7.278952 10.80547 
1 1 1   16   15   22 o   14.851   6.2154   10.396   12.617   36.128   23.654   0.1636   14.916   20.722   8.5780   12.980   6.0000 7.741703 10.46817 
1 1 1   16   15   23 o   19.712   6.6575   23.893   12.696   14.602   23.649   27.655   15.048   16.711   7.6626   20.444   7.2312 -3.733351 10.53588 
1 1 1   16   15   24 o   13.373   5.9289   4.7677   12.845   13.470   23.320   0.9775   15.390   16.509   7.5845   13.243   6.1119 3.266303 9.740575 
1 1 1   16   15   25 o   9.2178   4.5541 -19.3340   12.492 -19.8326   22.247 -19.1044   15.097   12.482   6.1499   10.340   5.0892 2.141516 7.982519 
1 1 1   16   15   26 o   9.4614   4.6485 -16.8754   12.418 -41.5766   22.716  -6.3473   14.830   11.026   5.5506   11.848   5.6331 -0.8218212 7.908293 
1 1 1   16   15   27 o   25.724   6.3831   38.342   13.321   80.608   24.233   20.041   15.946   33.201   8.8096   17.693   7.1495 15.50729 11.34566 
1 1 1   16   15   28 o   18.257   6.9767   21.380   14.464   19.587   23.389   22.490   18.405   17.384   7.8318   18.129   7.5409 -0.7451744 10.87204 
1 1 1   16   15   29 o   15.310   6.3697   12.045   13.135   36.511   24.278   1.9191   15.618   20.464   8.5970   13.408   6.1770 7.055926 10.58599 
1 1 1   16   15   30 o   25.803   6.4783   39.128   13.604 -10.5925   23.257   64.990   16.773   13.475   6.5647   33.910   6.2999 -20.43547 9.098573 
1 1 1   16   15   31 o   13.052   6.0095   1.3200   14.752  -7.5532   22.464   8.0484   19.561   13.603   6.5861   15.147   6.9541 -1.544191 9.577905 
1 1 1   16   15   32 o   15.756   6.6866   13.415   14.932   24.762   23.378   5.5971   19.405   18.145   8.0239   14.701   6.8124 3.443312 10.52573 
1 1 1   16   15   33 f   13.239   6.2320  -1.1442   17.321   10.739   22.265 -19.3612   27.567   15.788   7.3093   13.492   6.6836 2.296403 9.904353 
1 1 1   16   15   34 o   12.954   5.9507   1.6368   14.351   27.414   23.029 -14.7289   18.350   18.580   8.0969   11.797   5.7656 6.782452 9.939964 
1 1 1   16   15   35 o   14.175   6.7825  -1.1358   22.224  -1.1358   22.224   0.0000   0.0000   14.175   6.7825  ?   ?  0.000000 6.782526 
1 1 1   16   15   36 o   18.275   7.0439   22.247   14.831   52.836   24.479   4.5082   18.642   23.901   9.0901   14.323   6.6509 9.577507 11.26341 
1 1 1   16   15   37 o   11.528   5.4825  -5.9425   14.071 -28.6904   23.025   7.6162   17.776   11.814   5.8943   14.697   6.7027 -2.882973 8.925706 
1 1 1   16   15   38 o   10.188   4.9890 -15.4976   13.948  -8.3436   23.054 -19.6278   17.517   13.500   6.5679   11.013   5.4320 2.487328 8.523144 
1 1 1   16   15   39 o   8.3408   4.2157 -35.2975   13.877 -63.8745   22.484 -17.7113   17.638   9.6917   4.9443   11.220   5.5180 -1.528376 7.409044 
1 1 1   16   15   40 o   16.311   6.6910   16.154   14.220   3.4018   22.956   24.095   18.114   14.693   6.9922   18.166   7.5121 -3.473148 10.26266 
1 1 1   16   15   41 o   24.369   7.0524   38.623   14.806   33.047   23.634   42.225   18.996   19.297   8.3059   23.205   8.1314 -3.907675 11.62357 
1 1 1   16   15   42 o   19.478   7.0795   26.078   14.531   29.112   23.681   24.246   18.403   18.489   8.1298   18.091   7.5341 0.3976402 11.08402 
1 1 1   16   15   43 o   11.802   5.5568  -3.0741   13.783  -4.9203   22.378  -1.9457   17.495   13.585   6.5765   12.971   6.1530 0.6134501 9.006142 
1 1 1   16   15   44 o   15.157   6.8491   11.066   18.042   0.0000   0.0000   11.066   18.042  ?   ?    15.157   6.8491 0.000000 6.849128 
1 1 1   16   15   45 o   9.3872   4.7313 -35.7221   16.783   0.0000   0.0000 -35.7221   16.783  ?   ?    9.3872   4.7313 0.000000 4.731253 
1 1 1   16   15   46 o   18.015   7.4215   23.805   17.591   0.0000   0.0000   23.805   17.591  ?   ?    18.015   7.4215 0.000000 7.421503 
1 1 1   16   15   47 o   13.369   6.5028  -7.2190   22.571   0.0000   0.0000  -7.2190   22.571  ?   ?    13.369   6.5028 0.000000 6.502797 
1 1 1   16   15   48 o   11.589   5.7740 -26.0053   21.761   0.0000   0.0000 -26.0053   21.761  ?   ?    11.589   5.7740 0.000000 5.773986 
1 1 1   16   16    0 o   18.883   7.6390   16.253   18.228   35.721   24.856  -6.3984   26.811   24.128   9.1636   16.593   7.7929 7.534801 12.02916 
1 1 1   16   16    1 o   13.719   5.9864   7.1588   12.624   4.1622   17.450   10.449   18.285   14.013   6.4817   15.239   6.8895 -1.225533 9.459331 
1 1 1   16   16    2 o   11.423   5.3666  -3.6258   12.730 -13.6638   17.384   7.9814   18.694   11.573   5.6463   14.847   6.8096 -3.274277 8.846003 
1 1 1   16   16    3 o   22.677   6.6372   31.916   13.048   16.338   17.941   49.408   19.011   16.401   7.1470   25.851   8.1077 -9.450140 10.80812 
1 1 1   16   16    4 o   13.875   6.4374   3.3935   17.411   3.3935   17.411   0.0000   0.0000   13.875   6.4374  ?   ?  0.000000 6.437394 
1 1 1   16   16    5 o   18.841   7.1440   24.343   15.092   27.627   17.999   16.570   27.693   19.201   7.6515   16.678   7.8601 2.522423 10.96929 
1 1 1   16   16    6 o   23.778   7.1806   37.382   15.084   33.190   18.049   47.092   27.470   20.831   7.8315   21.339   9.0633 -0.5082912 11.97814 
1 1 1   16   16    7 o   10.403   5.0243 -10.3768   12.871 -18.1686   17.196  -0.4482   19.411   11.037   5.4321   13.678   6.4861 -2.640463 8.460333 
1 1 1   16   16    8 o   15.058   6.5678   11.157   15.179   39.139   25.735  -3.7729   18.797   20.210   8.6825   13.110   6.2633 7.099454 10.70588 
1 1 1   16   16    9 o   15.470   6.3529   13.294   12.837   8.4982   17.743   18.562   18.595   14.796   6.7278   16.859   7.3122 -2.063717 9.936345 
1 1 1   16   16   10 o   10.152   4.9168 -11.1733   12.546  -2.9968   17.338 -20.1598   18.177   12.867   6.1098   11.145   5.5038 1.722325 8.223207 
1 1 1   16   16   11 o   17.751   7.0476   21.138   15.216   14.355   26.330   24.539   18.644   16.325   7.6845   18.233   7.5875 -1.908369 10.79912 
1 1 1   16   16   12 o   22.945   7.3365   36.050   15.500   44.220   25.660   31.356   19.449   21.194   8.8665   19.832   7.9367 1.361578 11.89989 
1 1 1   16   16   13 o   18.403   7.1317   23.282   15.263   34.388   25.206   16.852   19.178   19.356   8.4524   16.469   7.2759 2.886642 11.15261 
1 1 1   16   16   14 o   15.812   6.6967   14.373   14.925  -8.4617   24.553   27.756   18.796   13.692   6.6870   19.002   7.7313 -5.309159 10.22201 
1 1 1   16   16   15 o   14.765   6.4840   10.148   15.019   15.809   26.203   7.3783   18.329   16.460   7.7222   14.637   6.7241 1.823686 10.23945 
1 1 1   16   16   16 o   12.578   5.8537  -0.1408   14.567 -15.2305   23.531   9.2362   18.549   12.894   6.3473   14.976   6.8364 -2.082368 9.328754 
1 1 1   16   16   17 o   14.380   6.3981   8.4585   15.091   15.432   25.756   4.8128   18.623   16.376   7.6744   14.246   6.6262 2.130013 10.13913 
1 1 1   16   16   18 f   19.092   7.2061   25.578   15.314  106.097   26.576 -14.4545   18.739   37.943   8.7683   11.825   5.7893 26.11798 10.50712 
1 1 1   16   16   19 o   17.925   7.5840   23.922   19.110   0.0000   0.0000   23.922   19.110  ?   ?    17.925   7.5840 0.000000 7.583961 
1 1 1   16   16   20 o   16.307   7.1824   16.552   18.554   0.0000   0.0000   16.552   18.554  ?   ?    16.307   7.1824 0.000000 7.182427 
1 1 1   16   16   21 o   17.911   7.5446   23.922   18.776   0.0000   0.0000   23.922   18.776  ?   ?    17.911   7.5446 0.000000 7.544559 
1 1 1   16   16   22 o   12.453   5.8109  -0.4489   14.511   5.1484   24.182  -3.5987   18.141   14.921   7.1216   12.878   6.1527 2.042106 9.411280 
1 1 1   16   16   23 o   9.1275   4.5624 -25.8267   14.075 -26.4584   23.197 -25.4586   17.706   11.878   5.9247   10.465   5.2131 1.412530 7.891680 
1 1 1   16   16   24 o   16.521   6.7946   17.438   14.712   12.055   24.140   20.618   18.556   15.719   7.3864   17.100   7.3600 -1.380943 10.42723 
1 1 1   16   16   25 o   18.860   7.5112   26.961   17.335   8.3025   23.201   50.544   26.083   15.152   7.1571   22.002   9.0478 -6.850284 11.53632 
1 1 1   16   16   26 o   12.946   6.1241  -1.0736   17.109   6.8558   23.694  -9.7106   24.729   14.994   7.1264   13.452   6.5992 1.542105 9.712620 
1 1 1   16   16   27 o   14.409   6.5649   8.0713   16.999  -5.4321   23.438   23.059   24.692   13.612   6.6224   17.169   7.8566 -3.556985 10.27536 
1 1 1   16   16   28 o   13.308   6.2468   1.4642   17.188   14.243   23.472 -13.3124   25.240   15.870   7.4007   13.200   6.5124 2.670769 9.858109 
1 1 1   16   16   29 o   13.051   6.1595  -0.1567   17.118 -33.9520   23.134   40.733   25.447   11.307   5.6799   20.041   8.6224 -8.733926 10.32502 
1 1 1   16   16   30 o   12.157   5.8259  -5.5317   16.536  -6.1874   22.385  -4.7442   24.531   13.346   6.4881   13.831   6.7392 -0.4850311 9.354745 
1 1 1   16   16   31 o   9.5554   4.7905 -29.4576   16.064 -10.4707   21.753 -52.2294   23.823   12.810   6.2644   10.477   5.3200 2.333541 8.218588 
1 1 1   16   16   32 o   12.398   5.8102  -0.7844   14.765   40.262   24.331 -24.7080   18.575   20.242   8.5605   10.753   5.3538 9.488528 10.09681 
1 1 1   16   16   33 o   11.291   5.6819 -36.4296   23.690   0.0000   0.0000 -36.4296   23.690  ?   ?    11.291   5.6819 0.000000 5.681901 
1 1 1   16   16   34 o   11.616   5.8216 -31.0983   23.624   0.0000   0.0000 -31.0983   23.624  ?   ?    11.616   5.8216 0.000000 5.821605 
1 1 1   16   16   35 o   11.942   5.9622 -26.7591   23.724   0.0000   0.0000 -26.7591   23.724  ?   ?    11.942   5.9622 0.000000 5.962158 
1 1 1   17    0 -113 o   27.733   11.843   63.116   27.281   63.116   27.281   63.116   27.281   27.733   11.843   27.733   11.843 0.000000 0.000000 
1 1 1   17    0 -112 o   7.0870   5.1686 -33.5818   17.728 -33.5818   17.728 -33.5818   17.728   7.0870   5.1686   7.0870   5.1686 0.000000 0.000000 
1 1 1   17    0 -111 o   9.7436   6.7531  -7.1605   18.543  -7.1605   18.543  -7.1605   18.543   9.7436   6.7531   9.7436   6.7531 0.000000 0.000000 
1 1 1   17    0 -110 o   15.581   9.0495   20.721   18.845   20.721   18.845   20.721   18.845   15.581   9.0495   15.581   9.0495 0.000000 0.000000 
1 1 1   17    0 -109 f   10.121   6.9523  -4.8631   18.616  -4.8631   18.616  -4.8631   18.616   10.121   6.9523   10.121   6.9523 0.000000 0.000000 
1 1 1   17    0 -108 o   8.5907   6.1000 -16.8210   18.141 -16.8210   18.141 -16.8210   18.141   8.5907   6.1000   8.5907   6.1000 0.000000 0.000000 
1 1 1   17    0 -107 o   7.9711   5.7420 -25.3283   18.580 -25.3283   18.580 -25.3283   18.580   7.9711   5.7420   7.9711   5.7420 0.000000 0.000000 
1 1 1   17    0 -106 o   11.823   7.7547   4.8804   18.694   4.8804   18.694   4.8804   18.694   11.823   7.7547   11.823   7.7547 0.000000 0.000000 
1 1 1   17    0 -105 o   10.755   7.2217  -0.2185   17.870  -0.2185   17.870  -0.2185   17.870   10.755   7.2217   10.755   7.2217 0.000000 0.000000 
1 1 1   17    0 -104 o   15.457   8.8961   19.225   17.958   19.225   17.958   19.225   17.958   15.457   8.8961   15.457   8.8961 0.000000 0.000000 
1 1 1   17    0 -103 o   10.910   7.2868   0.5097   17.765   0.5097   17.765   0.5097   17.765   10.910   7.2868   10.910   7.2868 0.000000 0.000000 
1 1 1   17    0 -102 o   9.0820   6.3774 -13.1529   18.105 -13.1529   18.105 -13.1529   18.105   9.0820   6.3774   9.0820   6.3774 0.000000 0.000000 
1 1 1   17    0 -101 o   25.198   9.9282   43.352   19.579   43.352   19.579   43.352   19.579   25.198   9.9282   25.198   9.9282 0.000000 0.000000 
1 1 1   17    0 -100 o   13.904   8.5109   13.166   18.417   13.166   18.417   13.166   18.417   13.904   8.5109   13.904   8.5109 0.000000 0.000000 
1 1 1   17    0  -99 o   9.2599   6.4415 -10.1853   17.281 -10.1853   17.281 -10.1853   17.281   9.2599   6.4415   9.2599   6.4415 0.000000 0.000000 
1 1 1   17    0  -98 o   16.086   8.9814   19.834   17.570   19.834   17.570   19.834   17.570   16.086   8.9814   16.086   8.9814 0.000000 0.000000 
1 1 1   17    0  -97 o   17.303   9.3176   22.981   18.193   22.981   18.193   22.981   18.193   17.303   9.3176   17.303   9.3176 0.000000 0.000000 
1 1 1   17    0  -96 o   13.316   8.2779   9.8095   18.072   9.8095   18.072   9.8095   18.072   13.316   8.2779   13.316   8.2779 0.000000 0.000000 
1 1 1   17    0  -95 o   12.566   7.9351   7.0742   17.313   7.0742   17.313   7.0742   17.313   12.566   7.9351   12.566   7.9351 0.000000 0.000000 
1 1 1   17    0  -94 f   17.659   8.4052   21.388   13.806   21.388   13.806   21.388   13.806   17.659   8.4052   17.659   8.4052 0.000000 0.000000 
1 1 1   17    0  -93 o   10.507   6.7796   2.1724   13.492   2.1724   13.492   2.1724   13.492   10.507   6.7796   10.507   6.7796 0.000000 0.000000 
1 1 1   17    0  -92 o   20.348   8.4799   26.241   14.049   26.241   14.049   26.241   14.049   20.348   8.4799   20.348   8.4799 0.000000 0.000000 
1 1 1   17    0  -91 o   36.490   5.1554   59.898   14.454   59.898   14.454   59.898   14.454   36.490   5.1554   36.490   5.1554 0.000000 0.000000 
1 1 1   17    0  -90 o   43.239   4.2700   80.800   14.689   80.800   14.689   80.800   14.689   43.239   4.2700   43.239   4.2700 0.000000 0.000000 
1 1 1   17    0  -89 o   30.530   6.2863   44.459   13.818   44.459   13.818   44.459   13.818   30.530   6.2863   30.530   6.2863 0.000000 0.000000 
1 1 1   17    0  -88 o   19.269   8.2914   23.319   13.358   23.319   13.358   23.319   13.358   19.269   8.2914   19.269   8.2914 0.000000 0.000000 
1 1 1   17    0  -87 o   11.317   7.3140   1.7796   15.789   1.7796   15.789   1.7796   15.789   11.317   7.3140   11.317   7.3140 0.000000 0.000000 
1 1 1   17    0  -86 o   50.317   2.1209  104.403   8.6637  104.403   8.6637  104.403   8.6637   50.317   2.1209   50.317   2.1209 0.000000 0.000000 
1 1 1   17    0  -85 o   17.352   6.2628   16.833   8.1191   16.833   8.1191   16.833   8.1191   17.352   6.2628   17.352   6.2628 0.000000 0.000000 
1 1 1   17    0  -84 o   16.510   6.5937   15.978   8.5949   15.978   8.5949   15.978   8.5949   16.510   6.5937   16.510   6.5937 0.000000 0.000000 
1 1 1   17    0  -83 o   10.070   5.8377   5.5044   7.8183   5.5044   7.8183   5.5044   7.8183   10.070   5.8377   10.070   5.8377 0.000000 0.000000 
1 1 1   17    0  -82 o   41.705   4.4469   74.907   14.685   74.907   14.685   74.907   14.685   41.705   4.4469   41.705   4.4469 0.000000 0.000000 
1 1 1   17    0  -81 o   20.829   8.3941   25.947   13.889   25.947   13.889   25.947   13.889   20.829   8.3941   20.829   8.3941 0.000000 0.000000 
1 1 1   17    0  -80 o   32.099   3.8940   44.471   9.7901   44.471   9.7901   44.471   9.7901   32.099   3.8940   32.099   3.8940 0.000000 0.000000 
1 1 1   17    0  -79 f   7.0472   4.8114  -4.8947   8.6183  -4.8947   8.6183  -4.8947   8.6183   7.0472   4.8114   7.0472   4.8114 0.000000 0.000000 
1 1 1   17    0  -78 o   25.127   5.3258   29.503   9.5936   29.503   9.5936   29.503   9.5936   25.127   5.3258   25.127   5.3258 0.000000 0.000000 
1 1 1   17    0  -77 o   56.032   2.7490  129.793   12.487  129.793   12.487  129.793   12.487   56.032   2.7490   56.032   2.7490 0.000000 0.000000 
1 1 1   17    0  -76 o   11.778   6.6080   8.0504   9.5680   8.0504   9.5680   8.0504   9.5680   11.778   6.6080   11.778   6.6080 0.000000 0.000000 
1 1 1   17    0  -75 o   53.119   2.7790  116.682   11.957  116.682   11.957  116.682   11.957   53.119   2.7790   53.119   2.7790 0.000000 0.000000 
1 1 1   17    0  -74 o   46.245   3.0779   88.955   11.483   88.955   11.483   88.955   11.483   46.245   3.0779   46.245   3.0779 0.000000 0.000000 
1 1 1   17    0  -73 o   9.3782   5.9223   1.8216   9.6447   1.8216   9.6447   1.8216   9.6447   9.3782   5.9223   9.3782   5.9223 0.000000 0.000000 
1 1 1   17    0  -72 o   13.265   6.8600   10.840   9.5479   10.840   9.5479   10.840   9.5479   13.265   6.8600   13.265   6.8600 0.000000 0.000000 
1 1 1   17    0  -71 o   9.4761   6.0595   0.9745   10.474   0.9745   10.474   0.9745   10.474   9.4761   6.0595   9.4761   6.0595 0.000000 0.000000 
1 1 1   17    0  -70 o   15.752   7.6588   15.365   11.536   15.365   11.536   15.365   11.536   15.752   7.6588   15.752   7.6588 0.000000 0.000000 
1 1 1   17    0  -69 o   13.977   7.0672   12.027   9.9956   12.027   9.9956   12.027   9.9956   13.977   7.0672   13.977   7.0672 0.000000 0.000000 
1 1 1   17    0  -68 o   23.377   6.1599   26.749   10.141   26.749   10.141   26.749   10.141   23.377   6.1599   23.377   6.1599 0.000000 0.000000 
1 1 1   17    0  -67 o   8.6437   5.6434  -0.9187   9.7369  -0.9187   9.7369  -0.9187   9.7369   8.6437   5.6434   8.6437   5.6434 0.000000 0.000000 
1 1 1   17    0  -66 o   63.504   2.5699  165.664   13.254  165.664   13.254  165.664   13.254   63.504   2.5699   63.504   2.5699 0.000000 0.000000 
1 1 1   17    0  -65 o   10.791   6.4474   5.1797   10.050   5.1797   10.050   5.1797   10.050   10.791   6.4474   10.791   6.4474 0.000000 0.000000 
1 1 1   17    0  -64 o   36.698   3.9375   57.082   11.437   57.082   11.437   57.082   11.437   36.698   3.9375   36.698   3.9375 0.000000 0.000000 
1 1 1   17    0  -63 o  104.037   2.2526  442.615   19.083  442.615   19.083  442.615   19.083  104.037   2.2526  104.037   2.2526 0.000000 0.000000 
1 1 1   17    0  -62 o   6.3003   4.5058 -16.2623   10.590 -16.2623   10.590 -16.2623   10.590   6.3003   4.5058   6.3003   4.5058 0.000000 0.000000 
1 1 1   17    0  -61 o   78.838   2.9376  255.110   18.819  255.110   18.819  255.110   18.819   78.838   2.9376   78.838   2.9376 0.000000 0.000000 
1 1 1   17    0  -60 o   94.471   2.4288  365.147   18.676  365.147   18.676  365.147   18.676   94.471   2.4288   94.471   2.4288 0.000000 0.000000 
1 1 1   17    0  -59 o   11.569   6.9300   5.7945   11.668   5.7945   11.668   5.7945   11.668   11.569   6.9300   11.569   6.9300 0.000000 0.000000 
1 1 1   17    0  -58 o   7.9571   5.4527  -7.4203   11.296  -7.4203   11.296  -7.4203   11.296   7.9571   5.4527   7.9571   5.4527 0.000000 0.000000 
1 1 1   17    0  -57 o   93.445   2.9632  357.795   22.520  357.795   22.520  357.795   22.520   93.445   2.9632   93.445   2.9632 0.000000 0.000000 
1 1 1   17    0  -56 o  113.505   2.8049  527.098   25.916  527.098   25.916  527.098   25.916  113.505   2.8049  113.505   2.8049 0.000000 0.000000 
1 1 1   17    0  -55 f   67.584   3.4625  188.156   18.960  188.156   18.960  188.156   18.960   67.584   3.4625   67.584   3.4625 0.000000 0.000000 
1 1 1   17    0  -54 o   14.019   7.3867   11.746   11.222   11.746   11.222   11.746   11.222   14.019   7.3867   14.019   7.3867 0.000000 0.000000 
1 1 1   17    0  -53 o   60.349   2.8356  149.678   13.879  149.678   13.879  149.678   13.879   60.349   2.8356   60.349   2.8356 0.000000 0.000000 
1 1 1   17    0  -52 o   68.796   3.0364  194.400   16.952  194.400   16.952  194.400   16.952   68.796   3.0364   68.796   3.0364 0.000000 0.000000 
1 1 1   17    0  -51 o   76.869   2.8564  242.221   17.842  242.221   17.842  242.221   17.842   76.869   2.8564   76.869   2.8564 0.000000 0.000000 
1 1 1   17    0  -50 o   15.557   8.0446   14.591   13.129   14.591   13.129   14.591   13.129   15.557   8.0446   15.557   8.0446 0.000000 0.000000 
1 1 1   17    0  -49 o   10.593   6.7564   1.1222   12.920   1.1222   12.920   1.1222   12.920   10.593   6.7564   10.593   6.7564 0.000000 0.000000 
1 1 1   17    0  -48 o   7.6519   5.2993  -9.4238   11.363  -9.4238   11.363  -9.4238   11.363   7.6519   5.2993   7.6519   5.2993 0.000000 0.000000 
1 1 1   17    0  -47 o   31.752   5.9315   45.347   13.782   45.347   13.782   45.347   13.782   31.752   5.9315   31.752   5.9315 0.000000 0.000000 
1 1 1   17    0  -46 o   94.330   2.3337  363.667   17.919  363.667   17.919  363.667   17.919   94.330   2.3337   94.330   2.3337 0.000000 0.000000 
1 1 1   17    0  -45 o  127.721   1.9126  665.706   19.902  665.706   19.902  665.706   19.902  127.721   1.9126  127.721   1.9126 0.000000 0.000000 
1 1 1   17    0  -44 o   32.047   4.2888   44.162   10.642   44.162   10.642   44.162   10.642   32.047   4.2888   32.047   4.2888 0.000000 0.000000 
1 1 1   17    0  -43 o  114.432   1.9477  534.471   18.156  534.471   18.156  534.471   18.156  114.432   1.9477  114.432   1.9477 0.000000 0.000000 
1 1 1   17    0  -42 o   28.376   5.5746   36.487   11.475   36.487   11.475   36.487   11.475   28.376   5.5746   28.376   5.5746 0.000000 0.000000 
1 1 1   17    0  -41 f   72.795   2.6408  217.043   15.624  217.043   15.624  217.043   15.624   72.795   2.6408   72.795   2.6408 0.000000 0.000000 
1 1 1   17    0  -40 o   43.111   3.2309   77.127   11.204   77.127   11.204   77.127   11.204   43.111   3.2309   43.111   3.2309 0.000000 0.000000 
1 1 1   17    0  -39 o   27.830   5.8545   35.557   11.693   35.557   11.693   35.557   11.693   27.830   5.8545   27.830   5.8545 0.000000 0.000000 
1 1 1   17    0  -38 o   40.689   4.6837   70.295   15.001   70.295   15.001   70.295   15.001   40.689   4.6837   40.689   4.6837 0.000000 0.000000 
1 1 1   17    0  -37 o   85.101   2.8078  296.422   19.430  296.422   19.430  296.422   19.430   85.101   2.8078   85.101   2.8078 0.000000 0.000000 
1 1 1   17    0  -36 o   67.786   3.1556  188.713   17.350  188.713   17.350  188.713   17.350   67.786   3.1556   67.786   3.1556 0.000000 0.000000 
1 1 1   17    0  -35 o   55.640   4.0967  128.458   18.344  128.458   18.344  128.458   18.344   55.640   4.0967   55.640   4.0967 0.000000 0.000000 
1 1 1   17    0  -34 o   58.957   3.0638  142.961   14.633  142.961   14.633  142.961   14.633   58.957   3.0638   58.957   3.0638 0.000000 0.000000 
1 1 1   17    0  -33 o   16.370   8.0804   16.180   12.916   16.180   12.916   16.180   12.916   16.370   8.0804   16.370   8.0804 0.000000 0.000000 
1 1 1   17    0  -32 o  209.465   3.2503  1791.56   55.466  1791.56   55.466  1791.56   55.466  209.465   3.2503  209.465   3.2503 0.000000 0.000000 
1 1 1   17    0  -31 o  157.800   2.4879  1016.30   31.984  1016.30   31.984  1016.30   31.984  157.800   2.4879  157.800   2.4879 0.000000 0.000000 
1 1 1   17    0  -30 o  240.628   2.5642  2362.29   50.283  2362.29   50.283  2362.29   50.283  240.628   2.5642  240.628   2.5642 0.000000 0.000000 
1 1 1   17    0  -29 o  315.609   3.0238  4064.65   77.777  4064.65   77.777  4064.65   77.777  315.609   3.0238  315.609   3.0238 0.000000 0.000000 
1 1 1   17    0  -28 o  246.690   2.6097  2482.85   52.465  2482.85   52.465  2482.85   52.465  246.690   2.6097  246.690   2.6097 0.000000 0.000000 
1 1 1   17    0  -27 o   64.864   3.5737  173.255   18.763  173.255   18.763  173.255   18.763   64.864   3.5737   64.864   3.5737 0.000000 0.000000 
1 1 1   17    0  -26 o   5.2357   3.8603 -37.1916   12.055 -37.1916   12.055 -37.1916   12.055   5.2357   3.8603   5.2357   3.8603 0.000000 0.000000 
1 1 1   17    0  -25 o   36.614   4.4015   57.060   12.634   57.060   12.634   57.060   12.634   36.614   4.4015   36.614   4.4015 0.000000 0.000000 
1 1 1   17    0  -24 o  254.273   2.6140  2637.72   54.167  2637.72   54.167  2637.72   54.167  254.273   2.6140  254.273   2.6140 0.000000 0.000000 
1 1 1   17    0  -23 o  104.289   2.2147  444.087   18.808  444.087   18.808  444.087   18.808  104.289   2.2147  104.289   2.2147 0.000000 0.000000 
1 1 1   17    0  -22 o  108.339   2.1723  479.169   19.167  479.169   19.167  479.169   19.167  108.339   2.1723  108.339   2.1723 0.000000 0.000000 
1 1 1   17    0  -21 o  124.376   2.1327  631.312   21.608  631.312   21.608  631.312   21.608  124.376   2.1327  124.376   2.1327 0.000000 0.000000 
1 1 1   17    0  -20 o   36.068   4.1928   55.215   11.893   55.215   11.893   55.215   11.893   36.068   4.1928   36.068   4.1928 0.000000 0.000000 
1 1 1   17    0  -19 o  190.501   2.5807  1480.81   40.059  1480.81   40.059  1480.81   40.059  190.501   2.5807  190.501   2.5807 0.000000 0.000000 
1 1 1   17    0  -18 o  192.919   2.5823  1518.61   40.592  1518.61   40.592  1518.61   40.592  192.919   2.5823  192.919   2.5823 0.000000 0.000000 
1 1 1   17    0  -17 o  148.549   2.3921  900.533   28.949  900.533   28.949  900.533   28.949  148.549   2.3921  148.549   2.3921 0.000000 0.000000 
1 1 1   17    0  -16 o   25.121   6.7846   30.804   12.006   30.804   12.006   30.804   12.006   25.121   6.7846   25.121   6.7846 0.000000 0.000000 
1 1 1   17    0  -15 o   78.466   2.5666  251.889   16.376  251.889   16.376  251.889   16.376   78.466   2.5666   78.466   2.5666 0.000000 0.000000 
1 1 1   17    0  -14 o   44.941   4.3132   84.693   15.445   84.693   15.445   84.693   15.445   44.941   4.3132   44.941   4.3132 0.000000 0.000000 
1 1 1   17    0  -13 o  214.471   3.3093  1877.82   57.823  1877.82   57.823  1877.82   57.823  214.471   3.3093  214.471   3.3093 0.000000 0.000000 
1 1 1   17    0  -12 o   61.681   3.5998  156.807   17.957  156.807   17.957  156.807   17.957   61.681   3.5998   61.681   3.5998 0.000000 0.000000 
1 1 1   17    0  -11 o  334.280   4.3864  4564.01  119.477  4564.01  119.477  4564.01  119.477  334.280   4.3864  334.280   4.3864 0.000000 0.000000 
1 1 1   17    0  -10 o   64.612   2.8203  171.233   14.789  171.233   14.789  171.233   14.789   64.612   2.8203   64.612   2.8203 0.000000 0.000000 
1 1 1   17    0   -9 o   50.732   3.2918  106.310   13.480  106.310   13.480  106.310   13.480   50.732   3.2918   50.732   3.2918 0.000000 0.000000 
1 1 1   17    0   -8 o  174.908   2.9916  1248.89   42.624  1248.89   42.624  1248.89   42.624  174.908   2.9916  174.908   2.9916 0.000000 0.000000 
1 1 1   17    0   -7 o  111.158   2.3577  504.513   21.341  504.513   21.341  504.513   21.341  111.158   2.3577  111.158   2.3577 0.000000 0.000000 
1 1 1   17    0   -6 f   54.933   3.1394  124.289   13.952  124.289   13.952  124.289   13.952   54.933   3.1394   54.933   3.1394 0.000000 0.000000 
1 1 1   17    0   -5 o  220.654   3.3204  1987.53   59.693  1987.53   59.693  1987.53   59.693  220.654   3.3204  220.654   3.3204 0.000000 0.000000 
1 1 1   17    0   -4 o  142.435   2.8551  828.418   33.119  828.418   33.119  828.418   33.119  142.435   2.8551  142.435   2.8551 0.000000 0.000000 
1 1 1   17    0   -3 o  113.864   2.8276  529.737   26.208  529.737   26.208  529.737   26.208  113.864   2.8276  113.864   2.8276 0.000000 0.000000 
1 1 1   17    0   -2 o  131.458   2.8358  705.773   30.356  705.773   30.356  705.773   30.356  131.458   2.8358  131.458   2.8358 0.000000 0.000000 
1 1 1   17    0   -1 o  264.909   3.7085  2865.09   80.045  2865.09   80.045  2865.09   80.045  264.909   3.7085  264.909   3.7085 0.000000 0.000000 
1 1 1   17    0    0 o   89.464   2.5045  327.149   18.232  327.149   18.232  327.149   18.232   89.464   2.5045   89.464   2.5045 0.000000 0.000000 
1 1 1   17    0    1 o  116.662   2.3989  555.667   22.791  555.667   22.791  555.667   22.791  116.662   2.3989  116.662   2.3989 0.000000 0.000000 
1 1 1   17    0    2 o  308.737   3.3832  3889.94   85.122  3889.94   85.122  3889.94   85.122  308.737   3.3832  308.737   3.3832 0.000000 0.000000 
1 1 1   17    0    3 o  277.896   3.1532  3151.29   71.408  3151.29   71.408  3151.29   71.408  277.896   3.1532  277.896   3.1532 0.000000 0.000000 
1 1 1   17    0    4 o   17.210   7.9901   17.703   12.414   17.703   12.414   17.703   12.414   17.210   7.9901   17.210   7.9901 0.000000 0.000000 
1 1 1   17    0    5 o   48.632   3.5548   98.027   13.915   98.027   13.915   98.027   13.915   48.632   3.5548   48.632   3.5548 0.000000 0.000000 
1 1 1   17    0    6 f  362.142   3.8140  5353.33  112.560  5353.33  112.560  5353.33  112.560  362.142   3.8140  362.142   3.8140 0.000000 0.000000 
1 1 1   17    0    7 o   51.437   3.4038  109.345   14.126  109.345   14.126  109.345   14.126   51.437   3.4038   51.437   3.4038 0.000000 0.000000 
1 1 1   17    0    8 o  157.689   3.0582  1015.39   39.276  1015.39   39.276  1015.39   39.276  157.689   3.0582  157.689   3.0582 0.000000 0.000000 
1 1 1   17    0    9 o  257.681   3.7142  2711.03   77.980  2711.03   77.980  2711.03   77.980  257.681   3.7142  257.681   3.7142 0.000000 0.000000 
1 1 1   17    0   10 o  218.334   3.3917  1946.16   60.331  1946.16   60.331  1946.16   60.331  218.334   3.3917  218.334   3.3917 0.000000 0.000000 
1 1 1   17    0   11 o   11.577   7.4152   0.7393   15.764   0.7393   15.764   0.7393   15.764   11.577   7.4152   11.577   7.4152 0.000000 0.000000 
1 1 1   17    0   12 o   92.080   2.5180  346.527   18.868  346.527   18.868  346.527   18.868   92.080   2.5180   92.080   2.5180 0.000000 0.000000 
1 1 1   17    0   13 o  118.360   2.4006  571.953   23.140  571.953   23.140  571.953   23.140  118.360   2.4006  118.360   2.4006 0.000000 0.000000 
1 1 1   17    0   14 o  165.751   2.4708  1121.07   33.367  1121.07   33.367  1121.07   33.367  165.751   2.4708  165.751   2.4708 0.000000 0.000000 
1 1 1   17    0   15 o   59.769   4.0411  147.788   19.479  147.788   19.479  147.788   19.479   59.769   4.0411   59.769   4.0411 0.000000 0.000000 
1 1 1   17    0   16 o  197.168   3.2714  1587.23   52.545  1587.23   52.545  1587.23   52.545  197.168   3.2714  197.168   3.2714 0.000000 0.000000 
1 1 1   17    0   17 o  117.751   2.4144  566.109   23.152  566.109   23.152  566.109   23.152  117.751   2.4144  117.751   2.4144 0.000000 0.000000 
1 1 1   17    0   18 o  118.229   2.4250  570.728   23.349  570.728   23.349  570.728   23.349  118.229   2.4250  118.229   2.4250 0.000000 0.000000 
1 1 1   17    0   19 o   9.3603   6.1995  -3.1631   12.413  -3.1631   12.413  -3.1631   12.413   9.3603   6.1995   9.3603   6.1995 0.000000 0.000000 
1 1 1   17    0   20 o   32.751   5.6367   47.519   13.712   47.519   13.712   47.519   13.712   32.751   5.6367   32.751   5.6367 0.000000 0.000000 
1 1 1   17    0   21 o   54.993   4.1537  125.546   18.370  125.546   18.370  125.546   18.370   54.993   4.1537   54.993   4.1537 0.000000 0.000000 
1 1 1   17    0   22 o  101.004   2.5913  416.882   21.303  416.882   21.303  416.882   21.303  101.004   2.5913  101.004   2.5913 0.000000 0.000000 
1 1 1   17    0   23 o   33.327   5.8664   49.383   14.462   49.383   14.462   49.383   14.462   33.327   5.8664   33.327   5.8664 0.000000 0.000000 
1 1 1   17    0   24 o   66.828   3.2235  183.472   17.467  183.472   17.467  183.472   17.467   66.828   3.2235   66.828   3.2235 0.000000 0.000000 
1 1 1   17    0   25 o   75.117   3.0754  231.341   18.759  231.341   18.759  231.341   18.759   75.117   3.0754   75.117   3.0754 0.000000 0.000000 
1 1 1   17    0   26 o  180.955   2.6836  1336.44   39.565  1336.44   39.565  1336.44   39.565  180.955   2.6836  180.955   2.6836 0.000000 0.000000 
1 1 1   17    0   27 o  100.585   2.8607  413.697   23.413  413.697   23.413  413.697   23.413  100.585   2.8607  100.585   2.8607 0.000000 0.000000 
1 1 1   17    0   28 o  109.241   3.5736  488.563   31.745  488.563   31.745  488.563   31.745  109.241   3.5736  109.241   3.5736 0.000000 0.000000 
1 1 1   17    0   29 o  105.845   2.8042  457.929   24.156  457.929   24.156  457.929   24.156  105.845   2.8042  105.845   2.8042 0.000000 0.000000 
1 1 1   17    0   30 o  139.377   3.1275  793.727   35.492  793.727   35.492  793.727   35.492  139.377   3.1275  139.377   3.1275 0.000000 0.000000 
1 1 1   17    0   31 o   20.154   9.4692   24.430   17.471   24.430   17.471   24.430   17.471   20.154   9.4692   20.154   9.4692 0.000000 0.000000 
1 1 1   17    0   32 o   66.551   3.9057  182.664   21.020  182.664   21.020  182.664   21.020   66.551   3.9057   66.551   3.9057 0.000000 0.000000 
1 1 1   17    0   33 o  173.740   3.1640  1232.87   44.776  1232.87   44.776  1232.87   44.776  173.740   3.1640  173.740   3.1640 0.000000 0.000000 
1 1 1   17    0   34 o   10.376   6.7761  -1.6299   14.050  -1.6299   14.050  -1.6299   14.050   10.376   6.7761   10.376   6.7761 0.000000 0.000000 
1 1 1   17    0   35 o   96.981   2.6444  384.501   20.869  384.501   20.869  384.501   20.869   96.981   2.6444   96.981   2.6444 0.000000 0.000000 
1 1 1   17    0   36 o   10.207   6.6611  -1.4867   13.545  -1.4867   13.545  -1.4867   13.545   10.207   6.6611   10.207   6.6611 0.000000 0.000000 
1 1 1   17    0   37 o   56.325   3.5108  131.002   15.974  131.002   15.974  131.002   15.974   56.325   3.5108   56.325   3.5108 0.000000 0.000000 
1 1 1   17    0   38 o  173.811   3.1273  1234.04   44.276  1234.04   44.276  1234.04   44.276  173.811   3.1273  173.811   3.1273 0.000000 0.000000 
1 1 1   17    0   39 o  271.103   3.1405  3000.72   69.380  3000.72   69.380  3000.72   69.380  271.103   3.1405  271.103   3.1405 0.000000 0.000000 
1 1 1   17    0   40 o  105.259   2.5662  452.789   21.989  452.789   21.989  452.789   21.989  105.259   2.5662  105.259   2.5662 0.000000 0.000000 
1 1 1   17    0   41 f   40.132   4.6020   68.376   14.542   68.376   14.542   68.376   14.542   40.132   4.6020   40.132   4.6020 0.000000 0.000000 
1 1 1   17    0   42 o  106.212   2.5470  461.016   22.023  461.016   22.023  461.016   22.023  106.212   2.5470  106.212   2.5470 0.000000 0.000000 
1 1 1   17    0   43 o  188.545   2.6401  1451.27   40.559  1451.27   40.559  1451.27   40.559  188.545   2.6401  188.545   2.6401 0.000000 0.000000 
1 1 1   17    0   44 o  119.052   2.5187  579.023   24.418  579.023   24.418  579.023   24.418  119.052   2.5187  119.052   2.5187 0.000000 0.000000 
1 1 1   17    0   45 o  109.698   3.1337  492.444   27.970  492.444   27.970  492.444   27.970  109.698   3.1337  109.698   3.1337 0.000000 0.000000 
1 1 1   17    0   46 o  106.200   2.5489  460.981   22.037  460.981   22.037  460.981   22.037  106.200   2.5489  106.200   2.5489 0.000000 0.000000 
1 1 1   17    0   47 o   35.344   5.2271   54.363   14.094   54.363   14.094   54.363   14.094   35.344   5.2271   35.344   5.2271 0.000000 0.000000 
1 1 1   17    0   48 o   7.7553   5.4537 -14.9513   13.387 -14.9513   13.387 -14.9513   13.387   7.7553   5.4537   7.7553   5.4537 0.000000 0.000000 
1 1 1   17    0   49 o  152.704   3.1801  953.465   39.546  953.465   39.546  953.465   39.546  152.704   3.1801  152.704   3.1801 0.000000 0.000000 
1 1 1   17    0   50 o   73.210   3.8651  220.905   22.918  220.905   22.918  220.905   22.918   73.210   3.8651   73.210   3.8651 0.000000 0.000000 
1 1 1   17    0   51 o   28.468   9.2327   42.423   18.942   42.423   18.942   42.423   18.942   28.468   9.2327   28.468   9.2327 0.000000 0.000000 
1 1 1   17    0   52 o   72.462   3.4968  216.047   20.544  216.047   20.544  216.047   20.544   72.462   3.4968   72.462   3.4968 0.000000 0.000000 
1 1 1   17    0   53 o  150.110   2.5198  920.449   30.813  920.449   30.813  920.449   30.813  150.110   2.5198  150.110   2.5198 0.000000 0.000000 
1 1 1   17    0   54 o   94.499   2.6283  365.388   20.211  365.388   20.211  365.388   20.211   94.499   2.6283   94.499   2.6283 0.000000 0.000000 
1 1 1   17    0   55 f   79.118   2.7841  256.551   17.905  256.551   17.905  256.551   17.905   79.118   2.7841   79.118   2.7841 0.000000 0.000000 
1 1 1   17    0   56 o   84.076   2.7449  289.576   18.766  289.576   18.766  289.576   18.766   84.076   2.7449   84.076   2.7449 0.000000 0.000000 
1 1 1   17    0   57 o   31.069   7.6185   46.211   16.709   46.211   16.709   46.211   16.709   31.069   7.6185   31.069   7.6185 0.000000 0.000000 
1 1 1   17    0   60 o   6.7000   4.8906 -37.9021   16.081 -37.9021   16.081 -37.9021   16.081   6.7000   4.8906   6.7000   4.8906 0.000000 0.000000 
1 1 1   17    0   61 o   33.717   7.4386   53.208   17.884   53.208   17.884   53.208   17.884   33.717   7.4386   33.717   7.4386 0.000000 0.000000 
1 1 1   17    0   62 o   17.817   8.8715   19.560   15.629   19.560   15.629   19.560   15.629   17.817   8.8715   17.817   8.8715 0.000000 0.000000 
1 1 1   17    0   63 o   73.015   2.8887  218.982   17.132  218.982   17.132  218.982   17.132   73.015   2.8887   73.015   2.8887 0.000000 0.000000 
1 1 1   17    0   64 o   24.317   7.2866   30.154   12.580   30.154   12.580   30.154   12.580   24.317   7.2866   24.317   7.2866 0.000000 0.000000 
1 1 1   17    0   65 o   53.050   3.3864  116.648   14.506  116.648   14.506  116.648   14.506   53.050   3.3864   53.050   3.3864 0.000000 0.000000 
1 1 1   17    0   66 o   39.887   4.1839   67.447   13.229   67.447   13.229   67.447   13.229   39.887   4.1839   39.887   4.1839 0.000000 0.000000 
1 1 1   17    0   67 o   12.826   7.2147   9.2907   11.444   9.2907   11.444   9.2907   11.444   12.826   7.2147   12.826   7.2147 0.000000 0.000000 
1 1 1   17    0   68 o   37.893   5.0719   62.306   14.880   62.306   14.880   62.306   14.880   37.893   5.0719   37.893   5.0719 0.000000 0.000000 
1 1 1   17    0   69 o   20.228   8.3499   24.027   13.652   24.027   13.652   24.027   13.652   20.228   8.3499   20.228   8.3499 0.000000 0.000000 
1 1 1   17    0   70 o   34.064   5.4142   51.449   13.898   51.449   13.898   51.449   13.898   34.064   5.4142   34.064   5.4142 0.000000 0.000000 
1 1 1   17    0   71 o   30.416   5.3724   41.631   12.080   41.631   12.080   41.631   12.080   30.416   5.3724   30.416   5.3724 0.000000 0.000000 
1 1 1   17    0   72 o   65.521   2.8593  176.947   15.205  176.947   15.205  176.947   15.205   65.521   2.8593   65.521   2.8593 0.000000 0.000000 
1 1 1   17    0   73 o   27.881   6.3237   36.864   12.531   36.864   12.531   36.864   12.531   27.881   6.3237   27.881   6.3237 0.000000 0.000000 
1 1 1   17    0   74 o   71.008   2.7692  207.677   15.973  207.677   15.973  207.677   15.973   71.008   2.7692   71.008   2.7692 0.000000 0.000000 
1 1 1   17    0   75 o   12.623   7.1685   9.0985   11.440   9.0985   11.440   9.0985   11.440   12.623   7.1685   12.623   7.1685 0.000000 0.000000 
1 1 1   17    0   76 o   6.1352   4.4210 -19.3343   11.058 -19.3343   11.058 -19.3343   11.058   6.1352   4.4210   6.1352   4.4210 0.000000 0.000000 
1 1 1   17    0   77 o   68.488   3.6067  195.097   20.007  195.097   20.007  195.097   20.007   68.488   3.6067   68.488   3.6067 0.000000 0.000000 
1 1 1   17    0   78 o   15.751   7.3126   15.426   10.398   15.426   10.398   15.426   10.398   15.751   7.3126   15.751   7.3126 0.000000 0.000000 
1 1 1   17    0   79 f   25.950   6.3971   32.853   11.715   32.853   11.715   32.853   11.715   25.950   6.3971   25.950   6.3971 0.000000 0.000000 
1 1 1   17    0   80 o   45.465   3.3273   86.609   12.176   86.609   12.176   86.609   12.176   45.465   3.3273   45.465   3.3273 0.000000 0.000000 
1 1 1   17    0   81 o   7.1955   4.8751  -3.9081   8.5019  -3.9081   8.5019  -3.9081   8.5019   7.1955   4.8751   7.1955   4.8751 0.000000 0.000000 
1 1 1   17    0   82 o   22.906   6.0276   26.069   9.7236   26.069   9.7236   26.069   9.7236   22.906   6.0276   22.906   6.0276 0.000000 0.000000 
1 1 1   17    0   83 o   13.919   7.1116   12.382   10.183   12.382   10.183   12.382   10.183   13.919   7.1116   13.919   7.1116 0.000000 0.000000 
1 1 1   17    0   84 o   11.427   6.6786   7.1339   10.368   7.1339   10.368   7.1339   10.368   11.427   6.6786   11.427   6.6786 0.000000 0.000000 
1 1 1   17    0   85 o   42.058   3.4757   74.734   11.722   74.734   11.722   74.734   11.722   42.058   3.4757   42.058   3.4757 0.000000 0.000000 
1 1 1   17    0   86 o   13.944   6.7615   12.369   8.9831   12.369   8.9831   12.369   8.9831   13.944   6.7615   13.944   6.7615 0.000000 0.000000 
1 1 1   17    0   87 o   68.451   2.1831  192.934   12.153  192.934   12.153  192.934   12.153   68.451   2.1831   68.451   2.1831 0.000000 0.000000 
1 1 1   17    0   88 o   5.7764   4.1101 -11.1737   8.3921 -11.1737   8.3921 -11.1737   8.3921   5.7764   4.1101   5.7764   4.1101 0.000000 0.000000 
1 1 1   17    0   89 o   36.460   3.2577   56.403   9.4957   56.403   9.4957   56.403   9.4957   36.460   3.2577   36.460   3.2577 0.000000 0.000000 
1 1 1   17    0   90 o   10.228   6.2441   4.6928   9.8540   4.6928   9.8540   4.6928   9.8540   10.228   6.2441   10.228   6.2441 0.000000 0.000000 
1 1 1   17    0   91 o   10.962   6.4935   6.5535   10.032   6.5535   10.032   6.5535   10.032   10.962   6.4935   10.962   6.4935 0.000000 0.000000 
1 1 1   17    0   92 o   19.904   7.0761   22.653   10.456   22.653   10.456   22.653   10.456   19.904   7.0761   19.904   7.0761 0.000000 0.000000 
1 1 1   17    0   93 o   12.371   6.8758   9.8940   10.242   9.8940   10.242   9.8940   10.242   12.371   6.8758   12.371   6.8758 0.000000 0.000000 
1 1 1   17    0   94 f   48.961   3.1062  101.046   12.281  101.046   12.281  101.046   12.281   48.961   3.1062   48.961   3.1062 0.000000 0.000000 
1 1 1   17    0   95 o   15.192   6.6272   14.578   8.5225   14.578   8.5225   14.578   8.5225   15.192   6.6272   15.192   6.6272 0.000000 0.000000 
1 1 1   17    0   96 o   40.292   2.8974   68.601   9.4008   68.601   9.4008   68.601   9.4008   40.292   2.8974   40.292   2.8974 0.000000 0.000000 
1 1 1   17    0   97 o   11.262   6.4408   8.0635   9.3259   8.0635   9.3259   8.0635   9.3259   11.262   6.4408   11.262   6.4408 0.000000 0.000000 
1 1 1   17    0   98 o   11.272   6.4481   8.1721   9.3509   8.1721   9.3509   8.1721   9.3509   11.272   6.4481   11.272   6.4481 0.000000 0.000000 
1 1 1   17    0   99 o   70.627   5.4582  225.259   30.980  225.259   30.980  225.259   30.980   70.627   5.4582   70.627   5.4582 0.000000 0.000000 
1 1 1   17    0  100 o   12.096   8.0563   2.2206   21.457   2.2206   21.457   2.2206   21.457   12.096   8.0563   12.096   8.0563 0.000000 0.000000 
1 1 1   17    0  101 o   15.132   9.3475   17.094   22.692   17.094   22.692   17.094   22.692   15.132   9.3475   15.132   9.3475 0.000000 0.000000 
1 1 1   17    0  102 o   12.400   8.1743   4.7408   21.181   4.7408   21.181   4.7408   21.181   12.400   8.1743   12.400   8.1743 0.000000 0.000000 
1 1 1   17    0  103 o   10.185   6.8114  -0.4982   15.613  -0.4982   15.613  -0.4982   15.613   10.185   6.8114   10.185   6.8114 0.000000 0.000000 
1 1 1   17    0  104 o   12.219   7.6248   8.8038   15.484   8.8038   15.484   8.8038   15.484   12.219   7.6248   12.219   7.6248 0.000000 0.000000 
1 1 1   17    0  105 o   18.864   9.1963   27.521   16.649   27.521   16.649   27.521   16.649   18.864   9.1963   18.864   9.1963 0.000000 0.000000 
1 1 1   17    0  106 o   7.2239   5.2175 -24.2964   15.827 -24.2964   15.827 -24.2964   15.827   7.2239   5.2175   7.2239   5.2175 0.000000 0.000000 
1 1 1   17    0  107 o   11.914   7.5873   7.4939   16.219   7.4939   16.219   7.4939   16.219   11.914   7.5873   11.914   7.5873 0.000000 0.000000 
1 1 1   17    0  108 o   41.370   5.8525   82.056   18.599   82.056   18.599   82.056   18.599   41.370   5.8525   41.370   5.8525 0.000000 0.000000 
1 1 1   17    0  109 f   14.055   8.3667   15.391   16.807   15.391   16.807   15.391   16.807   14.055   8.3667   14.055   8.3667 0.000000 0.000000 
1 1 1   17    0  110 o   11.288   7.7117  -1.8241   22.213  -1.8241   22.213  -1.8241   22.213   11.288   7.7117   11.288   7.7117 0.000000 0.000000 
1 1 1   17    0  111 o   11.063   7.5927  -3.0930   22.091  -3.0930   22.091  -3.0930   22.091   11.063   7.5927   11.063   7.5927 0.000000 0.000000 
1 1 1   17    0  112 o   12.923   8.4652   8.9950   22.175   8.9950   22.175   8.9950   22.175   12.923   8.4652   12.923   8.4652 0.000000 0.000000 
1 1 1   17    0  113 o   25.048   11.286   52.245   24.699   52.245   24.699   52.245   24.699   25.048   11.286   25.048   11.286 0.000000 0.000000 
1 1 1   17    1 -111 o   23.954   8.1290   39.640   18.930   33.808   26.386   45.825   27.174   20.660   8.8321   23.000   9.3188 -2.339916 12.83922 
1 1 1   17    1 -110 f   17.697   7.5439   18.159   19.154   26.995   27.051   9.2759   27.124   19.329   8.5850   16.795   7.8722 2.534168 11.64789 
1 1 1   17    1 -109 o   13.326   6.1271   0.1779   15.262 -32.5189   18.447   71.119   27.172   10.516   5.2515   29.401   9.7363 -18.88505 11.06222 
1 1 1   17    1 -108 o   10.602   5.1004 -11.3173   12.956 -26.4132   18.463   3.3268   18.185   11.058   5.4767   14.676   6.7257 -3.617615 8.673473 
1 1 1   17    1 -107 o   13.295   5.9400   2.6669   13.150   1.3745   18.715   3.9272   18.480   14.528   6.7173   14.906   6.8118 -0.3777533 9.566735 
1 1 1   17    1 -106 o   12.375   5.6897  -1.7831   13.162  -5.9735   18.751   2.2870   18.479   13.483   6.3882   14.673   6.7449 -1.190083 9.289907 
1 1 1   17    1 -105 o   12.487   5.7375  -1.7245   13.352  -9.4731   18.867   6.0502   18.898   13.094   6.2609   15.473   6.9989 -2.378512 9.390584 
1 1 1   17    1 -104 o   18.886   6.8769   20.439   13.720   1.1698   19.080   41.069   19.742   14.740   6.8036   24.661   8.3019 -9.921560 10.73359 
1 1 1   17    1 -103 o   11.878   5.5372  -4.7970   13.123 -17.4056   17.890   9.8873   19.307   11.911   5.7926   16.410   7.2724 -4.498739 9.297459 
1 1 1   17    1 -102 o   34.499   5.1740   58.448   14.102   79.833   19.647   35.723   20.253   38.681   6.4586   22.979   8.3571 15.70220 10.56193 
1 1 1   17    1 -101 o   16.956   6.5190   14.614   12.680   33.513   17.591  -5.8256   18.294   23.118   7.8363   13.604   6.4043 9.513444 10.12043 
1 1 1   17    1 -100 f   14.052   6.0370   5.3937   12.441   0.8354   17.234   10.353   17.976   14.446   6.5927   16.526   7.1784 -2.080157 9.746482 
1 1 1   17    1  -99 o   15.922   6.3345   11.410   12.317   15.036   17.004   7.4090   17.864   17.603   7.2786   15.943   7.0337 1.660277 10.12179 
1 1 1   17    1  -98 f   10.519   5.0205 -10.4973   12.012 -11.1793   17.003  -9.8177   16.973   12.552   5.9857   12.731   6.0453 -0.1792822 8.507311 
1 1 1   17    1  -97 o   12.562   6.0711 -16.8322   18.869  -5.7909   26.979 -27.4033   26.399   16.042   7.6185   13.819   6.7870 2.222904 10.20318 
1 1 1   17    1  -96 o   15.291   6.5278   7.1250   14.378   9.9591   27.363   6.0441   16.899   18.286   8.3303   15.676   6.8812 2.609561 10.80485 
1 1 1   17    1  -95 o   15.578   6.6340   7.3742   14.785   10.906   29.619   6.2022   17.063   18.949   8.6459   15.884   6.9449 3.065719 11.08975 
1 1 1   17    1  -94 o   14.639   6.0908   6.4833   12.011   2.1735   17.259   10.531   16.726   15.232   6.8053   16.993   7.1371 -1.761592 9.861567 
1 1 1   17    1  -93 o   37.126   3.9759   61.192   11.845   47.194   15.068   83.838   19.165   30.825   6.2117   41.750   5.7869 -10.92511 8.489571 
1 1 1   17    1  -92 o   46.116   2.9829   90.719   11.153   77.600   15.668  104.195   15.880   41.271   4.7434   48.550   4.0494 -7.278843 6.236805 
1 1 1   17    1  -91 o   34.233   3.8163   51.415   10.468   43.788   14.564   59.567   15.058   29.931   6.1743   35.750   5.3296 -5.819733 8.156398 
1 1 1   17    1  -90 o   26.961   5.4091   34.133   11.474   36.148   14.089   30.166   19.771   27.019   6.4805   23.631   8.2945 3.387619 10.52592 
1 1 1   17    1  -89 o   48.742   3.1737  101.088   12.541  102.407   15.592   98.672   21.108   48.485   3.9800   46.049   5.7480 2.436386 6.991464 
1 1 1   17    1  -88 o   13.369   5.6737   2.7107   10.751  -0.8079   13.385   9.1067   18.047   13.639   6.0494   17.691   7.4209 -4.052305 9.574177 
1 1 1   17    1  -87 o   30.431   4.6262   41.282   11.115   36.269   13.836   50.402   18.663   27.525   6.3028   31.791   7.3488 -4.266119 9.681435 
1 1 1   17    1  -86 o   49.397   2.5237  101.791   10.128  103.980   15.337  100.097   13.488   49.185   3.8560   48.513   3.4328 0.6718636 5.162689 
1 1 1   17    1  -85 o   24.048   4.1215   25.413   7.7886   45.644   13.592   15.522   9.5038   31.676   5.4612   18.446   5.7245 13.22939 7.911652 
1 1 1   17    1  -84 o   22.647   4.6312   22.929   8.2609   23.641   16.215   22.679   9.6002   22.297   7.5239   22.246   5.3583 0.5107498E-01 9.236851 
1 1 1   17    1  -83 o   24.869   3.1745   26.313   6.2887   23.368   8.2102   30.494   9.7819   22.926   4.5539   26.182   4.7587 -3.255745 6.586596 
1 1 1   17    1  -82 o   14.702   4.6606   9.3072   6.2661   7.2276   7.8140   13.054   10.488   14.008   5.1750   17.485   6.0472 -3.477047 7.959271 
1 1 1   17    1  -81 o   16.441   4.6416   11.995   6.4915   13.726   8.0980   8.8837   10.858   17.538   5.2534   15.845   6.0474 1.693128 8.010568 
1 1 1   17    1  -80 o   40.173   2.6748   67.266   8.7092   48.202   14.709   77.559   10.807   32.669   5.7322   42.988   3.1051 -10.31884 6.519200 
1 1 1   17    1  -79 f   54.808   1.8286  123.569   8.1582  123.518   11.221  123.626   11.882   54.568   2.5296   54.533   2.6812 0.3448868E-01 3.686146 
1 1 1   17    1  -78 o   28.848   3.0539   35.017   7.0723   33.706   10.193   36.235   9.8210   27.733   4.6748   28.926   4.2954 -1.193050 6.348548 
1 1 1   17    1  -77 o   22.231   3.8291   21.331   6.6885   34.662   9.3482   7.3491   9.5736   28.353   4.1692   14.867   5.6773 13.48579 7.043769 
1 1 1   17    1  -76 o   21.027   4.0932   19.232   6.7631   27.336   9.4322   10.658   9.7025   24.925   4.8167   16.396   5.8057 8.529448 7.543660 
1 1 1   17    1  -75 o   18.047   4.6604   14.359   6.9033   19.449   9.3868   8.3620   10.188   20.852   5.4594   15.583   5.8784 5.268552 8.022488 
1 1 1   17    1  -74 f   9.8997   4.3332  -1.1189   6.6588  -1.9293   9.2094  -0.2309   9.6394   11.448   5.0505   12.227   5.2838 -0.7784338 7.309311 
1 1 1   17    1  -73 o   27.764   3.2504   32.425   7.2173   36.712   10.386   28.421   10.037   29.179   4.5119   25.440   5.0183 3.738207 6.748357 
1 1 1   17    1  -72 o   58.234   1.9594  139.268   9.2876  135.598   12.309  144.119   14.152   57.283   2.6433   58.959   2.9541 -1.676537 3.964032 
1 1 1   17    1  -71 o   97.897   1.5915  392.185   12.700  366.623   17.036  424.166   19.055   94.476   2.2121  101.588   2.3010 -7.111794 3.191902 
1 1 1   17    1  -70 o   54.298   1.9493  120.995   8.6136  101.873   12.022  141.164   12.347   49.580   2.9885   58.504   2.5956 -8.923214 3.958321 
1 1 1   17    1  -69 o   34.670   2.8360   49.859   7.9448   57.099   11.945   44.114   10.640   36.804   4.0482   32.271   4.1398 4.532791 5.790166 
1 1 1   17    1  -68 o   13.655   4.8934   6.7732   6.9123   9.2108   9.6760   4.2328   9.8781   15.937   5.7792   13.990   5.6364 1.946194 8.072679 
1 1 1   17    1  -67 o   35.108   2.9510   51.121   8.3671   37.767   11.192   68.039   12.598   29.681   4.7891   40.310   3.8819 -10.62894 6.164743 
1 1 1   17    1  -66 o   26.566   3.6345   29.715   7.6645   28.711   11.214   30.595   10.500   25.637   5.5288   26.612   5.0243 -0.9758091 7.470730 
1 1 1   17    1  -65 o   36.868   2.7017   56.127   8.0630   65.191   11.881   48.388   10.978   39.531   3.7312   33.931   4.0490 5.599953 5.505977 
1 1 1   17    1  -64 o   48.869   2.6403   98.301   10.479  105.542   12.977   84.735   17.764   50.536   3.1662   44.794   4.9472 5.741421 5.873592 
1 1 1   17    1  -63 o   33.883   3.3090   47.711   9.0230   47.541   11.122   48.040   15.434   33.640   4.1432   33.341   5.8945 0.2997780 7.204915 
1 1 1   17    1  -62 o   20.073   5.2800   17.431   8.7534   13.918   10.703   24.527   15.212   18.525   6.1096   23.839   7.2134 -5.314377 9.453104 
1 1 1   17    1  -61 o   55.214   2.1026  124.885   9.4460  134.835   13.056  113.955   13.684   57.264   2.8055   52.557   3.2093 4.706120 4.262683 
1 1 1   17    1  -60 o   41.291   2.6554   70.157   8.8903   66.581   12.281   74.095   12.887   40.016   3.8109   42.237   3.7829 -2.221924 5.369670 
1 1 1   17    1  -59 o   74.127   1.8454  224.520   11.151  222.538   15.377  226.719   16.194   73.668   2.5645   74.338   2.6769 -0.6694717 3.707108 
1 1 1   17    1  -58 o   71.365   2.1718  208.453   12.619  209.212   19.926  207.945   16.306   71.269   3.4401   71.175   2.8161 0.9323120E-01 4.445715 
1 1 1   17    1  -57 o   84.649   2.0489  292.858   14.138  312.119   22.418  280.140   18.217   87.164   3.1603   82.661   2.7072 4.503799 4.161349 
1 1 1   17    1  -56 o   29.549   4.5211   36.837   10.544   43.889   17.160   32.560   13.365   31.780   6.8277   27.424   6.1326 4.356476 9.177451 
1 1 1   17    1  -55 o   67.264   2.0407  185.029   11.176  179.586   15.475  190.963   16.159   66.156   2.8766   68.217   2.9125 -2.061577 4.093608 
1 1 1   17    1  -54 o   71.565   1.9404  209.335   11.309  207.251   15.469  211.726   16.575   71.117   2.6732   71.857   2.8353 -0.7407303 3.896761 
1 1 1   17    1  -53 o   51.615   2.3746  109.140   9.9641   84.721   13.736  136.262   14.476   45.269   3.7561   57.591   3.0950 -12.32175 4.866951 
1 1 1   17    1  -52 o   56.187   2.1830  129.179   9.9791  127.069   13.760  131.519   14.494   55.622   3.0465   56.575   3.1553 -0.9529190 4.386014 
1 1 1   17    1  -51 o   20.627   5.0506   18.250   8.4230   27.454   11.733   8.4632   12.099   25.253   5.8194   16.833   6.3933 8.420702 8.645196 
1 1 1   17    1  -50 o   32.315   3.0393   43.119   7.9121   39.664   12.077   45.717   10.473   30.633   5.0094   33.141   3.9547 -2.507828 6.382284 
1 1 1   17    1  -49 o   70.653   1.7594  203.737   10.133  212.945   15.421  196.741   13.442   72.123   2.6274   69.348   2.3814 2.774223 3.546034 
1 1 1   17    1  -48 o   79.344   1.6651  256.897   10.770  248.227   16.227  263.724   14.398   77.889   2.5592   80.326   2.2010 -2.437027 3.375531 
1 1 1   17    1  -47 o   64.560   2.0901  170.361   10.985  172.957   17.055  168.521   14.359   64.922   3.2329   64.142   2.7528 0.7798691 4.246103 
1 1 1   17    1  -46 o   37.685   3.1016   58.496   9.4437   74.173   14.976   48.146   12.168   42.271   4.4110   33.941   4.5095 8.329281 6.308145 
1 1 1   17    1  -45 o  101.157   1.9217  417.668   15.846  408.042   22.092  427.867   22.741   99.876   2.7161  102.273   2.7302 -2.397339 3.851162 
1 1 1   17    1  -44 o   89.836   1.8656  329.369   13.662  337.854   20.915  323.054   18.043   90.864   2.8273   88.890   2.4926 1.974350 3.769152 
1 1 1   17    1  -43 o  160.030   1.6745  1044.86   21.844  1034.54   29.356  1057.66   32.697  159.169   2.2625  160.906   2.4929 -1.736420 3.366544 
1 1 1   17    1  -42 o   85.419   1.6660  297.673   11.600  317.169   17.738  283.106   15.333   88.084   2.4729   83.237   2.2619 4.847374 3.351321 
1 1 1   17    1  -41 o  106.589   1.4471  463.386   12.573  492.482   17.747  434.068   17.815  109.850   1.9820  103.120   2.1193 6.730263 2.901685 
1 1 1   17    1  -40 o  102.542   1.7236  428.980   14.407  430.058   16.985  426.216   27.198  102.651   2.0299  102.029   3.2745 0.6227188 3.852615 
1 1 1   17    1  -39 o   60.193   2.1126  148.065   10.350  150.422   13.852  145.085   15.572   60.610   2.8114   59.478   3.2239 1.131462 4.277573 
1 1 1   17    1  -38 o   29.071   4.0088   35.259   9.2469   36.220   12.723   34.182   13.463   29.201   5.5479   28.277   6.0251 0.9241524 8.190355 
1 1 1   17    1  -37 o   62.954   1.9406  161.866   9.9464  159.667   12.808  165.208   15.787   62.480   2.5200   63.504   3.0587 -1.024555 3.963120 
1 1 1   17    1  -36 o   21.420   4.5170   19.515   7.6381   19.117   10.721   19.926   10.884   21.250   5.9530   21.666   5.9715 -0.4159279 8.431945 
1 1 1   17    1  -35 o  215.772   1.6021  1898.95   28.178  1890.46   38.127  1909.18   41.831  215.222   2.1732  216.257   2.3730 -1.035278 3.217747 
1 1 1   17    1  -34 o  130.594   1.4300  695.509   15.223  688.748   20.820  703.276   22.315  129.925   1.9658  131.279   2.0853 -1.354263 2.865800 
1 1 1   17    1  -33 o  105.302   1.4606  452.204   12.537  463.595   17.427  439.982   18.051  106.593   2.0056  103.835   2.1326 2.757530 2.927567 
1 1 1   17    1  -32 o  146.262   1.4453  872.382   17.231  857.946   23.453  889.316   25.401  145.011   1.9841  147.628   2.1108 -2.617188 2.896904 
1 1 1   17    1  -31 o  254.202   1.7437  2635.73   36.132  2654.31   49.123  2613.82   53.333  255.013   2.3631  253.025   2.5858 1.988373 3.502979 
1 1 1   17    1  -30 o  107.904   1.4810  474.810   13.026  478.441   18.150  470.952   18.707  108.288   2.0562  107.433   2.1361 0.8553543 2.964952 
1 1 1   17    1  -29 o  115.640   1.4710  545.317   13.866  533.930   19.106  557.987   20.155  114.398   2.0489  116.943   2.1143 -2.544907 2.944180 
1 1 1   17    1  -28 o   34.469   3.1402   48.936   8.7264   47.777   12.924   49.908   11.830   33.810   4.8262   34.659   4.2781 -0.8487396 6.449370 
1 1 1   17    1  -27 o  124.604   1.5381  633.148   15.622  629.562   22.738  636.354   21.500  124.212   2.2457  124.889   2.1119 -0.6766434 3.082783 
1 1 1   17    1  -26 o   36.111   3.1723   53.675   9.2430   62.028   14.110   47.396   12.233   38.657   4.5658   33.720   4.5679 4.936493 6.458501 
1 1 1   17    1  -25 o   59.140   2.1638  142.886   10.413  144.160   15.889  141.926   13.788   59.311   3.2994   58.887   2.8811 0.4242973 4.380228 
1 1 1   17    1  -24 o   43.214   2.8851   76.586   10.105   73.693   14.579   79.261   14.018   42.223   4.2956   43.848   3.9649 -1.624996 5.845712 
1 1 1   17    1  -23 o   75.997   2.0103  235.763   12.443  237.380   17.993  234.281   17.226   76.194   2.9023   75.703   2.7963 0.4908218 4.030207 
1 1 1   17    1  -22 o   28.396   4.4476   33.783   9.9570   29.823   14.767   37.084   13.483   26.430   6.8116   29.558   5.8032 -3.128931 8.948448 
1 1 1   17    1  -21 o   70.807   2.2018  204.741   12.693  220.030   18.643  191.528   17.331   73.336   3.1258   68.413   3.1159 4.922882 4.413545 
1 1 1   17    1  -20 o  156.742   1.9882  1002.13   25.403  1019.27   33.337  978.391   39.226  158.033   2.5879  154.784   3.1089 3.248215 4.045101 
1 1 1   17    1  -19 o   58.547   4.5492  141.129   21.541  141.129   21.541   0.0000   0.0000   58.547   4.5492  ?   ?  0.000000 4.549165 
1 1 1   17    1  -18 o  220.474   2.4553  1983.59   44.127  2017.10   63.585  1952.46   61.289  222.187   3.5107  218.609   3.4394 3.577805 4.914722 
1 1 1   17    1  -16 o   7.5836   3.8188 -33.9998   10.799 -43.3329   17.825 -28.5869   13.575   10.710   5.3176   9.8198   4.8316 0.8904648 7.184804 
1 1 1   17    1  -15 f  117.799   1.9630  566.008   18.850  592.704   30.595  549.676   23.931  120.433   3.1191  116.057   2.5296 4.376411 4.015964 
1 1 1   17    1  -14 o  146.003   1.9468  869.474   23.170  887.968   37.337  857.893   29.547  147.462   3.1062  144.992   2.5000 2.469833 3.987223 
1 1 1   17    1  -13 o  154.125   1.7781  968.777   22.339  971.568   31.870  966.082   31.322  154.298   2.5339  153.864   2.4973 0.4334717 3.557701 
1 1 1   17    1  -12 o  127.415   1.7807  662.092   18.494  671.800   26.732  653.180   25.614  128.304   2.5560  126.518   2.4836 1.786057 3.563880 
1 1 1   17    1  -11 o  229.293   2.2045  2144.84   41.204  2141.70   53.630  2149.37   64.372  229.050   2.8724  229.380   3.4428 -0.3300018 4.483655 
1 1 1   17    1  -10 o   46.360   2.8415   88.061   10.686   94.220   15.626   82.650   14.647   47.836   4.0453   44.779   4.0566 3.056980 5.728887 
1 1 1   17    1   -9 o   89.886   1.8856  329.524   13.816  319.676   19.827  338.819   19.262   88.456   2.7530   91.081   2.5971 -2.624321 3.784703 
1 1 1   17    1   -8 o  255.699   2.3302  2667.55   48.568  2653.68   76.181  2677.05   63.041  254.839   3.6673  256.064   3.0202 -1.224686 4.750843 
1 1 1   17    1   -7 o  182.519   1.8419  1358.63   27.404  1332.10   38.655  1385.43   38.856  180.669   2.6247  184.253   2.5871 -3.584320 3.685395 
1 1 1   17    1   -6 o  188.613   1.8518  1450.87   28.471  1468.52   40.659  1433.90   39.879  189.694   2.6294  187.447   2.6100 2.247208 3.704843 
1 1 1   17    1   -5 o   98.454   1.8011  395.310   14.455  377.511   20.549  412.745   20.338   96.144   2.6244  100.575   2.4807 -4.430725 3.611299 
1 1 1   17    1   -4 o  204.255   1.9062  1701.56   31.737  1685.84   44.923  1717.23   44.843  203.239   2.7116  205.126   2.6819 -1.886810 3.813838 
1 1 1   17    1   -3 o   12.953   5.3174   2.1899   8.9894 -11.0707   13.107   13.966   12.352   12.116   5.6089   19.234   6.5658 -7.118442 8.635338 
1 1 1   17    1   -2 o  114.353   1.7440  533.271   16.257  546.512   23.447  521.013   22.559  115.730   2.4854  113.000   2.4491 2.730270 3.489346 
1 1 1   17    1   -1 o  120.002   1.8907  587.314   18.494  567.782   24.100  615.293   28.844  117.960   2.5064  122.773   2.8822 -4.813156 3.819559 
1 1 1   17    1    0 o   55.579   2.5571  126.317   11.554  119.124   15.355  135.705   17.541   53.887   3.5148   57.505   3.7628 -3.618065 5.149043 
1 1 1   17    1    1 o  135.884   1.8875  753.065   20.907  729.619   27.129  787.350   32.807  133.720   2.4889  138.881   2.8979 -5.161224 3.820037 
1 1 1   17    1    2 o  246.549   3.5806  2483.40   71.961   0.0000   0.0000  2483.40   71.961  ?   ?   246.549   3.5806 0.000000 3.580616 
1 1 1   17    1    3 o  142.197   2.4289  825.017   28.154  834.408   50.383  820.753   33.949  142.768   4.3343  141.793   2.9372 0.9747314 5.235809 
1 1 1   17    1    4 o  153.332   4.3627  962.406   54.473  962.406   54.473   0.0000   0.0000  153.332   4.3627  ?   ?  0.000000 4.362741 
1 1 1   17    1    5 o  100.107   2.6049  409.239   21.239  419.168   37.205  404.439   25.868  101.119   4.5252   99.469   3.1945 1.649902 5.539140 
1 1 1   17    1    6 o   23.725   5.9987   23.990   11.606   9.9256   15.616   41.343   17.347   18.890   7.2417   31.100   7.0106 -12.20971 10.07924 
1 1 1   17    1    7 o   94.081   2.2659  361.101   17.377  353.126   23.975  369.928   25.223   92.939   3.1693   95.119   3.2578 -2.179901 4.545094 
1 1 1   17    1    8 o  102.144   1.8229  425.506   15.178  417.530   21.793  433.020   21.151  101.112   2.6463  103.012   2.5189 -1.900101 3.653478 
1 1 1   17    1    9 o  234.728   2.0472  2247.42   39.171  2236.36   55.417  2258.46   55.375  234.055   2.9046  235.211   2.8882 -1.155884 4.096147 
1 1 1   17    1   10 o  160.535   1.7942  1051.03   23.479  1063.55   33.601  1039.07   32.823  161.438   2.5533  159.571   2.5234 1.866623 3.589847 
1 1 1   17    1   11 o   33.701   3.8229   47.012   10.317   59.244   15.287   36.780   13.980   37.694   5.1064   29.408   6.0345 8.285589 7.905056 
1 1 1   17    1   12 o   21.590   5.5845   19.830   9.9017   8.1326   14.543   29.938   13.519   17.864   6.9507   26.474   6.3470 -8.610090 9.412580 
1 1 1   17    1   13 o  155.258   1.8105  983.099   22.913  974.450   32.704  991.439   32.113  154.521   2.5964  155.868   2.5275 -1.346527 3.623464 
1 1 1   17    1   14 o  175.191   1.8592  1251.78   26.551  1250.43   37.931  1253.07   37.178  175.033   2.6585  175.224   2.6029 -0.1901245 3.720545 
1 1 1   17    1   15 f   83.420   2.0557  283.871   13.979  302.390   20.394  267.461   19.197   86.013   2.9130   80.886   2.9164 5.126289 4.121976 
1 1 1   17    1   16 o   10.677   5.0726 -15.0434   11.982   14.431   21.131 -29.0117   14.547   22.206   8.4454   10.343   5.0713 11.86293 9.851064 
1 1 1   17    1   17 o  167.660   1.8747  1146.50   25.621  1135.06   36.339  1157.81   36.130  166.760   2.6733  168.427   2.6316 -1.666367 3.751233 
1 1 1   17    1   18 o  114.474   2.7446  534.915   25.611  534.915   25.611   0.0000   0.0000  114.474   2.7446  ?   ?  0.000000 2.744643 
1 1 1   17    1   19 o  161.411   1.8716  1062.62   24.625  1058.98   35.192  1066.12   34.470  161.074   2.6803  161.621   2.6164 -0.5475006 3.745623 
1 1 1   17    1   20 o   9.4786   4.5989 -18.9601   11.102  -7.9323   16.106 -28.9438   15.325   14.477   6.5127   10.796   5.2749 3.680757 8.380877 
1 1 1   17    1   21 o   56.269   2.7164  129.541   12.423  122.919   17.807  135.819   17.339   54.681   4.0233   57.527   3.7175 -2.846279 5.477839 
1 1 1   17    1   22 o  102.362   2.0888  427.442   17.429  398.461   22.499  470.927   27.560   98.756   2.7977  107.335   3.1534 -8.578697 4.215554 
1 1 1   17    1   23 o   84.316   2.0369  290.004   13.999  297.165   20.180  283.360   19.438   85.263   2.9077   83.259   2.8683 2.003059 4.084347 
1 1 1   17    1   24 o   83.575   2.1924  285.173   14.923  264.258   23.365  299.584   19.395   80.332   3.5771   85.618   2.7827 -5.286407 4.531996 
1 1 1   17    1   25 o   97.097   1.9286  384.567   15.265  360.804   21.677  407.939   21.498   93.962   2.8334   99.934   2.6414 -5.971107 3.873714 
1 1 1   17    1   26 o   16.463   6.2681   7.7728   11.648  -3.3736   17.124   17.369   15.889   15.972   6.9710   21.549   7.4436 -5.576815 10.19815 
1 1 1   17    1   27 o   75.295   2.4791  231.647   15.195  228.596   22.437  234.231   20.652   74.683   3.6971   75.637   3.3581 -0.9533844 4.994473 
1 1 1   17    1   28 o   90.848   2.2756  337.010   16.839  333.345   24.720  340.183   23.000   90.254   3.3659   91.204   3.0982 -0.9501495 4.574753 
1 1 1   17    1   29 o  194.964   2.0662  1550.83   32.838  1591.85   53.065  1525.37   41.803  197.368   3.2984  193.292   2.6531 4.076035 4.232974 
1 1 1   17    1   30 o  148.896   1.7730  904.304   21.519  934.343   31.272  877.286   29.658  151.287   2.5358  146.600   2.4818 4.687149 3.548217 
1 1 1   17    1   31 o   35.550   3.5224   52.175   10.073   56.768   14.665   48.073   13.860   36.872   5.0087   33.845   5.1891 3.026356 7.212059 
1 1 1   17    1   32 o   65.100   2.1973  173.147   11.644  168.118   17.144  177.452   15.864   64.049   3.2947   65.841   2.9634 -1.791939 4.431376 
1 1 1   17    1   33 o  139.512   1.7542  793.955   19.949  797.739   28.880  790.502   27.589  139.781   2.5346  139.155   2.4322 0.6259003 3.512840 
1 1 1   17    1   34 o   27.114   4.4913   30.921   9.5793   30.964   14.298   30.886   12.904   26.873   6.5804   26.869   6.0389 0.3862381E-02 8.931380 
1 1 1   17    1   35 o   41.676   3.0437   71.356   10.269   82.581   15.026   61.518   14.066   44.710   4.1709   38.470   4.5752 6.240665 6.191053 
1 1 1   17    1   36 o   25.752   4.7602   28.061   9.6245   39.502   14.458   18.957   12.898   30.449   6.0382   21.475   6.6694 8.974491 8.996758 
1 1 1   17    1   37 o  139.789   1.7622  797.185   20.080  823.912   29.233  773.312   27.629  142.043   2.5248  137.619   2.4629 4.424438 3.527104 
1 1 1   17    1   38 o  154.270   1.7838  970.952   22.432  955.434   31.992  985.960   31.461  152.952   2.5659  155.386   2.4838 -2.434143 3.571197 
1 1 1   17    1   39 o  122.602   1.7706  613.248   17.695  624.485   25.598  602.963   24.489  123.655   2.5395  121.512   2.4724 2.143013 3.544276 
1 1 1   17    1   40 o  166.488   1.8052  1130.95   24.499  1120.69   34.968  1140.84   34.334  165.637   2.5899  167.129   2.5202 -1.491913 3.613712 
1 1 1   17    1   41 o  147.322   1.7727  885.538   21.288  889.167   30.612  882.140   29.624  147.539   2.5453  146.964   2.4728 0.5750427 3.548738 
1 1 1   17    1   42 o   69.444   2.3781  197.178   13.442  171.147   22.842  210.969   16.626   64.436   4.3748   71.786   2.8468 -7.350029 5.219513 
1 1 1   17    1   43 o   46.248   2.8500   87.765   10.692   77.773   15.636   96.540   14.653   43.294   4.4959   48.401   3.7431 -5.107182 5.850101 
1 1 1   17    1   44 o  139.286   1.7729  791.663   20.130  795.451   29.092  788.184   27.882  139.528   2.5578  138.902   2.4625 0.6261139 3.550561 
1 1 1   17    1   45 o   78.290   2.6094  250.761   16.629  262.642   24.498  240.608   22.646   79.965   3.7689   76.550   3.6396 3.415001 5.239408 
1 1 1   17    1   46 o   57.692   3.2062  136.632   15.019  129.904   21.999  142.506   20.554   55.984   4.8689   58.755   4.3219 -2.770973 6.510386 
1 1 1   17    1   47 o  109.488   2.2947  489.658   20.480  486.911   29.797  492.117   28.195  108.994   3.3578  109.610   3.1589 -0.6168747 4.610143 
1 1 1   17    1   48 o  158.108   1.7982  1020.28   23.176  1017.04   33.029  1023.42   32.527  157.742   2.5687  158.244   2.5216 -0.5025482 3.599573 
1 1 1   17    1   49 o   17.218   6.0457   10.885   10.504   10.033   13.902   12.019   16.037   18.141   6.8615   19.600   7.3793 -1.458691 10.07642 
1 1 1   17    1   50 o   72.622   2.0751  215.564   12.271  211.161   17.919  219.452   16.840   71.755   3.0707   73.187   2.8280 -1.431580 4.174531 
1 1 1   17    1   51 o   93.954   1.8820  360.403   14.413  352.415   21.115  367.372   19.723   92.768   2.7955   94.755   2.5558 -1.986160 3.787701 
1 1 1   17    1   52 o   86.044   2.0728  302.414   14.538  284.830   23.009  314.100   18.757   83.283   3.3963   87.593   2.6300 -4.309952 4.295581 
1 1 1   17    1   53 o  103.785   1.9827  439.936   16.773  454.445   27.109  430.935   21.351  105.265   3.1629  102.647   2.5518 2.617889 4.063916 
1 1 1   17    1   54 o   92.394   1.9399  348.669   14.611  329.943   21.034  366.129   20.310   89.719   2.8798   94.558   2.6376 -4.839066 3.905138 
1 1 1   17    1   55 o   75.876   2.1138  235.446   13.061  223.306   19.044  246.228   17.947   73.732   3.1760   77.489   2.8462 -3.756149 4.264737 
1 1 1   17    1   56 o   28.878   4.5212   35.217   10.294   38.867   15.723   32.478   13.619   29.915   6.6228   27.372   6.2424 2.542246 9.101043 
1 1 1   17    1   57 o   44.611   3.4252   82.213   12.360   69.213   16.589   98.441   18.533   40.550   5.1335   48.563   4.7420 -8.013580 6.988502 
1 1 1   17    1   58 o   62.716   2.5577  161.312   13.048  157.511   17.257  166.385   19.937   61.816   3.4383   63.445   3.8735 -1.628414 5.179388 
1 1 1   17    1   59 o   85.607   2.1378  299.713   14.918  280.252   19.393  327.925   23.349   82.617   2.8840   89.299   3.2129 -6.681763 4.317447 
1 1 1   17    1   60 o   36.502   3.6015   55.374   10.577   67.549   14.218   40.289   15.826   40.174   4.4144   30.381   6.5813 9.793552 7.924659 
1 1 1   17    1   61 o   49.528   2.7720  100.923   11.146   73.068   14.584  140.055   17.285   41.802   4.3432   58.186   3.6629 -16.38476 5.681596 
1 1 1   17    1   62 o  124.622   1.9249  635.058   19.554  613.592   25.302  666.895   30.813  122.351   2.5369  127.422   2.9666 -5.071411 3.903402 
1 1 1   17    1   63 o   54.053   2.3548  119.931   10.351  113.308   15.142  125.740   14.181   52.294   3.5737   55.195   3.1653 -2.900703 4.773890 
1 1 1   17    1   64 o   19.483   5.7184   16.296   9.6740  -6.0185   14.451   34.418   13.023   13.733   6.1742   28.088   5.8768 -14.35508 8.523961 
1 1 1   17    1   65 o   87.630   2.9291  316.206   20.893   0.0000   0.0000  316.206   20.893  ?   ?    87.630   2.9291 0.000000 2.929063 
1 1 1   17    1   66 o   57.731   2.5630  137.124   12.031  140.368   18.128  134.571   16.084   58.073   3.8513   56.965   3.4805 1.107918 5.190978 
1 1 1   17    1   67 o   10.433   4.6685  -3.2181   8.1549   2.7410   12.358  -7.8146   10.853   14.785   6.1669   11.159   5.1437 3.626294 8.030432 
1 1 1   17    1   68 o   75.761   2.1604  235.563   13.328  205.168   22.448  252.111   16.564   70.132   3.9426   78.260   2.6001 -8.127373 4.722808 
1 1 1   17    1   69 o   12.006   5.0275   1.4221   8.2615  -5.3420   12.590   6.5373   10.948   12.744   5.7432   15.341   6.0129 -2.597659 8.315017 
1 1 1   17    1   70 o   43.884   2.6393   79.579   9.3975   81.543   14.115   78.015   12.595   44.049   3.9736   43.193   3.6103 0.8564568 5.368768 
1 1 1   17    1   71 o   41.154   2.7160   70.133   9.0605   66.544   13.540   73.044   12.193   39.631   4.2580   41.754   3.6179 -2.123497 5.587484 
1 1 1   17    1   72 o   36.030   3.3224   54.329   9.6481   52.257   15.937   55.527   12.122   34.407   5.8944   36.157   4.1903 -1.750320 7.232018 
1 1 1   17    1   73 o   10.322   4.6574  -3.7634   8.3072 -11.1830   14.180   0.1140   10.250   12.381   5.7663   12.715   5.4714 -0.3341990 7.948930 
1 1 1   17    1   74 f   9.0239   4.2495  -8.2446   8.0664   8.8343   13.767 -17.1722   9.9538   17.099   6.7304   8.7959   4.2873 8.303089 7.979937 
1 1 1   17    1   75 o   47.422   2.6349   93.202   10.145   87.379   17.034   96.403   12.630   45.106   4.7017   48.029   3.2451 -2.923176 5.712801 
1 1 1   17    1   76 o   71.483   1.9869  210.154   11.566  206.370   17.810  212.913   15.211   70.379   3.1121   71.720   2.6061 -1.341499 4.059202 
1 1 1   17    1   77 o   43.881   2.9892   80.392   10.629   82.420   21.440   79.731   12.238   42.756   6.3439   43.518   3.4789 -0.7627029 7.235183 
1 1 1   17    1   78 o   27.187   3.9221   31.774   8.4410   34.446   13.123   29.888   11.024   27.472   6.0261   25.792   5.4163 1.679735 8.102489 
1 1 1   17    1   79 f   50.128   2.8171  104.717   11.465  105.974   16.102  103.425   16.327   49.883   3.9932   49.216   4.1072 0.6677208 5.728423 
1 1 1   17    1   80 o   13.777   5.5851   4.5492   9.7674   8.1918   14.298   1.3617   13.375   16.824   6.7799   14.498   6.2443 2.325789 9.217322 
1 1 1   17    1   81 o   26.782   4.4095   31.427   9.2916   41.128   16.503   26.925   11.243   29.396   6.9899   24.205   5.7784 5.191246 9.069126 
1 1 1   17    1   82 o   39.314   2.5399   64.370   8.0961   61.421   10.930   67.955   12.051   38.006   3.5698   39.909   3.7482 -1.903130 5.176178 
1 1 1   17    1   83 o   41.924   2.1670   72.784   7.3804   76.106   11.097   70.150   9.8829   42.470   3.2297   40.867   2.9874 1.603222 4.399476 
1 1 1   17    1   84 o   16.664   4.7229   12.429   6.7076   5.8124   10.761   16.633   8.5777   14.577   5.8794   19.091   5.3162 -4.513729 7.926499 
1 1 1   17    1   85 o   48.578   1.9255   97.454   7.6096   90.601   11.420  102.926   10.206   46.387   3.0369   49.693   2.5277 -3.306866 3.951209 
1 1 1   17    1   86 o   9.9242   4.3751  -1.1781   6.8993   2.2280   9.7736  -4.5613   9.7407   12.826   5.4250   10.883   4.9628 1.942391 7.352526 
1 1 1   17    1   87 o   16.429   4.8797   12.196   7.0099   15.690   9.8766   8.6487   9.9508   18.437   5.8520   15.226   5.7944 3.211174 8.235376 
1 1 1   17    1   88 o   33.495   2.6668   47.216   7.2212   52.663   9.9269   41.094   10.524   34.986   3.5290   30.443   4.3656 4.542650 5.613592 
1 1 1   17    1   89 o   30.157   2.6379   38.359   6.4193   38.697   9.4657   38.070   8.7347   29.657   4.0188   29.573   3.7045 0.8441162E-01 5.465691 
1 1 1   17    1   90 o   19.847   3.9694   17.633   6.1972   25.118   9.2740   11.593   8.3301   23.239   5.0410   16.043   5.3926 7.196260 7.381833 
1 1 1   17    1   91 o   19.399   3.9740   16.932   6.0725   23.913   9.0887   11.302   8.1616   22.579   5.0632   15.807   5.3378 6.772196 7.357224 
1 1 1   17    1   92 o   9.1156   4.0063  -0.6473   5.7442   2.9375   8.5730  -3.5678   7.7380   12.193   5.1146   9.6501   4.4091 2.542637 6.752722 
1 1 1   17    1   93 o   26.387   3.0040   30.000   6.3464   28.297   9.7083   31.271   8.3865   24.497   5.0303   26.411   4.0223 -1.913589 6.440672 
1 1 1   17    1   94 o   24.774   3.2714   26.814   6.4451   15.918   9.4874   36.153   8.7829   18.030   5.7371   28.457   3.8878 -10.42760 6.930312 
1 1 1   17    1   95 o   16.988   4.4722   13.572   6.2766   9.3389   9.6590   16.667   8.2578   14.895   5.6991   18.482   5.2410 -3.586859 7.742570 
1 1 1   17    1   96 o   15.463   5.3093   11.274   8.0794   13.346   9.5079   5.8888   15.325   16.572   5.7563   15.234   6.6225 1.337689 8.774543 
1 1 1   17    1   97 o   46.978   2.6758   94.292   10.205   82.731   11.171  152.576   25.082   43.598   3.1649   55.785   5.5911 -12.18758 6.424722 
1 1 1   17    1   98 f   37.491   3.7981   63.143   11.447   64.462   13.133   58.972   23.355   37.311   4.4027   29.975   8.9078 7.336708 9.936460 
1 1 1   17    1   99 o   22.103   6.8171   27.311   13.502   10.296   16.630   60.223   23.129   16.352   7.0015   30.364   8.8224 -14.01195 11.26304 
1 1 1   17    1  100 f   20.371   6.7702   23.210   13.135   37.206   16.922   1.9952   20.834   24.866   7.6251   15.534   7.1481 9.332013 10.45171 
1 1 1   17    1  101 o   27.892   6.1429   40.958   13.588   41.901   16.591   39.036   23.682   26.719   7.3758   23.291   8.9206 3.428383 11.57501 
1 1 1   17    1  102 o   32.329   5.7132   53.244   14.505   50.994   17.789   57.709   25.058   29.513   7.4070   27.920   9.3525 1.593096 11.93037 
1 1 1   17    1  103 o   33.996   5.5340   58.237   14.808   37.177   17.826  105.136   26.601   24.148   7.8804   41.648   8.1275 -17.50045 11.32062 
1 1 1   17    1  104 o   22.531   6.3383   28.032   12.127   24.335   16.768   32.086   17.559   19.889   7.5329   22.317   7.8180 -2.427679 10.85661 
1 1 1   17    1  105 o   20.264   6.5555   23.386   12.351   45.000   17.731   3.0137   17.214   26.892   7.6976   14.556   6.6218 12.33653 10.15386 
1 1 1   17    1  106 o   10.655   5.1102 -10.7453   12.780  -9.8261   16.057 -12.3341   21.109   12.100   5.7828   13.347   6.4432 -1.247293 8.657700 
1 1 1   17    1  107 o   12.537   5.8951  -5.1935   15.419  -7.1175   22.011  -3.3396   21.606   14.124   6.7558   14.497   6.8653 -0.3730812 9.631896 
1 1 1   17    1  108 o   14.691   6.5389   6.1043   15.777   3.9398   22.156   8.3310   22.472   15.522   7.2223   16.222   7.4497 -0.6991673 10.37591 
1 1 1   17    1  109 o   18.545   7.3043   21.195   16.225   4.4623   22.588   39.030   23.321   15.588   7.2661   22.260   8.7602 -6.671259 11.38148 
1 1 1   17    1  110 f   14.102   6.3757   3.6273   15.658  -0.5952   22.232   7.7836   22.057   14.853   7.0129   16.009   7.3624 -1.155532 10.16786 
1 1 1   17    1  111 o   12.077   5.7361  -7.5481   15.302  -3.7129   21.741 -11.3125   21.540   14.389   6.8351   13.454   6.4982 0.9353352 9.431061 
1 1 1   17    2 -109 f   12.356   5.9745 -12.9200   18.334 -28.1163   26.047   2.0017   25.811   13.036   6.4645   15.770   7.4786 -2.734603 9.885296 
1 1 1   17    2 -108 o   12.010   5.8226 -13.9711   17.709  -6.1146   25.261 -21.5636   24.833   14.741   7.0993   13.226   6.5129 1.514953 9.634181 
1 1 1   17    2 -107 o   10.338   5.1569 -30.7788   17.595 -29.5593   25.008 -31.9743   24.760   12.647   6.2826   12.413   6.1805 0.2338667 8.813001 
1 1 1   17    2 -106 o   25.270   7.2499   39.156   15.711   41.059   19.382   35.511   26.829   24.199   8.2253   20.882   8.9159 3.317348 12.13046 
1 1 1   17    2 -105 o   13.358   6.1203   0.3996   15.045   5.9620   18.288 -11.2500   26.466   15.176   6.8729   14.577   7.0791 0.5992508 9.866639 
1 1 1   17    2 -104 o   20.197   7.3463   25.448   15.651   23.816   19.252   28.628   26.876   19.264   7.8296   19.876   8.7026 -0.6118450 11.70633 
1 1 1   17    2 -103 o   14.842   6.2962   8.5297   13.230   1.0030   18.628   16.190   18.794   14.494   6.7016   17.467   7.4601 -2.973034 10.02821 
1 1 1   17    2 -102 o   17.903   6.7568   17.865   13.464  -6.5433   18.630   44.550   19.480   13.423   6.3620   25.866   8.2195 -12.44312 10.39399 
1 1 1   17    2 -101 o   10.773   5.1682 -11.2378   13.093  -0.7390   18.732 -21.2668   18.308   14.354   6.6657   11.616   5.6941 2.738191 8.766675 
1 1 1   17    2 -100 o   12.169   5.6219  -3.1152   13.069  -8.9916   18.451   2.8022   18.515   13.115   6.2487   14.930   6.8210 -1.815036 9.250537 
1 1 1   17    2  -99 o   13.007   6.0265  -2.9970   15.180   7.3912   18.200 -26.7434   27.516   15.782   7.0237   13.830   6.8191 1.951880 9.789430 
1 1 1   17    2  -98 o   27.855   6.1439   40.812   13.575   30.586   18.455   52.866   20.038   21.940   7.9778   29.133   8.1303 -7.192915 11.39069 
1 1 1   17    2  -97 o   22.150   6.6611   27.230   13.000   25.114   17.570   29.791   19.326   20.446   7.7183   21.668   8.1127 -1.221754 11.19765 
1 1 1   17    2  -96 o   10.500   5.0269 -11.2200   12.248   1.7444   17.301 -24.2437   17.341   14.682   6.6632   11.119   5.4689 3.562691 8.620166 
1 1 1   17    2  -95 o   43.507   4.8293   89.436   16.839   76.305   30.609   95.135   20.164   31.553   10.328   43.607   5.8178 -12.05405 11.85397 
1 1 1   17    2  -94 o   26.113   7.0698   37.914   15.415   34.827   28.807   39.153   18.247   22.373   9.3795   25.491   7.9356 -3.118113 12.28609 
1 1 1   17    2  -93 o   15.334   6.5598   6.9808   14.573   34.944   27.442  -4.0029   17.199   22.825   9.3211   13.866   6.4212 8.958489 11.31882 
1 1 1   17    2  -92 o   24.755   7.1104   33.418   15.104   8.3978   28.403   43.282   17.834   18.499   8.4504   27.724   7.6449 -9.224979 11.39538 
1 1 1   17    2  -91 o   32.390   6.0665   51.900   15.429   49.587   29.814   52.746   18.031   26.639   10.055   31.540   7.1756 -4.900290 12.35249 
1 1 1   17    2  -90 o   27.768   5.8482   37.705   12.818   45.511   18.816   30.944   17.510   28.664   7.8318   23.584   7.8161 5.080801 11.06477 
1 1 1   17    2  -89 o   24.327   5.6267   28.608   10.936   24.740   14.158   34.329   17.218   21.821   7.0152   25.084   7.6913 -3.262642 10.41008 
1 1 1   17    2  -88 o   23.326   5.7324   26.301   10.821   18.755   14.054   37.289   16.958   19.586   6.9820   26.498   7.5093 -6.912109 10.25367 
1 1 1   17    2  -87 o   34.909   3.2184   52.216   9.0553   61.114   14.518   46.551   11.585   36.613   4.9946   32.191   4.5409 4.422112 6.750216 
1 1 1   17    2  -86 o   13.613   5.2477   6.5113   8.2321  -6.2354   13.105   14.820   10.580   12.276   5.6565   17.925   6.0773 -5.648176 8.302387 
1 1 1   17    2  -85 o   12.325   5.1037   3.0975   8.3772   10.012   13.192  -1.5742   10.844   16.629   6.5750   12.203   5.4268 4.426426 8.525331 
1 1 1   17    2  -84 o   23.270   4.5553   24.343   8.3312   41.409   13.651   14.213   10.517   29.764   5.8350   17.780   6.0588 11.98390 8.411624 
1 1 1   17    2  -83 o   27.698   3.8862   33.366   8.5333   32.830   13.827   33.696   10.845   26.132   6.5144   27.275   5.0641 -1.143082 8.251237 
1 1 1   17    2  -82 o   15.355   4.5718   10.450   6.1472   5.9835   7.6015   18.892   10.450   13.257   5.0597   20.145   5.9516 -6.888681 7.811691 
1 1 1   17    2  -81 o   21.945   3.8720   21.038   6.6732   22.978   8.5921   18.090   10.594   22.596   4.8124   19.796   6.0259 2.800371 7.711733 
1 1 1   17    2  -80 o   17.142   4.7703   13.168   6.9089   26.744   8.4332 -14.5425   12.048   24.638   4.3585   10.411   4.9848 14.22709 6.621505 
1 1 1   17    2  -79 o   13.567   5.4825   4.6103   9.3777   5.1754   15.959   4.3122   11.590   16.474   6.9482   14.482   6.0005 1.992277 9.180567 
1 1 1   17    2  -78 o   40.015   2.5383   66.654   8.2366   61.969   10.400   74.536   13.490   38.273   3.3680   41.692   4.0191 -3.418484 5.243683 
1 1 1   17    2  -77 o   12.288   4.8198   4.3104   7.0390   5.7770   8.2570   0.4100   13.466   13.552   5.2472   14.282   6.2082 -0.7303972 8.128614 
1 1 1   17    2  -76 o   18.779   4.5831   15.691   6.9530   19.006   8.6026   9.4466   11.808   20.540   5.1485   16.433   6.2977 4.107464 8.134363 
1 1 1   17    2  -75 o   35.424   2.7943   52.400   8.0034   55.680   10.241   47.256   12.827   36.278   3.5069   32.803   4.9512 3.475483 6.067351 
1 1 1   17    2  -74 f   31.716   2.8821   42.096   7.3699   49.589   9.8476   32.556   11.112   34.214   3.5841   27.045   5.2295 7.169119 6.339840 
1 1 1   17    2  -73 o   91.160   1.6019  340.577   11.903  336.253   15.949  346.014   17.885   90.374   2.1649   91.542   2.3989 -1.167809 3.231358 
1 1 1   17    2  -72 o   28.810   3.6324   35.242   8.3412   39.558   9.7659   23.600   16.039   30.412   4.0392   22.844   7.4761 7.567419 8.497532 
1 1 1   17    2  -71 o   11.148   4.7948  -0.0290   7.8644   1.5067   9.2154  -4.1454   15.087   12.527   5.2815   14.192   6.3503 -1.665555 8.259565 
1 1 1   17    2  -70 o   14.681   5.2516   8.1348   7.9577   10.746   9.4760   1.8888   14.657   16.437   5.7443   15.444   6.5918 0.9931850 8.743509 
1 1 1   17    2  -69 o   38.257   3.1064   61.043   9.6040   55.104   11.682   73.428   16.870   36.047   4.0453   41.228   5.1304 -5.180347 6.533462 
1 1 1   17    2  -68 o   28.519   3.2740   34.154   7.4732   33.267   10.061   35.247   11.163   27.753   4.6086   28.456   4.9944 -0.7029781 6.795816 
1 1 1   17    2  -67 o   66.147   1.8248  179.387   9.8298  156.988   13.121  208.037   14.840   61.681   2.6156   71.036   2.5670 -9.354465 3.664802 
1 1 1   17    2  -66 o   14.316   5.0150   7.8136   7.2251   11.583   9.9319   3.5763   10.530   17.064   5.8855   14.061   5.7618 3.002670 8.236297 
1 1 1   17    2  -65 o   36.738   2.6741   55.838   7.9535   51.946   10.708   60.626   11.878   35.161   3.7963   37.987   3.8909 -2.826302 5.436072 
1 1 1   17    2  -64 o   29.502   3.2699   36.386   7.7316   27.060   10.600   46.990   11.302   24.857   5.3872   33.314   4.2594 -8.456816 6.867579 
1 1 1   17    2  -63 o   12.918   4.9358   4.9818   7.2387  -7.3136   9.7967   19.767   10.743   10.562   4.8751   21.249   5.9613 -10.68704 7.700906 
1 1 1   17    2  -62 o  136.784   1.6768  765.018   18.696  753.807   26.257  776.546   26.627  135.560   2.3762  137.590   2.3741 -2.030212 3.358930 
1 1 1   17    2  -61 o   38.301   2.7671   60.590   8.5811   77.773   12.307   44.331   11.971   43.258   3.5206   32.290   4.6848 10.96782 5.860181 
1 1 1   17    2  -60 o   12.065   4.8899   2.6916   7.4846   0.7803   10.572   4.6121   10.598   13.268   5.6285   14.569   5.8490 -1.300781 8.117278 
1 1 1   17    2  -59 o   42.980   2.8840   76.220   10.046   75.445   17.109   76.628   12.411   42.230   5.0713   42.956   3.5767 -0.7257881 6.205734 
1 1 1   17    2  -58 o   14.563   5.4145   6.9535   8.5784   0.2047   13.954   11.053   10.876   14.983   6.4144   17.281   6.1441 -2.298419 8.882282 
1 1 1   17    2  -57 o   40.067   2.9689   66.268   9.6278   68.964   15.285   64.495   12.396   40.499   4.7182   39.339   3.9177 1.160011 6.132651 
1 1 1   17    2  -56 o   17.553   5.2006   13.030   7.9700   28.895   11.094  -3.8916   11.457   25.861   5.4356   12.538   5.5770 13.32213 7.787680 
1 1 1   17    2  -55 o   59.106   1.9326  142.943   9.2988  147.610   14.134  139.382   12.347   59.919   2.9025   58.271   2.6060 1.648281 3.900713 
1 1 1   17    2  -54 o   87.083   1.6350  309.677   11.606  327.115   17.682  296.477   15.383   89.364   2.4295   85.109   2.2193 4.255455 3.290583 
1 1 1   17    2  -53 o   92.894   1.6252  352.348   12.307  337.841   18.192  364.589   16.711   90.823   2.4595   94.427   2.1710 -3.604103 3.280639 
1 1 1   17    2  -52 o   27.673   3.8859   32.115   8.5245   21.576   12.847   40.405   11.394   22.473   6.5881   30.937   4.6630 -8.464449 8.071316 
1 1 1   17    2  -51 o   15.975   5.3187   10.046   8.1060   18.183   12.679   4.4219   10.542   20.953   6.6280   14.570   5.8389 6.383244 8.833100 
1 1 1   17    2  -50 o   96.676   1.6092  381.512   12.681  367.984   18.783  392.842   17.190   94.824   2.4321   98.043   2.1510 -3.219238 3.246790 
1 1 1   17    2  -49 o   33.719   3.1001   46.976   8.4256   35.117   13.065   55.420   11.024   28.591   5.8043   36.544   3.7542 -7.952408 6.912622 
1 1 1   17    2  -48 o  121.525   1.5205  602.668   15.062  621.879   22.568  587.235   20.227  123.357   2.2443  119.896   2.0696 3.460960 3.052899 
1 1 1   17    2  -47 o   63.539   1.9730  165.032   10.206  167.681   15.056  162.779   13.883   63.939   2.8963   63.020   2.7089 0.9182968 3.965701 
1 1 1   17    2  -46 o   68.865   1.7764  193.717   9.9633  185.074   15.297  200.086   13.130   67.198   2.7988   69.936   2.3064 -2.737663 3.626631 
1 1 1   17    2  -45 o  101.346   1.5462  419.093   12.774  435.019   19.463  407.043   16.930  103.181   2.3141   99.832   2.0804 3.348541 3.111790 
1 1 1   17    2  -44 o  101.828   1.5502  423.075   12.868  411.874   19.338  431.976   17.238  100.398   2.3629  102.850   2.0561 -2.452782 3.132231 
1 1 1   17    2  -43 o   35.956   2.8584   53.213   8.3089   49.394   12.864   55.947   10.884   34.332   4.7216   36.759   3.6818 -2.427406 5.987384 
1 1 1   17    2  -42 o   69.263   2.1597  196.106   12.179  195.754   15.687  196.639   19.323   69.132   2.7894   69.201   3.4362 -0.6863403E-01 4.425897 
1 1 1   17    2  -41 o  127.957   1.9340  668.353   20.172  651.305   26.678  691.111   30.825  126.237   2.5926  129.990   2.9091 -3.753662 3.896706 
1 1 1   17    2  -40 o   98.408   2.0112  395.341   16.133  382.753   21.595  411.242   24.270   96.722   2.7418  100.227   2.9740 -3.504601 4.044995 
1 1 1   17    2  -39 o   96.796   2.0555  382.515   16.218  389.426   21.990  374.271   24.016   97.562   2.7679   95.599   3.0859 1.963371 4.145390 
1 1 1   17    2  -38 o  148.151   1.5237  895.370   18.401  913.982   26.867  878.928   25.253  149.610   2.2031  146.724   2.1114 2.885864 3.051476 
1 1 1   17    2  -37 o  174.896   1.5705  1247.85   22.390  1241.76   32.209  1253.55   31.146  174.381   2.2659  175.219   2.1806 -0.8382111 3.144734 
1 1 1   17    2  -36 o   35.683   3.0127   52.432   8.6812   61.359   13.569   46.245   11.296   38.418   4.4128   33.310   4.2572 5.107845 6.131597 
1 1 1   17    2  -35 o   64.962   1.8068  172.329   9.5583  166.884   13.602  177.640   13.435   63.859   2.6186   65.899   2.5055 -2.040180 3.624183 
1 1 1   17    2  -34 o   56.244   1.9651  129.260   8.9958  131.259   13.062  127.456   12.407   56.601   2.8400   55.784   2.7370 0.8175468 3.944198 
1 1 1   17    2  -33 o  110.416   1.4664  497.254   13.198  490.192   18.470  504.623   18.867  109.591   2.0675  111.191   2.0816 -1.600372 2.933869 
1 1 1   17    2  -32 o   98.307   1.5080  394.178   12.084  387.842   16.878  400.842   17.309   97.479   2.1241   99.098   2.1428 -1.619011 3.017176 
1 1 1   17    2  -31 o  163.151   1.4749  1085.62   19.615  1065.32   26.794  1109.07   28.794  161.569   2.0345  164.841   2.1429 -3.272202 2.954837 
1 1 1   17    2  -30 o  144.401   1.4437  850.397   16.993  830.302   23.228  873.537   24.926  142.643   1.9977  146.301   2.0901 -3.658218 2.891201 
1 1 1   17    2  -29 o  158.205   1.5377  1020.84   19.831  1012.64   28.637  1028.39   27.488  157.508   2.2304  158.738   2.1244 -1.230499 3.080212 
1 1 1   17    2  -28 o   91.999   1.7562  345.275   13.170  318.467   17.805  377.665   19.572   88.281   2.4767   96.141   2.4995 -7.859261 3.518734 
1 1 1   17    2  -27 o  175.992   1.7005  1263.44   24.395  1301.71   33.377  1219.55   35.744  178.577   2.2929  172.820   2.5373 5.757111 3.419852 
1 1 1   17    2  -26 o   63.007   2.1004  162.185   10.772  155.929   14.857  169.119   15.643   61.706   2.9624   64.265   2.9943 -2.559383 4.212052 
1 1 1   17    2  -25 o   46.001   2.5944   86.681   9.6890   92.802   13.501   80.181   13.913   47.508   3.5111   44.090   3.9119 3.418213 5.256455 
1 1 1   17    2  -24 o  198.688   1.7704  1610.35   28.674  1602.40   38.369  1620.41   43.153  198.130   2.3757  199.202   2.6576 -1.072266 3.564619 
1 1 1   17    2  -23 o  177.849   1.5817  1290.02   22.931  1285.64   33.041  1294.08   31.850  177.483   2.2838  178.075   2.1941 -0.5912781 3.167037 
1 1 1   17    2  -22 o  143.134   1.5345  835.518   17.903  835.762   26.288  835.307   24.450  143.104   2.2536  143.078   2.0964 0.2626038E-01 3.077898 
1 1 1   17    2  -21 o  117.104   2.1035  559.549   20.079   0.0000   0.0000  559.549   20.079  ?   ?   117.104   2.1035 0.000000 2.103508 
1 1 1   17    2  -20 o   75.228   1.9835  231.042   12.152  228.655   22.305  232.049   14.492   74.685   3.6752   75.365   2.3619 -0.6798859 4.368653 
1 1 1   17    2  -19 o   98.129   1.8026  392.773   14.419  431.212   26.987  377.417   17.057  102.678   3.2283   96.174   2.1758 6.504189 3.893118 
1 1 1   17    2  -18 o   64.182   2.1219  168.258   11.086  164.029   19.046  170.425   13.633   63.226   3.7119   64.560   2.5959 -1.333565 4.529551 
1 1 1   17    2  -17 o  193.180   1.7661  1522.14   27.812  1464.26   43.107  1563.41   36.401  189.367   2.7926  195.734   2.2815 -6.366928 3.606045 
1 1 1   17    2  -16 o   78.049   1.8034  248.471   11.474  249.968   17.302  247.295   15.329   78.199   2.7184   77.803   2.4200 0.3960190 3.639545 
1 1 1   17    2  -15 o  166.341   1.5882  1128.38   21.535  1118.17   31.004  1137.91   29.934  165.534   2.2977  166.997   2.1990 -1.463394 3.180417 
1 1 1   17    2  -14 o  136.230   1.7592  756.933   19.536  756.421   28.050  757.415   27.224  136.133   2.5277  136.229   2.4516 -0.9518433E-01 3.521295 
1 1 1   17    2  -13 o   93.705   1.7482  358.118   13.353  359.481   20.620  357.134   17.524   93.800   2.6997   93.552   2.2979 0.2472076 3.545209 
1 1 1   17    2  -12 o   47.536   2.6190   92.518   10.109  119.464   16.077   74.897   13.001   53.934   3.6789   42.634   3.7801 11.30017 5.274779 
1 1 1   17    2  -11 o   88.683   1.7923  320.768   12.957  321.052   20.617  320.584   16.657   88.628   2.8574   88.607   2.3082 0.2125549E-01 3.673255 
1 1 1   17    2  -10 o   31.292   3.8164   40.624   9.5336   76.094   15.541   19.221   12.072   42.880   4.5137   21.493   6.4086 21.38715 7.838562 
1 1 1   17    2   -9 o  100.448   1.7378  411.501   14.229  434.126   22.731  396.922   18.247  103.089   2.7073   98.630   2.2695 4.459358 3.532770 
1 1 1   17    2   -8 o  153.754   1.7861  964.170   22.386  1001.87   39.314  946.083   27.232  156.625   3.0793  152.278   2.1939 4.346710 3.780890 
1 1 1   17    2   -7 o   60.380   2.2811  148.969   11.207  147.088   17.825  150.199   14.412   59.876   3.6698   60.580   2.9271 -0.7036819 4.694163 
1 1 1   17    2   -6 o  199.616   1.7993  1625.16   29.277  1653.20   45.174  1604.85   38.444  201.238   2.7539  198.314   2.3782 2.923996 3.638608 
1 1 1   17    2   -5 o  245.437   2.3289  2458.01   46.594  2532.13   76.512  2414.33   58.742  248.879   3.7714  243.160   2.9636 5.718567 4.796509 
1 1 1   17    2   -4 o  163.226   2.0317  1086.83   27.033  1054.59   44.002  1106.38   34.261  160.666   3.3598  164.646   2.5528 -3.980148 4.219565 
1 1 1   17    2   -3 o  127.183   2.0237  659.842   20.981  719.475   36.377  630.117   25.683  132.663   3.3666  124.255   2.5357 8.407990 4.214679 
1 1 1   17    2   -2 o  242.719   2.3170  2403.81   45.842  2404.82   74.207  2403.19   58.296  242.549   3.7533  242.603   2.9479 -0.5430603E-01 4.772518 
1 1 1   17    2   -1 o  143.412   2.2493  839.142   26.295  886.432   39.893  802.814   34.966  147.306   3.3223  140.210   3.0593 7.095261 4.516329 
1 1 1   17    2    0 o  101.545   2.1390  420.665   17.705  411.683   23.162  433.291   27.462  100.379   2.8335  102.939   3.2769 -2.560509 4.332085 
1 1 1   17    2    1 o  291.789   2.5805  3474.93   61.378  3420.43   78.700  3559.55   98.063  289.356   3.3366  295.013   4.0778 -5.656921 5.268913 
1 1 1   17    2    2 o  231.910   2.2726  2194.39   42.961  2188.63   55.718  2202.83   67.464  231.520   2.9524  232.173   3.5647 -0.6529694 4.628580 
1 1 1   17    2    3 o   17.937   6.4033   11.295   11.825   0.9184   15.650   25.098   18.050   16.266   6.8718   24.875   7.9131 -8.608974 10.48039 
1 1 1   17    2    4 o   55.495   2.8297  126.058   12.758  128.458   17.555  123.371   18.574   55.919   3.8753   54.758   4.1931 1.161213 5.709601 
1 1 1   17    2    5 o   43.131   3.4187   76.482   11.921   74.232   16.655   78.845   17.072   42.288   4.9236   43.604   4.8869 -1.316574 6.937111 
1 1 1   17    2    6 o   79.572   2.2615  258.553   14.654  265.261   20.026  250.823   21.499   80.537   3.0561   78.281   3.3772 2.255814 4.554648 
1 1 1   17    2    7 o  159.073   1.9919  1032.20   25.829  1034.35   33.983  1029.27   39.745  159.189   2.6189  158.754   3.0713 0.4348450 4.036231 
1 1 1   17    2    8 o  141.872   1.9784  821.044   22.880  808.976   29.966  837.915   35.429  140.782   2.6112  143.241   3.0343 -2.459198 4.003181 
1 1 1   17    2    9 o   56.646   2.5366  131.226   11.683  134.982   17.418  128.154   15.753   57.341   3.7469   55.894   3.4746 1.446362 5.110029 
1 1 1   17    2   10 o   67.589   2.2607  186.606   12.438  183.021   18.268  189.705   16.982   66.845   3.3635   68.085   3.0678 -1.240616 4.552387 
1 1 1   17    2   11 o   44.069   3.0635   79.697   10.936   72.323   16.342   85.679   14.718   41.734   4.8967   45.596   4.0004 -3.862461 6.323028 
1 1 1   17    2   12 o   34.059   3.9294   48.065   10.710   54.712   16.375   43.097   14.157   36.067   5.7638   31.942   5.6434 4.125217 8.066575 
1 1 1   17    2   13 o  238.458   2.2669  2320.23   44.064  2305.14   69.583  2330.34   56.934  237.474   3.5946  238.886   2.9238 -1.411331 4.633533 
1 1 1   17    2   14 o   97.853   2.0166  390.619   16.085  379.583   26.127  397.355   20.413   96.327   3.3324   98.634   2.5410 -2.306923 4.190626 
1 1 1   17    2   15 o   45.036   3.1153   83.243   11.366   72.576   19.033   89.155   14.170   41.655   5.7592   46.544   3.7671 -4.888966 6.881809 
1 1 1   17    2   16 o  108.658   1.9580  481.637   17.342  430.382   27.253  516.517   22.482  102.581   3.2633  112.495   2.4517 -9.914490 4.081664 
1 1 1   17    2   17 o   76.669   2.4659  240.170   15.391  236.168   33.112  241.273   17.383   75.671   5.4036   76.819   2.7806 -1.148270 6.077086 
1 1 1   17    2   18 o   51.986   2.6196  110.608   11.065   93.215   16.752  124.068   14.737   47.516   4.3742   55.002   3.3021 -7.486832 5.480676 
1 1 1   17    2   19 o  105.432   1.8182  453.421   15.626  457.265   22.994  450.123   21.300  105.795   2.6685  105.011   2.4883 0.7842941 3.648635 
1 1 1   17    2   20 o   73.668   2.2433  221.669   13.455  229.736   18.627  212.868   19.457   74.928   3.0561   72.094   3.3198 2.834541 4.512294 
1 1 1   17    2   21 o   57.060   3.0926  133.411   14.331  134.807   17.067  130.076   26.388   57.296   3.6735   55.949   5.8735 1.347527 6.927697 
1 1 1   17    2   22 o  130.625   2.1174  696.252   22.545  698.706   33.216  694.156   30.700  130.767   3.1161  130.363   2.8890 0.4034729 4.249324 
1 1 1   17    2   23 o  155.334   2.1545  984.624   27.281  967.443   39.585  1000.16   37.649  153.864   3.1562  156.471   2.9518 -2.606247 4.321392 
1 1 1   17    2   24 o  174.020   1.9893  1235.58   28.218  1247.92   45.816  1228.03   35.818  174.735   3.2166  173.430   2.5336 1.305237 4.094615 
1 1 1   17    2   25 o   63.439   2.3012  164.482   11.880  168.433   18.224  161.562   15.667   64.081   3.5021   62.804   3.0696 1.277691 4.656921 
1 1 1   17    2   26 o  216.626   1.9879  1914.76   35.102  1875.39   50.051  1952.86   49.242  214.258   2.8658  218.656   2.7627 -4.398193 3.980622 
1 1 1   17    2   27 o  162.857   1.9680  1082.19   26.126  1128.16   43.065  1055.42   32.864  166.130   3.1801  160.774   2.5077 5.356506 4.049857 
1 1 1   17    2   28 o  154.016   1.7944  967.721   22.528  1007.44   33.205  933.846   30.665  157.064   2.5935  151.231   2.4875 5.833603 3.593595 
1 1 1   17    2   29 o  129.684   1.7782  686.104   18.798  696.170   27.681  677.489   25.608  130.561   2.6009  128.814   2.4388 1.747849 3.565457 
1 1 1   17    2   30 o   27.123   4.6180   31.007   9.8446   24.404   15.260   35.714   12.884   24.130   7.2076   28.974   5.6585 -4.843306 9.163404 
1 1 1   17    2   31 o   59.735   2.3185  145.897   11.268  164.322   17.268  132.234   14.870   63.296   3.3588   56.777   3.2262 6.519356 4.657253 
1 1 1   17    2   32 o   49.646   2.6829  100.978   10.817  106.031   16.785   97.389   14.146   50.706   4.0956   48.651   3.5925 2.055244 5.447972 
1 1 1   17    2   33 o  100.335   1.8423  410.770   15.068  418.387   22.453  404.530   20.323  101.158   2.7254   99.491   2.5080 1.666275 3.703745 
1 1 1   17    2   34 o   69.779   2.1368  198.943   12.140  210.119   18.307  190.173   16.218   71.612   3.1438   68.147   2.9265 3.465797 4.295100 
1 1 1   17    2   35 o   27.904   4.4280   32.723   9.7358   25.529   14.764   38.257   12.950   24.522   7.0258   30.023   5.4941 -5.501152 8.918900 
1 1 1   17    2   36 o   87.668   1.9228  313.667   13.741  327.683   20.666  302.562   18.396   89.490   2.8366   86.012   2.6269 3.477715 3.866127 
1 1 1   17    2   37 o   88.177   2.0751  317.405   14.915  312.546   24.729  320.182   18.699   87.304   3.4819   88.484   2.5953 -1.180351 4.342711 
1 1 1   17    2   38 o  126.222   1.7634  650.121   18.144  650.122   26.502  650.120   24.892  126.136   2.5775  126.155   2.4206 -0.1882172E-01 3.535915 
1 1 1   17    2   39 o   95.574   1.8677  372.805   14.551  343.313   21.489  397.776   19.773   91.584   2.8821   98.673   2.4584 -7.089386 3.788153 
1 1 1   17    2   40 o   42.543   3.8822   74.821   13.315   74.356   20.475   75.162   17.527   41.966   6.1694   42.411   5.1770 -0.4449005 8.053719 
1 1 1   17    2   41 o  106.981   3.0816  468.684   26.845   0.0000   0.0000  468.684   26.845  ?   ?   106.981   3.0816 0.000000 3.081575 
1 1 1   17    2   42 o  120.558   2.2365  593.642   21.978  620.431   33.099  572.515   29.394  123.049   3.3029  118.245   3.0521 4.803848 4.497193 
1 1 1   17    2   43 o   20.016   6.1769   16.596   11.083  -1.9455   14.896   39.590   16.589   15.074   6.5412   30.270   6.8796 -15.19561 9.492976 
1 1 1   17    2   44 o   95.283   1.8584  370.616   14.434  387.731   21.625  356.866   19.384   97.331   2.7283   93.399   2.5484 3.932159 3.733355 
1 1 1   17    2   45 o  115.683   1.7882  546.264   16.862  579.937   25.291  519.316   22.625  119.093   2.6052  112.716   2.4624 6.376801 3.584727 
1 1 1   17    2   46 o  104.971   2.0290  450.021   17.362  463.147   23.250  433.476   26.104  106.377   2.6834  102.835   3.1177 3.541870 4.113458 
1 1 1   17    2   47 o   12.594   5.3310   0.5102   9.4498  -0.7559   14.747   1.3922   12.309   15.267   6.5661   14.555   6.1185 0.7118511 8.974903 
1 1 1   17    2   48 o   18.075   5.7247   13.362   9.4560   12.723   14.850   13.798   12.264   19.392   7.1394   19.001   6.5405 0.3914547 9.682416 
1 1 1   17    2   49 o   29.041   4.3337   35.471   9.9454   44.822   15.430   28.825   13.008   32.332   6.0778   25.810   6.2500 6.521276 8.717917 
1 1 1   17    2   50 o   57.436   2.4842  135.193   11.603  145.315   17.946  127.921   15.211   59.355   3.7280   55.739   3.3634 3.615845 5.020944 
1 1 1   17    2   51 o   83.382   2.0471  284.104   13.914  265.896   20.590  299.407   18.876   80.465   3.1453   85.473   2.7127 -5.008080 4.153536 
1 1 1   17    2   52 o  102.906   2.0469  432.784   17.170  421.112   27.859  439.933   21.803  101.216   3.3813  103.669   2.5801 -2.453659 4.253286 
1 1 1   17    2   53 o   61.511   2.4352  155.076   12.186  169.780   18.846  144.511   15.975   64.155   3.6185   59.230   3.3220 4.924496 4.912092 
1 1 1   17    2   54 o   96.543   1.9044  380.882   14.987  360.923   22.073  397.952   20.414   93.776   2.8911   98.550   2.5433 -4.773666 3.850532 
1 1 1   17    2   55 o   44.063   2.9079   79.980   10.386   76.824   15.895   82.331   13.720   42.831   4.6258   44.541   3.8156 -1.709389 5.996430 
1 1 1   17    2   56 o   11.930   5.1195  -0.3273   8.9283   1.6298   13.751  -1.7539   11.740   15.294   6.4501   13.267   5.7814 2.027512 8.661900 
1 1 1   17    2   57 o   83.347   1.9260  284.015   13.085  273.429   19.424  292.811   17.706   81.562   2.9264   84.486   2.5740 -2.924278 3.897287 
1 1 1   17    2   58 o   26.576   4.7982   30.224   10.012   18.403   13.432   45.005   15.019   21.056   6.8383   32.262   5.9296 -11.20618 9.051097 
1 1 1   17    2   59 o   35.832   4.2544   53.933   12.184   44.290   16.097   66.869   18.643   31.825   6.4265   39.439   5.9871 -7.613300 8.783219 
1 1 1   17    2   60 o   17.468   6.1807   11.486   10.995   3.3318   15.203   20.424   15.918   16.383   6.8373   22.238   7.4543 -5.855011 10.11515 
1 1 1   17    2   61 o   42.479   3.6769   75.150   12.607   72.928   16.920   77.923   18.902   41.433   5.1185   42.696   5.5633 -1.263775 7.559688 
1 1 1   17    2   62 o  112.948   2.1531  522.702   19.824  509.098   23.641  554.923   36.383  111.332   2.6050  115.641   3.8652 -4.308395 4.661046 
1 1 1   17    2   63 o   10.761   4.7494  -2.1247   8.1528   8.1437   13.009  -8.7657   10.462   16.836   6.5673   10.699   4.9728 6.137295 8.237586 
1 1 1   17    2   64 o   65.745   2.0659  177.318   11.058  197.221   16.973  162.641   14.575   69.090   3.0210   62.775   2.8558 6.314510 4.157209 
1 1 1   17    2   65 o   74.806   1.9532  229.429   11.900  230.305   17.914  228.737   15.919   74.668   2.9491   74.516   2.6249 0.1517715 3.948084 
1 1 1   17    2   66 o   15.031   5.3860   8.3695   8.3740   17.716   13.256   2.1632   10.802   20.477   6.8011   13.736   5.7501 6.741550 8.906099 
1 1 1   17    2   67 o   47.011   2.5180   91.215   9.6141  113.664   15.320   76.632   12.348   52.160   3.6259   42.799   3.5720 9.361271 5.089777 
1 1 1   17    2   68 o   33.779   3.2742   47.751   8.9026   54.271   14.247   43.574   11.403   35.428   5.0783   31.880   4.5141 3.548594 6.794624 
1 1 1   17    2   69 o   32.474   3.4070   44.308   8.8846   66.043   14.199   30.323   11.390   39.326   4.5110   26.145   5.5179 13.18075 7.127109 
1 1 1   17    2   70 o   43.252   2.6148   77.486   9.1760   72.887   14.526   80.539   11.836   41.353   4.3757   43.883   3.3339 -2.529686 5.501036 
1 1 1   17    2   71 o   26.809   3.8735   30.711   8.2196   24.078   12.950   35.187   10.637   23.004   6.5765   28.425   4.7587 -5.421795 8.117617 
1 1 1   17    2   72 o   30.819   3.3992   40.070   8.3979   40.848   13.236   39.546   10.865   30.316   5.5611   30.222   4.5512 0.9416008E-01 7.186043 
1 1 1   17    2   73 o   41.468   2.6462   71.421   8.8982   84.328   14.074   62.825   11.485   44.603   3.9104   38.534   3.7019 6.068405 5.384710 
1 1 1   17    2   74 f   38.148   3.0315   60.908   9.3491   67.049   12.741   53.746   13.761   39.667   3.9949   35.062   4.9524 4.604271 6.362796 
1 1 1   17    2   75 o   38.415   3.4336   62.285   10.638   73.450   16.594   54.494   13.862   40.955   5.0795   35.263   4.9593 5.692543 7.099000 
1 1 1   17    2   76 o   21.823   5.5483   21.659   9.8900   25.457   15.893   19.259   12.634   23.285   7.4273   20.609   6.6270 2.675877 9.954010 
1 1 1   17    2   77 o   42.541   2.8025   75.580   9.6642   70.727   16.615   78.062   11.881   39.993   5.2211   42.989   3.4186 -2.995853 6.240716 
1 1 1   17    2   78 o   69.084   1.8898  196.551   10.632  197.911   15.384  195.308   14.711   68.931   2.7435   68.531   2.6384 0.4001999 3.806280 
1 1 1   17    2   79 o   27.739   3.6193   32.989   7.9886   34.046   11.950   32.135   10.742   27.348   5.5502   26.753   5.1120 0.5947247 7.545674 
1 1 1   17    2   80 o   49.022   2.3426   99.718   9.3338   97.185   13.614  101.965   12.821   47.868   3.5136   49.191   3.2152 -1.323231 4.762619 
1 1 1   17    2   81 o   18.582   5.4605   15.732   8.8166   13.141   11.934   18.846   13.082   17.727   6.4197   20.235   6.7572 -2.508179 9.320527 
1 1 1   17    2   82 o   19.869   4.9396   17.963   7.9662   9.3322   10.779   28.353   11.826   15.857   6.0316   24.588   5.9626 -8.730387 8.481325 
1 1 1   17    2   83 o   17.337   4.8771   13.628   7.1803   17.466   10.038   9.6058   10.275   19.393   5.8578   15.775   5.9137 3.617769 8.323809 
1 1 1   17    2   84 o   45.476   2.2228   85.954   8.2150   70.525   11.009  105.342   12.340   40.677   3.3498   49.943   3.0457 -9.265453 4.527411 
1 1 1   17    2   85 o   16.029   4.8500   11.610   6.8769   3.7483   9.8226   19.168   9.6311   13.274   5.5141   20.167   5.6396 -6.892958 7.887410 
1 1 1   17    2   86 o   49.387   1.9282  101.031   7.7477   88.548   12.082  109.751   10.097   45.544   3.2762   51.242   2.4243 -5.697975 4.075582 
1 1 1   17    2   87 o   16.576   4.5144   12.576   6.2634  -1.1594   9.5787   22.835   8.2783   11.535   5.1168   22.311   4.7004 -10.77600 6.948043 
1 1 1   17    2   88 o   31.358   2.6112   41.567   6.6143   41.850   10.113   41.355   8.7438   30.663   4.1527   30.826   3.5442 -0.1630688 5.459473 
1 1 1   17    2   89 o   24.822   3.4627   26.964   6.8160   11.261   11.833   34.760   8.3381   16.384   6.2980   28.086   3.7345 -11.70210 7.321915 
1 1 1   17    2   90 o   24.057   3.5944   25.554   6.8328   36.669   11.738   19.858   8.4033   27.722   5.3885   20.422   5.0712 7.300730 7.399545 
1 1 1   17    2   91 o   8.7320   3.9965  -3.2174   6.3939 -23.5393   10.969   7.2405   7.8689   8.3425   4.1470   13.579   5.1562 -5.235990 6.616967 
1 1 1   17    2   92 o   27.767   3.1128   33.478   6.9245   36.504   11.816   31.895   8.5458   27.390   5.4835   26.535   4.0815 0.8551102 6.835708 
1 1 1   17    2   93 o   24.975   4.0767   28.440   8.0134   25.320   11.824   31.091   10.898   22.002   6.2820   25.124   5.4763 -3.122440 8.333907 
1 1 1   17    2   94 o   31.492   3.9075   44.774   9.8157   45.341   12.408   43.827   16.046   30.667   5.1457   28.263   7.0014 2.403109 8.688953 
1 1 1   17    2   95 o   13.383   5.1713   7.1895   8.0077   12.369   9.3566  -6.9912   15.482   15.990   5.6973   12.615   5.9240 3.374763 8.219054 
1 1 1   17    2   96 o   15.157   5.5108   10.784   8.8059   10.328   9.5727   13.295   22.454   15.062   5.6946   17.819   7.8726 -2.757028 9.716223 
1 1 1   17    2   97 o   13.591   5.3691   7.2867   8.7899   11.201   9.6433 -11.9382   21.372   15.414   5.7388   13.782   6.6094 1.632105 8.753166 
1 1 1   17    2   98 o   17.032   6.6502   14.666   13.350   20.736   16.636   3.6845   22.376   19.044   7.4271   16.031   7.3882 3.013384 10.47605 
1 1 1   17    2   99 o   13.590   6.0115   3.1534   13.132   6.4682   16.178  -3.2472   22.481   15.171   6.6933   14.989   7.0696 0.1811094 9.735455 
1 1 1   17    2  100 o   24.454   6.8278   34.118   14.129   30.268   17.390   41.596   24.233   21.818   7.7678   23.524   9.0203 -1.705605 11.90402 
1 1 1   17    2  101 o   20.142   7.0607   23.981   14.323   14.056   17.614   43.354   24.609   17.032   7.2466   23.774   9.0965 -6.742041 11.63014 
1 1 1   17    2  102 o   15.703   6.9257   8.6399   17.306   8.6399   17.306   0.0000   0.0000   15.703   6.9257  ?   ?  0.000000 6.925656 
1 1 1   17    2  103 o   23.095   7.5994   33.920   16.562   27.388   24.040   39.822   22.851   19.878   8.4620   23.005   8.7746 -3.126667 12.19010 
1 1 1   17    2  104 o   13.358   6.1786  -1.1487   15.854  -5.4704   22.897   2.8315   21.974   14.519   6.9299   15.412   7.1783 -0.8933229 9.977494 
1 1 1   17    2  105 o   13.714   6.2834   1.0608   15.859   10.161   22.900  -7.3272   21.985   16.571   7.5765   14.042   6.7260 2.529043 10.13126 
1 1 1   17    2  106 o   16.417   6.8954   13.647   15.614   44.263   23.052 -12.3066   21.224   23.771   8.8683   13.246   6.4107 10.52501 10.94277 
1 1 1   17    2  107 o   13.931   6.3396   2.7552   15.793  -1.7413   23.075   6.7178   21.661   14.824   7.0416   15.740   7.2594 -0.9159803 10.11354 
1 1 1   17    2  108 o   14.564   6.5122   5.8363   15.838   9.5278   22.972   2.4921   21.865   16.342   7.5149   15.161   7.0938 1.180717 10.33416 
1 1 1   17    3 -106 o   15.368   6.9513   7.4172   18.640   14.285   26.746   0.9310   25.992   17.312   8.0137   15.588   7.4244 1.724109 10.92432 
1 1 1   17    3 -105 o   11.732   5.7383 -17.9991   18.284 -41.6718   25.829   5.7801   25.887   12.027   6.0358   16.125   7.5995 -4.098534 9.704779 
1 1 1   17    3 -104 o   13.598   6.3936  -2.6514   18.138  -6.6984   24.407   2.3403   27.107   14.487   6.9771   15.890   7.5719 -1.403314 10.29627 
1 1 1   17    3 -103 o   21.883   8.0064   33.293   18.629   17.730   25.116   52.328   27.777   17.820   8.0637   24.188   9.5478 -6.367794 12.49737 
1 1 1   17    3 -102 o   15.765   6.7676   10.882   15.611  -2.8332   19.163   37.940   26.917   13.940   6.5598   21.472   9.0382 -7.532874 11.16784 
1 1 1   17    3 -101 o   10.357   5.1145 -23.1417   15.687 -20.8845   18.927 -28.0957   28.039   11.755   5.7680   13.572   6.7263 -1.816418 8.860785 
1 1 1   17    3 -100 o   14.455   6.4761   4.5960   15.746   4.3963   19.225   5.0032   27.444   15.176   6.9399   16.555   7.8090 -1.379483 10.44713 
1 1 1   17    3  -99 o   11.348   5.4765 -13.2644   15.215 -10.0504   18.751 -19.4597   26.034   12.984   6.2171   13.911   6.8131 -0.9270535 9.223378 
1 1 1   17    3  -98 o   14.552   6.2680   6.9394   13.477  -5.3677   18.475   20.938   19.704   13.576   6.4048   18.768   7.8043 -5.192052 10.09591 
1 1 1   17    3  -97 o   14.585   6.2341   7.2533   13.143   7.2074   18.321   7.3019   18.864   15.679   7.0079   15.797   7.0821 -0.1184616 9.963264 
1 1 1   17    3  -96 o   12.164   5.6154  -3.1494   13.005 -15.8018   17.499   12.458   19.436   11.979   5.8030   16.996   7.4220 -5.017177 9.421304 
1 1 1   17    3  -95 o   32.466   5.5150   52.737   14.074   29.670   19.407   78.323   20.439   21.463   8.1095   37.855   6.8768 -16.39270 10.63276 
1 1 1   17    3  -94 o   11.881   5.5173  -4.6319   12.833  -0.6825   18.327  -8.4315   17.976   14.471   6.6754   13.182   6.2483 1.288573 9.143431 
1 1 1   17    3  -93 f   14.277   6.1144   5.8546   12.688   6.3408   18.240   5.3986   17.662   15.774   7.0251   15.458   6.8969 0.3156853 9.844728 
1 1 1   17    3  -92 o   17.213   6.5799   14.799   12.868   19.440   18.612   10.550   17.810   18.936   7.6976   16.667   7.1924 2.268806 10.53488 
1 1 1   17    3  -91 f   15.530   6.6213   8.0563   14.759   7.3284   27.520   8.3502   17.486   17.749   8.1847   16.201   7.0581 1.547382 10.80769 
1 1 1   17    3  -90 o   21.163   7.1795   24.891   14.766   11.652   27.157   30.447   17.594   18.539   8.3875   22.730   7.8336 -4.190710 11.47671 
1 1 1   17    3  -89 o   10.014   4.9110 -21.0917   13.666 -33.4359   26.194 -16.4752   16.019   13.502   6.6564   11.654   5.6228 1.847736 8.713408 
1 1 1   17    3  -88 o   35.854   5.2682   60.855   14.938   85.701   28.890   51.787   17.452   37.103   9.5093   31.396   6.9982 5.707256 11.80683 
1 1 1   17    3  -87 o   13.891   6.1432   1.2215   13.706 -31.1972   25.661   14.160   16.212   13.721   6.7292   18.001   7.2316 -4.279807 9.878159 
1 1 1   17    3  -86 o   24.427   4.8621   27.783   9.3407   34.488   17.222   24.989   11.118   25.098   7.6917   22.472   5.9691 2.625956 9.736166 
1 1 1   17    3  -85 o   8.8750   4.2121  -8.3901   8.2202  -0.2876   13.578 -13.0785   10.328   13.628   6.0656   9.4075   4.5328 4.220047 7.572233 
1 1 1   17    3  -84 o   11.870   4.9936   2.3412   8.2097  -2.5410   13.350   5.3106   10.411   13.091   5.9056   13.946   5.7235 -0.8546257 8.223996 
1 1 1   17    3  -83 o   34.763   3.3671   51.927   9.4220   62.602   16.815   47.042   11.375   36.464   5.8554   32.493   4.4084 3.971481 7.329351 
1 1 1   17    3  -82 o   16.308   5.3638   11.934   8.2514   3.6665   13.378   17.010   10.483   14.747   6.2962   19.002   6.0286 -4.254742 8.717057 
1 1 1   17    3  -81 o   19.996   4.1333   17.847   6.5144   18.211   8.2355   17.238   10.648   19.866   5.0696   19.182   6.0748 0.6834393 7.912260 
1 1 1   17    3  -80 f   25.474   3.4661   27.965   7.0111   28.728   9.0531   26.822   11.082   25.361   4.5462   23.917   5.7545 1.444382 7.333673 
1 1 1   17    3  -79 o   13.607   4.9942   7.0144   7.2575   2.7021   8.2273   22.139   15.408   12.173   5.0508   21.553   7.3336 -9.380106 8.904603 
1 1 1   17    3  -78 o   14.587   5.9192   5.6581   10.982  -1.9125   13.027   24.260   20.419   13.372   5.9473   22.684   8.3683 -9.311854 10.26635 
1 1 1   17    3  -77 o   43.930   2.5160   80.383   8.9720   90.374   10.491   53.183   17.311   46.480   2.7817   33.640   6.5486 12.84003 7.114876 
1 1 1   17    3  -76 o   19.796   4.2630   17.376   6.6754   15.337   8.5813   20.501   10.623   18.403   5.3815   21.039   5.9370 -2.636082 8.012998 
1 1 1   17    3  -75 o   21.138   4.3347   19.774   7.2180   31.118   9.8663   6.7103   10.587   26.481   4.7450   14.885   5.8886 11.59599 7.562500 
1 1 1   17    3  -74 o   48.272   2.2388   96.455   8.7853   90.225   12.089  103.429   12.790   46.303   3.2229   49.609   3.1795 -3.306789 4.527280 
1 1 1   17    3  -73 o   55.625   2.0511  127.649   9.2840  123.106   12.934  132.477   13.334   54.282   2.9340   56.325   2.9141 -2.042850 4.135253 
1 1 1   17    3  -72 o   53.460   2.0964  117.931   9.1180  123.517   11.531  108.611   14.894   54.535   2.6015   50.683   3.6292 3.852329 4.465276 
1 1 1   17    3  -71 o   12.393   4.8213   4.5097   6.9966  -1.2667   8.7442   14.789   11.665   11.274   4.9493   18.597   6.3796 -7.322496 8.074330 
1 1 1   17    3  -70 o   26.020   3.9516   29.141   8.1184   28.066   9.5833   31.872   15.278   25.214   4.8387   26.068   7.0300 -0.8545704 8.534274 
1 1 1   17    3  -69 o   36.867   2.8281   56.661   8.4341   57.486   10.646   55.268   13.822   36.890   3.5854   35.642   4.8860 1.248199 6.060359 
1 1 1   17    3  -68 o   29.219   3.5967   36.210   8.3859   35.061   11.093   37.742   12.811   28.254   4.9992   29.094   5.6050 -0.8393955 7.510564 
1 1 1   17    3  -67 o   34.168   2.9599   48.746   8.1627   49.496   10.291   47.475   13.403   34.189   3.7545   32.944   5.1602 1.244457 6.381546 
1 1 1   17    3  -66 o   47.385   2.2048   92.541   8.4927   85.185   11.250  102.285   12.949   45.220   3.0703   49.516   3.2256 -4.296001 4.453223 
1 1 1   17    3  -65 o   35.092   2.7353   51.154   7.7627   62.651   10.630   38.016   11.363   38.669   3.4071   29.579   4.8831 9.090078 5.954270 
1 1 1   17    3  -64 o   74.903   1.7486  229.845   10.677  231.946   14.401  227.281   15.910   75.052   2.3568   74.198   2.6347 0.8538742 3.535018 
1 1 1   17    3  -63 o   30.667   3.0772   39.276   7.5885   39.413   10.408   39.121   11.087   30.374   4.3259   30.151   4.6614 0.2226810 6.359371 
1 1 1   17    3  -62 o   22.846   4.0827   22.410   7.3239   20.945   10.130   24.015   10.602   21.754   5.6593   23.283   5.6451 -1.528912 7.993426 
1 1 1   17    3  -61 o   9.6868   4.3389  -2.8649   7.0635 -13.3224   9.6468   9.2217   10.371   9.2426   4.4346   16.168   5.9640 -6.925665 7.431994 
1 1 1   17    3  -60 o  102.583   1.7810  430.719   14.893  417.967   22.305  440.978   20.006  100.734   2.7188  103.629   2.3683 -2.894684 3.605691 
1 1 1   17    3  -59 o   62.527   2.1265  160.438   10.823  135.024   16.376  180.143   14.420   57.002   3.5419   66.129   2.6807 -9.127148 4.441995 
1 1 1   17    3  -58 o   44.229   2.3407   80.469   8.4090   71.746   15.246   84.283   10.081   41.201   4.6190   45.191   2.7497 -3.990250 5.375517 
1 1 1   17    3  -57 o   74.781   1.6173  228.591   9.8588  214.824   14.692  239.867   13.297   72.306   2.4965   76.491   2.1346 -4.184959 3.284714 
1 1 1   17    3  -56 o   28.436   3.1634   33.704   7.2087   38.447   11.555   30.682   9.2236   29.976   4.8981   26.844   4.3651 3.132347 6.560864 
1 1 1   17    3  -55 o   35.598   2.6185   52.277   7.5452   53.315   11.970   51.593   9.7191   35.621   4.2034   35.212   3.4295 0.4093475 5.424931 
1 1 1   17    3  -54 f   12.144   4.7805   3.6117   6.9465   5.6708   11.242   2.3399   8.8351   15.284   6.0611   12.776   5.2610 2.507942 8.025920 
1 1 1   17    3  -53 o   49.718   2.0727  101.308   8.3819   84.840   12.706  113.995   11.153   45.253   3.4711   52.663   2.6061 -7.410416 4.340534 
1 1 1   17    3  -52 o   24.026   3.8974   24.414   7.3715   13.749   11.085   32.868   9.8700   18.552   6.2206   27.824   4.5057 -9.272522 7.680957 
1 1 1   17    3  -51 o   62.144   1.8446  157.970   9.3335  171.167   14.165  147.845   12.408   64.559   2.6977   60.018   2.5419 4.540981 3.706565 
1 1 1   17    3  -50 o  116.048   1.6206  549.995   15.330  548.400   21.378  551.683   21.995  115.767   2.2654  116.101   2.3241 -0.3339996 3.245574 
1 1 1   17    3  -49 o   63.875   1.9408  166.905   10.093  173.942   15.300  161.483   13.431   65.064   2.8920   62.730   2.6324 2.334026 3.910635 
1 1 1   17    3  -48 o   41.924   2.7048   72.300   9.1941   85.658   14.038   62.265   12.167   45.455   3.8241   38.687   3.9118 6.767845 5.470429 
1 1 1   17    3  -47 o   87.225   1.7478  310.728   12.427  294.671   18.411  324.168   16.844   84.785   2.6672   88.992   2.3239 -4.206650 3.537608 
1 1 1   17    3  -46 o   46.214   2.5394   87.665   9.5293   88.392   14.555   87.120   12.607   46.185   3.9027   45.943   3.3901 0.2428017 5.169523 
1 1 1   17    3  -45 o   91.747   1.8420  343.785   13.776  323.815   18.569  368.226   20.543   88.919   2.5646   94.809   2.6608 -5.889320 3.695556 
1 1 1   17    3  -44 o   60.244   2.2746  148.578   11.150  154.250   15.327  142.202   16.250   61.273   3.0784   58.772   3.4066 2.501575 4.591485 
1 1 1   17    3  -43 o   58.409   2.2900  139.668   10.882  124.669   15.207  155.410   15.579   55.024   3.4072   61.505   3.1176 -6.480602 4.618215 
1 1 1   17    3  -42 o  116.085   1.5337  549.934   14.512  570.118   21.750  533.737   19.484  118.108   2.2591  114.300   2.0912 3.807938 3.078420 
1 1 1   17    3  -41 f   20.585   4.8859   18.177   8.0746   12.971   12.473   21.933   10.594   18.726   6.5870   22.575   5.7439 -3.849583 8.739571 
1 1 1   17    3  -40 o   46.981   2.3190   90.421   8.8535   90.281   13.557   90.525   11.691   46.779   3.5824   46.917   3.0738 -0.1381836 4.720395 
1 1 1   17    3  -39 o   90.617   1.6138  335.100   11.920  309.320   17.613  356.888   16.192   86.950   2.4876   93.473   2.1251 -6.522499 3.271724 
1 1 1   17    3  -38 o   63.122   2.1103  162.917   10.843  135.518   14.865  194.068   15.851   57.438   3.1875   68.816   2.8317 -11.37819 4.263643 
1 1 1   17    3  -37 o   37.047   3.5866   56.786   10.696   46.497   13.399   74.859   17.758   33.206   5.1139   42.276   5.2671 -9.069664 7.341278 
1 1 1   17    3  -36 o   60.495   2.3540  149.751   11.586  150.701   15.092  148.386   18.081   60.605   3.0649   60.043   3.7124 0.5620117 4.814050 
1 1 1   17    3  -35 o   59.348   2.5481  144.221   12.298  139.217   17.001  149.714   17.812   58.172   3.6029   60.328   3.6390 -2.155773 5.120868 
1 1 1   17    3  -34 o  105.216   1.9473  451.921   16.701  455.277   22.338  447.666   25.149  105.541   2.5965  104.570   2.9534 0.9704971 3.932428 
1 1 1   17    3  -33 o   47.423   2.9593   92.343   11.382   78.291   19.657   99.431   13.961   43.177   5.7261   49.145   3.5081 -5.967484 6.715303 
1 1 1   17    3  -32 o  131.616   1.7389  706.891   18.657  712.029   34.868  704.830   22.084  131.894   3.2431  131.391   2.0619 0.5027771 3.843076 
1 1 1   17    3  -31 o   39.756   2.8016   64.936   9.0210   51.177   15.058   72.639   11.267   34.822   5.4863   41.996   3.3181 -7.174107 6.411649 
1 1 1   17    3  -30 o  103.351   1.5547  435.755   13.098  439.033   19.606  433.114   17.602  103.680   2.3198  102.998   2.0965 0.6816559 3.126811 
1 1 1   17    3  -29 o  103.075   1.5672  433.426   13.168  427.839   19.658  437.972   17.734  102.348   2.3562  103.576   2.1005 -1.227242 3.156540 
1 1 1   17    3  -28 o   81.448   1.6886  270.660   11.211  264.427   16.994  275.462   14.917   80.405   2.5962   82.105   2.2309 -1.699554 3.423099 
1 1 1   17    3  -27 o   88.499   1.6487  319.525   11.894  307.759   17.748  329.117   16.025   86.761   2.5121   89.783   2.1896 -3.022003 3.332414 
1 1 1   17    3  -26 o   75.817   1.7615  234.540   10.886  222.410   16.324  244.257   14.610   73.725   2.7209   77.306   2.3211 -3.581055 3.576433 
1 1 1   17    3  -25 o   54.155   2.1753  119.916   9.5832  122.052   14.904  118.411   12.513   54.514   3.3704   53.749   2.8663 0.7648735 4.424412 
1 1 1   17    3  -24 o   98.057   1.7800  392.307   14.228  378.825   25.514  398.392   17.140   96.183   3.2590   98.792   2.1284 -2.609421 3.892431 
1 1 1   17    3  -23 o   39.299   2.9095   63.466   9.2545   63.109   16.319   63.635   11.236   38.824   5.2945   39.274   3.5479 -0.4505196 6.373337 
1 1 1   17    3  -22 o   79.938   1.8555  260.731   12.091  257.618   20.618  262.363   14.927   79.308   3.1957   80.132   2.2876 -0.8232803 3.930101 
1 1 1   17    3  -21 o   40.145   2.6996   66.134   8.7828   75.392   13.716   59.699   11.434   42.719   3.9849   38.007   3.7391 4.712093 5.464495 
1 1 1   17    3  -20 o   78.382   1.7375  250.638   11.101  240.726   16.884  258.187   14.734   76.717   2.7041   79.494   2.2762 -2.776657 3.534549 
1 1 1   17    3  -19 o   99.757   1.5919  405.909   12.944  411.914   19.511  401.189   17.300  100.443   2.3831   99.143   2.1406 1.299530 3.203305 
1 1 1   17    3  -18 o  107.620   1.6826  472.462   14.761  464.470   20.592  480.911   21.172  106.661   2.3684  108.530   2.3931 -1.869461 3.366927 
1 1 1   17    3  -17 o  178.150   1.7201  1294.69   24.979  1263.28   33.648  1333.24   37.280  175.908   2.3466  180.689   2.5311 -4.780838 3.451545 
1 1 1   17    3  -16 o  137.993   1.6070  776.702   18.077  772.923   28.227  779.330   23.536  137.580   2.5169  138.190   2.0894 -0.6094513 3.271169 
1 1 1   17    3  -15 o   19.177   5.3279   15.557   8.6260   28.156   14.101   8.0231   10.905   25.644   6.6799   16.210   6.0888 9.434772 9.038508 
1 1 1   17    3  -14 o  221.045   1.8301  1993.39   32.976  1980.75   50.754  2002.63   43.380  220.194   2.8276  221.478   2.4028 -1.284790 3.710678 
1 1 1   17    3  -13 o  195.190   1.8798  1554.42   29.909  1603.27   53.960  1532.75   35.933  198.015   3.3430  193.779   2.2749 4.235367 4.043626 
1 1 1   17    3  -12 f   54.477   2.3378  121.369   10.357  121.271   19.023  121.410   12.348   54.231   4.3393   54.447   2.7914 -0.2163849 5.159657 
1 1 1   17    3  -11 o   95.341   1.7457  370.801   13.567  400.126   23.482  356.107   16.622   98.920   2.9153   93.410   2.1830 5.510094 3.642041 
1 1 1   17    3  -10 o   50.172   2.4959  103.028   10.176  135.586   18.703   89.338   12.128   57.408   4.0221   46.641   3.2095 10.76648 5.145684 
1 1 1   17    3   -9 o  190.841   1.7532  1485.67   27.273  1543.38   44.345  1450.55   34.588  194.383   2.7986  188.520   2.2508 5.863678 3.591436 
1 1 1   17    3   -8 o   94.451   1.7276  363.893   13.301  339.559   21.420  379.165   16.969   91.125   2.8873   96.390   2.1597 -5.264717 3.605654 
1 1 1   17    3   -7 o   71.032   1.8699  205.981   10.818  193.889   16.732  214.667   14.180   68.823   2.9895   72.476   2.4035 -3.653397 3.835920 
1 1 1   17    3   -6 o   25.123   4.5370   26.654   8.9496   37.257   14.824   20.573   11.226   29.519   6.3493   22.018   6.0630 7.501005 8.779198 
1 1 1   17    3   -5 o  123.203   1.7897  619.190   17.974  616.003   25.644  622.268   25.200  122.829   2.5612  123.457   2.5041 -0.6278381 3.581963 
1 1 1   17    3   -4 o   84.504   1.9695  291.350   13.567  293.363   19.434  289.436   18.947   84.702   2.8187   84.138   2.7664 0.5644073 3.949399 
1 1 1   17    3   -3 o  107.305   1.8247  469.721   15.961  475.027   22.966  464.764   22.197  107.859   2.6121  106.692   2.5522 1.167030 3.651999 
1 1 1   17    3   -2 o   94.608   1.9035  365.157   14.679  364.757   21.094  365.533   20.441   94.467   2.7423   94.576   2.6541 -0.1090927 3.816290 
1 1 1   17    3   -1 o   72.257   1.9377  213.162   11.403  215.096   18.349  211.945   14.554   72.486   3.1127   72.010   2.4832 0.4757843 3.981834 
1 1 1   17    3    0 o  124.616   1.6413  633.382   16.673  603.455   25.852  654.695   21.816  121.569   2.6088  126.665   2.1129 -5.095802 3.357095 
1 1 1   17    3    1 o  264.255   2.0300  2849.26   43.728  2805.90   66.708  2881.93   57.903  262.039   3.1230  265.658   2.6739 -3.619202 4.111312 
1 1 1   17    3    2 o  176.425   1.7066  1269.59   24.544  1323.32   38.881  1234.00   31.645  180.020   2.6496  173.886   2.2326 6.133911 3.464833 
1 1 1   17    3    3 o  138.326   1.7724  780.517   19.985  804.053   29.619  760.847   27.077  140.329   2.5893  136.521   2.4332 3.808014 3.553125 
1 1 1   17    3    4 o  202.868   1.9245  1679.06   31.824  1636.46   45.342  1720.43   44.678  200.169   2.7789  205.256   2.6703 -5.087219 3.853915 
1 1 1   17    3    5 o  184.350   1.8613  1386.44   27.970  1363.94   40.192  1407.56   38.947  182.753   2.6980  185.669   2.5734 -2.916275 3.728444 
1 1 1   17    3    6 o   20.077   5.6246   17.034   9.5707   14.896   14.864   18.548   12.509   20.316   7.1866   21.234   6.5638 -0.9182758 9.732940 
1 1 1   17    3    7 o  164.472   1.8045  1103.51   24.192  1089.71   34.975  1116.18   33.499  163.358   2.6265  165.346   2.4854 -1.988190 3.616049 
1 1 1   17    3    8 o   58.279   2.3975  138.882   11.365  119.958   17.228  153.464   15.123   53.994   3.9415   61.209   3.0405 -7.215237 4.977967 
1 1 1   17    3    9 o  190.046   2.0643  1473.81   31.979  1438.66   41.542  1524.92   50.099  187.685   2.7154  193.156   3.1819 -5.470535 4.183026 
1 1 1   17    3   10 o  179.887   2.0343  1320.42   29.830  1356.79   39.840  1274.03   45.002  182.269   2.6814  176.558   3.1269 5.710754 4.119150 
1 1 1   17    3   11 o  125.007   1.9608  637.604   19.981  633.592   26.572  642.823   30.309  124.560   2.6170  125.429   2.9644 -0.8694763 3.954313 
1 1 1   17    3   12 f  142.070   1.9549  823.551   22.640  841.210   30.448  801.714   33.858  143.525   2.6025  140.074   2.9653 3.450363 3.945398 
1 1 1   17    3   13 o   98.708   2.7685  398.304   22.254  398.304   22.254   0.0000   0.0000   98.708   2.7685  ?   ?  0.000000 2.768499 
1 1 1   17    3   14 o   45.112   3.0929   83.566   11.305   76.003   16.070   90.975   15.906   42.796   4.6831   46.940   4.2014 -4.143742 6.291496 
1 1 1   17    3   15 o   62.355   2.4630  159.002   12.495  156.573   17.621  161.458   17.719   61.769   3.5142   62.733   3.4786 -0.9636078 4.944754 
1 1 1   17    3   16 o  157.178   1.9562  1008.06   25.063  993.251   33.199  1027.68   38.217  155.950   2.6116  158.585   2.9564 -2.634750 3.944691 
1 1 1   17    3   17 o  114.492   2.2009  535.040   20.541  696.324   51.026  503.850   22.439  130.167   4.8173  111.083   2.4781 19.08403 5.417366 
1 1 1   17    3   18 o   40.923   3.7912   69.134   12.503   53.299   33.504   71.696   13.477   35.363   10.706   41.649   4.0195 -6.285976 11.43604 
1 1 1   17    3   19 o  148.833   1.9464  903.879   23.613  880.211   38.511  918.137   29.892  146.722   3.2200  149.951   2.4455 -3.229034 4.043332 
1 1 1   17    3   20 o  103.291   1.9854  435.378   16.717  403.430   27.442  454.228   21.079   99.253   3.3969  105.469   2.4519 -6.215660 4.189315 
1 1 1   17    3   21 o  121.107   1.7771  598.387   17.544  568.404   25.426  625.634   24.238  117.962   2.6443  123.782   2.4022 -5.820107 3.572487 
1 1 1   17    3   22 o   58.953   2.3593  142.133   11.315  138.400   17.077  145.055   15.107   58.037   3.6278   59.482   3.1266 -1.444592 4.789243 
1 1 1   17    3   23 o   79.141   2.1642  255.863   13.948  268.735   19.353  241.946   20.122   81.033   2.9347   76.849   3.2193 4.183769 4.356154 
1 1 1   17    3   24 o   67.144   2.4906  184.382   13.608  180.907   18.225  188.762   20.458   66.411   3.3776   67.797   3.7161 -1.385674 5.021752 
1 1 1   17    3   25 o  193.014   2.3134  1521.19   36.397  1559.28   52.408  1485.69   50.587  195.232   3.2932  190.578   3.2564 4.654251 4.631277 
1 1 1   17    3   26 o  230.312   2.2215  2165.67   41.705  2177.71   66.710  2157.95   53.435  230.641   3.5483  229.772   2.8529 0.8690186 4.552974 
1 1 1   17    3   27 o   98.609   2.0052  396.890   16.118  415.753   26.639  385.997   20.244  100.755   3.2477   97.169   2.5580 3.586006 4.134163 
1 1 1   17    3   28 o  170.184   1.9788  1182.15   27.451  1217.01   44.719  1161.08   34.773  172.477   3.1807  168.583   2.5304 3.894745 4.064491 
1 1 1   17    3   29 o  106.167   2.1392  460.190   18.513  514.360   38.416  443.804   21.129  111.884   4.2198  104.228   2.4869 7.656227 4.898088 
1 1 1   17    3   30 o  106.445   1.9469  462.478   16.893  432.948   27.679  480.008   21.326  102.796   3.3075  108.401   2.4134 -5.604919 4.094456 
1 1 1   17    3   31 o   70.642   2.2538  204.005   12.962  202.788   21.785  204.672   16.127   70.232   3.8196   70.699   2.8039 -0.4665909 4.738284 
1 1 1   17    3   32 o  115.635   1.8058  545.700   17.021  511.157   25.180  574.768   23.098  111.816   2.7625  118.616   2.3889 -6.799545 3.652156 
1 1 1   17    3   33 o   58.021   2.3826  137.758   11.245  139.233   17.479  136.717   14.688   58.168   3.7056   57.717   3.1337 0.4508057 4.853016 
1 1 1   17    3   34 o   76.848   2.2333  241.406   13.975  211.939   25.422  254.167   16.729   71.694   4.3709   78.814   2.6076 -7.119926 5.089596 
1 1 1   17    3   35 o   77.799   2.2191  247.416   14.059  253.434   25.501  244.788   16.851   78.485   3.9992   77.333   2.6771 1.152100 4.812520 
1 1 1   17    3   36 o   89.227   2.4023  325.554   17.457  356.306   27.514  304.832   22.586   93.158   3.6302   86.225   3.2190 6.932755 4.851840 
1 1 1   17    3   37 o   19.644   6.1498   15.879   10.943   12.453   15.509   19.276   15.441   19.559   7.2787   22.027   7.3410 -2.467459 10.33782 
1 1 1   17    3   38 o   81.144   2.2040  269.169   14.565  263.768   19.617  275.804   21.741   80.220   3.0053   81.993   3.2593 -1.772270 4.433411 
1 1 1   17    3   39 o   55.345   2.4097  125.432   10.845  135.908   16.950  118.169   14.113   57.448   3.6382   53.611   3.2445 3.836205 4.874776 
1 1 1   17    3   40 o   19.938   5.5055   16.953   9.2422   2.1978   14.775   26.438   11.846   16.063   6.7246   24.764   5.9439 -8.701130 8.975030 
1 1 1   17    3   41 f   70.394   2.1406  202.635   12.269  202.119   18.720  203.024   16.243   70.148   3.2830   70.374   2.8373 -0.2259369 4.339159 
1 1 1   17    3   42 o   86.974   1.9647  308.951   13.929  278.477   20.898  333.312   18.685   82.385   3.1174   90.239   2.5426 -7.854080 4.022862 
1 1 1   17    3   43 o  123.235   2.0389  620.425   20.482  632.584   27.438  605.125   30.780  124.327   2.7074  121.480   3.1109 2.847099 4.124049 
1 1 1   17    3   44 o  157.938   1.8465  1018.69   23.772  992.818   34.290  1042.64   32.986  155.742   2.7010  159.642   2.5348 -3.900070 3.704160 
1 1 1   17    3   45 o   72.276   2.2179  213.747   13.052  199.519   20.121  224.082   17.149   69.609   3.5579   73.911   2.8517 -4.301743 4.559699 
1 1 1   17    3   46 o  105.647   1.8907  455.946   16.282  442.848   24.263  466.676   21.961  103.926   2.8669  106.788   2.5229 -2.862076 3.818895 
1 1 1   17    3   47 o   56.383   2.9320  130.663   13.429  143.737   18.697  116.731   19.301   58.958   3.9126   52.972   4.5127 5.985619 5.972714 
1 1 1   17    3   48 o   32.334   4.1118   43.784   10.593   33.060   17.028   50.554   13.529   27.483   7.4264   34.594   4.9375 -7.111067 8.917980 
1 1 1   17    3   49 o   11.538   5.1072  -2.9029   9.4930   5.2861   15.350  -7.9747   12.080   17.108   6.9770   11.993   5.4906 5.114986 8.878406 
1 1 1   17    3   50 o   60.246   2.3708  148.800   11.620  157.582   18.379  142.952   14.998   61.754   3.6677   58.919   3.1341 2.835598 4.824373 
1 1 1   17    3   51 o   57.868   2.3969  137.349   11.282  108.225   17.038  160.091   15.056   51.019   4.1321   62.382   2.9693 -11.36296 5.088362 
1 1 1   17    3   52 o   38.373   3.3286   61.018   10.309   52.987   16.996   65.693   12.966   35.026   6.1786   39.672   4.0671 -4.646358 7.397035 
1 1 1   17    3   53 o   23.559   4.8652   23.909   9.0335   38.195   14.501   14.849   11.548   29.593   6.2097   19.139   6.3476 10.45393 8.879842 
1 1 1   17    3   54 f   37.201   3.3302   57.435   9.9919   46.157   14.678   67.176   13.640   32.719   5.7110   40.046   4.2431 -7.327324 7.114758 
1 1 1   17    3   55 o   65.518   2.4159  176.210   12.880  197.675   20.813  162.887   16.398   69.073   3.7102   62.815   3.2131 6.257938 4.908133 
1 1 1   17    3   56 o   27.970   4.5464   33.360   10.010   52.066   16.603   22.679   12.546   34.609   6.1087   22.770   6.4613 11.83877 8.891787 
1 1 1   17    3   57 o   80.665   2.1984  266.836   14.442  277.091   22.322  259.453   18.940   81.873   3.3518   79.351   2.9333 2.521683 4.454039 
1 1 1   17    3   58 o   15.276   5.3811   8.7838   8.3267   2.5203   13.273   12.849   10.693   15.187   6.3668   17.931   6.1091 -2.744032 8.823705 
1 1 1   17    3   59 o   10.487   4.7994  -5.8902   9.2190 -15.2055   12.787   4.1938   13.304   10.993   5.2276   15.671   6.4548 -4.678316 8.306150 
1 1 1   17    3   60 o   9.7871   4.5765  -8.4423   9.0760  -8.6228   13.435  -8.2908   12.310   12.547   5.7614   11.953   5.4983 0.5937443 7.963967 
1 1 1   17    3   61 o   28.550   4.4896   34.915   10.104   24.287   14.046   46.312   14.545   23.372   6.8987   32.562   5.6867 -9.189713 8.940413 
1 1 1   17    3   62 o   33.608   3.7181   47.519   10.016   59.417   14.094   35.382   14.235   37.291   4.7439   28.122   6.3595 9.169065 7.933970 
1 1 1   17    3   63 o   65.024   2.3923  174.120   12.659  201.413   17.289  142.583   18.585   69.722   3.0495   58.314   3.9327 11.40836 4.976515 
1 1 1   17    3   64 o   11.372   4.8626   0.2412   8.0020   7.1851   13.162  -3.8306   10.079   16.410   6.5418   11.526   5.1711 4.884670 8.338832 
1 1 1   17    3   65 o   16.429   5.3988   11.259   8.3602   2.6328   13.249   16.965   10.776   15.025   6.3336   19.681   6.0937 -4.656838 8.789082 
1 1 1   17    3   66 o   34.908   3.1299   50.959   8.8118   45.278   14.089   54.609   11.293   32.012   5.6034   35.895   3.9234 -3.883163 6.840359 
1 1 1   17    3   67 o   28.877   3.7204   35.435   8.5541   49.223   13.912   27.052   10.847   33.511   5.2663   24.590   5.5443 8.921644 7.646770 
1 1 1   17    3   68 o   51.320   2.4684  108.928   10.296  113.197   17.802  106.783   12.621   51.586   4.2717   50.609   3.0739 0.9767647 5.262707 
1 1 1   17    3   69 o   23.976   4.6643   25.258   8.7876   23.891   15.699   25.881   10.605   22.874   7.3901   23.987   5.5360 -1.112837 9.233643 
1 1 1   17    3   70 o   15.257   5.7465   8.1582   9.7271   14.571   15.156   3.6669   12.684   19.289   7.1920   14.919   6.2371 4.370016 9.519804 
1 1 1   17    3   71 o   23.564   5.9769   25.435   11.496   48.167   23.956   18.634   13.103   30.951   8.9747   20.434   6.7609 10.51656 11.23632 
1 1 1   17    3   72 o   31.640   4.4842   43.541   11.242   55.354   19.767   37.894   13.667   34.163   7.3185   28.787   6.0182 5.375357 9.475134 
1 1 1   17    3   73 o   19.629   5.4830   17.463   9.1091   9.0536   18.843   20.028   10.406   18.502   7.6573   20.911   5.8672 -2.409298 9.646654 
1 1 1   17    3   74 o   15.401   5.3041   9.8112   8.0657   17.965   13.913   5.6841   9.8987   20.107   6.9645   14.233   5.6734 5.874162 8.982884 
1 1 1   17    3   75 o   43.492   2.6651   78.896   9.4030   82.337   15.305   76.810   11.917   43.621   4.3628   42.578   3.4635 1.042320 5.570457 
1 1 1   17    3   76 o   76.193   1.9947  239.475   12.378  239.431   19.160  239.507   16.217   75.538   3.1183   75.866   2.6263 -0.3285217 4.076928 
1 1 1   17    3   77 o   11.816   5.0200   1.2707   8.4313   13.863   14.384  -5.3208   10.407   18.543   6.9871   11.164   5.1055 7.379319 8.653642 
1 1 1   17    3   78 o   10.390   4.7514  -4.7676   9.0122  -1.4160   19.550  -5.6720   10.156   16.195   7.2388   10.909   5.0092 5.286599 8.802980 
1 1 1   17    3   79 o   36.357   3.0967   55.919   9.0904   63.838   14.858   51.181   11.492   37.864   4.9308   34.253   4.2041 3.611015 6.479734 
1 1 1   17    3   80 f   26.024   4.3079   29.965   8.8191   15.271   14.356   38.872   11.177   18.840   7.0044   29.444   4.8236 -10.60452 8.504622 
1 1 1   17    3   81 o   29.957   3.7781   38.967   9.0211   34.156   14.647   41.907   11.451   26.357   6.7791   30.569   4.7494 -4.212490 8.277256 
1 1 1   17    3   82 o   29.048   3.7790   36.767   8.7363   34.089   13.825   38.547   11.272   26.423   6.4712   29.138   4.9208 -2.715036 8.129631 
1 1 1   17    3   83 o   11.485   5.1623  -2.5494   10.096   3.1402   13.786  -9.1312   14.828   14.698   6.3352   12.559   5.8651 2.138842 8.633362 
1 1 1   17    3   84 o   42.839   2.5335   77.108   8.8073   80.916   12.546   73.407   12.367   43.248   3.5912   41.086   3.7333 2.162632 5.180167 
1 1 1   17    3   85 o   25.730   4.1924   29.711   8.4908   29.230   12.831   30.085   11.325   24.146   6.4119   24.992   5.6875 -0.8455582 8.570876 
1 1 1   17    3   86 o   11.262   4.6726   2.6321   7.0409  -7.1582   11.505   8.4951   8.9030   11.108   5.1804   14.540   5.4930 -3.432147 7.550416 
1 1 1   17    3   87 o   12.125   4.7564   4.8922   6.8557   12.736   10.993  -0.1006   8.7704   16.713   6.1443   11.254   4.9480 5.458900 7.888950 
1 1 1   17    3   88 o   11.850   4.6205   4.7801   6.4373  -6.7819   10.836   11.085   8.0024   10.743   5.0158   15.505   5.2850 -4.762268 7.286232 
1 1 1   17    3   89 o   34.716   2.6006   51.257   7.3060   50.654   12.031   51.610   9.1957   33.139   4.5757   34.394   3.3212 -1.254959 5.653993 
1 1 1   17    3   90 o   29.960   3.3361   39.409   8.0093   37.430   11.997   41.001   10.758   27.577   5.5296   29.668   4.5970 -2.090652 7.190858 
1 1 1   17    3   91 f   54.331   2.5758  125.629   11.375  127.443   14.152  122.316   19.120   54.081   3.2250   51.281   4.6237 2.799820 5.637261 
1 1 1   17    3   92 o   28.895   4.3724   38.808   9.9769   32.773   12.214   50.906   17.294   25.123   6.0391   30.271   7.1274 -5.147947 9.341869 
1 1 1   17    3   93 f   12.745   5.4785   3.4016   10.256  -1.4557   11.418   23.697   23.338   11.952   5.4198   19.909   8.4000 -7.956710 9.996697 
1 1 1   17    3   94 o   10.853   4.8765  -1.0776   9.0002  -7.5395   9.6752   40.442   24.525   9.7466   4.6092   23.642   9.0722 -13.89559 10.17593 
1 1 1   17    3   95 o   15.458   5.6568   11.507   9.3004   7.9949   10.138   30.161   23.364   14.176   5.7105   21.129   8.6111 -6.952735 10.33254 
1 1 1   17    3   96 o   15.582   5.6274   11.910   9.1621   6.1373   9.9275   45.076   23.796   13.412   5.5550   24.719   9.0479 -11.30761 10.61713 
1 1 1   17    3   97 o   28.743   5.5900   42.127   12.626   42.127   12.626   0.0000   0.0000   28.743   5.5900  ?   ?  0.000000 5.589975 
1 1 1   17    3   98 o   11.139   5.4582 -20.3722   16.765 -20.3722   16.765   0.0000   0.0000   11.139   5.4582  ?   ?  0.000000 5.458172 
1 1 1   17    3   99 o   13.248   6.4616 -17.8257   22.712 -17.8257   22.712   0.0000   0.0000   13.248   6.4616  ?   ?  0.000000 6.461590 
1 1 1   17    3  100 o   14.516   6.9429  -6.4354   23.243  -6.4354   23.243   0.0000   0.0000   14.516   6.9429  ?   ?  0.000000 6.942904 
1 1 1   17    3  101 o   36.240   9.0565   90.676   26.677   90.676   26.677   0.0000   0.0000   36.240   9.0565  ?   ?  0.000000 9.056472 
1 1 1   17    3  102 o   16.976   7.0935   15.330   16.394 -11.1466   23.279   41.384   23.093   13.914   6.7292   23.100   8.8184 -9.185298 11.09261 
1 1 1   17    3  103 o   14.157   6.4245   3.4044   16.081 -10.3736   23.633   15.285   21.945   14.009   6.7762   17.239   7.6899 -3.230071 10.24948 
1 1 1   17    3  104 o   12.608   5.9743  -6.0335   16.410  -0.0260   23.602 -11.6551   22.831   15.096   7.1567   13.641   6.6130 1.455188 9.744194 
1 1 1   17    3  105 o   18.398   7.3387   21.089   16.574   19.298   24.213   22.668   22.734   17.929   8.0318   18.534   8.0614 -0.6050568 11.37968 
1 1 1   17    3  106 o   12.001   5.7352  -8.8501   15.784 -11.4946   22.872  -6.4456   21.809   13.671   6.6255   13.983   6.6981 -0.3117266 9.421349 
1 1 1   17    4 -104 o   19.990   8.8252   32.461   28.167   32.461   28.167   0.0000   0.0000   19.990   8.8252  ?   ?  0.000000 8.825200 
1 1 1   17    4 -103 o   19.254   8.5724   28.030   27.138   28.030   27.138   0.0000   0.0000   19.254   8.5724  ?   ?  0.000000 8.572409 
1 1 1   17    4 -102 o   12.742   6.3149 -26.4321   24.700 -26.4321   24.700   0.0000   0.0000   12.742   6.3149  ?   ?  0.000000 6.314913 
1 1 1   17    4 -101 o   14.097   6.8543 -11.4777   25.013 -11.4777   25.013   0.0000   0.0000   14.097   6.8543  ?   ?  0.000000 6.854319 
1 1 1   17    4 -100 o   17.171   7.8853   13.785   25.171   13.785   25.171   0.0000   0.0000   17.171   7.8853  ?   ?  0.000000 7.885291 
1 1 1   17    4  -99 o   26.363   9.8543   62.058   28.489   62.058   28.489   0.0000   0.0000   26.363   9.8543  ?   ?  0.000000 9.854252 
1 1 1   17    4  -98 o   11.473   5.5245 -11.9289   15.284 -28.9748   18.423   25.706   27.374   10.829   5.3817   19.249   8.5874 -8.419980 10.13441 
1 1 1   17    4  -97 o   14.107   6.3497   3.5562   15.334   3.8989   18.512   2.8070   27.370   14.909   6.8148   16.240   7.7014 -1.331779 10.28360 
1 1 1   17    4  -96 o   10.635   5.1956 -17.7286   14.859 -25.8475   18.098  -0.9358   26.028   11.044   5.4610   15.697   7.4629 -4.653282 9.247602 
1 1 1   17    4  -95 o   13.673   6.2258   1.0481   15.258  -0.8992   18.695   4.9323   26.404   14.271   6.6379   16.529   7.7535 -2.258181 10.20683 
1 1 1   17    4  -94 o   11.377   5.4472 -10.8345   14.387   0.1979   17.511 -33.7466   25.236   14.175   6.5339   12.643   6.2855 1.532183 9.066385 
1 1 1   17    4  -93 o   14.640   6.2092   7.6129   12.862   12.819   17.704   1.7929   18.718   16.811   7.2115   14.811   6.8008 1.999856 9.912450 
1 1 1   17    4  -92 o   11.984   5.5314  -3.3357   12.612   23.024   17.708 -30.4714   17.967   19.600   7.6573   10.701   5.3172 8.899310 9.322360 
1 1 1   17    4  -91 o   26.745   6.1168   37.638   13.045   27.967   18.297   47.635   18.603   21.147   7.8987   27.974   7.8434 -6.827530 11.13142 
1 1 1   17    4  -90 o   18.741   6.7095   19.180   12.992   33.043   18.240   4.9030   18.510   22.905   7.9718   15.508   6.9786 7.396897 10.59481 
1 1 1   17    4  -89 o   22.290   6.5969   27.279   12.830   11.526   17.933   43.798   18.364   16.851   7.2438   26.884   7.8755 -10.03314 10.70029 
1 1 1   17    4  -88 o   13.856   6.0262   4.0149   12.702   15.182   18.197  -6.5969   17.739   17.853   7.4677   13.481   6.3339 4.371858 9.792038 
1 1 1   17    4  -87 o   12.927   5.9279  -2.7814   14.158   5.8351   26.799  -6.1171   16.674   17.535   8.0828   13.275   6.2059 4.259967 10.19042 
1 1 1   17    4  -86 o   26.133   6.9188   36.901   14.968   61.844   28.095   27.014   17.688   29.581   9.9030   21.641   7.8184 7.940104 12.61733 
1 1 1   17    4  -85 o   13.261   6.0027  -1.5065   13.931 -20.0564   26.207   5.8001   16.448   14.731   7.1280   15.710   6.8446 -0.9784660 9.882125 
1 1 1   17    4  -84 o   14.817   5.8097   8.5028   10.224   11.143   26.505   8.0412   11.082   18.897   8.4387   14.891   5.9802 4.005217 10.34279 
1 1 1   17    4  -83 o   21.384   5.7207   22.467   10.166   28.553   25.298   21.295   11.102   22.387   9.0197   20.610   6.1459 1.777435 10.91455 
1 1 1   17    4  -82 o   15.936   5.8299   11.120   9.8770   16.162   25.166   10.202   10.739   19.950   8.5787   15.737   6.0121 4.212712 10.47569 
1 1 1   17    4  -81 o   11.741   5.0164   1.6103   8.5032   22.133   16.639  -5.6437   9.8925   20.875   7.5774   10.559   4.8828 10.31542 9.014336 
1 1 1   17    4  -80 o   12.075   5.0965   2.3099   8.5965   9.2306   13.512  -2.3958   11.142   16.288   6.5815   12.061   5.4222 4.226986 8.527403 
1 1 1   17    4  -79 o   18.925   4.5179   16.352   6.8727   0.3603   8.9945   38.787   10.654   11.684   5.0763   29.362   4.6023 -17.67890 6.851984 
1 1 1   17    4  -78 o   38.072   3.0147   61.457   9.2796   68.400   14.924   57.080   11.849   39.088   4.7834   36.101   4.0988 2.986549 6.299298 
1 1 1   17    4  -77 o   28.979   3.1926   35.857   7.4167   33.928   9.6970   38.577   11.513   27.604   4.4617   29.161   5.0247 -1.556770 6.719663 
1 1 1   17    4  -76 o   16.807   4.8921   12.780   7.1060   14.200   9.3558   10.843   10.924   17.695   5.7040   16.437   6.1103 1.257795 8.358914 
1 1 1   17    4  -75 o   44.675   2.3027   82.963   8.3575   87.088   11.089   77.539   12.716   45.467   3.0088   42.535   3.7045 2.931782 4.772475 
1 1 1   17    4  -74 o   33.461   2.9094   47.162   7.8569   40.245   10.437   56.211   11.937   30.289   4.3518   35.986   4.1448 -5.697296 6.009845 
1 1 1   17    4  -73 o   46.391   2.2452   89.240   8.4650   89.014   11.158   89.545   12.992   46.031   2.9900   45.920   3.4973 0.1115532 4.601211 
1 1 1   17    4  -72 o   23.585   3.9417   24.239   7.3109   26.472   9.6602   21.244   11.185   24.222   5.0562   21.359   6.1138 2.862724 7.933725 
1 1 1   17    4  -71 o   40.794   2.4382   69.197   8.0706   69.560   10.655   68.709   12.361   40.594   3.2470   40.077   3.8304 0.5170670 5.021492 
1 1 1   17    4  -70 o   21.190   4.5436   19.981   7.6127   7.5350   10.455   34.027   11.106   15.159   5.8947   27.557   5.1331 -12.39794 7.816442 
1 1 1   17    4  -69 o   37.029   2.7933   57.336   8.3692   55.375   11.659   59.421   12.021   35.892   4.0560   37.207   4.0275 -1.314701 5.715976 
1 1 1   17    4  -68 o   55.872   2.1335  128.877   9.6991  123.390   13.587  134.578   13.850   54.291   3.0828   56.743   3.0050 -2.451786 4.305075 
1 1 1   17    4  -67 o   63.421   2.7918  167.346   14.397  167.346   14.397   0.0000   0.0000   63.421   2.7918  ?   ?  0.000000 2.791764 
1 1 1   17    4  -66 o   29.487   3.4114   36.838   8.0486   27.248   10.080   53.709   13.370   24.696   5.1731   35.102   4.7980 -10.40569 7.055635 
1 1 1   17    4  -65 f   49.180   2.2794   99.922   9.1129  100.206   11.527   99.447   14.882   49.049   2.8958   48.493   3.7949 0.5559654 4.773608 
1 1 1   17    4  -64 o   14.702   5.0055   8.7561   7.1782   9.1233   9.5009   8.2677   10.957   15.633   5.7180   15.800   6.0637 -0.1666298 8.334488 
1 1 1   17    4  -63 o   48.567   2.1970   97.273   8.6752  106.051   11.583   86.062   13.092   50.527   2.8237   45.236   3.5796 5.290859 4.559203 
1 1 1   17    4  -62 o   67.511   1.6563  186.758   9.1150  196.433   13.629  178.928   12.260   68.986   2.4274   65.884   2.2864 3.102470 3.334642 
1 1 1   17    4  -61 o   56.375   2.0215  130.683   9.2747  116.606   15.932  137.899   11.407   52.687   3.7337   57.802   2.4263 -5.114819 4.452866 
1 1 1   17    4  -60 o   50.485   2.2867  105.049   9.3862  109.869   15.489  102.252   11.800   51.166   3.7396   49.631   2.9296 1.535179 4.750486 
1 1 1   17    4  -59 o   41.521   2.3426   71.132   7.8965   63.607   11.340   78.215   11.002   38.924   3.6153   43.343   3.1353 -4.419056 4.785451 
1 1 1   17    4  -58 o   53.798   1.9759  118.846   8.6502  123.981   12.507  114.138   11.977   54.742   2.8122   52.520   2.8078 2.222454 3.973935 
1 1 1   17    4  -57 o   51.624   2.0639  109.485   8.6677  102.658   12.573  115.669   11.966   49.732   3.1171   52.895   2.7850 -3.162655 4.180011 
1 1 1   17    4  -56 o   43.722   2.3013   78.714   8.1730   72.516   11.804   84.421   11.328   41.677   3.5070   45.101   3.1000 -3.424191 4.680719 
1 1 1   17    4  -55 o   35.236   2.5837   51.327   7.3693   59.284   11.375   45.572   9.6738   37.602   3.7615   32.948   3.6638 4.654652 5.250963 
1 1 1   17    4  -54 o   39.105   2.3944   63.016   7.5959   62.884   11.607   63.115   10.046   38.767   3.7187   38.971   3.1901 -0.2044830 4.899539 
1 1 1   17    4  -53 o   47.389   2.1015   92.200   8.0978  100.141   12.287   86.101   10.767   49.192   3.0796   45.638   2.9094 3.553986 4.236576 
1 1 1   17    4  -52 o   83.718   1.6593  286.565   11.324  286.392   15.977  286.740   16.052   83.528   2.3488   83.576   2.3585 -0.4842377E-01 3.328573 
1 1 1   17    4  -51 o   33.441   2.8401   46.306   7.6688   52.626   12.027   41.975   9.9551   35.343   4.2605   31.589   3.9524 3.753719 5.811494 
1 1 1   17    4  -50 o   74.113   1.7181  224.560   10.380  198.206   15.975  243.813   13.655   69.390   2.8303   77.123   2.1742 -7.733688 3.568960 
1 1 1   17    4  -49 o   16.891   4.9758   12.125   7.3132   5.5256   11.621   16.452   9.4103   15.399   6.1441   19.546   5.6119 -4.147064 8.321299 
1 1 1   17    4  -48 o   40.723   2.6516   68.320   8.7543   70.896   12.070   65.460   12.716   41.300   3.6219   39.588   3.9950 1.712185 5.392430 
1 1 1   17    4  -47 o   78.763   2.0249  253.937   12.990  254.049   15.797  253.702   22.826   78.699   2.4655   78.369   3.5826 0.3301086 4.348970 
1 1 1   17    4  -46 o   82.651   2.0177  279.386   13.594  268.219   16.500  302.976   23.982   80.868   2.5061   85.720   3.4392 -4.852318 4.255388 
1 1 1   17    4  -45 o   85.559   1.8143  299.165   12.653  281.609   17.184  319.955   18.701   82.864   2.5471   88.319   2.6004 -5.455139 3.640028 
1 1 1   17    4  -44 o  170.319   1.7258  1185.09   23.960  1156.76   31.898  1221.77   36.296  168.109   2.3278  172.685   2.5785 -4.575714 3.473780 
1 1 1   17    4  -43 o   20.255   5.5179   17.665   9.3558   16.052   12.943   19.430   13.540   20.031   6.7217   21.572   6.8524 -1.541714 9.598714 
1 1 1   17    4  -42 o   35.010   3.1723   50.725   8.9553   30.433   13.886   65.176   11.718   26.414   6.4952   39.631   3.6689 -13.21718 7.459743 
1 1 1   17    4  -41 o   39.053   2.9315   62.880   9.2642   34.328   14.191   84.084   12.230   28.098   6.3463   45.123   3.3488 -17.02509 7.175679 
1 1 1   17    4  -40 o   53.134   2.3218  115.702   10.032  127.724   15.792  107.568   12.990   55.645   3.4994   51.112   3.1328 4.533314 4.696846 
1 1 1   17    4  -39 o   43.663   2.6858   78.353   9.5128   74.729   14.860   80.868   12.382   42.345   4.3678   44.242   3.4610 -1.897026 5.572847 
1 1 1   17    4  -38 o   69.499   2.0341  197.536   11.511  167.649   18.851  215.306   14.536   63.773   3.6414   72.505   2.4630 -8.731350 4.396146 
1 1 1   17    4  -37 o   45.944   2.9636   86.837   11.040   85.201   16.831   88.072   14.626   45.206   4.6329   46.111   3.9286 -0.9056320 6.074347 
1 1 1   17    4  -36 o   44.102   2.6821   79.890   9.5965   80.693   16.331   79.467   11.860   43.993   4.6231   43.891   3.3400 0.1016808 5.703379 
1 1 1   17    4  -35 o   57.305   2.2096  134.403   10.302  132.708   17.684  135.273   12.675   56.701   3.8489   57.429   2.7153 -0.7286377 4.710309 
1 1 1   17    4  -34 o   17.617   5.8355   12.293   9.7609   23.818   15.076   3.9742   12.808   23.731   7.1813   15.598   6.3687 8.132409 9.598451 
1 1 1   17    4  -33 f   38.756   2.9088   61.834   9.1226   82.747   15.967   51.700   11.115   44.612   4.4501   35.259   3.9344 9.352760 5.939922 
1 1 1   17    4  -32 o   78.235   1.8250  249.891   11.638  256.349   19.754  246.458   14.404   79.058   3.0711   77.626   2.2788 1.432030 3.824228 
1 1 1   17    4  -31 o   53.841   2.4456  118.743   10.705  133.359   17.312  109.695   13.621   56.881   3.7548   51.642   3.2523 5.238605 4.967516 
1 1 1   17    4  -30 f   67.763   2.3233  187.860   12.814  153.779   24.115  201.269   15.126   60.881   4.9006   70.103   2.6518 -9.222069 5.572087 
1 1 1   17    4  -29 o  117.026   1.7662  559.001   16.848  556.898   25.541  560.622   22.417  116.693   2.6851  117.130   2.3479 -0.4363785 3.566831 
1 1 1   17    4  -28 f   77.760   2.0038  247.062   12.691  232.837   19.954  256.725   16.445   75.329   3.2573   79.206   2.5504 -3.876869 4.137010 
1 1 1   17    4  -27 o  139.809   1.8538  797.905   21.127  842.331   48.782  787.648   23.439  143.135   4.1854  138.881   2.0704 4.253860 4.669532 
1 1 1   17    4  -26 o   49.091   2.5381   98.764   10.122  109.604   20.356   95.203   11.667   51.355   4.9229   48.144   2.9875 3.210865 5.758477 
1 1 1   17    4  -25 o   93.512   1.6736  356.838   12.757  351.850   20.745  359.871   16.177   92.721   2.7478   93.875   2.1140 -1.154121 3.466918 
1 1 1   17    4  -24 o   56.390   2.1680  130.051   9.9470  127.591   16.394  131.484   12.514   55.678   3.6320   56.644   2.7181 -0.9661331 4.536412 
1 1 1   17    4  -23 o  114.471   1.6965  534.714   15.830  552.675   27.826  526.120   19.249  116.201   2.9401  113.513   2.0803 2.687775 3.601633 
1 1 1   17    4  -22 o   63.394   2.0698  164.262   10.682  176.557   18.661  158.270   13.027   65.559   3.5046   62.177   2.5758 3.381443 4.349384 
1 1 1   17    4  -21 o   44.256   2.9106   80.447   10.442   79.158   17.091   81.215   13.190   43.592   4.8941   44.367   3.6802 -0.7747650 6.123419 
1 1 1   17    4  -20 o  135.735   1.6480  751.734   18.234  763.495   30.078  744.901   22.928  136.666   2.6999  135.072   2.0824 1.594101 3.409698 
1 1 1   17    4  -19 o   77.276   1.9051  243.738   12.000  237.505   20.545  246.965   14.785   76.098   3.3200   77.723   2.3362 -1.624603 4.059616 
1 1 1   17    4  -18 o  185.010   1.7420  1396.74   26.271  1371.11   41.594  1413.75   33.885  183.135   2.7862  186.062   2.2342 -2.927155 3.571374 
1 1 1   17    4  -17 o  158.833   1.5654  1029.20   20.268  1049.89   29.964  1011.76   27.518  160.334   2.2927  157.416   2.1446 2.917862 3.139339 
1 1 1   17    4  -16 o  145.696   1.5533  865.967   18.448  846.620   27.106  882.661   25.179  143.979   2.3096  147.037   2.1008 -3.058578 3.122079 
1 1 1   17    4  -15 o   93.555   1.6341  357.094   12.462  337.703   18.810  372.264   16.637   90.879   2.5417   95.488   2.1375 -4.608185 3.320981 
1 1 1   17    4  -14 o  160.615   1.5684  1052.39   20.534  1054.68   30.289  1050.44   27.931  160.703   2.3122  160.403   2.1362 0.2993774 3.147991 
1 1 1   17    4  -13 o  150.655   1.5598  925.899   19.155  999.939   29.275  870.467   25.331  156.481   2.2951  146.019   2.1281 10.46172 3.129915 
1 1 1   17    4  -12 o   67.007   1.9294  183.399   10.528  173.867   16.303  190.217   13.788   65.129   3.0796   68.194   2.4844 -3.064896 3.956839 
1 1 1   17    4  -11 o  148.350   1.6348  897.836   19.769  931.428   31.522  876.058   25.381  150.993   2.5611  146.491   2.1255 4.502930 3.328164 
1 1 1   17    4  -10 o   74.157   1.8673  224.553   11.279  245.905   18.438  211.787   14.257   77.502   2.9237   71.968   2.4338 5.533775 3.804161 
1 1 1   17    4   -9 o   63.880   2.2999  166.840   11.956  179.784   17.365  155.173   16.486   66.216   3.2269   61.497   3.3009 4.719547 4.616101 
1 1 1   17    4   -8 o   93.346   2.0459  355.663   15.568  358.979   24.195  353.320   20.336   93.631   3.1747   92.950   2.6868 0.6801834 4.159031 
1 1 1   17    4   -7 o  118.770   1.8239  575.603   17.658  569.999   25.569  580.712   24.414  118.114   2.6557  119.234   2.5120 -1.120171 3.655507 
1 1 1   17    4   -6 o  165.948   1.7178  1123.55   23.237  1110.83   31.217  1139.37   34.799  164.936   2.3219  167.008   2.5562 -2.072250 3.453277 
1 1 1   17    4   -5 o   88.810   1.6819  321.777   12.176  341.184   18.855  307.897   15.946   91.358   2.5344   86.811   2.2553 4.546982 3.392550 
1 1 1   17    4   -4 o   76.358   1.7974  237.903   11.188  249.246   17.482  230.036   14.559   78.051   2.7521   75.016   2.3840 3.035240 3.641073 
1 1 1   17    4   -3 o   75.870   1.8128  234.877   11.211  213.991   17.109  250.595   14.842   72.297   2.9091   78.305   2.3279 -6.008362 3.725849 
1 1 1   17    4   -2 o  135.956   1.6373  754.048   18.146  768.423   29.082  744.885   23.220  137.150   2.6013  135.086   2.1087 2.063400 3.348644 
1 1 1   17    4   -1 f  144.922   1.5700  856.722   18.546  835.767   27.189  874.958   25.363  143.066   2.3314  146.405   2.1253 -3.338882 3.154726 
1 1 1   17    4    0 o  104.362   1.6144  444.300   13.734  463.757   20.970  429.686   18.174  106.564   2.4141  102.594   2.1731 3.969757 3.248127 
1 1 1   17    4    1 f   80.494   1.8359  264.384   12.046  271.117   19.513  260.238   15.312   81.386   2.9462   79.796   2.3566 1.589912 3.772722 
1 1 1   17    4    2 o   96.379   1.7318  378.977   13.606  385.612   22.034  374.888   17.298   97.100   2.7867   95.826   2.2145 1.273918 3.559400 
1 1 1   17    4    3 o   75.582   1.9102  233.270   11.759  225.334   19.132  238.089   14.908   74.160   3.1722   76.318   2.3994 -2.157639 3.977402 
1 1 1   17    4    4 o  148.471   1.6640  899.291   20.139  940.333   32.375  873.386   25.721  151.714   2.6179  146.269   2.1572 5.445084 3.392182 
1 1 1   17    4    5 o  118.121   1.7638  569.278   16.983  607.276   30.441  552.106   20.464  121.829   3.0678  116.295   2.1587 5.534302 3.751180 
1 1 1   17    4    6 o   44.503   2.9187   81.302   10.530   81.089   16.252   81.456   13.823   44.214   4.5754   44.427   3.8551 -0.2127914 5.983001 
1 1 1   17    4    7 o   53.926   2.5397  119.049   11.133  121.619   16.934  117.093   14.774   54.352   3.8471   53.384   3.4129 0.9681320 5.142779 
1 1 1   17    4    8 o   96.784   1.8830  382.257   14.856  352.444   21.727  408.433   20.358   92.812   2.8753   99.996   2.4976 -7.183525 3.808536 
1 1 1   17    4    9 o  132.861   1.9184  720.391   20.776  706.196   27.914  738.021   31.109  131.474   2.6046  134.373   2.8401 -2.899353 3.853599 
1 1 1   17    4   10 o   51.109   2.3937  106.912   9.9448  112.855   16.405  103.460   12.504   52.340   3.8726   50.206   3.0700 2.134388 4.941901 
1 1 1   17    4   11 o   72.184   1.9604  212.821   11.524  219.415   18.953  208.952   14.517   73.170   3.1852   71.478   2.4953 1.692001 4.046271 
1 1 1   17    4   12 o  148.725   1.9376  902.749   23.490  861.537   38.477  927.234   29.658  145.110   3.2529  150.671   2.4147 -5.561279 4.051176 
1 1 1   17    4   13 o  122.232   1.9326  609.779   19.256  574.016   32.002  630.075   24.109  118.388   3.3194  124.205   2.3812 -5.816666 4.085135 
1 1 1   17    4   14 o   36.487   4.1733   55.310   12.189   71.391   19.812   45.515   15.462   41.143   6.0910   32.699   6.0227 8.444584 8.565859 
1 1 1   17    4   15 o   42.169   3.6919   73.398   12.563  100.495   20.560   57.254   15.870   49.137   5.2124   36.893   5.4401 12.24423 7.534217 
1 1 1   17    4   16 o   78.352   2.2376  250.896   14.277  252.192   19.827  249.500   20.575   78.456   3.1063   78.017   3.2423 0.4388046 4.490231 
1 1 1   17    4   17 o  160.262   1.9833  1048.40   25.909  1047.18   34.371  1050.01   39.430  160.075   2.6341  160.224   3.0190 -0.1488037 4.006613 
1 1 1   17    4   18 o  110.239   2.2550  496.303   20.264  480.286   31.000  508.254   26.777  108.235   3.5183  111.441   2.9503 -3.206215 4.591585 
1 1 1   17    4   19 o   95.812   1.8722  374.670   14.622  389.610   22.630  363.964   19.158   97.572   2.8483   94.349   2.4932 3.223335 3.785370 
1 1 1   17    4   20 o  127.530   1.7855  663.727   18.561  656.338   27.551  669.868   25.116  126.718   2.6673  128.051   2.4061 -1.333588 3.592197 
1 1 1   17    4   21 o   49.480   2.7058  100.382   10.872  118.937   17.389   88.473   13.931   53.699   4.0013   46.313   3.7214 7.385403 5.464330 
1 1 1   17    4   22 o  171.259   1.8421  1197.07   25.716  1232.99   38.134  1167.11   34.827  173.671   2.6937  168.997   2.5281 4.673325 3.694215 
1 1 1   17    4   23 o   29.133   4.3152   35.599   9.9383   42.843   16.068   31.110   12.648   31.595   6.4572   26.920   5.9248 4.675005 8.763451 
1 1 1   17    4   24 o   70.995   2.3290  206.123   13.460  188.231   19.027  224.045   19.043   67.699   3.4594   73.917   3.1678 -6.218353 4.690673 
1 1 1   17    4   25 o   74.412   2.0824  226.278   12.619  225.709   19.674  226.676   16.448   74.175   3.2618   74.408   2.7163 -0.2328186 4.244730 
1 1 1   17    4   26 o   90.126   1.9311  331.607   14.187  320.943   21.296  340.115   19.023   88.519   2.9556   91.182   2.5619 -2.663689 3.911345 
1 1 1   17    4   27 o   77.405   2.6276  245.238   16.555  239.585   26.040  249.073   21.448   76.253   4.2056   77.900   3.3858 -1.646744 5.399128 
1 1 1   17    4   28 f   48.884   2.9320   98.130   11.630   98.981   22.026   97.802   13.694   48.607   5.6651   48.729   3.4703 -0.1217003 6.643533 
1 1 1   17    4   29 o   45.964   3.1307   86.902   11.660   97.511   22.091   82.805   13.728   48.217   5.7326   44.764   3.7980 3.452946 6.876586 
1 1 1   17    4   30 f   15.767   5.9428   7.6071   10.407   41.479   19.828  -5.2737   12.227   30.859   7.8614   12.742   5.7079 18.11684 9.715044 
1 1 1   17    4   31 o   81.582   2.2429  272.148   14.901  291.682   20.493  250.230   21.707   84.357   2.9849   78.054   3.4200 6.303001 4.539393 
1 1 1   17    4   32 o   69.635   2.7112  198.671   15.360  200.334   23.890  197.499   20.055   69.667   4.2268   69.297   3.5623 0.3698044 5.527669 
1 1 1   17    4   33 f  137.616   1.9927  773.485   22.353  761.682   29.814  788.636   33.780  136.447   2.6806  138.777   2.9861 -2.330246 4.012796 
1 1 1   17    4   34 o   69.292   2.1613  196.379   12.193  189.826   19.077  200.903   15.853   67.940   3.4561   70.007   2.7835 -2.067398 4.437672 
1 1 1   17    4   35 o   70.394   2.1553  202.676   12.353  212.716   19.523  195.973   15.952   71.944   3.3381   69.129   2.8369 2.814514 4.380763 
1 1 1   17    4   36 o   43.751   3.0138   78.789   10.683   94.532   17.227   68.953   13.617   47.682   4.4850   40.724   4.1603 6.958336 6.117455 
1 1 1   17    4   37 o   74.945   2.1306  229.725   13.003  222.190   20.176  235.078   17.005   73.509   3.3760   75.724   2.7596 -2.215080 4.360371 
1 1 1   17    4   38 o   55.646   2.5450  126.969   11.514  137.457   18.583  120.434   14.668   57.659   3.9780   54.071   3.3443 3.588303 5.197063 
1 1 1   17    4   39 o   20.620   5.7558   18.215   10.042   26.273   15.930   12.902   12.935   24.756   7.3569   18.793   6.6985 5.962978 9.949614 
1 1 1   17    4   40 o  100.352   2.1771  411.749   17.809  409.164   23.971  414.934   26.605   99.862   2.9480  100.492   3.2521 -0.6301422 4.389428 
1 1 1   17    4   41 o   86.136   2.0402  303.275   14.325  292.375   21.539  311.920   19.182   84.350   3.1380   87.219   2.7013 -2.868820 4.140538 
1 1 1   17    4   42 o   12.069   5.3155  -2.6072   10.161   5.9016   17.913  -6.6441   12.339   18.361   7.5184   12.445   5.6397 5.915777 9.398521 
1 1 1   17    4   43 o   37.462   3.5521   58.248   10.718   61.321   18.203   56.617   13.260   37.818   6.1134   36.723   4.5251 1.094448 7.605881 
1 1 1   17    4   44 o   91.690   2.5543  344.675   19.072   0.0000   0.0000  344.675   19.072  ?   ?    91.690   2.5543 0.000000 2.554306 
1 1 1   17    4   45 o   30.818   4.1465   39.927   10.152   42.786   17.774   38.542   12.369   31.170   7.1479   30.005   5.2480 1.164900 8.867555 
1 1 1   17    4   46 o   65.396   2.3103  175.311   12.296  191.302   20.596  166.455   15.328   68.010   3.7295   63.601   2.9646 4.408493 4.764232 
1 1 1   17    4   47 o  139.679   1.8986  797.754   21.617  843.844   35.651  770.957   27.184  143.293   3.0522  137.172   2.4311 6.120544 3.902130 
1 1 1   17    4   48 o   32.329   3.7357   43.706   9.6637   27.762   15.887   53.070   12.175   25.169   7.3115   35.535   4.2900 -10.36577 8.477184 
1 1 1   17    4   49 o  104.334   2.1070  445.623   17.919  442.360   27.021  448.184   23.941  103.605   3.2033  104.416   2.8154 -0.8108826 4.264679 
1 1 1   17    4   50 o   68.515   2.6068  192.958   14.532  163.951   26.052  206.061   17.509   62.362   5.1714   70.699   3.0454 -8.336021 6.001459 
1 1 1   17    4   51 o   59.704   2.7795  146.828   13.490  132.462   24.337  153.199   16.208   55.880   5.4105   60.865   3.2789 -4.984566 6.326471 
1 1 1   17    4   52 o   56.556   2.6102  131.665   12.001  132.563   24.332  131.377   13.796   55.859   5.4115   56.402   3.0115 -0.5430832 6.193019 
1 1 1   17    4   53 o   40.884   2.9493   69.192   9.7628   78.296   16.785   64.537   12.002   42.960   4.8794   39.276   3.7960 3.683712 6.182063 
1 1 1   17    4   54 o   30.475   3.8351   39.140   9.3167   34.795   15.766   41.471   11.549   27.837   6.9656   31.142   4.6954 -3.304907 8.400394 
1 1 1   17    4   55 o   12.640   5.1869   2.6263   8.5491   21.468   14.502  -7.4092   10.584   22.251   7.0945   11.051   5.0888 11.19961 8.730856 
1 1 1   17    4   56 o   23.383   4.8826   23.833   9.0055   27.150   15.159   22.024   11.195   24.600   7.1408   22.290   6.0207 2.309778 9.340266 
1 1 1   17    4   57 o   15.418   5.5518   8.7844   8.9099  -5.5337   15.391   16.002   10.927   14.188   6.3758   19.336   6.1575 -5.148249 8.863692 
1 1 1   17    4   58 o   59.844   2.3047  147.404   11.222  132.328   18.631  155.986   14.057   56.099   4.1026   61.418   2.8153 -5.318420 4.975714 
1 1 1   17    4   59 o   11.825   5.0424   0.4883   8.5617   9.3677   15.206  -3.6331   10.360   17.871   7.0613   11.757   5.2611 6.114538 8.805763 
1 1 1   17    4   60 o   21.021   5.2505   19.592   8.9697   19.358   16.244   19.695   10.759   21.462   7.5194   21.022   5.9892 0.4394932 9.613147 
1 1 1   17    4   61 o   50.044   3.0402  104.187   12.343   92.559   17.874  114.787   17.066   46.460   4.7880   52.138   4.0472 -5.678009 6.269323 
1 1 1   17    4   62 o   13.330   5.5564   2.5330   10.023  -3.9199   14.965   7.7828   13.498   14.182   6.3366   16.641   6.6278 -2.458342 9.169490 
1 1 1   17    4   63 o   79.207   2.3699  258.845   15.284  256.061   22.374  261.281   20.929   78.211   3.5184   79.158   3.2505 -0.9471283 4.790089 
1 1 1   17    4   64 o   18.770   6.1105   15.305   10.721  -5.3590   16.199   31.411   14.301   14.425   6.5067   26.068   6.6955 -11.64321 9.336277 
1 1 1   17    4   65 f   31.904   4.4405   44.003   11.235   12.761   16.892   68.794   15.047   19.169   7.4816   39.875   4.7207 -20.70585 8.846452 
1 1 1   17    4   66 o   36.147   4.3981   56.345   12.693   53.242   25.267   57.392   14.679   32.476   9.1535   36.145   5.1257 -3.668362 10.49094 
1 1 1   17    4   67 o   44.711   3.7217   84.737   13.441   93.781   26.187   81.502   15.662   44.676   7.4533   43.472   4.4840 1.204426 8.698129 
1 1 1   17    4   68 o   49.282   2.8804  101.389   11.521  129.684   27.300   95.258   12.708   53.451   6.3924   47.590   3.2962 5.860809 7.192182 
1 1 1   17    4   69 o   54.573   2.3300  123.335   10.341  119.246   16.289  126.095   13.384   52.972   3.7975   54.897   3.0024 -1.925331 4.841047 
1 1 1   17    4   70 o   75.338   2.0977  234.297   12.870  219.881   21.569  242.266   16.037   72.038   3.6853   76.364   2.5801 -4.325645 4.498713 
1 1 1   17    4   71 o   69.080   2.0601  196.997   11.588  199.165   18.054  195.479   15.110   68.830   3.2269   68.496   2.7117 0.3339691 4.214940 
1 1 1   17    4   72 o   35.780   3.2473   54.171   9.3682   67.318   15.303   46.292   11.848   39.054   4.9157   32.455   4.6076 6.598698 6.737480 
1 1 1   17    4   73 o   64.317   2.2876  171.451   11.974  196.642   20.563  158.527   14.729   67.970   3.7256   61.506   2.9464 6.464752 4.749898 
1 1 1   17    4   74 o   47.309   2.6568   93.505   10.204   70.802   15.955  109.219   13.274   39.904   5.0157   50.858   3.2185 -10.95382 5.959499 
1 1 1   17    4   75 o   10.726   4.7871  -2.2060   8.5155  -0.8647   14.042  -2.9863   10.710   14.052   6.2161   11.856   5.3240 2.195976 8.184473 
1 1 1   17    4   76 o   26.523   4.3095   31.102   8.9975   40.173   14.657   25.617   11.398   29.024   6.3701   23.266   5.9782 5.757889 8.735955 
1 1 1   17    4   77 o   12.872   5.2430   4.1019   8.6549   33.873   14.204 -13.4790   10.915   26.353   6.6213   9.8114   4.7101 16.54144 8.125663 
1 1 1   17    4   78 o   17.081   5.7611   13.150   9.5072   38.372   18.869   4.5690   11.006   26.991   8.0032   14.059   5.8384 12.93196 9.906521 
1 1 1   17    4   79 o   25.441   4.4503   29.105   8.8933   26.846   14.408   30.496   11.303   23.067   7.0287   25.405   5.6084 -2.338453 8.992064 
1 1 1   17    4   80 o   34.156   3.5413   50.518   9.7168   37.292   16.923   57.022   11.868   26.693   7.4798   35.945   4.1251 -9.252773 8.541903 
1 1 1   17    4   81 o   19.486   5.5051   18.179   9.1282  -3.5216   16.127   28.410   11.073   14.008   6.3867   24.288   5.6925 -10.28058 8.555442 
1 1 1   17    4   82 o   31.240   4.2432   43.761   10.526   27.368   17.250   53.488   13.287   22.506   7.7566   34.075   4.9265 -11.56817 9.188829 
1 1 1   17    4   83 o   16.173   5.5642   12.075   8.8754 -10.9304   12.397   36.268   12.713   10.874   5.1641   27.180   5.9071 -16.30605 7.846123 
1 1 1   17    4   84 o   21.787   5.0583   22.636   8.8103   22.114   11.938   23.260   13.057   20.771   6.4107   21.113   6.7317 -0.3425102 9.295798 
1 1 1   17    4   85 o   12.948   5.3008   4.9223   8.9024   11.470   12.432  -1.9674   12.754   16.337   6.4062   12.671   5.7387 3.666048 8.600658 
1 1 1   17    4   86 o   8.3016   4.0124 -10.9741   8.2462  -1.8401   10.843 -23.5056   12.700   11.752   5.3100   9.2341   4.5676 2.517883 7.004232 
1 1 1   17    4   87 o   37.034   3.7283   61.154   11.102   53.683   12.605   86.984   23.439   33.866   4.6922   39.609   7.5346 -5.743595 8.876226 
1 1 1   17    4   88 o   16.878   5.9634   14.222   10.232   12.606   11.617   19.818   21.612   16.312   6.2478   19.196   8.0905 -2.884060 10.22211 
1 1 1   17    4   89 o   24.396   5.5431   29.997   10.772   30.270   12.195   29.031   22.971   23.904   6.2051   21.175   8.5721 2.729784 10.58227 
1 1 1   17    4   90 o   34.568   5.4108   59.054   14.747   74.652   18.322   30.359   24.850   38.045   6.1150   21.206   8.7865 16.83961 10.70499 
1 1 1   17    4   91 o   17.629   6.1023   16.257   10.681   22.416   11.945  -8.3159   23.860   20.215   6.4379   14.779   7.0595 5.436017 9.554201 
1 1 1   17    4   92 o   10.050   4.7517  -7.5280   10.275  -9.7255   11.331   2.6385   24.372   10.216   4.8756   16.167   7.5398 -5.951457 8.978875 
1 1 1   17    4   93 o   12.425   5.5571   0.8237   11.540   0.8237   11.540   0.0000   0.0000   12.425   5.5571  ?   ?  0.000000 5.557086 
1 1 1   17    4   94 o   13.608   5.8748   5.0390   11.892   5.0390   11.892   0.0000   0.0000   13.608   5.8748  ?   ?  0.000000 5.874800 
1 1 1   17    4   95 o   31.347   6.1077   52.072   15.045   52.072   15.045   0.0000   0.0000   31.347   6.1077  ?   ?  0.000000 6.107750 
1 1 1   17    4   96 o   17.154   6.8507   15.803   14.460   15.803   14.460   0.0000   0.0000   17.154   6.8507  ?   ?  0.000000 6.850737 
1 1 1   17    4   97 o   16.865   7.7313   10.736   24.054   10.736   24.054   0.0000   0.0000   16.865   7.7313  ?   ?  0.000000 7.731270 
1 1 1   17    4   98 o   12.684   6.2520 -23.8171   23.069 -23.8171   23.069   0.0000   0.0000   12.684   6.2520  ?   ?  0.000000 6.252005 
1 1 1   17    4   99 o   10.963   5.4928 -38.0418   20.967   0.0000   0.0000 -38.0418   20.967  ?   ?    10.963   5.4928 0.000000 5.492783 
1 1 1   17    4  100 o   16.873   7.6335   13.213   22.493   0.0000   0.0000   13.213   22.493  ?   ?    16.873   7.6335 0.000000 7.633528 
1 1 1   17    4  101 o   16.523   7.5625   11.322   22.893   0.0000   0.0000   11.322   22.893  ?   ?    16.523   7.5625 0.000000 7.562515 
1 1 1   17    4  102 o   14.020   6.7122  -5.7007   21.833   0.0000   0.0000  -5.7007   21.833  ?   ?    14.020   6.7122 0.000000 6.712151 
1 1 1   17    4  103 o   15.129   6.7006   8.3914   16.364   18.025   23.838  -0.1951   22.505   17.633   7.9285   14.826   7.0168 2.806663 10.58763 
1 1 1   17    5 -100 o   13.471   6.6430 -20.7690   26.156 -20.7690   26.156   0.0000   0.0000   13.471   6.6430  ?   ?  0.000000 6.643039 
1 1 1   17    5  -99 o   13.300   6.5789 -23.4333   26.339 -23.4333   26.339   0.0000   0.0000   13.300   6.5789  ?   ?  0.000000 6.578863 
1 1 1   17    5  -98 o   19.187   8.4435   27.585   25.592   27.585   25.592   0.0000   0.0000   19.187   8.4435  ?   ?  0.000000 8.443518 
1 1 1   17    5  -97 o   17.758   8.0297   18.353   24.848   18.353   24.848   0.0000   0.0000   17.758   8.0297  ?   ?  0.000000 8.029662 
1 1 1   17    5  -96 o   17.017   7.9254   11.647   26.785   11.647   26.785   0.0000   0.0000   17.017   7.9254  ?   ?  0.000000 7.925367 
1 1 1   17    5  -95 o   26.675   9.6574   60.824   27.005   60.824   27.005   0.0000   0.0000   26.675   9.6574  ?   ?  0.000000 9.657402 
1 1 1   17    5  -94 o   15.492   7.3424   0.3308   24.812   0.3308   24.812   0.0000   0.0000   15.492   7.3424  ?   ?  0.000000 7.342395 
1 1 1   17    5  -93 o   9.9219   4.9829 -37.8751   17.757 -37.8751   17.757   0.0000   0.0000   9.9219   4.9829  ?   ?  0.000000 4.982863 
1 1 1   17    5  -92 o   10.440   5.2049 -31.5745   17.801 -31.5745   17.801   0.0000   0.0000   10.440   5.2049  ?   ?  0.000000 5.204885 
1 1 1   17    5  -91 o   23.636   8.2354   38.160   19.469   38.160   19.469   0.0000   0.0000   23.636   8.2354  ?   ?  0.000000 8.235435 
1 1 1   17    5  -90 o   13.598   6.4207  -5.5047   18.641  -5.5047   18.641   0.0000   0.0000   13.598   6.4207  ?   ?  0.000000 6.420730 
1 1 1   17    5  -89 o   23.086   7.2816   31.988   15.313   21.781   18.545   53.856   27.145   19.100   7.7130   25.847   9.6274 -6.746431 12.33599 
1 1 1   17    5  -88 o   18.786   6.6659   19.557   12.796   11.673   18.231   27.212   17.964   16.710   7.2440   20.848   7.8184 -4.137215 10.65845 
1 1 1   17    5  -87 o   16.204   6.4854   12.313   12.987   8.9744   17.904   16.021   18.868   16.134   7.0825   17.842   7.5416 -1.707781 10.34589 
1 1 1   17    5  -86 o   12.563   5.6837  -0.5702   12.471 -11.4612   17.261   11.322   18.037   12.518   5.9861   16.721   7.2269 -4.203503 9.384133 
1 1 1   17    5  -85 o   22.314   6.5766   27.310   12.773   52.164   18.121   2.7629   18.008   30.191   7.4173   15.051   6.8178 15.13978 10.07466 
1 1 1   17    5  -84 o   11.410   5.3104  -5.4829   11.993   0.4530   16.411 -12.2863   17.570   14.248   6.4755   12.621   6.0367 1.626653 8.852893 
1 1 1   17    5  -83 o   22.533   5.5815   25.467   10.198   6.5194   16.776   36.574   12.844   15.704   6.8759   26.740   6.0362 -11.03577 9.149533 
1 1 1   17    5  -82 o   23.317   5.7541   27.290   10.869   26.232   27.033   27.494   11.871   21.164   8.9900   23.066   6.1864 -1.902195 10.91293 
1 1 1   17    5  -81 o   18.045   5.9309   16.121   10.089  -5.2408   17.430   26.886   12.373   13.873   6.4382   22.761   6.4018 -8.888055 9.079279 
1 1 1   17    5  -80 o   10.608   4.9408  -6.3228   10.413 -22.6823   24.666  -2.7752   11.486   14.125   6.8539   11.949   5.4254 2.176332 8.741322 
1 1 1   17    5  -79 o   10.079   4.7485  -8.1811   10.094   10.393   25.364 -11.6762   11.003   18.727   8.3155   9.9812   4.7748 8.745481 9.588833 
1 1 1   17    5  -78 o   15.530   5.8731   10.041   10.184   8.5232   25.332   10.334   11.122   18.564   8.2728   15.864   6.1039 2.699992 10.28085 
1 1 1   17    5  -77 o   13.995   5.6970   5.8476   10.211   11.953   26.217   4.7556   11.087   19.491   8.5628   13.968   5.8347 5.523111 10.36173 
1 1 1   17    5  -76 o   56.673   2.2958  134.081   10.584  145.051   15.879  125.312   14.197   58.172   3.3630   54.160   3.2305 4.011364 4.663258 
1 1 1   17    5  -75 o   9.8872   4.5007  -3.5469   7.9672  -1.7973   11.832  -4.9981   10.776   12.588   5.6286   11.279   5.1722 1.308442 7.644116 
1 1 1   17    5  -74 o   35.229   2.8425   52.474   8.0935   48.684   10.804   57.321   12.218   33.313   4.0626   36.072   4.2356 -2.759365 5.868996 
1 1 1   17    5  -73 o   39.623   2.6106   65.859   8.3848   73.522   11.240   56.246   12.590   41.502   3.3511   35.669   4.4248 5.832287 5.550570 
1 1 1   17    5  -72 o   11.981   4.8700   3.3885   7.4492  -4.3856   9.9916   13.117   11.177   11.054   5.0351   17.412   6.2244 -6.357598 8.005964 
1 1 1   17    5  -71 o   20.040   4.7199   18.215   7.5820   19.227   10.219   16.975   11.310   20.264   5.8571   19.173   6.2781 1.091293 8.586090 
1 1 1   17    5  -70 o   16.699   5.0997   12.509   7.5793   16.613   10.404   7.8683   11.064   19.007   6.0029   15.379   6.0395 3.628377 8.515305 
1 1 1   17    5  -69 o   19.514   4.7867   17.225   7.5555   22.289   10.262   11.231   11.165   21.908   5.6947   16.752   6.1865 5.156269 8.408445 
1 1 1   17    5  -68 o   16.343   5.0392   11.844   7.3784   17.801   10.020   4.7861   10.906   19.667   5.8322   14.287   5.8600 5.379851 8.267663 
1 1 1   17    5  -67 o   9.6027   4.3945  -4.4161   7.7270 -18.8454   11.139   8.9655   10.727   9.2306   4.5072   15.769   6.0127 -6.538689 7.514447 
1 1 1   17    5  -66 o   28.013   3.4468   33.500   7.7049   34.342   10.297   32.429   11.615   27.855   4.7019   26.674   5.5237 1.180902 7.253910 
1 1 1   17    5  -65 o   37.842   2.3804   59.496   7.3056   49.031   10.879   68.091   9.8592   33.730   4.0368   40.265   3.0260 -6.534569 5.045056 
1 1 1   17    5  -64 o   70.057   1.7307  201.619   9.8832  188.202   15.656  210.508   12.743   67.170   2.8659   71.383   2.1927 -4.212234 3.608463 
1 1 1   17    5  -63 f   30.977   3.3383   40.640   8.2966   25.783   16.848   45.397   9.5327   23.396   7.6627   32.645   3.6444 -9.249466 8.485208 
1 1 1   17    5  -62 o   18.315   5.2228   15.001   8.1776   34.951   16.290   8.2798   9.4552   27.096   7.2381   15.166   5.6753 11.93081 9.197815 
1 1 1   17    5  -61 o   40.739   2.4821   68.867   8.2036   58.820   12.053   77.540   11.198   37.084   4.0531   42.984   3.2192 -5.900093 5.176017 
1 1 1   17    5  -60 o   24.625   3.6453   25.949   7.0967   23.258   10.188   28.485   9.8913   22.689   5.5539   25.364   4.9618 -2.674873 7.447506 
1 1 1   17    5  -59 o   18.816   4.5113   15.631   6.8296   8.5598   10.392   21.007   9.0610   15.696   5.9335   21.673   5.1962 -5.977262 7.887136 
1 1 1   17    5  -58 o   41.742   2.5097   72.192   8.4999   72.646   11.795   71.701   12.260   41.552   3.5152   41.214   3.6883 0.3377457 5.095081 
1 1 1   17    5  -57 o   50.692   2.2696  106.019   9.3545  100.044   12.766  112.948   13.747   48.939   3.2180   51.996   3.2598 -3.056461 4.580554 
1 1 1   17    5  -56 o   82.048   1.7515  275.991   11.714  267.433   15.753  286.577   17.521   80.524   2.4027   83.282   2.5840 -2.758133 3.528423 
1 1 1   17    5  -55 o   82.001   1.8778  275.832   12.552  268.187   15.898  288.483   20.452   80.650   2.4210   83.387   3.0138 -2.737160 3.865816 
1 1 1   17    5  -54 o   97.413   1.7069  388.733   13.554  379.317   18.281  400.227   20.198   96.014   2.3358   98.519   2.5172 -2.504776 3.433942 
1 1 1   17    5  -53 f   30.837   3.0333   39.709   7.5260   24.672   11.342   51.540   10.060   23.486   5.9255   35.021   3.5740 -11.53442 6.919861 
1 1 1   17    5  -52 o   45.141   2.2048   83.883   8.0885   69.435   12.034   95.790   10.924   40.690   3.6675   48.104   2.7980 -7.414188 4.612944 
1 1 1   17    5  -51 o   69.117   1.8817  195.887   10.592  189.093   14.310  204.116   15.750   67.722   2.5971   70.315   2.7533 -2.593063 3.784899 
1 1 1   17    5  -50 o   36.856   2.8244   56.317   8.4208   64.598   11.603   47.100   12.241   39.271   3.6669   33.189   4.6520 6.082012 5.923456 
1 1 1   17    5  -49 o   76.466   1.8958  239.496   11.817  230.417   15.198  253.374   18.791   74.828   2.4952   78.324   2.9484 -3.496025 3.862521 
1 1 1   17    5  -48 o   53.468   2.1864  117.443   9.5093  141.109   15.156  102.079   12.212   58.364   3.1979   49.656   3.0315 8.707409 4.406447 
1 1 1   17    5  -47 o   40.959   2.4850   69.153   8.2577   53.101   12.204   82.709   11.215   35.442   4.3127   44.676   3.0988 -9.233902 5.310596 
1 1 1   17    5  -46 o   21.977   4.4311   20.826   7.6636   13.616   11.568   26.467   10.231   18.492   6.3527   24.643   5.2538 -6.150730 8.243725 
1 1 1   17    5  -45 o   86.958   1.7331  309.254   12.285  278.768   18.116  335.209   16.716   82.316   2.7036   90.395   2.2703 -8.079124 3.530401 
1 1 1   17    5  -44 o   9.1953   4.2296  -5.2835   7.2839  -6.2401   12.434  -4.7837   8.9875   12.516   5.6677   10.624   4.8139 1.892237 7.436142 
1 1 1   17    5  -43 o   65.726   1.8678  176.850   9.9966  159.069   15.880  188.520   12.865   62.074   3.1487   67.778   2.3321 -5.704197 3.918300 
1 1 1   17    5  -42 o   23.746   4.2974   24.089   8.0120   22.104   14.177   25.020   9.7115   22.666   6.9845   24.032   5.1147 -1.365650 8.657021 
1 1 1   17    5  -41 o   39.769   2.6488   65.173   8.5378   55.651   14.565   70.159   10.538   36.183   5.0776   41.175   3.1641 -4.991608 5.982739 
1 1 1   17    5  -40 o   31.784   3.2326   41.982   8.2587   42.763   14.089   41.574   10.194   31.481   5.7002   31.451   4.0716 0.3065872E-01 7.004984 
1 1 1   17    5  -39 o   50.796   2.2246  105.819   9.1888  100.136   15.387  108.970   11.456   49.097   3.8760   51.466   2.7406 -2.368954 4.747056 
1 1 1   17    5  -38 o   51.618   2.3041  109.300   9.6703  116.850   16.677  105.476   11.870   53.069   3.8819   50.612   2.8891 2.457455 4.839033 
1 1 1   17    5  -37 o   60.604   2.0841  150.405   10.280  153.714   17.693  148.718   12.632   60.991   3.5744   60.187   2.5806 0.8042755 4.408628 
1 1 1   17    5  -36 o   73.174   2.1242  219.198   12.657  221.768   19.470  217.316   16.657   73.384   3.2630   72.738   2.8146 0.6456299 4.309242 
1 1 1   17    5  -35 o   75.469   1.9293  232.952   11.859  220.165   19.909  239.985   14.764   73.108   3.3497   76.533   2.3695 -3.425201 4.103028 
1 1 1   17    5  -34 o  154.440   1.7028  974.235   21.436  962.201   34.568  981.755   27.325  153.213   2.7679  154.933   2.1636 -1.719940 3.513167 
1 1 1   17    5  -33 o   55.489   2.3969  126.242   10.816  133.303   19.306  123.012   13.057   56.679   4.2087   54.690   2.9397 1.988613 5.133709 
1 1 1   17    5  -32 o   31.544   4.8089   42.099   11.975   0.0000   0.0000   42.099   11.975  ?   ?    31.544   4.8089 0.000000 4.808896 
1 1 1   17    5  -31 o   23.338   6.4122   23.537   12.572   46.662   24.542   15.310   14.639   32.442   8.9767   20.205   7.1334 12.23647 11.46589 
1 1 1   17    5  -30 f   68.373   2.3981  191.482   13.345  194.966   37.135  190.965   14.300   67.833   6.8079   68.254   2.5749 -0.4208908 7.278572 
1 1 1   17    5  -29 o  145.818   1.6847  868.187   20.025  847.509   32.046  881.434   25.649  143.861   2.7327  146.845   2.1428 -2.984634 3.472666 
1 1 1   17    5  -28 o  132.427   1.7901  716.173   19.323  746.432   29.806  694.236   25.379  135.024   2.7081  130.283   2.3897 4.741562 3.611712 
1 1 1   17    5  -27 o   52.012   2.6690  111.018   11.278   66.695   25.035  122.304   12.632   39.019   8.1349   54.573   2.8495 -15.55381 8.619548 
1 1 1   17    5  -26 o   71.210   1.9694  207.299   11.421  194.519   19.373  214.107   14.139   68.757   3.4677   72.317   2.4018 -3.560593 4.218252 
1 1 1   17    5  -25 o   76.498   2.0408  239.251   12.714  238.007   20.262  240.058   16.329   76.115   3.2733   76.551   2.6207 -0.4361954 4.193196 
1 1 1   17    5  -24 o  102.688   1.6948  430.470   14.187  452.370   20.187  409.099   19.941  105.189   2.3543  100.019   2.4459 5.169678 3.394849 
1 1 1   17    5  -23 o   24.778   4.4846   26.056   8.7245   15.302   13.123   34.575   11.680   19.853   6.7678   28.484   5.2227 -8.630339 8.548649 
1 1 1   17    5  -22 o   49.644   2.4120  100.997   9.7313  104.651   14.438   97.955   13.173   50.381   3.5382   48.767   3.3339 1.614223 4.861419 
1 1 1   17    5  -21 o   11.637   4.9183   0.4892   8.0236  -0.2895   13.004   0.9678   10.196   14.454   6.1902   13.206   5.5609 1.247993 8.321174 
1 1 1   17    5  -20 o  128.374   1.5436  672.503   16.153  682.664   24.095  664.209   21.768  129.244   2.2871  127.513   2.0942 1.730965 3.101065 
1 1 1   17    5  -19 o  125.873   1.5367  646.542   15.767  630.058   23.170  660.758   21.518  124.167   2.2892  127.186   2.0755 -3.019386 3.090005 
1 1 1   17    5  -18 o   58.161   2.0431  138.327   9.6712  127.789   14.986  145.848   12.660   55.744   3.3131   59.662   2.6095 -3.917881 4.217356 
1 1 1   17    5  -17 o  115.078   1.6199  540.446   15.195  543.750   24.233  538.305   19.507  115.314   2.5780  114.800   2.0846 0.5135422 3.315338 
1 1 1   17    5  -16 o   45.829   2.4947   86.116   9.2845   85.130   15.410   86.678   11.633   45.314   4.2205   45.901   3.1277 -0.5869446 5.253114 
1 1 1   17    5  -15 o   75.095   1.9225  230.403   11.759  271.181   21.325  212.588   14.095   81.303   3.2241   72.082   2.4022 9.221321 4.020586 
1 1 1   17    5  -14 o   14.691   5.6514   5.9870   9.5335   8.8552   13.857   3.4091   13.137   17.704   6.8127   15.609   6.4201 2.095046 9.361070 
1 1 1   17    5  -13 o   42.950   2.9932   75.866   10.414   70.425   15.365   80.489   14.163   41.102   4.6687   44.099   3.9829 -2.997219 6.136775 
1 1 1   17    5  -12 o   62.435   2.2042  159.437   11.200  154.108   15.614  165.085   16.075   61.271   3.1368   63.424   3.1189 -2.152718 4.423432 
1 1 1   17    5  -11 o  130.931   1.6936  699.624   18.076  706.443   24.789  691.881   26.415  131.492   2.3127  130.104   2.4907 1.387909 3.398867 
1 1 1   17    5  -10 o  140.102   1.5529  800.887   17.735  789.279   26.123  810.812   24.155  138.990   2.3057  140.902   2.1031 -1.911942 3.120749 
1 1 1   17    5   -9 o  115.541   1.5698  544.714   14.785  568.804   22.497  526.401   19.615  117.988   2.3392  113.531   2.1195 4.457764 3.156581 
1 1 1   17    5   -8 o   25.729   4.2860   27.918   8.6731   29.499   14.732   27.079   10.730   26.151   6.8356   25.143   5.3968 1.008890 8.709233 
1 1 1   17    5   -7 o   46.834   2.4653   89.887   9.3785   94.051   15.666   87.561   11.708   47.691   4.0688   46.144   3.1312 1.547050 5.134147 
1 1 1   17    5   -6 o   77.611   1.7835  245.850   11.283  230.928   17.343  256.802   14.858   75.084   2.8387   79.250   2.3024 -4.166069 3.655031 
1 1 1   17    5   -5 o   99.340   1.7071  402.737   13.823  444.049   22.776  378.643   17.393  104.178   2.6843   96.280   2.2162 7.897301 3.480892 
1 1 1   17    5   -4 o  163.926   1.6733  1096.58   22.359  1115.97   35.486  1083.82   28.793  165.218   2.6349  162.901   2.1683 2.317154 3.412379 
1 1 1   17    5   -3 o   48.792   2.6627   97.622   10.550   85.560   16.198  106.510   13.904   45.411   4.4322   50.883   3.3713 -5.471527 5.568688 
1 1 1   17    5   -2 o   79.341   1.9252  256.990   12.451  268.444   18.021  246.526   17.224   80.977   2.7340   77.598   2.7273 3.379181 3.861667 
1 1 1   17    5   -1 o  127.755   1.6830  666.050   17.527  687.251   24.635  644.318   24.941  129.699   2.3301  125.568   2.4367 4.130531 3.371503 
1 1 1   17    5    0 o   49.860   2.5105  101.858   10.171   93.221   14.832  109.524   13.974   47.515   3.8627   51.606   3.3397 -4.090206 5.106291 
1 1 1   17    5    1 o   78.617   1.9139  252.316   12.265  264.364   17.752  241.310   16.965   80.362   2.7138   76.774   2.7152 3.588226 3.838874 
1 1 1   17    5    2 o  110.257   1.5966  496.030   14.350  487.250   21.370  503.240   19.364  109.200   2.4008  111.006   2.1400 -1.806175 3.216127 
1 1 1   17    5    3 o   82.718   1.7455  279.246   11.770  263.688   17.618  291.785   15.817   80.261   2.6967   84.482   2.2989 -4.220879 3.543620 
1 1 1   17    5    4 o   58.017   2.1128  137.641   9.9753  144.390   15.787  133.155   12.870   59.290   3.2792   56.993   2.7787 2.296532 4.298179 
1 1 1   17    5    5 o   98.765   1.7532  398.112   14.115  406.236   20.246  390.431   19.688   99.698   2.4913   97.710   2.4738 1.987755 3.510896 
1 1 1   17    5    6 o   43.590   2.7806   78.023   9.8286   68.158   14.668   86.061   13.241   40.464   4.5244   45.683   3.5843 -5.218666 5.772146 
1 1 1   17    5    7 o   64.995   2.2170  172.750   11.729  167.206   23.047  174.688   13.625   63.612   4.4731   65.322   2.5638 -1.709274 5.155752 
1 1 1   17    5    8 o  101.752   1.8482  422.629   15.329  413.161   28.797  426.373   18.108  100.341   3.5262  102.171   2.1743 -1.830391 4.142693 
1 1 1   17    5    9 o  194.915   1.9123  1551.02   30.383  1573.02   55.029  1541.38   36.441  195.928   3.4455  194.236   2.3015 1.691925 4.143535 
1 1 1   17    5   10 o  140.391   1.6645  804.328   19.049  800.842   30.315  806.604   24.487  139.949   2.6573  140.531   2.1376 -0.5825195 3.410370 
1 1 1   17    5   11 o   73.887   1.9066  223.027   11.474  230.343   18.867  218.733   14.454   74.948   3.0949   73.118   2.4284 1.829750 3.933860 
1 1 1   17    5   12 o   12.065   5.1102   0.3872   8.6920   5.7527   15.064  -2.2905   10.642   17.232   6.9540   12.516   5.4783 4.715679 8.852675 
1 1 1   17    5   13 o  112.966   1.6806  520.812   15.475  519.127   24.846  521.879   19.781  112.664   2.7054  113.034   2.1468 -0.3703232 3.453710 
1 1 1   17    5   14 o  148.463   1.6761  899.543   20.284  898.716   32.256  900.083   26.088  148.242   2.6694  148.442   2.1560 -0.2001343 3.431291 
1 1 1   17    5   15 o  114.188   1.6982  532.166   15.807  498.368   25.142  554.258   20.326  110.336   2.7977  116.486   2.1407 -6.150208 3.522686 
1 1 1   17    5   16 o  142.915   1.6753  833.598   19.517  849.980   31.381  823.264   24.923  144.160   2.6705  141.963   2.1537 2.197327 3.430753 
1 1 1   17    5   17 o  159.000   1.6909  1031.84   21.915  1033.56   34.593  1030.69   28.324  158.964   2.6696  158.835   2.1876 0.1291809 3.451450 
1 1 1   17    5   18 o   56.346   2.2910  129.955   10.501  129.666   17.567  130.116   13.099   56.063   3.8676   56.314   2.8629 -0.2508430 4.811917 
1 1 1   17    5   19 o   43.379   3.3437   77.583   11.732   87.838   21.657   73.323   13.958   45.646   5.9630   42.036   4.1266 3.610523 7.251633 
1 1 1   17    5   20 o   68.857   2.4321  194.076   13.629  170.941   23.838  205.311   16.612   64.255   4.5814   70.764   2.8860 -6.508667 5.414599 
1 1 1   17    5   21 o   23.724   5.8148   24.262   11.156   27.643   20.689   22.876   13.247   25.940   8.4911   23.148   6.6623 2.791323 10.79280 
1 1 1   17    5   22 o   80.859   2.2708  267.427   14.953  310.062   26.742  248.034   18.036   86.805   3.7884   77.789   2.8491 9.016151 4.740194 
1 1 1   17    5   23 o  147.716   2.2513  891.807   27.108  887.442   40.380  895.388   36.575  147.101   3.3675  147.844   3.0349 -0.7432556 4.533307 
1 1 1   17    5   24 o   74.040   2.0884  224.151   12.592  244.615   19.642  209.873   16.407   77.197   3.1278   71.545   2.8188 5.652077 4.210548 
1 1 1   17    5   25 o   80.977   2.5589  268.522   16.870  247.593   20.329  314.810   30.232   77.645   3.2188   87.333   4.2596 -9.687386 5.339032 
1 1 1   17    5   26 o   72.160   2.4318  213.202   14.284  208.865   19.257  218.507   21.297   71.280   3.3234   72.858   3.5970 -1.577599 4.897276 
1 1 1   17    5   27 o   30.792   4.8697   40.107   11.817   26.809   16.020   55.981   17.502   25.006   7.3638   36.183   6.1541 -11.17648 9.596835 
1 1 1   17    5   28 o   75.661   2.1532  234.173   13.267  250.975   20.508  222.082   17.397   78.156   3.2260   73.569   2.9067 4.587173 4.342333 
1 1 1   17    5   29 o   57.664   2.8642  136.559   13.421  123.686   18.170  152.013   19.908   54.646   4.1092   60.625   4.0518 -5.978622 5.770847 
1 1 1   17    5   30 f   54.130   2.7383  120.311   12.043  138.432   18.941  108.014   15.603   57.834   4.0433   51.107   3.7720 6.726864 5.529528 
1 1 1   17    5   31 o   62.171   2.4801  158.438   12.544  165.629   19.403  153.274   16.441   63.335   3.7754   61.010   3.3185 2.325096 5.026496 
1 1 1   17    5   32 o  124.048   1.8758  628.712   18.968  648.924   28.632  612.905   25.321  125.839   2.7913  122.354   2.5388 3.485077 3.773139 
1 1 1   17    5   33 o  106.296   1.9262  461.744   16.690  486.031   25.704  444.042   21.944  108.834   2.9000  104.127   2.5854 4.706932 3.885094 
1 1 1   17    5   34 o   84.010   2.0540  288.555   14.066  269.637   21.344  303.080   18.702   80.957   3.2408   85.964   2.6721 -5.006882 4.200355 
1 1 1   17    5   35 o   46.408   3.1359   88.837   11.793   60.057   21.417  101.361   14.128   37.037   7.3532   49.512   3.5236 -12.47425 8.153854 
1 1 1   17    5   36 o   32.421   4.3664   44.234   11.246   46.433   15.841   41.998   15.970   32.771   6.1558   31.040   6.5195 1.731806 8.966465 
1 1 1   17    5   37 o   13.622   5.4531   3.9713   9.1838   0.3600   15.112   6.0862   11.564   15.628   6.6824   15.620   6.1622 0.7792473E-02 9.089979 
1 1 1   17    5   38 o  108.250   1.9297  479.106   17.028  521.723   28.709  455.978   21.150  112.630   3.1300  105.501   2.4593 7.129082 3.980618 
1 1 1   17    5   39 o  129.655   1.9003  687.326   20.084  721.827   33.613  668.170   25.046  132.517   3.1117  127.714   2.4058 4.803207 3.933272 
1 1 1   17    5   40 o   65.282   2.2426  174.701   11.916  158.821   19.775  183.755   14.932   61.865   3.9418   66.859   2.7456 -4.994884 4.803785 
1 1 1   17    5   41 o   41.269   3.0264   70.387   10.110   69.799   17.617   70.676   12.345   40.471   5.4808   41.211   3.7147 -0.7393837 6.621091 
1 1 1   17    5   42 o   44.636   2.8000   82.156   10.137   65.508   17.063   91.236   12.601   39.157   5.4969   46.942   3.3145 -7.785038 6.418826 
1 1 1   17    5   43 o   33.465   3.8128   46.906   10.216   65.785   17.216   36.647   12.691   39.203   5.5417   29.075   5.5575 10.12844 7.848335 
1 1 1   17    5   44 o   77.658   2.4935  247.718   15.764  220.377   29.071  259.106   18.762   72.411   4.9551   79.315   2.9068 -6.904327 5.744808 
1 1 1   17    5   45 o   37.558   3.8475   59.041   11.613   38.257   21.847   67.226   13.710   29.078   8.6091   39.986   4.2724 -10.90716 9.610921 
1 1 1   17    5   46 o   61.539   2.4596  155.708   12.313  144.110   25.311  159.304   14.093   58.237   5.3930   62.170   2.7880 -3.932743 6.071071 
1 1 1   17    5   47 o   45.798   2.7223   86.575   10.117   89.405   17.236   85.088   12.496   45.997   4.6611   45.238   3.4138 0.7589836 5.777589 
1 1 1   17    5   48 o   60.252   2.3077  149.214   11.313  141.080   19.118  153.597   14.034   58.072   4.0643   61.004   2.8299 -2.931747 4.952455 
1 1 1   17    5   49 o   32.780   3.6830   45.141   9.6714   58.191   16.836   38.714   11.815   36.542   5.8493   29.940   5.0187 6.601549 7.707277 
1 1 1   17    5   50 o   44.307   2.8143   81.239   10.112   86.351   17.200   78.538   12.500   45.075   4.7526   43.362   3.5680 1.713085 5.942921 
1 1 1   17    5   51 o   45.464   2.7688   85.523   10.213   98.466   17.619   78.974   12.533   48.217   4.5359   43.466   3.5686 4.751366 5.771457 
1 1 1   17    5   52 o   15.846   5.5792   9.6939   8.9500   7.3930   15.485   10.848   10.968   17.418   7.0427   17.008   6.1549 0.4099922 9.353247 
1 1 1   17    5   53 f   14.250   5.4200   6.4840   8.7034   25.005   14.998  -2.9199   10.687   23.574   7.1686   12.148   5.3958 11.42547 8.972393 
1 1 1   17    5   54 o   56.849   2.4033  133.280   11.112  131.309   18.467  134.398   13.912   55.814   4.0874   56.899   3.0103 -1.084988 5.076231 
1 1 1   17    5   55 o   29.876   3.8651   37.938   9.1923   41.819   16.124   36.068   11.189   30.297   6.7064   28.753   4.9523 1.543964 8.336781 
1 1 1   17    5   56 o   22.145   5.1906   21.794   9.2056   14.846   15.893   25.302   11.293   19.734   7.3634   23.699   5.8752 -3.965336 9.420033 
1 1 1   17    5   57 o   28.524   4.1316   34.922   9.3272   43.545   16.598   30.942   11.276   30.787   6.7961   26.364   5.4278 4.422501 8.697573 
1 1 1   17    5   58 o   52.508   2.5498  114.144   10.881  113.722   18.322  114.374   13.524   51.633   4.3949   52.334   3.1853 -0.7015839 5.427793 
1 1 1   17    5   59 o   46.172   2.7981   88.666   10.482   92.601   17.867   86.602   12.943   46.315   4.8022   45.364   3.5279 0.9513702 5.958810 
1 1 1   17    5   60 o   26.063   6.1237   31.066   12.788   59.052   25.281   21.444   14.824   34.462   8.9283   21.797   7.1903 12.66520 11.46366 
1 1 1   17    5   61 o   50.352   3.5593  106.898   14.515  133.463   27.409   96.544   17.111   54.484   6.2866   47.379   4.4838 7.104897 7.721800 
1 1 1   17    5   62 o   70.164   2.9122  205.150   16.620  225.171   30.272  196.512   19.884   71.829   5.2055   68.284   3.5849 3.544876 6.320528 
1 1 1   17    5   63 f   12.471   5.4336  -0.4556   10.367   8.3012   15.006  -8.4497   14.338   17.109   6.9276   12.795   5.9029 4.313977 9.101410 
1 1 1   17    5   64 o   41.796   3.4862   73.942   11.769   46.056   16.658  101.735   16.630   31.332   6.7236   48.663   4.2346 -17.33140 7.946000 
1 1 1   17    5   65 o   46.401   3.1716   90.562   11.924   95.784   17.557   86.090   16.246   46.914   4.6522   44.525   4.5396 2.389229 6.500077 
1 1 1   17    5   66 o   63.286   2.2790  165.849   11.738  193.749   20.341  151.922   14.371   67.552   3.7083   60.255   2.9348 7.297195 4.729120 
1 1 1   17    5   67 o   41.367   2.9011   71.775   9.7206   63.322   15.637   77.099   12.410   37.673   5.2332   42.558   3.6112 -4.884884 6.358254 
1 1 1   17    5   68 o   60.069   2.2648  149.520   11.070  145.373   17.437  152.320   14.327   58.450   3.6783   60.302   2.9234 -1.851536 4.698530 
1 1 1   17    5   69 o   90.558   1.9200  338.055   14.173  311.797   21.491  358.263   18.854   86.172   3.0645   92.835   2.4937 -6.663445 3.950876 
1 1 1   17    5   70 o   33.265   3.5744   47.417   9.5404   56.442   15.463   41.870   12.123   35.192   5.5761   30.517   5.0496 4.674828 7.522763 
1 1 1   17    5   71 o   44.585   2.7979   83.449   10.117   73.502   15.784   90.387   13.181   40.667   4.8572   46.014   3.5415 -5.346268 6.011189 
1 1 1   17    5   72 o   33.478   3.5570   48.152   9.5584   60.020   15.441   40.780   12.170   36.313   5.3789   29.949   5.1722 6.363976 7.462181 
1 1 1   17    5   73 o   20.505   5.3288   19.606   8.9873   19.728   14.430   19.529   11.487   20.362   7.0904   20.229   6.2961 0.1323185 9.482337 
1 1 1   17    5   74 o   18.576   5.5048   16.142   8.9290   2.1131   14.480   24.749   11.342   14.763   6.4273   22.672   6.0321 -7.908911 8.814544 
1 1 1   17    5   75 o   12.460   5.3229   1.8706   9.5718   18.986   17.621  -5.2931   11.400   20.159   7.7014   11.561   5.3083 8.597444 9.353539 
1 1 1   17    5   76 o   20.056   5.7199   19.325   9.8077   1.2611   17.696   27.335   11.783   15.580   6.9303   23.650   6.0791 -8.070105 9.218675 
1 1 1   17    5   77 o   11.044   5.0388  -3.9265   10.058   7.3224   17.800  -9.2032   12.191   16.815   7.2226   11.137   5.2383 5.677864 8.922179 
1 1 1   17    5   78 o   29.053   5.2573   39.731   11.992   19.788   26.421   44.906   13.458   20.756   8.8546   30.668   5.5894 -9.912245 10.47114 
1 1 1   17    5   79 o   13.349   5.5815   4.3462   10.160 -16.2499   17.182   15.418   12.598   12.300   5.9060   17.978   6.5829 -5.678057 8.843984 
1 1 1   17    5   80 o   14.978   5.8099   9.0006   10.137  -0.1979   16.539   14.535   12.829   14.546   6.5667   17.578   6.6039 -3.031602 9.313077 
1 1 1   17    5   81 o   15.947   5.9019   11.495   10.171   11.256   16.249   11.649   13.042   17.004   7.0803   16.507   6.5340 0.4963722 9.634517 
1 1 1   17    5   82 o   15.024   5.7769   9.5671   9.9581  -2.6088   16.153   17.032   12.647   13.786   6.3256   18.309   6.6117 -4.523078 9.150301 
1 1 1   17    5   83 o   14.126   5.3772   8.3811   8.5705   0.5538   11.407   18.529   12.988   12.543   5.5728   18.765   6.7095 -6.221673 8.721971 
1 1 1   17    5   84 o   12.195   5.3405   1.5512   10.126  -2.3364   11.272   17.803   23.047   11.731   5.3452   18.861   8.1606 -7.130089 9.755309 
1 1 1   17    5   85 o   18.201   6.0719   17.288   10.563   6.4087   11.742   63.479   24.194   14.173   5.9678   30.831   9.0417 -16.65799 10.83360 
1 1 1   17    5   86 o   11.136   5.1397  -3.8780   10.884   1.3658   12.370 -21.8550   22.904   12.973   5.7810   13.159   6.4335 -0.1864634 8.649253 
1 1 1   17    5   87 o   16.066   6.1814   12.455   11.407   9.7427   13.052   21.224   23.468   15.406   6.3743   19.207   8.2720 -3.800576 10.44304 
1 1 1   17    5   88 o   25.211   6.7347   35.563   14.103   35.563   14.103   0.0000   0.0000   25.211   6.7347  ?   ?  0.000000 6.734716 
1 1 1   17    5   89 o   15.483   6.5105   9.8037   13.944   9.8037   13.944   0.0000   0.0000   15.483   6.5105  ?   ?  0.000000 6.510497 
1 1 1   17    5   90 o   22.234   7.8020   31.881   17.492   31.881   17.492   0.0000   0.0000   22.234   7.8020  ?   ?  0.000000 7.801966 
1 1 1   17    5   91 o   13.689   6.1174   3.0416   13.955   3.0416   13.955   0.0000   0.0000   13.689   6.1174  ?   ?  0.000000 6.117446 
1 1 1   17    5   92 o   27.201   6.7445   41.996   14.880   41.996   14.880   0.0000   0.0000   27.201   6.7445  ?   ?  0.000000 6.744538 
1 1 1   17    5   93 o   16.836   6.7645   15.024   14.187   15.024   14.187   0.0000   0.0000   16.836   6.7645  ?   ?  0.000000 6.764502 
1 1 1   17    5   94 o   13.845   5.9793   5.9748   12.329   2.4364   13.884   19.163   26.805   13.423   6.0421   18.216   8.2776 -4.792493 10.24820 
1 1 1   17    5   95 o   11.660   5.4197  -3.5493   12.429 -10.8238   14.437   17.280   24.429   11.270   5.4119   17.747   7.9991 -6.477465 9.657870 
1 1 1   17    5   96 o   11.318   5.2832  -4.3165   12.009 -14.0066   13.808   25.775   24.333   10.563   5.1261   19.158   8.3363 -8.594609 9.786291 
1 1 1   17    5   97 o   8.8316   4.4668 -41.4679   15.744 -71.8375   22.166 -10.5422   22.368   9.4711   4.8383   13.625   6.5908 -4.153587 8.176048 
1 1 1   17    5   98 o   19.428   7.5176   25.054   16.940   28.230   23.675   21.722   24.249   19.442   8.3398   18.205   8.1044 1.236994 11.62902 
1 1 1   17    5   99 o   10.633   5.2423 -21.3927   16.254 -12.0049   23.082 -30.6268   22.892   13.573   6.5960   11.938   5.9434 1.635271 8.878730 
1 1 1   17    5  100 o   9.8013   4.9025 -31.2393   16.380 -37.0087   23.022 -25.3245   23.311   11.531   5.7744   12.453   6.1652 -0.9221029 8.447075 
1 1 1   17    6  -97 o   17.927   8.0848   20.414   24.997   20.414   24.997   0.0000   0.0000   17.927   8.0848  ?   ?  0.000000 8.084795 
1 1 1   17    6  -96 o   18.497   8.1943   24.063   24.489   24.063   24.489   0.0000   0.0000   18.497   8.1943  ?   ?  0.000000 8.194279 
1 1 1   17    6  -95 o   21.888   9.1644   44.093   27.446   44.093   27.446   0.0000   0.0000   21.888   9.1644  ?   ?  0.000000 9.164392 
1 1 1   17    6  -94 o   12.497   6.2187 -29.9886   24.931 -29.9886   24.931   0.0000   0.0000   12.497   6.2187  ?   ?  0.000000 6.218692 
1 1 1   17    6  -93 o   15.860   7.4661   5.1703   24.861   5.1703   24.861   0.0000   0.0000   15.860   7.4661  ?   ?  0.000000 7.466097 
1 1 1   17    6  -92 o   16.824   7.8158   11.169   25.794   11.169   25.794   0.0000   0.0000   16.824   7.8158  ?   ?  0.000000 7.815768 
1 1 1   17    6  -91 o   16.143   7.5439   6.5870   24.599   6.5870   24.599   0.0000   0.0000   16.143   7.5439  ?   ?  0.000000 7.543918 
1 1 1   17    6  -90 o   16.329   7.5619   8.0838   23.856   8.0838   23.856   0.0000   0.0000   16.329   7.5619  ?   ?  0.000000 7.561854 
1 1 1   17    6  -89 o   18.915   8.2431   23.239   23.869   23.239   23.869   0.0000   0.0000   18.915   8.2431  ?   ?  0.000000 8.243076 
1 1 1   17    6  -88 o   19.021   7.5720   22.429   17.610   22.429   17.610   0.0000   0.0000   19.021   7.5720  ?   ?  0.000000 7.572039 
1 1 1   17    6  -87 o   20.338   7.6908   26.605   17.463   26.605   17.463   0.0000   0.0000   20.338   7.6908  ?   ?  0.000000 7.690825 
1 1 1   17    6  -86 o   10.703   5.2905 -25.1327   16.925 -25.1327   16.925   0.0000   0.0000   10.703   5.2905  ?   ?  0.000000 5.290450 
1 1 1   17    6  -85 o   21.798   7.8578   30.673   17.854   30.673   17.854   0.0000   0.0000   21.798   7.8578  ?   ?  0.000000 7.857756 
1 1 1   17    6  -84 o   12.537   5.9811 -10.0142   17.012 -10.0142   17.012   0.0000   0.0000   12.537   5.9811  ?   ?  0.000000 5.981059 
1 1 1   17    6  -83 o   23.100   7.9933   34.243   18.325   34.243   18.325   0.0000   0.0000   23.100   7.9933  ?   ?  0.000000 7.993253 
1 1 1   17    6  -82 o   26.937   5.5674   36.703   11.820   34.694   17.508   38.386   16.024   23.589   7.8155   25.590   7.3153 -2.001467 10.70490 
1 1 1   17    6  -81 o   18.852   6.3819   19.099   11.667  -4.2765   17.748   36.887   15.482   13.740   6.4164   25.340   7.1730 -11.60067 9.624075 
1 1 1   17    6  -80 o   18.451   5.9465   17.669   10.169   26.773   16.780   12.385   12.783   21.202   7.6210   16.335   6.4680 4.867592 9.995699 
1 1 1   17    6  -79 o   10.480   4.9380  -7.6539   10.918 -13.7495   24.171  -6.0914   12.238   14.516   6.9790   11.437   5.3367 3.079308 8.785587 
1 1 1   17    6  -78 o   25.236   5.1503   30.789   10.236  -4.5978   16.841   51.519   12.890   13.628   6.3257   32.998   4.9441 -19.36996 8.028580 
1 1 1   17    6  -77 o   29.309   4.5380   39.696   10.492   47.607   17.129   34.945   13.273   29.670   7.1639   26.050   6.3167 3.620077 9.551032 
1 1 1   17    6  -76 f   18.410   5.9181   16.824   10.076   7.1120   16.891   22.189   12.554   16.152   6.9873   20.630   6.6034 -4.478701 9.613860 
1 1 1   17    6  -75 o   12.369   5.3149   2.1200   9.6453   5.1614   16.297   0.4802   11.966   15.630   6.8114   12.967   5.7370 2.663376 8.905572 
1 1 1   17    6  -74 o   29.761   4.3361   40.070   10.210   18.870   17.228   51.547   12.676   19.562   7.5780   33.475   4.7810 -13.91297 8.960193 
1 1 1   17    6  -73 o   27.112   3.9999   32.754   8.5747   33.380   11.933   32.085   12.330   26.265   5.7346   25.531   6.0226 0.7341328 8.316074 
1 1 1   17    6  -72 o   47.723   2.6826   96.109   10.394  110.865   15.943   85.201   13.707   50.320   3.9176   44.136   3.8483 6.183784 5.491519 
1 1 1   17    6  -71 o   42.403   2.9006   76.237   9.9655   99.123   15.464   59.984   13.032   47.554   4.0272   36.637   4.4553 10.91778 6.005671 
1 1 1   17    6  -70 o   20.315   5.3652   19.458   9.0150   8.5891   13.515   28.171   12.101   16.146   6.5608   24.063   6.1475 -7.917061 8.990877 
1 1 1   17    6  -69 o   24.088   4.4777   26.127   8.4687   18.432   12.071   33.586   11.885   19.653   6.4885   26.723   5.6336 -7.070595 8.592906 
1 1 1   17    6  -68 o   10.884   4.7587  -0.4292   8.0101   6.1465   11.548  -6.5264   11.120   14.819   6.0486   11.206   5.1801 3.613090 7.963564 
1 1 1   17    6  -67 o   67.250   2.0330  187.176   11.132  178.264   15.987  195.562   15.509   65.030   3.0242   68.284   2.7922 -3.253632 4.116051 
1 1 1   17    6  -66 f   39.799   2.8716   66.681   9.2534   71.946   13.588   62.127   12.637   40.661   4.1580   37.750   4.1763 2.911240 5.893218 
1 1 1   17    6  -65 o   10.005   4.5253  -3.2628   7.8979 -25.3935   16.722   3.0919   8.9604   11.378   5.5482   12.708   5.2718 -1.330806 7.653417 
1 1 1   17    6  -64 o   20.124   4.7495   18.309   7.6648   7.9008   13.591   23.164   9.2816   16.281   6.5927   22.517   5.1666 -6.236288 8.375972 
1 1 1   17    6  -63 o   11.032   4.5552   2.1311   6.6473   12.139   10.157  -5.3673   8.7917   16.920   5.9445   10.100   4.6463 6.820140 7.544861 
1 1 1   17    6  -62 o   53.163   2.0179  116.747   8.7287  119.877   13.941  114.729   11.195   53.329   3.2220   52.459   2.6262 0.8691864 4.156729 
1 1 1   17    6  -61 o   17.653   4.6784   13.985   6.8394   15.635   10.341   12.703   9.1189   18.630   5.9959   17.044   5.6401 1.586042 8.231781 
1 1 1   17    6  -60 o   15.089   4.9121   9.7579   6.9283   11.372   10.627   8.5647   9.1371   16.756   6.0593   15.093   5.5924 1.663448 8.245625 
1 1 1   17    6  -59 o   36.262   2.5821   54.832   7.5824   51.584   11.433   57.381   10.131   34.564   4.1402   36.795   3.4168 -2.231770 5.368022 
1 1 1   17    6  -58 o   17.100   4.7964   13.026   6.9552   8.5152   10.605   16.431   9.2136   15.623   5.9730   19.060   5.5769 -3.436851 8.171876 
1 1 1   17    6  -57 o   14.043   5.0544   7.5427   7.3837   21.828   11.482  -2.5295   9.6415   21.755   6.1838   11.456   5.1044 10.29950 8.018377 
1 1 1   17    6  -56 o   29.138   3.4789   36.088   8.1000   32.671   12.448   38.598   10.667   26.758   5.8687   29.739   4.5444 -2.981335 7.422538 
1 1 1   17    6  -55 o   33.018   3.1020   45.817   8.2511   56.518   12.743   38.092   10.827   36.183   4.4115   29.520   4.6535 6.663370 6.412245 
1 1 1   17    6  -54 f   60.719   2.3030  152.292   11.378  151.020   14.999  154.016   17.461   60.156   3.0690   60.511   3.5557 -0.3551292 4.697014 
1 1 1   17    6  -53 o   25.922   3.9667   28.907   8.1154   38.474   11.111   17.965   11.882   29.682   4.7524   20.099   6.4231 9.582264 7.990099 
1 1 1   17    6  -52 o   46.216   2.3945   88.339   8.9899   84.038   12.259   93.343   13.223   44.749   3.3859   47.143   3.4651 -2.393284 4.844700 
1 1 1   17    6  -51 o   32.768   2.8696   44.824   7.5877   27.219   11.497   58.412   10.100   24.547   5.8323   37.287   3.3589 -12.74021 6.730392 
1 1 1   17    6  -50 o   51.181   2.0052  107.774   8.3498  106.395   12.623  108.848   11.134   50.533   3.0789   51.251   2.6743 -0.7175102 4.078217 
1 1 1   17    6  -49 o   19.498   4.9331   16.818   7.8453   27.836   11.025   5.5137   11.167   24.967   5.5598   14.931   6.0006 10.03583 8.180400 
1 1 1   17    6  -48 o   37.478   2.5707   58.198   7.8059   45.159   11.852   68.187   10.374   32.376   4.6218   40.415   3.1743 -8.038815 5.606928 
1 1 1   17    6  -47 o   71.999   1.6963  212.347   9.9554  205.248   14.903  218.068   13.378   70.502   2.5976   72.788   2.2575 -2.286079 3.441519 
1 1 1   17    6  -46 o   54.492   2.1051  122.101   9.3331  137.184   15.800  114.017   11.567   57.370   3.3937   52.501   2.7120 4.869461 4.344170 
1 1 1   17    6  -45 f   43.186   2.5171   77.039   8.8226   65.844   15.071   82.876   10.882   39.211   4.8163   44.674   3.0058 -5.463387 5.677272 
1 1 1   17    6  -44 o   72.521   1.8108  215.438   10.705  227.283   17.894  208.836   13.359   74.118   2.9677   71.255   2.3030 2.863403 3.756482 
1 1 1   17    6  -43 o   29.725   3.3416   37.044   7.9568   16.599   13.391   48.202   9.8926   20.034   6.8364   33.876   3.6395 -13.84220 7.744830 
1 1 1   17    6  -42 o   17.132   5.0485   12.632   7.5274   26.620   13.280   6.0108   9.1369   24.391   6.5441   14.296   5.5239 10.09494 8.563814 
1 1 1   17    6  -41 f   33.780   2.9750   47.424   8.1085   63.448   14.311   39.848   9.8402   38.638   4.6364   30.683   4.0318 7.955019 6.144246 
1 1 1   17    6  -40 o   53.358   2.1892  116.968   9.5019  113.955   17.281  118.273   11.376   52.152   4.0979   53.566   2.6132 -1.414650 4.860175 
1 1 1   17    6  -39 o   66.440   1.9759  180.959   10.689  164.474   19.404  188.141   12.808   62.843   3.8058   67.672   2.3253 -4.828789 4.459929 
1 1 1   17    6  -38 o   42.502   2.5799   74.484   8.8959   98.409   17.037   65.516   10.431   48.398   4.3652   39.712   3.2507 8.686649 5.442632 
1 1 1   17    6  -37 o   78.258   2.2169  251.245   14.128  227.398   33.873  256.267   15.544   73.103   5.7302   78.988   2.4171 -5.885712 6.219102 
1 1 1   17    6  -36 o   71.068   2.1508  207.118   12.446  169.879   23.405  221.799   14.696   63.672   4.5393   73.479   2.4570 -9.806507 5.161598 
1 1 1   17    6  -35 o   65.699   2.5658  177.450   13.714  172.741   23.585  179.855   16.857   64.236   4.5334   66.002   3.1423 -1.765739 5.515943 
1 1 1   17    6  -34 o   33.137   3.5804   45.862   9.5179   26.509   20.237   51.358   10.785   25.042   8.4051   35.028   3.8401 -9.985346 9.240788 
1 1 1   17    6  -33 o   56.946   2.2907  133.088   10.612  132.436   18.806  133.392   12.854   56.375   4.1208   56.919   2.7787 -0.5436554 4.970143 
1 1 1   17    6  -32 o   89.272   1.8105  325.859   13.175  347.301   20.778  311.440   17.038   91.922   2.7762   87.136   2.4011 4.786278 3.670489 
1 1 1   17    6  -31 f   79.951   1.9164  261.432   12.489  259.216   19.182  263.063   16.455   79.364   2.9704   80.058   2.5246 -0.6944275 3.898293 
1 1 1   17    6  -30 o   98.622   1.6634  397.427   13.372  392.401   21.913  400.410   16.880   97.743   2.7531   98.918   2.0934 -1.175171 3.458586 
1 1 1   17    6  -29 f   43.473   2.6227   77.777   9.2509   74.406   16.125   79.431   11.294   42.045   4.7904   43.837   3.1824 -1.791927 5.751144 
1 1 1   17    6  -28 o   22.088   5.4605   21.187   9.7752   23.522   15.154   19.522   12.793   23.431   7.2213   21.451   6.6389 1.979885 9.809328 
1 1 1   17    6  -27 o   71.039   2.1099  206.643   12.204  213.517   19.209  201.990   15.804   71.978   3.2826   70.116   2.7705 1.861343 4.295454 
1 1 1   17    6  -26 o   50.783   2.4093  105.848   9.9448   90.467   17.576  113.091   12.061   46.465   4.7052   52.427   2.8328 -5.962051 5.492165 
1 1 1   17    6  -25 o   70.100   1.9747  201.073   11.273  205.067   19.366  199.026   13.864   70.529   3.3783   69.669   2.4450 0.8595428 4.170224 
1 1 1   17    6  -24 o   65.570   2.2748  176.159   12.140  168.268   26.264  178.304   13.690   63.404   5.1252   65.924   2.5525 -2.519314 5.725649 
1 1 1   17    6  -23 o   81.452   1.8886  271.147   12.539  241.885   21.290  286.690   15.516   76.617   3.4175   83.671   2.2771 -7.053413 4.106602 
1 1 1   17    6  -22 o   11.635   5.0284  -0.8488   8.7319   2.1941   15.987  -2.1424   10.424   16.541   6.9643   12.363   5.4163 4.178208 8.822557 
1 1 1   17    6  -21 o   28.875   4.1719   35.101   9.5352   17.147   17.026   43.306   11.509   21.463   7.6812   32.052   4.5315 -10.58860 8.918253 
1 1 1   17    6  -20 o   29.960   4.1036   37.693   9.7588   39.760   17.486   36.757   11.761   30.092   7.2208   29.356   5.0998 0.7362881 8.840163 
1 1 1   17    6  -19 o   69.053   2.7084  195.655   15.216  207.587   20.772  181.840   22.351   70.950   3.6034   66.262   4.1590 4.688560 5.502872 
1 1 1   17    6  -18 o   61.326   2.6573  154.326   13.252  137.395   16.624  183.844   21.950   57.700   3.5516   66.660   4.0588 -8.959194 5.393362 
1 1 1   17    6  -17 o  143.069   1.9157  836.349   22.341  818.678   27.465  870.915   38.412  141.452   2.3820  145.656   3.2352 -4.204468 4.017459 
1 1 1   17    6  -16 o   9.4885   4.5043 -11.4507   9.4103   16.621   13.939 -34.9565   12.756   20.533   6.9756   8.6424   4.3234 11.89085 8.206701 
1 1 1   17    6  -15 o   84.033   1.7956  288.426   12.300  265.028   18.429  307.220   16.516   80.378   2.8170   86.631   2.3410 -6.253166 3.662787 
1 1 1   17    6  -14 o   54.147   2.2838  120.115   10.058  116.321   15.542  122.848   13.192   53.077   3.6137   54.664   2.9718 -1.587349 4.678761 
1 1 1   17    6  -13 o   16.290   5.7146   9.8350   9.3838  -8.7164   13.697   26.245   12.882   12.837   5.8655   24.600   6.3733 -11.76277 8.661585 
1 1 1   17    6  -12 o   97.106   1.8330  385.151   14.509  388.613   20.285  381.525   20.762   97.410   2.5568   96.502   2.6418 0.9088364 3.676496 
1 1 1   17    6  -11 o   26.344   4.6037   29.464   9.5262   46.572   14.251   15.644   12.808   33.079   5.4766   19.882   6.6868 13.19679 8.643309 
1 1 1   17    6  -10 f  141.291   1.7200  815.147   19.810  804.368   27.043  827.629   29.101  140.238   2.3657  142.221   2.5102 -1.982101 3.449248 
1 1 1   17    6   -9 o  140.271   1.7173  803.408   19.636  787.687   26.792  821.653   28.863  138.779   2.3683  141.711   2.4986 -2.932877 3.442681 
1 1 1   17    6   -8 o   26.054   4.3490   28.714   8.9109   22.942   14.156   32.502   11.468   23.222   6.9435   27.560   5.2972 -4.337900 8.733396 
1 1 1   17    6   -7 o   48.278   2.5455   95.632   9.9821   96.677   16.376   95.015   12.592   48.267   4.2041   48.023   3.2355 0.2442741 5.305006 
1 1 1   17    6   -6 o   64.998   2.0866  172.821   11.041  208.838   18.402  152.564   13.801   71.295   3.1744   60.976   2.7839 10.31876 4.222230 
1 1 1   17    6   -5 o   29.854   3.8819   37.252   9.2231   57.402   15.741   26.718   11.381   36.837   5.4027   24.877   5.7307 11.96059 7.875906 
1 1 1   17    6   -4 o   88.444   1.8074  319.445   13.031  338.532   21.451  308.282   16.404   90.863   2.8999   86.800   2.3206 4.063431 3.714072 
1 1 1   17    6   -3 o   28.088   4.1280   33.151   9.1697   39.256   15.423   29.813   11.404   30.112   6.4760   26.339   5.4898 3.772686 8.489803 
1 1 1   17    6   -2 o   62.722   2.1200  160.951   10.823  163.332   17.837  159.564   13.617   62.982   3.4879   62.379   2.6842 0.6029892 4.401158 
1 1 1   17    6   -1 o   28.169   4.1127   33.331   9.1650   4.3709   15.385   49.260   11.410   16.922   6.9526   34.346   4.1603 -17.42451 8.102299 
1 1 1   17    6    0 o   40.031   2.9388   65.995   9.5229   69.349   16.132   64.201   11.798   40.664   4.9701   39.356   3.7217 1.307648 6.209044 
1 1 1   17    6    1 o   95.453   2.2328  372.452   17.373   0.0000   0.0000  372.452   17.373  ?   ?    95.453   2.2328 0.000000 2.232763 
1 1 1   17    6    2 o   46.944   2.9776   90.648   11.335  129.412   22.241   77.046   13.175   55.735   4.9469   43.133   3.7854 12.60146 6.228991 
1 1 1   17    6    3 o   13.258   5.4373   2.5724   9.3875   3.2885   19.901   2.3675   10.646   18.592   7.7954   13.916   5.7573 4.675897 9.690927 
1 1 1   17    6    4 o   58.769   2.3386  141.449   11.181  147.417   20.520  138.929   13.334   59.673   4.2462   58.178   2.8200 1.495453 5.097356 
1 1 1   17    6    5 o   84.206   1.7902  289.554   12.288  268.471   18.823  305.214   16.222   80.912   2.8583   86.368   2.3063 -5.455544 3.672749 
1 1 1   17    6    6 o   89.799   1.7389  329.267   12.729  337.614   19.615  323.194   16.730   90.782   2.6535   88.876   2.3112 1.906677 3.518934 
1 1 1   17    6    7 o  143.991   1.6027  846.364   18.812  858.294   28.146  836.732   25.290  144.865   2.3835  143.077   2.1684 1.788742 3.222272 
1 1 1   17    6    8 o   55.488   2.2874  126.104   10.324  141.327   16.513  116.335   13.228   58.569   3.4745   53.186   3.0640 5.382195 4.632485 
1 1 1   17    6    9 o   48.082   2.5369   94.863   9.9080  109.225   15.846   85.643   12.696   51.400   3.8090   45.546   3.4452 5.854652 5.135941 
1 1 1   17    6   10 f   68.219   2.0064  190.320   11.145  186.990   17.365  192.652   14.534   67.450   3.1672   68.558   2.6054 -1.107506 4.101170 
1 1 1   17    6   11 o  142.143   1.7406  825.057   20.168  828.148   33.398  823.283   25.302  142.173   2.8818  141.912   2.1872 0.2615814 3.617817 
1 1 1   17    6   12 o   73.383   2.2140  220.367   13.229  201.914   26.133  226.724   15.339   69.765   4.6213   74.389   2.5333 -4.624260 5.270101 
1 1 1   17    6   13 o   71.912   2.4362  211.819   14.260  241.165   26.990  200.454   16.796   76.337   4.3555   69.872   2.9555 6.464867 5.263639 
1 1 1   17    6   14 o   35.598   3.7837   52.703   10.812   66.509   22.661   48.634   12.302   39.124   7.3759   34.025   4.5494 5.099228 8.666121 
1 1 1   17    6   15 o   14.166   5.7339   3.7285   10.276   32.494   21.950  -4.3454   11.629   27.604   8.7194   12.559   5.6004 15.04479 10.36300 
1 1 1   17    6   16 o   28.820   4.4143   35.055   10.041   35.286   17.071   34.933   12.415   28.386   7.3278   28.520   5.5401 -0.1346531 9.186331 
1 1 1   17    6   17 o   61.538   2.3343  155.140   11.688  171.420   19.915  146.586   14.436   64.423   3.8093   59.717   2.9749 4.705944 4.833260 
1 1 1   17    6   18 o   28.532   4.7272   34.549   10.610   25.897   16.680   40.428   13.750   24.645   7.5728   30.685   5.7072 -6.040327 9.482592 
1 1 1   17    6   19 o   60.113   2.3589  148.087   11.537  132.650   18.828  157.367   14.598   56.566   4.1113   61.885   2.9019 -5.319332 5.032286 
1 1 1   17    6   20 o   88.961   2.7629  324.649   20.011  383.965   29.617  274.823   27.145   96.491   3.7727   81.520   4.0981 14.97126 5.570231 
1 1 1   17    6   21 o   33.682   4.1739   47.522   11.215   34.933   16.370   58.655   15.395   28.215   7.1191   37.223   5.2167 -9.008266 8.825827 
1 1 1   17    6   22 o   10.103   4.7734 -11.6154   10.332   3.8503   15.542 -23.8636   13.831   16.781   6.9504   10.459   5.0880 6.321765 8.613745 
1 1 1   17    6   23 o   80.621   1.9470  265.690   12.795  256.253   21.027  271.240   16.124   78.899   3.2766   81.356   2.4341 -2.457169 4.081760 
1 1 1   17    6   24 o   42.167   3.2917   73.522   11.225   55.408   16.887   87.862   15.024   35.927   5.9760   45.961   4.0517 -10.03386 7.220017 
1 1 1   17    6   25 o   60.971   2.7178  152.717   13.473  185.640   18.823  118.127   19.294   67.079   3.4541   53.224   4.4890 13.85555 5.664060 
1 1 1   17    6   26 o   40.925   3.3228   69.328   10.990   67.572   16.321   70.784   14.864   39.980   5.1258   41.095   4.5115 -1.114334 6.828391 
1 1 1   17    6   27 o   34.427   3.7620   49.445   10.386   34.311   15.633   61.401   13.895   27.921   6.9072   38.225   4.5486 -10.30390 8.270405 
1 1 1   17    6   28 o   24.879   4.5878   26.461   8.9614   22.028   14.910   28.968   11.213   22.793   7.1845   25.860   5.4892 -3.066429 9.041478 
1 1 1   17    6   29 f   51.081   2.4958  107.188   10.361   97.991   18.120  111.655   12.629   48.359   4.6542   52.050   2.9890 -3.691135 5.531364 
1 1 1   17    6   30 o   34.503   3.3844   49.486   9.3965   44.802   16.343   51.799   11.485   32.016   6.4849   35.157   4.0834 -3.140717 7.663381 
1 1 1   17    6   31 f   88.872   1.8515  322.956   13.413  349.436   23.800  310.631   16.237   92.101   3.1749   87.055   2.2901 5.045959 3.914659 
1 1 1   17    6   32 o   67.512   2.2955  186.942   12.614  214.914   20.491  169.874   16.007   72.102   3.4969   64.192   3.0679 7.909859 4.651927 
1 1 1   17    6   33 o   30.984   4.0776   40.435   10.049   29.301   15.950   47.763   12.940   25.748   7.2781   33.505   4.8813 -7.756870 8.763430 
1 1 1   17    6   34 o   16.602   5.4409   11.209   8.4934   15.271   15.289   9.3959   10.214   20.177   7.2717   16.286   5.9331 3.890867 9.385112 
1 1 1   17    6   35 o   47.266   2.5480   91.963   9.7810   87.258   17.546   94.084   11.781   45.466   4.8071   47.710   3.0452 -2.244133 5.690429 
1 1 1   17    6   36 o   94.218   2.1373  363.671   16.415  372.619   24.433  356.310   22.161   95.030   3.1585   93.005   2.9268 2.024704 4.306058 
1 1 1   17    6   37 o  101.803   2.1095  424.610   17.505  421.560   25.851  427.193   23.790  101.071   3.1416  101.849   2.8683 -0.7782211 4.254009 
1 1 1   17    6   38 o   71.265   2.6142  208.983   15.160  247.582   29.427  195.037   17.688   76.772   4.7251   68.688   3.1677 8.083382 5.688661 
1 1 1   17    6   39 o   33.280   4.0098   46.678   10.659   33.916   23.524   49.975   11.957   27.587   9.0556   34.349   4.3691 -6.761986 10.05449 
1 1 1   17    6   40 o   33.938   3.9022   48.475   10.599   33.215   21.809   53.194   12.128   27.191   8.7033   35.462   4.2820 -8.271297 9.699633 
1 1 1   17    6   41 f   81.014   2.2274  269.525   14.695  230.858   29.095  282.767   17.027   73.930   4.8549   82.895   2.5228 -8.964821 5.471220 
1 1 1   17    6   42 o   26.248   4.4786   29.617   9.2387   17.806   15.250   36.465   11.612   20.898   7.2882   28.997   5.0988 -8.099234 8.894731 
1 1 1   17    6   43 o   71.453   2.1452  209.691   12.481  206.318   20.771  211.597   15.613   70.375   3.6331   71.624   2.6789 -1.249481 4.513988 
1 1 1   17    6   44 o   58.128   2.3780  139.136   11.244  156.802   18.711  129.152   14.067   61.253   3.7657   55.797   3.1050 5.455456 4.880713 
1 1 1   17    6   45 f   38.488   3.1775   61.746   9.8800   42.998   16.433   72.359   12.364   30.863   6.7228   41.531   3.6906 -10.66814 7.669209 
1 1 1   17    6   46 o   42.291   2.9596   74.311   10.139   77.603   17.318   72.595   12.506   42.453   5.1068   41.566   3.7305 0.8869400 6.324216 
1 1 1   17    6   47 o   8.1672   3.9833 -15.2407   8.6299   6.2035   15.046 -25.7536   10.535   16.832   6.8911   8.1122   4.0377 8.719447 7.986938 
1 1 1   17    6   48 o   31.994   3.7630   43.335   9.6265   39.036   16.264   45.653   11.943   29.168   6.9413   32.552   4.6316 -3.384525 8.344637 
1 1 1   17    6   49 o   39.141   3.1415   64.000   9.9392   63.449   16.917   64.290   12.283   37.989   5.6335   38.971   3.9197 -0.9818115 6.862964 
1 1 1   17    6   50 o   16.614   5.6016   11.429   8.9882 -10.6891   14.735   24.537   11.343   12.728   5.9112   23.301   5.9516 -10.57214 8.388269 
1 1 1   17    6   51 o   17.678   5.6118   13.521   9.0820   23.135   15.504   8.4990   11.206   22.623   7.3470   16.000   6.1342 6.622979 9.571159 
1 1 1   17    6   52 o   48.254   2.7168   96.674   10.643  104.520   17.732   92.255   13.307   49.440   4.4473   46.848   3.5100 2.592728 5.665548 
1 1 1   17    6   53 o   13.426   5.3647   4.5783   8.8724   9.1858   15.172   2.1840   10.937   17.577   7.0182   13.645   5.7535 3.932406 9.075107 
1 1 1   17    6   54 f   27.813   4.9150   34.081   10.736   47.809   23.808   30.577   12.028   30.963   8.9374   25.956   5.8280 5.007046 10.66972 
1 1 1   17    6   55 o   23.662   8.6773   25.061   21.902   25.061   21.902   0.0000   0.0000   23.662   8.6773  ?   ?  0.000000 8.677264 
1 1 1   17    6   56 o   30.310   5.3876   41.056   12.823   51.345   24.358   37.112   15.082   31.836   8.9923   28.179   6.6704 3.657656 11.19623 
1 1 1   17    6   57 o   32.521   3.8276   45.255   9.9525   38.273   17.005   48.892   12.274   28.248   7.3246   33.472   4.6219 -5.223583 8.660910 
1 1 1   17    6   58 o   13.969   5.4887   5.8322   9.1423   2.2717   15.531   7.7199   11.309   15.639   6.7323   15.576   6.1093 0.6308270E-01 9.091009 
1 1 1   17    6   59 o   27.538   4.4018   33.214   9.5484   51.584   16.043   23.137   11.882   33.533   6.0935   22.280   6.2761 11.25280 8.747591 
1 1 1   17    6   60 o   38.307   3.3557   62.133   10.373   62.205   17.774   62.095   12.774   36.814   6.1390   37.901   4.2053 -1.087048 7.441257 
1 1 1   17    6   61 o   18.680   5.6992   15.839   9.4691   28.591   16.791   9.8916   11.466   24.224   7.6228   16.365   6.2219 7.859243 9.839692 
1 1 1   17    6   62 o   35.991   3.4991   55.168   10.136   47.519   16.877   59.484   12.678   31.624   6.7524   37.004   4.2819 -5.379532 7.995560 
1 1 1   17    6   63 o   43.919   3.0109   81.136   10.714   87.033   18.386   78.104   13.184   44.193   5.2034   42.682   3.8299 1.510376 6.460979 
1 1 1   17    6   64 o   31.352   4.4763   43.263   11.115   34.035   15.513   52.998   15.934   26.399   7.0686   33.846   5.9948 -7.446749 9.268363 
1 1 1   17    6   65 o   18.408   6.0545   15.381   10.513   13.768   14.725   17.058   15.016   18.453   7.0424   19.644   7.1878 -1.191107 10.06285 
1 1 1   17    6   66 f   12.402   5.4309  -0.3249   10.469 -13.6918   14.466   14.377   15.171   11.781   5.5901   18.686   7.1440 -6.905034 9.071150 
1 1 1   17    6   67 o   58.200   2.3469  140.951   11.111  133.233   17.551  146.113   14.354   55.589   3.8980   58.878   3.0008 -3.288055 4.919214 
1 1 1   17    6   68 o   14.452   5.5162   7.6311   9.0347   0.7170   14.548   11.972   11.527   14.511   6.3766   16.941   6.2805 -2.430209 8.950225 
1 1 1   17    6   69 o   39.978   3.0706   67.879   9.9297   64.526   15.586   70.170   12.883   37.598   5.2264   40.105   3.9938 -2.506886 6.577686 
1 1 1   17    6   70 o   32.842   3.9250   47.244   10.300   56.103   18.843   43.469   12.300   33.399   7.1378   30.797   5.0761 2.601248 8.758718 
1 1 1   17    6   71 o   16.863   6.0439   12.664   10.545   30.844   18.170   3.4307   12.949   23.987   7.9624   14.384   6.1689 9.603472 10.07250 
1 1 1   17    6   72 o   19.173   6.1356   17.854   10.839   9.3642   18.415   22.355   13.408   17.470   7.4204   21.035   6.8324 -3.564585 10.08681 
1 1 1   17    6   73 o   38.636   4.0683   66.169   12.621   52.278   25.311   70.766   14.560   29.132   9.3811   39.536   4.6038 -10.40389 10.44986 
1 1 1   17    6   74 o   38.758   4.1021   66.930   12.764   62.766   25.570   68.312   14.730   32.023   9.2680   38.590   4.7850 -6.567551 10.43040 
1 1 1   17    6   75 o   20.038   6.4820   20.511   12.075   0.0086   23.556   27.819   14.064   16.596   7.6237   22.896   6.9375 -6.300421 10.30772 
1 1 1   17    6   76 f   10.503   4.9630  -8.9342   11.176   9.8960   23.807 -14.2563   12.657   18.129   8.0528   10.425   5.0218 7.704386 9.490325 
1 1 1   17    6   77 o   22.658   6.2824   26.590   12.007   48.214   25.545   20.458   13.604   26.742   9.4248   19.701   6.8827 7.040783 11.67040 
1 1 1   17    6   78 o   12.711   5.6207   0.9797   11.470 -20.2109   22.952   8.0339   13.243   13.608   6.6047   15.258   6.3754 -1.650107 9.179741 
1 1 1   17    6   79 o   14.144   5.7636   7.1850   10.465   32.488   17.536  -6.8099   13.041   23.259   7.8241   11.675   5.4677 11.58454 9.545280 
1 1 1   17    6   80 o   11.352   5.1350  -1.6128   10.174 -16.5840   16.797   7.0631   12.787   11.758   5.6935   14.676   6.2062 -2.917677 8.422129 
1 1 1   17    6   81 o   18.602   6.8696   18.880   13.767   12.564   17.114   30.461   23.174   16.916   7.1680   21.393   8.6281 -4.477217 11.21710 
1 1 1   17    6   82 o   16.587   6.6565   13.219   13.721   19.391   17.241   2.5584   22.660   18.639   7.4680   15.913   7.3694 2.725716 10.49184 
1 1 1   17    6   83 o   16.842   6.3717   14.485   11.989   14.485   11.989   0.0000   0.0000   16.842   6.3717  ?   ?  0.000000 6.371679 
1 1 1   17    6   84 o   15.930   6.2709   12.119   11.953   12.119   11.953   0.0000   0.0000   15.930   6.2709  ?   ?  0.000000 6.270949 
1 1 1   17    6   85 o   12.481   5.7222  -1.6816   13.181  -1.6816   13.181   0.0000   0.0000   12.481   5.7222  ?   ?  0.000000 5.722165 
1 1 1   17    6   86 o   18.550   6.9157   19.763   14.014   19.763   14.014   0.0000   0.0000   18.550   6.9157  ?   ?  0.000000 6.915723 
1 1 1   17    6   87 o   15.065   6.4221   8.8588   13.881   8.8588   13.881   0.0000   0.0000   15.065   6.4221  ?   ?  0.000000 6.422149 
1 1 1   17    6   88 o   18.732   7.4358   21.284   16.936   21.284   16.936   0.0000   0.0000   18.732   7.4358  ?   ?  0.000000 7.435839 
1 1 1   17    6   89 o   17.889   6.9478   18.421   14.510   18.421   14.510   0.0000   0.0000   17.889   6.9478  ?   ?  0.000000 6.947783 
1 1 1   17    6   90 o   21.855   7.3079   30.062   15.300   30.062   15.300   0.0000   0.0000   21.855   7.3079  ?   ?  0.000000 7.307878 
1 1 1   17    6   91 o   20.256   7.2298   25.844   15.073   25.844   15.073   0.0000   0.0000   20.256   7.2298  ?   ?  0.000000 7.229787 
1 1 1   17    6   92 o   23.443   7.1331   33.921   14.847   33.921   14.847   0.0000   0.0000   23.443   7.1331  ?   ?  0.000000 7.133113 
1 1 1   17    6   93 o   11.332   5.3980  -8.1260   13.752  -8.1260   13.752   0.0000   0.0000   11.332   5.3980  ?   ?  0.000000 5.397963 
1 1 1   17    6   94 o   16.780   6.8139   15.834   14.566   15.834   14.566   0.0000   0.0000   16.780   6.8139  ?   ?  0.000000 6.813929 
1 1 1   17    6   95 o   11.419   5.4404  -7.7988   13.983  -7.7988   13.983   0.0000   0.0000   11.419   5.4404  ?   ?  0.000000 5.440442 
1 1 1   17    6   96 o   15.684   7.3446   6.1047   23.518   6.1047   23.518   0.0000   0.0000   15.684   7.3446  ?   ?  0.000000 7.344637 
1 1 1   17    6   97 o   15.783   6.9403   11.203   17.259   7.1939   24.508   15.147   24.308   15.982   7.4883   17.083   7.8087 -1.100864 10.81901 
1 1 1   17    7  -93 o   27.316   9.4980   64.198   25.889   64.198   25.889   0.0000   0.0000   27.316   9.4980  ?   ?  0.000000 9.498030 
1 1 1   17    7  -92 o   18.492   8.1290   24.432   23.661   24.432   23.661   0.0000   0.0000   18.492   8.1290  ?   ?  0.000000 8.129028 
1 1 1   17    7  -91 o   14.995   7.0833   2.2660   22.731   2.2660   22.731   0.0000   0.0000   14.995   7.0833  ?   ?  0.000000 7.083330 
1 1 1   17    7  -90 o   17.618   7.8410   19.091   22.681   19.091   22.681   0.0000   0.0000   17.618   7.8410  ?   ?  0.000000 7.840961 
1 1 1   17    7  -89 o   13.561   6.5463  -9.2379   21.784  -9.2379   21.784   0.0000   0.0000   13.561   6.5463  ?   ?  0.000000 6.546256 
1 1 1   17    7  -88 o   17.705   7.9822   18.326   24.347   18.326   24.347   0.0000   0.0000   17.705   7.9822  ?   ?  0.000000 7.982192 
1 1 1   17    7  -87 o   18.966   8.3094   25.239   24.538   25.239   24.538   0.0000   0.0000   18.966   8.3094  ?   ?  0.000000 8.309424 
1 1 1   17    7  -86 o   22.146   8.8951   39.922   24.523   39.922   24.523   0.0000   0.0000   22.146   8.8951  ?   ?  0.000000 8.895059 
1 1 1   17    7  -85 o   21.943   8.8291   38.206   24.206   38.206   24.206   0.0000   0.0000   21.943   8.8291  ?   ?  0.000000 8.829072 
1 1 1   17    7  -84 o   17.505   7.9387   15.056   24.503   15.056   24.503   0.0000   0.0000   17.505   7.9387  ?   ?  0.000000 7.938663 
1 1 1   17    7  -83 o   17.786   7.9551   16.733   23.650   16.733   23.650   0.0000   0.0000   17.786   7.9551  ?   ?  0.000000 7.955064 
1 1 1   17    7  -82 o   11.474   5.5681 -15.3378   16.295 -15.3378   16.295   0.0000   0.0000   11.474   5.5681  ?   ?  0.000000 5.568099 
1 1 1   17    7  -81 o   16.359   7.0552   11.738   17.117   11.738   17.117   0.0000   0.0000   16.359   7.0552  ?   ?  0.000000 7.055225 
1 1 1   17    7  -80 o   20.648   7.5779   26.549   16.709   26.549   16.709   0.0000   0.0000   20.648   7.5779  ?   ?  0.000000 7.577879 
1 1 1   17    7  -79 o   18.256   7.2927   18.620   16.391   18.620   16.391   0.0000   0.0000   18.256   7.2927  ?   ?  0.000000 7.292746 
1 1 1   17    7  -78 o   17.019   7.0756   14.060   16.192   14.060   16.192   0.0000   0.0000   17.019   7.0756  ?   ?  0.000000 7.075612 
1 1 1   17    7  -77 o   37.645   4.0636   64.969   12.272   59.739   17.926   69.584   16.837   32.903   6.9040   37.050   5.7621 -4.146561 8.992565 
1 1 1   17    7  -76 o   16.117   6.4854   11.861   13.061  -1.8581   26.735   16.162   14.969   16.164   7.6494   17.671   6.9985 -1.506950 10.36787 
1 1 1   17    7  -75 o   12.141   5.4090   0.3174   10.824   7.0546   16.027  -5.3317   14.676   15.476   6.7493   12.552   5.8529 2.923321 8.933647 
1 1 1   17    7  -74 o   16.770   6.1944   13.775   11.195   17.217   16.629   10.923   15.139   18.328   7.3375   16.371   6.8268 1.957087 10.02215 
1 1 1   17    7  -73 o   29.699   5.0841   42.203   11.866   22.197   17.566   58.994   16.092   19.995   7.6765   34.305   5.9716 -14.30977 9.725715 
1 1 1   17    7  -72 o   19.032   6.2159   18.512   11.090   31.204   16.434   7.8989   15.027   23.422   7.5606   15.764   6.6997 7.657785 10.10192 
1 1 1   17    7  -71 o   8.3305   3.9753  -8.2692   7.5269   2.0386   15.593 -11.4007   8.5945   14.617   6.5034   8.4890   4.1013 6.127640 7.688634 
1 1 1   17    7  -70 o   12.229   4.8249   4.9566   7.0905   7.6861   11.362   3.2158   9.0742   14.835   6.0203   12.446   5.2438 2.388865 7.983784 
1 1 1   17    7  -69 o   28.347   3.4017   35.086   7.7036   26.754   12.197   40.617   9.9365   22.931   6.3217   30.053   4.1682 -7.121588 7.572124 
1 1 1   17    7  -68 o   15.175   5.0202   10.459   7.2247   6.7214   11.626   12.811   9.2214   14.719   6.0453   16.605   5.6729 -1.886009 8.290240 
1 1 1   17    7  -67 o   12.004   4.9471   3.3735   7.8203  -6.1019   15.789   6.4539   9.0022   13.361   6.1750   13.753   5.4334 -0.3920059 8.225176 
1 1 1   17    7  -66 o   16.775   5.4923   13.009   8.6556  -1.2430   20.806   15.992   9.5183   16.052   7.2938   18.328   5.7353 -2.276178 9.278596 
1 1 1   17    7  -65 o   9.1383   4.1931  -3.9639   7.0977   0.0113   11.367  -6.5041   9.0868   12.789   5.6278   9.8989   4.6123 2.890252 7.276352 
1 1 1   17    7  -64 f   42.914   2.4244   77.067   8.4463   62.652   13.105   87.309   11.047   37.601   4.3561   45.376   3.0034 -7.774761 5.291172 
1 1 1   17    7  -63 o   9.8204   4.3440  -1.2346   6.8570   6.5626   10.490  -7.0526   9.0610   14.523   5.8231   9.8016   4.5798 4.721793 7.408281 
1 1 1   17    7  -62 o   15.219   4.9901   10.181   7.1441   1.4328   10.826   16.929   9.5080   13.033   5.6158   19.020   5.6913 -5.986708 7.995491 
1 1 1   17    7  -61 o   25.097   3.7264   27.419   7.3923   15.421   11.338   36.290   9.7495   18.414   6.2904   28.660   4.3062 -10.24559 7.623185 
1 1 1   17    7  -60 o   10.367   4.5652  -1.0719   7.4925  -2.5013   11.191   0.0891   10.086   12.216   5.4674   12.309   5.3616 -0.9339428E-01 7.657570 
1 1 1   17    7  -59 f   10.997   4.6684   1.0946   7.2821  -2.5159   11.452   3.5458   9.4356   12.376   5.5354   13.105   5.4206 -0.7288780 7.747498 
1 1 1   17    7  -58 o   35.450   2.9099   52.929   8.3347   47.061   13.904   56.220   10.413   32.130   5.5069   36.255   3.5697 -4.125385 6.562679 
1 1 1   17    7  -57 o   47.292   2.6206   93.364   10.063   99.737   14.919   88.045   13.630   48.253   3.8241   45.382   3.7171 2.871403 5.332947 
1 1 1   17    7  -56 o   14.864   5.3915   8.6685   8.4220   18.515   12.630   0.7843   11.301   20.062   6.6377   13.227   5.7186 6.835518 8.761360 
1 1 1   17    7  -55 o   45.094   2.6830   84.928   9.8174   92.405   14.665   78.855   13.216   46.430   3.9111   42.920   3.8172 3.510323 5.465162 
1 1 1   17    7  -54 o   52.921   2.1537  115.864   9.2714  119.801   15.356  113.605   11.631   53.139   3.5658   52.161   2.7450 0.9775543 4.499983 
1 1 1   17    7  -53 f   18.969   4.9309   16.237   7.6937   22.133   12.895   12.978   9.5873   21.735   6.6544   17.274   5.7850 4.461365 8.817438 
1 1 1   17    7  -52 o   29.715   3.3469   37.510   7.9660   36.415   13.198   38.138   9.9911   28.135   5.9414   29.607   4.2626 -1.471684 7.312323 
1 1 1   17    7  -51 o   39.548   2.6377   65.196   8.4546   59.841   13.981   68.284   10.616   36.980   4.7473   40.245   3.2639 -3.264633 5.761055 
1 1 1   17    7  -50 o   14.710   5.2841   8.4017   8.0656   22.840   12.554  -1.7488   10.526   22.173   6.5158   12.195   5.3889 9.977510 8.455526 
1 1 1   17    7  -49 o   27.943   4.0056   33.677   8.8631   44.197   15.424   28.490   10.830   30.980   6.3218   25.107   5.4485 5.873732 8.345716 
1 1 1   17    7  -48 o   16.532   5.4547   11.666   8.5311  -8.7615   14.777   21.878   10.448   12.993   5.9939   21.904   5.7717 -8.910981 8.321012 
1 1 1   17    7  -47 o   14.273   5.1732   7.6517   7.7518   2.2005   14.653   9.7701   9.1347   15.361   6.5747   15.760   5.6278 -0.3988409 8.654453 
1 1 1   17    7  -46 o   33.211   3.2282   46.410   8.6293   61.632   16.482   40.662   10.128   37.267   5.5985   30.752   4.1461 6.515493 6.966537 
1 1 1   17    7  -45 o   52.599   2.1532  114.089   9.2125  123.244   15.471  109.060   11.467   54.154   3.5239   51.234   2.7559 2.919533 4.473580 
1 1 1   17    7  -44 o   18.718   4.9164   15.551   7.5966   25.655   13.386   10.752   9.2262   23.614   6.6649   16.303   5.6700 7.310734 8.750400 
1 1 1   17    7  -43 o   16.362   5.0785   11.544   7.4794   15.413   13.069   9.6603   9.1209   19.238   6.7443   15.768   5.6244 3.469626 8.781717 
1 1 1   17    7  -42 o   27.821   3.6084   32.860   7.9906   48.012   14.009   25.553   9.7284   33.023   5.3900   24.006   5.1273 9.016659 7.439133 
1 1 1   17    7  -41 o   34.802   3.5531   51.056   9.9385   47.245   20.476   52.231   11.367   31.585   7.9578   35.033   4.0554 -3.447430 8.931516 
1 1 1   17    7  -40 o   39.465   2.8918   64.799   9.2381   70.559   20.291   63.293   10.376   39.673   6.4994   38.880   3.3051 0.7929688 7.291472 
1 1 1   17    7  -39 o   44.328   2.6804   81.411   9.6401   80.229   20.809   81.734   10.878   42.574   6.1761   44.316   3.0294 -1.742043 6.879048 
1 1 1   17    7  -38 o   66.816   1.8825  183.229   10.243  171.344   16.635  190.486   13.000   64.195   3.1890   67.997   2.3489 -3.802704 3.960703 
1 1 1   17    7  -37 o   27.761   3.7460   32.686   8.2609   31.313   15.435   33.237   9.7793   26.173   7.0695   27.779   4.4704 -1.605499 8.364402 
1 1 1   17    7  -36 o   42.222   2.5331   73.672   8.6782   73.566   14.714   73.729   10.746   41.624   4.4033   42.080   3.1559 -0.4558258 5.417393 
1 1 1   17    7  -35 o   48.114   2.2949   95.345   8.9747  106.011   15.331   89.785   11.070   50.310   3.7657   46.532   2.9333 3.777973 4.773356 
1 1 1   17    7  -34 o   32.902   3.2184   45.225   8.5216   31.166   16.013   50.779   10.065   26.183   7.2533   34.780   3.6024 -8.597187 8.098590 
1 1 1   17    7  -33 o   50.180   2.5539  103.883   10.412  115.704   17.777   97.710   12.846   52.447   4.1930   48.475   3.2702 3.972023 5.317480 
1 1 1   17    7  -32 o   53.080   2.1981  115.827   9.4901  109.487   17.732  118.372   11.235   50.985   4.3068   53.575   2.5801 -2.589268 5.020476 
1 1 1   17    7  -31 o   12.678   5.1740   2.8982   8.4485   18.677   15.393  -3.9047   10.107   21.267   7.3273   11.571   5.1859 9.696281 8.976801 
1 1 1   17    7  -30 o   72.784   1.8287  217.026   10.841  207.118   18.029  222.637   13.567   70.749   3.1340   73.619   2.2635 -2.869713 3.865945 
1 1 1   17    7  -29 o   28.433   3.5992   34.014   8.1553   28.638   14.474   36.515   9.8714   25.299   6.8511   29.302   4.2572 -4.003157 8.066096 
1 1 1   17    7  -28 o   24.219   4.0868   25.039   7.7811   15.133   13.636   29.823   9.4753   19.596   6.8875   26.350   4.5774 -6.754679 8.269839 
1 1 1   17    7  -27 o   21.790   4.5710   20.552   7.8594   12.996   13.581   24.357   9.6371   18.777   6.8412   23.631   5.1488 -4.854242 8.562279 
1 1 1   17    7  -26 o   19.082   5.0423   15.841   7.9596   24.243   13.814   11.665   9.7388   23.449   6.8196   17.121   5.8303 6.328842 8.972149 
1 1 1   17    7  -25 o   43.615   3.1182   78.806   11.013   76.846   15.415   80.848   15.739   42.697   4.4965   43.814   4.4694 -1.116898 6.339823 
1 1 1   17    7  -24 o   24.771   5.9818   27.025   11.941   34.388   14.405   10.853   21.348   27.863   6.4671   20.614   8.2926 7.249474 10.51623 
1 1 1   17    7  -23 o   20.723   6.3673   18.427   11.793   10.561   14.179   36.079   21.239   18.143   6.9138   28.332   8.5128 -10.18895 10.96672 
1 1 1   17    7  -22 o   18.469   6.4290   13.305   11.863   13.748   14.362   12.354   21.048   19.345   7.0371   20.944   8.2975 -1.599802 10.87974 
1 1 1   17    7  -21 o   65.043   2.3462  173.666   12.419  179.582   17.793  168.047   17.342   65.908   3.3226   63.744   3.3493 2.164494 4.717771 
1 1 1   17    7  -20 o   34.156   4.3012   49.186   11.710   32.574   20.734   56.968   14.191   27.160   8.4595   36.635   4.8726 -9.475069 9.762399 
1 1 1   17    7  -19 o   82.676   1.8930  279.621   12.757  297.497   20.093  267.549   16.512   85.018   2.9037   80.720   2.5126 4.297806 3.839816 
1 1 1   17    7  -18 o   83.497   1.7885  285.065   12.173  288.738   20.185  282.966   15.261   83.747   2.9614   83.079   2.2555 0.6678696 3.722567 
1 1 1   17    7  -17 o   51.390   2.2988  108.414   9.6053  108.829   16.712  108.210   11.738   51.109   4.0442   51.249   2.8206 -0.1398735 4.930680 
1 1 1   17    7  -16 o   43.724   2.5814   78.693   9.1598   97.005   16.222   70.122   11.098   48.209   4.1690   41.125   3.3393 7.084019 5.341479 
1 1 1   17    7  -15 o   65.343   1.9921  174.842   10.598  153.069   17.892  186.611   13.154   60.797   3.6268   67.438   2.3967 -6.640842 4.347172 
1 1 1   17    7  -14 o   32.758   3.3228   44.630   8.7501   34.950   15.245   49.385   10.685   28.151   6.7342   34.357   3.8834 -6.205860 7.773660 
1 1 1   17    7  -13 o   31.202   3.7915   40.775   9.4456   47.127   15.538   37.052   11.896   32.991   5.9987   29.391   5.1532 3.600771 7.908213 
1 1 1   17    7  -12 o   11.743   4.9868   0.3931   8.3134  -6.5482   12.349   6.1458   11.242   12.433   5.6374   15.464   6.0834 -3.030639 8.293818 
1 1 1   17    7  -11 o   17.589   5.4323   12.961   8.5703   1.3172   12.663   22.803   11.642   14.614   6.1778   22.869   6.1233 -8.255363 8.698297 
1 1 1   17    7  -10 o  127.333   1.6773  662.501   17.410  655.294   23.871  670.690   25.447  126.495   2.3150  127.938   2.4400 -1.443405 3.363476 
1 1 1   17    7   -9 o  147.333   1.5701  886.663   18.856  907.816   27.916  868.914   25.572  148.893   2.3001  145.710   2.1529 3.182770 3.150510 
1 1 1   17    7   -8 o   39.098   2.8156   63.059   8.9134   52.980   14.093   69.780   11.508   35.330   5.0358   41.017   3.4744 -5.686661 6.118058 
1 1 1   17    7   -7 o   61.195   2.0768  153.381   10.345  140.923   16.816  160.966   13.121   58.375   3.5507   62.609   2.5765 -4.234913 4.386958 
1 1 1   17    7   -6 o   32.068   3.2759   42.734   8.4432   43.523   13.571   42.236   10.785   31.863   5.4189   31.665   4.2884 0.1983814 6.910422 
1 1 1   17    7   -5 o   19.083   5.1317   15.700   8.1550   15.090   13.024   16.093   10.459   19.604   6.7405   19.525   5.9960 0.7976532E-01 9.021466 
1 1 1   17    7   -4 o   44.714   2.6860   82.286   9.7450   78.796   17.822   83.774   11.639   43.188   5.1648   45.029   3.1916 -1.840858 6.071374 
1 1 1   17    7   -3 o   28.231   4.0270   33.571   9.0049   44.165   17.445   29.723   10.514   31.695   6.9447   26.291   5.0900 5.404182 8.610245 
1 1 1   17    7   -2 o   37.421   3.1437   57.954   9.5008   63.534   17.973   55.790   11.192   38.502   5.9157   36.579   3.8094 1.922272 7.036113 
1 1 1   17    7   -1 o   96.625   1.7727  381.558   13.962  377.404   20.097  385.433   19.412   95.921   2.5727   96.963   2.4579 -1.042419 3.558085 
1 1 1   17    7    0 o   13.513   5.2573   4.8787   8.3191   6.4320   13.690   3.9692   10.475   16.682   6.6645   14.313   5.7906 2.369128 8.828762 
1 1 1   17    7    1 o   43.882   2.5851   79.202   9.2058   76.152   14.828   81.115   11.743   42.676   4.3222   44.290   3.2758 -1.613865 5.423282 
1 1 1   17    7    2 o   41.453   2.9030   70.880   9.7471   71.564   17.815   70.588   11.645   41.048   5.4595   41.256   3.4955 -0.2083511 6.482618 
1 1 1   17    7    3 o   55.128   2.3539  124.682   10.553  111.419   18.666  130.914   12.795   51.656   4.4771   56.418   2.7908 -4.761932 5.275659 
1 1 1   17    7    4 o   95.952   1.8074  376.311   14.137  355.791   23.767  387.545   17.585   92.983   3.1403   97.305   2.2171 -4.321434 3.844033 
1 1 1   17    7    5 o   85.102   1.8681  296.075   12.959  309.450   22.726  289.630   15.776   86.686   3.2217   84.073   2.3041 2.612976 3.960880 
1 1 1   17    7    6 o   52.889   2.3547  114.783   10.126  118.926   17.319  112.631   12.482   53.502   4.0002   52.291   2.9402 1.211273 4.964477 
1 1 1   17    7    7 o   34.250   3.3276   48.716   9.1732   65.490   15.802   40.190   11.266   39.350   5.0422   30.791   4.6319 8.558889 6.846761 
1 1 1   17    7    8 o   45.418   2.6472   84.878   9.7581   97.432   16.768   78.450   11.999   48.317   4.3024   43.520   3.4096 4.797428 5.489617 
1 1 1   17    7    9 o   48.244   2.5847   95.694   10.128  111.346   18.679   89.178   12.053   51.624   4.4833   46.457   3.2023 5.166790 5.509528 
1 1 1   17    7   10 o   13.510   5.2904   4.6976   8.4690   5.0894   14.435   4.4919   10.458   16.582   6.7647   14.483   5.8118 2.099673 8.918392 
1 1 1   17    7   11 o   26.026   4.1991   28.723   8.6053   30.200   14.480   27.916   10.700   26.197   6.7415   25.394   5.3387 0.8028278 8.599417 
1 1 1   17    7   12 o   40.678   2.7839   68.232   9.1753   83.163   15.390   59.999   11.429   44.602   4.2856   37.947   3.7433 6.654106 5.690259 
1 1 1   17    7   13 o   44.937   2.6266   83.107   9.5794   93.419   16.207   77.571   11.876   47.299   4.2488   43.266   3.3945 4.032990 5.438265 
1 1 1   17    7   14 o   85.083   1.9834  296.141   13.756  312.366   20.368  282.535   18.652   87.160   2.8707   82.916   2.7635 4.244072 3.984730 
1 1 1   17    7   15 o   83.412   1.9994  284.658   13.595  286.596   20.005  282.995   18.531   83.459   2.9452   82.984   2.7433 0.4747162 4.024871 
1 1 1   17    7   16 o   36.863   3.3022   56.404   9.8176   51.113   14.177   61.279   13.609   34.613   5.1839   38.164   4.4585 -3.551437 6.837435 
1 1 1   17    7   17 o   94.350   1.8160  364.008   13.967  421.288   25.771  340.189   16.619  101.132   3.1299   91.134   2.2371 9.997116 3.847198 
1 1 1   17    7   18 o   63.556   2.0866  165.535   10.796  170.134   18.186  163.032   13.415   64.124   3.4924   62.975   2.6190 1.148678 4.365337 
1 1 1   17    7   19 o   22.064   4.8389   21.075   8.4628   27.575   14.697   17.850   10.351   25.002   6.9576   20.332   5.9004 4.669504 9.122650 
1 1 1   17    7   20 o   60.161   2.6923  148.929   13.169   0.0000   0.0000  148.929   13.169  ?   ?    60.161   2.6923 0.000000 2.692287 
1 1 1   17    7   21 o   65.673   2.0320  176.728   10.865  160.629   17.735  186.400   13.747   62.273   3.5080   67.354   2.5082 -5.080860 4.312410 
1 1 1   17    7   22 o   62.663   2.1457  161.037   10.944  168.643   19.348  157.458   13.271   63.732   3.7407   61.864   2.6377 1.867470 4.577141 
1 1 1   17    7   23 o   47.356   2.5572   92.335   9.8345   78.408   17.000   99.341   12.057   43.017   4.9374   49.026   3.0318 -6.009315 5.793983 
1 1 1   17    7   24 o   79.681   1.9118  259.860   12.417  309.812   22.467  237.888   14.900   86.624   3.1872   76.108   2.4048 10.51585 3.992643 
1 1 1   17    7   25 o   29.100   3.8806   35.709   8.9759   66.041   16.224   22.330   10.775   39.329   5.1870   22.542   5.8231 16.78743 7.798355 
1 1 1   17    7   26 o   96.185   1.9474  378.801   15.269  426.763   25.380  351.594   19.115  101.706   3.0648   92.486   2.5379 9.220825 3.979198 
1 1 1   17    7   27 o   28.995   3.8579   35.473   8.8923   59.938   16.055   24.647   10.680   37.325   5.4366   23.680   5.6181 13.64504 7.817885 
1 1 1   17    7   28 o   41.057   3.1058   69.932   10.317   52.651   16.718   80.561   13.112   34.672   6.1399   43.931   3.6957 -9.258881 7.166359 
1 1 1   17    7   29 o   13.918   5.7017   3.4015   10.308   13.972   15.134  -5.7477   14.080   19.540   7.2049   13.507   6.0817 6.032985 9.428601 
1 1 1   17    7   30 o   67.085   2.5065  185.241   13.683  203.324   20.064  169.520   18.708   69.956   3.5299   63.833   3.6100 6.123165 5.049001 
1 1 1   17    7   31 o   53.116   2.6788  116.430   11.561  131.244   18.443  106.841   14.838   55.964   4.0707   50.615   3.6203 5.348267 5.447609 
1 1 1   17    7   32 o   61.752   2.4147  156.962   12.132  168.437   19.688  149.939   15.403   63.513   3.8205   60.145   3.1528 3.368626 4.953421 
1 1 1   17    7   33 o   30.028   3.9425   38.189   9.4171   29.051   21.727   40.303   10.450   25.667   8.7089   30.760   4.2836 -5.093056 9.705332 
1 1 1   17    7   34 o   11.593   5.0309  -0.7823   8.8120   15.939   20.636  -4.5114   9.7452   21.492   8.3023   11.157   5.0382 10.33524 9.711419 
1 1 1   17    7   35 o   18.911   6.1160   15.212   10.751  -2.6636   21.377   21.263   12.438   17.386   7.6812   21.892   6.4994 -4.506004 10.06195 
1 1 1   17    7   36 o   35.310   3.1835   52.049   9.0648   61.483   16.819   48.187   10.762   37.516   5.6773   33.735   3.9906 3.780819 6.939537 
1 1 1   17    7   37 o   51.840   2.3585  110.778   9.9403  124.677   18.327  104.986   11.832   54.373   4.1668   50.319   2.8968 4.054348 5.074844 
1 1 1   17    7   38 o   61.086   2.1562  153.510   10.720  154.559   19.650  153.066   12.791   60.618   3.9992   60.875   2.5835 -0.2574234 4.761051 
1 1 1   17    7   39 o   16.966   5.4172   12.244   8.4530   2.0211   15.974   16.220   9.9623   16.073   6.8716   19.229   5.8415 -3.155996 9.018966 
1 1 1   17    7   40 o   26.522   4.0303   30.141   8.4393   61.199   15.987   18.142   9.9366   37.425   5.3961   20.191   5.7570 17.23403 7.890540 
1 1 1   17    7   41 o   18.809   5.5412   15.610   9.0694   9.1303   20.694   17.151   10.090   19.458   8.0361   19.668   5.8576 -0.2094898 9.944343 
1 1 1   17    7   42 o   59.481   2.1882  145.772   10.592  189.791   20.119  128.893   12.458   67.239   3.6847   55.751   2.7498 11.48838 4.597686 
1 1 1   17    7   43 o   72.882   1.9886  218.427   11.803  230.372   21.854  213.507   14.024   74.096   3.6292   71.913   2.3958 2.183403 4.348687 
1 1 1   17    7   44 o   40.413   2.8903   68.075   9.4588   88.020   17.432   59.753   11.261   45.157   4.8098   37.571   3.7258 7.586235 6.084047 
1 1 1   17    7   45 o   27.683   4.0008   32.914   8.7666   72.129   16.938   18.564   10.246   40.594   5.2408   20.309   5.8634 20.28510 7.864180 
1 1 1   17    7   46 o   52.400   2.6449  113.951   11.261  109.030   19.105  116.570   13.940   50.287   4.7156   52.758   3.2573 -2.471046 5.731230 
1 1 1   17    7   47 o   28.391   4.3176   34.945   9.6778   34.211   25.575   35.068   10.455   26.606   9.4254   28.293   4.6980 -1.687000 10.53138 
1 1 1   17    7   48 o   23.025   5.2188   23.831   9.5681   7.9231   23.030   27.150   10.519   19.556   8.3021   24.539   5.4051 -4.982302 9.906513 
1 1 1   17    7   49 o   47.230   3.6743   94.485   14.035  106.139   26.977   90.160   16.434   47.748   7.1509   45.723   4.4660 2.025005 8.430936 
1 1 1   17    7   50 o   39.729   3.3263   66.585   10.673   84.160   18.168   57.323   13.189   43.700   5.2022   36.307   4.5567 7.393715 6.915715 
1 1 1   17    7   51 o   16.687   5.7799   11.661   9.5827   42.929   16.463  -4.3596   11.785   30.140   6.8562   12.248   5.5347 17.89226 8.811378 
1 1 1   17    7   52 o   59.454   2.3854  146.536   11.537  148.350   19.543  145.566   14.293   58.870   4.0981   58.978   2.9828 -0.1086159 5.068657 
1 1 1   17    7   53 f   25.738   4.7807   29.490   9.6608   8.6899   16.644   40.058   11.864   17.625   7.2354   29.972   5.0342 -12.34773 8.814413 
1 1 1   17    7   54 o   31.080   3.9755   41.737   9.8417   40.490   17.023   42.363   12.062   28.882   7.2441   30.851   4.9648 -1.968512 8.782142 
1 1 1   17    7   55 o   41.896   3.0488   73.867   10.341   71.602   17.666   75.048   12.754   39.826   5.5956   41.885   3.7762 -2.058487 6.750578 
1 1 1   17    7   56 o   24.168   5.9660   27.292   11.681   0.0000   0.0000   27.292   11.681  ?   ?    24.168   5.9660 0.000000 5.965982 
1 1 1   17    7   57 o   35.295   3.5346   53.201   10.032   58.249   17.509   50.734   12.241   35.325   6.3123   33.973   4.5333 1.351711 7.771519 
1 1 1   17    7   58 o   19.449   5.6606   17.475   9.5141   36.603   16.461   7.8806   11.659   27.238   7.2761   15.597   6.1766 11.64077 9.544204 
1 1 1   17    7   59 f   30.732   4.1213   41.236   10.064   65.965   17.785   29.587   12.207   37.764   5.9762   25.031   6.0501 12.73235 8.504062 
1 1 1   17    7   60 o   24.240   5.0775   26.833   9.7109   15.371   16.726   32.661   11.927   19.290   7.4684   26.475   5.6956 -7.184757 9.392393 
1 1 1   17    7   61 o   32.067   3.9522   44.769   10.113   65.494   17.805   34.900   12.287   37.447   6.0385   27.346   5.6971 10.10141 8.301817 
1 1 1   17    7   62 o   14.255   5.6073   6.6875   9.5508   9.6286   16.487   5.2021   11.717   17.438   7.1844   14.581   6.0367 2.857014 9.383897 
1 1 1   17    7   63 o   19.875   5.7613   18.726   9.8739  -1.3542   16.642   29.635   12.266   14.838   6.6519   24.799   6.1085 -9.961417 9.031174 
1 1 1   17    7   64 f   24.745   5.2495   28.518   10.260   32.974   18.902   26.656   12.217   24.843   8.1153   23.344   6.2826 1.499350 10.26297 
1 1 1   17    7   65 o   15.512   5.9467   9.3802   10.530   5.9225   17.416   11.373   13.220   16.535   7.1238   16.921   6.6146 -0.3856907 9.721203 
1 1 1   17    7   66 o   26.450   6.5218   34.945   13.971   7.3909   18.464   71.853   21.369   17.072   7.3447   37.563   7.2416 -20.49077 10.31434 
1 1 1   17    7   67 o   17.287   6.6788   12.811   13.355   18.566   17.730   5.2613   20.306   19.724   7.6744   16.990   7.4972 2.733715 10.72870 
1 1 1   17    7   68 o   19.973   6.9346   20.202   13.798   22.404   18.699   17.570   20.445   20.789   7.9355   19.607   8.0307 1.182415 11.29001 
1 1 1   17    7   69 o   23.585   5.6905   27.258   10.813   20.571   17.918   31.089   13.562   20.061   7.7397   24.518   6.6284 -4.457113 10.19011 
1 1 1   17    7   70 o   21.857   6.0173   24.063   11.059   29.648   18.038   20.700   13.998   22.852   7.9291   19.952   6.9810 2.899714 10.56436 
1 1 1   17    7   71 o   44.700   3.4211   87.115   12.371   59.490   19.316  106.324   16.108   33.241   7.3266   48.740   4.0919 -15.49995 8.391850 
1 1 1   17    7   72 o   45.868   3.3474   91.670   12.429   89.866   19.225   92.965   16.292   43.042   5.6131   45.059   4.4957 -2.016827 7.191511 
1 1 1   17    7   73 o   13.151   5.6331   3.6100   10.772   2.8687   17.405   4.0702   13.713   15.151   6.7968   14.318   6.2437 0.8337717 9.229366 
1 1 1   17    7   74 o   26.118   5.3892   33.642   11.093   44.047   17.668   26.872   14.252   27.546   7.6143   21.877   7.0390 5.669455 10.36937 
1 1 1   17    7   75 o   8.6538   4.2495 -16.9208   10.335 -25.0802   15.934 -10.9962   13.578   10.475   5.1692   11.169   5.3323 -0.6940260 7.426583 
1 1 1   17    7   76 o   12.441   5.4310   2.2587   10.399  -7.3514   16.414   8.7031   13.441   12.809   6.0409   15.229   6.3971 -2.419901 8.798611 
1 1 1   17    7   77 o   15.944   6.9201   9.1891   16.680   9.1891   16.680   0.0000   0.0000   15.944   6.9201  ?   ?  0.000000 6.920118 
1 1 1   17    7   78 o   16.264   7.5425   4.1446   23.860   4.1446   23.860   0.0000   0.0000   16.264   7.5425  ?   ?  0.000000 7.542515 
1 1 1   17    7   80 o   19.640   8.4796   24.997   24.780   24.997   24.780   0.0000   0.0000   19.640   8.4796  ?   ?  0.000000 8.479614 
1 1 1   17    7   81 o   19.199   8.4089   23.371   25.109   23.371   25.109   0.0000   0.0000   19.199   8.4089  ?   ?  0.000000 8.408875 
1 1 1   17    7   82 o   13.013   6.4126 -24.4113   24.225 -24.4113   24.225   0.0000   0.0000   13.013   6.4126  ?   ?  0.000000 6.412603 
1 1 1   17    7   83 o   12.211   6.0866 -34.7468   24.296 -34.7468   24.296   0.0000   0.0000   12.211   6.0866  ?   ?  0.000000 6.086566 
1 1 1   17    7   84 o   17.818   8.1376   16.371   26.320   16.371   26.320   0.0000   0.0000   17.818   8.1376  ?   ?  0.000000 8.137620 
1 1 1   17    7   85 o   14.706   7.0663  -6.1390   24.696  -6.1390   24.696   0.0000   0.0000   14.706   7.0663  ?   ?  0.000000 7.066321 
1 1 1   17    7   86 o   11.080   5.6023 -53.4775   24.641 -53.4775   24.641   0.0000   0.0000   11.080   5.6023  ?   ?  0.000000 5.602253 
1 1 1   17    7   87 o   12.881   6.3499 -22.4159   23.821 -22.4159   23.821   0.0000   0.0000   12.881   6.3499  ?   ?  0.000000 6.349888 
1 1 1   17    7   88 o   16.491   7.6731   9.8338   25.010   9.8338   25.010   0.0000   0.0000   16.491   7.6731  ?   ?  0.000000 7.673084 
1 1 1   17    7   90 o   16.050   7.4911   8.3529   24.138   8.3529   24.138   0.0000   0.0000   16.050   7.4911  ?   ?  0.000000 7.491135 
1 1 1   17    7   91 o   15.628   7.3665   5.4957   24.347   5.4957   24.347   0.0000   0.0000   15.628   7.3665  ?   ?  0.000000 7.366457 
1 1 1   17    7   92 o   15.764   7.3872   6.9240   23.865   6.9240   23.865   0.0000   0.0000   15.764   7.3872  ?   ?  0.000000 7.387199 
1 1 1   17    7   93 o   12.445   6.1848 -27.8368   24.335 -27.8368   24.335   0.0000   0.0000   12.445   6.1848  ?   ?  0.000000 6.184827 
1 1 1   17    8  -89 o   19.981   8.4194   32.119   23.397   32.119   23.397   0.0000   0.0000   19.981   8.4194  ?   ?  0.000000 8.419401 
1 1 1   17    8  -88 o   13.016   6.3766 -15.7680   22.845 -15.7680   22.845   0.0000   0.0000   13.016   6.3766  ?   ?  0.000000 6.376597 
1 1 1   17    8  -87 o   11.673   5.8280 -31.9683   22.676 -31.9683   22.676   0.0000   0.0000   11.673   5.8280  ?   ?  0.000000 5.828036 
1 1 1   17    8  -86 o   11.859   5.8664 -23.7030   20.957 -23.7030   20.957   0.0000   0.0000   11.859   5.8664  ?   ?  0.000000 5.866404 
1 1 1   17    8  -85 o   15.567   7.1663   7.8912   20.967   7.8912   20.967   0.0000   0.0000   15.567   7.1663  ?   ?  0.000000 7.166314 
1 1 1   17    8  -84 o   17.052   7.5360   16.160   20.592   16.160   20.592   0.0000   0.0000   17.052   7.5360  ?   ?  0.000000 7.536004 
1 1 1   17    8  -83 o   14.585   6.8409   1.0098   20.545   1.0098   20.545   0.0000   0.0000   14.585   6.8409  ?   ?  0.000000 6.840872 
1 1 1   17    8  -82 o   20.896   8.4221   33.427   22.066   33.427   22.066   0.0000   0.0000   20.896   8.4221  ?   ?  0.000000 8.422050 
1 1 1   17    8  -81 o   16.669   7.5574   12.302   22.187   12.302   22.187   0.0000   0.0000   16.669   7.5574  ?   ?  0.000000 7.557441 
1 1 1   17    8  -80 o   15.212   7.1094   2.6584   21.857   2.6584   21.857   0.0000   0.0000   15.212   7.1094  ?   ?  0.000000 7.109383 
1 1 1   17    8  -79 o   12.079   5.7272  -7.1513   15.124  -4.3535   21.694  -9.7969   21.096   14.307   6.8054   13.518   6.5046 0.7892084 9.413977 
1 1 1   17    8  -78 o   19.618   7.1544   23.625   14.858   22.532   21.860   24.562   20.255   18.766   8.0311   19.292   7.9572 -0.5258389 11.30557 
1 1 1   17    8  -77 o   12.135   5.6866  -4.8817   14.137 -12.2760   20.464   1.8697   19.554   13.138   6.3429   14.793   6.8490 -1.654517 9.334905 
1 1 1   17    8  -76 o   14.900   6.4579   7.7092   14.483  -3.4208   21.390   17.130   19.680   14.505   6.8575   17.751   7.6089 -3.246483 10.24306 
1 1 1   17    8  -75 o   18.645   6.6019   19.569   12.546   25.777   16.289   10.516   19.671   20.383   7.4819   16.471   7.3179 3.911997 10.46565 
1 1 1   17    8  -74 o   17.704   6.5445   17.042   12.500   27.075   16.318   2.7945   19.446   20.902   7.5150   15.106   6.9346 5.796161 10.22570 
1 1 1   17    8  -73 o   32.557   5.2899   52.629   13.557   39.271   17.774   71.213   20.965   24.937   7.8422   34.815   7.6010 -9.877262 10.92129 
1 1 1   17    8  -72 o   17.125   6.4584   15.282   12.296   10.675   15.732   22.515   19.712   16.074   6.8441   19.349   7.9006 -3.274515 10.45275 
1 1 1   17    8  -71 o   10.923   5.0737  -4.7441   10.864   3.2891   15.347 -12.8131   15.381   14.333   6.4095   11.599   5.5741 2.733808 8.494258 
1 1 1   17    8  -70 o   13.057   5.2436   6.1906   8.5203   6.1707   15.856   6.1987   10.103   15.157   6.6590   13.572   5.6109 1.585540 8.707727 
1 1 1   17    8  -69 o   15.635   5.4765   11.763   8.6160   35.258   16.377   2.7718   10.131   24.480   7.5003   12.537   5.4174 11.94297 9.252168 
1 1 1   17    8  -68 o   18.261   5.5174   16.741   8.9044   6.0839   16.195   21.359   10.660   15.415   6.7523   20.271   6.0168 -4.855860 9.044104 
1 1 1   17    8  -67 o   16.887   5.2767   13.898   8.0602   18.576   11.931   9.9695   10.932   18.903   6.4530   15.351   6.0108 3.552958 8.818745 
1 1 1   17    8  -66 o   20.841   4.9042   20.802   8.1916   20.369   12.005   21.178   11.205   19.767   6.4682   20.258   6.2034 -0.4908714 8.962111 
1 1 1   17    8  -65 o   10.937   4.8215  -0.2028   8.3794   2.2093   13.262  -1.8057   10.811   13.835   6.0837   11.796   5.3186 2.039164 8.080812 
1 1 1   17    8  -64 o   24.541   4.4330   27.711   8.5417   22.920   12.612   31.771   11.610   20.983   6.6069   25.390   5.7442 -4.406717 8.754830 
1 1 1   17    8  -63 o   38.215   2.9615   62.541   9.1532   55.882   13.615   68.034   12.365   34.671   4.9584   39.174   3.9249 -4.502949 6.323807 
1 1 1   17    8  -62 o   27.091   4.0704   32.885   8.7111   21.032   13.219   41.985   11.582   20.296   6.7927   30.114   4.8854 -9.818420 8.367053 
1 1 1   17    8  -61 o   29.818   3.4975   38.758   8.3397   28.936   13.753   44.469   10.488   23.709   6.7772   31.547   4.1813 -7.837946 7.963307 
1 1 1   17    8  -60 o   28.155   4.1826   35.421   9.3080   17.316   13.240   53.114   13.088   18.981   6.7758   34.104   4.8441 -15.12299 8.329247 
1 1 1   17    8  -59 f   25.888   4.6022   30.477   9.3560   36.399   13.605   25.164   12.886   27.237   6.2594   22.394   6.6072 4.843315 9.101396 
1 1 1   17    8  -58 f   17.464   5.6090   14.179   9.0526   25.602   13.171   3.9493   12.463   22.631   6.6803   14.371   6.1043 8.260225 9.049250 
1 1 1   17    8  -57 o   38.530   2.6335   62.451   8.2215   58.391   12.542   65.510   10.887   36.320   4.3208   39.037   3.4570 -2.716942 5.533579 
1 1 1   17    8  -56 o   22.648   4.2994   22.984   7.6473   24.592   11.790   21.816   10.047   22.529   6.2174   21.454   5.6631 1.074640 8.409916 
1 1 1   17    8  -55 o   10.836   4.6676   0.4400   7.4743  -4.2057   11.429   3.9112   9.8795   11.891   5.4042   13.368   5.5397 -1.477217 7.739102 
1 1 1   17    8  -54 o   16.030   5.1524   11.454   7.6375   4.7943   11.701   16.396   10.081   14.477   6.0165   18.779   5.9061 -4.302158 8.430893 
1 1 1   17    8  -53 o   18.771   4.9169   16.118   7.6117   8.2600   11.600   22.060   10.087   15.633   6.1704   21.696   5.6490 -6.062668 8.365688 
1 1 1   17    8  -52 f   19.507   4.9956   17.414   7.9775   14.647   13.528   18.889   9.8777   18.489   6.8130   20.116   5.7413 -1.626156 8.909570 
1 1 1   17    8  -51 o   10.548   4.6486  -1.1816   7.7829  -5.7623   13.470   1.1143   9.5359   12.711   5.8112   12.348   5.2948 0.3627434 7.861644 
1 1 1   17    8  -50 o   30.803   3.3840   40.503   8.3573   55.307   14.451   33.063   10.244   35.072   5.2129   27.184   4.7985 7.888836 7.085206 
1 1 1   17    8  -49 o   28.588   3.6437   35.166   8.2985   35.677   13.785   34.876   10.393   27.494   6.2879   27.991   4.7228 -0.4967136 7.863965 
1 1 1   17    8  -48 o   23.220   4.3273   23.854   7.8893   37.439   13.783   17.233   9.6213   28.284   6.1534   19.362   5.7082 8.922686 8.393326 
1 1 1   17    8  -47 o   25.591   3.9434   28.485   7.9623   32.881   13.463   26.121   9.8741   26.394   6.3378   23.967   5.2037 2.427238 8.200395 
1 1 1   17    8  -46 o   43.326   2.7090   78.440   9.5198   78.701   15.286   78.275   12.167   42.516   4.4778   42.928   3.5077 -0.4111176 5.688132 
1 1 1   17    8  -45 o   19.208   5.3337   16.791   8.6475   9.8547   18.973   18.610   9.7153   18.589   7.6875   20.131   5.6766 -1.542736 9.556240 
1 1 1   17    8  -44 o   39.467   3.2164   65.709   10.258  102.269   20.718   53.836   11.807   47.956   5.3934   35.282   4.1867 12.67432 6.827684 
1 1 1   17    8  -43 o   22.742   5.1996   23.410   9.4284   1.6213   19.577   29.990   10.758   16.983   7.4321   25.766   5.2993 -8.782263 9.127856 
1 1 1   17    8  -42 o   22.401   4.8101   22.425   8.5209   32.252   13.663   16.171   10.900   26.251   6.4356   19.017   6.1592 7.234571 8.907950 
1 1 1   17    8  -41 o   69.677   1.9127  199.888   10.853  178.365   17.830  212.557   13.679   65.125   3.3701   71.672   2.3446 -6.547516 4.105471 
1 1 1   17    8  -40 o   26.860   4.2001   31.334   8.8949   35.421   18.880   30.168   10.084   26.937   8.0101   26.060   4.9276 0.8771877 9.404384 
1 1 1   17    8  -39 o   33.565   3.2708   47.527   8.8356   43.835   16.288   49.066   10.517   30.674   6.7021   33.883   3.8777 -3.209442 7.743088 
1 1 1   17    8  -38 o   22.457   5.0995   22.595   9.1212   20.724   15.372   23.611   11.331   21.497   7.3250   22.695   6.0251 -1.198006 9.484545 
1 1 1   17    8  -37 o   13.931   5.4314   5.8500   8.8945   11.560   15.365   2.9719   10.908   18.323   7.1401   13.852   5.7870 4.470981 9.190738 
1 1 1   17    8  -36 o   13.971   5.3601   6.2682   8.5600  -1.5686   13.597   11.414   11.017   13.955   6.1472   17.049   6.1690 -3.094361 8.708923 
1 1 1   17    8  -35 o   35.115   3.2938   51.874   9.3182   61.282   14.687   45.535   12.055   37.521   4.9204   32.357   4.7086 5.163731 6.810382 
1 1 1   17    8  -34 o   76.818   2.2052  243.227   13.794  233.932   18.878  253.876   20.206   74.928   3.0975   78.013   3.1842 -3.085632 4.442204 
1 1 1   17    8  -33 o   72.335   2.0438  215.312   12.039  228.240   18.268  205.386   16.007   74.057   3.0326   70.355   2.7967 3.702202 4.125259 
1 1 1   17    8  -32 o   46.117   2.6328   88.193   9.8562   69.574   14.831  102.921   13.191   40.219   4.6068   49.603   3.2807 -9.383835 5.655535 
1 1 1   17    8  -31 o   53.575   2.1679  118.279   9.4481   85.879   15.501  137.431   11.918   44.898   4.2874   57.640   2.5428 -12.74203 4.984693 
1 1 1   17    8  -30 o   31.305   3.8211   41.639   9.5488   49.862   14.101   34.674   12.977   33.716   5.3057   27.771   5.9140 5.944794 7.945212 
1 1 1   17    8  -29 o   26.674   4.4190   30.784   9.2722   40.838   13.967   22.861   12.399   30.235   5.8786   22.476   6.4381 7.759626 8.718159 
1 1 1   17    8  -28 o   18.376   5.6110   14.740   9.1759   1.5527   13.755   25.313   12.317   14.938   6.3811   23.638   6.2845 -8.700304 8.956223 
1 1 1   17    8  -27 o   65.972   2.3498  179.397   12.616  144.835   19.975  202.337   16.273   58.533   4.2148   69.881   2.8629 -11.34864 5.095119 
1 1 1   17    8  -26 o   48.455   2.4504   96.956   9.6471   83.961   18.300  101.957   11.353   44.081   5.1924   49.588   2.8202 -5.507111 5.908873 
1 1 1   17    8  -25 o   43.168   2.6435   77.147   9.2573   70.460   17.379   79.796   10.938   40.253   5.4352   43.784   3.0845 -3.530586 6.249454 
1 1 1   17    8  -24 o   46.034   2.4088   87.451   9.0074   89.754   15.315   86.233   11.137   46.101   4.1186   45.552   3.0164 0.5487747 5.105104 
1 1 1   17    8  -23 o   56.954   2.1078  133.360   9.7690  118.494   16.156  141.928   12.265   53.179   3.7510   58.635   2.5724 -5.455917 4.548318 
1 1 1   17    8  -22 o   18.295   5.6519   14.436   9.2764   23.438   14.401   8.0524   12.128   22.915   7.0354   16.318   6.3478 6.597605 9.475857 
1 1 1   17    8  -21 o   29.092   3.6519   35.738   8.4698   47.222   14.944   30.304   10.280   32.755   5.8098   26.368   4.9651 6.386715 7.642374 
1 1 1   17    8  -20 o   55.021   2.1650  124.476   9.6913  121.402   16.721  126.031   11.892   53.834   3.8355   55.244   2.6486 -1.410210 4.661153 
1 1 1   17    8  -19 o   33.098   3.2305   45.772   8.6048   70.331   15.617   35.065   10.311   40.570   4.8160   28.550   4.5859 12.02010 6.650167 
1 1 1   17    8  -18 o   14.555   5.2570   7.7189   7.9959   2.8840   14.684   9.7570   9.5334   15.841   6.6721   16.084   5.7487 -0.2429857 8.807023 
1 1 1   17    8  -17 o   37.973   3.1006   59.991   9.5139   49.649   21.801   62.424   10.574   32.699   8.1959   38.665   3.3892 -5.965950 8.869051 
1 1 1   17    8  -16 o   28.151   3.7172   33.487   8.3218   40.617   14.905   30.257   10.031   30.222   6.2564   26.421   4.8356 3.800407 7.907310 
1 1 1   17    8  -15 o   49.427   2.3617  100.600   9.4879  101.072   16.332  100.359   11.657   49.038   4.1238   49.237   2.9174 -0.1983452 5.051478 
1 1 1   17    8  -14 o   72.447   1.8817  215.144   11.103  231.035   18.960  206.850   13.698   74.710   3.1203   70.917   2.3728 3.792740 3.919999 
1 1 1   17    8  -13 f   18.914   5.1429   15.626   8.1364   18.535   14.745   14.352   9.7563   21.089   7.1741   18.383   5.8140 2.706141 9.234200 
1 1 1   17    8  -12 o   42.099   2.6543   73.223   9.0622   73.106   16.021   73.278   10.989   41.431   4.8347   41.977   3.2365 -0.5467033 5.817965 
1 1 1   17    8  -11 o   20.503   4.9035   18.378   8.0845   27.475   14.552   14.317   9.7230   24.765   6.9347   18.369   5.8033 6.395815 9.042640 
1 1 1   17    8  -10 o   68.120   2.2485  190.635   12.469  184.007   24.756  192.889   14.433   66.088   4.6246   68.434   2.5920 -2.345703 5.301429 
1 1 1   17    8   -9 o   19.812   5.5318   17.159   9.2740   8.5709   20.382   19.401   10.415   19.597   8.0216   21.012   5.8604 -1.415087 9.934242 
1 1 1   17    8   -8 o   14.585   5.5637   6.5909   9.1877  -6.4637   20.408   9.9092   10.289   16.402   7.3586   16.456   5.9607 -0.5418015E-01 9.469932 
1 1 1   17    8   -7 o   32.936   3.6121   45.485   9.5388   33.774   16.958   50.906   11.537   27.330   7.4219   34.715   4.1597 -7.384892 8.508074 
1 1 1   17    8   -6 o   67.754   2.3005  188.618   12.687  208.477   18.722  171.753   17.254   70.958   3.2453   64.375   3.2989 6.583191 4.627639 
1 1 1   17    8   -5 o   15.115   5.5499   7.9921   8.9639   1.6622   12.484   14.729   12.879   14.508   6.1335   19.238   6.6985 -4.729707 9.082387 
1 1 1   17    8   -4 o   17.274   5.6094   12.373   9.0380   17.652   12.512   6.6138   13.070   20.401   6.5980   16.317   6.5142 4.083345 9.271914 
1 1 1   17    8   -3 o   93.050   1.6469  354.133   12.492  366.251   18.685  344.339   16.797   94.404   2.4301   91.616   2.2492 2.788155 3.311225 
1 1 1   17    8   -2 o  107.417   1.5846  471.799   13.875  492.163   21.067  456.198   18.439  109.495   2.3603  105.484   2.1444 4.010788 3.188982 
1 1 1   17    8   -1 o   63.452   1.9241  165.026   9.9403  161.179   15.327  167.819   13.059   62.449   3.0199   63.860   2.5136 -1.411110 3.929124 
1 1 1   17    8    0 o   21.601   4.6858   20.266   8.0129   26.652   12.640   15.975   10.361   24.497   6.2960   19.315   5.9741 5.181744 8.679273 
1 1 1   17    8    1 o   36.715   2.8526   55.841   8.4703   51.367   13.497   58.747   10.879   34.654   4.9159   37.489   3.6045 -2.834469 6.095741 
1 1 1   17    8    2 o   49.134   2.2821   99.265   9.1152  103.878   14.355   96.149   11.799   49.960   3.5479   48.196   3.0186 1.764107 4.658257 
1 1 1   17    8    3 o   32.144   3.2081   43.077   8.2937   47.879   13.252   39.986   10.634   33.399   5.0229   30.659   4.3793 2.740738 6.663902 
1 1 1   17    8    4 o   11.078   4.7726  -0.3838   7.8166  -2.0637   12.581   0.6723   9.9753   13.548   5.9426   12.823   5.4546 0.7249756 8.066437 
1 1 1   17    8    5 o   64.379   1.9184  169.885   10.056  164.761   15.599  173.529   13.154   63.129   3.0402   64.941   2.4896 -1.811497 3.929479 
1 1 1   17    8    6 o   59.492   2.0184  145.190   9.7740  149.928   15.069  141.750   12.841   60.200   3.0811   58.634   2.6940 1.565922 4.092754 
1 1 1   17    8    7 o   39.872   2.6711   65.692   8.6314   68.983   13.416   63.368   11.275   40.492   4.1219   38.942   3.5923 1.550167 5.467588 
1 1 1   17    8    8 o   48.941   2.5303   98.715   10.060  111.370   14.373   86.557   14.087   51.761   3.4257   45.487   3.8348 6.273823 5.142072 
1 1 1   17    8    9 o   26.086   4.3940   29.168   9.0115   26.774   13.076   31.334   12.436   24.506   6.4567   26.634   5.8852 -2.127918 8.736341 
1 1 1   17    8   10 o   12.155   5.1239   1.0976   8.6710  -0.0187   12.649   2.0872   11.910   14.107   6.0743   14.323   6.0194 -0.2155037 8.551622 
1 1 1   17    8   11 o   67.891   1.8862  188.922   10.428  192.249   16.330  186.630   13.551   68.212   2.9438   67.341   2.4728 0.8710480 3.844593 
1 1 1   17    8   12 o   52.159   2.2643  111.881   9.6042  107.794   16.074  114.150   11.977   50.747   3.9159   52.562   2.8056 -1.814808 4.817277 
1 1 1   17    8   13 f   47.401   2.4279   92.573   9.3499   87.547   15.773   95.296   11.609   45.571   4.2968   47.965   2.9841 -2.393501 5.231380 
1 1 1   17    8   14 o   31.888   3.3226   42.528   8.5099   33.827   14.459   47.139   10.526   27.468   6.5500   33.425   3.9389 -5.957067 7.643135 
1 1 1   17    8   15 o   43.308   2.5997   77.462   9.1355   99.772   15.732   66.111   11.221   48.766   3.9926   39.780   3.4961 8.986073 5.306901 
1 1 1   17    8   16 o   40.714   2.6472   68.535   8.7380   75.514   14.156   64.240   11.106   42.322   4.1571   39.198   3.5131 3.123474 5.442704 
1 1 1   17    8   17 o   13.278   5.1812   4.8689   8.0992  -3.1136   13.961   8.9184   9.9436   13.985   6.1918   15.860   5.8416 -1.874262 8.512456 
1 1 1   17    8   18 o   52.173   2.3104  112.053   9.8014  115.441   16.138  110.072   12.338   52.522   3.7949   51.549   2.9484 0.9738426 4.805681 
1 1 1   17    8   19 o   64.748   2.1749  172.301   11.463  157.885   17.190  183.843   15.381   61.591   3.4376   66.692   2.8358 -5.100513 4.456307 
1 1 1   17    8   20 o   62.675   2.3051  161.645   11.756  192.006   19.686  144.814   14.657   67.874   3.5706   59.103   3.0527 8.771370 4.697643 
1 1 1   17    8   21 o   71.006   2.2743  207.393   13.147  195.828   23.037  212.978   16.010   68.265   4.1597   71.809   2.7401 -3.543694 4.981069 
1 1 1   17    8   22 o   19.276   5.5468   16.311   9.1836   5.3547   14.820   23.140   11.701   16.546   6.8137   22.742   6.1605 -6.196285 9.185750 
1 1 1   17    8   23 o   26.590   4.1427   30.274   8.6868   28.323   15.746   31.127   10.415   24.946   7.2884   26.712   4.9659 -1.766672 8.819354 
1 1 1   17    8   24 o   14.041   5.3085   6.4202   8.3188   4.6506   15.317   7.1607   9.9074   16.526   6.8772   15.055   5.7689 1.471523 8.976415 
1 1 1   17    8   25 o   36.510   3.4309   55.895   10.091   75.605   16.934   45.042   12.566   41.885   5.0623   32.245   4.9377 9.640335 7.071610 
1 1 1   17    8   26 o   25.069   4.3621   27.166   8.5904   46.805   15.856   19.007   10.220   32.329   6.2429   20.665   5.8205 11.66420 8.535319 
1 1 1   17    8   27 o   26.441   5.0152   30.660   10.414   12.250   21.192   36.521   11.958   20.447   8.2493   28.817   5.2851 -8.370264 9.797095 
1 1 1   17    8   28 o   22.591   5.2110   22.652   9.4004   34.602   21.924   19.960   10.406   27.121   8.7306   21.120   5.8456 6.001486 10.50685 
1 1 1   17    8   29 o   44.738   2.8987   83.216   10.514   96.463   24.392   80.193   11.652   46.382   6.6407   43.790   3.2883 2.591564 7.410281 
1 1 1   17    8   30 o   49.670   2.4760  102.010   9.9934   73.832   17.773  115.038   12.085   41.089   5.4399   52.642   2.8266 -11.55314 6.130427 
1 1 1   17    8   31 o   44.046   2.7077   80.525   9.6747   89.216   17.605   76.765   11.580   45.516   4.8179   42.797   3.3460 2.719219 5.865836 
1 1 1   17    8   32 o   54.579   2.3564  123.020   10.459  130.712   19.007  119.679   12.526   55.471   4.2354   53.661   2.8741 1.810886 5.118498 
1 1 1   17    8   33 o   45.667   2.6522   86.540   9.8303   86.834   18.183   86.419   11.685   44.714   5.0784   45.461   3.1732 -0.7472076 5.988266 
1 1 1   17    8   34 o   62.787   2.1776  162.508   11.128  174.421   20.414  157.470   13.274   64.255   3.9160   61.638   2.6481 2.616459 4.727345 
1 1 1   17    8   35 o   48.693   2.8458   98.676   11.246  113.327   18.382   89.912   14.218   51.466   4.4245   46.091   3.8186 5.375843 5.844452 
1 1 1   17    8   36 o   36.124   3.5709   55.199   10.378   59.444   17.001   52.678   13.101   36.411   5.9322   34.809   4.7403 1.601620 7.593571 
1 1 1   17    8   37 o   8.0506   3.9653 -18.7003   9.2246 -32.8565   15.538 -10.9944   11.464   10.173   5.0356   10.746   5.0622 -0.5733500 7.140223 
1 1 1   17    8   38 o   12.897   5.3703   2.5843   9.3486   0.7884   15.451   3.6213   11.742   15.339   6.6590   14.442   6.0165 0.8964748 8.974445 
1 1 1   17    8   39 o   49.039   2.7389  100.105   10.905  144.251   28.780   92.704   11.783   56.512   6.3579   47.051   3.0894 9.460548 7.068715 
1 1 1   17    8   40 o   41.244   3.1660   71.462   10.563   69.925   25.771   71.772   11.580   37.513   8.6103   41.207   3.4800 -3.694023 9.286933 
1 1 1   17    8   41 o   32.761   3.8021   45.908   9.9651   58.564   25.161   43.553   10.853   33.906   8.9675   31.690   4.3130 2.215704 9.950827 
1 1 1   17    8   42 o   12.266   5.1547   1.9084   8.7328 -11.3148   17.106   6.5691   10.156   13.614   6.3381   14.690   5.7811 -1.076521 8.578632 
1 1 1   17    8   43 o   21.254   5.7009   20.736   10.080   21.614   16.571   20.220   12.700   21.748   7.5965   20.938   6.6347 0.8098965 10.08595 
1 1 1   17    8   44 o   36.460   4.0145   57.194   11.734  103.196   24.837   43.977   13.313   47.212   6.6367   31.245   5.4238 15.96697 8.571080 
1 1 1   17    8   45 o   11.557   5.1481  -2.3394   9.8010   16.473   16.859 -11.9436   12.046   19.963   7.5549   10.843   5.1323 9.119733 9.133277 
1 1 1   17    8   46 o   20.964   5.4362   20.162   9.3668   45.388   17.943   10.713   10.982   30.555   7.3036   16.541   6.1306 14.01388 9.535575 
1 1 1   17    8   47 o   17.632   5.6558   13.889   9.2061   19.569   17.294   11.644   10.875   20.956   7.7064   16.879   6.1260 4.076674 9.844591 
1 1 1   17    8   48 o   9.5240   4.4724  -7.9915   8.8249  -5.8285   16.024  -8.9332   10.573   13.965   6.3669   10.483   4.9138 3.482470 8.042610 
1 1 1   17    8   49 o   13.271   5.3788   4.3997   9.0566   31.017   17.371  -5.5361   10.613   24.970   7.7377   11.218   5.1400 13.75184 9.289299 
1 1 1   17    8   50 o   38.093   3.1440   61.371   9.6756   84.521   18.402   52.526   11.375   43.398   5.3126   34.786   4.0895 8.611942 6.704287 
1 1 1   17    8   51 o   32.197   3.7218   44.657   9.5883   45.573   17.921   44.289   11.349   30.382   7.3227   31.670   4.5247 -1.288193 8.607871 
1 1 1   17    8   52 f   24.889   5.0113   28.145   9.8150   11.800   16.668   36.820   12.144   18.248   7.3321   28.311   5.4600 -10.06257 9.141750 
1 1 1   17    8   53 o   45.704   2.7807   87.713   10.311  113.707   19.316   77.354   12.193   50.723   4.7260   42.517   3.5506 8.205551 5.911170 
1 1 1   17    8   54 o   16.019   5.5950   11.015   8.9889   28.785   17.108   4.2391   10.565   23.831   7.7159   13.813   5.7267 10.01750 9.608915 
1 1 1   17    8   55 o   12.919   5.2890   4.0001   8.8625   18.973   16.698  -1.8716   10.457   20.291   7.5522   11.925   5.3145 8.365662 9.234688 
1 1 1   17    8   56 o   33.320   3.5547   47.899   9.5060   43.836   17.174   49.693   11.414   29.492   7.2062   33.549   4.2702 -4.057199 8.376381 
1 1 1   17    8   57 o   13.175   5.2533   5.2406   8.4892  -1.4392   14.138   9.0068   10.616   13.760   6.1526   15.450   5.9584 -1.690627 8.564849 
1 1 1   17    8   58 f   9.2358   4.3890  -9.3948   8.9825  -6.5470   14.015 -11.3800   11.702   12.618   5.8267   10.549   5.0121 2.068889 7.685818 
1 1 1   17    8   59 f   13.005   5.4857   3.1363   9.9491 -19.3153   17.725   13.463   12.021   12.310   5.9332   17.405   6.4209 -5.095253 8.742434 
1 1 1   17    8   60 o   17.951   5.9102   15.294   10.017   0.5239   18.029   21.890   12.048   15.459   6.9275   20.952   6.4356 -5.492900 9.455528 
1 1 1   17    8   61 o   17.851   5.9759   15.205   10.231   8.7926   19.277   17.720   12.071   17.428   7.5014   19.017   6.4907 -1.589029 9.919724 
1 1 1   17    8   62 o   15.335   5.8603   9.6252   10.205   9.8306   18.488   9.5352   12.239   17.383   7.4109   15.814   6.3070 1.568406 9.731339 
1 1 1   17    8   63 o   11.178   5.0554  -2.5399   9.8556   17.618   18.123 -11.0055   11.744   19.186   7.6669   10.491   4.9950 8.694267 9.150521 
1 1 1   17    8   64 o   25.844   5.0539   31.642   10.265   35.393   18.807   30.051   12.251   24.684   8.0967   24.349   6.1668 0.3356304 10.17771 
1 1 1   17    8   65 o   35.377   3.7983   55.578   10.782   24.777   18.755   70.782   13.177   21.048   7.9678   39.670   4.1356 -18.62263 8.977149 
1 1 1   17    8   66 o   25.298   5.1229   30.729   10.202   35.885   18.543   28.491   12.216   24.608   8.0378   23.451   6.2697 1.156380 10.19390 
1 1 1   17    8   67 o   37.539   3.5317   62.154   10.680   75.179   19.322   56.424   12.816   38.294   6.4169   34.846   4.6260 3.447262 7.910491 
1 1 1   17    8   68 o   41.075   3.8679   75.726   12.798   62.763   19.051   86.387   17.277   33.926   7.1165   42.540   5.0827 -8.613823 8.745173 
1 1 1   17    8   69 o   30.786   5.0166   45.610   12.156   39.949   18.365   50.024   16.218   25.529   7.9632   30.491   6.7076 -4.961784 10.41173 
1 1 1   17    8   70 o   11.332   5.2444  -4.2750   11.448  -5.3428   17.961  -3.5445   14.857   13.632   6.3947   12.885   5.9672 0.7465076 8.746400 
1 1 1   17    8   71 o   25.275   4.9001   31.031   9.7312   20.751   17.006   36.036   11.866   19.022   7.4824   26.600   5.6473 -7.577621 9.374347 
1 1 1   17    8   72 o   9.5405   4.5571  -9.2649   9.9410 -16.7924   16.121  -4.6461   12.628   11.353   5.5162   11.724   5.4542 -0.3711443 7.757364 
1 1 1   17    8   73 o   14.054   5.8856   6.9386   11.324 -21.2592   23.501   15.466   12.924   13.241   6.4827   17.160   6.5855 -3.919079 9.240893 
1 1 1   17    8   74 o   12.789   5.9546  -3.7370   15.100   12.415   23.881 -14.4976   19.492   17.380   7.8642   12.740   6.1605 4.640098 9.989799 
1 1 1   17    8   75 o   10.780   5.2542 -17.0741   14.947 -23.0756   23.900 -13.2194   19.154   13.112   6.4432   12.746   6.1495 0.3650818 8.906824 
1 1 1   17    8   76 o   17.125   7.0262   15.492   15.683   16.940   25.332   14.592   19.971   18.030   8.1343   17.230   7.5238 0.8004131 11.08041 
1 1 1   17    8   77 o   13.527   6.1995   0.4443   15.454  -5.3917   24.531   4.2840   19.898   14.858   7.1136   15.249   7.0055 -0.3908730 9.984002 
1 1 1   17    8   78 o   12.911   5.9904  -2.0968   15.077 -19.8924   24.315   9.0194   19.218   13.335   6.5420   15.900   7.1364 -2.564710 9.681248 
1 1 1   17    8   79 o   17.207   7.1080   16.329   16.195   11.639   25.744   19.400   20.834   17.037   7.8777   18.061   7.7863 -1.023663 11.07634 
1 1 1   17    8   80 o   12.408   5.8473  -5.2773   15.323   31.971   26.100 -24.8668   18.928   20.247   8.7217   11.317   5.5939 8.929666 10.36148 
1 1 1   17    8   81 o   12.710   5.9771  -4.2706   15.859 -27.6819   24.872   11.768   20.586   12.739   6.3174   16.420   7.3768 -3.680753 9.712183 
1 1 1   17    8   82 o   11.475   5.4869  -9.0708   14.490  -9.0708   14.490   0.0000   0.0000   11.475   5.4869  ?   ?  0.000000 5.486860 
1 1 1   17    8   83 o   16.551   6.8543   14.916   15.111   14.916   15.111   0.0000   0.0000   16.551   6.8543  ?   ?  0.000000 6.854316 
1 1 1   17    8   84 o   17.170   6.8641   17.196   14.532   17.196   14.532   0.0000   0.0000   17.170   6.8641  ?   ?  0.000000 6.864081 
1 1 1   17    8   85 o   10.801   5.2310 -12.6398   14.195 -12.6398   14.195   0.0000   0.0000   10.801   5.2310  ?   ?  0.000000 5.231025 
1 1 1   17    8   86 o   16.797   6.7609   16.371   14.199   16.371   14.199   0.0000   0.0000   16.797   6.7609  ?   ?  0.000000 6.760902 
1 1 1   17    8   87 o   10.101   4.9581 -17.5519   14.029 -17.5519   14.029   0.0000   0.0000   10.101   4.9581  ?   ?  0.000000 4.958138 
1 1 1   17    8   88 o   16.818   6.8280   16.552   14.623   16.552   14.623   0.0000   0.0000   16.818   6.8280  ?   ?  0.000000 6.828002 
1 1 1   17    8   89 o   12.790   6.0982  -6.1035   17.633  -6.1035   17.633   0.0000   0.0000   12.790   6.0982  ?   ?  0.000000 6.098204 
1 1 1   17    9  -84 o   15.590   7.1826   8.9009   21.124   8.9009   21.124   0.0000   0.0000   15.590   7.1826  ?   ?  0.000000 7.182593 
1 1 1   17    9  -83 o   17.442   7.6475   19.639   20.818   19.639   20.818   0.0000   0.0000   17.442   7.6475  ?   ?  0.000000 7.647547 
1 1 1   17    9  -82 o   13.070   6.3506 -11.0856   21.367 -11.0856   21.367   0.0000   0.0000   13.070   6.3506  ?   ?  0.000000 6.350550 
1 1 1   17    9  -81 f   15.633   7.2278   8.6361   21.663   8.6361   21.663   0.0000   0.0000   15.633   7.2278  ?   ?  0.000000 7.227850 
1 1 1   17    9  -80 o   15.992   7.3622   10.270   22.133   10.270   22.133   0.0000   0.0000   15.992   7.3622  ?   ?  0.000000 7.362218 
1 1 1   17    9  -79 o   16.624   7.5381   13.780   22.085   13.780   22.085   0.0000   0.0000   16.624   7.5381  ?   ?  0.000000 7.538134 
1 1 1   17    9  -78 o   15.040   6.9488   5.2052   19.973   5.2052   19.973   0.0000   0.0000   15.040   6.9488  ?   ?  0.000000 6.948796 
1 1 1   17    9  -77 o   13.362   6.1355   1.1076   15.235   13.402   20.185 -15.1677   23.224   16.518   7.3713   13.286   6.4917 3.232676 9.822293 
1 1 1   17    9  -76 o   23.540   7.4857   36.000   16.154   44.382   21.544   25.232   24.417   24.035   8.6357   18.865   8.2765 5.170155 11.96141 
1 1 1   17    9  -75 o   16.516   6.8707   14.476   15.280   13.791   20.577   15.319   22.814   16.756   7.4621   17.185   7.7393 -0.4290810 10.75081 
1 1 1   17    9  -74 f   22.100   7.4293   31.460   15.811   28.724   21.017   35.028   23.998   20.053   8.1694   21.094   8.6768 -1.040211 11.91745 
1 1 1   17    9  -73 f   9.3304   4.6562 -27.9467   14.399 -43.0466   19.087  -8.0043   21.936   9.9990   5.0404   13.889   6.6701 -3.890250 8.360361 
1 1 1   17    9  -72 o   19.353   7.1530   23.029   14.932   17.919   20.369   28.964   21.953   17.733   7.6722   20.139   8.2930 -2.405516 11.29762 
1 1 1   17    9  -71 o   12.340   5.7584  -3.8454   14.251 -24.3474   19.707   18.628   20.633   11.675   5.7593   17.975   7.7490 -6.299613 9.654819 
1 1 1   17    9  -70 o   12.958   5.9702  -1.3040   14.596  -7.6441   19.996   5.9255   21.353   13.590   6.4836   15.806   7.2600 -2.216254 9.733665 
1 1 1   17    9  -69 o   19.404   7.1385   22.466   14.842  -0.0816   19.771   51.577   22.465   14.635   6.8139   26.765   8.8525 -12.12955 11.17117 
1 1 1   17    9  -68 o   13.863   6.0409   5.0057   12.817   20.756   16.362 -20.0076   20.619   18.767   7.3521   12.475   6.1000 6.291894 9.553125 
1 1 1   17    9  -67 o   7.2623   3.6418 -23.2097   9.3148 -32.4298   15.041 -17.4734   11.864   9.3159   4.6653   9.3308   4.5760 -0.1494694E-01 6.534930 
1 1 1   17    9  -66 o   44.754   3.1490   87.928   11.414   69.823   17.336  101.782   15.166   36.667   6.0081   47.183   3.9801 -10.51610 7.206860 
1 1 1   17    9  -65 o   18.942   5.8019   18.860   9.8010 -24.3436   16.082   44.389   12.362   10.524   5.1933   29.950   5.2551 -19.42661 7.388288 
1 1 1   17    9  -64 o   35.715   3.6234   57.197   10.403   29.616   17.421   72.483   12.969   21.818   7.7741   39.796   4.0545 -17.97832 8.767859 
1 1 1   17    9  -63 o   29.100   4.5132   39.800   10.359   32.341   12.702   54.617   17.902   24.608   6.3044   31.199   7.1872 -6.591194 9.560433 
1 1 1   17    9  -62 o   16.140   5.8961   12.585   10.097  -0.3526   12.619   35.608   16.834   12.755   5.7491   24.498   7.6213 -11.74322 9.546536 
1 1 1   17    9  -61 o   21.536   4.9653   22.463   8.5383   28.670   12.492   17.020   11.697   23.238   6.3943   18.165   6.3797 5.073122 9.032579 
1 1 1   17    9  -60 o   12.380   5.1091   4.2359   8.3568  -0.7639   12.185   8.6763   11.483   12.596   5.6657   15.022   6.0681 -2.425913 8.301938 
1 1 1   17    9  -59 o   13.668   5.2851   7.2994   8.3687   14.102   12.468   1.7210   11.290   17.196   6.4994   12.879   5.6396 4.317543 8.605057 
1 1 1   17    9  -58 o   9.6987   4.4848  -4.6439   8.3458  -4.7877   12.592  -4.5313   11.145   11.988   5.5310   11.334   5.2202 0.6534557 7.605440 
1 1 1   17    9  -57 o   18.244   5.4274   16.224   8.6662   12.384   13.178   19.151   11.504   16.817   6.5952   19.406   6.3303 -2.588278 9.141649 
1 1 1   17    9  -56 o   13.445   5.3378   6.2382   8.7277   22.706   13.369  -5.9949   11.522   20.841   6.8258   11.283   5.2357 9.557882 8.602553 
1 1 1   17    9  -55 o   16.148   5.7313   11.887   9.4599  -9.5676   16.190   23.009   11.657   12.846   6.0402   21.323   6.2822 -8.477406 8.714943 
1 1 1   17    9  -54 o   39.750   3.2551   68.085   10.455   45.883   18.073   79.252   12.817   29.237   7.5358   42.550   3.7331 -13.31340 8.409760 
1 1 1   17    9  -53 o   13.825   5.7020   5.2056   10.400   14.549   16.272  -1.2477   13.523   18.339   7.2859   13.367   5.9942 4.971917 9.434751 
1 1 1   17    9  -52 o   27.125   5.0798   34.195   10.819   56.048   17.243   20.002   13.895   33.695   6.5135   20.071   6.9596 13.62350 9.532148 
1 1 1   17    9  -51 o   33.598   3.5471   48.958   9.5681   48.951   14.588   48.962   12.675   32.099   5.7882   32.752   4.8980 -0.6528168 7.582446 
1 1 1   17    9  -50 o   9.7154   4.5090  -5.7769   8.5524 -13.6079   13.534  -0.5704   11.035   11.174   5.3317   12.481   5.5163 -1.306847 7.671773 
1 1 1   17    9  -49 o   40.019   3.4440   68.827   11.125   47.048   20.519   77.896   13.241   29.547   8.2202   42.302   3.8832 -12.75440 9.091227 
1 1 1   17    9  -48 o   38.882   3.5635   65.121   11.169   60.443   20.647   67.056   13.280   34.438   7.5624   39.035   4.2416 -4.596382 8.670742 
1 1 1   17    9  -47 o   8.9647   4.2642  -9.3391   8.5187   19.060   19.358 -16.1594   9.4866   20.587   8.0167   8.4743   4.1425 12.11291 9.023715 
1 1 1   17    9  -46 o   49.049   2.4026  100.350   9.5769   84.786   16.135  108.816   11.900   43.768   4.5905   50.828   2.8840 -7.059425 5.421274 
1 1 1   17    9  -45 o   55.150   2.2202  126.344   9.9608  135.107   16.728  121.531   12.398   56.132   3.6762   53.768   2.8389 2.363537 4.644766 
1 1 1   17    9  -44 o   23.840   4.4903   25.436   8.4058   32.146   14.826   22.258   10.204   25.541   6.9413   21.774   5.6880 3.767174 8.974131 
1 1 1   17    9  -43 o   14.510   5.4067   7.9771   8.5630   38.213   16.917  -2.4386   9.9290   27.655   7.3710   11.523   5.1540 16.13164 8.994191 
1 1 1   17    9  -42 o   59.319   2.1180  145.722   10.225  148.834   17.422  144.087   12.629   59.052   3.6370   58.726   2.6449 0.3264122 4.497049 
1 1 1   17    9  -41 o   21.523   4.8977   21.042   8.3987   22.290   14.587   20.423   10.272   21.599   7.1330   20.905   5.8163 0.6942043 9.203738 
1 1 1   17    9  -40 o   30.171   3.5588   39.058   8.5841   38.447   14.595   39.381   10.614   28.437   6.4458   29.868   4.4989 -1.431736 7.860549 
1 1 1   17    9  -39 o   30.142   3.5255   38.925   8.4988   54.779   14.747   31.041   10.400   34.827   5.3666   26.214   5.0500 8.613663 7.369036 
1 1 1   17    9  -38 o   34.126   3.4276   49.621   9.4059   30.549   14.721   62.779   12.227   25.103   6.9548   38.142   3.9917 -13.03945 8.018875 
1 1 1   17    9  -37 o   53.250   2.4284  117.874   10.513   84.565   15.816  144.241   14.072   44.048   4.4666   58.647   2.9530 -14.59979 5.354510 
1 1 1   17    9  -36 o   50.113   2.6341  104.748   10.722  130.805   18.276   91.073   13.240   55.155   4.0942   46.293   3.5354 8.862225 5.409445 
1 1 1   17    9  -35 o   56.191   2.6879  131.704   12.276  134.065   16.384  128.681   18.537   56.192   3.5957   54.658   4.1924 1.533997 5.523197 
1 1 1   17    9  -34 o   21.890   5.4570   21.967   9.7029   27.797   13.990   16.563   13.469   24.127   6.8149   19.415   6.8435 4.712231 9.657954 
1 1 1   17    9  -33 o   40.687   3.1581   69.745   10.392   66.085   15.046   73.084   14.370   38.750   4.8708   41.067   4.3592 -2.316204 6.536601 
1 1 1   17    9  -32 o   20.687   4.9131   19.280   8.1611   38.275   14.135   9.7806   9.9956   28.701   6.2214   15.914   5.8576 12.78725 8.545049 
1 1 1   17    9  -31 o   16.777   5.5192   12.207   8.7363   1.9806   13.401   19.765   11.521   14.632   6.2755   20.710   6.2800 -6.077819 8.878092 
1 1 1   17    9  -30 o   15.739   5.2927   10.462   8.0244   4.0838   13.753   13.754   9.8805   15.376   6.4657   17.740   5.8710 -2.364324 8.733447 
1 1 1   17    9  -29 o   54.752   2.3080  124.094   10.278  155.734   19.138  111.270   12.184   60.510   3.9008   51.605   2.9081 8.904621 4.865576 
1 1 1   17    9  -28 o   44.400   2.6328   82.047   9.4857   93.614   17.856   77.499   11.196   46.374   4.7925   42.925   3.2234 3.448612 5.775635 
1 1 1   17    9  -27 o   35.129   3.2030   51.989   9.0710   46.152   16.999   54.312   10.726   31.370   6.8408   35.705   3.7407 -4.335606 7.796787 
1 1 1   17    9  -26 o   19.333   5.1981   16.813   8.3682   24.054   15.814   13.996   9.8622   22.753   7.4221   17.912   5.8625 4.840832 9.458101 
1 1 1   17    9  -25 o   21.880   4.7919   21.306   8.3094   31.929   15.745   17.206   9.7825   25.943   7.1947   19.534   5.7550 6.408655 9.213185 
1 1 1   17    9  -24 o   42.427   2.6406   74.856   9.0869   53.760   15.626   85.635   11.170   34.633   5.7356   45.245   3.0463 -10.61173 6.494423 
1 1 1   17    9  -23 o   13.827   5.1762   6.6485   7.8668  -2.8400   13.862   11.156   9.5544   13.765   6.1276   16.524   5.7685 -2.759135 8.415658 
1 1 1   17    9  -22 o   50.106   2.5450  104.110   10.361   84.146   21.592  110.082   11.809   43.160   6.3250   51.424   2.8281 -8.264217 6.928431 
1 1 1   17    9  -21 o   36.074   3.1278   54.596   9.1068   56.225   17.859   54.024   10.587   35.083   6.4836   35.686   3.6927 -0.6027031 7.461456 
1 1 1   17    9  -20 o   38.135   2.9825   60.801   9.1977   46.934   18.161   65.585   10.667   31.622   7.2065   39.491   3.3451 -7.868546 7.945035 
1 1 1   17    9  -19 o   25.899   4.3055   29.121   8.7706   47.469   17.620   23.077   10.112   31.953   6.9620   22.617   5.5317 9.336494 8.892083 
1 1 1   17    9  -18 o   38.652   3.2578   62.714   10.169   62.893   15.494   62.578   13.478   37.914   5.1461   38.157   4.4145 -0.2428703 6.780156 
1 1 1   17    9  -17 o   29.496   3.5963   36.942   8.4682   26.240   14.610   42.356   10.392   23.800   7.0386   31.411   4.1609 -7.611151 8.176482 
1 1 1   17    9  -16 o   41.431   2.9057   71.559   9.7511   88.783   21.718   67.210   10.913   44.591   6.1376   39.989   3.3795 4.602455 7.006502 
1 1 1   17    9  -15 o   21.422   5.1599   20.489   8.9023   16.806   20.755   21.319   9.8549   21.329   8.3022   21.767   5.5408 -0.4380493 9.981318 
1 1 1   17    9  -14 o   27.165   4.2372   31.856   9.0767   20.087   20.775   34.632   10.091   22.278   8.3965   28.239   4.5373 -5.961664 9.544016 
1 1 1   17    9  -13 o   26.390   4.3717   30.191   9.0753   55.532   21.199   24.505   10.042   34.279   7.7671   23.403   5.3771 10.87660 9.446769 
1 1 1   17    9  -12 o   59.726   2.1191  146.909   10.300  143.043   17.410  148.991   12.776   58.329   3.6805   59.985   2.6192 -1.655815 4.517325 
1 1 1   17    9  -11 o   52.439   2.3322  113.533   9.9441  130.946   17.168  104.742   12.199   55.750   3.8005   50.153   2.9976 5.597122 4.840391 
1 1 1   17    9  -10 o   48.101   2.4521   95.684   9.5826   98.647   16.432   94.156   11.796   48.170   4.2276   47.523   3.0614 0.6465569 5.219660 
1 1 1   17    9   -9 o   46.411   2.5341   89.177   9.5506   99.627   16.745   84.138   11.627   48.386   4.2899   44.869   3.2000 3.516842 5.351907 
1 1 1   17    9   -8 o   17.760   5.5110   13.715   8.8083   23.101   14.382   8.0802   11.143   22.580   7.0474   15.835   6.1050 6.745543 9.324042 
1 1 1   17    9   -7 o   28.574   4.2110   35.093   9.5146   24.556   16.660   40.193   11.591   23.294   7.6194   30.383   4.8424 -7.088831 9.027949 
1 1 1   17    9   -6 o   10.460   4.6772  -2.8668   8.1711   12.996   14.923  -9.6590   9.7649   18.834   7.1124   9.9474   4.6816 8.886395 8.514875 
1 1 1   17    9   -5 o   29.594   3.7588   37.215   8.8633   27.039   15.695   41.979   10.740   24.242   7.3253   31.262   4.3306 -7.020037 8.509662 
1 1 1   17    9   -4 o   70.800   1.9928  206.042   11.490  208.524   19.642  204.750   14.166   70.650   3.4209   70.418   2.4717 0.2317734 4.220450 
1 1 1   17    9   -3 o   10.009   4.5600  -4.5700   8.1996  -4.9397   14.664  -4.4019   9.8904   13.817   6.2151   11.218   5.0698 2.599117 8.020662 
1 1 1   17    9   -2 o   18.751   5.3046   15.547   8.4697   29.682   15.380   9.3952   10.147   25.345   7.1407   16.019   5.9008 9.326420 9.263352 
1 1 1   17    9   -1 o   46.627   2.5271   89.956   9.5689  106.882   17.120   82.266   11.540   50.192   4.2237   44.377   3.2118 5.814571 5.306104 
1 1 1   17    9    0 o   41.237   3.0453   70.913   10.165   72.814   16.119   69.657   13.097   41.071   4.9119   40.534   4.0166 0.5366478 6.345069 
1 1 1   17    9    1 o   37.926   3.8535   60.867   11.748   68.368   16.232   52.616   17.025   39.678   5.1392   34.189   6.3422 5.488720 8.163041 
1 1 1   17    9    2 o   50.804   2.7589  107.048   11.383  104.713   14.286  111.107   18.836   49.972   3.5299   51.006   4.5790 -1.034176 5.781630 
1 1 1   17    9    3 o   17.595   5.5719   13.340   8.9581   17.259   12.440   9.1185   12.910   19.954   6.5871   16.879   6.5541 3.074537 9.292245 
1 1 1   17    9    4 o   33.591   3.5172   47.569   9.4881   47.575   13.189   47.563   13.660   33.030   5.0593   32.941   5.2644 0.8952332E-01 7.301421 
1 1 1   17    9    5 o   72.176   1.8545  213.886   10.902  220.150   16.497  209.029   14.525   72.894   2.7814   71.135   2.5090 1.759346 3.745826 
1 1 1   17    9    6 o   49.090   2.3584   99.514   9.4097   84.725   14.159  111.213   12.593   44.766   3.9196   51.698   3.0011 -6.931545 4.936629 
1 1 1   17    9    7 o   52.555   2.3541  114.026   10.059  132.326   14.615   97.551   13.867   56.328   3.1961   48.203   3.5542 8.124870 4.779881 
1 1 1   17    9    8 o   14.285   5.5714   6.0284   9.3613  -3.8209   12.599   18.167   13.987   12.965   5.8020   20.531   6.9873 -7.565292 9.082132 
1 1 1   17    9    9 o   27.170   4.5267   32.051   9.6730   23.972   12.912   42.385   14.603   22.933   6.5701   30.699   6.0509 -7.765062 8.931976 
1 1 1   17    9   10 o   49.468   2.7357  101.541   10.989  100.459   14.697  102.912   16.547   48.839   3.7198   49.238   4.1617 -0.3987617 5.581827 
1 1 1   17    9   11 o   36.914   3.4093   57.296   10.143   55.414   13.815   59.496   14.938   35.742   4.8682   36.953   5.0947 -1.210720 7.046667 
1 1 1   17    9   12 o   29.979   4.2016   38.603   9.9860   65.189   14.472   14.438   13.797   38.897   4.6567   19.023   6.9007 19.87348 8.324951 
1 1 1   17    9   13 o   51.537   2.4811  109.879   10.392  113.827   16.137  107.081   13.585   51.930   3.8392   50.583   3.3128 1.346684 5.070915 
1 1 1   17    9   14 o   25.345   4.4523   27.963   8.8629   39.898   14.187   20.325   11.350   29.717   6.0623   21.214   6.1850 8.502922 8.660597 
1 1 1   17    9   15 o   49.016   2.5765   99.563   10.258  106.549   15.987   94.672   13.375   50.171   3.9406   47.472   3.4805 2.698723 5.257604 
1 1 1   17    9   16 o   8.0142   3.9049 -14.2016   8.2376 -13.2224   14.724 -14.6476   9.9384   12.251   5.7606   9.1507   4.4184 3.100530 7.259913 
1 1 1   17    9   17 o   31.107   3.4700   40.927   8.6491   26.373   14.345   49.241   10.842   23.864   6.9520   33.967   3.9917 -10.10316 8.016454 
1 1 1   17    9   18 o   21.720   5.0290   21.029   8.7281   33.758   15.974   15.611   10.421   26.818   7.1693   18.854   6.0143 7.964014 9.357911 
1 1 1   17    9   19 o   31.496   3.5870   42.069   9.0453   31.082   16.242   47.009   10.890   25.688   7.3717   33.118   4.1232 -7.429506 8.446490 
1 1 1   17    9   20 o   41.681   2.8321   72.396   9.5654   84.952   17.454   67.006   11.436   44.240   4.9232   39.839   3.5588 4.400703 6.074785 
1 1 1   17    9   21 o   34.930   3.4390   51.516   9.6652   41.152   18.490   55.412   11.338   29.339   7.6526   36.058   3.9204 -6.718592 8.598359 
1 1 1   17    9   22 o   59.764   2.8909  148.710   14.042  191.174   34.748  140.423   15.351   65.010   6.6508   57.903   3.2656 7.107792 7.409220 
1 1 1   17    9   23 o   50.015   2.6119  103.853   10.611  120.029   20.603   98.013   12.380   52.644   4.8559   48.381   3.1563 4.263721 5.791526 
1 1 1   17    9   24 o   68.185   1.9866  191.429   11.030  191.970   17.991  191.103   13.962   67.700   3.2697   67.915   2.5264 -0.2154770 4.132071 
1 1 1   17    9   25 o   17.735   5.6240   13.810   9.1236   21.577   14.053   8.1512   11.996   21.708   6.9900   16.047   6.2927 5.660547 9.405173 
1 1 1   17    9   26 o   23.283   4.8717   24.143   8.9487   35.459   16.181   19.156   10.741   27.304   7.1769   20.508   6.0272 6.795729 9.372030 
1 1 1   17    9   27 o   47.687   2.6111   94.546   10.111  130.854   18.590   79.293   12.049   55.335   4.1516   43.342   3.4387 11.99366 5.390771 
1 1 1   17    9   28 o   40.249   3.2605   68.235   10.606   65.437   17.781   69.780   13.214   38.061   5.9237   40.348   4.0735 -2.286228 7.189177 
1 1 1   17    9   29 o   51.050   2.5299  108.249   10.495  135.521   19.817   97.618   12.372   56.136   4.3649   48.216   3.1655 7.920219 5.391893 
1 1 1   17    9   30 o   41.504   3.2165   72.538   10.797   55.675   25.461   76.235   11.922   32.796   9.1689   42.441   3.4765 -9.645458 9.805843 
1 1 1   17    9   31 o   40.595   3.3346   69.617   10.937   90.549   26.066   65.143   12.049   43.447   7.6387   39.040   3.8358 4.406574 8.547672 
1 1 1   17    9   32 o   80.647   2.1704  268.728   14.255  305.628   33.898  260.801   15.712   83.634   4.9950   79.310   2.4332 4.324600 5.556104 
1 1 1   17    9   33 o   38.403   3.4675   62.594   10.738   80.436   26.393   59.055   11.755   40.218   8.3252   37.076   3.9501 3.141487 9.214800 
1 1 1   17    9   34 o   21.100   5.2544   20.296   9.0026   14.616   16.788   22.588   10.666   19.358   7.4856   22.079   5.8381 -2.720507 9.493032 
1 1 1   17    9   35 o   8.9347   4.2536  -9.8364   8.5132   12.961   16.367 -18.2920   9.9677   18.724   7.3479   8.5583   4.1966 10.16538 8.461841 
1 1 1   17    9   36 o   21.841   5.0920   21.683   8.8980   28.130   16.779   19.160   10.495   23.991   7.6290   20.337   5.9527 3.654404 9.676594 
1 1 1   17    9   37 o   17.436   5.8356   13.385   9.7560   10.774   16.094   14.901   12.267   17.951   7.2075   18.497   6.5300 -0.5463829 9.725677 
1 1 1   17    9   38 o   50.848   2.8027  108.239   11.572  112.717   18.936  105.570   14.620   50.767   4.6265   49.776   3.6281 0.9918251 5.879447 
1 1 1   17    9   39 o   25.747   5.7886   30.799   11.853   47.823   17.273   15.652   16.294   31.519   6.9137   19.449   7.4116 12.06953 10.13567 
1 1 1   17    9   40 o   52.502   2.7919  115.436   11.906  148.837   19.950   96.963   14.837   58.677   4.1988   47.523   3.8634 11.15483 5.705755 
1 1 1   17    9   41 o   43.235   3.6958   80.057   12.900   91.239   19.295   71.017   17.348   45.034   5.3611   39.560   5.5307 5.473835 7.702607 
1 1 1   17    9   42 o   13.739   5.5627   4.9889   9.6750   2.7621   16.206   6.2222   12.060   15.770   6.8329   15.149   6.1820 0.6207333 9.214426 
1 1 1   17    9   43 o   14.063   5.4821   6.5286   9.0604   15.841   17.132   2.9125   10.676   19.525   7.5586   13.475   5.6832 6.049773 9.456796 
1 1 1   17    9   44 o   36.475   3.3757   56.793   9.9231   59.353   18.374   55.739   11.790   35.190   6.6493   35.746   4.1218 -0.5559120 7.823142 
1 1 1   17    9   45 o   28.915   4.2170   36.837   9.6469   26.259   17.671   41.327   11.514   22.892   7.8523   30.329   4.8183 -7.436357 9.212682 
1 1 1   17    9   46 o   19.660   5.8506   18.209   10.069   18.417   24.722   18.167   11.025   21.240   8.7787   19.612   6.1776 1.627777 10.73447 
1 1 1   17    9   47 o   24.125   5.0090   26.705   9.5279   16.821   17.777   30.688   11.286   19.719   7.6813   25.597   5.5677 -5.878250 9.486901 
1 1 1   17    9   48 o   33.956   3.6811   49.953   10.026   54.224   18.239   48.104   12.003   33.067   6.9858   32.778   4.6201 0.2888107 8.375347 
1 1 1   17    9   49 o   28.017   4.8178   35.694   10.606   65.948   18.568   21.042   12.922   37.000   6.3874   20.716   6.7056 16.28378 9.260874 
1 1 1   17    9   50 o   15.596   5.6475   10.315   9.2356   28.714   17.442   3.1472   10.887   23.370   7.8024   13.470   5.7127 9.900332 9.670185 
1 1 1   17    9   51 o   43.065   3.2185   79.358   11.216   60.957   18.634   89.814   14.046   35.028   6.7711   45.389   3.8322 -10.36083 7.780295 
1 1 1   17    9   52 o   19.254   5.9127   17.933   10.171   20.661   17.523   16.547   12.490   20.439   7.7095   18.640   6.5884 1.798231 10.14116 
1 1 1   17    9   53 o   9.5143   4.5938 -13.9334   10.741 -42.9071   22.625  -5.5026   12.205   11.913   5.9276   11.839   5.4563 0.7427120E-01 8.056500 
1 1 1   17    9   54 o   17.198   6.0580   13.809   10.553   18.453   18.925   11.714   12.713   19.686   7.8456   16.707   6.4992 2.979609 10.18787 
1 1 1   17    9   55 o   22.199   5.8429   24.366   10.715   31.694   19.818   21.339   12.738   23.512   8.3000   20.419   6.6613 3.093428 10.64251 
1 1 1   17    9   56 o   45.886   3.1467   90.637   11.699  107.393   20.822   82.908   14.142   47.558   5.4706   43.119   4.0716 4.438808 6.819489 
1 1 1   17    9   57 o   43.733   3.2740   82.865   11.587   75.389   19.947   86.673   14.234   38.498   6.5934   44.099   4.0033 -5.600750 7.713633 
1 1 1   17    9   58 o   30.944   4.3790   43.781   10.737   47.987   18.828   41.754   13.071   29.121   7.7828   29.160   5.7035 -0.3872490E-01 9.648932 
1 1 1   17    9   59 o   14.168   5.7019   7.2191   10.097   24.657   18.030  -0.7487   12.188   20.894   7.8334   12.641   5.6779 8.252357 9.674717 
1 1 1   17    9   60 o   16.785   5.9345   13.706   10.135   7.2807   17.453   16.975   12.448   16.107   7.0335   18.232   6.5627 -2.125717 9.619713 
1 1 1   17    9   61 o   15.698   5.8471   11.409   10.013   7.0763   17.693   13.450   12.144   16.012   7.0344   16.766   6.3964 -0.7542419 9.507695 
1 1 1   17    9   62 o   15.660   5.8449   11.486   10.015  -1.1284   17.513   17.616   12.209   14.284   6.5660   18.296   6.5092 -4.012069 9.245617 
1 1 1   17    9   63 o   9.7729   4.6144  -7.3186   9.6265   9.1728   16.731 -15.4794   11.770   16.064   6.9516   9.6230   4.6841 6.440548 8.382462 
1 1 1   17    9   64 o   18.372   5.8840   17.690   9.9671   22.149   17.299   15.474   12.195   19.439   7.5758   17.264   6.4484 2.174965 9.948550 
1 1 1   17    9   65 o   13.195   5.4746   5.7131   9.6654   14.937   17.467   1.6424   11.604   17.379   7.2960   12.691   5.6305 4.688301 9.215984 
1 1 1   17    9   66 o   11.648   5.2487  -0.5829   10.511   13.826   17.028  -9.4535   13.360   16.982   7.1706   11.188   5.3268 5.794458 8.932710 
1 1 1   17    9   67 o   14.075   5.9496   6.7516   11.743   51.652   26.936  -3.7846   13.048   25.212   9.5477   12.011   5.5726 13.20148 11.05498 
1 1 1   17    9   68 o   9.9506   4.7982 -11.9952   11.625 -70.1200   24.675   4.5870   13.180   10.424   5.3051   13.860   6.0808 -3.436173 8.069691 
1 1 1   17    9   69 o   8.5215   4.2206 -20.1576   10.971  -8.2319   23.516 -23.4754   12.404   14.434   6.9250   8.9003   4.4219 5.533664 8.216377 
1 1 1   17    9   70 o   15.601   6.7765   9.5441   16.018   36.091   25.552  -7.6432   20.560   21.520   8.9125   13.737   6.5596 7.782290 11.06621 
1 1 1   17    9   71 o   16.064   6.8120   12.006   15.476 -11.8085   24.782   27.231   19.814   14.210   6.8892   20.056   8.0161 -5.845558 10.56974 
1 1 1   17    9   72 o   12.762   5.9706  -3.6039   15.481 -14.5581   24.172   4.0142   20.158   13.757   6.7001   15.162   6.9966 -1.404932 9.687247 
1 1 1   17    9   73 f   12.885   6.0192  -3.0106   15.639   11.767   25.872 -11.5197   19.632   17.003   7.8745   12.898   6.2236 4.104872 10.03693 
1 1 1   17    9   74 f   11.949   5.7244  -9.7212   15.938 -34.9736   24.982   7.6125   20.698   12.265   6.1227   15.745   7.2005 -3.480074 9.451745 
1 1 1   17    9   75 o   15.990   6.8688   12.166   16.102   26.968   25.633   2.5186   20.694   19.216   8.4537   14.904   6.9497 4.312457 10.94363 
1 1 1   17    9   76 o   17.041   7.1336   16.434   16.626   9.5300   25.823   21.323   21.728   16.505   7.7183   18.187   7.8959 -1.681627 11.04161 
1 1 1   17    9   77 o   15.063   6.6495   8.6651   15.989   7.3009   26.830   9.4163   19.910   16.255   7.6838   15.770   7.1534 0.4857645 10.49814 
1 1 1   17    9   78 o   12.884   6.0105  -1.8682   15.506 -29.3175   24.304   16.976   20.137   12.358   6.1480   17.161   7.5229 -4.803140 9.715538 
1 1 1   17    9   79 o   15.929   6.8525   12.710   16.070   38.349   25.592  -3.9827   20.650   21.016   8.8275   13.841   6.5992 7.174786 11.02149 
1 1 1   17    9   80 o   11.728   5.6357  -9.5991   15.718 -29.4378   24.469   4.3373   20.509   12.318   6.1347   14.888   6.9344 -2.570315 9.258513 
1 1 1   17    9   81 f   19.161   7.3276   24.646   15.963   28.439   26.242   22.418   20.112   18.875   8.4150   18.097   7.7228 0.7784386 11.42164 
1 1 1   17    9   82 o   15.332   6.4836   11.722   13.956   1.4051   18.927   24.013   20.659   14.082   6.5926   18.350   7.8290 -4.268243 10.23508 
1 1 1   17    9   83 o   10.967   5.4247 -22.7955   17.915 -22.7955   17.915   0.0000   0.0000   10.967   5.4247  ?   ?  0.000000 5.424696 
1 1 1   17    9   84 o   15.153   6.9182   7.8595   19.005   7.8595   19.005   0.0000   0.0000   15.153   6.9182  ?   ?  0.000000 6.918241 
1 1 1   17   10  -79 o   13.579   6.4998  -4.4443   20.451  -4.4443   20.451   0.0000   0.0000   13.579   6.4998  ?   ?  0.000000 6.499757 
1 1 1   17   10  -78 o   18.591   7.8843   25.614   20.736   25.614   20.736   0.0000   0.0000   18.591   7.8843  ?   ?  0.000000 7.884269 
1 1 1   17   10  -77 o   14.972   6.9340   6.4335   20.065   6.4335   20.065   0.0000   0.0000   14.972   6.9340  ?   ?  0.000000 6.933967 
1 1 1   17   10  -76 o   14.160   6.7425  -1.0591   21.413  -1.0591   21.413   0.0000   0.0000   14.160   6.7425  ?   ?  0.000000 6.742512 
1 1 1   17   10  -75 o   13.325   6.1906   0.4941   16.184 -11.8666   21.640   16.181   24.379   13.049   6.3516   16.902   7.7611 -3.853166 10.02885 
1 1 1   17   10  -74 o   13.612   6.2884   1.7288   16.350 -18.1572   21.429   29.438   25.295   12.429   6.1066   19.114   8.4037 -6.684793 10.38807 
1 1 1   17   10  -73 o   25.696   7.4026   42.531   16.348   20.830   21.334   73.401   25.444   17.808   7.7763   30.203   9.3656 -12.39577 12.17308 
1 1 1   17   10  -72 o   16.340   6.8758   14.562   15.571   16.920   20.406   11.274   24.091   17.075   7.5258   16.370   7.5874 0.7040367 10.68673 
1 1 1   17   10  -71 o   15.006   6.6210   8.7843   15.833   10.504   20.722   6.3728   24.541   15.976   7.2670   15.809   7.4344 0.1676769 10.39615 
1 1 1   17   10  -70 o   12.428   6.0753 -16.6257   20.406 -16.6257   20.406   0.0000   0.0000   12.428   6.0753  ?   ?  0.000000 6.075268 
1 1 1   17   10  -69 o   11.480   5.6595 -22.2656   18.936 -22.2656   18.936   0.0000   0.0000   11.480   5.6595  ?   ?  0.000000 5.659496 
1 1 1   17   10  -68 o   10.680   5.3449 -34.8595   19.588 -34.8595   19.588   0.0000   0.0000   10.680   5.3449  ?   ?  0.000000 5.344934 
1 1 1   17   10  -66 o   15.233   6.9991   5.3078   19.871   5.3078   19.871   0.0000   0.0000   15.233   6.9991  ?   ?  0.000000 6.999148 
1 1 1   17   10  -65 o   16.828   7.3969   13.947   19.589   13.947   19.589   0.0000   0.0000   16.828   7.3969  ?   ?  0.000000 7.396945 
1 1 1   17   10  -64 o   10.842   5.2669 -14.9979   14.684 -21.9092   19.482  -5.9062   22.344   11.812   5.8073   14.288   6.8269 -2.475958 8.962738 
1 1 1   17   10  -63 o   15.503   6.1249   11.666   11.439   10.395   20.521   12.239   13.778   16.398   7.3661   15.957   6.5704 0.4402256 9.870642 
1 1 1   17   10  -62 o   18.820   6.2858   19.713   11.320   14.018   18.904   22.898   14.135   16.996   7.3721   19.613   7.0010 -2.616907 10.16671 
1 1 1   17   10  -61 o   18.041   6.3299   17.917   11.514   2.2651   19.546   26.233   14.248   14.947   6.8946   20.935   7.0527 -5.987667 9.862853 
1 1 1   17   10  -60 o   15.213   5.7126   11.204   9.5972   8.7277   13.436   13.784   13.714   15.001   6.3534   16.542   6.6493 -1.541550 9.196680 
1 1 1   17   10  -59 o   11.636   5.0700   1.8979   9.0256  -3.5975   12.022   8.9969   13.664   11.618   5.3759   15.161   6.4135 -3.542858 8.368614 
1 1 1   17   10  -58 o   11.512   5.1206   0.3811   9.6606   15.885   15.797  -8.8821   12.210   17.435   7.0900   10.762   5.1151 6.672929 8.742511 
1 1 1   17   10  -57 o   12.156   5.2755   2.4963   9.6909   7.3379   15.986  -0.3165   12.185   15.326   6.7112   12.443   5.6249 2.883516 8.756714 
1 1 1   17   10  -56 o   18.320   5.8931   17.566   9.9899   17.153   16.723   17.795   12.457   18.009   7.3055   18.180   6.5622 -0.1706848 9.819980 
1 1 1   17   10  -55 o   17.491   5.8842   15.695   9.9180   17.186   16.600   14.868   12.368   18.125   7.3050   17.137   6.4742 0.9881821 9.761082 
1 1 1   17   10  -54 o   19.459   5.8318   19.558   9.9776  -1.5745   16.593   31.527   12.488   13.920   6.3959   24.438   6.2458 -10.51849 8.939674 
1 1 1   17   10  -53 o   16.165   6.1961   12.098   11.431   0.5589   27.594   14.489   12.559   16.937   7.9392   17.181   6.5166 -0.2441502 10.27115 
1 1 1   17   10  -52 o   15.539   6.0761   10.396   11.157   9.7536   27.570   10.522   12.201   18.279   8.3406   15.791   6.2974 2.488422 10.45095 
1 1 1   17   10  -51 o   28.097   5.2646   38.114   11.615   18.674   27.934   42.177   12.771   19.818   8.7671   29.350   5.5411 -9.531595 10.37138 
1 1 1   17   10  -50 o   32.320   4.0444   47.071   10.423   58.918   18.559   41.613   12.597   33.248   7.0659   29.253   5.4840 3.994347 8.944343 
1 1 1   17   10  -49 o   31.890   4.0992   45.844   10.410   15.701   18.044   60.881   12.744   18.441   7.5478   36.582   4.3595 -18.14182 8.716322 
1 1 1   17   10  -48 o   7.0279   3.5309 -24.4457   8.9630 -21.7733   16.974 -25.4789   10.554   11.475   5.5944   7.8909   3.9452 3.583948 6.845551 
1 1 1   17   10  -47 o   11.605   5.1058   0.0835   9.3518   25.494   17.402 -10.2345   11.089   21.555   7.7593   10.254   4.8738 11.30088 9.163007 
1 1 1   17   10  -46 o   28.754   4.3808   37.556   9.9443   27.688   17.973   41.910   11.938   22.355   7.9031   29.904   5.0789 -7.548450 9.394386 
1 1 1   17   10  -45 o   29.837   3.9052   39.491   9.2702   37.326   14.916   40.853   11.833   26.895   6.8006   29.563   5.0943 -2.667439 8.497071 
1 1 1   17   10  -44 o   12.751   5.2388   4.2141   8.7349   26.498   14.418  -8.7059   10.979   22.535   7.0599   10.536   4.9604 11.99887 8.628271 
1 1 1   17   10  -43 o   9.2435   4.3656  -7.9547   8.6272  -8.4805   14.152  -7.6438   10.883   12.235   5.7191   10.707   5.0081 1.528756 7.601908 
1 1 1   17   10  -42 o   38.542   3.1223   63.537   9.7254   76.896   15.537   54.930   12.471   41.255   4.7039   34.971   4.4773 6.284115 6.494087 
1 1 1   17   10  -41 o   17.447   5.7152   14.210   9.3720   12.704   14.373   15.324   12.361   17.567   6.8883   18.193   6.5407 -0.6255169 9.498923 
1 1 1   17   10  -40 o   17.648   5.8242   14.514   9.7258   6.1870   14.361   21.568   13.219   15.660   6.5974   20.846   6.7849 -5.186060 9.463593 
1 1 1   17   10  -39 o   10.479   4.8139  -4.8958   9.3942  -0.6571   13.861  -8.4971   12.776   13.788   6.1334   11.653   5.4426 2.135124 8.200019 
1 1 1   17   10  -38 o   17.528   5.8725   14.108   9.8794   15.105   14.437   13.230   13.548   18.534   6.9964   17.723   6.7572 0.8104115 9.726759 
1 1 1   17   10  -37 o   38.789   2.9186   63.671   9.1606   64.978   15.280   62.937   11.446   37.842   5.0817   38.127   3.7304 -0.2849579 6.303959 
1 1 1   17   10  -36 o   12.292   5.0443   3.4267   8.0857   7.0864   14.238   1.6847   9.8234   16.026   6.6465   12.586   5.3850 3.439284 8.554168 
1 1 1   17   10  -35 o   51.481   2.3214  110.396   9.7165  121.212   16.682  104.842   11.954   52.943   3.8926   49.835   2.9558 3.107533 4.887698 
1 1 1   17   10  -34 f   18.523   5.1429   15.837   8.0402   6.7141   14.062   20.268   9.8000   15.910   6.6025   20.751   5.6450 -4.841356 8.686697 
1 1 1   17   10  -33 o   40.073   2.8130   67.604   9.1303   54.128   15.526   74.728   11.288   34.143   5.7849   41.877   3.3344 -7.733875 6.677062 
1 1 1   17   10  -32 o   16.307   5.3293   11.818   8.1513   10.640   14.130   12.406   9.9793   17.181   6.8010   16.881   5.8952 0.2999458 9.000400 
1 1 1   17   10  -31 o   14.552   5.4380   8.0099   8.6750   10.677   14.156   6.4058   10.978   17.222   6.8104   14.759   5.9433 2.463321 9.039096 
1 1 1   17   10  -30 o   20.658   5.3366   19.748   9.0497   1.6989   14.359   31.641   11.656   14.769   6.4155   26.089   5.6451 -11.32018 8.545468 
1 1 1   17   10  -29 o   17.174   5.8289   13.013   9.7330   16.351   14.137   10.004   13.420   19.231   6.9839   16.841   6.6400 2.390514 9.636614 
1 1 1   17   10  -28 f   25.724   4.1779   29.109   8.4601   34.316   14.474   26.407   10.427   26.651   6.6771   23.898   5.4707 2.753204 8.632079 
1 1 1   17   10  -27 o   16.853   5.3658   12.696   8.2983   5.8133   13.995   16.428   10.305   15.764   6.5680   18.902   5.9750 -3.137897 8.879110 
1 1 1   17   10  -26 o   12.403   5.0415   3.6141   7.9828   16.472   14.035  -2.5342   9.7054   19.315   6.9664   11.392   5.0956 7.923080 8.631085 
1 1 1   17   10  -25 o   21.933   4.8102   21.742   8.3625   11.570   13.943   27.457   10.451   17.564   6.8137   24.449   5.3892 -6.884533 8.687400 
1 1 1   17   10  -24 o   37.108   2.9985   58.054   8.9929   61.525   15.221   56.192   11.146   37.052   5.1811   36.124   3.8443 0.9279022 6.451533 
1 1 1   17   10  -23 o   13.938   5.2478   6.9823   8.1104   12.631   14.094   4.1860   9.9168   17.984   6.8834   13.598   5.5839 4.385753 8.863503 
1 1 1   17   10  -22 o   32.007   3.8128   44.152   9.7523   17.226   21.237   51.347   10.978   20.834   8.3083   34.465   3.9808 -13.63054 9.212768 
1 1 1   17   10  -21 o   7.4343   3.6842 -18.6712   8.4056 -35.7965   19.634 -14.8283   9.3010   11.684   5.7609   8.6063   4.1835 3.078163 7.119683 
1 1 1   17   10  -20 o   23.972   4.9711   25.937   9.3949   17.308   20.824   28.142   10.527   20.828   8.2526   24.820   5.3603 -3.991880 9.840633 
1 1 1   17   10  -19 o   12.849   5.1339   4.4427   8.1245   4.5611   14.312   4.3865   9.8687   15.618   6.5833   13.674   5.5876 1.944870 8.634860 
1 1 1   17   10  -18 f   64.036   2.1836  169.684   11.381  187.589   20.788  162.020   13.601   66.290   3.8639   62.332   2.6831 3.957630 4.704089 
1 1 1   17   10  -17 o   30.073   3.6798   38.820   8.8330   37.443   15.215   39.520   10.848   28.010   6.7451   29.946   4.5903 -1.935762 8.158831 
1 1 1   17   10  -16 o   17.631   5.3778   13.956   8.4320  -4.9041   14.576   23.441   10.337   13.517   6.1272   22.545   5.6395 -9.028171 8.327498 
1 1 1   17   10  -15 o   47.785   2.9989   95.819   11.622  109.021   19.020   87.952   14.682   49.956   4.7270   45.258   4.0216 4.698235 6.206220 
1 1 1   17   10  -14 o   25.003   4.8669   27.963   9.5622   25.008   22.716   28.600   10.542   23.309   8.7810   25.096   5.3185 -1.787628 10.26609 
1 1 1   17   10  -13 o   28.954   4.2028   36.495   9.6297   34.467   21.883   36.982   10.724   26.147   8.7395   28.924   4.7102 -2.777649 9.928043 
1 1 1   17   10  -12 o   29.243   4.2005   37.202   9.7258   45.809   22.443   35.212   10.792   29.896   8.6919   28.136   4.8822 1.759033 9.969244 
1 1 1   17   10  -11 o   36.411   3.4746   56.308   10.188   50.661   17.932   59.000   12.380   32.661   6.9492   36.953   4.1833 -4.292751 8.111156 
1 1 1   17   10  -10 o   15.793   5.6994   9.9105   9.3960   13.463   21.175   9.0395   10.485   20.092   8.1943   15.754   5.9589 4.337057 10.13190 
1 1 1   17   10   -9 o   27.273   4.1107   32.328   8.8550   52.027   15.599   22.963   10.756   33.794   5.8761   22.296   5.8471 11.49804 8.289577 
1 1 1   17   10   -8 o   53.059   2.3888  116.770   10.305  120.770   17.564  114.670   12.726   53.091   4.0901   52.320   2.9965 0.7705994 5.070279 
1 1 1   17   10   -7 o   13.094   5.3197   3.9776   8.8827   3.9128   16.739   4.0030   10.480   16.468   7.0372   13.887   5.7253 2.580807 9.071993 
1 1 1   17   10   -6 o   33.866   3.4112   48.662   9.2886   29.506   15.858   58.667   11.460   24.757   7.3361   37.022   3.8538 -12.26523 8.286787 
1 1 1   17   10   -5 o   46.463   2.9461   90.396   11.101  100.237   16.728   82.652   14.839   48.232   4.2998   43.819   4.2059 4.413235 6.014783 
1 1 1   17   10   -4 o   67.044   2.7935  187.376   15.233  201.422   21.480  173.165   21.607   68.840   3.8432   63.565   4.1934 5.274258 5.688098 
1 1 1   17   10   -3 o   36.349   4.1051   56.906   11.951   59.596   16.188   53.683   17.717   36.390   5.6396   33.901   6.6490 2.488865 8.718641 
1 1 1   17   10   -2 o   19.350   5.7274   17.008   9.6705   13.748   15.124   19.263   12.578   18.796   7.1458   20.522   6.6135 -1.726227 9.736553 
1 1 1   17   10   -1 o   41.084   3.1700   71.038   10.534   73.630   16.386   69.213   13.752   40.895   5.0206   40.039   4.2800 0.8564758 6.597339 
1 1 1   17   10    0 o   17.052   5.7973   12.431   9.6283   17.954   15.150   8.6883   12.470   20.274   7.2469   16.318   6.4108 3.956156 9.675497 
1 1 1   17   10    1 o   27.787   4.0573   33.450   8.9190   57.675   15.684   21.871   10.843   35.846   5.5464   21.768   5.9444 14.07809 8.130123 
1 1 1   17   10    2 o   16.039   5.4829   10.801   8.6142   1.0076   15.038   15.584   10.509   15.106   6.5636   18.687   6.0473 -3.580462 8.924682 
1 1 1   17   10    3 o   51.131   2.4679  108.548   10.256   92.603   17.246  117.272   12.757   46.145   4.6481   52.936   2.9681 -6.791286 5.514982 
1 1 1   17   10    4 o   21.807   5.1043   21.487   8.9120   9.0849   15.405   27.726   10.926   17.402   7.0287   24.642   5.5706 -7.240446 8.968562 
1 1 1   17   10    5 o   20.617   5.2391   19.293   8.8216   31.108   15.205   13.299   10.831   25.488   7.0709   17.675   6.1435 7.812700 9.366942 
1 1 1   17   10    6 o   14.264   5.6391   6.0055   9.7025   4.6732   15.121   6.9380   12.650   16.059   6.7677   15.783   6.3713 0.2762451 9.294906 
1 1 1   17   10    7 o   54.440   2.6973  123.484   11.933  130.246   19.941  119.712   14.893   54.877   4.4971   53.234   3.4508 1.643372 5.668538 
1 1 1   17   10    8 o   19.839   5.8228   17.993   10.030   31.081   17.314   11.382   12.306   25.253   7.7070   17.225   6.4686 8.027639 10.06184 
1 1 1   17   10    9 o   23.188   5.4691   24.556   10.169   31.138   17.096   20.953   12.650   25.281   7.6465   21.240   6.6065 4.040453 10.10517 
1 1 1   17   10   10 o   29.026   3.7808   36.220   8.7330   44.309   14.009   31.079   11.169   31.212   5.7167   26.169   5.4145 5.043171 7.873833 
1 1 1   17   10   11 o   16.224   5.4734   11.222   8.5815   0.4172   13.850   17.954   10.933   14.409   6.2793   19.813   6.1384 -5.404628 8.781173 
1 1 1   17   10   12 o   36.316   3.1173   55.591   9.1389   59.462   14.895   53.254   11.573   36.587   5.1354   35.112   4.1220 1.475208 6.585077 
1 1 1   17   10   13 o   51.894   2.4876  111.925   10.492  103.908   18.563  115.689   12.719   48.785   4.7272   52.541   2.9820 -3.755661 5.589114 
1 1 1   17   10   14 o   15.830   5.6364   10.175   9.1562   23.965   18.015   5.3721   10.632   22.591   7.9184   14.401   5.8311 8.190012 9.833797 
1 1 1   17   10   15 o   41.305   3.0403   71.740   10.165   82.867   20.201   67.967   11.763   42.669   5.9712   39.928   3.6545 2.741421 7.000732 
1 1 1   17   10   16 o   18.412   5.5619   15.355   9.0491   41.707   18.007   6.4522   10.467   29.142   7.5276   14.710   5.8436 14.43190 9.529574 
1 1 1   17   10   17 o   24.679   4.4527   26.932   8.6280   19.998   14.282   30.917   10.827   20.829   7.0610   26.115   5.2679 -5.286526 8.809542 
1 1 1   17   10   18 f   50.471   2.6391  106.242   10.820  113.554   16.123  100.251   14.595   51.525   3.8669   48.482   3.7214 3.042835 5.366697 
1 1 1   17   10   19 o   40.644   2.7912   69.206   9.1915   58.935   14.796   75.660   11.729   36.341   5.1379   42.217   3.4381 -5.875942 6.182101 
1 1 1   17   10   20 o   32.251   3.6415   44.578   9.4060   24.610   17.565   52.605   11.137   22.676   7.8267   34.903   3.9860 -12.22652 8.783269 
1 1 1   17   10   21 o   12.443   5.2106   2.3761   8.8750   1.3633   16.869   2.7637   10.436   15.793   6.9053   13.384   5.6303 2.409602 8.909762 
1 1 1   17   10   22 o   50.802   2.5829  107.619   10.661   86.676   19.505  116.543   12.731   43.797   5.5905   52.679   2.9769 -8.881416 6.333698 
1 1 1   17   10   23 o   14.069   5.4959   6.3510   9.1212   7.8802   18.121   5.8321   10.556   17.716   7.4339   14.466   5.8271 3.249853 9.445485 
1 1 1   17   10   24 o   37.520   3.2119   59.627   9.7289   61.986   17.775   58.618   11.625   36.520   6.1919   36.859   3.9295 -0.3392830 7.333583 
1 1 1   17   10   25 o   60.783   2.3002  153.324   11.376  149.001   20.198  155.333   13.768   58.670   4.2522   60.931   2.7793 -2.260983 5.079918 
1 1 1   17   10   26 o   45.465   2.7985   86.665   10.321  112.967   18.918   75.519   12.315   50.767   4.6221   42.028   3.6303 8.738823 5.877295 
1 1 1   17   10   27 o   22.064   5.0937   22.250   8.9759   43.551   14.903   10.126   11.244   30.426   6.2191   16.284   6.1682 14.14259 8.759219 
1 1 1   17   10   28 f   63.286   2.2937  166.268   11.813  177.518   17.540  156.927   15.981   64.746   3.3346   60.938   3.2288 3.808392 4.641655 
1 1 1   17   10   29 o   35.875   4.1665   56.084   11.958   47.993   17.644   62.956   16.262   31.340   7.0749   37.172   5.5355 -5.832129 8.983082 
1 1 1   17   10   30 o   23.340   6.0582   25.837   11.625   19.004   17.219   31.561   15.760   20.536   7.6640   25.194   7.2713 -4.658173 10.56449 
1 1 1   17   10   31 o   39.582   3.9415   67.820   12.549   73.489   18.827   63.289   16.833   39.796   5.9893   37.056   5.7595 2.739815 8.309262 
1 1 1   17   10   32 o   43.960   3.6028   82.811   12.797  103.237   19.111   66.207   17.230   48.124   4.9418   37.882   5.7611 10.24190 7.590240 
1 1 1   17   10   33 o   35.379   3.7688   54.110   10.702   59.503   18.057   51.189   13.287   35.276   6.5196   33.707   4.9860 1.568275 8.207629 
1 1 1   17   10   34 f   19.625   5.8832   18.138   10.153   18.389   17.092   18.001   12.622   20.170   7.6128   19.587   6.6378 0.5828800 10.10027 
1 1 1   17   10   35 o   12.569   5.3932   1.4529   9.9060   0.7886   16.482   1.8285   12.394   15.276   6.7471   13.869   5.9925 1.406829 9.024010 
1 1 1   17   10   36 o   22.133   5.6184   23.134   10.153   34.310   17.191   17.148   12.581   25.783   7.6375   19.171   6.6236 6.611725 10.10951 
1 1 1   17   10   37 o   69.598   2.3760  201.971   13.460  231.602   22.733  185.975   16.703   73.251   3.8203   66.259   3.1010 6.992210 4.920512 
1 1 1   17   10   38 o   11.988   5.2683  -0.3805   9.9305  -4.8941   16.366   2.2496   12.493   14.004   6.4036   13.956   6.0232 0.4759789E-01 8.791216 
1 1 1   17   10   39 o   31.801   4.1875   44.760   10.592   36.181   17.484   49.734   13.312   26.219   7.6855   32.935   5.1253 -6.716419 9.237702 
1 1 1   17   10   40 o   18.360   5.9954   15.939   10.317   15.866   16.874   15.983   13.038   19.043   7.4645   18.570   6.7122 0.4732075 10.03852 
1 1 1   17   10   41 o   30.140   4.4764   40.863   10.664   36.840   17.281   43.338   13.553   26.355   7.6165   30.216   5.7116 -3.861069 9.520172 
1 1 1   17   10   42 o   43.897   3.2823   82.709   11.660   98.876   19.120   73.137   14.712   46.404   5.1409   40.348   4.5526 6.055805 6.866990 
1 1 1   17   10   43 o   29.783   4.5566   40.228   10.711   47.365   18.076   36.366   13.297   30.000   7.4306   27.205   6.1422 2.794147 9.640554 
1 1 1   17   10   44 o   18.168   6.8558   15.214   13.860   29.244   17.154 -11.1722   23.524   23.219   7.7373   15.282   7.2148 7.937894 10.57918 
1 1 1   17   10   45 o   12.376   5.7015  -5.2347   13.306  -5.1006   17.016  -5.4458   21.346   13.943   6.4319   15.340   7.1210 -1.397403 9.595710 
1 1 1   17   10   46 o   17.656   6.3679   14.810   11.727   31.504   17.399   0.9101   15.876   23.781   7.7869   14.618   6.5293 9.162868 10.16209 
1 1 1   17   10   47 o   11.640   5.2915  -3.0323   10.966   15.713   23.787  -8.0914   12.358   19.357   8.3323   11.312   5.3057 8.045133 9.878101 
1 1 1   17   10   48 o   14.537   5.9389   7.0772   11.146 -18.2407   23.769   14.213   12.619   14.266   6.8746   17.391   6.5462 -3.124945 9.492775 
1 1 1   17   10   49 o   11.549   5.2745  -3.3875   11.059 -41.8009   23.225   7.8761   12.576   11.982   5.9689   15.173   6.2652 -3.190679 8.653358 
1 1 1   17   10   50 o   9.4435   4.5337 -11.3372   10.116 -28.6015   17.605  -2.8258   12.361   10.976   5.4196   12.265   5.5919 -1.289155 7.787238 
1 1 1   17   10   51 o   13.755   5.6623   5.9990   10.229  -1.0547   17.315   9.7810   12.678   14.441   6.5971   15.700   6.3637 -1.258625 9.166200 
1 1 1   17   10   52 o   31.963   4.2759   46.780   10.862   40.277   18.250   50.347   13.516   26.090   7.9024   32.258   5.3257 -6.168890 9.529482 
1 1 1   17   10   53 o   13.216   5.5643   4.6536   10.205   21.947   17.524  -4.2224   12.554   19.798   7.6499   11.957   5.5189 7.841372 9.432843 
1 1 1   17   10   54 o   11.822   5.2430   0.3565   10.053   3.8748   17.266  -1.4477   12.364   15.142   6.7828   12.405   5.6312 2.736422 8.815693 
1 1 1   17   10   55 o   10.982   5.0308  -3.0503   10.161  -1.1721   17.296  -4.0401   12.556   14.135   6.5077   11.900   5.5020 2.235690 8.521843 
1 1 1   17   10   56 o   24.544   5.3828   30.227   10.472   33.567   17.882   28.483   12.920   23.098   7.8996   22.663   6.5965 0.4350281 10.29161 
1 1 1   17   10   57 o   31.064   6.7384   53.034   16.571   0.0000   0.0000   53.034   16.571  ?   ?    31.064   6.7384 0.000000 6.738449 
1 1 1   17   10   58 o   23.978   5.4838   29.338   10.485   32.115   17.686   27.833   13.019   22.404   7.8464   22.170   6.6657 0.2338753 10.29548 
1 1 1   17   10   59 o   11.420   5.2415  -2.6078   11.104 -11.6693   26.011  -0.5884   12.279   14.693   7.1075   12.359   5.6107 2.334081 9.055146 
1 1 1   17   10   60 o   17.982   6.6325   17.969   12.826   55.688   27.167   7.1514   14.550   26.004   9.6417   14.828   6.4493 11.17592 11.59978 
1 1 1   17   10   61 o   14.724   6.1945   8.4319   12.632   22.275   26.405   4.3234   14.385   18.981   8.4530   14.097   6.2608 4.884285 10.51907 
1 1 1   17   10   62 o   11.671   5.4334  -4.2060   12.567 -17.5161   26.598  -0.3806   14.259   14.155   6.9231   13.037   5.9674 1.118454 9.139956 
1 1 1   17   10   63 o   17.913   6.6447   18.137   12.906   40.243   27.722   12.020   14.582   21.961   9.2036   15.990   6.6864 5.971092 11.37600 
1 1 1   17   10   64 o   15.341   7.3774  -4.4397   27.045  -4.4397   27.045   0.0000   0.0000   15.341   7.3774  ?   ?  0.000000 7.377410 
1 1 1   17   10   65 o   13.683   5.9402   5.5352   12.296   15.118   26.767   2.9720   13.843   17.545   8.0841   13.493   6.0564 4.052687 10.10116 
1 1 1   17   10   66 o   12.917   5.7502   2.7705   12.206  -5.8084   26.192   5.1504   13.795   14.930   7.2000   13.938   6.1637 0.9921064 9.477952 
1 1 1   17   10   67 o   15.417   6.8359   8.9715   17.080   27.088   27.891  -1.8986   21.604   19.176   8.6030   14.490   6.8628 4.686175 11.00502 
1 1 1   17   10   68 o   18.921   7.4964   23.226   17.181   36.625   27.009   14.118   22.267   20.801   8.9149   16.911   7.6282 3.889750 11.73306 
1 1 1   17   10   69 o   18.701   7.4622   22.662   17.143   0.3799   26.247   39.238   22.638   15.453   7.3875   22.167   8.6585 -6.713992 11.38176 
1 1 1   17   10   70 o   13.052   6.3650 -14.5148   22.011   0.0000   0.0000 -14.5148   22.011  ?   ?    13.052   6.3650 0.000000 6.365020 
1 1 1   17   10   71 o   18.616   8.0291   24.449   22.171   0.0000   0.0000   24.449   22.171  ?   ?    18.616   8.0291 0.000000 8.029096 
1 1 1   17   10   72 o   16.489   7.5566   12.701   22.958   0.0000   0.0000   12.701   22.958  ?   ?    16.489   7.5566 0.000000 7.556577 
1 1 1   17   10   73 o   15.555   7.1908   7.8582   21.433   0.0000   0.0000   7.8582   21.433  ?   ?    15.555   7.1908 0.000000 7.190758 
1 1 1   17   10   74 o   12.987   6.3002 -10.9185   20.812   0.0000   0.0000 -10.9185   20.812  ?   ?    12.987   6.3002 0.000000 6.300201 
1 1 1   17   10   75 o   15.057   7.0566   4.9115   21.784   0.0000   0.0000   4.9115   21.784  ?   ?    15.057   7.0566 0.000000 7.056561 
1 1 1   17   10   76 o   13.173   6.3547  -7.6997   20.439   0.0000   0.0000  -7.6997   20.439  ?   ?    13.173   6.3547 0.000000 6.354728 
1 1 1   17   10   77 o   12.419   6.0823 -15.5910   20.743   0.0000   0.0000 -15.5910   20.743  ?   ?    12.419   6.0823 0.000000 6.082309 
1 1 1   17   11  -73 o   14.447   6.7941   2.7215   20.495   2.7215   20.495   0.0000   0.0000   14.447   6.7941  ?   ?  0.000000 6.794131 
1 1 1   17   11  -72 o   11.393   5.6138 -19.4894   18.548 -19.4894   18.548   0.0000   0.0000   11.393   5.6138  ?   ?  0.000000 5.613771 
1 1 1   17   11  -71 o   23.044   7.4307   36.203   15.877   31.519   20.395   43.407   25.292   19.917   8.0721   21.476   8.8782 -1.558661 11.99923 
1 1 1   17   11  -70 o   13.523   6.2199   2.8365   15.750   9.7409   20.542  -7.0109   24.532   15.456   7.1071   13.971   6.7921 1.484582 9.830733 
1 1 1   17   11  -69 o   12.311   5.8237  -4.1793   15.466   2.7881   20.053 -14.4074   24.297   14.395   6.7541   13.304   6.5293 1.091776 9.394135 
1 1 1   17   11  -68 o   22.286   7.5528   34.428   16.341   29.253   21.729   41.166   24.792   19.296   8.1214   21.322   8.7998 -2.025293 11.97471 
1 1 1   17   11  -67 o   16.638   6.9929   16.219   16.075   15.547   21.081   17.152   24.849   16.658   7.4759   17.060   7.8344 -0.4016609 10.82902 
1 1 1   17   11  -66 o   11.655   5.5792  -8.3273   15.078 -14.2814   19.337   0.9088   24.084   12.247   5.9708   14.930   7.1207 -2.682684 9.292709 
1 1 1   17   11  -65 o   12.167   5.7724  -5.6954   15.413 -13.6720   19.944   6.1330   24.287   12.497   6.0864   15.623   7.3620 -3.125371 9.552148 
1 1 1   17   11  -64 o   12.980   6.3940 -19.4627   24.001   0.0000   0.0000 -19.4627   24.001  ?   ?    12.980   6.3940 0.000000 6.394011 
1 1 1   17   11  -63 o   10.905   5.3228 -15.8561   15.500 -17.9101   20.519 -13.1263   23.655   12.290   6.0254   13.507   6.5894 -1.217265 8.928873 
1 1 1   17   11  -62 o   13.128   6.1356  -1.7254   16.279 -10.9074   22.079   9.2103   24.096   13.411   6.5020   16.170   7.5263 -2.758338 9.945928 
1 1 1   17   11  -61 o   12.529   5.8798  -3.6198   15.209  -4.4374   19.598  -2.3819   24.116   13.615   6.4739   14.779   7.0699 -1.164147 9.586166 
1 1 1   17   11  -60 o   17.274   6.9335   17.352   14.889   0.0000   0.0000   17.352   14.889  ?   ?    17.274   6.9335 0.000000 6.933484 
1 1 1   17   11  -59 o   17.055   6.9421   16.548   15.161   0.0000   0.0000   16.548   15.161  ?   ?    17.055   6.9421 0.000000 6.942145 
1 1 1   17   11  -58 o   15.504   6.5978   10.936   14.607   0.0000   0.0000   10.936   14.607  ?   ?    15.504   6.5978 0.000000 6.597816 
1 1 1   17   11  -57 o   18.330   7.0145   20.197   14.634   0.0000   0.0000   20.197   14.634  ?   ?    18.330   7.0145 0.000000 7.014452 
1 1 1   17   11  -56 o   18.468   6.9762   20.342   14.360   0.0000   0.0000   20.342   14.360  ?   ?    18.468   6.9762 0.000000 6.976230 
1 1 1   17   11  -55 o   15.555   6.5322   10.903   14.009   0.0000   0.0000   10.903   14.009  ?   ?    15.555   6.5322 0.000000 6.532224 
1 1 1   17   11  -54 o   17.927   6.4092   17.961   11.851   47.096   20.765   3.8883   14.432   25.846   8.5094   13.934   6.2244 11.91141 10.54292 
1 1 1   17   11  -53 o   17.069   6.3743   15.738   11.915  -8.0971   20.434   28.019   14.667   13.644   6.5215   21.434   7.1548 -7.790437 9.680990 
1 1 1   17   11  -52 o   9.0796   4.4174 -13.4653   10.432 -10.2083   20.142 -14.6592   12.195   13.332   6.3995   9.8234   4.7786 3.508140 7.986735 
1 1 1   17   11  -51 o   16.849   6.0945   14.989   10.752   45.354   21.910   5.3577   12.339   25.035   8.7356   13.788   5.9684 11.24699 10.57981 
1 1 1   17   11  -50 o   30.706   4.6477   45.210   11.270   33.216   22.217   49.366   13.077   21.609   8.5361   31.444   5.2893 -9.835817 10.04200 
1 1 1   17   11  -49 o   16.948   5.9093   14.980   10.025   5.8056   17.612   19.376   12.193   15.260   6.8421   18.669   6.5165 -3.408855 9.448706 
1 1 1   17   11  -48 o   14.839   5.7345   10.037   9.8481   28.219   17.281   1.2929   11.985   21.199   7.7182   12.723   5.6785 8.476356 9.582080 
1 1 1   17   11  -47 o   15.485   5.8553   11.411   10.122   11.422   17.530   11.406   12.397   16.574   7.1439   15.792   6.3309 0.7821398 9.545440 
1 1 1   17   11  -46 o   32.203   4.1782   47.852   10.710   78.364   18.688   32.932   13.068   39.015   6.0738   24.648   6.4358 14.36684 8.849343 
1 1 1   17   11  -45 o   13.909   6.0113   4.7138   12.478   4.9758   17.352   4.4331   17.958   15.311   6.8334   15.349   6.8931 -0.3728485E-01 9.706178 
1 1 1   17   11  -44 o   20.281   6.9247   22.877   13.739   26.436   17.193   16.589   22.853   21.107   7.6964   18.596   8.0854 2.511271 11.16283 
1 1 1   17   11  -43 o   16.310   6.3756   12.204   12.282   39.768   17.378 -15.3007   17.359   26.047   7.6695   12.201   5.8784 13.84542 9.663235 
1 1 1   17   11  -42 o   17.925   5.9302   16.264   10.081   15.785   17.406   16.506   12.366   18.090   7.4096   17.980   6.5315 0.1098747 9.877415 
1 1 1   17   11  -41 o   21.569   5.7426   23.525   10.275   11.449   17.469   29.913   12.705   17.063   7.2366   23.838   6.4031 -6.774893 9.662725 
1 1 1   17   11  -40 o   55.232   2.7400  130.111   12.297  123.158   20.972  133.754   15.181   51.041   5.1094   55.369   3.3797 -4.328045 6.126029 
1 1 1   17   11  -39 o   41.687   4.1527   78.380   13.924   0.0000   0.0000   78.380   13.924  ?   ?    41.687   4.1527 0.000000 4.152705 
1 1 1   17   11  -38 o   30.150   4.0544   40.976   9.7121   38.417   15.210   42.737   12.620   26.821   6.9131   29.767   5.3999 -2.945526 8.772099 
1 1 1   17   11  -37 o   18.294   5.6184   16.469   9.1830   3.9057   14.415   25.049   11.913   14.667   6.3987   22.040   6.3099 -7.372561 8.986590 
1 1 1   17   11  -36 o   21.354   5.3886   22.205   9.3784   32.710   14.966   15.413   12.034   24.662   7.0760   17.825   6.4478 6.836441 9.573089 
1 1 1   17   11  -35 o   36.795   3.3729   58.857   10.004   57.973   15.532   59.484   13.078   34.651   5.6967   36.113   4.5430 -1.461208 7.286359 
1 1 1   17   11  -34 o   12.474   5.2537   3.1465   9.1030  -7.1758   14.540   9.8011   11.674   12.528   5.8363   15.718   6.1944 -3.190442 8.510711 
1 1 1   17   11  -33 o   34.003   3.6559   50.703   9.9743   48.365   15.706   52.283   12.912   31.084   6.4115   33.686   4.8414 -2.602020 8.034087 
1 1 1   17   11  -32 o   28.622   4.2318   36.844   9.5762   28.867   14.847   42.527   12.531   23.381   7.1369   30.029   5.3138 -6.648254 8.897877 
1 1 1   17   11  -31 f   13.205   5.3902   4.9225   9.1717  -5.4519   14.632   11.636   11.771   12.964   5.9747   16.523   6.2988 -3.559321 8.681714 
1 1 1   17   11  -30 o   18.019   5.6434   15.504   9.2139   34.533   14.757   3.3469   11.796   25.899   6.8760   13.803   5.9030 12.09609 9.062281 
1 1 1   17   11  -29 o   30.172   4.0133   40.351   9.6261   41.730   15.103   39.408   12.492   28.876   6.5655   28.840   5.5148 0.3598404E-01 8.574318 
1 1 1   17   11  -28 o   20.966   6.3195   21.776   11.691   24.785   19.278   20.025   14.704   21.796   8.1141   20.106   7.1444 1.689510 10.81120 
1 1 1   17   11  -27 o   24.511   4.9680   27.848   9.5859   46.091   19.751   22.227   10.964   29.125   8.0507   21.321   6.0365 7.803873 10.06251 
1 1 1   17   11  -26 o   11.956   5.1872   0.7295   9.3634 -24.2101   19.273   8.4342   10.713   12.397   6.0252   15.180   5.9483 -2.782546 8.466728 
1 1 1   17   11  -25 o   23.497   4.7129   25.279   8.7125   29.334   14.352   22.912   10.964   24.020   6.9410   21.715   5.9966 2.305105 9.172585 
1 1 1   17   11  -24 o   19.612   5.5929   18.292   9.3775   29.606   14.579   10.309   12.247   24.127   7.0029   16.337   6.3723 7.790035 9.468134 
1 1 1   17   11  -23 o   21.698   5.3993   22.213   9.5113   14.252   14.830   27.776   12.397   18.272   7.0435   23.808   6.2933 -5.536329 9.445453 
1 1 1   17   11  -22 o   15.667   5.6622   10.363   9.2779   2.1505   14.438   16.140   12.109   14.713   6.4116   18.624   6.4945 -3.910119 9.126174 
1 1 1   17   11  -21 o   13.198   5.2926   5.0775   8.6667   10.458   14.909   2.3311   10.651   17.150   6.9191   13.163   5.6190 3.986747 8.913251 
1 1 1   17   11  -20 o   20.000   5.2825   18.712   8.7388 -11.5648   14.844   34.769   10.811   12.201   5.7513   27.586   4.9912 -15.38540 7.615138 
1 1 1   17   11  -19 o   38.699   3.0475   63.563   9.5360   67.256   16.197   61.604   11.797   38.340   5.3261   37.624   3.9033 0.7153702 6.603278 
1 1 1   17   11  -18 o   15.920   5.7489   10.668   9.5616  -6.6740   15.154   22.137   12.324   13.205   6.0838   21.334   6.5006 -8.128500 8.903369 
1 1 1   17   11  -17 o   35.002   3.6580   52.934   10.283   40.958   16.014   61.336   13.414   28.733   6.9202   37.176   4.5191 -8.443165 8.265123 
1 1 1   17   11  -16 o   8.2051   4.0246 -16.6606   9.1892 -12.4900   15.004 -19.1642   11.625   12.162   5.7480   9.3907   4.5894 2.771531 7.355447 
1 1 1   17   11  -15 o   24.851   5.0875   28.352   9.9585   22.393   15.827   32.257   12.813   21.411   7.4275   25.935   6.1538 -4.523638 9.645502 
1 1 1   17   11  -14 o   29.756   4.6028   39.573   10.804   23.247   15.662   54.399   14.925   21.743   7.3938   34.374   5.5126 -12.63117 9.222692 
1 1 1   17   11  -13 o   58.369   2.4891  142.240   11.816  135.171   18.150  147.441   15.566   55.850   4.0136   58.938   3.2526 -3.088188 5.166076 
1 1 1   17   11  -12 o   30.247   4.6105   40.835   11.009   77.172   19.213   23.074   13.432   40.706   5.9674   21.759   6.8138 18.94702 9.057440 
1 1 1   17   11  -11 o   12.159   5.2601   0.6270   9.5731   10.815   14.782  -6.7325   12.564   17.372   6.9303   11.978   5.5261 5.393806 8.863791 
1 1 1   17   11  -10 o   14.590   5.6987   7.2230   9.8055   10.446   14.935   4.7809   13.000   17.309   6.9454   14.991   6.2939 2.317759 9.372917 
1 1 1   17   11   -9 o   13.430   5.3460   5.3487   8.7771   20.541   15.022  -2.5251   10.815   20.775   7.2344   11.980   5.3672 8.795259 9.007991 
1 1 1   17   11   -8 o   16.110   5.6682   11.079   9.2368   39.156   18.357   1.5609   10.688   27.602   7.8098   13.035   5.5978 14.56699 9.608802 
1 1 1   17   11   -7 o   27.622   4.5623   34.049   9.9142   21.296   21.995   37.301   11.107   21.682   8.5152   28.747   4.9162 -7.064957 9.832508 
1 1 1   17   11   -6 o   13.746   5.6707   4.3570   10.290  -8.7203   34.178   5.6604   10.790   19.043   8.8967   14.408   5.8595 4.634913 10.65298 
1 1 1   17   11   -5 o   32.958   3.6950   46.872   9.7560   37.901   19.588   49.831   11.251   26.940   8.1927   33.741   4.1799 -6.801184 9.197361 
1 1 1   17   11   -4 o   34.488   3.3826   50.832   9.3872   51.864   16.341   50.324   11.468   33.100   6.2863   33.876   4.2461 -0.7759399 7.585939 
1 1 1   17   11   -3 o   29.195   3.9395   37.155   9.1365   41.959   15.928   34.799   11.154   29.354   6.7914   27.638   5.1401 1.715755 8.517274 
1 1 1   17   11   -2 o   42.438   2.8665   75.812   9.8579   80.857   17.269   73.373   12.006   42.447   5.0926   41.374   3.5956 1.072983 6.233969 
1 1 1   17   11   -1 o   10.707   4.7914  -2.3555   8.5923 -11.1152   15.243   1.7239   10.402   12.559   5.8913   12.954   5.5419 -0.3955593 8.088234 
1 1 1   17   11    0 o   43.868   2.8126   80.891   10.004   52.347   16.832   96.483   12.440   33.139   6.4633   47.707   3.2178 -14.56837 7.220004 
1 1 1   17   11    1 o   18.149   5.5103   15.147   8.8663   15.053   15.499   15.193   10.810   18.937   7.2255   18.281   6.1430 0.6560535 9.483938 
1 1 1   17   11    2 o   28.481   4.0937   35.558   9.2312   35.177   16.073   35.746   11.277   26.554   7.2317   28.031   5.1240 -1.476517 8.863008 
1 1 1   17   11    3 o   15.534   5.6248   9.8586   9.1612   20.606   17.575   5.8491   10.735   21.034   7.7629   14.458   5.8575 6.575335 9.724818 
1 1 1   17   11    4 o   28.431   4.2233   35.594   9.4906   9.8665   17.793   45.824   11.220   17.945   7.4351   32.233   4.3837 -14.28848 8.631214 
1 1 1   17   11    5 o   33.470   3.6050   48.202   9.6808   25.529   17.852   57.646   11.522   22.689   7.8873   36.454   3.9400 -13.76544 8.816614 
1 1 1   17   11    6 o   26.506   4.5924   31.432   9.5632   40.962   18.190   27.791   11.242   28.350   7.6816   24.313   5.7613 4.036501 9.602116 
1 1 1   17   11    7 o   21.429   5.4028   21.372   9.4338   11.697   17.861   25.115   11.110   18.424   7.5215   23.031   5.8940 -4.606148 9.555743 
1 1 1   17   11    8 o   25.541   5.1606   29.887   10.374   34.241   27.864   29.187   11.178   25.277   9.6775   24.993   5.6230 0.2843590 11.19252 
1 1 1   17   11    9 o   26.858   5.3597   33.243   11.323   0.0000   0.0000   33.243   11.323  ?   ?    26.858   5.3597 0.000000 5.359727 
1 1 1   17   11   10 o   32.501   4.1609   46.298   10.771   39.817   28.917   47.342   11.606   26.593   9.9303   32.699   4.4712 -6.106548 10.89051 
1 1 1   17   11   11 o   30.805   3.9996   41.447   9.8064   30.471   17.783   46.244   11.755   24.391   7.8640   32.230   4.6052 -7.839741 9.113185 
1 1 1   17   11   12 o   24.211   4.9847   26.783   9.5096   24.068   17.208   27.976   11.410   22.094   7.7395   24.323   5.8308 -2.228647 9.690106 
1 1 1   17   11   13 o   19.772   5.9890   18.465   10.482   39.845   17.292   6.0457   13.179   28.027   7.4442   15.405   6.3923 12.62207 9.812113 
1 1 1   17   11   14 o   44.020   3.2319   82.394   11.516  105.999   18.993   68.672   14.481   48.760   4.8425   39.340   4.6028 9.420315 6.680981 
1 1 1   17   11   15 o   14.675   5.8047   7.0704   10.286   31.374   17.270  -6.2921   12.806   24.701   7.7247   12.171   5.6018 12.53055 9.542135 
1 1 1   17   11   16 o   41.998   3.0558   74.751   10.390   84.594   19.049   70.583   12.396   42.893   5.5803   40.380   3.8110 2.512291 6.757465 
1 1 1   17   11   17 o   13.344   5.4177   4.7506   9.2065   37.388   17.114  -8.5401   10.921   27.007   7.5050   10.670   4.9993 16.33744 9.017636 
1 1 1   17   11   18 o   13.302   5.4495   4.3971   9.4165   35.445   17.474  -8.3096   11.179   26.151   7.6880   10.861   5.0788 15.29013 9.214121 
1 1 1   17   11   19 o   14.140   5.4353   7.1589   8.8132   25.590   14.539  -3.5482   11.081   22.621   7.0896   11.824   5.3529 10.79699 8.883498 
1 1 1   17   11   20 o   28.776   4.0048   36.396   9.1397   22.284   14.793   45.108   11.623   21.258   7.1864   31.722   4.6317 -10.46372 8.549637 
1 1 1   17   11   21 o   19.405   5.3902   17.681   8.8301   14.097   14.701   19.703   11.044   18.257   7.0193   20.241   6.1509 -1.984718 9.332930 
1 1 1   17   11   22 o   27.459   4.2116   33.497   9.1263   25.996   14.777   38.122   11.604   22.674   7.1533   28.789   5.1329 -6.115585 8.804358 
1 1 1   17   11   23 o   49.738   2.7488  104.224   11.101  115.969   16.568   94.654   14.955   51.584   3.9706   46.574   3.9773 5.010281 5.620024 
1 1 1   17   11   24 o   51.264   3.3734  112.593   14.019  147.419   20.970   84.452   18.850   57.631   4.4994   42.646   5.5542 14.98444 7.148031 
1 1 1   17   11   25 o   40.182   3.2906   69.208   10.684   72.853   15.520   65.924   14.729   40.135   4.8415   38.158   4.8446 1.977303 6.849065 
1 1 1   17   11   26 o   33.859   3.5224   49.655   9.5797   65.802   15.500   39.675   12.186   37.845   5.1587   29.163   5.3219 8.681686 7.411832 
1 1 1   17   11   27 o   23.209   5.0170   25.090   9.2146   4.0604   14.885   38.158   11.733   15.229   6.5735   28.631   5.2198 -13.40222 8.393820 
1 1 1   17   11   28 o   20.100   5.4020   19.264   9.0397   19.680   14.669   19.009   11.478   19.977   7.1320   19.701   6.3148 0.2759457 9.525877 
1 1 1   17   11   29 o   31.322   4.4772   44.250   11.106   31.690   18.141   51.780   14.047   24.097   7.9544   33.269   5.3618 -9.172661 9.592805 
1 1 1   17   11   30 o   25.069   5.0912   29.436   10.048   55.151   18.360   18.440   12.006   32.784   7.0777   19.357   6.4735 13.42792 9.591619 
1 1 1   17   11   31 f   20.819   5.5925   21.004   9.6915   43.560   18.152   12.011   11.462   28.393   7.6654   16.608   6.2416 11.78459 9.885138 
1 1 1   17   11   32 o   21.617   5.5661   22.665   9.8666   26.200   18.140   21.180   11.758   22.001   7.9218   20.529   6.3667 1.472218 10.16314 
1 1 1   17   11   33 o   48.762   3.1122  101.926   12.306  135.168   20.803   84.032   15.263   54.499   4.7295   43.222   4.3930 11.27745 6.454954 
1 1 1   17   11   34 o   22.221   5.9240   24.565   10.926   44.143   18.737   14.479   13.448   28.129   7.8661   17.709   6.7370 10.41972 10.35679 
1 1 1   17   11   35 o   13.973   5.7681   5.7515   10.655  -1.6158   17.985   9.7358   13.226   14.785   6.7424   16.032   6.4993 -1.247538 9.364831 
1 1 1   17   11   36 o   19.923   6.0964   20.033   10.825   23.412   18.310   18.218   13.421   20.779   7.8712   18.984   6.8166 1.794876 10.41257 
1 1 1   17   11   37 o   14.770   5.8761   8.2658   10.598   22.699   17.504  -0.0882   13.317   20.473   7.7091   13.330   5.9650 7.143422 9.747389 
1 1 1   17   11   38 o   12.470   5.4184   1.7576   10.250 -11.6843   16.768   9.7763   12.951   12.618   5.9964   15.849   6.4290 -3.230580 8.791379 
1 1 1   17   11   39 o   9.6538   4.6070 -10.0924   10.112  -3.5337   16.457 -14.0698   12.816   13.758   6.3389   10.491   5.0534 3.266962 8.106672 
1 1 1   17   11   40 o   32.519   4.8005   49.544   12.343   58.060   24.897   46.769   14.212   29.715   9.2724   30.597   5.9124 -0.8819408 10.99699 
1 1 1   17   11   41 o   17.694   6.3403   15.703   11.604 -19.2278   22.697   28.066   13.503   13.636   6.6064   22.752   6.7761 -9.116130 9.463669 
1 1 1   17   11   42 o   27.995   6.1506   40.258   13.651   9.2890   22.334   58.729   17.248   17.369   7.7522   33.548   6.5424 -16.17859 10.14393 
1 1 1   17   11   43 o   10.645   5.0184  -7.8821   11.307 -19.1068   22.391  -4.0400   13.100   13.462   6.5315   12.223   5.6403 1.238989 8.629759 
1 1 1   17   11   44 o   17.017   6.2987   14.448   11.585   46.107   23.580   4.3747   13.301   25.834   9.0591   14.136   6.1570 11.69818 10.95339 
1 1 1   17   11   45 o   22.099   6.2190   26.058   11.673   44.859   22.947   19.495   13.558   25.450   8.9357   18.886   6.8421 6.563763 11.25433 
1 1 1   17   11   46 o   12.017   5.3412   0.5941   10.491   8.7400   17.383  -4.0732   13.158   16.033   7.0099   12.116   5.6126 3.917160 8.980011 
1 1 1   17   11   47 o   22.219   6.7634   27.960   13.346   49.084   22.902   17.098   16.422   26.366   8.9413   17.916   7.2497 8.450115 11.51107 
1 1 1   17   11   48 o   13.410   5.6436   5.6350   10.492   4.4909   17.418   6.2865   13.144   15.015   6.7622   14.364   6.1884 0.6515512 9.166411 
1 1 1   17   11   49 o   28.322   5.7445   41.398   12.808   23.540   18.461   57.970   17.784   19.536   7.7607   32.040   7.0051 -12.50482 10.45464 
1 1 1   17   11   50 o   45.780   3.7272   94.837   13.789   83.119   19.440  106.701   19.561   39.618   6.2245   46.402   5.2644 -6.784225 8.152215 
1 1 1   17   11   51 o   23.142   7.2600   32.552   15.242 -13.7184   28.349   51.367   18.077   14.880   7.2491   29.132   7.5510 -14.25177 10.46745 
1 1 1   17   11   52 o   13.879   5.8904   6.5045   11.588   18.273   26.808   3.8004   12.851   18.292   8.2988   13.510   5.9628 4.782319 10.21886 
1 1 1   17   11   53 o   14.951   6.1016   9.8729   11.749   30.816   27.148   5.0465   13.032   20.302   8.8199   13.854   6.0632 6.447291 10.70299 
1 1 1   17   11   54 o   10.472   5.0587 -12.7197   13.063 -29.3146   27.223  -7.7560   14.889   13.313   6.6032   11.944   5.6687 1.368793 8.702700 
1 1 1   17   11   55 o   11.925   5.5356  -3.2926   12.898   13.117   27.079  -8.1076   14.669   17.401   8.0578   11.786   5.6033 5.614837 9.814531 
1 1 1   17   11   56 o   21.513   7.2420   28.984   15.024   0.0000   0.0000   28.984   15.024  ?   ?    21.513   7.2420 0.000000 7.242043 
1 1 1   17   11   57 o   40.317   5.2819   82.167   16.942   0.0000   0.0000   82.167   16.942  ?   ?    40.317   5.2819 0.000000 5.281947 
1 1 1   17   11   58 o   22.786   8.7178   40.918   22.601   0.0000   0.0000   40.918   22.601  ?   ?    22.786   8.7178 0.000000 8.717786 
1 1 1   17   11   59 o   20.234   8.3412   30.846   22.240   0.0000   0.0000   30.846   22.240  ?   ?    20.234   8.3412 0.000000 8.341168 
1 1 1   17   11   60 o   28.796   9.0805   63.539   23.815   0.0000   0.0000   63.539   23.815  ?   ?    28.796   9.0805 0.000000 9.080466 
1 1 1   17   11   61 o   17.462   7.7624   17.908   22.164   0.0000   0.0000   17.908   22.164  ?   ?    17.462   7.7624 0.000000 7.762403 
1 1 1   17   11   62 o   18.333   7.9063   22.702   21.494   0.0000   0.0000   22.702   21.494  ?   ?    18.333   7.9063 0.000000 7.906252 
1 1 1   17   12  -64 o   12.355   6.1685 -28.6721   25.412   0.0000   0.0000 -28.6721   25.412  ?   ?    12.355   6.1685 0.000000 6.168501 
1 1 1   17   12  -63 o   19.328   8.5134   34.223   26.073   0.0000   0.0000   34.223   26.073  ?   ?    19.328   8.5134 0.000000 8.513442 
1 1 1   17   12  -62 o   18.389   8.2670   28.094   25.903   0.0000   0.0000   28.094   25.903  ?   ?    18.389   8.2670 0.000000 8.267035 
1 1 1   17   12  -61 o   15.617   7.4089   7.4834   25.380   0.0000   0.0000   7.4834   25.380  ?   ?    15.617   7.4089 0.000000 7.408939 
1 1 1   17   12  -60 o   19.864   8.6681   36.219   26.468   0.0000   0.0000   36.219   26.468  ?   ?    19.864   8.6681 0.000000 8.668145 
1 1 1   17   12  -59 o   15.335   7.3206   3.8522   25.574   0.0000   0.0000   3.8522   25.574  ?   ?    15.335   7.3206 0.000000 7.320561 
1 1 1   17   12  -58 o   12.716   6.3145 -24.8130   25.182   0.0000   0.0000 -24.8130   25.182  ?   ?    12.716   6.3145 0.000000 6.314507 
1 1 1   17   12  -57 o   15.353   7.3546   2.5599   26.300   0.0000   0.0000   2.5599   26.300  ?   ?    15.353   7.3546 0.000000 7.354624 
1 1 1   17   12  -56 o   17.426   7.1848   19.083   16.505   0.0000   0.0000   19.083   16.505  ?   ?    17.426   7.1848 0.000000 7.184771 
1 1 1   17   12  -55 o   13.088   6.1115  -1.1110   16.094   0.0000   0.0000  -1.1110   16.094  ?   ?    13.088   6.1115 0.000000 6.111477 
1 1 1   17   12  -54 o   12.788   5.9720  -1.8610   15.372   0.0000   0.0000  -1.8610   15.372  ?   ?    12.788   5.9720 0.000000 5.971954 
1 1 1   17   12  -53 o   16.197   6.8705   13.938   15.751   0.0000   0.0000   13.938   15.751  ?   ?    16.197   6.8705 0.000000 6.870489 
1 1 1   17   12  -52 o   10.318   4.9502  -9.6413   12.016 -14.0757   20.095  -7.1732   14.992   12.573   6.1200   11.870   5.6492 0.7027168 8.328718 
1 1 1   17   12  -51 o   22.040   6.5453   28.712   12.613   26.704   21.322   29.793   15.643   19.230   8.0661   21.265   7.3837 -2.035118 10.93533 
1 1 1   17   12  -50 o   24.162   7.6075   38.602   16.721   41.766   21.818   34.098   26.031   23.020   8.6198   20.263   8.7192 2.757370 12.26075 
1 1 1   17   12  -49 o   11.304   5.4669 -12.5928   15.368   5.5235   20.089 -38.1489   23.860   15.184   6.9987   11.689   5.8572 3.494272 9.126230 
1 1 1   17   12  -48 o   17.875   7.2610   19.425   16.547   14.239   21.677   26.665   25.614   16.884   7.5788   19.112   8.4274 -2.227425 11.33403 
1 1 1   17   12  -47 o   14.846   6.1842   9.7225   12.403   26.273   21.148   1.0444   15.314   19.399   8.0775   13.459   6.1695 5.939783 10.16407 
1 1 1   17   12  -46 o   17.336   6.5279   16.935   12.551   19.140   21.241   15.753   15.557   17.917   7.7926   16.951   6.9809 0.9659767 10.46226 
1 1 1   17   12  -45 f   12.676   5.6090   2.6755   11.441  -3.0532   21.882   4.8307   13.422   14.491   6.8759   13.812   6.0951 0.6783428 9.188475 
1 1 1   17   12  -44 o   20.837   6.2881   24.516   11.570   4.5664   22.244   31.915   13.547   15.619   7.2568   23.364   6.7412 -7.745444 9.904778 
1 1 1   17   12  -43 o   14.503   6.0055   8.7354   11.598   21.584   22.562   4.1205   13.522   18.587   8.0581   13.715   6.0817 4.872499 10.09552 
1 1 1   17   12  -42 o   13.147   5.7006   4.4255   11.296   26.270   22.515  -2.9227   13.059   19.601   8.2594   12.074   5.5926 7.527646 9.974710 
1 1 1   17   12  -41 o   17.426   6.3038   16.633   11.503 -11.7724   21.872   27.495   13.525   13.571   6.5533   21.563   6.8486 -7.991296 9.478890 
1 1 1   17   12  -40 o   12.622   5.5572   2.6238   11.097   15.781   22.330  -1.6910   12.788   17.610   7.8120   12.250   5.6235 5.360363 9.625509 
1 1 1   17   12  -39 o   11.605   5.3305  -2.4096   11.513 -14.3849   23.224   1.4927   13.257   13.706   6.6505   13.121   5.9050 0.5856810 8.893734 
1 1 1   17   12  -38 o   39.402   3.9682   71.338   12.572   68.014   24.780   72.490   14.589   30.836   9.1786   38.876   4.6988 -8.039938 10.31145 
1 1 1   17   12  -37 o   12.667   5.4927   3.3645   10.489  -2.0515   17.431   6.4386   13.132   13.783   6.4106   14.335   6.1810 -0.5523424 8.905112 
1 1 1   17   12  -36 o   33.037   4.7949   52.542   12.536   36.336   18.623   65.969   16.951   23.553   8.0615   35.542   6.0685 -11.98896 10.09031 
1 1 1   17   12  -35 o   14.490   5.9843   8.0885   11.477   12.172   17.044   4.7011   15.523   16.632   7.1040   14.623   6.4986 2.008818 9.628012 
1 1 1   17   12  -34 o   15.432   6.1275   10.731   11.503   16.532   17.473   6.2942   15.282   17.838   7.3773   14.971   6.5585 2.866989 9.871067 
1 1 1   17   12  -33 o   19.431   6.8409   21.127   13.456 -11.7798   26.528   32.526   15.613   15.028   7.2470   23.447   7.3468 -8.418928 10.31962 
1 1 1   17   12  -32 o   13.746   6.0735   3.0185   13.367   2.8999   26.847   3.0576   15.414   16.807   7.8630   14.382   6.4279 2.425847 10.15600 
1 1 1   17   12  -31 o   13.318   5.5974   5.0996   10.299   3.1375   13.904   7.4849   15.330   13.990   6.1872   15.421   6.6637 -1.430952 9.093184 
1 1 1   17   12  -30 o   15.890   5.9511   11.899   10.401   10.777   14.006   13.280   15.530   16.078   6.6227   17.039   6.9913 -0.9611740 9.630075 
1 1 1   17   12  -29 o   10.505   4.8364  -3.9350   9.5534   10.709   14.064 -16.4822   13.018   16.109   6.6359   10.171   4.9452 5.937802 8.275914 
1 1 1   17   12  -28 o   16.330   5.7998   12.933   9.6889   17.745   14.135   8.6680   13.307   18.425   6.9298   15.380   6.4059 3.045520 9.437020 
1 1 1   17   12  -27 o   17.139   5.8448   14.602   9.7878  -1.6852   14.402   28.582   13.343   13.240   6.0364   22.946   6.7105 -9.706089 9.025983 
1 1 1   17   12  -26 o   12.694   5.4807   2.6698   10.353  -0.5200   14.029   6.4834   15.340   13.363   6.0388   15.370   6.6539 -2.006927 8.985647 
1 1 1   17   12  -25 o   20.151   5.7561   20.570   9.9247   24.288   14.991   17.669   13.242   20.907   7.2298   18.501   6.7532 2.405247 9.893240 
1 1 1   17   12  -24 o   18.628   5.7724   17.455   9.6676   6.6360   14.547   26.014   12.938   15.255   6.5405   22.043   6.6488 -6.787128 9.326593 
1 1 1   17   12  -23 o   33.411   3.8211   49.840   10.220   50.318   15.324   49.457   13.716   31.515   6.1860   31.922   5.4675 -0.4071579 8.255906 
1 1 1   17   12  -22 o   31.202   4.0564   43.938   10.073   51.307   15.533   38.590   13.233   31.849   6.2062   27.656   6.0394 4.192545 8.659729 
1 1 1   17   12  -21 o   20.088   5.6514   20.135   9.6407   14.182   14.864   24.457   12.666   17.551   6.9665   21.514   6.5968 -3.962923 9.594295 
1 1 1   17   12  -20 o   26.723   4.6771   33.290   9.8172   31.449   15.297   34.580   12.801   23.889   7.2347   26.113   6.1211 -2.224400 9.476749 
1 1 1   17   12  -19 o   16.528   5.8088   12.938   9.6987   15.574   14.720   10.916   12.893   18.042   7.0003   16.230   6.4732 1.811285 9.534512 
1 1 1   17   12  -18 o   9.9898   4.7633 -10.5211   10.761  -1.5715   14.427 -21.7423   16.155   13.459   6.0990   11.121   5.4298 2.338001 8.165790 
1 1 1   17   12  -17 o   16.469   6.3892   11.814   12.260   20.009   14.585  -7.9315   22.638   19.643   7.0992   15.164   7.1340 4.479318 10.06440 
1 1 1   17   12  -16 o   27.690   5.8197   37.737   12.718   40.085   15.236   32.343   23.095   27.678   6.8022   23.130   8.8216 4.548201 11.13955 
1 1 1   17   12  -15 o   21.823   5.8384   23.718   10.589   28.508   15.039   19.008   14.912   22.950   7.2130   19.342   7.1484 3.607891 10.15514 
1 1 1   17   12  -14 o   11.651   5.0608   0.9602   8.9341  -0.9985   14.540   2.1484   11.324   13.685   6.1694   13.135   5.7015 0.5503616 8.400496 
1 1 1   17   12  -13 o   17.843   5.5849   15.413   9.0250   19.952   14.413   12.485   11.575   19.730   7.0664   16.677   6.2714 3.052914 9.448012 
1 1 1   17   12  -12 o   13.750   5.4390   6.6578   9.0309   14.538   14.621   1.7970   11.483   17.879   6.9657   13.130   5.7199 4.748595 9.013185 
1 1 1   17   12  -11 o   26.618   4.5231   32.474   9.4633   52.977   15.341   19.881   12.023   32.963   5.9273   19.828   6.4720 13.13522 8.776128 
1 1 1   17   12  -10 o   23.070   5.1399   25.295   9.4182   25.038   15.179   25.456   12.009   21.694   7.2793   22.404   6.3092 -0.7101688 9.632951 
1 1 1   17   12   -9 o   53.252   2.5025  119.436   10.832   85.515   16.955  142.833   14.081   43.099   4.9137   57.846   2.9965 -14.74741 5.755325 
1 1 1   17   12   -8 o   22.877   5.3284   25.092   9.7507   34.433   17.221   20.684   11.830   24.996   7.6969   20.248   6.4018 4.748163 10.01131 
1 1 1   17   12   -7 o   18.942   5.9550   17.606   10.250   12.836   15.213   21.572   13.871   17.513   7.0157   20.480   6.9583 -2.966715 9.881191 
1 1 1   17   12   -6 o   11.510   5.0318   0.3198   8.9543   6.2771   14.623  -3.2539   11.326   15.524   6.6038   11.829   5.3774 3.695118 8.516255 
1 1 1   17   12   -5 f   18.299   5.6193   16.165   9.1863   17.571   14.887   15.301   11.674   19.022   7.1206   17.916   6.3659 1.105667 9.551353 
1 1 1   17   12   -4 o   15.496   5.6189   10.508   9.1461   18.338   14.929   5.8036   11.572   19.298   7.1487   14.401   5.9840 4.897338 9.322668 
1 1 1   17   12   -3 o   11.973   5.2642   0.1121   9.9264  -9.4172   20.110   3.1818   11.414   14.378   6.7515   13.546   5.8003 0.8316956 8.900897 
1 1 1   17   12   -2 o   21.735   5.2834   22.597   9.2683   35.245   15.060   14.886   11.759   25.986   6.9674   17.763   6.3803 8.223152 9.447332 
1 1 1   17   12   -1 o   24.612   5.1916   28.666   10.087 -10.0822   18.837   44.246   11.944   13.841   6.5103   30.943   4.8984 -17.10242 8.147257 
1 1 1   17   12    0 o   21.385   5.8214   22.481   10.418   6.3742   22.772   26.744   11.716   17.660   7.8583   23.160   6.1162 -5.500092 9.957988 
1 1 1   17   12    1 o   15.766   6.1792   9.8135   11.562   0.0000   0.0000   9.8135   11.562  ?   ?    15.766   6.1792 0.000000 6.179194 
1 1 1   17   12    2 o   10.121   4.7745  -8.6188   10.266   0.5170   25.581 -10.3726   11.208   17.340   7.9578   10.346   4.9125 6.994442 9.352016 
1 1 1   17   12    3 o   10.729   4.9779  -6.0327   10.413 -39.0280   26.253   0.1279   11.344   13.347   6.5956   12.673   5.5974 0.6739979 8.650593 
1 1 1   17   12    4 o   8.8662   4.2712 -11.6964   9.1587 -12.3534   16.366 -11.3968   11.051   12.536   5.9479   10.078   4.8114 2.458119 7.650266 
1 1 1   17   12    5 f   11.508   5.1772  -2.1040   10.179   3.9704   22.565  -3.6561   11.406   17.171   7.7179   11.782   5.3718 5.388617 9.403300 
1 1 1   17   12    6 o   25.866   4.8020   31.022   9.7521   43.064   17.325   25.437   11.799   28.362   7.4127   22.491   6.2244 5.870543 9.679390 
1 1 1   17   12    7 o   34.001   3.7405   50.844   10.196   41.725   17.808   55.291   12.436   27.653   7.6447   34.949   4.4672 -7.296438 8.854252 
1 1 1   17   12    8 o   31.159   4.0817   43.371   10.118   40.659   17.847   44.655   12.283   27.211   7.7010   30.950   5.0420 -3.738815 9.204743 
1 1 1   17   12    9 o   29.484   4.3161   39.293   10.066   37.753   17.788   40.019   12.209   26.092   7.7791   29.029   5.3566 -2.937368 9.444959 
1 1 1   17   12   10 o   13.013   5.5670   2.8175   10.497   16.944   17.123  -5.6872   13.286   18.968   7.4936   12.251   5.6629 6.716500 9.392706 
1 1 1   17   12   11 o   14.960   5.7148   9.0945   9.7023   2.8174   17.033   12.110   11.805   15.397   6.8267   16.604   6.3130 -1.207197 9.298256 
1 1 1   17   12   12 o   41.291   3.2004   73.496   10.688   75.077   18.882   72.750   12.965   39.119   6.1220   40.491   3.9793 -1.372368 7.301630 
1 1 1   17   12   13 o   18.506   5.8420   16.811   9.8548   16.426   17.297   16.997   11.991   18.764   7.4930   18.543   6.4631 0.2203426 9.895258 
1 1 1   17   12   14 o   30.316   4.2089   41.465   10.121   42.371   18.006   41.046   12.237   27.618   7.7066   29.368   5.3068 -1.749884 9.357012 
1 1 1   17   12   15 o   15.081   5.7006   9.5690   9.5920  -0.3138   17.014   14.173   11.613   14.688   6.6427   17.316   6.3236 -2.628017 9.171383 
1 1 1   17   12   16 o   25.104   5.4612   30.555   10.857   23.727   17.406   34.904   13.890   20.906   7.7237   25.977   6.5595 -5.070526 10.13321 
1 1 1   17   12   17 o   12.609   5.4916   1.5727   10.579  -3.5780   16.902   4.8907   13.565   14.013   6.4448   14.673   6.3039 -0.6601391 9.015265 
1 1 1   17   12   18 o   11.632   5.2443  -1.9358   10.510   11.168   16.803 -10.3567   13.470   17.122   7.1698   11.429   5.4147 5.693024 8.984726 
1 1 1   17   12   19 o   41.865   3.2176   75.904   10.896   84.181   18.885   71.773   13.341   41.649   5.7129   39.936   4.1591 1.713772 7.066461 
1 1 1   17   12   20 o   33.314   4.2572   50.381   11.297   77.635   18.257   33.473   14.380   39.861   5.7880   25.025   6.8506 14.83630 8.968325 
1 1 1   17   12   21 o   34.629   4.1341   54.148   11.439   53.100   17.766   54.891   14.951   31.501   7.0903   33.523   5.6736 -2.021608 9.080858 
1 1 1   17   12   22 o   50.410   3.3911  110.831   13.854  135.982   20.092   88.034   19.128   54.453   4.5685   42.550   5.6547 11.90309 7.269581 
1 1 1   17   12   23 o   22.130   5.9176   24.897   10.881   37.709   17.438   16.726   13.925   25.570   7.7202   18.246   6.8749 7.323324 10.33761 
1 1 1   17   12   24 o   23.479   5.7682   27.735   10.959   43.854   17.271   16.871   14.179   27.970   7.4443   18.275   6.9256 9.694704 10.16769 
1 1 1   17   12   25 o   13.037   5.5821   3.4574   10.571   24.074   16.534 -10.7966   13.748   20.675   7.5460   11.389   5.4173 9.286007 9.289237 
1 1 1   17   12   26 o   19.548   6.0742   19.736   10.697   3.0239   16.519   31.805   14.037   14.921   6.6627   24.173   6.8258 -9.252147 9.538486 
1 1 1   17   12   27 o   17.437   6.0885   15.257   10.644 -11.6306   16.250   35.466   14.088   12.290   5.8581   25.703   6.6678 -13.41312 8.875636 
1 1 1   17   12   28 o   37.716   3.7589   63.571   11.403   66.380   17.801   61.616   14.849   35.925   6.3089   35.716   5.2576 0.2088966 8.212399 
1 1 1   17   12   29 o   15.080   5.8472   9.8681   10.264   16.012   15.712   5.2935   13.557   17.903   7.1441   14.489   6.2639 3.414289 9.501248 
1 1 1   17   12   30 o   15.525   5.7076   11.305   9.4856   18.656   13.096   3.1908   13.758   18.688   6.7306   13.997   6.1741 4.690866 9.133499 
1 1 1   17   12   31 o   18.687   5.6796   17.887   9.4162   10.103   12.669   27.494   14.075   15.568   6.3425   22.040   6.9847 -6.472344 9.434648 
1 1 1   17   12   32 o   14.028   5.5667   7.8903   9.4883   12.740   13.044   2.4403   13.828   16.434   6.5250   13.760   6.1232 2.673462 8.948187 
1 1 1   17   12   33 o   29.971   4.6256   42.570   10.937   31.912   16.350   51.201   14.714   22.972   7.5502   31.576   5.9346 -8.604038 9.603360 
1 1 1   17   12   34 o   44.388   3.3036   86.880   11.868   76.607   17.837   95.039   15.897   38.811   5.8171   45.198   4.3693 -6.386509 7.275213 
1 1 1   17   12   35 o   31.259   5.1076   47.883   12.565   44.009   23.546   49.426   14.858   24.513   8.9958   30.627   6.1650 -6.113621 10.90556 
1 1 1   17   12   36 o   13.361   5.7876   4.3043   11.620 -13.9847   21.643   11.712   13.774   13.450   6.5006   16.001   6.5770 -2.551711 9.247356 
1 1 1   17   12   37 o   18.685   6.4567   19.416   11.955   34.766   22.809   13.601   14.038   21.932   8.6537   16.546   6.7002 5.385805 10.94438 
1 1 1   17   12   38 o   44.926   4.2706   94.215   15.452  161.680   28.556   66.284   18.374   54.634   6.5420   34.582   6.7605 20.05217 9.407555 
1 1 1   17   12   39 o   33.463   4.6433   53.730   12.325   46.146   23.103   56.747   14.571   24.800   8.9387   33.390   5.5483 -8.589836 10.52064 
1 1 1   17   12   40 o   33.532   4.5623   53.787   12.147   23.796   22.096   66.777   14.542   19.199   8.1403   36.929   4.9558 -17.73044 9.530191 
1 1 1   17   12   41 o   15.716   6.5309   11.396   13.786   0.0000   0.0000   11.396   13.786  ?   ?    15.716   6.5309 0.000000 6.530853 
1 1 1   17   12   42 o   11.864   5.5549  -4.8721   13.446   0.0000   0.0000  -4.8721   13.446  ?   ?    11.864   5.5549 0.000000 5.554928 
1 1 1   17   12   43 o   17.233   6.7390   16.427   13.726   0.0000   0.0000   16.427   13.726  ?   ?    17.233   6.7390 0.000000 6.738984 
1 1 1   17   12   44 o   10.884   5.2086  -9.8892   13.121   0.0000   0.0000  -9.8892   13.121  ?   ?    10.884   5.2086 0.000000 5.208587 
1 1 1   17   12   45 f   27.489   6.5738   42.737   14.531   0.0000   0.0000   42.737   14.531  ?   ?    27.489   6.5738 0.000000 6.573781 
1 1 1   17   12   46 o   17.451   6.7849   17.415   13.849   0.0000   0.0000   17.415   13.849  ?   ?    17.451   6.7849 0.000000 6.784883 
1 1 1   17   12   47 o   15.393   6.7335   9.5739   16.057   0.0000   0.0000   9.5739   16.057  ?   ?    15.393   6.7335 0.000000 6.733545 
1 1 1   17   12   48 o   23.248   7.6294   35.781   16.698   0.0000   0.0000   35.781   16.698  ?   ?    23.248   7.6294 0.000000 7.629450 
1 1 1   17   12   49 o   15.393   6.7833   9.6185   16.570   0.0000   0.0000   9.6185   16.570  ?   ?    15.393   6.7833 0.000000 6.783327 
1 1 1   17   12   50 o   12.437   5.8912  -5.6221   15.930   0.0000   0.0000  -5.6221   15.930  ?   ?    12.437   5.8912 0.000000 5.891244 
1 1 1   17   12   51 o   9.3501   4.6891 -32.1430   15.451   0.0000   0.0000 -32.1430   15.451  ?   ?    9.3501   4.6891 0.000000 4.689059 
1 1 1   17   12   52 o   13.555   6.2690   0.8302   16.317   0.0000   0.0000   0.8302   16.317  ?   ?    13.555   6.2690 0.000000 6.269021 
1 1 1   17   12   53 o   22.541   9.0409   45.081   25.296   0.0000   0.0000   45.081   25.296  ?   ?    22.541   9.0409 0.000000 9.040924 
1 1 1   17   12   54 o   13.575   6.5870 -10.1074   22.790   0.0000   0.0000 -10.1074   22.790  ?   ?    13.575   6.5870 0.000000 6.586959 
1 1 1   17   12   55 o   12.147   6.0228 -25.1679   22.563   0.0000   0.0000 -25.1679   22.563  ?   ?    12.147   6.0228 0.000000 6.022791 
1 1 1   17   12   56 o   16.277   6.9830   14.576   16.603   0.0000   0.0000   14.576   16.603  ?   ?    16.277   6.9830 0.000000 6.983022 
1 1 1   17   12   57 o   14.145   6.3993   5.4403   15.807   0.0000   0.0000   5.4403   15.807  ?   ?    14.145   6.3993 0.000000 6.399253 
1 1 1   17   12   58 o   22.623   7.5583   35.275   16.367   0.0000   0.0000   35.275   16.367  ?   ?    22.623   7.5583 0.000000 7.558302 
1 1 1   17   12   59 o   14.214   6.8218  -2.7002   22.860   0.0000   0.0000  -2.7002   22.860  ?   ?    14.214   6.8218 0.000000 6.821819 
1 1 1   17   12   60 o   14.763   7.0102   2.4685   22.825   0.0000   0.0000   2.4685   22.825  ?   ?    14.763   7.0102 0.000000 7.010240 
1 1 1   17   12   61 o   16.639   7.6723   15.948   24.173   0.0000   0.0000   15.948   24.173  ?   ?    16.639   7.6723 0.000000 7.672316 
1 1 1   17   12   62 o   19.501   8.3423   32.786   23.571   0.0000   0.0000   32.786   23.571  ?   ?    19.501   8.3423 0.000000 8.342335 
1 1 1   17   12   63 o   13.407   6.5016  -7.4836   22.114   0.0000   0.0000  -7.4836   22.114  ?   ?    13.407   6.5016 0.000000 6.501605 
1 1 1   17   12   64 o   11.970   5.9391 -23.4229   22.089   0.0000   0.0000 -23.4229   22.089  ?   ?    11.970   5.9391 0.000000 5.939054 
1 1 1   17   13  -52 o   21.103   8.4820   39.013   22.314   0.0000   0.0000   39.013   22.314  ?   ?    21.103   8.4820 0.000000 8.482036 
1 1 1   17   13  -51 o   16.432   7.4753   15.621   21.936   0.0000   0.0000   15.621   21.936  ?   ?    16.432   7.4753 0.000000 7.475340 
1 1 1   17   13  -50 o   12.789   6.2309 -11.6432   20.961   0.0000   0.0000 -11.6432   20.961  ?   ?    12.789   6.2309 0.000000 6.230923 
1 1 1   17   13  -49 o   11.700   5.4878  -3.3746   13.219 -10.1924   21.643   0.6816   16.694   13.115   6.3766   13.380   6.2401 -0.2649040 8.921879 
1 1 1   17   13  -48 o   15.711   6.4684   13.540   13.352   32.141   22.102   2.8522   16.754   19.788   8.2499   13.776   6.3646 6.011948 10.41966 
1 1 1   17   13  -47 o   11.992   5.5883  -2.1413   13.347   10.938   22.206  -9.5391   16.700   15.877   7.3326   11.948   5.7587 3.929420 9.323628 
1 1 1   17   13  -46 o   23.652   6.7763   34.435   13.735   32.984   22.728   35.270   17.238   19.964   8.3477   22.192   7.7482 -2.228809 11.38942 
1 1 1   17   13  -45 o   14.543   6.2645   9.0850   13.464   16.005   21.922   4.8937   17.061   16.755   7.5623   14.273   6.5310 2.482062 9.992130 
1 1 1   17   13  -44 o   11.944   5.5734  -2.7071   13.348   28.114   22.083 -20.4533   16.756   19.128   8.1251   10.801   5.3245 8.326912 9.714327 
1 1 1   17   13  -43 o   18.658   6.7992   21.748   13.416   40.158   22.529   11.633   16.699   21.942   8.6179   15.626   6.8504 6.315848 11.00887 
1 1 1   17   13  -42 o   19.564   6.8830   24.148   13.620   18.946   22.491   27.160   17.116   17.410   7.7743   19.761   7.5799 -2.350645 10.85793 
1 1 1   17   13  -41 o   12.299   5.6890  -1.2309   13.444   10.734   22.428  -7.9410   16.796   16.102   7.4122   12.299   5.8878 3.803384 9.466119 
1 1 1   17   13  -40 o   17.255   6.7504   17.686   13.777   32.506   24.062   10.457   16.805   20.002   8.4884   15.464   6.8222 4.538344 10.89011 
1 1 1   17   13  -39 o   16.546   7.0450   15.150   16.670   0.0000   0.0000   15.150   16.670  ?   ?    16.546   7.0450 0.000000 7.045025 
1 1 1   17   13  -38 o   10.575   5.1345 -13.4945   13.901   0.0000   0.0000 -13.4945   13.901  ?   ?    10.575   5.1345 0.000000 5.134526 
1 1 1   17   13  -37 o   13.231   5.9971   2.3563   13.959   0.0000   0.0000   2.3563   13.959  ?   ?    13.231   5.9971 0.000000 5.997076 
1 1 1   17   13  -36 o   28.126   5.7816   42.331   12.812   18.494   23.759   52.104   15.214   17.597   7.9135   30.592   6.3104 -12.99568 10.12152 
1 1 1   17   13  -35 o   17.423   6.5133   17.497   12.447   34.100   23.848   11.281   14.592   20.658   8.5876   15.521   6.5994 5.137017 10.83047 
1 1 1   17   13  -34 o   29.423   5.5020   45.008   12.711   50.339   23.611   42.832   15.083   24.931   9.0296   26.956   6.8512 -2.024826 11.33454 
1 1 1   17   13  -33 o   14.443   6.0571   8.6771   12.020   4.2570   21.845   10.597   14.395   15.345   7.1503   15.375   6.5467 -0.3027344E-01 9.694690 
1 1 1   17   13  -32 o   26.340   5.9765   37.581   12.537   47.128   23.935   33.972   14.717   24.072   9.0252   23.530   7.0898 0.5423164 11.47692 
1 1 1   17   13  -31 f   18.029   6.5306   18.721   12.351   48.946   24.424   8.3361   14.317   24.444   9.1267   14.831   6.4243 9.612982 11.16101 
1 1 1   17   13  -30 o   13.722   5.9123   6.0277   11.998   7.2906   21.867   5.4838   14.351   15.889   7.3159   14.172   6.2760 1.716803 9.639001 
1 1 1   17   13  -29 o   12.323   5.5616   0.6587   11.854   15.566   22.340  -5.1833   13.985   17.334   7.7435   11.963   5.6215 5.370811 9.568877 
1 1 1   17   13  -28 o   15.221   6.1636   10.932   11.880  -1.8140   22.253   16.012   14.049   14.722   6.9706   17.035   6.7693 -2.312970 9.716598 
1 1 1   17   13  -27 o   13.830   5.9493   6.1830   12.112   14.392   22.165   2.6879   14.463   17.157   7.6854   13.626   6.1470 3.530977 9.841316 
1 1 1   17   13  -26 o   13.930   5.9582   6.5767   12.021   7.6072   22.406   6.1602   14.244   16.099   7.4100   14.360   6.3101 1.738624 9.732690 
1 1 1   17   13  -25 o   11.456   5.5628 -15.2051   16.331  -4.9459   21.887 -28.0911   24.529   14.315   6.8165   12.729   6.3056 1.586152 9.285781 
1 1 1   17   13  -24 f   12.962   5.7597   2.6134   12.190  -5.5836   16.468   12.549   18.130   12.808   6.0439   16.510   7.1898 -3.701857 9.392645 
1 1 1   17   13  -23 o   30.868   4.8482   46.575   11.797   39.027   15.092   58.431   18.915   25.751   7.0054   31.080   7.5433 -5.328751 10.29453 
1 1 1   17   13  -22 o   10.281   4.7829  -4.4552   9.7132  -2.6866   14.142  -6.0345   13.364   12.544   5.8137   11.655   5.4826 0.8890820 7.991103 
1 1 1   17   13  -21 o   18.297   5.9090   18.062   10.038   20.936   14.350   15.309   14.046   18.856   7.0043   16.967   6.7598 1.888973 9.734232 
1 1 1   17   13  -20 o   18.968   5.9563   19.492   10.257   27.304   14.829   12.327   14.202   21.168   7.1947   16.098   6.6537 5.069405 9.799786 
1 1 1   17   13  -19 o   15.351   5.8061   11.510   9.9538   6.2055   14.354   16.425   13.815   14.522   6.3590   17.367   6.7697 -2.845481 9.287971 
1 1 1   17   13  -18 o   19.451   5.8996   20.337   10.167  -0.3885   14.714   39.272   14.064   13.227   6.0573   26.594   6.5352 -13.36627 8.910645 
1 1 1   17   13  -17 o   13.534   5.5870   6.6234   9.9966   13.656   14.621   0.4504   13.698   16.606   6.7954   13.081   5.9338 3.524858 9.021462 
1 1 1   17   13  -16 o   15.690   5.8625   12.153   10.082  -5.8608   14.763   27.894   13.800   12.302   5.7792   21.853   6.9152 -9.551375 9.012177 
1 1 1   17   13  -15 o   11.372   5.1221  -0.6857   9.9969   7.8482   14.519  -8.3778   13.785   15.055   6.4953   11.523   5.4646 3.532199 8.488329 
1 1 1   17   13  -14 o   13.976   5.6560   7.7434   9.9967   11.715   14.432   4.0795   13.861   16.100   6.6855   13.993   6.1836 2.106564 9.106757 
1 1 1   17   13  -13 o   22.892   5.5483   26.929   10.244   23.732   14.809   29.862   14.186   20.061   7.1654   22.651   6.9878 -2.589344 10.00859 
1 1 1   17   13  -12 o   19.752   5.8564   20.652   10.104   11.941   14.577   28.708   14.017   16.225   6.7268   22.249   6.9597 -6.023380 9.679182 
1 1 1   17   13  -11 o   8.4784   4.1516 -14.9142   9.6504 -31.1176   14.133  -0.7582   13.210   9.0559   4.5333   12.741   5.7979 -3.684738 7.359778 
1 1 1   17   13  -10 o   24.547   5.6747   30.994   11.128   29.964   15.125   32.209   16.429   22.461   7.2536   22.925   7.5699 -0.4631920 10.48423 
1 1 1   17   13   -9 o   14.567   5.9004   8.6334   10.890   15.608   14.795   0.3858   16.089   17.390   6.9347   13.946   6.3666 3.443884 9.414051 
1 1 1   17   13   -8 o   12.958   5.7188   2.2780   11.819   1.1196   16.750   3.4266   16.680   14.286   6.5119   14.709   6.6214 -0.4229536 9.286958 
1 1 1   17   13   -7 o   19.230   6.2139   19.913   11.099   23.319   14.647   15.320   17.010   20.064   7.1304   17.507   7.2631 2.556793 10.17816 
1 1 1   17   13   -6 o   23.151   6.0358   28.356   11.506   12.228   19.000   37.695   14.458   17.009   7.3841   26.048   6.7535 -9.039700 10.00674 
1 1 1   17   13   -5 o   12.561   5.5581   1.5375   11.233  -7.1665   18.443   6.6711   14.164   13.476   6.3702   14.820   6.4047 -1.343541 9.033253 
1 1 1   17   13   -4 o   16.155   6.4706   12.118   12.938   1.8943   18.796   21.324   17.836   14.996   6.8593   19.216   7.6300 -4.220181 10.25994 
1 1 1   17   13   -3 o   9.4610   4.5644 -11.9740   10.551 -20.0807   16.415  -6.2658   13.774   11.144   5.4480   11.965   5.6088 -0.8208256 7.819118 
1 1 1   17   13   -2 o   12.444   5.4330   2.2868   10.410   8.9380   15.938  -2.6620   13.748   15.793   6.8095   12.619   5.8068 3.174110 8.949221 
1 1 1   17   13   -1 o   44.888   3.2923   88.656   11.963   72.169   18.280  101.006   15.821   37.202   6.2494   46.898   4.1825 -9.695927 7.519842 
1 1 1   17   13    0 o   14.124   5.7862   7.4126   10.616   29.810   17.141  -6.5235   13.521   22.012   7.7235   11.820   5.5460 10.19165 9.508423 
1 1 1   17   13    1 o   20.112   6.5993   22.390   12.494   0.0000   0.0000   22.390   12.494  ?   ?    20.112   6.5993 0.000000 6.599319 
1 1 1   17   13    2 o   18.589   5.8336   18.023   9.8403   30.453   16.579   11.263   12.227   22.369   7.6072   15.777   6.2999 6.591906 9.877199 
1 1 1   17   13    3 o   17.194   5.8841   15.184   9.9217   21.554   16.434   11.531   12.446   19.340   7.4251   15.896   6.3533 3.443578 9.772204 
1 1 1   17   13    4 o   11.859   5.2040   1.3974   9.6581  -6.7223   15.937   6.1099   12.142   12.716   5.9835   14.133   6.0149 -1.417048 8.484185 
1 1 1   17   13    5 o   14.919   5.8999   9.6776   10.624   19.493   16.319   2.4583   13.996   18.683   7.3355   13.765   6.1406 4.917573 9.566445 
1 1 1   17   13    6 o   10.894   5.0431  -4.2676   10.595 -10.8416   21.716  -2.2137   12.138   13.942   6.6800   12.046   5.5109 1.896123 8.659858 
1 1 1   17   13    7 o   11.320   5.1625  -2.2286   10.545 -10.1588   20.910   0.4759   12.211   13.793   6.5940   12.672   5.6882 1.121016 8.708403 
1 1 1   17   13    8 o   25.107   5.5569   32.037   11.072   11.038   23.180   38.244   12.602   17.294   7.7935   27.208   5.8558 -9.914221 9.748246 
1 1 1   17   13    9 o   16.171   6.2654   12.707   11.778   21.214   15.920   2.4179   17.507   19.170   7.3210   14.714   6.6878 4.456015 9.915814 
1 1 1   17   13   10 o   20.578   6.5327   23.571   12.308   15.526   16.379   34.006   18.653   17.459   7.1735   22.918   8.0556 -5.459621 10.78662 
1 1 1   17   13   11 o   15.135   6.1700   9.6984   11.998  -1.7896   16.086   24.106   18.014   13.525   6.2442   19.877   7.7353 -6.352713 9.941079 
1 1 1   17   13   12 o   17.223   6.1270   15.540   10.817  -2.4313   16.020   30.599   14.665   13.377   6.1954   22.815   7.1158 -9.438490 9.434925 
1 1 1   17   13   13 o   35.315   4.0509   57.386   11.451   76.887   17.244   42.006   15.314   39.091   5.5689   27.264   6.8892 11.82675 8.858533 
1 1 1   17   13   14 o   16.083   6.0398   12.905   10.728  -6.6986   15.772   29.786   14.636   12.564   5.9243   22.431   7.1244 -9.867025 9.265738 
1 1 1   17   13   15 o   26.730   5.2099   35.605   10.944   37.667   16.505   33.987   14.620   24.815   7.5148   24.147   7.0136 0.6682663 10.27927 
1 1 1   17   13   16 o   20.556   6.0099   22.797   10.703   29.854   15.988   17.065   14.408   21.963   7.4704   17.678   6.9068 4.285406 10.17405 
1 1 1   17   13   17 o   22.009   5.9021   25.848   10.805   14.354   16.413   34.641   14.355   16.964   7.0937   24.475   6.8999 -7.511141 9.895885 
1 1 1   17   13   18 o   21.769   5.9723   25.515   10.916   33.656   16.618   19.336   14.477   23.094   7.6128   18.374   6.9898 4.720514 10.33503 
1 1 1   17   13   19 o   17.473   6.1000   16.428   10.684   14.866   16.122   17.652   14.267   17.006   7.0644   17.776   6.8933 -0.7701073 9.870337 
1 1 1   17   13   20 o   8.7750   4.2972 -15.3250   10.347  -3.2100   15.851 -24.3212   13.659   13.052   6.0848   9.4028   4.6661 3.649002 7.667974 
1 1 1   17   13   21 o   22.236   5.8376   26.415   10.713   22.624   16.360   29.261   14.176   19.216   7.4003   22.126   7.0095 -2.910110 10.19304 
1 1 1   17   13   22 o   10.303   4.8426  -6.0527   10.389   1.9650   15.766 -12.2064   13.812   13.926   6.3362   10.886   5.2443 3.040628 8.224977 
1 1 1   17   13   23 o   19.662   6.1006   21.340   10.794   51.839   16.514  -1.4115   14.263   30.142   6.8740   12.809   5.9016 17.33304 9.059852 
1 1 1   17   13   24 f   9.5879   4.5923  -9.4665   10.247   1.6076   15.710 -17.6644   13.517   13.804   6.2977   10.034   4.9132 3.770648 7.987543 
1 1 1   17   13   25 o   11.081   5.0938  -2.5516   10.540  -0.3140   16.089  -4.2339   13.950   13.539   6.2486   12.154   5.6801 1.384505 8.444429 
1 1 1   17   13   26 o   19.448   7.0054   22.884   14.188   30.125   23.296   18.616   17.887   20.290   8.4653   17.862   7.4325 2.427231 11.26513 
1 1 1   17   13   27 o   9.2381   4.5846 -23.3467   13.190 -23.4407   20.899 -23.2845   17.004   12.088   5.9566   10.818   5.3389 1.269558 7.999033 
1 1 1   17   13   28 o   14.989   6.4054   9.0837   13.869   11.876   22.365   7.3391   17.679   16.724   7.5843   15.278   6.8520 1.445951 10.22115 
1 1 1   17   13   29 o   14.785   6.0992   9.6117   11.903 -11.9600   22.071   18.460   14.135   13.495   6.5327   17.825   6.8751 -4.329460 9.483788 
1 1 1   17   13   30 o   13.362   5.8157   4.8636   11.848 -14.5227   22.347   12.445   13.974   13.283   6.4630   15.908   6.5899 -2.625120 9.230247 
1 1 1   17   13   31 f   15.963   6.2791   13.195   11.976   20.823   23.313   10.460   13.959   18.249   8.0437   15.327   6.4830 2.921804 10.33108 
1 1 1   17   13   32 o   13.621   5.8696   5.9290   11.829   26.719   22.359  -2.1516   13.940   19.414   8.2082   12.444   5.7690 6.969990 10.03275 
1 1 1   17   13   33 o   15.999   6.3125   13.408   12.137 -10.3176   22.907   22.667   14.311   13.775   6.6651   19.164   7.0163 -5.388637 9.677403 
1 1 1   17   13   34 o   19.206   6.9522   22.727   13.994   20.115   22.500   24.375   17.871   17.968   7.9117   19.151   7.6267 -1.183418 10.98921 
1 1 1   17   13   35 o   18.916   6.5490   21.185   12.302 -11.2088   22.314   35.332   14.746   13.490   6.5394   23.936   7.0694 -10.44541 9.630116 
1 1 1   17   13   36 o   13.118   5.7788   4.1730   12.016  -1.1051   22.945   6.1673   14.104   14.716   6.9996   14.135   6.2425 0.5808115 9.378854 
1 1 1   17   13   37 o   12.151   5.5277   0.2256   11.994   6.3449   22.409  -2.2313   14.199   15.570   7.2507   12.417   5.7789 3.152590 9.271859 
1 1 1   17   13   38 o   11.552   5.4908  -7.0648   14.074   0.0000   0.0000  -7.0648   14.074  ?   ?    11.552   5.4908 0.000000 5.490829 
1 1 1   17   13   39 o   36.652   5.5135   70.174   15.963   0.0000   0.0000   70.174   15.963  ?   ?    36.652   5.5135 0.000000 5.513525 
1 1 1   17   13   40 o   16.826   7.1987   16.243   17.554   0.0000   0.0000   16.243   17.554  ?   ?    16.826   7.1987 0.000000 7.198742 
1 1 1   17   13   41 o   24.958   7.9498   43.494   18.213   0.0000   0.0000   43.494   18.213  ?   ?    24.958   7.9498 0.000000 7.949805 
1 1 1   17   13   42 o   10.623   5.2658 -24.2926   17.212   0.0000   0.0000 -24.2926   17.212  ?   ?    10.623   5.2658 0.000000 5.265840 
1 1 1   17   13   43 o   14.329   6.5804   4.3982   17.530   0.0000   0.0000   4.3982   17.530  ?   ?    14.329   6.5804 0.000000 6.580357 
1 1 1   17   13   44 o   22.507   7.8212   36.191   17.553   0.0000   0.0000   36.191   17.553  ?   ?    22.507   7.8212 0.000000 7.821151 
1 1 1   17   13   45 o   13.356   6.2633  -0.7925   17.209   0.0000   0.0000  -0.7925   17.209  ?   ?    13.356   6.2633 0.000000 6.263318 
1 1 1   17   13   46 o   10.658   5.2683 -21.7040   16.789   0.0000   0.0000 -21.7040   16.789  ?   ?    10.658   5.2683 0.000000 5.268291 
1 1 1   17   13   47 o   12.188   5.8496  -7.9301   16.812   0.0000   0.0000  -7.9301   16.812  ?   ?    12.188   5.8496 0.000000 5.849575 
1 1 1   17   13   48 o   11.592   5.6370 -12.9731   16.933   0.0000   0.0000 -12.9731   16.933  ?   ?    11.592   5.6370 0.000000 5.636988 
1 1 1   17   13   49 o   11.727   5.6783 -11.1086   16.705   0.0000   0.0000 -11.1086   16.705  ?   ?    11.727   5.6783 0.000000 5.678284 
1 1 1   17   13   50 o   11.606   5.6320 -11.8790   16.671   0.0000   0.0000 -11.8790   16.671  ?   ?    11.606   5.6320 0.000000 5.631981 
1 1 1   17   13   51 o   13.543   6.2819   2.1977   16.563   0.0000   0.0000   2.1977   16.563  ?   ?    13.543   6.2819 0.000000 6.281899 
1 1 1   17   13   52 o   9.6488   4.8390 -31.3274   16.463   0.0000   0.0000 -31.3274   16.463  ?   ?    9.6488   4.8390 0.000000 4.839024 
1 1 1   17   13   53 o   10.630   5.2382 -18.7443   16.158   0.0000   0.0000 -18.7443   16.158  ?   ?    10.630   5.2382 0.000000 5.238154 
1 1 1   17   13   54 o   15.042   6.7340   10.476   16.992   0.0000   0.0000   10.476   16.992  ?   ?    15.042   6.7340 0.000000 6.734025 
1 1 1   17   13   55 o   15.542   7.3633   8.9524   24.911   0.0000   0.0000   8.9524   24.911  ?   ?    15.542   7.3633 0.000000 7.363349 
1 1 1   17   13   56 o   12.554   6.2183 -20.2747   23.840   0.0000   0.0000 -20.2747   23.840  ?   ?    12.554   6.2183 0.000000 6.218283 
1 1 1   17   14  -48 o   16.361   7.4583   16.552   21.981   0.0000   0.0000   16.552   21.981  ?   ?    16.361   7.4583 0.000000 7.458343 
1 1 1   17   14  -47 o   19.719   8.2378   34.316   22.103   0.0000   0.0000   34.316   22.103  ?   ?    19.719   8.2378 0.000000 8.237785 
1 1 1   17   14  -46 o   20.967   8.5182   40.527   22.777   0.0000   0.0000   40.527   22.777  ?   ?    20.967   8.5182 0.000000 8.518209 
1 1 1   17   14  -45 o   8.9127   4.4501 -24.3480   13.229 -51.1094   22.211  -9.6346   16.469   10.158   5.1559   11.676   5.6499 -1.518085 7.648849 
1 1 1   17   14  -44 o   15.436   6.8667   12.754   17.376   0.0000   0.0000   12.754   17.376  ?   ?    15.436   6.8667 0.000000 6.866749 
1 1 1   17   14  -43 o   11.889   5.7249  -7.7964   16.414   0.0000   0.0000  -7.7964   16.414  ?   ?    11.889   5.7249 0.000000 5.724857 
1 1 1   17   14  -42 o   14.293   6.2098   9.2349   13.458  -9.1182   22.156   19.966   16.942   13.128   6.3982   17.129   7.1878 -4.001322 9.622961 
1 1 1   17   14  -41 o   10.453   5.0585 -10.7466   13.209  -3.4867   21.734 -14.9991   16.634   13.664   6.5818   11.145   5.4558 2.519522 8.549070 
1 1 1   17   14  -40 o   14.325   6.2248   9.1442   13.528   39.282   23.039  -6.7161   16.713   20.785   8.5204   12.170   5.8385 8.615257 10.32890 
1 1 1   17   14  -39 o   13.613   6.0726   5.9778   13.688  -0.0067   22.334   9.5781   17.323   14.212   6.7997   14.928   6.7315 -0.7167253 9.568127 
1 1 1   17   14  -38 o   18.363   6.9453   22.394   14.243   25.053   23.512   20.852   17.902   17.937   7.9831   17.436   7.3568 0.5012169 10.85599 
1 1 1   17   14  -37 o   22.504   7.0598   33.237   14.413   38.694   24.347   30.292   17.884   20.509   8.6122   20.048   7.7330 0.4618130 11.57445 
1 1 1   17   14  -36 o   24.542   6.9561   38.208   14.550   23.106   23.691   47.355   18.437   17.669   7.9278   25.579   7.9788 -7.909725 11.24772 
1 1 1   17   14  -35 o   10.317   5.0317 -13.9652   13.769 -22.3967   22.115  -8.6277   17.596   12.077   5.9835   12.252   5.9066 -0.1745882 8.407759 
1 1 1   17   14  -34 f   11.078   5.3260  -9.1310   14.073 -11.5540   23.361  -7.7507   17.632   13.304   6.5029   12.383   5.9553 0.9216471 8.817798 
1 1 1   17   14  -33 f   13.686   6.1464   5.3065   14.279   1.2439   23.811   7.5876   17.843   14.713   7.0345   14.757   6.7244 -0.4452133E-01 9.731456 
1 1 1   17   14  -32 o   14.878   6.7607   8.0960   17.878   25.779   22.834 -19.9149   28.739   18.327   8.0232   13.655   6.7751 4.672129 10.50108 
1 1 1   17   14  -31 o   10.561   5.1623 -15.3158   14.725   0.5771   23.025 -26.3159   19.155   14.578   6.9554   10.999   5.4695 3.578875 8.848317 
1 1 1   17   14  -30 o   13.233   6.0638   2.2369   14.777   14.309   22.857  -6.4332   19.370   16.440   7.5363   13.056   6.2694 3.383903 9.803129 
1 1 1   17   14  -29 o   19.337   6.7018   23.440   12.884   46.832   23.987   13.954   15.275   22.907   8.9226   15.962   6.7682 6.944166 11.19917 
1 1 1   17   14  -28 o   13.101   5.8319   4.1855   12.554  -1.2302   22.942   6.5005   15.000   14.420   6.8972   14.178   6.3387 0.2415323 9.367524 
1 1 1   17   14  -27 o   26.049   6.2805   38.919   13.179   46.754   24.560   35.751   15.618   22.768   8.9808   23.196   7.3586 -0.4284687 11.61048 
1 1 1   17   14  -26 o   12.000   5.5287  -0.8531   12.516 -13.6445   22.600   4.8059   15.032   13.092   6.3985   13.859   6.2579 -0.7665091 8.950022 
1 1 1   17   14  -25 o   29.570   5.7536   47.193   13.369   42.239   25.297   49.113   15.748   21.589   8.8974   28.642   6.8397 -7.052670 11.22255 
1 1 1   17   14  -24 o   14.403   6.1407   8.8859   12.694   27.477   24.100   1.7482   14.933   18.837   8.2444   13.258   6.0829 5.578249 10.24562 
1 1 1   17   14  -23 o   21.811   7.1800   31.002   14.784   2.5936   24.286   47.728   18.635   15.156   7.2067   26.128   7.9996 -10.97107 10.76712 
1 1 1   17   14  -22 o   15.251   6.2562   11.805   12.432   13.510   23.245   11.122   14.712   16.515   7.5816   15.294   6.5676 1.221181 10.03066 
1 1 1   17   14  -21 o   14.464   6.1155   9.1964   12.412   26.047   23.784   2.8895   14.551   18.637   8.1728   13.401   6.0932 5.236355 10.19422 
1 1 1   17   14  -20 o   19.660   6.6317   23.642   12.598   15.053   24.218   26.828   14.750   16.838   7.7331   20.258   7.1598 -3.419720 10.53870 
1 1 1   17   14  -19 o   17.488   6.5144   18.113   12.429   17.449   23.568   18.369   14.629   17.206   7.7963   17.387   6.9081 -0.1806374 10.41650 
1 1 1   17   14  -18 o   10.715   5.1026  -7.6547   12.268 -24.4847   22.561  -0.5888   14.618   12.224   6.0538   12.786   5.9207 -0.5629616 8.467760 
1 1 1   17   14  -17 o   13.872   5.8065   7.9421   11.013   13.256   16.630   3.7913   14.698   16.069   6.9422   13.667   6.1782 2.401386 9.293262 
1 1 1   17   14  -16 o   16.798   6.1432   15.887   10.966   26.363   16.901   8.2697   14.411   19.651   7.5335   14.620   6.3876 5.030988 9.877048 
1 1 1   17   14  -15 o   12.350   5.4591   2.8513   10.811 -10.9601   16.807   12.600   14.120   11.942   5.7610   15.726   6.5780 -3.784228 8.744082 
1 1 1   17   14  -14 o   17.636   6.2529   17.899   11.258   40.920   17.800   2.5534   14.533   24.363   7.8691   13.407   6.0934 10.95594 9.952492 
1 1 1   17   14  -13 o   40.602   4.2108   78.294   13.734   62.354   26.452   84.177   16.070   26.549   9.5652   41.143   4.8870 -14.59415 10.74135 
1 1 1   17   14  -12 o   14.911   6.2194   10.276   12.569   3.8955   23.667   12.783   14.834   15.408   7.2628   15.876   6.6976 -0.4680882 9.879540 
1 1 1   17   14  -11 o   14.164   6.0688   7.6960   12.510   37.776   24.011  -3.5113   14.656   21.323   8.7148   12.349   5.7876 8.974180 10.46152 
1 1 1   17   14  -10 o   12.102   5.4084   1.6415   10.909   19.763   16.626 -12.0577   14.456   17.843   7.2672   11.004   5.3171 6.839168 9.004637 
1 1 1   17   14   -9 o   13.039   5.6422   4.9654   11.020   24.017   16.870  -9.2169   14.555   19.066   7.4665   11.438   5.4772 7.627517 9.259999 
1 1 1   17   14   -8 f   11.605   5.2659  -0.2548   10.800   9.5311   16.657  -7.3525   14.186   15.351   6.7815   11.582   5.5074 3.769082 8.736172 
1 1 1   17   14   -7 f   18.846   6.5636   21.117   12.366  -5.3676   16.731   53.000   18.357   12.727   6.0311   28.726   7.6883 -15.99927 9.771550 
1 1 1   17   14   -6 o   9.9351   4.8057 -11.9485   11.886 -22.2076   16.602  -1.1589   17.026   10.678   5.2707   13.454   6.2836 -2.776504 8.201492 
1 1 1   17   14   -5 f   14.650   6.1302   9.4079   12.270   18.803   17.097  -0.5703   17.620   17.617   7.2928   13.702   6.3970 3.915282 9.700845 
1 1 1   17   14   -4 o   10.376   5.0471 -14.3612   13.601   8.4602   22.925 -26.7554   16.895   16.011   7.4140   10.370   5.1533 5.641246 9.029099 
1 1 1   17   14   -3 o   13.874   5.9673   6.7683   12.182   8.6359   17.010   4.8019   17.455   15.244   6.7869   14.581   6.6468 0.6625862 9.499560 
1 1 1   17   14   -2 o   23.560   7.0448   34.231   14.572   36.449   17.665   29.507   25.780   22.996   7.8519   19.514   8.5342 3.482489 11.59675 
1 1 1   17   14   -1 o   12.839   5.8685   0.5680   13.725   7.5979   16.581 -14.7276   24.459   14.964   6.6789   13.627   6.6590 1.337102 9.431365 
1 1 1   17   14    0 o   25.431   7.7405   42.802   17.481   42.802   17.481   0.0000   0.0000   25.431   7.7405  ?   ?  0.000000 7.740533 
1 1 1   17   14    1 o   16.505   6.7844   14.822   14.658   23.914   17.432  -7.1233   27.082   19.022   7.5462   14.820   7.1888 4.201550 10.42233 
1 1 1   17   14    2 o   21.158   7.1263   28.322   14.547   28.091   17.474   28.844   26.255   20.267   7.6866   19.364   8.5357 0.9031849 11.48660 
1 1 1   17   14    3 o   20.118   7.0937   25.580   14.473   9.0928   17.229   65.094   26.673   15.371   6.8378   27.445   9.6341 -12.07434 11.81403 
1 1 1   17   14    4 o   19.792   6.9891   24.448   14.053   28.975   16.960   14.531   25.102   20.662   7.6258   17.084   7.8558 3.578259 10.94840 
1 1 1   17   14    5 f   16.294   6.7307   14.159   14.521   13.459   24.498   14.538   18.030   16.880   7.7618   16.611   7.2024 0.2690563 10.58868 
1 1 1   17   14    6 o   20.676   6.4990   25.219   12.208   15.053   16.889   36.343   17.667   16.655   7.0914   22.926   7.8517 -6.271017 10.58008 
1 1 1   17   14    7 f   17.806   6.4958   18.498   12.250   17.765   16.969   19.295   17.702   17.332   7.2275   17.718   7.3847 -0.3859158 10.33300 
1 1 1   17   14    8 f   11.881   5.4438  -0.9464   11.905 -13.5307   16.444   12.912   17.257   11.552   5.6031   16.165   7.0273 -4.613210 8.987655 
1 1 1   17   14    9 o   10.125   4.8793 -10.8875   11.976 -35.7788   16.556   16.429   17.344   9.5100   4.7808   16.984   7.2070 -7.473720 8.648546 
1 1 1   17   14   10 o   17.700   6.4520   18.236   12.082   22.101   16.671   13.961   17.533   18.507   7.3675   16.403   7.1074 2.103676 10.23699 
1 1 1   17   14   11 o   18.373   6.5284   20.010   12.277   26.984   16.951   12.315   17.806   19.938   7.5686   16.055   7.0549 3.883511 10.34675 
1 1 1   17   14   12 o   11.231   5.2410  -3.8628   11.806   4.6929   16.251 -13.4248   17.181   14.255   6.4650   11.788   5.7197 2.467358 8.631979 
1 1 1   17   14   13 o   17.201   6.8202   17.412   14.231   10.434   23.489   21.459   17.888   16.257   7.5198   18.186   7.4871 -1.929474 10.61150 
1 1 1   17   14   14 o   15.088   6.4418   10.267   14.004  -0.4081   22.910   16.635   17.695   14.728   7.0019   16.973   7.2436 -2.245335 10.07456 
1 1 1   17   14   15 o   18.254   6.9401   20.684   14.266   10.933   23.540   26.345   17.936   16.297   7.5346   19.481   7.6777 -3.184641 10.75720 
1 1 1   17   14   16 o   22.387   6.4808   29.547   12.502   33.056   17.236   25.652   18.160   21.755   7.7347   19.225   7.6774 2.529795 10.89807 
1 1 1   17   14   17 o   15.543   6.2676   12.571   12.227   0.4088   16.519   27.306   18.183   13.487   6.2618   19.665   7.7365 -6.178539 9.953056 
1 1 1   17   14   18 o   25.587   6.0386   36.403   12.391   46.119   16.978   25.330   18.125   26.723   7.4931   19.095   7.6550 7.628559 10.71189 
1 1 1   17   14   19 o   9.9371   4.8161 -12.2193   12.088  -5.0911   21.901 -15.3422   14.496   13.912   6.6768   10.552   5.1501 3.359776 8.432227 
1 1 1   17   14   20 o   11.104   5.2329  -5.2922   12.271  -3.6404   22.367  -6.0036   14.678   14.153   6.7807   11.879   5.6352 2.274099 8.816632 
1 1 1   17   14   21 o   12.887   5.7719   3.0873   12.498  -2.1974   22.954   5.3144   14.901   14.410   6.8945   13.984   6.2797 0.4266148 9.325695 
1 1 1   17   14   22 o   22.921   6.6414   31.687   13.123   34.508   24.267   30.521   15.602   20.229   8.5519   21.308   7.3752 -1.078781 11.29285 
1 1 1   17   14   23 o   23.268   6.6340   32.573   13.195   52.581   24.274   24.182   15.720   24.567   9.1129   19.051   7.2751 5.516270 11.66073 
1 1 1   17   14   24 o   19.941   6.7341   24.727   12.990   5.8658   23.629   32.896   15.551   15.464   7.2794   22.203   7.3660 -6.738708 10.35608 
1 1 1   17   14   25 o   13.201   5.8702   4.3071   12.685   28.383   23.172  -5.9954   15.158   19.064   8.2150   12.007   5.7048 7.056291 10.00158 
1 1 1   17   14   26 o   17.528   6.6367   18.665   13.014   29.703   23.772   13.941   15.551   19.226   8.3031   16.032   6.8146 3.193554 10.74150 
1 1 1   17   14   27 o   20.090   6.7411   25.266   13.018   3.0197   23.066   35.664   15.769   14.966   7.0892   23.084   7.4019 -8.117293 10.24917 
1 1 1   17   14   28 o   20.759   6.7159   26.845   12.962   15.851   23.290   31.779   15.602   16.752   7.6522   21.641   7.3794 -4.889225 10.63065 
1 1 1   17   14   29 o   26.255   6.2636   39.547   13.217   10.381   24.236   51.893   15.769   15.999   7.4804   29.629   6.6880 -13.62964 10.03418 
1 1 1   17   14   30 o   22.353   7.2108   32.999   14.950   58.980   24.863   18.285   18.710   25.702   9.2717   17.048   7.3644 8.653603 11.84055 
1 1 1   17   14   31 o   12.178   5.5902   0.0894   12.636   15.591   23.493  -6.2202   14.988   16.631   7.6300   11.851   5.6423 4.780290 9.489641 
1 1 1   17   14   32 o   11.394   5.4710  -8.7272   14.744 -12.0329   23.859  -6.6849   18.754   13.396   6.5530   12.836   6.1651 0.5603771 8.997201 
1 1 1   17   14   33 f   23.198   7.8862   39.432   17.817   38.971   23.790   40.022   26.887   20.862   8.6161   20.390   8.8180 0.4722919 12.32860 
1 1 1   17   14   34 f   14.398   6.5818   6.1764   17.270   12.381   23.598  -0.9786   25.341   16.073   7.4699   14.664   7.0744 1.408317 10.28813 
1 1 1   17   14   35 o   12.001   5.6246  -2.6544   13.844   3.1333   23.089  -5.9030   17.298   14.794   7.0324   12.519   5.9882 2.275840 9.236478 
1 1 1   17   14   36 o   14.997   6.4707   11.011   14.412   32.356   23.490  -1.8734   18.250   19.400   8.3142   13.286   6.2969 6.113826 10.42963 
1 1 1   17   14   37 o   18.470   7.0019   22.757   14.496   20.600   24.571   23.909   17.953   17.222   7.8641   18.242   7.5044 -1.020681 10.87021 
1 1 1   17   14   38 o   30.305   6.3583   53.276   15.205   74.398   26.344   42.724   18.619   28.576   9.5897   23.718   8.0619 4.858622 12.52820 
1 1 1   17   14   39 o   14.148   6.2463   7.9666   14.111  -6.8117   23.433   16.374   17.675   13.666   6.6425   16.358   7.1116 -2.691835 9.731287 
1 1 1   17   14   40 o   13.770   6.1587   6.3542   14.174   36.655   24.032  -9.8088   17.552   19.963   8.4779   12.018   5.8194 7.945265 10.28305 
1 1 1   17   14   41 o   13.950   6.4584   4.3582   17.381   0.0000   0.0000   4.3582   17.381  ?   ?    13.950   6.4584 0.000000 6.458396 
1 1 1   17   14   42 o   23.926   8.0475   43.919   18.552   0.0000   0.0000   43.919   18.552  ?   ?    23.926   8.0475 0.000000 8.047523 
1 1 1   17   14   43 o   17.347   7.3164   21.259   17.694   0.0000   0.0000   21.259   17.694  ?   ?    17.347   7.3164 0.000000 7.316429 
1 1 1   17   14   44 o   21.964   7.9225   37.731   18.153   0.0000   0.0000   37.731   18.153  ?   ?    21.964   7.9225 0.000000 7.922499 
1 1 1   17   14   45 o   11.178   5.4698 -14.4969   16.670   0.0000   0.0000 -14.4969   16.670  ?   ?    11.178   5.4698 0.000000 5.469790 
1 1 1   17   14   46 o   13.251   6.2426   0.1857   17.439   0.0000   0.0000   0.1857   17.439  ?   ?    13.251   6.2426 0.000000 6.242555 
1 1 1   17   14   47 o   11.918   5.9335 -24.8242   22.811   0.0000   0.0000 -24.8242   22.811  ?   ?    11.918   5.9335 0.000000 5.933481 
1 1 1   17   14   48 o   18.762   8.3382   32.160   25.558   0.0000   0.0000   32.160   25.558  ?   ?    18.762   8.3382 0.000000 8.338245 
1 1 1   17   15  -35 o   21.130   8.8599   45.994   25.710   0.0000   0.0000   45.994   25.710  ?   ?    21.130   8.8599 0.000000 8.859882 
1 1 1   17   15  -34 o   13.137   6.4735 -13.1842   24.670   0.0000   0.0000 -13.1842   24.670  ?   ?    13.137   6.4735 0.000000 6.473456 
1 1 1   17   15  -33 o   14.774   7.0338   5.6960   23.285   0.0000   0.0000   5.6960   23.285  ?   ?    14.774   7.0338 0.000000 7.033843 
1 1 1   17   15  -32 o   11.737   5.5834  -4.6629   14.614   5.1408   25.368  -9.5327   17.879   14.915   7.1653   12.017   5.8317 2.898333 9.238549 
1 1 1   17   15  -31 o   12.336   5.7833  -0.9713   14.653 -27.5922   23.526   15.901   18.729   11.815   5.9047   16.010   7.1251 -4.194526 9.253778 
1 1 1   17   15  -30 o   16.451   6.7777   17.468   14.673   36.866   25.085   7.3794   18.091   19.398   8.4522   14.411   6.6422 4.987225 10.74984 
1 1 1   17   15  -29 o   18.188   7.0334   23.193   14.821   50.121   24.680   8.0022   18.536   22.298   8.9348   14.565   6.7168 7.733429 11.17791 
1 1 1   17   15  -28 o   15.487   6.6080   13.978   14.720 -19.3081   23.880   34.374   18.693   12.480   6.1891   20.502   7.9066 -8.022027 10.04090 
1 1 1   17   15  -27 o   14.299   6.3262   9.1123   14.550 -13.9819   24.155   22.262   18.227   12.963   6.3911   17.409   7.3879 -4.445818 9.768712 
1 1 1   17   15  -26 o   12.779   6.0417  -1.3664   16.605   2.8190   24.366  -4.9957   22.690   14.594   7.0140   13.542   6.5713 1.052176 9.611326 
1 1 1   17   15  -25 o   13.968   6.4156   5.7476   16.673   6.5285   23.069   4.8936   24.124   14.904   7.0686   14.820   7.0844 0.8418560E-01 10.00764 
1 1 1   17   15  -24 o   12.472   6.0105  -6.6777   18.180   8.3748   24.441 -25.3218   27.201   15.274   7.2530   12.751   6.3689 2.522249 9.652412 
1 1 1   17   15  -23 o   9.3283   4.6445 -23.1811   13.986 -31.0583   23.364 -18.7815   17.461   11.597   5.8089   10.976   5.4157 0.6211252 7.941864 
1 1 1   17   15  -22 o   12.224   5.7265  -1.4314   14.320  -9.0491   24.326   2.6081   17.714   13.495   6.6044   13.667   6.3917 -0.1723595 9.190833 
1 1 1   17   15  -21 o   10.672   5.1829 -11.6937   14.187 -36.6250   23.839   1.9775   17.653   11.378   5.7220   13.570   6.3574 -2.192369 8.553271 
1 1 1   17   15  -20 o   12.402   5.9647  -6.6033   17.692   0.0000   0.0000  -6.6033   17.692  ?   ?    12.402   5.9647 0.000000 5.964712 
1 1 1   17   15  -19 o   15.243   6.8789   11.219   18.131   0.0000   0.0000   11.219   18.131  ?   ?    15.243   6.8789 0.000000 6.878886 
1 1 1   17   15  -18 o   16.290   7.1722   16.344   18.487   0.0000   0.0000   16.344   18.487  ?   ?    16.290   7.1722 0.000000 7.172180 
1 1 1   17   15  -17 o   16.898   6.8790   18.389   14.890   16.946   24.825   19.199   18.608   16.536   7.6772   16.916   7.3259 -0.3801975 10.61168 
1 1 1   17   15  -16 o   16.969   6.8774   18.572   14.805   22.000   24.113   16.497   18.757   17.294   7.8556   16.355   7.2118 0.9388103 10.66396 
1 1 1   17   15  -15 o   17.830   7.0029   21.367   14.877   18.090   25.022   23.159   18.502   16.721   7.7438   17.860   7.5041 -1.138628 10.78321 
1 1 1   17   15  -14 o   13.055   6.0052   2.2779   14.686   21.935   24.350  -8.9602   18.412   17.300   7.8725   12.351   5.9761 4.948668 9.883769 
1 1 1   17   15  -13 o   19.958   7.2695   27.967   15.333   25.413   25.878   29.348   19.034   17.787   8.1024   19.370   7.8168 -1.583166 11.25838 
1 1 1   17   15  -12 o   18.016   7.0587   21.976   15.084   28.930   25.080   18.035   18.880   18.411   8.2161   16.709   7.3055 1.701923 10.99430 
1 1 1   17   15  -11 o   10.425   5.1031 -15.2326   14.548 -23.4933   24.424 -10.6900   18.112   12.452   6.1896   12.087   5.8666 0.3655596 8.528089 
1 1 1   17   15  -10 o   12.397   5.7847  -0.9807   14.375   20.690   23.809 -13.4126   18.033   17.154   7.7975   11.768   5.7438 5.385345 9.684595 
1 1 1   17   15   -9 o   15.792   6.4143   14.344   12.911   19.409   18.274   9.2974   18.243   17.045   7.3196   14.990   6.8185 2.054142 10.00340 
1 1 1   17   15   -8 o   21.406   7.3470   31.970   15.471   28.822   25.394   33.828   19.510   18.404   8.2363   20.516   8.0309 -2.112379 11.50361 
1 1 1   17   15   -7 o   11.340   5.3314  -3.7778   12.604   19.639   17.368 -29.8289   18.319   17.153   7.2423   10.381   5.1913 6.772272 8.910676 
1 1 1   17   15   -6 o   18.107   7.0216   21.995   14.803   26.607   17.807   11.678   26.630   18.936   7.5888   16.046   7.6054 2.890896 10.74396 
1 1 1   17   15   -5 o   20.675   7.1790   29.221   14.788   28.915   17.578   29.961   27.355   19.659   7.6437   18.440   8.3727 1.218985 11.33703 
1 1 1   17   15   -4 o   29.380   6.7189   52.083   15.740   44.975   18.662   69.603   29.300   24.468   8.0674   25.372   9.8676 -0.9033489 12.74570 
1 1 1   17   15   -3 o   13.913   6.2156   6.6068   14.396   13.570   17.438  -8.2959   25.511   15.776   6.9552   13.905   6.7962 1.871534 9.724411 
1 1 1   17   15   -2 o   10.972   5.2081  -5.9025   12.577  -6.5164   17.391  -5.2295   18.209   12.419   5.9575   12.792   6.1257 -0.3730917 8.544904 
1 1 1   17   15   -1 o   16.512   6.5198   16.478   12.956   1.1028   17.567   34.816   19.185   13.537   6.3418   20.935   8.0263 -7.398413 10.22937 
1 1 1   17   15    0 o   12.769   5.7465   3.3517   12.552   7.5371   17.247  -1.3614   18.302   14.566   6.6271   13.331   6.3148 1.234246 9.153961 
1 1 1   17   15    1 o   14.315   6.1140   9.3979   12.624   10.111   17.145   8.5539   18.657   15.045   6.7477   14.932   6.8315 0.1130495 9.602116 
1 1 1   17   15    2 o   16.472   6.5182   16.366   12.975   22.653   17.947   9.4823   18.780   17.877   7.4422   15.106   6.8893 2.770899 10.14148 
1 1 1   17   15    3 o   11.094   5.2353  -4.6965   12.361   3.4781   16.731 -14.5233   18.344   13.752   6.3560   11.755   5.7492 1.997359 8.570421 
1 1 1   17   15    4 o   13.510   6.1290   4.4985   14.622   9.1521   17.547  -6.0772   26.452   14.901   6.7419   14.242   6.9522 0.6595631 9.684275 
1 1 1   17   15    5 o   17.615   6.9499   20.411   14.711   18.711   17.591   24.368   26.833   16.927   7.2231   17.664   8.1226 -0.7372494 10.86969 
1 1 1   17   15    6 o   17.368   6.9003   19.594   14.596   13.276   17.373   34.756   26.913   15.702   6.9316   19.230   8.5506 -3.527155 11.00726 
1 1 1   17   15    7 o   13.290   6.0492   3.7023   14.388  -1.0797   17.286   14.487   25.960   13.136   6.1965   16.343   7.6732 -3.207220 9.862817 
1 1 1   17   15    8 o   13.602   6.0007   6.4756   13.001   23.568   17.949 -12.3858   18.855   18.087   7.4783   12.110   5.9024 5.976277 9.527005 
1 1 1   17   15    9 o   13.863   6.2619   5.8628   15.066   16.768   25.867   0.2637   18.535   16.616   7.7552   13.589   6.4123 3.026345 10.06285 
1 1 1   17   15   10 o   10.844   5.1581  -6.3343   12.462 -17.5439   16.841   7.2316   18.527   10.975   5.3962   14.662   6.7448 -3.687469 8.637721 
1 1 1   17   15   11 o   15.139   6.5580   11.690   14.919   12.777   24.120   11.016   18.986   16.003   7.4755   15.362   6.9751 0.6409645 10.22425 
1 1 1   17   15   12 o   13.844   6.2476   5.9346   14.957  -4.3024   24.696   11.864   18.796   14.111   6.8494   15.493   6.9965 -1.381731 9.791067 
1 1 1   17   15   13 o   23.580   7.2785   37.533   15.388   20.401   25.475   47.374   19.308   17.069   7.8727   24.819   8.2069 -7.749598 11.37247 
1 1 1   17   15   14 o   15.360   6.6100   12.642   14.962  -5.2957   23.824   24.326   19.228   13.863   6.7286   18.070   7.6243 -4.207098 10.16877 
1 1 1   17   15   15 o   21.222   7.2367   31.100   15.005   36.695   25.723   28.215   18.473   19.644   8.5591   19.163   7.7122 0.4806976 11.52110 
1 1 1   17   15   16 o   15.090   6.5404   11.637   14.857  -1.0898   23.955   19.592   18.939   14.297   6.8926   17.003   7.3770 -2.705727 10.09592 
1 1 1   17   15   17 o   15.455   6.6188   13.130   14.867 -28.2674   23.630   40.252   19.127   11.908   5.9461   22.477   8.1290 -10.56821 10.07156 
1 1 1   17   15   18 o   11.287   5.4198  -8.0382   14.475   23.058   23.773 -26.3586   18.247   17.436   7.8718   10.595   5.2801 6.840408 9.478609 
1 1 1   17   15   19 o   20.720   7.2528   30.083   15.110   23.429   24.943   33.940   18.992   17.422   7.9434   20.547   7.9573 -3.124418 11.24347 
1 1 1   17   15   20 o   33.003   7.6980   72.876   20.328   0.0000   0.0000   72.876   20.328  ?   ?    33.003   7.6980 0.000000 7.698002 
1 1 1   17   15   21 o   16.579   7.2654   18.051   18.767   0.0000   0.0000   18.051   18.767  ?   ?    16.579   7.2654 0.000000 7.265389 
1 1 1   17   15   22 o   11.987   5.6673  -3.3928   14.612 -12.5414   24.315   1.7787   18.281   13.189   6.4848   13.646   6.4171 -0.4568338 9.123181 
1 1 1   17   15   23 o   16.834   6.8353   18.469   14.657   14.118   23.879   21.099   18.565   15.985   7.4578   17.215   7.3849 -1.229367 10.49548 
1 1 1   17   15   24 o   15.537   6.6155   13.895   14.698 -12.8100   23.987   29.952   18.599   13.082   6.4337   19.402   7.7625 -6.320252 10.08212 
1 1 1   17   15   25 o   17.518   7.3216   22.136   17.472  -1.4245   23.820   49.579   25.707   14.101   6.8165   21.900   8.9915 -7.798758 11.28324 
1 1 1   17   15   26 o   11.174   5.4746 -14.6638   16.848 -34.4132   22.760   9.2795   25.060   11.204   5.6289   15.378   7.3143 -4.173258 9.229500 
1 1 1   17   15   27 o   22.139   7.8945   38.517   17.969   31.556   24.555   46.540   26.364   18.538   8.2092   20.942   8.8862 -2.404860 12.09780 
1 1 1   17   15   28 o   17.918   7.3553   23.820   17.199   39.796   23.860   6.5396   24.814   20.247   8.5153   15.006   7.1765 5.241318 11.13608 
1 1 1   17   15   29 o   15.262   6.8018   12.499   17.130   12.367   23.348   12.654   25.211   15.613   7.3134   15.746   7.4444 -0.1327581 10.43574 
1 1 1   17   15   30 o   10.862   5.3401 -16.4001   16.472  -1.2030   22.528 -33.8587   24.146   13.890   6.6931   11.551   5.8021 2.339375 8.857924 
1 1 1   17   15   31 o   14.665   6.6632   9.3004   17.363  -7.1309   24.310   26.412   24.808   13.578   6.6361   17.652   7.9984 -4.073846 10.39285 
1 1 1   17   15   32 o   16.919   7.8256   21.647   25.433   0.0000   0.0000   21.647   25.433  ?   ?    16.919   7.8256 0.000000 7.825565 
1 1 1   17   15   33 o   16.626   7.7405   19.482   25.509   0.0000   0.0000   19.482   25.509  ?   ?    16.626   7.7405 0.000000 7.740510 
1 1 1   17   15   34 o   24.857   9.3983   63.004   26.076   0.0000   0.0000   63.004   26.076  ?   ?    24.857   9.3983 0.000000 9.398332 
1 1 1   17   15   35 o   13.633   6.7453 -13.5064   27.771   0.0000   0.0000 -13.5064   27.771  ?   ?    13.633   6.7453 0.000000 6.745344 
1 1 1   17   16   -9 o   17.999   8.3864   32.626   30.039   0.0000   0.0000   32.626   30.039  ?   ?    17.999   8.3864 0.000000 8.386357 
1 1 1   17   16   -8 o   13.095   6.5107 -18.1789   27.090   0.0000   0.0000 -18.1789   27.090  ?   ?    13.095   6.5107 0.000000 6.510660 
1 1 1   17   16   -7 o   14.198   6.5921   6.3085   18.307   0.0000   0.0000   6.3085   18.307  ?   ?    14.198   6.5921 0.000000 6.592146 
1 1 1   17   16   -6 o   13.328   6.3338  -0.0371   18.707   0.0000   0.0000  -0.0371   18.707  ?   ?    13.328   6.3338 0.000000 6.333850 
1 1 1   17   16   -5 o   16.596   7.3272   19.396   19.419   0.0000   0.0000   19.396   19.419  ?   ?    16.596   7.3272 0.000000 7.327212 
1 1 1   17   16   -4 o   11.252   5.5493 -17.4632   18.260   0.0000   0.0000 -17.4632   18.260  ?   ?    11.252   5.5493 0.000000 5.549253 
1 1 1   17   16   -3 o   12.474   6.0370  -7.0577   18.822   0.0000   0.0000  -7.0577   18.822  ?   ?    12.474   6.0370 0.000000 6.037005 
1 1 1   17   16   -2 o   15.416   6.9813   13.251   18.869   0.0000   0.0000   13.251   18.869  ?   ?    15.416   6.9813 0.000000 6.981346 
1 1 1   17   16   -1 o   16.863   7.3110   20.519   18.574   0.0000   0.0000   20.519   18.574  ?   ?    16.863   7.3110 0.000000 7.310952 
1 1 1   17   16    0 o   20.710   8.0327   36.452   19.376   0.0000   0.0000   36.452   19.376  ?   ?    20.710   8.0327 0.000000 8.032651 
1 1 1   17   16    1 o   13.181   6.2594  -0.3470   18.203   0.0000   0.0000  -0.3470   18.203  ?   ?    13.181   6.2594 0.000000 6.259406 
1 1 1   17   16    2 o   13.331   6.3487  -0.3585   18.999   0.0000   0.0000  -0.3585   18.999  ?   ?    13.331   6.3487 0.000000 6.348672 
1 1 1   17   16    3 o   18.144   7.5896   26.154   18.797   0.0000   0.0000   26.154   18.797  ?   ?    18.144   7.5896 0.000000 7.589569 
1 1 1   17   16    4 o   14.576   6.7386   8.3367   18.824   0.0000   0.0000   8.3367   18.824  ?   ?    14.576   6.7386 0.000000 6.738611 
1 1 1   17   16    5 o   19.053   7.8439   30.492   19.633   0.0000   0.0000   30.492   19.633  ?   ?    19.053   7.8439 0.000000 7.843883 
1 1 1   17   16    6 o   16.869   7.3791   20.681   19.282   0.0000   0.0000   20.681   19.282  ?   ?    16.869   7.3791 0.000000 7.379139 
1 1 1   17   16    8 o   15.183   7.3312   6.9312   27.366   0.0000   0.0000   6.9312   27.366  ?   ?    15.183   7.3312 0.000000 7.331166 
1 1 1   18    0 -109 o   13.764   9.0116   12.338   25.080   12.338   25.080   12.338   25.080   13.764   9.0116   13.764   9.0116 0.000000 0.000000 
1 1 1   18    0 -108 o   14.162   9.1735   14.783   25.026   14.783   25.026   14.783   25.026   14.162   9.1735   14.162   9.1735 0.000000 0.000000 
1 1 1   18    0 -107 o   11.733   8.0421  -1.1324   24.610  -1.1324   24.610  -1.1324   24.610   11.733   8.0421   11.733   8.0421 0.000000 0.000000 
1 1 1   18    0 -106 o   20.632   10.974   40.604   24.961   40.604   24.961   40.604   24.961   20.632   10.974   20.632   10.974 0.000000 0.000000 
1 1 1   18    0 -105 o   9.2547   6.4742 -10.4733   18.149 -10.4733   18.149 -10.4733   18.149   9.2547   6.4742   9.2547   6.4742 0.000000 0.000000 
1 1 1   18    0 -104 o   17.945   9.6834   27.997   19.688   27.997   19.688   27.997   19.688   17.945   9.6834   17.945   9.6834 0.000000 0.000000 
1 1 1   18    0 -103 o   9.7100   6.7215  -7.2878   18.227  -7.2878   18.227  -7.2878   18.227   9.7100   6.7215   9.7100   6.7215 0.000000 0.000000 
1 1 1   18    0 -102 o   19.038   9.7537   30.190   19.185   30.190   19.185   30.190   19.185   19.038   9.7537   19.038   9.7537 0.000000 0.000000 
1 1 1   18    0 -101 o   35.192   8.0623   67.000   20.143   67.000   20.143   67.000   20.143   35.192   8.0623   35.192   8.0623 0.000000 0.000000 
1 1 1   18    0 -100 o   8.6372   6.1167 -15.8842   17.825 -15.8842   17.825 -15.8842   17.825   8.6372   6.1167   8.6372   6.1167 0.000000 0.000000 
1 1 1   18    0  -99 o   23.160   9.6088   37.866   18.057   37.866   18.057   37.866   18.057   23.160   9.6088   23.160   9.6088 0.000000 0.000000 
1 1 1   18    0  -98 o   13.201   8.2337   11.088   18.034   11.088   18.034   11.088   18.034   13.201   8.2337   13.201   8.2337 0.000000 0.000000 
1 1 1   18    0  -97 o   14.802   8.7786   16.717   18.375   16.717   18.375   16.717   18.375   14.802   8.7786   14.802   8.7786 0.000000 0.000000 
1 1 1   18    0  -96 o   11.833   7.6686   5.2338   17.516   5.2338   17.516   5.2338   17.516   11.833   7.6686   11.833   7.6686 0.000000 0.000000 
1 1 1   18    0  -95 o   9.8605   6.7438  -5.3204   17.091  -5.3204   17.091  -5.3204   17.091   9.8605   6.7438   9.8605   6.7438 0.000000 0.000000 
1 1 1   18    0  -94 o   14.071   8.4788   13.742   17.673   13.742   17.673   13.742   17.673   14.071   8.4788   14.071   8.4788 0.000000 0.000000 
1 1 1   18    0  -93 o   7.6263   5.4713 -22.0664   16.129 -22.0664   16.129 -22.0664   16.129   7.6263   5.4713   7.6263   5.4713 0.000000 0.000000 
1 1 1   18    0  -92 o   47.903   5.3014  103.669   20.054  103.669   20.054  103.669   20.054   47.903   5.3014   47.903   5.3014 0.000000 0.000000 
1 1 1   18    0  -91 o   11.086   7.0225   4.6603   13.681   4.6603   13.681   4.6603   13.681   11.086   7.0225   11.086   7.0225 0.000000 0.000000 
1 1 1   18    0  -90 o   24.169   8.2908   34.182   14.680   34.182   14.680   34.182   14.680   24.169   8.2908   24.169   8.2908 0.000000 0.000000 
1 1 1   18    0  -89 o   11.906   7.3605   6.9305   14.097   6.9305   14.097   6.9305   14.097   11.906   7.3605   11.906   7.3605 0.000000 0.000000 
1 1 1   18    0  -88 o   9.6407   6.4257  -1.9698   13.692  -1.9698   13.692  -1.9698   13.692   9.6407   6.4257   9.6407   6.4257 0.000000 0.000000 
1 1 1   18    0  -87 o   7.2579   5.2693 -32.7587   17.257 -32.7587   17.257 -32.7587   17.257   7.2579   5.2693   7.2579   5.2693 0.000000 0.000000 
1 1 1   18    0  -86 f   20.081   6.5771   22.046   9.5423   22.046   9.5423   22.046   9.5423   20.081   6.5771   20.081   6.5771 0.000000 0.000000 
1 1 1   18    0  -85 o   12.245   7.8840   3.6182   18.118   3.6182   18.118   3.6182   18.118   12.245   7.8840   12.245   7.8840 0.000000 0.000000 
1 1 1   18    0  -84 f   51.261   5.1757  115.018   21.081  115.018   21.081  115.018   21.081   51.261   5.1757   51.261   5.1757 0.000000 0.000000 
1 1 1   18    0  -83 o   10.338   6.1222   5.5697   8.9136   5.5697   8.9136   5.5697   8.9136   10.338   6.1222   10.338   6.1222 0.000000 0.000000 
1 1 1   18    0  -82 o   5.6286   4.0569 -16.1422   9.3362 -16.1422   9.3362 -16.1422   9.3362   5.6286   4.0569   5.6286   4.0569 0.000000 0.000000 
1 1 1   18    0  -81 o   32.421   3.9711   45.653   10.074   45.653   10.074   45.653   10.074   32.421   3.9711   32.421   3.9711 0.000000 0.000000 
1 1 1   18    0  -80 o   30.328   4.3667   40.649   10.146   40.649   10.146   40.649   10.146   30.328   4.3667   30.328   4.3667 0.000000 0.000000 
1 1 1   18    0  -79 o   8.0550   5.4453  -4.2392   10.491  -4.2392   10.491  -4.2392   10.491   8.0550   5.4453   8.0550   5.4453 0.000000 0.000000 
1 1 1   18    0  -78 f   5.3270   3.8988 -26.2416   10.676 -26.2416   10.676 -26.2416   10.676   5.3270   3.8988   5.3270   3.8988 0.000000 0.000000 
1 1 1   18    0  -77 o   15.902   7.7860   16.281   11.953   16.281   11.953   16.281   11.953   15.902   7.7860   15.902   7.7860 0.000000 0.000000 
1 1 1   18    0  -76 o   20.669   6.7689   22.974   10.108   22.974   10.108   22.974   10.108   20.669   6.7689   20.669   6.7689 0.000000 0.000000 
1 1 1   18    0  -75 o   10.185   6.2291   4.1982   9.8465   4.1982   9.8465   4.1982   9.8465   10.185   6.2291   10.185   6.2291 0.000000 0.000000 
1 1 1   18    0  -74 o   59.200   2.7198  144.900   13.062  144.900   13.062  144.900   13.062   59.200   2.7198   59.200   2.7198 0.000000 0.000000 
1 1 1   18    0  -73 o   7.2760   5.0207  -7.1650   9.9732  -7.1650   9.9732  -7.1650   9.9732   7.2760   5.0207   7.2760   5.0207 0.000000 0.000000 
1 1 1   18    0  -72 o   32.678   4.9134   47.288   12.215   47.288   12.215   47.288   12.215   32.678   4.9134   32.678   4.9134 0.000000 0.000000 
1 1 1   18    0  -71 o   29.198   4.7467   38.021   10.402   38.021   10.402   38.021   10.402   29.198   4.7467   29.198   4.7467 0.000000 0.000000 
1 1 1   18    0  -70 o   8.9262   5.7632   0.2730   9.7703   0.2730   9.7703   0.2730   9.7703   8.9262   5.7632   8.9262   5.7632 0.000000 0.000000 
1 1 1   18    0  -69 f   42.506   3.3851   75.727   11.553   75.727   11.553   75.727   11.553   42.506   3.3851   42.506   3.3851 0.000000 0.000000 
1 1 1   18    0  -68 o   34.250   3.9735   50.272   10.705   50.272   10.705   50.272   10.705   34.250   3.9735   34.250   3.9735 0.000000 0.000000 
1 1 1   18    0  -67 o   29.063   4.8991   37.743   10.616   37.743   10.616   37.743   10.616   29.063   4.8991   29.063   4.8991 0.000000 0.000000 
1 1 1   18    0  -66 o   29.611   4.7718   38.895   10.621   38.895   10.621   38.895   10.621   29.611   4.7718   29.611   4.7718 0.000000 0.000000 
1 1 1   18    0  -65 o   44.814   3.2236   83.673   11.633   83.673   11.633   83.673   11.633   44.814   3.2236   44.814   3.2236 0.000000 0.000000 
1 1 1   18    0  -64 o   7.3852   5.0628  -6.2916   9.7599  -6.2916   9.7599  -6.2916   9.7599   7.3852   5.0628   7.3852   5.0628 0.000000 0.000000 
1 1 1   18    0  -63 o   10.527   6.8925  -1.4222   14.675  -1.4222   14.675  -1.4222   14.675   10.527   6.8925   10.527   6.8925 0.000000 0.000000 
1 1 1   18    0  -62 o   5.7064   4.2009 -40.3037   13.823 -40.3037   13.823 -40.3037   13.823   5.7064   4.2009   5.7064   4.2009 0.000000 0.000000 
1 1 1   18    0  -61 o   87.143   3.2774  312.534   23.206  312.534   23.206  312.534   23.206   87.143   3.2774   87.143   3.2774 0.000000 0.000000 
1 1 1   18    0  -60 o   44.559   3.5907   82.983   12.841   82.983   12.841   82.983   12.841   44.559   3.5907   44.559   3.5907 0.000000 0.000000 
1 1 1   18    0  -59 o   39.139   3.7044   64.472   11.561   64.472   11.561   64.472   11.561   39.139   3.7044   39.139   3.7044 0.000000 0.000000 
1 1 1   18    0  -58 o   59.119   2.7781  143.860   13.320  143.860   13.320  143.860   13.320   59.119   2.7781   59.119   2.7781 0.000000 0.000000 
1 1 1   18    0  -57 o   13.868   7.3652   11.573   11.229   11.573   11.229   11.573   11.229   13.868   7.3652   13.868   7.3652 0.000000 0.000000 
1 1 1   18    0  -56 o   18.548   7.7178   20.050   11.641   20.050   11.641   20.050   11.641   18.548   7.7178   18.548   7.7178 0.000000 0.000000 
1 1 1   18    0  -55 o   73.980   2.5859  224.430   15.551  224.430   15.551  224.430   15.551   73.980   2.5859   73.980   2.5859 0.000000 0.000000 
1 1 1   18    0  -54 o   6.7882   4.8509 -18.3770   12.178 -18.3770   12.178 -18.3770   12.178   6.7882   4.8509   6.7882   4.8509 0.000000 0.000000 
1 1 1   18    0  -53 o   35.371   4.9138   54.228   13.387   54.228   13.387   54.228   13.387   35.371   4.9138   35.371   4.9138 0.000000 0.000000 
1 1 1   18    0  -52 o   78.545   2.6366  252.836   16.838  252.836   16.838  252.836   16.838   78.545   2.6366   78.545   2.6366 0.000000 0.000000 
1 1 1   18    0  -51 o   48.957   3.5028   99.526   13.811   99.526   13.811   99.526   13.811   48.957   3.5028   48.957   3.5028 0.000000 0.000000 
1 1 1   18    0  -50 o   40.872   4.0460   70.367   13.155   70.367   13.155   70.367   13.155   40.872   4.0460   40.872   4.0460 0.000000 0.000000 
1 1 1   18    0  -49 o   13.009   7.4138   9.1128   12.296   9.1128   12.296   9.1128   12.296   13.009   7.4138   13.009   7.4138 0.000000 0.000000 
1 1 1   18    0  -48 o   21.893   7.5110   25.604   12.047   25.604   12.047   25.604   12.047   21.893   7.5110   21.893   7.5110 0.000000 0.000000 
1 1 1   18    0  -47 o   8.8530   5.7061   0.0235   9.5243   0.0235   9.5243   0.0235   9.5243   8.8530   5.7061   8.8530   5.7061 0.000000 0.000000 
1 1 1   18    0  -46 o   18.245   7.7946   19.492   11.817   19.492   11.817   19.492   11.817   18.245   7.7946   18.245   7.7946 0.000000 0.000000 
1 1 1   18    0  -45 f   15.056   7.5561   13.758   11.382   13.758   11.382   13.758   11.382   15.056   7.5561   15.056   7.5561 0.000000 0.000000 
1 1 1   18    0  -44 o   22.768   7.3121   26.947   11.970   26.947   11.970   26.947   11.970   22.768   7.3121   22.768   7.3121 0.000000 0.000000 
1 1 1   18    0  -43 o   14.849   7.2958   13.366   10.510   13.366   10.510   13.366   10.510   14.849   7.2958   14.849   7.2958 0.000000 0.000000 
1 1 1   18    0  -42 o   68.929   4.3757  196.737   24.356  196.737   24.356  196.737   24.356   68.929   4.3757   68.929   4.3757 0.000000 0.000000 
1 1 1   18    0  -41 o   91.784   2.4732  344.525   18.473  344.525   18.473  344.525   18.473   91.784   2.4732   91.784   2.4732 0.000000 0.000000 
1 1 1   18    0  -40 o   73.041   2.7443  218.680   16.287  218.680   16.287  218.680   16.287   73.041   2.7443   73.041   2.7443 0.000000 0.000000 
1 1 1   18    0  -39 o   65.270   2.8758  174.915   15.233  174.915   15.233  174.915   15.233   65.270   2.8758   65.270   2.8758 0.000000 0.000000 
1 1 1   18    0  -38 o  113.829   2.1219  529.090   19.673  529.090   19.673  529.090   19.673  113.829   2.1219  113.829   2.1219 0.000000 0.000000 
1 1 1   18    0  -37 o  146.046   2.4765  871.044   29.463  871.044   29.463  871.044   29.463  146.046   2.4765  146.046   2.4765 0.000000 0.000000 
1 1 1   18    0  -36 o   81.339   2.3473  270.583   15.534  270.583   15.534  270.583   15.534   81.339   2.3473   81.339   2.3473 0.000000 0.000000 
1 1 1   18    0  -35 o   67.539   2.5126  186.882   13.789  186.882   13.789  186.882   13.789   67.539   2.5126   67.539   2.5126 0.000000 0.000000 
1 1 1   18    0  -34 o   17.589   7.5058   18.037   10.959   18.037   10.959   18.037   10.959   17.589   7.5058   17.589   7.5058 0.000000 0.000000 
1 1 1   18    0  -33 o   59.440   2.7314  145.081   13.170  145.081   13.170  145.081   13.170   59.440   2.7314   59.440   2.7314 0.000000 0.000000 
1 1 1   18    0  -32 o   82.785   2.3032  280.201   15.515  280.201   15.515  280.201   15.515   82.785   2.3032   82.785   2.3032 0.000000 0.000000 
1 1 1   18    0  -31 o   24.359   6.6669   29.129   11.444   29.129   11.444   29.129   11.444   24.359   6.6669   24.359   6.6669 0.000000 0.000000 
1 1 1   18    0  -30 o   39.369   3.8245   65.071   11.990   65.071   11.990   65.071   11.990   39.369   3.8245   39.369   3.8245 0.000000 0.000000 
1 1 1   18    0  -29 o   47.503   3.1991   93.350   12.256   93.350   12.256   93.350   12.256   47.503   3.1991   47.503   3.1991 0.000000 0.000000 
1 1 1   18    0  -28 o   7.6099   5.2414  -7.9955   10.749  -7.9955   10.749  -7.9955   10.749   7.6099   5.2414   7.6099   5.2414 0.000000 0.000000 
1 1 1   18    0  -27 o  126.304   2.0987  651.126   21.594  651.126   21.594  651.126   21.594  126.304   2.0987  126.304   2.0987 0.000000 0.000000 
1 1 1   18    0  -26 o   12.360   7.0142   8.1926   10.942   8.1926   10.942   8.1926   10.942   12.360   7.0142   12.360   7.0142 0.000000 0.000000 
1 1 1   18    0  -25 o   48.925   3.1244   98.874   12.343   98.874   12.343   98.874   12.343   48.925   3.1244   48.925   3.1244 0.000000 0.000000 
1 1 1   18    0  -24 o   52.397   3.0838  113.194   13.066  113.194   13.066  113.194   13.066   52.397   3.0838   52.397   3.0838 0.000000 0.000000 
1 1 1   18    0  -23 o  107.743   2.5268  474.296   22.165  474.296   22.165  474.296   22.165  107.743   2.5268  107.743   2.5268 0.000000 0.000000 
1 1 1   18    0  -22 o   32.809   5.7629   47.876   13.991   47.876   13.991   47.876   13.991   32.809   5.7629   32.809   5.7629 0.000000 0.000000 
1 1 1   18    0  -21 o  203.111   2.7025  1683.81   44.727  1683.81   44.727  1683.81   44.727  203.111   2.7025  203.111   2.7025 0.000000 0.000000 
1 1 1   18    0  -20 f   66.824   3.1617  183.436   17.134  183.436   17.134  183.436   17.134   66.824   3.1617   66.824   3.1617 0.000000 0.000000 
1 1 1   18    0  -19 o  220.933   2.4257  1991.53   43.673  1991.53   43.673  1991.53   43.673  220.933   2.4257  220.933   2.4257 0.000000 0.000000 
1 1 1   18    0  -18 o  134.358   2.4277  736.977   26.569  736.977   26.569  736.977   26.569  134.358   2.4277  134.358   2.4277 0.000000 0.000000 
1 1 1   18    0  -17 o   52.977   3.5389  116.071   15.123  116.071   15.123  116.071   15.123   52.977   3.5389   52.977   3.5389 0.000000 0.000000 
1 1 1   18    0  -16 o   16.466   8.1887   16.373   13.309   16.373   13.309   16.373   13.309   16.466   8.1887   16.466   8.1887 0.000000 0.000000 
1 1 1   18    0  -15 o   51.296   3.6746  109.043   15.180  109.043   15.180  109.043   15.180   51.296   3.6746   51.296   3.6746 0.000000 0.000000 
1 1 1   18    0  -14 o   92.280   2.6410  348.194   19.829  348.194   19.829  348.194   19.829   92.280   2.6410   92.280   2.6410 0.000000 0.000000 
1 1 1   18    0  -13 o   31.486   6.2679   45.024   14.286   45.024   14.286   45.024   14.286   31.486   6.2679   31.486   6.2679 0.000000 0.000000 
1 1 1   18    0  -12 o  164.052   2.5574  1098.48   34.181  1098.48   34.181  1098.48   34.181  164.052   2.5574  164.052   2.5574 0.000000 0.000000 
1 1 1   18    0  -11 o  134.201   3.0012  735.838   32.794  735.838   32.794  735.838   32.794  134.201   3.0012  134.201   3.0012 0.000000 0.000000 
1 1 1   18    0  -10 o  140.672   2.5109  807.841   28.771  807.841   28.771  807.841   28.771  140.672   2.5109  140.672   2.5109 0.000000 0.000000 
1 1 1   18    0   -9 o   92.704   2.7425  351.463   20.684  351.463   20.684  351.463   20.684   92.704   2.7425   92.704   2.7425 0.000000 0.000000 
1 1 1   18    0   -8 o  255.251   3.0492  2659.16   63.423  2659.16   63.423  2659.16   63.423  255.251   3.0492  255.251   3.0492 0.000000 0.000000 
1 1 1   18    0   -7 o  213.700   2.8038  1863.76   48.823  1863.76   48.823  1863.76   48.823  213.700   2.8038  213.700   2.8038 0.000000 0.000000 
1 1 1   18    0   -6 o  338.083   3.6705  4666.68  101.128  4666.68  101.128  4666.68  101.128  338.083   3.6705  338.083   3.6705 0.000000 0.000000 
1 1 1   18    0   -5 o  109.314   3.3873  489.008   30.117  489.008   30.117  489.008   30.117  109.314   3.3873  109.314   3.3873 0.000000 0.000000 
1 1 1   18    0   -4 o   13.490   7.8890   8.8157   14.481   8.8157   14.481   8.8157   14.481   13.490   7.8890   13.490   7.8890 0.000000 0.000000 
1 1 1   18    0   -3 o   34.280   5.9719   52.182   15.172   52.182   15.172   52.182   15.172   34.280   5.9719   34.280   5.9719 0.000000 0.000000 
1 1 1   18    0   -2 o   7.6312   5.4190 -19.3657   14.326 -19.3657   14.326 -19.3657   14.326   7.6312   5.4190   7.6312   5.4190 0.000000 0.000000 
1 1 1   18    0   -1 o   93.513   3.6170  358.481   27.477  358.481   27.477  358.481   27.477   93.513   3.6170   93.513   3.6170 0.000000 0.000000 
1 1 1   18    0    0 o   8.8379   6.2857 -27.1633   19.548 -27.1633   19.548 -27.1633   19.548   8.8379   6.2857   8.8379   6.2857 0.000000 0.000000 
1 1 1   18    0    1 o   53.119   5.2660  118.668   22.250  118.668   22.250  118.668   22.250   53.119   5.2660   53.119   5.2660 0.000000 0.000000 
1 1 1   18    0    2 o   7.8875   5.7157 -40.0062   19.803 -40.0062   19.803 -40.0062   19.803   7.8875   5.7157   7.8875   5.7157 0.000000 0.000000 
1 1 1   18    0    3 o   24.896   8.2683   32.535   14.929   32.535   14.929   32.535   14.929   24.896   8.2683   24.896   8.2683 0.000000 0.000000 
1 1 1   18    0    4 o  131.436   2.5495  705.363   27.292  705.363   27.292  705.363   27.292  131.436   2.5495  131.436   2.5495 0.000000 0.000000 
1 1 1   18    0    5 o   12.118   7.4749   4.5192   14.461   4.5192   14.461   4.5192   14.461   12.118   7.4749   12.118   7.4749 0.000000 0.000000 
1 1 1   18    0    6 o   9.6479   6.4908  -6.1916   14.567  -6.1916   14.567  -6.1916   14.567   9.6479   6.4908   9.6479   6.4908 0.000000 0.000000 
1 1 1   18    0    7 o   80.192   3.5869  264.014   23.340  264.014   23.340  264.014   23.340   80.192   3.5869   80.192   3.5869 0.000000 0.000000 
1 1 1   18    0    8 o   95.885   3.2782  376.449   25.555  376.449   25.555  376.449   25.555   95.885   3.2782   95.885   3.2782 0.000000 0.000000 
1 1 1   18    0    9 o   78.506   3.5929  253.109   22.882  253.109   22.882  253.109   22.882   78.506   3.5929   78.506   3.5929 0.000000 0.000000 
1 1 1   18    0   10 o  229.895   3.5196  2158.42   65.922  2158.42   65.922  2158.42   65.922  229.895   3.5196  229.895   3.5196 0.000000 0.000000 
1 1 1   18    0   11 o   39.351   6.1927   67.841   18.395   67.841   18.395   67.841   18.395   39.351   6.1927   39.351   6.1927 0.000000 0.000000 
1 1 1   18    0   12 o   52.865   3.8365  115.869   16.328  115.869   16.328  115.869   16.328   52.865   3.8365   52.865   3.8365 0.000000 0.000000 
1 1 1   18    0   13 o  156.339   2.5596  997.696   32.600  997.696   32.600  997.696   32.600  156.339   2.5596  156.339   2.5596 0.000000 0.000000 
1 1 1   18    0   14 o   55.744   3.6455  128.448   16.400  128.448   16.400  128.448   16.400   55.744   3.6455   55.744   3.6455 0.000000 0.000000 
1 1 1   18    0   15 o   99.618   2.6690  405.656   21.638  405.656   21.638  405.656   21.638   99.618   2.6690   99.618   2.6690 0.000000 0.000000 
1 1 1   18    0   16 o  136.782   2.5299  763.873   28.186  763.873   28.186  763.873   28.186  136.782   2.5299  136.782   2.5299 0.000000 0.000000 
1 1 1   18    0   17 o   94.044   2.7055  361.660   20.701  361.660   20.701  361.660   20.701   94.044   2.7055   94.044   2.7055 0.000000 0.000000 
1 1 1   18    0   18 o  108.040   2.6046  476.947   22.909  476.947   22.909  476.947   22.909  108.040   2.6046  108.040   2.6046 0.000000 0.000000 
1 1 1   18    0   19 o   10.199   6.9537 -10.5878   17.874 -10.5878   17.874 -10.5878   17.874   10.199   6.9537   10.199   6.9537 0.000000 0.000000 
1 1 1   18    0   20 f   93.593   2.6723  358.197   20.350  358.197   20.350  358.197   20.350   93.593   2.6723   93.593   2.6723 0.000000 0.000000 
1 1 1   18    0   21 o   80.881   2.8547  267.881   18.768  267.881   18.768  267.881   18.768   80.881   2.8547   80.881   2.8547 0.000000 0.000000 
1 1 1   18    0   22 o   23.736   9.2755   31.705   17.143   31.705   17.143   31.705   17.143   23.736   9.2755   23.736   9.2755 0.000000 0.000000 
1 1 1   18    0   23 o   97.530   3.1900  389.437   25.299  389.437   25.299  389.437   25.299   97.530   3.1900   97.530   3.1900 0.000000 0.000000 
1 1 1   18    0   24 o  197.919   3.2719  1600.08   52.754  1600.08   52.754  1600.08   52.754  197.919   3.2719  197.919   3.2719 0.000000 0.000000 
1 1 1   18    0   25 o   59.296   4.0196  145.573   19.221  145.573   19.221  145.573   19.221   59.296   4.0196   59.296   4.0196 0.000000 0.000000 
1 1 1   18    0   26 o  127.008   2.5349  658.825   26.220  658.825   26.220  658.825   26.220  127.008   2.5349  127.008   2.5349 0.000000 0.000000 
1 1 1   18    0   27 o  302.039   3.3780  3725.55   83.146  3725.55   83.146  3725.55   83.146  302.039   3.3780  302.039   3.3780 0.000000 0.000000 
1 1 1   18    0   28 o   31.524   6.5640   45.579   14.872   45.579   14.872   45.579   14.872   31.524   6.5640   31.524   6.5640 0.000000 0.000000 
1 1 1   18    0   29 o  164.521   2.5737  1105.07   34.496  1105.07   34.496  1105.07   34.496  164.521   2.5737  164.521   2.5737 0.000000 0.000000 
1 1 1   18    0   30 o   76.023   2.9469  236.917   18.200  236.917   18.200  236.917   18.200   76.023   2.9469   76.023   2.9469 0.000000 0.000000 
1 1 1   18    0   31 o   33.237   5.9067   49.263   14.497   49.263   14.497   49.263   14.497   33.237   5.9067   33.237   5.9067 0.000000 0.000000 
1 1 1   18    0   32 o   95.570   2.6419  373.522   20.546  373.522   20.546  373.522   20.546   95.570   2.6419   95.570   2.6419 0.000000 0.000000 
1 1 1   18    0   33 o   84.505   2.7567  292.336   18.943  292.336   18.943  292.336   18.943   84.505   2.7567   84.505   2.7567 0.000000 0.000000 
1 1 1   18    0   34 o   10.451   6.7540  -0.2802   13.462  -0.2802   13.462  -0.2802   13.462   10.451   6.7540   10.451   6.7540 0.000000 0.000000 
1 1 1   18    0   35 o   9.4030   6.2659  -4.0636   13.007  -4.0636   13.007  -4.0636   13.007   9.4030   6.2659   9.4030   6.2659 0.000000 0.000000 
1 1 1   18    0   36 o   46.149   4.0162   88.996   14.834   88.996   14.834   88.996   14.834   46.149   4.0162   46.149   4.0162 0.000000 0.000000 
1 1 1   18    0   37 o   16.297   8.2283   16.095   13.539   16.095   13.539   16.095   13.539   16.297   8.2283   16.297   8.2283 0.000000 0.000000 
1 1 1   18    0   38 o  129.669   2.5123  686.879   26.532  686.879   26.532  686.879   26.532  129.669   2.5123  129.669   2.5123 0.000000 0.000000 
1 1 1   18    0   39 o  149.028   2.5172  907.073   30.560  907.073   30.560  907.073   30.560  149.028   2.5172  149.028   2.5172 0.000000 0.000000 
1 1 1   18    0   40 o   9.7380   6.4477  -3.2508   13.411  -3.2508   13.411  -3.2508   13.411   9.7380   6.4477   9.7380   6.4477 0.000000 0.000000 
1 1 1   18    0   41 o  105.165   3.2582  453.027   27.870  453.027   27.870  453.027   27.870  105.165   3.2582  105.165   3.2582 0.000000 0.000000 
1 1 1   18    0   42 o   73.987   3.8465  225.592   23.055  225.592   23.055  225.592   23.055   73.987   3.8465   73.987   3.8465 0.000000 0.000000 
1 1 1   18    0   43 o   31.876   8.5718   49.896   19.245   49.896   19.245   49.896   19.245   31.876   8.5718   31.876   8.5718 0.000000 0.000000 
1 1 1   18    0   44 o   25.009   7.6736   32.000   13.674   32.000   13.674   32.000   13.674   25.009   7.6736   25.009   7.6736 0.000000 0.000000 
1 1 1   18    0   45 f   24.853   8.0003   32.192   14.304   32.192   14.304   32.192   14.304   24.853   8.0003   24.853   8.0003 0.000000 0.000000 
1 1 1   18    0   46 o   34.065   5.7875   51.516   14.679   51.516   14.679   51.516   14.679   34.065   5.7875   34.065   5.7875 0.000000 0.000000 
1 1 1   18    0   47 o  128.733   2.5311  677.302   26.538  677.302   26.538  677.302   26.538  128.733   2.5311  128.733   2.5311 0.000000 0.000000 
1 1 1   18    0   48 o  177.143   2.6249  1282.09   37.885  1282.09   37.885  1282.09   37.885  177.143   2.6249  177.143   2.6249 0.000000 0.000000 
1 1 1   18    0   49 o   22.760   9.4261   30.150   17.383   30.150   17.383   30.150   17.383   22.760   9.4261   22.760   9.4261 0.000000 0.000000 
1 1 1   18    0   50 o   35.819   5.6639   56.468   15.302   56.468   15.302   56.468   15.302   35.819   5.6639   35.819   5.6639 0.000000 0.000000 
1 1 1   18    0   51 o   8.2147   5.7185 -12.4166   13.684 -12.4166   13.684 -12.4166   13.684   8.2147   5.7185   8.2147   5.7185 0.000000 0.000000 
1 1 1   18    0   52 o   67.069   3.2545  185.228   17.697  185.228   17.697  185.228   17.697   67.069   3.2545   67.069   3.2545 0.000000 0.000000 
1 1 1   18    0   53 o  142.796   2.6105  833.779   30.363  833.779   30.363  833.779   30.363  142.796   2.6105  142.796   2.6105 0.000000 0.000000 
1 1 1   18    0   54 o   24.435   8.3811   32.087   15.003   32.087   15.003   32.087   15.003   24.435   8.3811   24.435   8.3811 0.000000 0.000000 
1 1 1   18    0   55 o   51.217   3.8066  109.231   15.686  109.231   15.686  109.231   15.686   51.217   3.8066   51.217   3.8066 0.000000 0.000000 
1 1 1   18    0   56 o   32.807   5.7280   48.137   13.921   48.137   13.921   48.137   13.921   32.807   5.7280   32.807   5.7280 0.000000 0.000000 
1 1 1   18    0   57 o   21.986   8.8001   27.865   15.298   27.865   15.298   27.865   15.298   21.986   8.8001   21.986   8.8001 0.000000 0.000000 
1 1 1   18    0   58 o   12.952   7.4465   8.9671   12.563   8.9671   12.563   8.9671   12.563   12.952   7.4465   12.952   7.4465 0.000000 0.000000 
1 1 1   18    0   59 o   56.776   3.2829  133.331   15.076  133.331   15.076  133.331   15.076   56.776   3.2829   56.776   3.2829 0.000000 0.000000 
1 1 1   18    0   60 o   15.807   8.3319   15.311   14.282   15.311   14.282   15.311   14.282   15.807   8.3319   15.807   8.3319 0.000000 0.000000 
1 1 1   18    0   61 o   49.974   4.2277  104.867   16.928  104.867   16.928  104.867   16.928   49.974   4.2277   49.974   4.2277 0.000000 0.000000 
1 1 1   18    0   62 o   75.610   3.2650  235.662   20.037  235.662   20.037  235.662   20.037   75.610   3.2650   75.610   3.2650 0.000000 0.000000 
1 1 1   18    0   63 o   9.5066   6.2306  -1.3901   12.035  -1.3901   12.035  -1.3901   12.035   9.5066   6.2306   9.5066   6.2306 0.000000 0.000000 
1 1 1   18    0   64 o   24.318   7.3796   30.527   12.764   30.527   12.764   30.527   12.764   24.318   7.3796   24.318   7.3796 0.000000 0.000000 
1 1 1   18    0   65 o   79.598   2.7731  260.490   17.944  260.490   17.944  260.490   17.944   79.598   2.7731   79.598   2.7731 0.000000 0.000000 
1 1 1   18    0   66 o   23.162   7.3846   28.263   12.278   28.263   12.278   28.263   12.278   23.162   7.3846   23.162   7.3846 0.000000 0.000000 
1 1 1   18    0   67 o   29.025   6.2124   39.460   12.909   39.460   12.909   39.460   12.909   29.025   6.2124   29.025   6.2124 0.000000 0.000000 
1 1 1   18    0   68 o   61.613   3.0874  157.051   15.417  157.051   15.417  157.051   15.417   61.613   3.0874   61.613   3.0874 0.000000 0.000000 
1 1 1   18    0   69 f   67.426   3.0240  187.837   16.544  187.837   16.544  187.837   16.544   67.426   3.0240   67.426   3.0240 0.000000 0.000000 
1 1 1   18    0   70 o   93.772   3.1709  362.854   24.175  362.854   24.175  362.854   24.175   93.772   3.1709   93.772   3.1709 0.000000 0.000000 
1 1 1   18    0   71 o   14.800   8.2549   13.344   14.825   13.344   14.825   13.344   14.825   14.800   8.2549   14.800   8.2549 0.000000 0.000000 
1 1 1   18    0   72 o   31.615   6.8677   47.522   15.513   47.522   15.513   47.522   15.513   31.615   6.8677   31.615   6.8677 0.000000 0.000000 
1 1 1   18    0   73 o   71.727   3.5073  213.867   20.394  213.867   20.394  213.867   20.394   71.727   3.5073   71.727   3.5073 0.000000 0.000000 
1 1 1   18    0   74 o   50.865   4.3140  109.806   17.579  109.806   17.579  109.806   17.579   50.865   4.3140   50.865   4.3140 0.000000 0.000000 
1 1 1   18    0   75 o   48.233   4.6384   99.691   17.824   99.691   17.824   99.691   17.824   48.233   4.6384   48.233   4.6384 0.000000 0.000000 
1 1 1   18    0   76 o   59.246   4.0233  147.800   19.221  147.800   19.221  147.800   19.221   59.246   4.0233   59.246   4.0233 0.000000 0.000000 
1 1 1   18    0   77 o  114.513   3.0773  542.057   28.678  542.057   28.678  542.057   28.678  114.513   3.0773  114.513   3.0773 0.000000 0.000000 
1 1 1   18    0   78 f   86.875   2.6447  311.321   18.689  311.321   18.689  311.321   18.689   86.875   2.6447   86.875   2.6447 0.000000 0.000000 
1 1 1   18    0   79 o   49.184   4.5969  103.907   18.039  103.907   18.039  103.907   18.039   49.184   4.5969   49.184   4.5969 0.000000 0.000000 
1 1 1   18    0   80 o   11.166   6.7767   5.7494   11.459   5.7494   11.459   5.7494   11.459   11.166   6.7767   11.166   6.7767 0.000000 0.000000 
1 1 1   18    0   81 o   55.373   3.2207  128.122   14.424  128.122   14.424  128.122   14.424   55.373   3.2207   55.373   3.2207 0.000000 0.000000 
1 1 1   18    0   82 o   7.8209   5.3851  -7.2596   11.327  -7.2596   11.327  -7.2596   11.327   7.8209   5.3851   7.8209   5.3851 0.000000 0.000000 
1 1 1   18    0   83 o   9.7801   6.2790   1.5198   11.388   1.5198   11.388   1.5198   11.388   9.7801   6.2790   9.7801   6.2790 0.000000 0.000000 
1 1 1   18    0   84 f   8.1893   5.4945  -3.0266   10.308  -3.0266   10.308  -3.0266   10.308   8.1893   5.4945   8.1893   5.4945 0.000000 0.000000 
1 1 1   18    0   85 o   17.672   6.9837   18.579   9.6773   18.579   9.6773   18.579   9.6773   17.672   6.9837   17.672   6.9837 0.000000 0.000000 
1 1 1   18    0   86 f   9.7587   6.0398   3.7629   9.5173   3.7629   9.5173   3.7629   9.5173   9.7587   6.0398   9.7587   6.0398 0.000000 0.000000 
1 1 1   18    0   87 o   16.589   6.7448   16.641   8.9435   16.641   8.9435   16.641   8.9435   16.589   6.7448   16.589   6.7448 0.000000 0.000000 
1 1 1   18    0   88 o   12.063   6.4938   9.4695   8.8342   9.4695   8.8342   9.4695   8.8342   12.063   6.4938   12.063   6.4938 0.000000 0.000000 
1 1 1   18    0   89 o   7.3341   4.9501  -3.0096   8.6037  -3.0096   8.6037  -3.0096   8.6037   7.3341   4.9501   7.3341   4.9501 0.000000 0.000000 
1 1 1   18    0   90 o   6.6693   4.6230  -6.3135   8.6975  -6.3135   8.6975  -6.3135   8.6975   6.6693   4.6230   6.6693   4.6230 0.000000 0.000000 
1 1 1   18    0   91 o   17.545   6.8267   18.545   9.3019   18.545   9.3019   18.545   9.3019   17.545   6.8267   17.545   6.8267 0.000000 0.000000 
1 1 1   18    0   92 o   20.151   6.4890   22.464   9.4079   22.464   9.4079   22.464   9.4079   20.151   6.4890   20.151   6.4890 0.000000 0.000000 
1 1 1   18    0   93 o   22.862   6.0089   26.926   9.6750   26.926   9.6750   26.926   9.6750   22.862   6.0089   22.862   6.0089 0.000000 0.000000 
1 1 1   18    0   94 o   6.7577   4.6768  -5.8476   8.8118  -5.8476   8.8118  -5.8476   8.8118   6.7577   4.6768   6.7577   4.6768 0.000000 0.000000 
1 1 1   18    0   95 o   39.175   3.7873   67.037   11.818   67.037   11.818   67.037   11.818   39.175   3.7873   39.175   3.7873 0.000000 0.000000 
1 1 1   18    0   96 o   54.150   4.5041  129.758   19.554  129.758   19.554  129.758   19.554   54.150   4.5041   54.150   4.5041 0.000000 0.000000 
1 1 1   18    0   97 o   8.1517   5.7724 -15.2561   15.866 -15.2561   15.866 -15.2561   15.866   8.1517   5.7724   8.1517   5.7724 0.000000 0.000000 
1 1 1   18    0   98 o   10.698   7.0444   2.0220   15.664   2.0220   15.664   2.0220   15.664   10.698   7.0444   10.698   7.0444 0.000000 0.000000 
1 1 1   18    0   99 o   12.788   7.8807   10.598   16.038   10.598   16.038   10.598   16.038   12.788   7.8807   12.788   7.8807 0.000000 0.000000 
1 1 1   18    0  100 o   12.068   7.6707   7.7243   16.486   7.7243   16.486   7.7243   16.486   12.068   7.6707   12.068   7.6707 0.000000 0.000000 
1 1 1   18    0  101 o   25.573   9.2198   42.404   17.607   42.404   17.607   42.404   17.607   25.573   9.2198   25.573   9.2198 0.000000 0.000000 
1 1 1   18    0  102 o   11.687   7.5670   5.8861   17.005   5.8861   17.005   5.8861   17.005   11.687   7.5670   11.687   7.5670 0.000000 0.000000 
1 1 1   18    0  103 o   24.449   11.189   49.520   24.302   49.520   24.302   49.520   24.302   24.449   11.189   24.449   11.189 0.000000 0.000000 
1 1 1   18    0  104 o   20.228   10.673   37.421   23.457   37.421   23.457   37.421   23.457   20.228   10.673   20.228   10.673 0.000000 0.000000 
1 1 1   18    0  105 o   24.446   10.977   48.703   23.363   48.703   23.363   48.703   23.363   24.446   10.977   24.446   10.977 0.000000 0.000000 
1 1 1   18    0  106 o   10.919   7.5407  -5.1040   22.612  -5.1040   22.612  -5.1040   22.612   10.919   7.5407   10.919   7.5407 0.000000 0.000000 
1 1 1   18    0  107 o   11.167   7.6374  -1.8149   21.918  -1.8149   21.918  -1.8149   21.918   11.167   7.6374   11.167   7.6374 0.000000 0.000000 
1 1 1   18    0  108 o   10.659   7.3943  -6.5878   22.360  -6.5878   22.360  -6.5878   22.360   10.659   7.3943   10.659   7.3943 0.000000 0.000000 
1 1 1   18    0  109 o   11.692   7.9264   1.0739   22.540   1.0739   22.540   1.0739   22.540   11.692   7.9264   11.692   7.9264 0.000000 0.000000 
1 1 1   18    1 -107 o   22.289   8.1343   35.294   19.211   18.047   25.657   57.305   28.984   17.842   8.1042   24.823   9.7671 -6.980354 12.69144 
1 1 1   18    1 -106 o   12.653   6.0486  -8.3237   17.590 -10.3587   24.051  -5.9837   25.791   14.042   6.8028   14.817   7.1453 -0.7746801 9.865777 
1 1 1   18    1 -105 o   12.137   5.8816 -13.5125   18.012 -10.2211   25.448 -16.8168   25.498   14.330   6.9550   13.741   6.7326 0.5884314 9.679877 
1 1 1   18    1 -104 o   23.320   7.9461   37.070   18.090   17.230   24.982   58.940   26.230   17.727   8.0299   26.460   9.5260 -8.733540 12.45883 
1 1 1   18    1 -103 o   12.936   6.1263  -6.0352   17.212  -5.6732   24.225  -6.4042   24.458   14.688   7.0421   14.654   7.0389 0.3391361E-01 9.956781 
1 1 1   18    1 -102 o   11.547   5.5262 -10.1009   14.769  -5.0796   18.027 -20.3524   25.758   13.351   6.3071   13.662   6.7089 -0.3111601 9.208099 
1 1 1   18    1 -101 o   16.380   6.8504   13.047   15.310   20.094   18.870  -0.5284   26.191   18.370   7.6380   15.728   7.4800 2.642416 10.69060 
1 1 1   18    1 -100 o   28.387   6.3009   43.700   14.200   23.842   19.738   65.000   20.443   19.388   7.9100   32.647   7.7905 -13.25888 11.10222 
1 1 1   18    1  -99 o   14.556   6.2731   6.9386   13.514  -9.0957   19.070   23.110   19.152   13.239   6.3204   19.319   7.8249 -6.080016 10.05869 
1 1 1   18    1  -98 o   10.714   5.1190 -10.0787   12.559 -17.1038   17.580  -2.7575   17.947   11.814   5.7449   13.844   6.4608 -2.029281 8.645598 
1 1 1   18    1  -97 o   15.433   6.3308   10.287   12.730   12.352   17.602   8.0223   18.431   16.728   7.1836   15.926   7.0792 0.8015804 10.08556 
1 1 1   18    1  -96 o   16.508   6.8569   12.406   15.186   21.556   18.115  -9.2281   27.853   19.215   7.6697   15.489   7.4584 3.725676 10.69824 
1 1 1   18    1  -95 o   25.099   6.3549   33.839   13.012   50.204   18.441   17.609   18.364   29.120   7.6653   18.269   7.5600 10.85148 10.76614 
1 1 1   18    1  -94 o   28.672   5.8212   41.894   13.140   48.589   18.706   35.372   18.462   28.473   7.8209   23.726   8.0281 4.746407 11.20789 
1 1 1   18    1  -93 o   11.890   5.4845  -3.8383   12.367  -4.3302   17.717  -3.3710   17.271   13.796   6.4322   13.810   6.4088 -0.1406860E-01 9.080039 
1 1 1   18    1  -92 o   11.760   5.5964 -10.6715   14.707 -25.9963   27.117  -4.2858   17.505   14.104   6.9170   13.799   6.4200 0.3049603 9.437253 
1 1 1   18    1  -91 o   17.646   6.5420   15.541   12.507   27.745   18.025   4.2125   17.367   21.714   7.8860   15.407   6.8587 6.307714 10.45132 
1 1 1   18    1  -90 o   11.328   5.3029  -7.2337   12.243 -12.3336   17.331  -2.1533   17.298   12.718   6.0586   14.294   6.5538 -1.575879 8.925233 
1 1 1   18    1  -89 o   17.981   6.5289   15.772   12.355   4.4388   17.646   26.668   17.303   15.794   6.9785   21.873   7.7523 -6.078216 10.43059 
1 1 1   18    1  -88 o   27.539   5.7650   37.018   12.526   24.269   17.666   49.908   17.763   21.206   7.7904   30.701   7.2199 -9.495134 10.62153 
1 1 1   18    1  -87 f   16.408   6.0745   11.914   10.776   3.4675   13.864   24.806   17.127   14.564   6.3152   21.561   7.7054 -6.997493 9.962665 
1 1 1   18    1  -86 o   39.408   3.7524   67.878   11.908   77.410   15.310   53.278   18.947   41.418   4.6130   31.893   7.4271 9.525312 8.743102 
1 1 1   18    1  -85 o   41.163   3.3120   72.735   11.019   83.127   19.225   67.651   13.447   42.015   5.7653   39.031   4.2976 2.984428 7.190854 
1 1 1   18    1  -84 o   18.432   5.7632   16.005   9.6132 -10.9805   17.915   26.916   11.392   13.597   6.3811   23.639   5.9244 -10.04210 8.707258 
1 1 1   18    1  -83 o   16.698   5.8156   12.313   9.7081  -6.8263   18.442   19.651   11.418   14.536   6.7020   20.233   6.2739 -5.696985 9.180396 
1 1 1   18    1  -82 o   24.698   4.1182   26.959   7.9991   24.168   10.961   30.139   11.700   22.552   5.8968   25.276   5.8017 -2.723989 8.272349 
1 1 1   18    1  -81 o   22.335   4.2527   22.179   7.4599   28.038   10.252   15.586   10.875   24.708   5.2522   18.486   6.1607 6.221851 8.095708 
1 1 1   18    1  -80 o   24.262   4.0274   25.818   7.6859   19.540   10.024   34.777   11.973   20.469   5.7639   27.487   5.5354 -7.018389 7.991446 
1 1 1   18    1  -79 o   33.661   2.8813   47.689   7.8301   49.299   10.507   45.678   11.743   33.806   3.8832   32.173   4.6091 1.632919 6.026853 
1 1 1   18    1  -78 o   35.540   2.9994   53.198   8.6082   54.080   10.756   51.625   14.357   35.509   3.7737   33.852   5.3829 1.656651 6.573916 
1 1 1   18    1  -77 o   28.102   3.7132   33.961   8.2980   30.136   10.346   40.856   13.893   25.879   5.0861   29.790   5.9297 -3.911083 7.812149 
1 1 1   18    1  -76 o   12.379   4.9576   3.8980   7.5942   3.4321   9.5783   4.6865   12.461   13.238   5.4673   14.979   6.2156 -1.740499 8.277950 
1 1 1   18    1  -75 o   21.155   5.0024   20.169   8.4898   15.115   11.006   27.595   13.341   18.528   6.1981   24.207   6.5869 -5.678308 9.044548 
1 1 1   18    1  -74 o   43.957   2.9495   80.857   10.507   89.252   13.102   65.729   17.588   45.941   3.5256   38.193   5.8342 7.748348 6.816690 
1 1 1   18    1  -73 o   28.223   3.8829   34.226   8.6966   26.229   11.652   44.282   13.066   23.886   5.9947   31.558   5.2647 -7.672350 7.978308 
1 1 1   18    1  -72 o   19.482   5.0152   16.988   8.0114   13.097   10.272   23.030   12.801   17.585   5.9877   22.346   6.5832 -4.761410 8.898981 
1 1 1   18    1  -71 o   28.207   3.7170   33.953   8.3386   14.744   11.808   53.059   11.777   18.647   6.4180   35.173   4.1898 -16.52673 7.664506 
1 1 1   18    1  -70 o   30.784   3.6703   40.242   9.0288   43.565   10.845   32.740   16.296   31.822   4.2902   26.405   7.3182 5.417469 8.483065 
1 1 1   18    1  -69 o   77.150   1.9701  244.668   12.379  243.084   14.894  248.207   22.266   76.749   2.3835   76.973   3.5583 -0.2246780 4.282813 
1 1 1   18    1  -68 o   34.559   3.2698   50.108   9.1016   46.793   10.986   57.360   16.252   33.093   4.1646   36.018   5.7269 -2.924389 7.081000 
1 1 1   18    1  -67 o   23.410   4.0663   23.622   7.4782   26.489   10.471   20.639   10.683   24.405   5.4062   21.458   5.9169 2.946880 8.014745 
1 1 1   18    1  -66 o   30.979   3.2658   40.264   8.1231   48.869   11.520   31.754   11.456   33.846   4.2702   26.798   5.4306 7.048086 6.908439 
1 1 1   18    1  -65 o   20.630   4.6456   18.633   7.6237   22.304   10.555   14.629   11.023   22.368   5.7556   18.659   6.2021 3.709890 8.461292 
1 1 1   18    1  -64 o   49.583   2.1985  101.152   8.8635   94.056   12.234  108.992   12.859   47.565   3.1734   51.241   3.0931 -3.676514 4.431472 
1 1 1   18    1  -63 o   9.2462   4.3421  -8.2888   8.3198 -15.5646   13.371  -3.6927   10.628   11.248   5.3481   11.945   5.3382 -0.6965895 7.556354 
1 1 1   18    1  -62 f   31.169   3.6193   40.826   9.0248   57.887   14.693   30.491   11.436   36.737   5.0393   26.354   5.5015 10.38318 7.460610 
1 1 1   18    1  -61 o   48.231   2.2896   95.676   8.9758   90.952   12.546  100.630   12.847   46.790   3.3107   49.253   3.2175 -2.463055 4.616577 
1 1 1   18    1  -60 o   29.670   3.3532   36.821   7.9679   42.849   11.126   30.474   11.416   31.761   4.4169   26.405   5.4834 5.355387 7.041033 
1 1 1   18    1  -59 o   27.697   3.6089   32.247   7.9542   20.962   11.029   44.482   11.483   21.867   6.0047   32.378   4.4698 -10.51122 7.485703 
1 1 1   18    1  -58 o   75.533   1.8388  233.396   11.322  254.183   16.448  214.679   15.608   78.645   2.5691   72.248   2.6547 6.396721 3.694273 
1 1 1   18    1  -57 o   57.084   2.1075  133.607   9.7896  132.097   13.859  135.110   13.831   56.585   3.0155   57.237   2.9745 -0.6525879 4.235681 
1 1 1   18    1  -56 o   34.941   3.1141   50.619   8.7768   50.478   12.636   50.751   12.200   34.551   4.6007   34.695   4.4136 -0.1437531 6.375440 
1 1 1   18    1  -55 o   62.681   1.9983  160.886   10.197  169.414   14.248  151.933   14.600   64.195   2.7291   60.740   2.9576 3.454826 4.024340 
1 1 1   18    1  -54 o   51.448   2.5980  108.788   10.860  117.419   13.431   92.486   18.458   53.363   3.1010   46.908   4.8996 6.454624 5.798451 
1 1 1   18    1  -53 o   34.122   3.2747   48.303   8.9968   51.401   12.306   44.745   13.187   34.968   4.4154   32.403   5.1657 2.564949 6.795655 
1 1 1   18    1  -52 o   12.552   5.1645   2.2139   8.5045   12.341   11.752  -8.9194   12.322   18.142   6.3927   11.936   5.4943 6.206123 8.429392 
1 1 1   18    1  -51 o  132.305   1.5411  714.724   16.620  718.459   24.541  711.560   22.589  132.511   2.2720  131.911   2.1008 0.6005707 3.094373 
1 1 1   18    1  -50 o   53.570   2.2522  117.595   9.8127  120.566   15.033  115.391   12.953   54.055   3.4295   52.952   3.0133 1.102638 4.565186 
1 1 1   18    1  -49 f   62.192   2.2752  158.411   11.515  172.436   16.046  143.522   16.534   64.768   3.0478   59.002   3.4527 5.766224 4.605504 
1 1 1   18    1  -48 o   18.282   5.8183   13.706   9.7577   5.2395   13.717   22.379   13.883   16.394   6.6286   22.932   6.8807 -6.538218 9.554218 
1 1 1   18    1  -47 o  114.875   1.7303  538.843   16.202  554.614   22.292  521.182   23.590  116.453   2.3484  112.851   2.5644 3.601509 3.477247 
1 1 1   18    1  -46 o   72.425   2.0418  214.484   12.042  210.585   16.615  218.799   17.479   71.652   2.8504   73.023   2.9424 -1.371147 4.096623 
1 1 1   18    1  -45 o   80.356   2.0550  263.976   13.449  295.012   17.638  220.860   20.789   84.883   2.5520   73.279   3.4903 11.60426 4.323731 
1 1 1   18    1  -44 o   56.080   2.0992  128.669   9.5795  121.792   14.477  134.025   12.776   54.408   3.2795   57.161   2.7501 -2.752987 4.279991 
1 1 1   18    1  -43 f   44.018   2.3109   79.408   8.2626   75.418   11.554   83.585   11.821   42.763   3.3409   45.047   3.2410 -2.283813 4.654658 
1 1 1   18    1  -42 o  120.630   1.4348  593.700   14.109  577.350   19.237  612.730   20.754  118.901   1.9848  122.478   2.0788 -3.577126 2.874164 
1 1 1   18    1  -41 o   55.738   2.1020  127.075   9.5332  109.013   14.487  140.869   12.660   51.450   3.4747   58.629   2.6560 -7.179062 4.373569 
1 1 1   18    1  -40 o   93.951   1.5220  360.152   11.656  377.459   16.292  342.004   16.683   96.137   2.0790   91.495   2.2369 4.641151 3.053817 
1 1 1   18    1  -39 o   97.316   1.6789  386.486   13.318  416.735   18.567  354.427   19.115  101.000   2.2553   93.083   2.5215 7.916847 3.382927 
1 1 1   18    1  -38 o  140.325   1.4414  803.299   16.488  821.621   22.774  783.120   23.901  141.860   1.9694  138.478   2.1173 3.382172 2.891690 
1 1 1   18    1  -37 o  111.817   1.6500  510.186   15.040  511.481   20.567  508.697   22.049  111.902   2.2547  111.578   2.4242 0.3238983 3.310673 
1 1 1   18    1  -36 o   69.360   2.1420  196.639   12.096  203.194   15.303  185.726   19.746   70.453   2.6695   67.225   3.6167 3.227379 4.495174 
1 1 1   18    1  -35 o   15.475   5.6978   7.8602   9.4589   8.9523   14.528   7.0566   12.462   18.036   6.9664   16.506   6.4310 1.529900 9.480896 
1 1 1   18    1  -34 o   40.506   2.8167   67.407   9.2425   61.908   12.698   73.601   13.478   38.632   4.0947   42.180   3.9666 -3.547512 5.700907 
1 1 1   18    1  -33 o   29.740   3.3684   36.666   8.0222   40.265   11.260   32.957   11.432   30.975   4.5990   27.847   5.2280 3.128244 6.963011 
1 1 1   18    1  -32 o   38.091   2.6546   59.581   8.1909   54.492   11.548   64.733   11.620   36.242   3.9739   39.588   3.6416 -3.345634 5.390114 
1 1 1   18    1  -31 o   33.188   3.0475   45.423   8.1526   42.678   11.502   48.195   11.557   31.923   4.5485   34.012   4.2619 -2.088760 6.233192 
1 1 1   18    1  -30 o  184.041   1.7094  1381.96   25.644  1408.08   34.343  1349.04   38.555  185.697   2.2688  181.708   2.6030 3.988907 3.452962 
1 1 1   18    1  -29 o  135.467   1.6198  748.641   17.886  738.024   23.554  763.102   27.490  134.455   2.1491  136.685   2.4673 -2.229782 3.272008 
1 1 1   18    1  -28 o  112.193   1.6357  513.494   14.959  519.010   19.882  506.299   22.709  112.755   2.1632  111.335   2.5023 1.419556 3.307665 
1 1 1   18    1  -27 o   86.818   1.7399  307.515   12.313  302.454   16.197  314.446   18.954   86.036   2.3115   87.692   2.6546 -1.655533 3.519969 
1 1 1   18    1  -26 o   28.053   4.2746   32.992   9.4665   19.354   13.738   45.320   13.063   21.782   6.9005   32.840   5.0405 -11.05769 8.545362 
1 1 1   18    1  -25 o   95.300   1.6875  370.504   13.109  366.524   20.395  373.307   17.113   94.687   2.6450   95.630   2.1953 -0.9425583 3.437314 
1 1 1   18    1  -24 o   23.984   4.5713   24.375   8.6110   19.634   13.597   27.549   11.127   21.882   6.8560   25.394   5.5321 -3.512138 8.809563 
1 1 1   18    1  -23 o  153.491   1.7527  961.136   21.929  975.103   38.364  954.357   26.725  154.453   3.0472  152.912   2.1441 1.540604 3.725891 
1 1 1   18    1  -22 o  102.615   1.6404  429.521   13.721  429.613   20.933  429.451   18.169  102.570   2.5036  102.575   2.1730 -0.4859924E-02 3.315140 
1 1 1   18    1  -21 o   49.816   2.3380  101.534   9.4676   99.342   14.332  103.231   12.611   49.144   3.6027   50.160   3.0994 -1.015945 4.752496 
1 1 1   18    1  -20 o   73.471   1.8474  220.371   11.055  241.511   17.187  205.451   14.438   76.843   2.7483   70.889   2.5026 5.953857 3.716959 
1 1 1   18    1  -19 o   87.179   1.7301  310.037   12.295  292.931   18.801  322.819   16.252   84.641   2.7286   88.903   2.2444 -4.262238 3.533032 
1 1 1   18    1  -18 o   93.141   1.6997  353.875   12.905  347.513   19.634  358.714   17.123   92.210   2.6147   93.747   2.2407 -1.536209 3.443477 
1 1 1   18    1  -17 o  178.947   1.6841  1306.19   24.565  1274.55   37.122  1330.84   32.765  176.670   2.5777  180.572   2.2260 -3.902664 3.405836 
1 1 1   18    1  -16 o  187.765   1.7071  1438.11   26.128  1419.41   39.708  1452.39   34.697  186.437   2.6128  188.637   2.2565 -2.199753 3.452304 
1 1 1   18    1  -15 o   52.412   2.3175  112.349   9.8769  122.548   15.417  105.248   12.864   54.632   3.4799   50.651   3.1309 3.980946 4.681026 
1 1 1   18    1  -14 o   71.865   2.0253  210.900   11.852  215.563   16.823  206.306   16.701   72.589   2.8487   71.006   2.8914 1.582253 4.059007 
1 1 1   18    1  -13 o   91.484   1.8109  341.414   13.504  352.321   19.426  331.214   18.786   92.857   2.5690   90.031   2.5624 2.825989 3.628430 
1 1 1   18    1  -12 f   12.229   5.0865   1.3507   8.3726 -16.0394   13.222   12.992   10.818   11.292   5.3543   18.329   6.1451 -7.036187 8.150568 
1 1 1   18    1  -11 o  124.702   1.8585  634.376   18.892  623.356   29.681  641.882   24.495  123.529   2.9476  125.399   2.3963 -1.870941 3.798764 
1 1 1   18    1  -10 o   37.565   3.2319   58.093   9.8002   69.929   14.395   47.869   13.380   41.091   4.3643   33.802   5.0070 7.289383 6.642096 
1 1 1   18    1   -9 o   95.766   1.8071  374.109   14.107  352.488   20.027  395.398   19.873   92.875   2.6481   98.385   2.4800 -5.510460 3.628041 
1 1 1   18    1   -8 o  108.497   1.7809  480.169   15.750  470.819   22.846  488.638   21.743  107.385   2.6099  109.410   2.4379 -2.025391 3.571439 
1 1 1   18    1   -7 o  170.793   1.9774  1190.09   27.529  1197.44   44.453  1185.52   35.062  171.183   3.1857  170.411   2.5241 0.7719116 4.064425 
1 1 1   18    1   -6 o   74.415   2.2608  226.200   13.698  253.752   22.996  211.047   17.054   78.694   3.5944   71.822   2.9190 6.871353 4.630366 
1 1 1   18    1   -5 o  106.843   2.2660  465.866   19.735  508.284   28.670  427.664   27.208  111.488   3.1579  102.245   3.2687 9.243477 4.544975 
1 1 1   18    1   -4 o  112.204   2.2383  513.777   20.472  515.666   29.425  512.005   28.501  112.289   3.2180  111.900   3.1277 0.3890991 4.487556 
1 1 1   18    1   -3 o   60.454   2.5921  149.477   12.744  137.835   16.082  169.128   20.893   57.969   3.4185   64.164   4.0147 -6.195068 5.272888 
1 1 1   18    1   -2 o  158.821   1.9671  1029.06   25.466  1049.52   32.972  998.811   40.094  160.341   2.5227  156.351   3.1459 3.990311 4.032393 
1 1 1   18    1   -1 o   67.775   2.1167  187.606   11.680  181.512   16.791  193.319   16.257   66.583   3.1022   68.737   2.9080 -2.154366 4.252056 
1 1 1   18    1    0 o  111.286   1.7628  505.156   15.991  527.620   23.323  485.229   21.967  113.688   2.5167  109.028   2.4717 4.659668 3.527443 
1 1 1   18    1    1 o  107.707   1.7710  473.189   15.549  483.615   22.497  463.654   21.514  108.842   2.5357  106.576   2.4764 2.265953 3.544350 
1 1 1   18    1    2 o   50.748   2.5718  105.406   10.604  101.820   15.240  108.771   14.763   49.750   3.7865   51.458   3.5412 -1.708073 5.184337 
1 1 1   18    1    3 o  114.572   1.7608  535.426   16.444  541.626   23.764  529.730   22.779  115.185   2.5309  113.919   2.4531 1.266396 3.524630 
1 1 1   18    1    4 o   80.386   1.9568  263.622   12.822  263.081   18.565  264.116   17.729   80.210   2.8440   80.380   2.7098 -0.1699295 3.928241 
1 1 1   18    1    5 o   48.610   2.6700   96.772   10.539   85.854   15.339  106.534   14.504   45.608   4.1722   50.926   3.5156 -5.318329 5.455873 
1 1 1   18    1    6 o   75.901   2.0355  235.220   12.582  246.240   18.302  225.344   17.326   77.591   2.8988   74.224   2.8691 3.367096 4.078548 
1 1 1   18    1    7 o  145.469   1.7670  863.170   20.953  859.047   30.016  867.089   29.262  145.060   2.5385  145.744   2.4631 -0.6843872 3.537050 
1 1 1   18    1    8 o  139.916   1.7637  798.526   20.116  800.890   28.894  796.301   28.022  140.064   2.5307  139.668   2.4614 0.3956146 3.530252 
1 1 1   18    1    9 o   50.512   2.6521  104.467   10.882   85.112   15.737  122.201   15.064   45.388   4.3049   54.569   3.4034 -9.181484 5.487758 
1 1 1   18    1   10 o   37.510   3.3766   57.979   10.214   49.379   14.819   65.762   14.097   34.254   5.4930   39.826   4.4165 -5.572758 7.048346 
1 1 1   18    1   11 o  237.303   2.2592  2298.25   43.702  2298.23   56.750  2298.27   68.501  237.192   2.9352  237.071   3.5448 0.1215210 4.602221 
1 1 1   18    1   12 f  155.767   1.9512  989.916   24.775  999.069   32.430  977.086   38.395  156.430   2.5432  154.641   3.0459 1.788467 3.968047 
1 1 1   18    1   13 o   69.508   2.3470  197.431   13.279  217.377   17.880  172.898   19.830   72.879   3.0163   64.899   3.7645 7.979347 4.823820 
1 1 1   18    1   14 o  173.812   1.9966  1232.66   28.288  1194.80   36.361  1290.70   45.025  171.056   2.6077  177.719   3.1080 -6.662399 4.057078 
1 1 1   18    1   15 o  129.491   1.9255  684.120   20.324  669.619   26.518  704.767   31.641  128.062   2.5403  131.339   2.9555 -3.276306 3.897141 
1 1 1   18    1   16 o   87.000   2.2619  309.144   16.027  303.448   23.047  314.478   22.303   86.092   3.2901   87.664   3.1261 -1.571686 4.538425 
1 1 1   18    1   17 o  178.740   3.1141  1305.74   45.373   0.0000   0.0000  1305.74   45.373  ?   ?   178.740   3.1141 0.000000 3.114117 
1 1 1   18    1   18 o  148.532   2.4257  900.714   29.369  925.060   50.976  888.617   35.932  150.220   4.1669  147.466   2.9892 2.753723 5.128222 
1 1 1   18    1   19 o  217.924   3.3702  1942.06   59.868   0.0000   0.0000  1942.06   59.868  ?   ?   217.924   3.3702 0.000000 3.370183 
1 1 1   18    1   20 o   88.656   2.6658  321.311   19.243   0.0000   0.0000  321.311   19.243  ?   ?    88.656   2.6658 0.000000 2.665787 
1 1 1   18    1   21 o   27.960   4.6741   32.922   10.277   23.858   14.886   41.176   14.206   23.862   7.1169   31.139   5.8102 -7.276756 9.187422 
1 1 1   18    1   22 o   45.113   3.3300   83.678   12.159   68.596   15.719  106.146   19.186   40.598   4.8455   50.649   4.7007 -10.05098 6.751008 
1 1 1   18    1   23 o  153.639   1.7914  963.042   22.435  938.126   31.881  987.483   31.576  151.558   2.5806  155.505   2.4911 -3.946777 3.586767 
1 1 1   18    1   24 o   41.064   3.2440   69.382   10.771   86.964   16.045   54.962   14.531   45.854   4.3445   36.236   5.0571 9.618340 6.667040 
1 1 1   18    1   25 o  187.582   2.0497  1436.08   31.342  1471.58   41.559  1389.25   47.727  189.795   2.6862  184.324   3.1765 5.470779 4.160043 
1 1 1   18    1   26 o  161.003   1.8187  1057.66   23.868  1103.70   34.778  1016.67   32.817  164.377   2.5955  157.769   2.5518 6.608414 3.639838 
1 1 1   18    1   27 o   38.805   3.5933   62.161   11.237   72.521   18.509   56.113   14.142   41.602   5.6001   36.649   4.8530 4.953049 7.410346 
1 1 1   18    1   28 o  157.156   1.8087  1007.76   23.170  982.647   32.824  1032.70   32.711  155.093   2.5964  159.004   2.5238 -3.911331 3.620852 
1 1 1   18    1   29 o  113.644   1.8058  526.985   16.729  522.645   23.937  531.129   23.388  113.105   2.5963  114.028   2.5162 -0.9225845 3.615549 
1 1 1   18    1   30 o   53.699   2.5423  118.066   11.097  126.330   16.268  110.876   15.175   55.425   3.6206   51.911   3.6086 3.514233 5.111830 
1 1 1   18    1   31 o   83.996   1.9735  287.972   13.512  270.739   19.555  303.721   18.693   81.317   2.9550   86.169   2.6645 -4.852539 3.978928 
1 1 1   18    1   32 o   38.349   3.2876   60.623   10.178   55.025   15.092   65.293   13.784   36.185   5.2714   39.651   4.3352 -3.466427 6.825091 
1 1 1   18    1   33 o   59.670   2.3491  145.657   11.404  129.986   16.316  160.625   15.945   56.220   3.5789   62.579   3.1358 -6.358856 4.758332 
1 1 1   18    1   34 o   82.157   1.9503  275.525   13.061  285.337   19.099  266.906   17.901   83.492   2.8103   80.758   2.7232 2.733932 3.913271 
1 1 1   18    1   35 o   46.378   2.8026   88.265   10.546   95.622   15.611   82.089   14.303   48.114   4.0169   44.561   3.9795 3.553440 5.654393 
1 1 1   18    1   36 o  108.340   2.0165  479.207   17.808  474.955   29.288  481.701   22.431  107.648   3.3417  108.568   2.5346 -0.9204254 4.194211 
1 1 1   18    1   37 o  154.527   2.2358  975.323   28.163  972.999   40.585  977.481   39.113  154.163   3.2296  154.544   3.1048 -0.3807983 4.479929 
1 1 1   18    1   38 o   57.383   3.1388  135.188   14.626  140.576   22.048  130.953   19.546   58.265   4.6816   56.295   4.2919 1.969738 6.351170 
1 1 1   18    1   39 o   98.060   2.0586  392.672   16.455  383.104   21.332  406.730   25.857   96.752   2.7075   99.615   3.1884 -2.862648 4.182872 
1 1 1   18    1   40 o   33.733   3.6913   47.223   9.9845   52.934   14.847   42.507   13.491   35.429   5.3037   31.648   5.4246 3.781374 7.586515 
1 1 1   18    1   41 o   47.279   2.7167   91.731   10.426  106.786   15.353   78.847   14.203   50.880   3.7275   43.628   4.0396 7.252525 5.496631 
1 1 1   18    1   42 o  122.219   1.7784  609.789   17.717  611.568   25.535  608.136   24.603  122.292   2.5615  121.962   2.4747 0.3301773 3.561695 
1 1 1   18    1   43 f  149.511   1.9455  912.886   23.710  949.768   31.878  867.219   35.472  152.389   2.5663  145.527   2.9903 6.862808 3.940493 
1 1 1   18    1   44 o  138.569   1.7837  783.959   20.148  798.992   29.018  769.966   27.996  139.765   2.5470  137.212   2.5030 2.553879 3.571065 
1 1 1   18    1   45 o   78.675   2.0565  253.055   13.177  280.207   19.714  231.125   17.717   82.663   2.9303   75.070   2.9007 7.593040 4.123165 
1 1 1   18    1   46 o  114.997   2.0342  540.310   19.068  540.991   24.961  539.356   29.549  114.969   2.6634  114.653   3.1647 0.3154755 4.136322 
1 1 1   18    1   47 o   81.145   2.1079  269.285   13.931  283.222   20.455  257.228   19.026   83.070   3.0258   79.175   2.9531 3.895615 4.228023 
1 1 1   18    1   48 o   37.900   3.6288   59.571   11.074   97.313   16.941   31.412   14.633   48.380   4.3419   26.856   6.7053 21.52440 7.988341 
1 1 1   18    1   49 f   37.923   3.8472   59.798   11.729   33.300   18.486   77.651   15.174   27.622   7.8445   43.155   4.3738 -15.53222 8.981421 
1 1 1   18    1   50 o   32.230   4.0695   43.493   10.453   55.834   15.435   33.037   14.208   36.268   5.3841   27.533   6.4450 8.735355 8.398040 
1 1 1   18    1   51 o   21.068   5.5301   19.178   9.6157   30.673   14.504   10.164   12.844   26.484   6.7112   17.668   6.6140 8.816866 9.422574 
1 1 1   18    1   52 o   31.313   3.8855   41.036   9.7050   48.673   14.534   34.891   13.038   33.761   5.4681   28.391   5.8289 5.369942 7.992255 
1 1 1   18    1   53 o   63.077   2.2196  163.025   11.395  169.061   16.533  157.564   15.727   64.061   3.1759   61.848   3.1297 2.212311 4.458856 
1 1 1   18    1   54 o   42.526   2.8692   74.567   9.8879   72.512   14.392   76.404   13.608   41.634   4.3027   42.833   3.9416 -1.199829 5.835172 
1 1 1   18    1   55 o   61.727   2.1975  156.184   11.040  174.830   16.194  139.994   15.089   65.144   3.0581   58.249   3.1901 6.894466 4.419169 
1 1 1   18    1   56 o   56.184   2.6765  129.849   12.223  128.661   17.748  130.921   16.857   55.630   3.9393   56.183   3.7015 -0.5529938 5.405477 
1 1 1   18    1   57 o   50.052   2.8575  103.302   11.610   86.506   16.969  118.087   15.920   45.339   4.6576   53.329   3.6849 -7.990269 5.938986 
1 1 1   18    1   58 o   48.266   2.9458   96.200   11.535   88.505   17.042  102.706   15.669   45.847   4.6230   49.638   3.9040 -3.790966 6.050864 
1 1 1   18    1   59 o   24.993   4.4520   26.775   8.7376   30.169   12.977   23.961   11.817   26.135   6.1880   23.318   6.1355 2.816706 8.714090 
1 1 1   18    1   60 o   59.722   2.1879  146.427   10.633  153.880   15.303  139.471   14.785   61.010   3.0872   58.062   3.1355 2.947277 4.400244 
1 1 1   18    1   61 o   64.051   2.0981  168.358   10.940  189.028   16.204  151.046   14.829   67.654   2.9453   60.442   3.0194 7.212379 4.217998 
1 1 1   18    1   62 f  114.664   1.7566  538.182   16.418  549.531   23.920  528.071   22.576  115.598   2.5385  113.355   2.4433 2.242386 3.523288 
1 1 1   18    1   63 o   72.313   1.9966  214.544   11.758  226.608   17.373  204.349   15.971   74.058   2.8834   70.351   2.7906 3.706253 4.012661 
1 1 1   18    1   64 o   15.477   5.3684   9.3812   8.2683   16.611   12.519   3.7876   11.012   19.842   6.6099   14.354   5.8881 5.488365 8.852130 
1 1 1   18    1   65 o   37.330   3.0238   58.018   9.1223   51.729   13.407   63.439   12.448   34.647   4.8824   38.752   3.9980 -4.104336 6.310441 
1 1 1   18    1   66 o   17.975   5.2702   14.112   8.2206   9.0692   12.398   18.069   10.982   16.741   6.4435   20.237   6.1302 -3.496332 8.893686 
1 1 1   18    1   67 o   64.815   2.1059  172.811   11.111  170.659   16.099  174.769   15.355   64.070   3.0917   64.911   2.9093 -0.8411942 4.245297 
1 1 1   18    1   68 o   44.116   3.0676   81.153   10.963   90.795   14.741   69.221   16.398   46.347   3.9392   39.906   5.1620 6.441914 6.493300 
1 1 1   18    1   69 o   21.459   5.4389   20.632   9.5245   18.101   13.047   23.521   13.937   20.351   6.7467   22.718   6.9109 -2.366945 9.658085 
1 1 1   18    1   70 o   13.206   5.6334   1.1381   10.694   6.4258   16.869  -2.4146   13.827   17.410   7.2288   13.901   6.1579 3.508987 9.496063 
1 1 1   18    1   71 o   36.000   4.3801   55.798   12.590   62.053   14.302   34.267   26.536   37.823   4.7427   26.754   9.5876 11.06832 10.69649 
1 1 1   18    1   72 o   60.392   3.4738  153.351   17.029  167.774   20.870  124.620   29.455   62.805   4.0990   51.938   7.1466 10.86628 8.238640 
1 1 1   18    1   73 o   34.898   4.2891   52.554   11.945   59.198   18.480   47.786   15.655   35.841   6.5673   32.343   6.1627 3.498150 9.006036 
1 1 1   18    1   74 o   52.895   2.3888  115.943   10.273  104.017   15.327  125.673   13.844   49.457   3.8316   54.765   3.1139 -5.307461 4.937377 
1 1 1   18    1   75 o   77.499   1.9462  247.444   12.285  256.892   18.128  239.420   16.707   78.496   2.8378   75.853   2.7063 2.642555 3.921381 
1 1 1   18    1   76 o   40.964   2.8767   70.287   9.5449   67.308   14.510   72.561   12.673   39.266   4.6215   41.212   3.8157 -1.945827 5.993212 
1 1 1   18    1   77 o   49.254   2.4593  100.828   9.8425   90.378   14.831  109.054   13.158   45.895   4.0043   50.899   3.1873 -5.004028 5.117947 
1 1 1   18    1   78 o   34.622   3.1211   50.637   8.7140   46.655   12.614   54.272   12.052   32.396   4.9323   35.332   4.2711 -2.936344 6.524556 
1 1 1   18    1   79 o   38.917   2.9930   63.785   9.4217   61.368   14.296   65.641   12.527   37.240   4.8226   39.002   3.9967 -1.761440 6.263477 
1 1 1   18    1   80 o   18.695   5.4819   16.057   8.8937   38.992   15.269   4.2815   10.941   28.450   6.6962   14.068   5.8297 14.38199 8.878316 
1 1 1   18    1   81 o   18.463   5.1608   15.646   8.0671   25.758   11.317   5.1992   11.503   23.346   5.9347   14.567   6.0012 8.778803 8.440116 
1 1 1   18    1   82 o   8.4051   4.0035  -8.6961   7.5609  -1.1493   10.616 -16.4664   10.772   12.213   5.4035   9.2623   4.5023 2.950400 7.033376 
1 1 1   18    1   83 o   17.827   5.0357   14.663   7.6387   5.0622   10.732   24.523   10.875   14.098   5.8012   22.668   5.8472 -8.569122 8.236742 
1 1 1   18    1   84 o   10.333   4.5500  -0.8483   7.4417  -6.1719   10.353   4.8428   10.704   10.778   4.9879   13.959   5.7737 -3.181147 7.629904 
1 1 1   18    1   85 o   27.873   3.3025   33.549   7.3580   29.099   11.011   37.139   9.8901   24.706   5.5978   28.787   4.3503 -4.080990 7.089478 
1 1 1   18    1   86 o   15.894   4.9241   11.633   7.0355   2.5864   11.698   16.760   8.8061   13.559   5.8399   18.731   5.4442 -5.172320 7.983937 
1 1 1   18    1   87 f   13.368   4.9134   7.2093   7.0287   8.2001   11.345   6.5921   8.9541   15.129   6.0593   13.745   5.4224 1.383748 8.131248 
1 1 1   18    1   88 o   16.367   4.8032   12.558   6.8255   14.612   10.686   11.142   8.8708   17.478   6.1007   15.692   5.5518 1.786203 8.248693 
1 1 1   18    1   89 o   25.706   3.1841   28.755   6.5296   29.603   9.4423   27.978   9.0394   25.157   4.7791   24.492   4.6985 0.6649036 6.701901 
1 1 1   18    1   90 o   8.9522   4.0108  -1.5500   6.0395   4.2904   8.7329  -6.9042   8.3615   12.605   5.2145   9.1811   4.3244 3.424080 6.774333 
1 1 1   18    1   91 o   13.395   4.6237   7.9852   6.1303  -3.2410   8.9702   17.823   8.3973   10.377   4.7437   19.023   5.2459 -8.645592 7.072602 
1 1 1   18    1   92 o   12.762   4.8348   6.5359   6.9088   7.2943   9.0726   5.4892   10.659   13.765   5.4494   13.625   5.7083 0.1402760 7.891788 
1 1 1   18    1   93 o   11.309   4.8179   2.2733   7.8040   2.1104   9.1595   2.7046   14.906   11.910   5.1487   14.219   6.3405 -2.309286 8.167733 
1 1 1   18    1   94 o   30.594   3.5277   41.752   8.6367   38.106   10.119   51.538   16.577   28.473   4.5098   30.777   6.7901 -2.304445 8.151267 
1 1 1   18    1   95 o   13.805   5.4494   7.6709   9.0484   4.6753   11.099   13.608   15.625   13.406   5.7294   16.972   6.9935 -3.566738 9.040761 
1 1 1   18    1   96 o   35.264   4.3767   58.050   12.311   65.334   17.824   51.406   17.024   34.997   6.4868   30.252   7.0367 4.744764 9.570473 
1 1 1   18    1   97 o   15.329   6.1299   10.561   11.592 -14.8300   16.240   36.937   16.552   11.626   5.6219   24.612   7.5401 -12.98647 9.405266 
1 1 1   18    1   98 o   13.810   5.8828   5.9282   11.632  -1.6619   16.608   13.237   16.297   13.635   6.3126   16.713   7.0336 -3.077903 9.450994 
1 1 1   18    1   99 o   12.437   5.8735  -6.8584   15.612  -0.6086   22.208 -12.9641   21.950   15.144   7.1060   13.586   6.5615 1.557836 9.672051 
1 1 1   18    1  100 o   12.251   5.8354  -8.9543   16.063 -27.8601   22.502   10.691   22.938   12.299   6.0830   16.866   7.6616 -4.567343 9.782796 
1 1 1   18    1  101 o   18.621   7.3262   20.763   16.307   40.415   23.518   2.5662   22.630   22.939   8.8626   15.520   7.2469 7.419476 11.44830 
1 1 1   18    1  102 o   14.716   6.5427   6.0498   15.752   0.2718   22.578   11.529   21.987   15.146   7.1254   16.742   7.5633 -1.595458 10.39108 
1 1 1   18    1  103 o   12.993   6.0577  -2.7085   15.712 -19.3807   21.814   15.265   22.650   12.727   6.2339   17.365   7.7745 -4.638649 9.965215 
1 1 1   18    1  104 o   17.066   7.0233   16.089   15.733   11.764   22.182   20.468   22.319   16.645   7.5504   18.214   7.9538 -1.569798 10.96680 
1 1 1   18    1  105 o   15.529   6.7415   10.323   15.837   0.8087   22.454   19.741   22.340   14.998   7.0711   17.976   7.9006 -2.978372 10.60288 
1 1 1   18    1  106 o   11.694   5.6193 -10.6758   15.623   15.597   22.412 -35.5122   21.791   17.237   7.7240   11.339   5.6693 5.897412 9.581306 
1 1 1   18    1  107 o   10.650   5.2282 -19.4548   15.613 -34.9900   22.793  -5.7223   21.430   11.682   5.8343   14.010   6.6917 -2.327768 8.877942 
1 1 1   18    2 -105 o   17.590   7.5358   18.090   19.284   2.8123   27.107   33.744   27.439   15.943   7.5900   20.315   8.8459 -4.372267 11.65584 
1 1 1   18    2 -104 o   13.019   6.2148  -7.1765   18.430 -39.0078   25.415   28.126   26.765   12.067   6.0464   19.321   8.5626 -7.253284 10.48221 
1 1 1   18    2 -103 o   16.689   7.2901   14.299   18.763   4.6046   26.541   23.985   26.529   16.022   7.5939   18.650   8.3768 -2.627741 11.30652 
1 1 1   18    2 -102 o   9.1631   4.6477 -49.1316   17.842 -53.5012   25.215 -44.7500   25.250   11.205   5.6654   11.696   5.8829 -0.4911261 8.167328 
1 1 1   18    2 -101 o   17.937   7.5488   19.326   18.771   16.006   26.448   22.696   26.646   17.603   8.0832   18.606   8.3730 -1.003510 11.63811 
1 1 1   18    2 -100 o   14.527   6.7326   1.4592   18.965   8.6421   26.969  -5.5686   26.676   16.774   7.8581   15.142   7.2933 1.631373 10.72106 
1 1 1   18    2  -99 o   12.200   5.9066 -13.9827   18.060 -38.4323   24.785   13.694   26.370   12.072   6.0373   17.452   8.0348 -5.379132 10.05025 
1 1 1   18    2  -98 o   15.568   7.0242   7.0392   18.895   7.0392   18.895   0.0000   0.0000   15.568   7.0242  ?   ?  0.000000 7.024223 
1 1 1   18    2  -97 o   41.206   5.2695   84.568   17.295   78.146   21.017   98.039   30.440   36.796   7.2649   35.882   10.023 0.9146614 12.37919 
1 1 1   18    2  -96 o   19.915   6.8916   23.152   13.622   7.8074   18.924   39.655   19.625   15.844   7.0990   24.172   8.2755 -8.327290 10.90315 
1 1 1   18    2  -95 o   23.421   6.6862   31.137   13.395   21.312   19.020   40.806   18.869   18.899   7.7438   24.942   8.1054 -6.043295 11.20995 
1 1 1   18    2  -94 o   24.172   6.5359   32.399   13.185   35.350   19.074   29.699   18.245   23.144   8.1452   21.506   7.9142 1.638336 11.35688 
1 1 1   18    2  -93 o   16.887   6.5573   14.416   12.923   15.420   18.727   13.504   17.857   17.655   7.4904   17.116   7.2897 0.5396042 10.45205 
1 1 1   18    2  -92 o   22.547   6.6638   28.305   13.099   24.325   18.814   32.050   18.249   20.051   7.8751   22.524   7.9635 -2.473265 11.19976 
1 1 1   18    2  -91 o   13.221   5.8368   2.3516   12.321   4.7884   17.817   0.1183   17.057   15.353   6.8829   14.278   6.5322 1.075126 9.489150 
1 1 1   18    2  -90 o   25.185   6.3393   33.730   13.003   15.909   18.431   51.390   18.347   17.994   7.5202   29.846   7.5400 -11.85219 10.64919 
1 1 1   18    2  -89 o   21.083   6.6942   24.324   12.923   4.7517   18.634   42.462   17.938   15.692   7.0364   26.780   7.7661 -11.08824 10.47966 
1 1 1   18    2  -88 o   16.309   6.4321   11.842   12.596   23.585   18.230   1.1137   17.424   20.385   7.8218   14.811   6.7079 5.573713 10.30422 
1 1 1   18    2  -87 o   12.849   5.7526  -0.3035   12.401   18.773   17.628 -18.9939   17.449   19.158   7.5923   11.918   5.7786 7.239484 9.541253 
1 1 1   18    2  -86 o   18.277   6.4477   16.575   11.958   12.720   17.087   20.276   16.741   17.596   7.2879   19.752   7.5161 -2.155407 10.46925 
1 1 1   18    2  -85 o   19.433   6.5249   19.090   12.196   1.5393   16.860   38.353   17.663   15.043   6.7232   26.229   7.7346 -11.18651 10.24817 
1 1 1   18    2  -84 o   13.039   5.7242   0.9467   11.698  -2.3406   16.129   4.5948   16.991   14.107   6.4145   15.824   6.9243 -1.717582 9.438834 
1 1 1   18    2  -83 o   15.127   5.6683   9.4130   9.4381   12.021   16.854   8.2215   11.392   17.727   7.2796   15.212   6.0787 2.515438 9.483802 
1 1 1   18    2  -82 o   25.393   4.5743   29.334   9.1203   20.973   14.384   34.955   11.794   20.496   7.0821   27.179   5.5124 -6.682848 8.974572 
1 1 1   18    2  -81 o   16.161   4.9943   11.927   7.2427   13.440   9.6618   9.9858   10.943   17.145   5.8076   15.885   6.0689 1.260236 8.400018 
1 1 1   18    2  -80 o   11.352   4.6816   2.6093   7.0101  -3.0521   9.2275   10.336   10.780   10.861   4.9038   16.047   6.0483 -5.186206 7.786511 
1 1 1   18    2  -79 o   22.539   4.2159   22.646   7.4610   12.795   9.9442   35.333   11.286   16.998   5.8879   27.765   5.1769 -10.76625 7.840126 
1 1 1   18    2  -78 o   14.285   5.0613   8.3276   7.3749   14.615   9.9392   0.6250   11.001   17.921   5.8865   12.928   5.6154 4.993244 8.135349 
1 1 1   18    2  -77 o   20.774   5.4847   20.033   9.4229   20.475   10.613   18.388   20.482   20.870   5.9493   20.850   8.2085 0.1993561E-01 10.13769 
1 1 1   18    2  -76 o   16.223   5.6683   11.140   9.2267   17.055   11.334  -0.4835   15.888   19.271   6.2833   14.952   6.6133 4.319021 9.122215 
1 1 1   18    2  -75 o   26.541   4.1140   30.780   8.6128   24.424   10.070   48.098   16.622   23.047   5.4469   31.862   6.6166 -8.814924 8.570224 
1 1 1   18    2  -74 o   33.378   2.9448   46.893   7.9300   42.388   10.793   52.178   11.690   31.137   4.3726   34.670   4.2237 -3.532763 6.079408 
1 1 1   18    2  -73 o   31.998   3.0719   43.211   7.9142   57.496   10.781   26.518   11.654   36.708   3.6514   23.875   5.9971 12.83342 7.021246 
1 1 1   18    2  -72 o   13.106   4.9878   5.7422   7.3733   13.632   10.023  -3.5618   10.885   17.674   5.9150   11.902   5.3542 5.771095 7.978427 
1 1 1   18    2  -71 o   43.207   2.6311   77.765   9.2228   68.879   13.232   86.161   12.862   40.032   4.1135   45.111   3.5257 -5.078487 5.417691 
1 1 1   18    2  -70 o   10.933   4.7452  -0.3863   7.8416  -8.7533   10.763   9.0786   11.448   10.706   4.9988   16.154   6.1984 -5.448444 7.962932 
1 1 1   18    2  -69 o   24.157   4.5753   25.711   8.6795   29.729   11.659   20.717   12.999   25.554   5.7381   21.280   6.7085 4.273613 8.827764 
1 1 1   18    2  -68 o   57.943   2.1822  138.564   10.289  140.435   12.952  135.364   16.939   58.126   2.7412   56.620   3.6901 1.505722 4.596889 
1 1 1   18    2  -67 o   48.086   2.6524   96.004   10.356   94.403   12.140  100.285   19.849   47.502   3.1530   47.966   5.1575 -0.4640923 6.044906 
1 1 1   18    2  -66 o   25.510   4.1098   28.093   8.2558   33.678   10.364   18.393   13.658   27.747   4.7530   20.506   6.9050 7.241249 8.382674 
1 1 1   18    2  -65 o   72.149   1.9429  213.953   11.416  211.622   14.361  217.954   18.816   71.573   2.4652   72.307   3.2004 -0.7344589 4.039739 
1 1 1   18    2  -64 o   22.439   5.3234   22.462   9.5894   33.140   13.578   11.837   13.545   27.000   6.2870   18.038   6.7838 8.962374 9.249151 
1 1 1   18    2  -63 o   12.223   5.2176   0.6099   9.1844 -15.2684   13.347   14.892   12.658   11.212   5.3343   19.024   6.6397 -7.812056 8.517072 
1 1 1   18    2  -62 o   22.962   4.8817   23.168   8.8556   19.897   14.024   25.337   11.421   21.338   6.9912   23.757   5.9193 -2.419422 9.160505 
1 1 1   18    2  -61 o   58.882   2.0301  142.457   9.7296  152.638   13.573  131.696   13.954   60.751   2.7480   56.325   3.0506 4.426613 4.105832 
1 1 1   18    2  -60 o   24.984   4.0464   26.711   7.9590   39.343   11.318   14.354   11.194   30.206   4.7537   18.593   6.2513 11.61332 7.853409 
1 1 1   18    2  -59 o   32.400   3.1296   43.801   8.1627   42.773   11.427   44.873   11.665   31.609   4.5670   32.397   4.5416 -0.7882538 6.440770 
1 1 1   18    2  -58 o   18.497   5.0526   14.925   7.8322   6.8100   11.012   23.232   11.142   15.462   6.0392   22.884   5.9264 -7.421658 8.461275 
1 1 1   18    2  -57 o   44.653   2.4403   82.161   8.8487   91.370   12.337   72.405   12.698   46.906   3.2467   41.584   3.7877 5.322239 4.988787 
1 1 1   18    2  -56 o   14.880   5.2260   8.3851   7.8494   5.5337   10.858   11.507   11.360   14.960   5.9490   17.502   6.2731 -2.541350 8.645345 
1 1 1   18    2  -55 o   28.488   3.2227   33.902   7.3523   31.932   11.316   35.341   9.6719   27.102   5.3123   28.848   4.2393 -1.746292 6.796472 
1 1 1   18    2  -54 o  102.617   1.5210  430.324   12.723  400.060   18.608  456.889   17.434   98.772   2.3112  105.629   2.0248 -6.857285 3.072733 
1 1 1   18    2  -53 o   37.002   2.7706   56.577   8.2961   40.532   13.346   66.681   10.591   30.596   5.5557   40.087   3.2695 -9.490877 6.446332 
1 1 1   18    2  -52 o   58.932   1.9650  142.269   9.4265  123.247   14.519  156.130   12.394   54.593   3.2776   61.650   2.4713 -7.057087 4.104891 
1 1 1   18    2  -51 o   56.508   2.0168  130.828   9.2750  152.680   14.663  116.253   11.975   60.873   2.9639   53.136   2.7743 7.737030 4.059773 
1 1 1   18    2  -50 o   61.339   2.0877  154.145   10.423  158.217   14.391  149.652   15.117   62.008   2.8548   60.253   3.0882 1.754601 4.205568 
1 1 1   18    2  -49 o   42.129   2.7354   73.115   9.3431   74.335   12.956   71.792   13.486   42.275   3.8003   41.485   4.0390 0.7894592 5.545789 
1 1 1   18    2  -48 o   85.664   1.8063  299.907   12.613  322.435   17.613  276.194   18.070   88.690   2.4386   82.024   2.7064 6.665955 3.642939 
1 1 1   18    2  -47 o   43.600   2.9724   78.383   10.501   68.812   13.555   92.750   16.607   40.606   4.1535   47.150   4.3706 -6.544594 6.029431 
1 1 1   18    2  -46 o   17.187   5.3476   12.263   8.2874   2.4307   13.073   18.869   10.715   15.190   6.3399   20.959   5.9791 -5.768755 8.714612 
1 1 1   18    2  -45 o   63.664   2.0350  165.868   10.547  137.305   15.719  189.258   14.224   57.707   3.3561   67.929   2.5735 -10.22247 4.229227 
1 1 1   18    2  -44 o  111.017   1.6449  503.292   14.885  477.501   21.935  525.308   20.266  108.002   2.4915  113.335   2.1936 -5.333305 3.319592 
1 1 1   18    2  -43 o  128.611   1.6236  675.368   17.021  691.078   25.349  662.469   22.970  129.963   2.3928  127.280   2.2139 2.683128 3.259892 
1 1 1   18    2  -42 o   8.8357   4.2562 -13.7706   9.0917  -6.8867   14.491 -18.2392   11.675   13.670   6.1611   9.9114   4.7865 3.758591 7.801954 
1 1 1   18    2  -41 o   28.732   3.9523   34.591   9.0116   31.111   14.076   37.007   11.731   26.759   6.5152   29.503   5.0598 -2.744156 8.249249 
1 1 1   18    2  -40 o   94.691   1.6718  366.059   12.904  357.119   19.326  373.252   17.334   93.392   2.5410   95.556   2.2254 -2.163788 3.377749 
1 1 1   18    2  -39 o   57.571   1.9851  135.554   9.3017  130.024   13.124  141.137   13.186   56.277   2.8703   58.653   2.7657 -2.376324 3.985954 
1 1 1   18    2  -38 o   54.707   2.0344  122.431   9.0564  114.940   12.844  129.837   12.771   52.890   2.9914   56.251   2.7940 -3.360714 4.093313 
1 1 1   18    2  -37 o   51.998   2.6925  110.922   11.373  103.285   13.913  126.307   19.747   50.067   3.4297   55.207   4.4251 -5.139812 5.598574 
1 1 1   18    2  -36 o   51.654   2.2596  109.242   9.4910  109.951   12.471  108.267   14.631   51.736   2.9696   51.256   3.5233 0.4808006 4.607812 
1 1 1   18    2  -35 o   52.067   2.2469  110.980   9.5138  107.339   12.440  116.112   14.767   51.116   2.9987   53.108   3.4293 -1.992485 4.555486 
1 1 1   18    2  -34 o   33.287   3.2211   45.809   8.6311   39.487   11.449   54.130   13.136   30.610   4.7419   35.978   4.5830 -5.367418 6.594653 
1 1 1   18    2  -33 o  100.901   1.4971  415.393   12.314  419.846   17.216  410.729   17.619  101.389   2.0831  100.275   2.1555 1.114227 2.997571 
1 1 1   18    2  -32 o  112.966   1.7877  520.894   16.462  520.936   24.528  520.861   22.206  112.868   2.6659  112.894   2.4130 -0.2547455E-01 3.595799 
1 1 1   18    2  -31 o   59.532   2.0236  144.880   9.8059  155.868   13.293  131.763   14.524   61.687   2.6498   56.644   3.1581 5.042725 4.122461 
1 1 1   18    2  -30 o  106.236   1.6724  460.562   14.483  457.302   20.116  464.070   20.869  105.798   2.3325  106.570   2.4023 -0.7722855 3.348369 
1 1 1   18    2  -29 o   51.003   2.8840  106.739   11.941   55.950   22.121  127.624   14.186   35.927   7.7793   55.753   3.1340 -19.82605 8.386832 
1 1 1   18    2  -28 o  134.916   1.7742  742.862   19.512  749.628   35.982  740.044   23.223  135.315   3.2622  134.622   2.1163 0.6932831 3.888479 
1 1 1   18    2  -27 f   63.721   2.1959  166.019   11.389  153.930   22.026  170.430   13.306   61.045   4.4571   64.530   2.5345 -3.484268 5.127335 
1 1 1   18    2  -26 o   63.387   2.0871  164.226   10.769  165.104   18.099  163.745   13.399   63.391   3.5164   63.243   2.6047 0.1473846 4.376027 
1 1 1   18    2  -25 o   91.498   1.6322  341.580   12.174  348.070   18.119  336.239   16.437   92.273   2.4109   90.738   2.2223 1.535141 3.278874 
1 1 1   18    2  -24 o  109.485   1.6941  489.114   15.120  465.342   24.527  503.684   19.202  106.646   2.8239  111.068   2.1209 -4.421455 3.531666 
1 1 1   18    2  -23 o   52.236   2.3159  111.660   9.8365   89.325   15.410  127.019   12.778   46.485   4.1091   55.668   2.8253 -9.183235 4.986669 
1 1 1   18    2  -22 o  160.548   1.6441  1051.63   21.516  1050.01   33.012  1052.83   28.370  160.311   2.5262  160.578   2.1674 -0.2668762 3.328583 
1 1 1   18    2  -21 o   96.365   1.6263  378.857   12.775  379.057   18.986  378.691   17.268   96.302   2.4205   96.304   2.1997 -0.2159119E-02 3.270680 
1 1 1   18    2  -20 o   96.602   1.6425  380.727   12.934  383.511   19.259  378.440   17.457   96.866   2.4411   96.272   2.2245 0.5942459 3.302583 
1 1 1   18    2  -19 o   87.328   1.9425  311.246   13.828  301.680   19.485  320.952   19.627   85.868   2.7874   88.579   2.7214 -2.710876 3.895621 
1 1 1   18    2  -18 f  240.805   2.0662  2367.00   40.558  2387.77   57.965  2347.09   56.768  241.670   2.9425  239.612   2.9064 2.058197 4.135845 
1 1 1   18    2  -17 o   95.916   1.8597  375.414   14.540  395.851   21.279  357.513   19.915   98.394   2.6555   93.509   2.6152 4.885078 3.727049 
1 1 1   18    2  -16 o  148.905   1.6314  904.534   19.801  922.176   30.784  892.082   25.861  150.256   2.5134  147.827   2.1462 2.428482 3.305001 
1 1 1   18    2  -15 o  113.749   1.7863  527.930   16.563  572.221   30.695  509.736   19.672  118.242   3.1875  111.744   2.1597 6.497894 3.850268 
1 1 1   18    2  -14 o   47.084   2.7257   90.881   10.417   85.051   19.440   93.230   12.337   45.151   5.3881   47.639   3.1954 -2.488480 6.264371 
1 1 1   18    2  -13 f  113.460   1.7857  525.232   16.515  546.314   30.165  516.207   19.736  115.535   3.2061  112.454   2.1530 3.080681 3.861969 
1 1 1   18    2  -12 o   31.670   3.9129   41.701   9.8869   38.471   18.370   43.018   11.731   29.873   7.5436   32.053   4.6232 -2.180899 8.847567 
1 1 1   18    2  -11 o  103.436   1.9532  436.608   16.469  444.689   37.344  434.657   18.349  104.032   4.4137  103.189   2.1815 0.8428192 4.923424 
1 1 1   18    2  -10 o  156.486   1.7592  999.062   22.440  1018.42   38.908  989.411   27.469  157.841   3.0240  155.688   2.1645 2.152451 3.718815 
1 1 1   18    2   -9 o  109.938   1.8090  493.129   16.212  507.845   23.121  478.897   22.738  111.509   2.5437  108.282   2.5760 3.227638 3.620274 
1 1 1   18    2   -8 o   49.914   2.7488  102.092   11.141   81.142   15.431  124.903   16.102   44.280   4.3305   55.128   3.6029 -10.84878 5.633262 
1 1 1   18    2   -7 o  244.157   2.0994  2433.06   41.782  2447.75   59.199  2418.48   58.980  244.723   2.9676  243.253   2.9745 1.469330 4.201661 
1 1 1   18    2   -6 o   32.985   3.9687   45.197   10.457   44.228   14.856   46.149   14.721   32.283   5.8614   33.030   5.6718 -0.7467499 8.156251 
1 1 1   18    2   -5 o  129.209   1.6265  681.005   17.131  671.937   26.081  687.886   22.718  128.273   2.4944  129.820   2.1468 -1.546402 3.291010 
1 1 1   18    2   -4 o   95.317   1.8134  370.679   14.090  372.273   20.492  369.250   19.404   95.431   2.6368   95.056   2.5065 0.3751678 3.638032 
1 1 1   18    2   -3 o  103.329   1.7864  435.596   15.047  434.694   21.830  436.413   20.768  103.132   2.5988  103.379   2.4645 -0.2473221 3.581578 
1 1 1   18    2   -2 o   71.442   2.0802  208.479   12.101  216.090   17.859  202.017   16.454   72.648   3.0224   70.254   2.8794 2.394524 4.174420 
1 1 1   18    2   -1 o  120.702   1.7636  594.371   17.352  583.636   24.954  604.421   24.145  119.543   2.5608  121.665   2.4346 -2.121910 3.533368 
1 1 1   18    2    0 o  205.068   1.9227  1715.94   32.140  1755.97   46.559  1679.51   44.421  207.320   2.7550  202.768   2.6875 4.552139 3.848752 
1 1 1   18    2    1 o   54.627   2.4954  122.113   11.083  126.387   16.564  118.648   14.912   55.448   3.6857   53.749   3.4212 1.699287 5.028858 
1 1 1   18    2    2 o  113.039   1.7800  521.305   16.402  553.398   24.268  494.318   22.254  116.405   2.5576  110.023   2.4814 6.382446 3.563475 
1 1 1   18    2    3 o  112.495   1.7736  516.301   16.264  531.391   23.841  503.165   22.245  114.066   2.5641  111.005   2.4584 3.061584 3.552174 
1 1 1   18    2    4 o   24.865   4.8841   26.256   9.5462   25.900   14.406   26.534   12.746   24.672   6.8966   24.884   6.2837 -0.2119884 9.329988 
1 1 1   18    2    5 o   37.484   3.3333   57.915   10.079   61.763   15.054   54.789   13.569   38.478   4.9112   36.242   4.7040 2.236252 6.800590 
1 1 1   18    2    6 o   70.770   2.2758  204.674   13.112  228.045   22.056  191.902   16.305   74.557   3.6402   68.463   2.9285 6.094406 4.671919 
1 1 1   18    2    7 o  176.552   1.8348  1271.79   26.406  1277.54   37.958  1266.39   36.759  176.851   2.6330  176.088   2.5609 0.7629852 3.673060 
1 1 1   18    2    8 o  135.790   1.7898  752.287   19.811  746.858   28.682  757.241   27.396  135.222   2.6021  136.174   2.4680 -0.9514465 3.586371 
1 1 1   18    2    9 o  194.973   1.9010  1551.16   30.213  1525.71   42.926  1576.15   42.532  193.248   2.7250  196.429   2.6563 -3.180466 3.805452 
1 1 1   18    2   10 o  273.712   2.4548  3059.44   54.770  3035.60   70.995  3094.47   86.079  272.460   3.1966  274.888   3.8415 -2.428070 4.997567 
1 1 1   18    2   11 o  208.231   2.1278  1769.85   36.117  1736.15   46.842  1819.26   56.716  206.129   2.7878  210.899   3.2991 -4.769455 4.319252 
1 1 1   18    2   12 o  182.164   2.0282  1354.31   30.118  1364.27   39.818  1341.00   46.043  182.741   2.6730  181.099   3.1189 1.641663 4.107653 
1 1 1   18    2   13 f   49.977   3.1521  102.537   12.776   89.023   19.585  112.546   16.855   46.228   5.2927   52.261   3.9867 -6.033470 6.626198 
1 1 1   18    2   14 o   64.493   2.3872  170.079   12.528  172.357   20.914  168.804   15.646   64.737   3.9825   64.190   2.9985 0.5473709 4.985099 
1 1 1   18    2   15 o  157.836   2.1805  1017.00   28.054  1040.81   41.002  996.040   38.467  159.532   3.1530  156.084   3.0234 3.447922 4.368336 
1 1 1   18    2   16 o  150.697   2.1759  927.094   26.728  909.483   38.526  943.437   37.113  149.122   3.1694  151.908   2.9971 -2.785797 4.362082 
1 1 1   18    2   17 o   75.198   2.2681  231.098   13.887  244.978   19.101  215.535   20.226   77.345   3.0355   72.491   3.4327 4.854042 4.582294 
1 1 1   18    2   18 f  160.225   1.9709  1047.77   25.741  1015.69   33.376  1094.86   40.439  157.672   2.5968  163.631   3.0318 -5.958649 3.991860 
1 1 1   18    2   19 o   71.372   2.3217  208.243   13.490  201.090   18.265  216.827   20.008   70.038   3.2078   72.709   3.3851 -2.671005 4.663630 
1 1 1   18    2   20 o   79.511   2.2081  258.331   14.297  233.479   24.900  270.553   17.463   75.349   4.0692   81.328   2.6377 -5.979034 4.849298 
1 1 1   18    2   21 o   56.401   2.4170  130.172   11.086  133.506   17.092  127.750   14.566   56.968   3.7006   55.786   3.2169 1.182560 4.903342 
1 1 1   18    2   22 o   52.659   2.5609  113.569   10.960   99.483   16.372  125.009   14.754   49.075   4.1309   55.170   3.2956 -6.095333 5.284498 
1 1 1   18    2   23 o   87.135   1.9336  309.898   13.734  301.596   20.246  316.975   18.692   85.833   2.8977   88.033   2.6076 -2.199883 3.898296 
1 1 1   18    2   24 o  168.935   2.0186  1165.05   27.798  1185.19   36.588  1137.56   42.751  170.292   2.6358  166.738   3.1454 3.554214 4.103765 
1 1 1   18    2   25 o  101.851   1.8317  423.371   15.207  480.517   22.961  378.715   20.297  108.433   2.5977   96.230   2.5899 12.20287 3.668186 
1 1 1   18    2   26 o   98.981   2.0118  399.974   16.232  391.126   21.922  410.713   24.151   97.772   2.7534  100.162   2.9613 -2.390076 4.043537 
1 1 1   18    2   27 f   34.267   3.8799   48.761   10.647   39.784   17.868   53.704   13.258   30.317   7.3149   35.849   4.6463 -5.531509 8.665772 
1 1 1   18    2   28 o   58.016   2.5582  137.827   12.069  155.805   20.200  127.847   15.050   61.485   4.0529   55.779   3.3251 5.705410 5.242350 
1 1 1   18    2   29 o   74.190   2.2112  225.007   13.358  267.786   22.768  202.556   16.494   80.775   3.4660   70.312   2.8840 10.46256 4.508924 
1 1 1   18    2   30 o  113.306   2.1428  524.316   19.791  463.074   39.720  544.541   22.826  105.998   4.6080  115.438   2.4258 -9.439743 5.207531 
1 1 1   18    2   31 o   55.810   2.8949  127.770   13.125  136.549   29.899  125.674   14.608   56.977   6.5569   55.302   3.2548 1.674553 7.320302 
1 1 1   18    2   32 o   22.822   6.9338   21.856   14.036   18.011   27.102   23.265   16.407   24.684   9.5201   23.741   7.5434 0.9433250 12.14640 
1 1 1   18    2   33 o   61.963   3.0567  157.558   15.391  144.054   24.257  166.659   19.913   58.874   5.1048   63.606   3.8589 -4.731873 6.399226 
1 1 1   18    2   34 o   24.853   5.6509   26.562   11.188   22.498   15.171   31.408   16.566   23.234   7.2361   26.962   7.3415 -3.728106 10.30822 
1 1 1   18    2   35 o   38.145   3.2714   60.055   10.074   46.750   15.652   69.466   13.163   33.077   6.0268   40.930   3.9961 -7.852154 7.231263 
1 1 1   18    2   36 o  102.202   1.8280  426.466   15.229  415.170   22.391  436.190   20.775  100.695   2.7304  103.287   2.4675 -2.591705 3.680162 
1 1 1   18    2   37 o   73.255   2.0792  219.402   12.403  228.863   19.177  212.597   16.263   74.669   3.1578   72.021   2.7753 2.648048 4.204077 
1 1 1   18    2   38 o   51.963   2.5682  110.723   10.845  115.828   16.765  107.049   14.221   52.944   3.9122   50.968   3.4431 1.976234 5.211592 
1 1 1   18    2   39 o   56.166   2.4707  129.272   11.284  147.975   17.297  115.414   14.889   59.934   3.5564   52.920   3.4706 7.014168 4.969257 
1 1 1   18    2   40 o   54.602   2.5153  122.225   11.165  113.861   17.253  128.252   14.645   52.444   4.0676   55.830   3.2318 -3.386517 5.195188 
1 1 1   18    2   41 o   16.979   5.8503   10.976   9.8127  -0.9886   15.145   19.632   12.882   15.377   6.6341   21.623   6.6571 -6.245492 9.398271 
1 1 1   18    2   42 o   57.830   2.5295  137.128   11.895  145.915   18.300  130.699   15.653   59.439   3.7969   56.313   3.4263 3.126377 5.114255 
1 1 1   18    2   43 o   72.300   2.4940  214.197   14.677  194.465   19.183  242.049   22.791   68.716   3.4357   76.632   3.6592 -7.915131 5.019288 
1 1 1   18    2   44 o   58.844   2.7964  142.225   13.375  165.499   17.962  113.260   20.039   63.356   3.4916   52.090   4.7723 11.26657 5.913178 
1 1 1   18    2   45 o  110.910   2.0563  502.923   18.591  508.743   24.636  495.226   28.332  111.421   2.7125  109.778   3.1695 1.643265 4.171732 
1 1 1   18    2   46 o   83.461   2.2282  285.191   15.145  258.461   20.073  320.522   23.077   79.278   3.1122   88.272   3.2125 -8.994324 4.472820 
1 1 1   18    2   47 o   37.576   3.2646   58.466   9.9004   55.397   15.427   60.615   12.910   36.075   5.4129   38.067   4.2318 -1.992668 6.870747 
1 1 1   18    2   48 o   45.193   2.7362   84.065   10.033   80.619   15.627   86.481   13.085   43.904   4.4269   45.691   3.5409 -1.787037 5.668861 
1 1 1   18    2   49 o   48.566   2.7637   97.085   10.896  126.227   19.202   83.247   13.232   55.041   4.3143   44.788   3.6562 10.25378 5.655149 
1 1 1   18    2   50 o   23.752   4.7132   24.248   8.8033   25.967   13.395   22.941   11.680   24.343   6.5902   22.929   6.1307 1.414267 9.000936 
1 1 1   18    2   51 o   80.788   2.2240  267.499   14.632  257.634   21.747  275.658   19.778   78.994   3.3851   81.835   2.9699 -2.840942 4.503232 
1 1 1   18    2   52 o   64.052   2.5005  168.543   13.031  191.629   20.062  151.696   17.138   68.014   3.6317   60.532   3.4880 7.482407 5.035416 
1 1 1   18    2   53 o   79.699   2.2168  260.470   14.388  275.211   21.614  248.740   19.281   81.641   3.2543   77.670   3.0512 3.970657 4.460993 
1 1 1   18    2   54 o   29.753   3.7240   37.194   8.8347   29.536   13.467   42.981   11.706   25.825   6.4236   31.771   4.6583 -5.945461 7.934909 
1 1 1   18    2   55 o   35.486   3.2131   52.375   9.1937   66.266   14.119   42.150   12.114   39.620   4.4487   31.365   4.8979 8.254169 6.616663 
1 1 1   18    2   56 o   48.779   2.5485   98.049   10.098   91.531   15.176  103.228   13.528   46.744   4.0221   49.861   3.3479 -3.117043 5.233099 
1 1 1   18    2   57 o   58.797   2.2336  142.057   10.686  152.014   16.046  134.123   14.324   60.551   3.2629   56.914   3.0992 3.637115 4.500174 
1 1 1   18    2   58 o   49.501   2.5195  101.028   10.133   96.747   15.614  104.144   13.319   48.011   4.0266   50.063   3.2818 -2.051464 5.194585 
1 1 1   18    2   59 o   96.131   2.0617  379.062   16.156  368.964   21.295  392.759   24.800   94.563   2.7656   97.402   3.1276 -2.839264 4.174922 
1 1 1   18    2   60 o   60.396   2.1944  150.001   10.786  130.296   16.280  165.416   14.399   55.861   3.5943   63.254   2.7995 -7.392780 4.555918 
1 1 1   18    2   61 o   41.837   2.8045   72.597   9.5093   84.685   14.750   63.998   12.440   44.787   4.0850   38.924   3.9764 5.862461 5.700826 
1 1 1   18    2   62 o   36.105   3.1712   54.470   9.2383   70.762   14.405   43.087   12.041   40.758   4.4056   31.548   4.8361 9.210131 6.541986 
1 1 1   18    2   63 o   15.976   5.4581   10.341   8.5362   5.9438   13.595   13.203   10.967   16.126   6.5701   17.934   6.1847 -1.808769 9.023109 
1 1 1   18    2   64 o   37.736   2.9878   59.406   9.1156   64.475   14.075   55.744   11.964   38.764   4.5404   36.169   4.1317 2.594078 6.138960 
1 1 1   18    2   65 o   45.322   2.6431   85.189   9.7221   93.888   15.013   78.906   12.759   47.102   3.9464   43.273   3.6511 3.829048 5.376286 
1 1 1   18    2   66 o   34.327   3.2506   49.517   8.9873   46.050   13.447   52.315   12.082   32.316   5.2876   34.896   4.3411 -2.580132 6.841297 
1 1 1   18    2   67 o   54.536   2.9504  123.926   13.067  121.260   19.937  125.933   17.301   53.096   4.6535   54.528   3.9185 -1.432331 6.083553 
1 1 1   18    2   68 o   14.518   6.3372  -0.2443   14.157 -12.2102   17.291   24.084   24.656   13.642   6.3586   23.754   9.1011 -10.11191 11.10231 
1 1 1   18    2   69 o   29.185   6.3298   39.296   14.624   52.865   18.415   16.127   24.064   33.606   6.9518   21.599   8.7627 12.00742 11.18537 
1 1 1   18    2   70 o   43.224   3.0880   78.373   10.809   76.674   14.541   80.472   16.158   42.206   4.2860   43.033   4.6818 -0.8268776 6.347307 
1 1 1   18    2   71 o   12.156   5.2161   0.6682   9.2672   2.8568   12.891  -1.6729   13.332   14.659   6.2165   13.688   6.0560 0.9701166 8.678722 
1 1 1   18    2   72 o   24.129   4.3969   25.652   8.3295   31.035   13.265   22.147   10.703   25.725   6.3619   21.893   5.8752 3.831509 8.659777 
1 1 1   18    2   73 o   16.617   5.4234   12.047   8.4430   9.1777   13.281   13.994   10.938   16.699   6.5988   17.961   6.1770 -1.261997 9.038816 
1 1 1   18    2   74 o   46.202   2.5911   88.977   9.7193  105.531   15.365   77.936   12.549   49.702   3.8219   42.771   3.6336 6.930656 5.273551 
1 1 1   18    2   75 o   48.428   2.5109   97.672   9.8781  105.579   15.715   92.507   12.701   49.615   3.9174   46.737   3.3561 2.877987 5.158480 
1 1 1   18    2   76 o   16.990   5.3058   12.945   8.1505   21.198   12.577   6.9699   10.701   21.165   6.5882   14.922   5.9149 6.242605 8.853860 
1 1 1   18    2   77 o   44.257   2.5698   81.840   9.2311   80.346   13.590   83.121   12.578   43.168   3.9042   44.132   3.5257 -0.9640808 5.260544 
1 1 1   18    2   78 o   27.931   3.7889   33.896   8.4040   31.287   12.545   36.021   11.320   25.652   6.0906   28.133   5.1250 -2.480112 7.959928 
1 1 1   18    2   79 o   38.611   2.8466   62.891   8.8962   71.220   13.142   55.845   12.086   40.432   4.0416   35.647   4.2426 4.785034 5.859473 
1 1 1   18    2   80 o   28.761   3.9909   36.351   9.1047   24.136   14.820   43.756   11.539   21.977   7.1862   31.200   4.6813 -9.223127 8.576532 
1 1 1   18    2   81 o   16.504   5.4014   12.410   8.3717   5.0652   13.165   17.397   10.847   14.963   6.3108   19.083   6.1410 -4.120577 8.805607 
1 1 1   18    2   82 o   30.562   3.7599   40.912   9.1697   55.440   14.144   30.380   12.043   34.661   5.1635   24.983   5.9911 9.677942 7.909146 
1 1 1   18    2   83 o   51.488   2.5846  111.662   10.813  104.350   15.110  119.337   15.480   48.842   3.8258   52.408   3.6464 -3.566669 5.285156 
1 1 1   18    2   84 o   27.170   4.9952   34.475   10.656   44.579   13.811   19.615   16.749   30.354   5.7930   19.814   7.5230 10.54014 9.494933 
1 1 1   18    2   85 o   25.148   3.9825   28.388   7.8921   29.810   10.119   26.181   12.609   25.070   5.1250   22.538   6.5039 2.532104 8.280437 
1 1 1   18    2   86 o   10.807   4.6547   1.0226   7.4319  -5.5502   9.3173   12.519   12.322   10.118   4.6995   16.728   6.4276 -6.609732 7.962391 
1 1 1   18    2   87 o   13.006   4.6777   7.1574   6.3227   10.511   9.3396   4.3197   8.5906   15.329   5.6587   12.553   5.1804 2.776263 7.671842 
1 1 1   18    2   88 o   11.863   4.5306   5.2677   6.0970   11.162   9.0589   0.3868   8.2435   15.504   5.5961   10.976   4.8124 4.528228 7.380756 
1 1 1   18    2   89 o   7.5626   3.6512  -9.0567   6.7823  -5.1260   9.0247 -14.1579   10.281   9.9221   4.6141   9.0291   4.3911 0.8929510 6.369637 
1 1 1   18    2   90 o   17.176   5.3306   14.697   8.2408   15.702   9.5758   11.828   16.181   17.562   5.7783   16.687   7.0149 0.8750877 9.088297 
1 1 1   18    2   91 o   15.089   5.3063   10.841   8.0941   8.2919   9.4957   17.616   15.479   14.186   5.5877   18.183   7.1427 -3.997089 9.068722 
1 1 1   18    2   92 o   13.807   5.2353   8.2372   8.1048   12.131   9.3488  -3.5413   16.261   15.775   5.6861   13.355   6.2047 2.420213 8.416049 
1 1 1   18    2   93 o   19.224   5.1909   18.585   8.3235   18.265   9.7375   19.450   16.039   18.683   5.7938   18.620   7.2836 0.6343079E-01 9.306989 
1 1 1   18    2   94 o   31.730   3.5250   45.144   8.9638   38.988   10.434   62.492   17.515   28.562   4.6406   34.005   6.5562 -5.443771 8.032410 
1 1 1   18    2   95 o   26.851   6.6713   40.274   14.537   44.944   18.108   31.808   24.381   26.822   7.8100   21.056   8.7118 5.765835 11.70005 
1 1 1   18    2   96 o   13.863   6.3749   0.0084   16.529  -6.8325   23.905   6.2750   22.879   14.720   7.0408   16.233   7.4776 -1.513126 10.27069 
1 1 1   18    2   97 o   18.128   7.2772   18.871   16.404   34.136   23.744   4.9323   22.689   21.460   8.7050   15.931   7.3767 5.528410 11.41020 
1 1 1   18    2   98 o   13.575   6.2433  -0.0348   15.862   8.7791   22.590  -8.6050   22.276   16.424   7.5153   14.037   6.7361 2.386740 10.09229 
1 1 1   18    2   99 o   27.184   7.6892   46.565   17.797   34.456   25.539   57.996   24.814   21.022   8.8235   27.204   9.3056 -6.182747 12.82375 
1 1 1   18    2  100 o   24.655   7.7243   39.431   17.260   15.909   24.636   62.105   24.188   17.595   7.9717   28.689   9.1640 -11.09388 12.14607 
1 1 1   18    2  101 o   16.415   6.9517   13.608   16.081   36.593   23.024  -8.2874   22.471   21.690   8.6504   13.961   6.7166 7.728990 10.95183 
1 1 1   18    2  102 o   11.441   5.5306 -12.7256   15.682 -14.3543   22.352 -11.1467   22.008   13.248   6.4500   13.493   6.5295 -0.2447081 9.178042 
1 1 1   18    2  103 o   16.162   6.9004   12.974   16.069  -1.8119   22.362   28.762   23.107   14.612   6.9386   19.700   8.3374 -5.087889 10.84696 
1 1 1   18    2  104 o   14.413   6.4884   5.2034   16.017   14.481   22.935  -3.6285   22.377   17.025   7.7046   14.396   6.8656 2.628618 10.31976 
1 1 1   18    3 -102 o   18.608   8.3001   23.698   25.561   23.698   25.561   0.0000   0.0000   18.608   8.3001  ?   ?  0.000000 8.300071 
1 1 1   18    3 -101 o   18.328   8.2225   22.371   25.480   22.371   25.480   0.0000   0.0000   18.328   8.2225  ?   ?  0.000000 8.222542 
1 1 1   18    3 -100 o   20.558   8.7968   35.289   26.221   35.289   26.221   0.0000   0.0000   20.558   8.7968  ?   ?  0.000000 8.796849 
1 1 1   18    3  -99 o   28.143   9.7724   68.383   27.402   68.383   27.402   0.0000   0.0000   28.143   9.7724  ?   ?  0.000000 9.772391 
1 1 1   18    3  -98 o   11.586   5.8250 -44.0285   24.597 -44.0285   24.597   0.0000   0.0000   11.586   5.8250  ?   ?  0.000000 5.825003 
1 1 1   18    3  -97 o   18.223   7.6081   20.306   18.836  -2.2911   25.755   46.290   27.617   15.290   7.3121   22.942   9.3577 -7.651711 11.87580 
1 1 1   18    3  -96 o   17.499   7.4682   17.004   18.810   36.036   25.896  -4.2518   27.366   21.224   8.8951   15.399   7.4093 5.825074 11.57675 
1 1 1   18    3  -95 o   14.773   6.7829   3.0097   18.616  -3.7851   25.304   11.027   27.486   15.173   7.2538   17.233   8.0271 -2.060145 10.81905 
1 1 1   18    3  -94 o   18.652   7.3188   20.765   16.236   36.277   20.086  -8.4754   27.578   22.744   8.3148   15.162   7.3307 7.581956 11.08492 
1 1 1   18    3  -93 o   22.208   7.4413   30.689   15.863   45.880   20.397   7.4384   25.234   25.874   8.4285   16.681   7.7430 9.193348 11.44529 
1 1 1   18    3  -92 o   15.955   6.7127   11.262   14.837   38.046   18.459 -37.6272   24.939   24.058   8.0264   12.287   6.1310 11.77119 10.10017 
1 1 1   18    3  -91 o   21.732   6.6321   26.740   12.822   27.201   18.714   26.332   17.602   20.600   7.9198   20.485   7.7269 0.1150188 11.06472 
1 1 1   18    3  -90 o   13.219   5.8665   2.3104   12.606   15.407   18.251  -9.6390   17.433   17.561   7.4199   12.751   6.0751 4.809896 9.589693 
1 1 1   18    3  -89 o   11.710   5.4494  -4.9005   12.623  -4.8016   18.051  -4.9952   17.657   13.690   6.4183   13.540   6.3479 0.1499357 9.027214 
1 1 1   18    3  -88 o   13.491   5.9111   3.3798   12.419   4.1244   18.133   2.7220   17.043   15.259   6.8834   14.723   6.6544 0.5362158 9.574065 
1 1 1   18    3  -87 o   12.977   5.9747  -2.6834   14.582   5.0378   26.771  -5.9409   17.389   17.108   7.9528   13.398   6.2871 3.710197 10.13781 
1 1 1   18    3  -86 o   28.699   5.9809   42.185   13.537   55.769   19.331   29.110   18.964   31.018   7.6850   21.714   8.0547 9.304449 11.13274 
1 1 1   18    3  -85 o   17.164   6.5200   14.396   12.585   5.6983   17.789   23.111   17.806   15.753   6.9810   20.166   7.7322 -4.413386 10.41736 
1 1 1   18    3  -84 o   21.571   6.5981   24.804   12.681   7.0564   17.652   43.729   18.229   16.138   7.0597   27.524   7.7806 -11.38643 10.50606 
1 1 1   18    3  -83 o   10.658   5.0664 -10.4281   11.984 -20.4541   16.599   0.4866   17.319   11.438   5.5663   14.839   6.7074 -3.401741 8.716290 
1 1 1   18    3  -82 o   15.025   6.1393   7.7635   11.912   1.0787   16.896   14.371   16.797   14.913   6.6926   18.049   7.3217 -3.136614 9.919597 
1 1 1   18    3  -81 o   9.1732   4.3757  -9.6752   9.1007   3.9424   16.030 -16.1515   11.055   15.332   6.7169   9.3256   4.5394 6.006631 8.107013 
1 1 1   18    3  -80 o   11.657   5.1820  -0.9575   9.8786 -10.6680   16.284   4.6967   12.426   12.765   6.0193   14.386   6.1024 -1.621434 8.571501 
1 1 1   18    3  -79 o   12.341   5.2601   2.1769   9.3097  -2.0887   16.311   4.2379   11.338   14.332   6.4907   13.903   5.8599 0.4286814 8.744527 
1 1 1   18    3  -78 o   22.367   4.3728   22.660   7.6867   17.879   10.022   29.492   11.980   19.295   5.8584   24.621   6.0202 -5.326525 8.400208 
1 1 1   18    3  -77 o   24.663   3.7964   26.740   7.3877   21.282   9.4932   35.122   11.764   21.204   5.4597   27.381   5.4623 -6.177174 7.723009 
1 1 1   18    3  -76 o   39.189   2.5920   64.477   8.2336   62.992   10.836   66.506   12.665   38.272   3.5125   39.013   4.0410 -0.7402229 5.354160 
1 1 1   18    3  -75 o   49.408   2.3755  101.779   9.5392   98.297   13.224  105.557   13.774   47.993   3.4022   49.730   3.4187 -1.737225 4.823115 
1 1 1   18    3  -74 o   10.869   4.7112   0.0194   7.7093   5.0417   10.421  -6.0517   11.458   14.049   5.7415   11.538   5.3063 2.511297 7.817995 
1 1 1   18    3  -73 o   10.342   4.5855  -1.6005   7.6853 -12.5989   10.271   12.391   11.584   9.5852   4.5929   17.243   6.3128 -7.657934 7.806787 
1 1 1   18    3  -72 o   32.250   3.3328   44.303   8.6356   41.152   12.004   47.683   12.432   30.262   5.0437   32.755   4.7986 -2.493082 6.961712 
1 1 1   18    3  -71 o   82.039   1.8819  277.289   12.585  262.236   17.617  292.977   17.985   79.268   2.7305   83.858   2.6343 -4.589767 3.794140 
1 1 1   18    3  -70 o   11.944   5.0138   1.9269   8.2482   3.0865   11.797   0.8181   11.536   14.154   5.9721   13.370   5.7792 0.7837219 8.310521 
1 1 1   18    3  -69 o   26.884   3.8608   31.254   8.2183   28.332   11.129   34.759   12.188   24.834   5.6281   27.580   5.6125 -2.745586 7.948367 
1 1 1   18    3  -68 o   17.989   5.0335   14.566   7.6699   9.5130   10.260   20.967   11.548   15.872   5.9174   21.246   6.2510 -5.374231 8.607574 
1 1 1   18    3  -67 o   22.350   4.4122   22.076   7.7530   27.294   10.396   15.538   11.637   24.536   5.3492   18.797   6.3737 5.738958 8.320976 
1 1 1   18    3  -66 o   57.221   2.1798  135.290   10.149  126.786   14.400  143.681   14.306   54.946   3.2293   58.618   3.0039 -3.671814 4.410484 
1 1 1   18    3  -65 o   43.023   3.0453   77.552   10.611   77.184   18.417   77.736   12.982   41.652   5.5633   42.773   3.7618 -1.121197 6.715752 
1 1 1   18    3  -64 o   50.888   2.9795  108.141   12.305   95.861   18.835  117.286   16.253   46.888   5.0053   52.606   3.8162 -5.718346 6.294129 
1 1 1   18    3  -63 o   41.138   3.2086   71.004   10.675   87.206   15.347   55.820   14.857   45.169   4.2169   35.573   5.2839 9.596031 6.760337 
1 1 1   18    3  -62 o   27.715   3.9157   32.926   8.6001   48.402   10.907   7.4865   13.984   33.641   4.0592   16.637   6.7049 17.00412 7.837925 
1 1 1   18    3  -61 f   9.0636   4.2122  -6.1297   7.5024  -3.8660   10.137  -8.8713   11.156   11.485   5.1668   10.995   5.1188 0.4905128 7.273088 
1 1 1   18    3  -60 o   60.312   2.0261  149.656   9.9467  127.466   13.196  178.847   15.136   55.368   2.9343   65.651   2.8349 -10.28294 4.080099 
1 1 1   18    3  -59 o   56.885   1.8774  132.932   8.6934  118.566   12.959  144.688   11.722   53.395   2.9893   59.193   2.4347 -5.798538 3.855345 
1 1 1   18    3  -58 o   11.481   4.6837   2.4376   6.9197  -2.0702   10.641   5.7404   9.1085   12.309   5.4297   14.078   5.4942 -1.768953 7.724500 
1 1 1   18    3  -57 o   39.190   2.6376   63.643   8.3769   62.839   12.172   64.365   11.546   38.560   3.9273   39.119   3.6633 -0.5588112 5.370646 
1 1 1   18    3  -56 o   53.411   2.0883  117.298   9.0743   95.611   12.718  139.786   12.951   47.896   3.2772   58.135   2.7407 -10.23812 4.272177 
1 1 1   18    3  -55 o   25.586   3.8566   27.875   7.7936   25.052   11.300   30.435   10.763   23.700   5.8778   26.354   5.1951 -2.653643 7.844639 
1 1 1   18    3  -54 o   58.925   2.0007  142.536   9.5961  140.402   13.546  144.686   13.596   58.264   2.8610   59.158   2.8276 -0.8941994 4.022479 
1 1 1   18    3  -53 o   31.957   3.0846   42.571   7.9356   44.346   11.595   41.007   10.884   32.222   4.5402   30.997   4.4338 1.225578 6.345999 
1 1 1   18    3  -52 o   68.136   2.0174  190.446   11.192  194.600   14.451  184.218   17.694   68.735   2.5838   66.664   3.2660 2.071030 4.164434 
1 1 1   18    3  -51 o   45.895   2.4225   86.747   9.0310   80.865   12.195   93.890   13.438   44.079   3.4209   47.494   3.4956 -3.415501 4.891020 
1 1 1   18    3  -50 o   17.309   5.3656   12.666   8.3522   5.1549   10.976   22.999   12.873   14.890   5.9612   22.843   6.5654 -7.953013 8.867921 
1 1 1   18    3  -49 o   13.553   4.9761   6.2851   7.2061   13.956   11.080   0.6626   9.4863   18.529   6.2193   12.546   5.3273 5.982169 8.188981 
1 1 1   18    3  -48 o   60.852   1.9308  151.711   9.5653  140.883   14.824  159.435   12.520   58.391   3.1259   62.282   2.4711 -3.890980 3.984669 
1 1 1   18    3  -47 o   13.468   5.0750   5.7004   7.5889   0.8612   12.121   8.8201   9.7324   14.147   6.0149   15.845   5.7885 -1.698257 8.347849 
1 1 1   18    3  -46 o   55.333   2.3113  125.687   10.402  131.594   15.020  120.241   14.420   56.419   3.2800   53.918   3.2967 2.500896 4.650439 
1 1 1   18    3  -45 o   32.624   3.3718   44.311   8.8376   38.583   12.214   50.607   12.804   29.980   5.1854   34.581   4.6607 -4.601225 6.972150 
1 1 1   18    3  -44 o   65.053   2.0333  173.312   10.769  160.921   14.669  187.796   15.860   62.528   2.8858   67.558   2.8866 -5.029644 4.081736 
1 1 1   18    3  -43 o   56.575   2.2365  131.236   10.294  129.419   14.249  133.220   14.887   56.020   3.1328   56.819   3.2274 -0.7990990 4.497838 
1 1 1   18    3  -42 o   24.200   4.1665   24.880   7.9226   23.712   12.461   25.672   10.264   23.335   6.3726   24.353   5.3198 -1.018837 8.301175 
1 1 1   18    3  -41 o   31.470   3.4846   41.250   8.7893   41.879   12.971   40.716   11.952   31.300   5.2707   30.946   4.9010 0.3542557 7.197268 
1 1 1   18    3  -40 o  134.137   1.6600  734.947   18.150  758.208   29.605  720.939   22.974  136.007   2.6704  132.760   2.1229 3.246811 3.411401 
1 1 1   18    3  -39 o   73.575   1.8623  221.357   11.160  204.846   16.981  233.910   14.807   70.597   2.9574   75.551   2.4074 -4.953964 3.813365 
1 1 1   18    3  -38 o   70.954   1.9596  205.928   11.323  204.374   17.478  207.051   14.864   70.506   3.0483   71.056   2.5705 -0.5493927 3.987487 
1 1 1   18    3  -37 o  170.111   1.7723  1182.06   24.576  1143.69   39.494  1206.31   31.394  167.014   2.9010  171.731   2.2426 -4.717255 3.666741 
1 1 1   18    3  -36 o  147.800   1.7316  892.169   20.863  930.575   34.378  869.780   26.248  150.698   2.7986  145.840   2.2080 4.858276 3.564710 
1 1 1   18    3  -35 o   46.522   2.7329   88.946   10.318  103.521   16.424   79.443   13.262   49.965   4.0676   43.790   3.7514 6.174953 5.533375 
1 1 1   18    3  -34 o   19.918   6.1097   16.613   10.863   38.299   13.483 -23.5121   18.340   29.864   5.7472   13.005   6.2058 16.85935 8.458302 
1 1 1   18    3  -33 o   13.463   5.2857   4.4569   8.4730 -16.0273   12.847   20.226   11.272   11.003   5.2344   21.723   6.1107 -10.72034 8.046079 
1 1 1   18    3  -32 o  109.329   1.7169  488.025   15.300  526.703   25.956  467.426   18.941  113.411   2.8076  106.940   2.1729 6.471367 3.550225 
1 1 1   18    3  -31 o   92.414   1.7949  348.734   13.521  351.960   22.633  346.943   16.861   92.638   3.0012   92.128   2.2452 0.5097122 3.748048 
1 1 1   18    3  -30 o   70.635   1.9976  203.973   11.490  187.410   19.523  212.750   14.212   67.476   3.5621   72.089   2.4219 -4.613121 4.307478 
1 1 1   18    3  -29 o   58.327   2.1950  139.222   10.418  150.551   17.969  133.486   12.786   60.445   3.6642   57.044   2.7579 3.401344 4.586102 
1 1 1   18    3  -28 o   91.518   1.6268  341.849   12.136  333.010   18.152  348.993   16.320   90.210   2.4708   92.418   2.1664 -2.208694 3.286070 
1 1 1   18    3  -27 o   69.615   2.0282  198.117   11.497  200.706   16.960  195.915   15.640   69.948   2.9812   69.136   2.7809 0.8124008 4.076897 
1 1 1   18    3  -26 o   25.324   4.4338   27.151   8.8195   31.294   12.980   23.597   12.021   26.941   6.0578   23.416   6.2007 3.525507 8.668599 
1 1 1   18    3  -25 o   30.774   3.6027   39.371   8.8668   32.727   12.992   45.165   12.132   27.580   5.9534   32.792   4.6704 -5.211678 7.566693 
1 1 1   18    3  -24 o   78.818   1.8568  253.625   11.929  245.198   16.762  262.274   16.981   77.383   2.6613   80.043   2.6061 -2.659798 3.724803 
1 1 1   18    3  -23 o   26.824   4.4609   30.376   9.4115   12.540   18.793   36.347   10.873   20.690   7.9410   29.352   4.7033 -8.661648 9.229322 
1 1 1   18    3  -22 o  117.010   1.7799  558.861   16.977  547.662   31.868  563.299   20.060  115.557   3.3868  117.440   2.0955 -1.883339 3.982646 
1 1 1   18    3  -21 o   34.797   3.9004   50.307   10.873   42.591   20.198   53.456   12.902   31.279   7.9161   35.769   4.5262 -4.490492 9.118738 
1 1 1   18    3  -20 o   94.874   2.0491  367.568   15.847  406.273   28.230  349.760   19.149   99.504   3.4859   92.465   2.5429 7.039001 4.314851 
1 1 1   18    3  -19 o   72.545   2.0847  215.090   12.315  213.011   24.070  215.827   14.333   71.903   4.1239   72.634   2.4242 -0.7301483 4.783652 
1 1 1   18    3  -18 o  101.059   1.5865  416.719   13.069  409.416   19.436  422.748   17.658  100.100   2.3819  101.742   2.1291 -1.642441 3.194802 
1 1 1   18    3  -17 f   43.067   2.5858   76.088   9.0358   76.796   14.010   75.584   11.824   43.070   4.0376   42.821   3.4156 0.2489281 5.288561 
1 1 1   18    3  -16 o  107.693   1.5917  473.215   13.973  452.554   20.558  490.956   19.050  105.243   2.3964  109.646   2.1314 -4.402687 3.207087 
1 1 1   18    3  -15 o  120.379   1.5571  591.227   15.279  580.407   22.612  600.317   20.727  119.196   2.3273  121.249   2.0971 -2.053520 3.132725 
1 1 1   18    3  -14 o   74.989   1.8045  229.509   11.030  237.159   16.855  223.779   14.588   76.114   2.7210   73.967   2.4228 2.146919 3.643320 
1 1 1   18    3  -13 o   52.362   2.5511  112.317   10.856  106.854   15.075  118.204   15.647   50.931   3.6554   53.588   3.6029 -2.657436 5.132514 
1 1 1   18    3  -12 o  166.671   1.7207  1133.60   23.378  1113.21   31.298  1159.33   35.161  165.081   2.3259  168.426   2.5611 -3.344849 3.459594 
1 1 1   18    3  -11 o  175.124   1.9931  1252.01   28.452  1246.38   44.556  1255.89   36.970  174.519   3.1321  175.296   2.5873 -0.7775116 4.062498 
1 1 1   18    3  -10 o   82.211   1.8380  275.847   12.317  273.507   19.653  277.360   15.807   81.719   2.9552   82.366   2.3567 -0.6469955 3.779861 
1 1 1   18    3   -9 o  193.314   1.7511  1525.03   27.593  1490.40   42.196  1550.90   36.472  190.940   2.7110  194.859   2.2962 -3.919800 3.552772 
1 1 1   18    3   -8 o  169.724   1.6842  1175.43   23.301  1190.47   36.368  1164.95   30.348  170.668   2.6142  168.897   2.2043 1.771194 3.419499 
1 1 1   18    3   -7 o  178.960   1.7040  1306.87   24.858  1304.40   38.622  1308.61   32.480  178.642   2.6522  179.006   2.2259 -0.3636780 3.462515 
1 1 1   18    3   -6 o  109.516   1.6657  489.385   14.870  499.153   23.609  482.962   19.145  110.513   2.6207  108.754   2.1596 1.758911 3.395888 
1 1 1   18    3   -5 o  121.116   1.6405  598.521   16.196  590.017   25.309  604.419   21.076  120.156   2.5840  121.667   2.1251 -1.510483 3.345603 
1 1 1   18    3   -4 o   72.996   1.9221  217.646   11.427  221.680   18.492  215.154   14.534   73.545   3.0914   72.526   2.4619 1.018257 3.951964 
1 1 1   18    3   -3 o  123.826   1.6422  625.602   16.576  634.368   26.117  619.690   21.450  124.593   2.5716  123.194   2.1360 1.399437 3.342957 
1 1 1   18    3   -2 f  121.768   1.6460  604.984   16.338  578.638   25.379  623.630   21.350  118.989   2.6165  123.587   2.1193 -4.597374 3.367178 
1 1 1   18    3   -1 o   30.744   3.6923   39.279   9.0682   45.853   14.787   35.317   11.480   32.870   5.7268   28.880   5.0610 3.989733 7.642623 
1 1 1   18    3    0 f   38.767   2.9790   61.830   9.3417   83.061   15.383   49.425   11.758   44.783   4.2653   34.439   4.2806 10.34402 6.042861 
1 1 1   18    3    1 o   61.484   2.1563  154.550   10.790  144.328   17.321  161.033   13.794   59.247   3.6035   62.708   2.7049 -3.461445 4.505722 
1 1 1   18    3    2 f  200.203   1.7779  1635.67   29.015  1655.25   45.219  1621.97   37.829  201.220   2.7569  199.273   2.3288 1.946960 3.608849 
1 1 1   18    3    3 o   94.910   1.8767  367.654   14.519  373.452   21.339  362.656   19.811   95.540   2.7429   94.168   2.5833 1.371872 3.767895 
1 1 1   18    3    4 o   20.765   5.5552   18.406   9.5868   34.444   14.921   7.1312   12.511   28.273   6.5956   16.557   6.4455 11.71551 9.222070 
1 1 1   18    3    5 o   83.881   2.1137  287.466   14.441  270.406   19.583  307.797   21.379   81.256   2.9616   86.690   3.0301 -5.433601 4.236995 
1 1 1   18    3    6 o   47.768   2.8993   93.656   11.236   95.680   16.076   91.722   15.711   48.111   4.1395   47.099   4.1339 1.012016 5.850188 
1 1 1   18    3    7 o   72.255   2.2545  213.433   13.263  205.878   18.214  221.960   19.350   70.859   3.1612   73.570   3.2345 -2.710770 4.522768 
1 1 1   18    3    8 o  174.115   2.0265  1237.67   28.761  1065.09   44.403  1362.42   37.751  161.281   3.3775  182.593   2.5364 -21.31181 4.223800 
1 1 1   18    3    9 o  159.067   1.9694  1032.89   25.536  1053.46   42.439  1021.22   31.972  160.425   3.2453  158.092   2.4810 2.333298 4.085016 
1 1 1   18    3   10 o   45.083   3.0554   83.533   11.162   72.618   19.518   88.837   13.606   41.510   5.9371   46.423   3.6243 -4.912491 6.955973 
1 1 1   18    3   11 o   81.752   2.1173  273.088   14.098  249.734   23.830  285.663   17.487   77.960   3.7610   83.566   2.5701 -5.605202 4.555308 
1 1 1   18    3   12 o   71.694   2.0835  210.048   12.163  208.173   18.372  211.511   16.229   71.249   3.1713   71.870   2.7753 -0.6211700 4.214248 
1 1 1   18    3   13 o   61.120   2.2702  152.796   11.291  151.706   17.485  153.575   14.788   60.748   3.5465   61.199   2.9731 -0.4518623 4.627851 
1 1 1   18    3   14 o   94.893   1.8746  367.551   14.500  364.639   21.822  369.853   19.402   94.383   2.8397   95.101   2.5050 -0.7181091 3.786659 
1 1 1   18    3   15 o  109.161   1.8046  486.347   16.058  505.449   23.925  470.687   21.662  111.196   2.6396  107.324   2.4761 3.872719 3.619188 
1 1 1   18    3   16 o  129.761   1.7741  687.201   18.765  704.978   28.047  672.794   25.250  131.323   2.6200  128.319   2.4140 3.003967 3.562552 
1 1 1   18    3   17 f   83.935   1.9510  287.620   13.348  297.135   20.502  280.619   17.586   85.170   2.9576   82.813   2.6085 2.357269 3.943532 
1 1 1   18    3   18 o   91.379   1.8814  340.861   14.014  352.720   21.339  331.866   18.584   92.821   2.8236   90.072   2.5336 2.748978 3.793653 
1 1 1   18    3   19 o   28.860   4.2151   34.922   9.6236   33.002   15.304   36.177   12.377   27.631   6.8333   29.153   5.4074 -1.521488 8.714030 
1 1 1   18    3   20 o   29.984   4.6262   37.839   10.944   43.863   15.496   31.845   15.457   32.013   6.1620   27.143   6.9552 4.869762 9.292200 
1 1 1   18    3   21 o   71.552   2.6599  209.639   15.487  236.524   24.802  192.457   19.827   75.789   4.0291   68.423   3.5672 7.365189 5.381298 
1 1 1   18    3   22 o  125.345   1.9739  641.538   20.168  625.648   26.762  662.424   30.682  123.691   2.6543  127.223   2.9586 -3.532158 3.974715 
1 1 1   18    3   23 o   28.288   4.8146   33.866   10.705   44.902   15.566   23.963   14.745   32.394   6.1189   23.788   7.0800 8.606424 9.357778 
1 1 1   18    3   24 o   43.545   3.3423   78.156   11.773   80.473   21.782   77.199   13.993   43.586   6.3145   43.168   4.0230 0.4183731 7.487124 
1 1 1   18    3   25 o   80.750   2.1725  266.583   14.287  311.311   25.862  246.938   17.140   87.030   3.6536   77.647   2.7121 9.382347 4.550229 
1 1 1   18    3   26 o  131.729   1.9811  708.664   21.273  719.042   35.875  703.036   26.419  132.407   3.3265  131.131   2.4716 1.275513 4.144223 
1 1 1   18    3   27 o   39.994   4.7379   66.847   15.146   55.001   20.529   80.998   22.438   35.627   7.3142   43.653   6.5040 -8.026272 9.787685 
1 1 1   18    3   28 o   66.380   2.5088  180.454   13.551  169.788   18.153  193.875   20.364   64.242   3.4795   68.629   3.6534 -4.386543 5.045229 
1 1 1   18    3   29 o   60.232   2.6552  148.724   13.004  173.882   17.640  118.772   19.247   65.033   3.3387   53.512   4.4528 11.52089 5.565430 
1 1 1   18    3   30 o   81.142   2.2709  269.341   15.006  287.952   20.349  247.159   22.216   83.790   2.9841   77.522   3.5248 6.268333 4.618316 
1 1 1   18    3   31 o  114.060   1.8233  531.264   16.953  522.713   25.014  538.528   23.055  113.006   2.7155  114.746   2.4648 -1.739822 3.667324 
1 1 1   18    3   32 o   98.783   1.9238  398.594   15.491  402.434   23.117  395.465   20.869   99.083   2.8652   98.269   2.6076 0.8140030 3.874155 
1 1 1   18    3   33 o   57.523   2.6917  135.758   12.586  135.940   21.745  135.667   15.435   57.178   4.7071   57.407   3.3124 -0.2292137 5.755762 
1 1 1   18    3   34 o   80.457   2.0813  264.740   13.638  282.179   20.868  251.738   18.019   82.897   3.0936   78.341   2.8263 4.556335 4.190279 
1 1 1   18    3   35 o   39.108   3.5465   63.356   11.183   69.737   17.254   58.734   14.685   40.657   5.3348   37.353   4.9442 3.304279 7.273623 
1 1 1   18    3   36 o   29.902   4.5893   37.783   10.829   57.214   17.017   24.558   14.039   36.602   5.9043   23.868   6.8551 12.73402 9.047276 
1 1 1   18    3   37 o  111.244   2.0315  505.868   18.422  516.348   30.276  499.707   23.214  112.069   3.3178  110.466   2.5780 1.603195 4.201654 
1 1 1   18    3   38 o   14.627   5.7711   5.2087   10.144   16.557   16.014  -2.3966   13.109   20.996   7.4563   13.903   6.0828 7.093103 9.622733 
1 1 1   18    3   39 o   54.698   2.5521  122.811   11.348  127.372   17.738  119.652   14.764   55.437   3.9511   53.843   3.3809 1.593063 5.200205 
1 1 1   18    3   40 o   24.442   5.0686   25.724   9.7670   17.247   15.517   31.286   12.569   21.090   7.3521   26.839   5.9058 -5.748758 9.430345 
1 1 1   18    3   41 o   73.471   2.0823  220.968   12.458  231.223   19.134  213.423   16.413   74.952   3.1387   72.077   2.7989 2.875053 4.205425 
1 1 1   18    3   42 o  124.492   2.2164  634.321   22.492  633.034   32.162  635.553   31.466  124.050   3.1833  124.363   3.1039 -0.3125763 4.446077 
1 1 1   18    3   43 o   66.598   2.2824  181.824   12.372  202.253   20.813  170.660   15.386   69.934   3.6637   64.395   2.9388 5.538452 4.696762 
1 1 1   18    3   44 o  113.090   1.9188  523.046   17.688  563.608   29.802  500.986   21.978  117.021   3.1271  110.563   2.4386 6.458458 3.965525 
1 1 1   18    3   45 o   94.118   1.9611  362.394   15.045  402.253   25.444  340.964   18.656   98.813   3.1629   91.149   2.5134 7.664413 4.039933 
1 1 1   18    3   46 o   22.518   5.5584   22.137   10.140   19.679   16.550   23.614   12.830   22.074   7.5980   23.223   6.5147 -1.149084 10.00853 
1 1 1   18    3   47 o   52.359   3.0337  113.208   12.892  154.593   24.771   97.833   15.098   60.562   5.0641   48.462   3.8537 12.10030 6.363636 
1 1 1   18    3   48 o   29.216   4.7775   36.532   10.985   58.102   21.570   28.979   12.764   36.017   7.5867   25.629   6.1816 10.38839 9.786261 
1 1 1   18    3   49 o   48.521   2.7237   97.091   10.729  101.488   19.305   95.126   12.906   48.986   4.9002   47.888   3.3270 1.098858 5.922957 
1 1 1   18    3   50 o   69.980   2.0462  200.807   11.660  198.058   17.979  202.803   15.317   69.199   3.1959   70.176   2.6827 -0.9763565 4.172565 
1 1 1   18    3   51 o   41.016   2.8559   69.627   9.4889   82.017   14.885   61.146   12.316   44.170   4.1842   38.132   4.0227 6.037762 5.804261 
1 1 1   18    3   52 o   64.113   2.0993  168.730   10.956  180.136   16.905  160.470   14.387   65.957   3.1534   62.338   2.8386 3.618519 4.242889 
1 1 1   18    3   53 o   36.734   3.1437   56.171   9.3229   60.248   14.684   53.418   12.067   37.511   4.9207   35.508   4.2536 2.002773 6.504351 
1 1 1   18    3   54 o   17.433   5.4107   12.971   8.4901   10.328   13.156   14.857   11.114   17.549   6.6665   18.830   6.2265 -1.280966 9.121994 
1 1 1   18    3   55 o   82.075   1.9097  276.152   12.776  304.838   19.486  254.523   16.921   85.909   2.7863   78.544   2.6466 7.365730 3.842929 
1 1 1   18    3   56 o   34.416   3.3452   49.620   9.2663   46.718   14.355   51.693   12.132   32.614   5.6014   34.812   4.3716 -2.197552 7.105395 
1 1 1   18    3   57 o   31.144   3.6070   40.939   8.9879   15.836   13.763   59.607   11.868   19.677   6.9193   37.543   3.9366 -17.86596 7.960735 
1 1 1   18    3   58 o   48.460   2.4944   97.068   9.8200  112.978   15.272   85.854   12.822   51.897   3.6331   45.256   3.5030 6.641586 5.046794 
1 1 1   18    3   59 o   33.810   3.3241   48.017   9.0429   59.481   14.493   40.708   11.572   37.065   4.9181   30.610   4.7951 6.454489 6.868789 
1 1 1   18    3   60 o   15.007   5.4626   8.3557   8.6560   11.058   13.649   6.5377   11.195   17.769   6.7805   15.274   6.0514 2.494446 9.088107 
1 1 1   18    3   61 f   59.597   2.2675  146.536   10.996  150.768   17.018  143.503   14.406   59.958   3.4972   58.702   3.0208 1.256229 4.621233 
1 1 1   18    3   62 o   48.176   3.3828   97.411   13.200   99.166   21.086   96.280   16.927   47.488   5.5518   47.411   4.4311 0.7699585E-01 7.103376 
1 1 1   18    3   63 o   35.193   4.3088   53.306   12.103   83.056   19.691   35.240   15.344   43.252   5.7255   27.448   6.8738 15.80421 8.945937 
1 1 1   18    3   64 o   28.347   5.3516   35.929   11.913   65.565   19.539   18.393   15.029   37.800   6.5800   20.566   7.2308 17.23354 9.776545 
1 1 1   18    3   65 o   16.449   5.5306   11.458   8.7619  -8.0969   13.759   24.799   11.364   12.569   5.7928   23.221   5.9707 -10.65267 8.319036 
1 1 1   18    3   66 o   23.499   4.7026   24.520   8.6934   46.331   13.782   10.107   11.203   32.149   5.4538   16.462   6.1742 15.68687 8.237983 
1 1 1   18    3   67 o   20.074   5.2261   18.272   8.6337   11.988   13.434   22.695   11.269   17.764   6.7391   22.130   6.0671 -4.365374 9.067809 
1 1 1   18    3   68 o   42.822   3.1564   77.202   10.941   66.832   14.734   89.945   16.334   39.063   4.7230   45.546   4.4563 -6.483612 6.493553 
1 1 1   18    3   69 o   14.504   5.7340   6.3574   10.032   12.606   13.752  -0.7500   14.667   17.997   6.8205   14.472   6.3794 3.524972 9.338955 
1 1 1   18    3   70 o   11.983   5.2596  -0.9044   9.8713 -18.3099   13.699   17.892   14.236   10.780   5.2007   19.996   7.0368 -9.215755 8.750107 
1 1 1   18    3   71 o   34.609   3.9258   51.672   10.880   62.775   14.819   38.689   16.025   37.609   4.9542   28.267   6.9934 9.342030 8.570393 
1 1 1   18    3   72 o   42.531   2.8358   75.924   9.7753   64.312   15.329   83.882   12.691   37.938   5.0847   44.365   3.5385 -6.426468 6.194780 
1 1 1   18    3   73 o   40.122   2.8703   67.725   9.3252   46.044   13.742   86.232   12.696   31.713   5.5159   44.974   3.4905 -13.26094 6.527569 
1 1 1   18    3   74 o   36.029   3.0788   55.001   8.9556   70.119   13.389   42.761   12.047   40.118   4.1542   30.809   4.9659 9.309568 6.474370 
1 1 1   18    3   75 o   8.9318   4.2209  -8.0325   8.0869 -13.8297   11.943  -3.1238   10.990   10.353   4.9587   11.906   5.3657 -1.552429 7.306168 
1 1 1   18    3   76 o   26.254   4.1287   30.509   8.5442   11.731   12.424   47.361   11.769   16.993   6.4727   32.568   4.5580 -15.57448 7.916565 
1 1 1   18    3   77 o   30.970   3.6888   41.740   9.1297   20.212   13.975   57.770   12.059   20.342   6.9826   36.201   4.1622 -15.85883 8.128995 
1 1 1   18    3   78 o   27.148   4.4795   33.254   9.5673   33.294   13.904   33.218   13.185   25.806   6.5881   25.982   6.2928 -0.1768017 9.110578 
1 1 1   18    3   79 o   11.304   4.9956  -0.7206   9.0476   12.201   13.451 -11.3989   12.227   17.123   6.6782   10.775   5.1207 6.347448 8.415452 
1 1 1   18    3   80 o   53.595   2.9451  122.312   12.817   72.507   19.411  160.809   17.066   38.259   6.4537   61.001   3.4461 -22.74258 7.316108 
1 1 1   18    3   81 o   18.694   5.6672   17.045   9.3833   12.634   13.696   20.947   12.882   17.124   6.7211   20.225   6.7039 -3.101799 9.492908 
1 1 1   18    3   82 o   46.896   3.0541   94.414   11.611   80.842   17.736  104.595   15.361   41.262   5.4028   48.602   3.9102 -7.339558 6.669370 
1 1 1   18    3   83 o   30.004   4.0903   40.621   9.7439   34.477   13.449   47.409   14.136   25.837   6.4154   31.049   5.7985 -5.212105 8.647542 
1 1 1   18    3   84 o   27.967   4.2798   35.855   9.4469   37.053   13.070   34.545   13.670   26.979   6.0883   25.610   6.5292 1.368658 8.927370 
1 1 1   18    3   85 o   10.167   4.5320  -0.9596   7.6075  -1.2911   9.5497  -0.3838   12.585   11.178   5.0228   12.799   5.7574 -1.621116 7.640404 
1 1 1   18    3   86 o   17.777   5.3828   15.817   8.4687   14.203   9.7573   20.746   17.051   16.853   5.8325   19.294   7.5208 -2.441175 9.517430 
1 1 1   18    3   87 o   13.599   5.3746   7.2444   8.8113   4.9306   9.5928   19.734   22.288   12.991   5.4271   19.058   8.1315 -6.067524 9.776182 
1 1 1   18    3   88 o   16.593   5.5625   13.827   8.8637   12.592   9.6470   20.524   22.456   16.008   5.7753   19.112   8.1585 -3.104401 9.995759 
1 1 1   18    3   89 o   24.135   4.9151   28.380   9.3410   26.141   10.180   40.305   23.495   22.608   5.5626   23.694   8.9294 -1.086220 10.52036 
1 1 1   18    3   90 o   12.921   5.6342   3.1338   11.165  -8.9478   12.587   47.727   24.182   10.950   5.2013   25.406   9.1466 -14.45643 10.52207 
1 1 1   18    3   91 o   10.628   5.0145  -7.1894   11.332  -4.3397   12.834 -17.2693   24.138   11.837   5.5040   13.765   6.7020 -1.927622 8.672374 
1 1 1   18    3   92 o   12.453   5.6779  -0.9000   12.744 -13.9898   15.039   32.449   24.005   11.205   5.4166   21.167   8.6893 -9.961232 10.23931 
1 1 1   18    3   93 o   11.893   5.5178  -3.6620   12.792  -2.7942   15.074  -5.8943   24.178   12.892   5.9844   14.844   7.0950 -1.952451 9.281794 
1 1 1   18    3   94 o   20.492   7.6984   27.107   17.433   30.447   24.247   23.533   25.081   20.500   8.6006   19.107   8.3853 1.393497 12.01182 
1 1 1   18    3   95 o   13.517   6.3207  -2.6924   17.311 -11.8805   23.879   7.4855   25.132   14.028   6.7917   16.520   7.6883 -2.491464 10.25852 
1 1 1   18    3   96 o   11.271   5.5056 -17.7881   16.668   4.2922   23.649 -39.5840   23.496   15.806   7.3897   11.625   5.8229 4.181195 9.408176 
1 1 1   18    3   97 o   11.295   5.5050 -16.5338   16.406 -30.2377   22.720  -1.6022   23.716   12.038   5.9814   15.018   7.1354 -2.980161 9.310801 
1 1 1   18    3   98 o   18.251   7.4440   20.607   17.475   41.067   25.008   1.0838   24.429   22.251   8.9669   15.391   7.2919 6.860545 11.55755 
1 1 1   18    3   99 o   17.032   7.7336   14.341   23.341   0.0000   0.0000   14.341   23.341  ?   ?    17.032   7.7336 0.000000 7.733647 
1 1 1   18    3  100 o   18.841   8.1490   24.935   22.965   0.0000   0.0000   24.935   22.965  ?   ?    18.841   8.1490 0.000000 8.149031 
1 1 1   18    3  101 o   13.269   6.4261 -11.3885   21.423   0.0000   0.0000 -11.3885   21.423  ?   ?    13.269   6.4261 0.000000 6.426146 
1 1 1   18    3  102 o   12.092   5.9884 -26.2054   22.071   0.0000   0.0000 -26.2054   22.071  ?   ?    12.092   5.9884 0.000000 5.988402 
1 1 1   18    4  -99 o   18.190   8.2166   21.639   25.939   21.639   25.939   0.0000   0.0000   18.190   8.2166  ?   ?  0.000000 8.216614 
1 1 1   18    4  -98 o   18.045   8.1700   21.102   25.825   21.102   25.825   0.0000   0.0000   18.045   8.1700  ?   ?  0.000000 8.170032 
1 1 1   18    4  -97 o   21.236   9.0815   40.837   27.914   40.837   27.914   0.0000   0.0000   21.236   9.0815  ?   ?  0.000000 9.081476 
1 1 1   18    4  -96 o   15.403   7.3750  -0.2169   26.376  -0.2169   26.376   0.0000   0.0000   15.403   7.3750  ?   ?  0.000000 7.374951 
1 1 1   18    4  -95 o   19.569   8.6334   29.608   26.912   29.608   26.912   0.0000   0.0000   19.569   8.6334  ?   ?  0.000000 8.633359 
1 1 1   18    4  -94 o   13.076   6.4365 -21.5054   24.176 -21.5054   24.176   0.0000   0.0000   13.076   6.4365  ?   ?  0.000000 6.436491 
1 1 1   18    4  -93 o   14.600   7.0326  -7.0885   24.811  -7.0885   24.811   0.0000   0.0000   14.600   7.0326  ?   ?  0.000000 7.032610 
1 1 1   18    4  -92 o   19.022   8.3832   24.255   25.313   24.255   25.313   0.0000   0.0000   19.022   8.3832  ?   ?  0.000000 8.383170 
1 1 1   18    4  -91 o   15.329   7.2800  -1.3613   24.634  -1.3613   24.634   0.0000   0.0000   15.329   7.2800  ?   ?  0.000000 7.279960 
1 1 1   18    4  -90 o   21.767   8.0838   32.280   19.112   32.280   19.112   0.0000   0.0000   21.767   8.0838  ?   ?  0.000000 8.083827 
1 1 1   18    4  -89 o   18.011   7.5009   18.376   18.241   18.376   18.241   0.0000   0.0000   18.011   7.5009  ?   ?  0.000000 7.500897 
1 1 1   18    4  -88 o   15.036   6.4659   8.1313   14.298   6.0971   18.302   11.317   22.903   15.410   6.9365   17.035   7.7053 -1.625105 10.36762 
1 1 1   18    4  -87 o   23.651   7.1215   32.957   14.853   33.918   18.636   31.282   24.592   22.734   8.0465   21.009   8.7259 1.725634 11.86962 
1 1 1   18    4  -86 o   26.885   6.1946   38.461   13.296   51.949   18.948   25.375   18.663   29.249   7.8032   20.199   7.8698 9.050404 11.08256 
1 1 1   18    4  -85 o   10.598   5.0622 -10.3108   12.267 -20.7611   17.034   0.9464   17.679   11.290   5.5255   14.511   6.6430 -3.221187 8.640678 
1 1 1   18    4  -84 o   20.696   7.2788   25.115   15.231   12.127   27.522   30.848   18.286   18.040   8.2698   22.116   7.9548 -4.076509 11.47466 
1 1 1   18    4  -83 o   10.824   5.1079  -7.8219   11.766  -2.6687   17.109 -12.4454   16.206   13.830   6.4044   12.037   5.7679 1.793468 8.618886 
1 1 1   18    4  -82 o   26.866   6.6141   38.864   14.386   33.558   17.756   49.002   24.545   23.463   7.8728   26.379   9.2431 -2.915936 12.14156 
1 1 1   18    4  -81 o   10.636   4.8716  -3.4084   9.5247  -3.0603   16.998  -3.5677   11.500   13.890   6.4149   11.618   5.3331 2.272124 8.342259 
1 1 1   18    4  -80 o   12.125   5.2683   1.6238   9.6882 -12.1260   16.748   8.5392   11.877   12.487   5.9506   15.109   6.1465 -2.622746 8.555108 
1 1 1   18    4  -79 o   18.417   5.8356   16.865   9.8250  -1.7777   16.886   26.407   12.080   14.277   6.5194   22.607   6.3140 -8.329896 9.075763 
1 1 1   18    4  -78 o   31.791   4.2034   45.614   10.626   39.006   17.835   49.250   13.231   26.303   7.7761   32.265   5.2081 -5.961950 9.359042 
1 1 1   18    4  -77 o   15.473   5.8067   10.222   9.9129  -8.7898   16.456   21.049   12.419   13.059   6.1245   20.295   6.5742 -7.236049 8.984950 
1 1 1   18    4  -76 o   24.689   5.2355   28.912   10.209   24.711   17.612   31.039   12.529   21.514   7.7977   24.932   6.1928 -3.418758 9.957644 
1 1 1   18    4  -75 o   22.495   4.6720   23.342   8.2866   38.702   11.516   6.8468   11.933   28.856   5.0812   14.932   6.1279 13.92409 7.960523 
1 1 1   18    4  -74 o   11.593   4.8739   2.2034   7.8129  -1.1229   10.556   6.2328   11.618   12.055   5.3581   14.696   6.0404 -2.640783 8.074398 
1 1 1   18    4  -73 o   15.612   5.1656   10.907   7.6490   6.3712   10.184   16.777   11.586   14.270   5.7320   18.812   6.3597 -4.542278 8.561620 
1 1 1   18    4  -72 o   28.112   3.4439   34.136   7.7271   36.610   9.9972   30.463   12.178   28.629   4.4264   25.176   6.0165 3.453611 7.469336 
1 1 1   18    4  -71 o   14.166   5.0670   8.1668   7.4078   4.5696   9.6087   13.438   11.631   13.464   5.5090   17.538   6.3396 -4.074018 8.398780 
1 1 1   18    4  -70 o   17.670   5.2058   14.310   8.0045   17.221   11.080   11.131   11.577   19.206   6.2086   16.670   6.2712 2.536245 8.824661 
1 1 1   18    4  -69 o   47.230   2.3366   92.826   8.9680  102.330   11.989   80.750   13.513   49.273   2.9991   43.271   3.8720 6.002350 4.897670 
1 1 1   18    4  -68 o   13.844   5.2059   6.9515   7.9764   13.850   11.246  -0.0322   11.315   17.805   6.2552   12.951   5.6592 4.853499 8.435289 
1 1 1   18    4  -67 o   31.676   3.4099   42.823   8.6661   43.354   12.520   42.333   12.008   31.043   5.1264   30.759   4.9575 0.2839108 7.131427 
1 1 1   18    4  -66 o   35.169   3.6529   52.944   10.320   54.869   18.831   52.117   12.337   33.775   7.0671   34.479   4.4967 -0.7038155 8.376370 
1 1 1   18    4  -65 o   66.884   2.3484  185.515   12.784  175.902   22.869  189.885   15.418   63.746   4.4286   67.418   2.8116 -3.672562 5.245695 
1 1 1   18    4  -64 o   46.347   2.5545   89.451   9.6136   87.463   13.706   91.377   13.488   45.280   3.7470   46.368   3.5966 -1.088154 5.193770 
1 1 1   18    4  -63 o   16.462   5.4836   11.676   8.6161   27.372   13.037  -0.4964   11.481   24.089   6.4930   13.015   5.6934 11.07465 8.635652 
1 1 1   18    4  -62 o   49.011   2.1990   99.378   8.7628  100.845   14.459   98.527   11.016   48.738   3.6664   48.580   2.7937 0.1580544 4.609503 
1 1 1   18    4  -61 o   30.219   3.0508   38.480   7.4122   53.925   11.419   27.233   9.7441   35.434   4.0246   24.669   5.0167 10.76438 6.431500 
1 1 1   18    4  -60 o   23.870   3.9816   24.717   7.4745   15.269   11.865   30.933   9.6243   18.782   6.4345   26.519   4.6201 -7.736713 7.921327 
1 1 1   18    4  -59 o   41.694   2.5816   72.260   8.7309   80.734   13.393   65.998   11.513   43.597   3.8069   39.467   3.6190 4.129532 5.252606 
1 1 1   18    4  -58 o   18.297   5.1299   14.923   7.9580   13.286   12.290   16.106   10.443   18.114   6.5208   19.050   6.0138 -0.9355469 8.870533 
1 1 1   18    4  -57 o   8.6395   4.0504  -6.8028   7.1876  -4.8090   10.423  -8.6108   9.9251   11.411   5.1760   10.237   4.7863 1.174209 7.049792 
1 1 1   18    4  -56 o   12.335   4.9767   3.4099   7.7132   8.0326   10.529  -1.9451   11.332   15.538   5.9488   12.688   5.5997 2.849765 8.169715 
1 1 1   18    4  -55 o   32.777   3.5096   45.373   9.2311   45.662   13.327   45.108   12.798   32.215   5.2560   32.100   5.0585 0.1158867 7.294825 
1 1 1   18    4  -54 o   82.144   2.0023  277.228   13.407  284.830   16.354  261.647   23.414   83.077   2.4176   78.999   3.6457 4.078171 4.374473 
1 1 1   18    4  -53 o   16.213   5.6211   10.550   9.0643   16.261   10.897  -2.2753   16.330   19.310   6.1490   15.193   6.7130 4.116717 9.103554 
1 1 1   18    4  -52 o   40.920   3.2521   69.985   10.759   70.288   12.108   68.847   23.450   40.870   3.6735   38.514   7.7383 2.356853 8.566010 
1 1 1   18    4  -51 o   82.446   1.6172  278.322   10.868  268.286   15.963  286.994   14.839   80.679   2.4300   83.537   2.1810 -2.857979 3.265228 
1 1 1   18    4  -50 o   52.868   2.0519  114.890   8.8258  111.744   13.183  117.445   11.881   51.846   3.1340   53.277   2.7451 -1.430687 4.166244 
1 1 1   18    4  -49 o   12.273   4.8692   3.6893   7.2578 -14.6373   10.998   17.825   9.6595   9.9150   4.7514   20.103   5.6573 -10.18790 7.387893 
1 1 1   18    4  -48 f   29.990   3.0994   37.572   7.4679   37.303   11.395   37.776   9.8869   29.354   4.9374   29.780   4.1885 -0.4260883 6.474679 
1 1 1   18    4  -47 f   23.389   4.0711   23.449   7.4800   26.841   11.538   20.991   9.8239   24.590   5.8431   21.800   5.5229 2.790586 8.040177 
1 1 1   18    4  -46 o   14.373   5.0140   7.9068   7.2178   13.332   11.231   4.0889   9.4213   18.208   6.2593   13.676   5.5064 4.531924 8.336608 
1 1 1   18    4  -45 o   37.809   2.7057   59.131   8.2839   47.422   12.076   69.537   11.384   33.364   4.5596   40.839   3.4521 -7.475563 5.719011 
1 1 1   18    4  -44 o   38.025   2.7657   59.819   8.5141   44.438   12.265   74.123   11.828   32.220   4.8177   42.183   3.4706 -9.963207 5.937595 
1 1 1   18    4  -43 o   48.576   2.2713   96.988   8.9687   90.710   12.967  102.747   12.419   46.720   3.4286   49.829   3.0724 -3.109455 4.603802 
1 1 1   18    4  -42 o   37.423   2.8905   57.974   8.7492   48.374   13.577   64.791   11.442   33.589   5.1204   39.414   3.6010 -5.824596 6.259849 
1 1 1   18    4  -41 o   38.166   2.8587   60.245   8.8291   48.962   13.274   69.199   11.824   33.865   4.9550   40.755   3.5960 -6.890377 6.122381 
1 1 1   18    4  -40 o   87.721   1.9072  314.868   13.638  324.774   22.649  309.234   17.081   88.738   3.1361   86.796   2.4166 1.942558 3.959231 
1 1 1   18    4  -39 o   13.215   5.0278   5.2661   7.4906   12.817   11.869   0.2673   9.6568   18.286   6.4259   12.549   5.3532 5.736961 8.363584 
1 1 1   18    4  -38 o   42.291   2.4451   73.575   8.3933   60.044   13.041   83.143   10.966   37.801   4.3092   44.863   3.0163 -7.061916 5.259949 
1 1 1   18    4  -37 o  107.371   1.6439  471.093   14.388  426.024   22.795  500.941   18.550  101.832   2.7486  110.638   2.0569 -8.806595 3.433015 
1 1 1   18    4  -36 o   71.641   2.0626  210.183   12.032  160.146   24.028  226.930   13.901   61.851   4.8035   74.401   2.2948 -12.55074 5.323482 
1 1 1   18    4  -35 o   12.270   5.1988   0.5992   9.0008   15.158   20.579  -2.8450   10.009   21.721   8.3165   11.874   5.2507 9.846242 9.835319 
1 1 1   18    4  -34 o  115.982   1.7976  549.796   16.995  562.777   33.007  545.113   19.826  116.850   3.4691  115.427   2.1071 1.423431 4.058877 
1 1 1   18    4  -33 o   86.877   1.9788  308.632   14.014  260.110   20.585  350.544   19.131   79.487   3.1834   92.455   2.5409 -12.96864 4.073134 
1 1 1   18    4  -32 o   43.823   2.6790   79.020   9.5244   74.193   16.208   81.566   11.771   42.010   4.8203   44.424   3.2736 -2.414558 5.826843 
1 1 1   18    4  -31 f   65.941   2.3411  178.216   12.564  175.897   18.661  180.139   16.992   65.282   3.5198   66.146   3.1606 -0.8643112 4.730577 
1 1 1   18    4  -30 o  152.896   1.9943  955.722   24.856  942.716   39.369  964.343   32.051  151.492   3.1881  153.432   2.5627 -1.939255 4.090347 
1 1 1   18    4  -29 o   19.796   5.5166   16.817   9.2328   17.253   16.091   16.603   11.273   21.259   7.4813   19.942   6.2418 1.317326 9.743157 
1 1 1   18    4  -28 o   56.598   2.2559  131.249   10.387  109.435   15.947  147.326   13.689   51.405   3.8332   59.885   2.8122 -8.480541 4.754153 
1 1 1   18    4  -27 o   64.186   2.0570  168.589   10.749  193.200   16.856  151.722   13.954   68.562   3.0234   60.777   2.8243 7.785591 4.137374 
1 1 1   18    4  -26 o  111.813   1.7662  510.653   16.098  521.910   26.938  504.399   20.077  112.789   2.9324  111.058   2.2178 1.731277 3.676628 
1 1 1   18    4  -25 o   59.094   2.1792  142.974   10.479  146.947   16.048  140.021   13.836   59.736   3.3087   58.375   2.9170 1.361496 4.410927 
1 1 1   18    4  -24 o  105.616   1.7449  455.545   15.023  439.102   20.684  473.902   21.855  103.592   2.4495  107.612   2.4914 -4.019531 3.493850 
1 1 1   18    4  -23 o   82.943   1.7643  280.952   11.929  286.238   17.985  276.800   15.939   83.575   2.6433   82.227   2.3805 1.348320 3.557169 
1 1 1   18    4  -22 o   18.624   5.3862   14.707   8.6391  -2.3182   13.420   26.755   11.290   14.127   6.1683   24.891   5.6888 -10.76357 8.391071 
1 1 1   18    4  -21 o  139.130   1.6829  790.317   19.086  784.758   26.146  796.657   27.924  138.533   2.3154  139.551   2.4547 -1.017975 3.374391 
1 1 1   18    4  -20 o   53.278   2.4376  116.345   10.558  123.862   15.393  109.666   14.510   54.823   3.4621   51.571   3.4718 3.251911 4.903028 
1 1 1   18    4  -19 o   61.525   2.1770  154.901   10.901  155.974   15.544  153.864   15.291   61.610   3.1051   61.196   3.0752 0.4143791 4.370207 
1 1 1   18    4  -18 f   15.868   5.8972   8.1564   10.174   7.6316   12.825   9.0475   16.711   16.810   6.5310   18.846   7.4160 -2.036732 9.881857 
1 1 1   18    4  -17 o   83.976   1.8774  288.001   12.851  299.264   17.700  275.443   18.689   85.494   2.5427   81.977   2.8009 3.516678 3.782858 
1 1 1   18    4  -16 o   64.779   2.1455  171.660   11.314  164.263   15.432  180.255   16.636   63.254   3.0015   66.254   3.0888 -3.000374 4.306961 
1 1 1   18    4  -15 o   65.252   2.1689  174.185   11.520  165.798   15.788  183.735   16.848   63.543   3.0571   66.893   3.0981 -3.349884 4.352530 
1 1 1   18    4  -14 o   89.406   1.7654  326.345   12.866  341.468   20.937  317.171   16.309   91.290   2.8170   88.061   2.2738 3.228966 3.620158 
1 1 1   18    4  -13 o   67.979   2.0109  188.921   11.131  194.401   18.150  185.618   14.092   68.791   3.2460   67.315   2.5728 1.476021 4.141930 
1 1 1   18    4  -12 o  192.903   1.7622  1519.18   27.710  1541.96   43.478  1503.60   35.960  194.113   2.7478  191.799   2.3000 2.313339 3.583355 
1 1 1   18    4  -11 f  128.512   1.6589  674.104   17.378  642.665   27.112  696.031   22.641  125.337   2.6537  130.524   2.1280 -5.187012 3.401538 
1 1 1   18    4  -10 o  103.775   1.7041  439.600   14.415  470.298   23.549  421.205   18.229  107.181   2.6975  101.529   2.2027 5.652069 3.482549 
1 1 1   18    4   -9 o  121.191   1.5812  599.400   15.620  586.915   23.190  609.767   21.133  119.825   2.3742  122.171   2.1220 -2.346519 3.184346 
1 1 1   18    4   -8 o  151.692   1.5734  939.046   19.456  930.872   28.563  946.120   26.574  150.916   2.3219  152.179   2.1422 -1.262573 3.159129 
1 1 1   18    4   -7 o   66.153   1.9597  178.873   10.556  172.557   16.321  183.415   13.841   64.835   3.0971   66.924   2.5417 -2.089676 4.006571 
1 1 1   18    4   -6 o   94.437   1.7384  364.049   13.382  349.205   21.277  373.765   17.213   92.331   2.8303   95.643   2.2079 -3.312576 3.589637 
1 1 1   18    4   -5 o  109.761   1.6171  491.679   14.468  481.476   21.281  500.448   19.729  108.528   2.4056  110.674   2.1869 -2.145905 3.251026 
1 1 1   18    4   -4 o   70.533   2.1094  203.405   12.114  227.518   18.578  185.570   15.978   74.474   3.0669   67.268   2.9209 7.206520 4.235265 
1 1 1   18    4   -3 o  105.367   1.8088  453.245   15.536  465.526   22.961  442.873   21.100  106.685   2.6403  104.078   2.4870 2.607430 3.627163 
1 1 1   18    4   -2 o   82.944   1.9492  280.935   13.179  277.427   19.390  283.947   17.966   82.279   2.8956   83.278   2.6500 -0.9989624 3.925153 
1 1 1   18    4   -1 o  145.293   1.7795  861.764   21.076  848.094   30.294  874.585   29.340  144.009   2.5807  146.263   2.4608 -2.254120 3.565889 
1 1 1   18    4    0 o   57.553   2.2134  135.536   10.365  137.460   16.812  134.357   13.164   57.778   3.5873   57.231   2.8307 0.5474815 4.569596 
1 1 1   18    4    1 o  101.896   1.6964  423.787   14.090  409.985   22.531  432.653   18.056  100.065   2.7649  102.910   2.1525 -2.845726 3.503928 
1 1 1   18    4    2 o   55.921   2.2552  127.990   10.259  132.520   17.155  125.467   12.800   56.702   3.7323   55.298   2.8494 1.404541 4.695638 
1 1 1   18    4    3 o   43.994   2.7101   79.476   9.6717   65.042   16.331   87.275   12.003   39.348   5.2201   46.043   3.2184 -6.694664 6.132513 
1 1 1   18    4    4 o   72.198   2.1086  213.111   12.396  245.019   24.249  201.824   14.423   77.147   3.8684   70.211   2.5242 6.936455 4.619132 
1 1 1   18    4    5 o  136.303   1.7913  758.449   19.902  760.620   36.314  757.517   23.794  136.238   3.2699  136.171   2.1436 0.6715393E-01 3.909929 
1 1 1   18    4    6 o   80.551   1.9981  264.993   13.120  273.314   24.894  261.793   15.437   81.510   3.7567   79.995   2.3700 1.515320 4.441853 
1 1 1   18    4    7 o   22.805   4.9820   22.283   9.0016   0.6384   15.340   33.649   11.117   15.924   6.7684   28.141   5.0307 -12.21776 8.433263 
1 1 1   18    4    8 o   80.243   1.9713  262.962   12.894  265.898   19.787  260.796   16.999   80.525   3.0199   79.808   2.6165 0.7166672 3.995698 
1 1 1   18    4    9 o   77.338   1.8940  244.231   11.940  248.442   19.607  241.749   15.053   77.819   3.0971   76.862   2.4055 0.9567566 3.921551 
1 1 1   18    4   10 o   66.056   2.0578  178.408   11.067  175.956   18.213  179.842   13.934   65.415   3.4276   66.261   2.5847 -0.8453751 4.292915 
1 1 1   18    4   11 f   58.953   2.2077  142.215   10.591  141.496   17.421  142.636   13.338   58.600   3.6654   58.972   2.7826 -0.3717155 4.601954 
1 1 1   18    4   12 o  106.490   1.8117  463.012   15.726  423.190   22.979  498.092   21.568  101.650   2.7759  110.378   2.3971 -8.727829 3.667647 
1 1 1   18    4   13 o  115.856   1.7957  548.024   16.959  525.437   25.020  567.218   23.065  113.317   2.7087  117.786   2.4023 -4.468987 3.620496 
1 1 1   18    4   14 o  134.930   1.7867  743.335   19.651  723.924   28.869  760.095   26.825  133.015   2.6625  136.344   2.4136 -3.329681 3.593692 
1 1 1   18    4   15 o  110.934   1.8134  502.491   16.398  518.905   24.723  489.598   21.912  112.607   2.6934  109.418   2.4568 3.189232 3.645531 
1 1 1   18    4   16 o  112.162   1.8193  513.699   16.634  522.733   24.931  506.452   22.330  113.017   2.7063  111.282   2.4617 1.734497 3.658366 
1 1 1   18    4   17 o   75.720   2.2726  234.582   14.011  223.605   24.993  239.613   16.920   73.586   4.1839   76.465   2.7189 -2.879105 4.989717 
1 1 1   18    4   18 f   92.819   2.0926  352.029   15.833  348.706   27.701  353.641   19.295   92.060   3.6990   92.939   2.5493 -0.8798752 4.492339 
1 1 1   18    4   19 o   47.498   3.0320   92.817   11.678  101.167   21.728   89.425   13.848   49.090   5.5258   46.514   3.6823 2.575985 6.640307 
1 1 1   18    4   20 o   32.509   4.1974   44.225   10.864   50.754   20.365   41.628   12.844   34.086   7.5304   31.305   5.2166 2.781494 9.160797 
1 1 1   18    4   21 o   60.733   2.3923  151.089   11.820  139.407   18.789  158.742   15.206   58.068   3.9938   62.164   3.0098 -4.096375 5.000905 
1 1 1   18    4   22 o   67.514   2.8907  187.085   15.872  184.965   24.930  188.529   20.582   66.772   4.6086   67.615   3.7491 -0.8426666 5.940905 
1 1 1   18    4   23 o   20.538   6.3094   17.686   11.580  -0.6301   16.017   37.745   16.761   15.894   6.8393   29.397   7.0797 -13.50289 9.843680 
1 1 1   18    4   24 o   11.287   5.2403  -9.8703   11.567  -9.5710   15.990 -10.1988   16.753   13.954   6.3612   14.241   6.4995 -0.2875977 9.094426 
1 1 1   18    4   25 o   78.376   2.7982  251.996   17.848  255.802   20.859  241.591   34.485   78.877   3.2512   75.999   5.6061 2.878479 6.480624 
1 1 1   18    4   26 o   50.222   3.2051  103.941   13.053  124.122   18.420   83.589   18.498   54.707   4.1619   44.592   5.1856 10.11456 6.649217 
1 1 1   18    4   27 o   55.941   3.3230  128.985   15.085  117.014   18.662  151.549   25.622   53.055   4.3533   60.170   5.2772 -7.114338 6.841072 
1 1 1   18    4   28 o  109.153   2.1313  487.211   18.964  532.047   25.982  436.097   27.742  113.929   2.7977  102.978   3.3092 10.95174 4.333348 
1 1 1   18    4   29 o   71.526   2.2294  209.492   12.983  214.234   20.299  206.210   16.888   72.096   3.4643   70.843   2.9308 1.253365 4.537676 
1 1 1   18    4   30 o   28.090   5.2661   33.851   11.615   30.013   16.050   38.071   16.831   26.198   7.2633   29.432   7.0982 -3.234411 10.15581 
1 1 1   18    4   31 f   76.608   2.0687  240.179   12.906  273.567   20.392  217.869   16.670   81.566   3.0726   72.831   2.8131 8.734299 4.165884 
1 1 1   18    4   32 o   78.345   2.0492  251.194   13.076  257.356   19.983  246.580   17.291   79.092   3.1056   77.496   2.7415 1.595963 4.142544 
1 1 1   18    4   33 o   37.922   3.2771   59.571   10.031   39.890   15.961   72.419   12.896   30.174   6.6670   41.726   3.8344 -11.55157 7.690964 
1 1 1   18    4   34 o   59.826   2.3225  146.775   11.305  151.645   17.573  143.336   14.765   60.561   3.5756   58.982   3.0817 1.578918 4.720360 
1 1 1   18    4   35 o   44.280   3.0325   80.939   10.880   73.551   18.960   84.567   13.284   41.511   5.7581   45.143   3.6410 -3.631428 6.812678 
1 1 1   18    4   36 o   32.815   4.4462   45.456   11.587   43.980   18.379   46.430   14.928   31.493   7.3017   32.802   5.7949 -1.308947 9.321786 
1 1 1   18    4   37 o   21.723   5.0857   20.473   8.8455   25.734   14.443   17.315   11.190   24.247   6.9494   20.186   6.2024 4.060942 9.314715 
1 1 1   18    4   38 o   46.446   2.6246   88.809   9.8964   94.995   15.579   84.624   12.814   47.725   4.0426   45.157   3.5087 2.568382 5.352873 
1 1 1   18    4   39 o   74.535   1.9680  227.500   11.946  245.283   18.658  215.143   15.553   77.166   2.9717   72.344   2.6418 4.822128 3.976216 
1 1 1   18    4   40 o   54.176   2.5841  120.764   11.379  120.389   16.797  121.082   15.469   53.783   3.8569   54.028   3.5318 -0.2452850 5.229661 
1 1 1   18    4   41 o   53.973   2.5222  119.842   11.066  122.531   16.064  117.412   15.266   54.304   3.6501   53.183   3.5416 1.121433 5.085904 
1 1 1   18    4   42 o   48.619   2.9819   97.705   11.761  100.963   19.616   95.877   14.695   48.824   4.9992   47.955   3.7901 0.8693848 6.273504 
1 1 1   18    4   43 o   89.683   2.0176  329.455   14.750  343.274   25.837  322.774   17.965   91.031   3.4883   88.619   2.4894 2.411087 4.285531 
1 1 1   18    4   44 o   99.101   1.9741  402.296   15.947  376.428   27.253  415.765   19.665   95.284   3.5148  100.627   2.3974 -5.342674 4.254608 
1 1 1   18    4   45 o   30.303   3.7029   38.651   8.9571   48.484   14.781   32.945   11.260   33.383   5.6321   27.521   5.2100 5.862104 7.672307 
1 1 1   18    4   46 o   24.608   4.5992   26.168   8.8866   7.9574   14.113   38.133   11.439   17.136   6.7926   29.741   4.8882 -12.60482 8.368592 
1 1 1   18    4   47 f   70.842   2.0311  205.948   11.717  198.900   18.184  210.952   15.322   69.257   3.2300   71.533   2.6321 -2.275826 4.166598 
1 1 1   18    4   48 f   12.307   5.1386   1.7364   8.5935 -13.1688   14.655   9.5479   10.609   12.358   5.7903   16.357   6.0323 -3.999607 8.361598 
1 1 1   18    4   49 o   62.695   2.1302  161.549   10.871  162.129   16.718  161.124   14.309   62.447   3.2959   62.417   2.8196 0.2979279E-01 4.337418 
1 1 1   18    4   50 o   15.367   5.3850   9.1711   8.3312   10.368   13.506   8.4359   10.585   17.620   6.7398   15.850   5.9890 1.770230 9.016247 
1 1 1   18    4   51 o   12.611   5.1271   3.1654   8.2585   2.1929   13.579   3.7364   10.404   15.062   6.3836   13.982   5.7281 1.079614 8.576808 
1 1 1   18    4   52 o   31.317   3.4771   41.327   8.7270   52.807   13.908   33.872   11.208   34.883   5.0370   27.775   5.1395 7.107431 7.196259 
1 1 1   18    4   53 o   60.372   2.2236  150.159   10.924  139.723   16.440  158.410   14.618   57.772   3.5075   61.777   2.9111 -4.004356 4.558164 
1 1 1   18    4   54 o   64.342   2.1460  170.471   11.240  162.126   16.942  177.031   15.022   62.290   3.3490   65.326   2.8277 -3.036003 4.383093 
1 1 1   18    4   55 o   69.494   2.0945  198.802   11.852  182.467   17.870  211.630   15.835   66.076   3.3285   71.461   2.7235 -5.384911 4.300683 
1 1 1   18    4   56 o   35.511   3.2604   52.980   9.3327   63.788   14.599   45.511   12.136   38.384   4.7685   32.352   4.7428 6.032349 6.725514 
1 1 1   18    4   57 o   11.572   5.2847  -5.9069   11.100 -12.0101   17.876  -2.0768   14.161   13.982   6.4994   14.118   6.2441 -0.1363020 9.012786 
1 1 1   18    4   58 o   36.071   4.2223   55.880   12.180   56.146   19.141   55.700   15.790   34.717   7.0056   35.320   5.6766 -0.6025581 9.016728 
1 1 1   18    4   59 o   37.451   4.1354   60.160   12.415   71.584   20.137   53.156   15.767   39.587   6.4632   34.355   5.8391 5.232380 8.710223 
1 1 1   18    4   60 o   43.959   2.7644   80.575   9.8556   83.296   15.519   78.735   12.759   43.965   4.3891   43.087   3.6675 0.8777695 5.719627 
1 1 1   18    4   61 o   44.306   2.7843   81.930   10.005   75.495   15.261   86.780   13.249   41.711   4.5629   45.243   3.6228 -3.532536 5.826169 
1 1 1   18    4   62 o   21.599   5.3689   21.244   9.4119  -1.8909   15.280   35.389   11.948   14.539   6.4550   27.982   5.4341 -13.44312 8.437766 
1 1 1   18    4   63 o   32.087   3.7882   44.174   9.7175   38.042   16.199   47.622   12.146   28.133   7.0724   32.932   4.6540 -4.799433 8.466289 
1 1 1   18    4   64 o   19.207   5.6461   16.840   9.4247   39.996   16.756   6.1235   11.399   28.752   7.1732   14.976   6.0472 13.77552 9.382066 
1 1 1   18    4   65 o   20.706   5.4958   19.703   9.4290   3.5608   15.573   29.045   11.848   15.859   6.7826   24.998   5.9082 -9.138847 8.995043 
1 1 1   18    4   66 o   15.664   5.6846   9.7895   9.3641   25.009   16.253   2.2276   11.457   22.783   7.5295   13.718   5.8407 9.065133 9.529303 
1 1 1   18    4   67 o   79.209   2.1351  259.571   13.773  250.684   22.314  265.042   17.506   76.820   3.5731   79.687   2.6989 -2.866997 4.477854 
1 1 1   18    4   68 o   42.175   3.5427   75.943   12.067   97.310   18.203   59.190   16.118   46.908   4.8294   35.944   5.6901 10.96368 7.463307 
1 1 1   18    4   69 o   59.042   2.8041  146.194   13.457  140.695   19.472  151.222   18.618   56.913   4.2274   59.305   3.8726 -2.391178 5.733006 
1 1 1   18    4   70 o   22.721   6.0349   24.599   11.365   23.096   16.977   25.820   15.298   21.787   7.6829   22.820   7.2876 -1.032579 10.58948 
1 1 1   18    4   71 o   16.684   5.8058   12.242   9.6742  -0.2941   12.693   29.619   14.944   13.447   5.9308   24.299   7.1005 -10.85236 9.251522 
1 1 1   18    4   72 o   29.363   3.7968   37.632   8.8753   39.786   13.240   35.874   11.961   29.018   5.8001   27.716   5.4883 1.302217 7.985154 
1 1 1   18    4   73 o   28.488   4.2161   36.094   9.4953   8.3300   14.673   56.099   12.455   16.380   6.7660   35.497   4.3984 -19.11701 8.069991 
1 1 1   18    4   74 o   16.742   5.7674   12.749   9.5363  -6.7864   14.310   28.353   12.790   12.666   5.8626   23.858   6.4315 -11.19146 8.702566 
1 1 1   18    4   75 o   33.641   3.8374   49.751   10.335   37.848   15.191   60.007   14.101   27.190   6.8566   36.195   4.9055 -9.005014 8.430680 
1 1 1   18    4   76 o   10.822   4.9143  -3.1566   9.4270  -6.1528   14.086  -0.7262   12.687   12.563   5.8155   13.071   5.8376 -0.5074606 8.240016 
1 1 1   18    4   77 o   16.853   5.8420   13.361   9.7908   9.2273   14.053   17.260   13.648   16.122   6.6367   18.737   6.8533 -2.614548 9.540111 
1 1 1   18    4   78 o   9.8907   4.6403  -7.0625   9.4633   0.7187   13.515 -14.5477   13.255   13.637   6.0618   10.704   5.1519 2.932829 7.955390 
1 1 1   18    4   79 o   27.054   4.7005   34.111   9.9901   28.564   14.206   39.539   14.052   23.005   6.9729   27.808   6.3403 -4.802406 9.424419 
1 1 1   18    4   80 o   16.130   6.2446   11.574   11.693   8.7577   23.981   12.453   13.393   17.715   7.9599   16.715   6.6198 1.000269 10.35287 
1 1 1   18    4   81 o   12.534   5.4555   2.0896   10.427  -1.6082   16.642   4.4795   13.379   14.029   6.4309   14.273   6.1963 -0.2442541 8.930281 
1 1 1   18    4   82 o   17.020   6.1021   14.532   10.750   47.605   17.471  -5.6217   13.638   28.924   7.3853   12.113   5.6461 16.81064 9.296323 
1 1 1   18    4   83 o   9.6921   4.6299  -9.7521   10.265   5.1794   16.364 -19.4400   13.181   15.108   6.6954   9.8336   4.8227 5.274316 8.251521 
1 1 1   18    4   84 o   14.349   6.2359   5.3569   13.579   6.9577   16.352   1.8004   24.373   15.424   6.7696   16.172   7.5414 -0.7484970 10.13417 
1 1 1   18    4   85 o   9.2134   4.3924  -8.5834   9.1431  -3.1436   9.9206 -39.2649   23.561   10.792   4.9539   11.912   5.9462 -1.119657 7.739416 
1 1 1   18    4   86 o   14.708   5.9637   8.9404   11.138   8.9404   11.138   0.0000   0.0000   14.708   5.9637  ?   ?  0.000000 5.963669 
1 1 1   18    4   87 o   17.087   6.5777   15.280   12.921   15.280   12.921   0.0000   0.0000   17.087   6.5777  ?   ?  0.000000 6.577714 
1 1 1   18    4   88 o   17.133   6.6305   15.597   13.180   15.597   13.180   0.0000   0.0000   17.133   6.6305  ?   ?  0.000000 6.630538 
1 1 1   18    4   89 o   36.372   5.0582   65.094   14.592   65.094   14.592   0.0000   0.0000   36.372   5.0582  ?   ?  0.000000 5.058187 
1 1 1   18    4   90 o   12.537   5.7052  -0.3301   12.790  -0.3301   12.790   0.0000   0.0000   12.537   5.7052  ?   ?  0.000000 5.705186 
1 1 1   18    4   91 o   13.510   5.8333   5.2279   11.728   5.2279   11.728   0.0000   0.0000   13.510   5.8333  ?   ?  0.000000 5.833336 
1 1 1   18    4   92 o   8.5996   4.2641 -20.7621   11.318 -20.7621   11.318   0.0000   0.0000   8.5996   4.2641  ?   ?  0.000000 4.264056 
1 1 1   18    4   93 o   11.579   5.3696  -3.2338   12.090  -2.6779   13.869  -4.9931   24.672   12.361   5.7386   14.797   7.0976 -2.436080 9.127264 
1 1 1   18    4   94 o   10.976   5.4012 -21.2275   16.979   5.7045   23.504 -50.6176   24.554   15.860   7.3992   11.205   5.6565 4.655414 9.313679 
1 1 1   18    4   95 o   10.500   5.1993 -24.4381   16.608 -39.1333   22.353  -6.3309   24.813   11.239   5.6367   14.567   7.0206 -3.328130 9.003386 
1 1 1   18    4   96 o   15.867   6.8987   11.710   16.636  -5.3551   22.801   31.135   24.326   14.230   6.8250   19.968   8.5067 -5.738467 10.90614 
1 1 1   18    4   97 o   17.302   7.1922   17.729   16.726   16.569   23.396   18.940   23.922   17.255   7.7980   17.664   7.9425 -0.4086323 11.13065 
1 1 1   18    4   98 o   15.342   6.8044   9.3190   16.933   25.246   23.751  -7.1445   24.148   18.790   8.2051   14.262   6.8866 4.527891 10.71206 
1 1 1   18    4   99 o   17.266   7.8774   15.885   24.585   0.0000   0.0000   15.885   24.585  ?   ?    17.266   7.8774 0.000000 7.877364 
1 1 1   18    5  -96 o   14.105   6.8344  -8.8664   24.305  -8.8664   24.305   0.0000   0.0000   14.105   6.8344  ?   ?  0.000000 6.834422 
1 1 1   18    5  -95 o   11.060   5.5795 -46.7071   23.634 -46.7071   23.634   0.0000   0.0000   11.060   5.5795  ?   ?  0.000000 5.579460 
1 1 1   18    5  -94 o   17.058   7.8122   15.420   24.484   15.420   24.484   0.0000   0.0000   17.058   7.8122  ?   ?  0.000000 7.812248 
1 1 1   18    5  -93 o   16.736   7.8036   12.290   26.085   12.290   26.085   0.0000   0.0000   16.736   7.8036  ?   ?  0.000000 7.803646 
1 1 1   18    5  -92 o   14.011   6.8396 -12.8787   25.608 -12.8787   25.608   0.0000   0.0000   14.011   6.8396  ?   ?  0.000000 6.839557 
1 1 1   18    5  -91 o   22.285   9.1276   43.461   26.411   43.461   26.411   0.0000   0.0000   22.285   9.1276  ?   ?  0.000000 9.127586 
1 1 1   18    5  -90 f   16.132   7.5594   6.6045   24.987   6.6045   24.987   0.0000   0.0000   16.132   7.5594  ?   ?  0.000000 7.559394 
1 1 1   18    5  -89 o   16.044   7.5008   6.1131   24.362   6.1131   24.362   0.0000   0.0000   16.044   7.5008  ?   ?  0.000000 7.500837 
1 1 1   18    5  -88 o   17.427   7.8285   15.530   23.179   15.530   23.179   0.0000   0.0000   17.427   7.8285  ?   ?  0.000000 7.828498 
1 1 1   18    5  -87 o   22.262   8.7969   38.439   23.602   38.439   23.602   0.0000   0.0000   22.262   8.7969  ?   ?  0.000000 8.796920 
1 1 1   18    5  -86 o   14.120   6.7484  -7.0019   21.868  -7.0019   21.868   0.0000   0.0000   14.120   6.7484  ?   ?  0.000000 6.748438 
1 1 1   18    5  -85 o   22.504   7.9922   33.968   18.399   33.968   18.399   0.0000   0.0000   22.504   7.9922  ?   ?  0.000000 7.992230 
1 1 1   18    5  -84 o   10.891   5.3664 -23.2698   16.944 -23.2698   16.944   0.0000   0.0000   10.891   5.3664  ?   ?  0.000000 5.366399 
1 1 1   18    5  -83 o   12.134   5.8292 -12.1259   16.790 -12.1259   16.790   0.0000   0.0000   12.134   5.8292  ?   ?  0.000000 5.829238 
1 1 1   18    5  -82 o   15.056   6.7549   4.9290   17.196   4.9290   17.196   0.0000   0.0000   15.056   6.7549  ?   ?  0.000000 6.754920 
1 1 1   18    5  -81 o   22.915   9.3790   41.230   27.862   41.230   27.862   0.0000   0.0000   22.915   9.3790  ?   ?  0.000000 9.379040 
1 1 1   18    5  -80 o   32.916   6.0518   56.128   15.640   61.351   18.499   43.042   29.283   33.172   7.0583   23.207   9.5694 9.965076 11.89086 
1 1 1   18    5  -79 o   12.617   5.4644   2.9010   10.355  -9.7538   17.043   10.307   13.038   12.690   6.0349   15.635   6.4095 -2.945290 8.803496 
1 1 1   18    5  -78 o   14.365   5.8270   7.8813   10.639   16.400   17.993   3.3019   13.192   18.071   7.4811   13.801   6.0682 4.270617 9.632755 
1 1 1   18    5  -77 o   35.900   3.8867   58.018   11.193   66.273   18.403   53.172   14.101   35.526   6.5976   32.955   5.4388 2.571323 8.550407 
1 1 1   18    5  -76 o   14.622   5.7963   8.4479   10.277 -12.6942   16.941   20.758   12.927   12.447   5.9463   19.733   6.7174 -7.286737 8.971130 
1 1 1   18    5  -75 o   11.544   5.1668  -1.0828   9.9964  -9.6820   16.460   3.9417   12.582   12.767   6.0299   13.998   6.0429 -1.230597 8.536765 
1 1 1   18    5  -74 o   33.067   4.1086   49.205   10.836   64.494   17.755   40.129   13.680   35.834   6.3087   28.267   6.1150 7.566874 8.786005 
1 1 1   18    5  -73 o   18.424   5.9386   16.735   10.141   13.381   16.779   18.665   12.730   17.797   7.2807   19.202   6.6611 -1.405552 9.868093 
1 1 1   18    5  -72 o   9.9498   4.5381  -3.3928   8.1511 -15.3164   10.952   11.414   12.204   9.3883   4.5581   16.431   6.3745 -7.042795 7.836502 
1 1 1   18    5  -71 o   35.667   3.1322   54.641   9.0141   44.967   12.397   65.495   13.131   31.100   5.0641   38.264   4.2832 -7.163067 6.632544 
1 1 1   18    5  -70 o   26.412   4.0931   31.135   8.5274   40.101   11.670   20.864   12.491   29.428   5.0465   20.442   6.5908 8.986280 8.300984 
1 1 1   18    5  -69 o   32.045   3.5054   44.511   9.0073   41.354   12.795   47.612   12.683   29.658   5.4947   32.229   4.9884 -2.571758 7.421357 
1 1 1   18    5  -68 o   20.897   4.8198   20.156   8.0426   7.2911   10.774   36.348   12.087   14.822   5.9154   27.811   5.5265 -12.98884 8.095300 
1 1 1   18    5  -67 o   17.173   5.5736   13.517   8.9236   19.719   13.702   8.9484   11.760   20.209   6.9148   15.787   6.2183 4.422723 9.299526 
1 1 1   18    5  -66 o   20.049   5.3259   18.770   8.8505   11.966   13.644   23.713   11.629   17.395   6.7424   22.169   6.1961 -4.773331 9.157104 
1 1 1   18    5  -65 o   9.1264   4.2139  -4.8603   7.3277   5.1367   9.7618 -17.7651   11.091   13.775   5.5838   9.2795   4.5236 4.495363 7.186270 
1 1 1   18    5  -64 o   21.483   4.5862   20.819   7.7868   19.880   10.384   22.027   11.770   20.549   5.8937   21.475   6.3088 -0.9262657 8.633397 
1 1 1   18    5  -63 o   20.230   4.8106   18.603   7.8162   23.614   10.557   12.523   11.628   22.454   5.7448   17.307   6.3266 5.146891 8.545656 
1 1 1   18    5  -62 o   7.9482   3.8250 -10.1185   7.3018  -9.5712   10.073 -10.7247   10.600   10.021   4.7281   10.139   4.8034 -0.1175251 6.740000 
1 1 1   18    5  -61 o   61.919   1.8421  158.041   9.2872  135.318   13.650  177.627   12.673   56.783   2.9592   65.403   2.3810 -8.619385 3.798183 
1 1 1   18    5  -60 o   23.298   3.9388   23.698   7.2138   28.149   11.028   20.370   9.5372   24.716   5.6036   21.029   5.5015 3.686760 7.852809 
1 1 1   18    5  -59 o   22.923   4.0098   22.989   7.2199   11.653   10.917   31.801   9.6252   16.909   6.1378   26.813   4.5675 -9.903633 7.650754 
1 1 1   18    5  -58 o   23.578   4.1771   24.394   7.7344   13.977   12.549   30.775   9.8218   18.239   6.5860   26.303   4.7559 -8.063452 8.123674 
1 1 1   18    5  -57 o   35.980   2.8108   54.236   8.1784   34.924   13.059   66.697   10.490   27.483   5.9982   39.741   3.2671 -12.25755 6.830248 
1 1 1   18    5  -56 o   49.778   2.4934  102.932   10.085   94.957   14.676  110.069   13.883   47.193   3.8483   51.096   3.3516 -3.902893 5.103207 
1 1 1   18    5  -55 o   29.726   4.0727   38.173   9.6094   39.426   13.316   36.812   13.881   29.449   5.7536   28.210   6.2053 1.239235 8.462250 
1 1 1   18    5  -54 o   28.572   3.6111   34.857   8.2229   25.714   13.494   40.257   10.371   23.432   6.7178   30.468   4.2949 -7.036070 7.973361 
1 1 1   18    5  -53 o   11.611   5.2559  -4.4932   10.682   0.0000   0.0000  -4.4932   10.682  ?   ?    11.611   5.2559 0.000000 5.255937 
1 1 1   18    5  -52 o   45.657   2.7849   86.817   10.315   67.765   17.746   96.540   12.677   38.960   5.7613   47.968   3.2616 -9.007839 6.620412 
1 1 1   18    5  -51 o   21.629   5.1260   20.943   8.8986   16.386   15.558   23.159   10.848   20.003   7.3169   22.559   5.8506 -2.556715 9.368356 
1 1 1   18    5  -50 o   11.737   4.8603   2.1215   7.5979  -3.6461   12.706   5.3314   9.4793   13.018   5.8260   14.018   5.5636 -1.000141 8.055801 
1 1 1   18    5  -49 o   30.316   3.1791   38.652   7.7396   42.343   11.928   35.968   10.171   31.147   4.8564   28.803   4.4775 2.343994 6.605456 
1 1 1   18    5  -48 f   51.233   2.2518  108.302   9.3810   65.199   15.698  132.245   11.700   38.693   5.1013   56.530   2.5456 -17.83735 5.701151 
1 1 1   18    5  -47 o   39.736   2.4944   65.397   8.0389   56.071   12.177   72.601   10.703   36.246   4.1990   41.677   3.1742 -5.431042 5.263794 
1 1 1   18    5  -46 o   27.309   3.4297   31.532   7.4668   26.003   11.547   35.506   9.7891   24.010   5.9341   28.723   4.3142 -4.713284 7.336620 
1 1 1   18    5  -45 f   27.651   3.4072   32.275   7.5175   43.947   11.715   24.105   9.8017   31.919   4.6383   23.302   5.2826 8.616764 7.029883 
1 1 1   18    5  -44 o   41.408   2.4384   70.859   8.1941   81.863   12.666   62.939   10.745   44.193   3.5458   38.749   3.4376 5.443954 4.938585 
1 1 1   18    5  -43 o   34.453   2.7940   49.330   7.7794   49.175   12.144   49.439   10.131   33.889   4.5080   34.251   3.6866 -0.3617516 5.823495 
1 1 1   18    5  -42 o   33.427   2.9248   46.514   7.8894   45.184   12.344   47.433   10.258   32.373   4.8251   33.515   3.8230 -1.141720 6.155993 
1 1 1   18    5  -41 o   30.949   3.2925   40.129   8.1790   59.544   14.280   30.651   9.9778   37.275   4.8120   26.584   4.7801 10.69047 6.782664 
1 1 1   18    5  -40 o   26.206   4.1872   29.386   8.6436   10.972   18.587   34.468   9.7636   19.539   7.7789   28.375   4.3605 -8.836260 8.917740 
1 1 1   18    5  -39 o   47.727   2.5501   93.983   9.8849   55.158   20.520  105.715   11.280   34.836   7.4518   50.578   2.7463 -15.74169 7.941735 
1 1 1   18    5  -38 o   14.589   5.3914   7.3331   8.4822   3.3901   18.308   8.4108   9.5715   17.539   7.4219   15.517   5.7284 2.021584 9.375481 
1 1 1   18    5  -37 o   29.687   3.9791   37.304   9.3869   67.222   26.213   32.903   10.054   38.075   8.6439   27.672   4.6198 10.40317 9.800966 
1 1 1   18    5  -36 o   12.579   5.0544   3.3910   7.9215   24.313   14.949  -4.7775   9.3408   23.481   7.1602   10.844   4.9112 12.63728 8.682697 
1 1 1   18    5  -35 o   70.818   1.9116  205.503   11.025  221.538   19.798  198.296   13.274   73.141   3.3294   69.470   2.3474 3.670647 4.073711 
1 1 1   18    5  -34 o   19.076   5.1003   15.834   8.0840   0.9384   14.887   22.063   9.6270   15.525   6.6355   22.447   5.3394 -6.922002 8.516982 
1 1 1   18    5  -33 o   56.581   2.2910  131.504   10.544  135.425   18.244  129.538   12.921   56.988   3.9519   56.039   2.8378 0.9490128 4.865258 
1 1 1   18    5  -32 o   93.571   1.9863  358.471   15.150  344.695   20.726  374.279   22.201   91.516   2.7815   95.339   2.8599 -3.823524 3.989504 
1 1 1   18    5  -31 o   33.888   3.2399   47.767   8.8409   48.459   14.315   47.341   11.241   33.554   5.4183   33.506   4.2082 0.4801941E-01 6.860532 
1 1 1   18    5  -30 o   21.747   4.8420   20.504   8.3630   29.662   13.749   15.126   10.536   25.900   6.5183   18.998   6.0459 6.902071 8.890510 
1 1 1   18    5  -29 o   52.093   2.3763  111.484   10.064  111.203   15.995  111.669   12.948   51.706   3.8221   52.000   3.0683 -0.2939835 4.901307 
1 1 1   18    5  -28 o   86.029   1.8795  302.728   13.180  306.104   20.221  300.233   17.379   86.253   2.8800   85.522   2.4957 0.7315292 3.810909 
1 1 1   18    5  -27 o   66.367   2.7035  181.102   14.595  176.387   17.668  191.231   25.898   65.348   3.3277   67.603   4.7294 -2.254662 5.782852 
1 1 1   18    5  -26 o   84.535   1.8625  292.225   12.834  293.037   23.158  291.866   15.419   84.268   3.3781   84.391   2.2434 -0.1223907 4.055145 
1 1 1   18    5  -25 o   13.883   5.2947   5.7460   8.3198  -2.5730   14.380   9.9318   10.200   14.496   6.3559   16.549   5.9426 -2.052605 8.701268 
1 1 1   18    5  -24 o   57.696   2.0134  136.338   9.4548  149.438   14.408  126.430   12.530   60.245   2.9428   55.433   2.7819 4.812386 4.049582 
1 1 1   18    5  -23 o  110.924   1.6982  502.765   15.355  530.305   25.699  487.476   19.148  113.680   2.7733  109.140   2.1523 4.540016 3.510510 
1 1 1   18    5  -22 o   11.618   5.0296  -0.9194   8.7655  -2.9162   12.407   1.0705   12.386   13.338   5.8741   14.405   6.1006 -1.066767 8.468840 
1 1 1   18    5  -21 o   16.309   5.6106   10.236   9.0239   11.102   12.641   9.3365   12.887   17.912   6.5882   17.342   6.5954 0.5691948 9.322215 
1 1 1   18    5  -20 o   33.954   3.5252   47.971   9.6151   64.670   13.623   31.392   13.573   39.301   4.3236   26.794   6.3180 12.50708 7.655740 
1 1 1   18    5  -19 o   46.121   2.4382   87.362   9.1341   95.476   14.187   81.618   11.938   48.002   3.6531   44.427   3.3203 3.574734 4.936569 
1 1 1   18    5  -18 o   40.051   2.7440   66.078   8.9042   78.893   14.086   57.548   11.491   43.536   4.0144   37.162   3.8491 6.373123 5.561549 
1 1 1   18    5  -17 o  118.921   1.5803  577.542   15.319  613.361   23.123  549.521   20.452  122.413   2.3173  115.899   2.1648 6.514015 3.171135 
1 1 1   18    5  -16 o   27.343   4.0405   31.499   8.7348   31.667   13.710   31.385   11.333   26.933   6.3489   27.003   5.3380 -0.6979942E-01 8.294750 
1 1 1   18    5  -15 o   68.060   2.1260  189.638   11.780  178.254   16.758  200.759   16.563   65.810   3.1329   69.895   2.9136 -4.084259 4.278306 
1 1 1   18    5  -14 o   97.766   2.0073  390.763   15.997  373.001   20.260  420.170   26.068   95.383   2.6082  101.099   3.1671 -5.716499 4.102815 
1 1 1   18    5  -13 o   95.431   2.0322  372.332   15.809  383.635   20.573  356.033   24.704   96.736   2.6114   93.035   3.2625 3.700455 4.178904 
1 1 1   18    5  -12 o  110.774   1.7874  501.318   16.139  512.428   22.690  489.942   22.961  111.870   2.4882  109.370   2.5755 2.499947 3.581105 
1 1 1   18    5  -11 o   8.2160   4.0420 -19.7093   9.4921 -17.8693   13.941 -21.2993   12.960   11.358   5.4173   10.275   4.9816 1.082604 7.359650 
1 1 1   18    5  -10 o   20.742   6.1790   18.288   11.227   17.687   20.466   18.547   13.427   22.551   8.3671   21.193   6.8335 1.357487 10.80303 
1 1 1   18    5   -9 o   65.115   2.2605  173.654   11.980  169.644   20.230  175.821   14.868   64.052   3.8929   65.437   2.7938 -1.384918 4.791640 
1 1 1   18    5   -8 o   87.497   1.9722  312.897   14.067  283.948   19.520  344.169   20.288   83.171   2.8836   91.611   2.7198 -8.440010 3.963889 
1 1 1   18    5   -7 o   66.893   2.4496  183.397   13.335  146.688   20.396  210.803   17.623   59.470   4.2350   71.623   3.0252 -12.15269 5.204547 
1 1 1   18    5   -6 f  140.693   1.7702  808.550   20.301  785.541   27.811  834.795   29.703  138.534   2.4628  142.788   2.5519 -4.254639 3.546497 
1 1 1   18    5   -5 o   69.767   2.0435  199.130   11.609  210.711   17.937  190.783   15.228   71.599   3.0804   68.183   2.7456 3.416138 4.126402 
1 1 1   18    5   -4 o   32.008   4.0014   42.855   10.213   20.716   15.464   59.981   13.601   22.454   7.3405   37.842   4.4970 -15.38864 8.608451 
1 1 1   18    5   -3 o  159.882   1.7444  1044.05   22.734  1072.79   36.245  1025.41   29.190  161.814   2.7478  158.334   2.2616 3.480545 3.558873 
1 1 1   18    5   -2 o  121.791   1.7557  605.843   17.430  545.816   26.974  648.876   22.839  115.395   2.8676  125.961   2.2243 -10.56578 3.629176 
1 1 1   18    5   -1 o   33.903   4.1907   48.106   11.335   12.904   23.260   59.069   12.981   22.083   8.7308   37.592   4.3142 -15.50877 9.738544 
1 1 1   18    5    0 o   82.177   2.1633  276.314   14.478  234.949   28.271  291.020   16.857   75.233   4.6324   84.289   2.4560 -9.056725 5.243216 
1 1 1   18    5    1 o   11.206   5.1192  -6.7172   10.427 -30.8533   21.854   0.3962   11.864   13.812   6.6395   13.969   5.9455 -0.1566162 8.912429 
1 1 1   18    5    2 o   68.590   2.1785  192.570   12.165  170.111   19.867  206.043   15.387   64.172   3.8151   70.877   2.6680 -6.705200 4.655437 
1 1 1   18    5    3 o   90.258   1.8883  332.854   13.893  329.948   22.358  334.683   17.732   89.631   3.0647   90.404   2.4083 -0.7730789 3.897727 
1 1 1   18    5    4 o   98.824   1.8314  398.974   14.753  383.337   23.545  409.082   18.930   96.634   2.9926   99.997   2.3224 -3.362572 3.788040 
1 1 1   18    5    5 o   43.316   3.1956   77.426   11.204   75.214   17.654   78.918   14.497   42.251   5.2379   43.555   4.1327 -1.304298 6.671962 
1 1 1   18    5    6 f   82.551   1.9642  278.500   13.217  246.566   21.066  299.233   16.974   77.404   3.3467   85.471   2.4388 -8.067268 4.140970 
1 1 1   18    5    7 o   32.892   4.0742   45.269   10.690   30.203   16.650   55.835   13.944   26.334   7.4334   36.415   4.8155 -10.08095 8.856894 
1 1 1   18    5    8 o   42.380   3.0705   74.074   10.535   48.933   17.202   89.165   13.328   33.615   6.5130   46.433   3.5481 -12.81749 7.416703 
1 1 1   18    5    9 o   58.405   2.6107  139.989   12.398  140.900   23.879  139.652   14.506   58.044   5.0987   58.260   3.0654 -0.2153130 5.949214 
1 1 1   18    5   10 o  114.359   1.9232  534.462   17.928  539.654   33.333  532.348   21.266  114.482   3.5763  114.070   2.2871 0.4125443 4.245082 
1 1 1   18    5   11 o   66.990   2.3960  183.909   13.063  194.340   25.211  180.081   15.272   68.390   4.5482   66.216   2.8361 2.174294 5.359977 
1 1 1   18    5   12 o   64.081   2.4307  168.338   12.674  154.060   24.205  173.731   14.876   60.745   4.9306   65.037   2.8127 -4.292286 5.676461 
1 1 1   18    5   13 o   30.459   4.4000   39.116   10.608   48.883   21.413   35.939   12.212   33.210   8.0044   28.946   5.3736 4.264412 9.640846 
1 1 1   18    5   14 o   32.255   3.8014   43.442   9.8032   48.061   16.732   41.027   12.097   33.309   6.3947   31.078   4.9404 2.230740 8.080790 
1 1 1   18    5   15 o   10.649   4.8146  -4.6848   8.9293   8.6419   15.157 -11.7683   11.050   18.026   7.0720   10.560   4.9732 7.466113 8.645605 
1 1 1   18    5   16 o   25.745   4.6045   28.254   9.3083   19.489   15.666   33.036   11.573   21.969   7.3953   27.726   5.3137 -5.757607 9.106388 
1 1 1   18    5   17 o   29.287   4.5953   36.356   10.610   29.075   16.120   41.921   14.092   25.802   7.3247   31.203   5.7524 -5.401272 9.313528 
1 1 1   18    5   18 o   26.861   4.9324   30.878   10.402   24.040   15.517   36.458   14.018   23.714   7.3072   28.958   6.1298 -5.244295 9.537778 
1 1 1   18    5   19 o   29.809   4.4538   37.574   10.491   17.294   15.443   54.956   14.297   21.074   7.3351   36.029   5.0028 -14.95467 8.878730 
1 1 1   18    5   20 o   60.668   2.1961  150.816   10.843  165.839   18.096  142.402   13.543   63.366   3.5173   58.845   2.8317 4.520874 4.515516 
1 1 1   18    5   21 o   15.139   5.4610   8.1210   8.6254   11.865   14.700   6.1552   10.652   18.892   7.0751   15.208   5.9396 3.684156 9.237701 
1 1 1   18    5   22 o   55.358   2.4822  125.819   11.172  147.256   22.581  118.870   12.856   59.363   4.7049   53.723   2.9470 5.640144 5.551655 
1 1 1   18    5   23 o   92.109   1.7832  346.766   13.389  331.895   21.429  356.289   17.148   89.852   2.9296   93.287   2.2551 -3.435379 3.697030 
1 1 1   18    5   24 o   90.625   1.9228  335.858   14.204  334.365   21.170  337.082   19.156   90.189   2.8833   90.628   2.5957 -0.4388580 3.879622 
1 1 1   18    5   25 o   42.808   2.9090   75.615   10.091   77.486   15.537   74.249   13.270   42.977   4.5017   42.211   3.9008 0.7655487 5.956653 
1 1 1   18    5   26 o   70.892   2.0953  205.872   12.095  225.592   18.756  191.836   15.824   73.991   3.1168   68.283   2.8492 5.707489 4.222881 
1 1 1   18    5   27 o   63.704   2.2105  166.397   11.462  164.178   17.560  168.043   15.128   63.013   3.4317   63.879   2.9130 -0.8660774 4.501312 
1 1 1   18    5   28 o   27.618   4.6399   32.571   10.076   40.668   14.661   25.323   13.870   30.523   6.1058   24.022   6.7858 6.500578 9.128411 
1 1 1   18    5   29 o   65.880   2.4402  178.233   13.081  194.340   17.974  160.092   19.075   68.608   3.2229   62.099   3.7863 6.508110 4.972223 
1 1 1   18    5   30 o   60.065   2.5176  148.303   12.299  145.599   16.673  151.532   18.218   59.289   3.4649   60.417   3.7172 -1.127766 5.081623 
1 1 1   18    5   31 o   61.223   2.5027  154.083   12.464  168.412   17.285  138.566   17.988   63.803   3.3351   57.713   3.8456 6.090549 5.090322 
1 1 1   18    5   32 o   62.088   2.4865  158.484   12.559  168.955   17.372  147.018   18.178   63.890   3.3472   59.462   3.7698 4.428078 5.041341 
1 1 1   18    5   33 o   32.410   5.8247   45.723   14.823   45.723   14.823   0.0000   0.0000   32.410   5.8247  ?   ?  0.000000 5.824746 
1 1 1   18    5   34 o   44.482   3.0277   81.911   10.913   59.377   15.543  103.815   15.325   37.212   5.2717   49.895   3.7964 -12.68306 6.496408 
1 1 1   18    5   35 o   12.159   5.2094   0.0379   9.2164   4.8999   13.764  -3.9140   12.409   16.092   6.5899   13.001   5.7920 3.090666 8.773463 
1 1 1   18    5   36 o   64.244   2.5644  169.940   13.402  204.584   22.174  149.999   16.823   70.048   3.8987   60.102   3.4484 9.946613 5.204937 
1 1 1   18    5   37 o   37.119   3.4196   57.511   10.231   39.735   18.173   65.757   12.378   29.551   7.5253   39.582   3.8864 -10.03123 8.469656 
1 1 1   18    5   38 o   34.921   3.5254   51.062   9.8980   44.407   18.023   53.936   11.844   31.316   7.2095   35.725   4.1440 -4.408186 8.315652 
1 1 1   18    5   39 o   71.393   2.2186  209.438   12.896  204.458   22.757  211.794   15.651   69.899   4.0109   71.660   2.6841 -1.760437 4.826127 
1 1 1   18    5   40 o  102.480   1.8091  430.169   15.113  442.119   22.813  420.823   20.174  103.544   2.7052  101.154   2.4467 2.390228 3.647506 
1 1 1   18    5   41 o   78.212   1.9727  251.006   12.567  250.347   19.357  251.486   16.522   77.744   3.0604   78.095   2.5990 -0.3509521 4.015069 
1 1 1   18    5   42 o   30.099   3.7664   38.323   9.0393   39.900   14.557   37.333   11.532   29.892   6.1787   29.309   5.0065 0.5826130 7.952447 
1 1 1   18    5   43 o   45.448   2.6761   85.494   9.8703  106.677   15.876   72.147   12.602   50.374   3.8965   41.415   3.7743 8.959385 5.424767 
1 1 1   18    5   44 o   83.303   1.9371  284.721   13.154  278.393   19.972  289.568   17.480   81.944   2.9950   83.763   2.5631 -1.819847 3.942018 
1 1 1   18    5   45 f   48.267   2.5795   96.381   10.112   98.239   16.046   95.157   13.024   48.185   4.1249   47.710   3.3705 0.4751129 5.326833 
1 1 1   18    5   46 o   38.156   3.1229   60.829   9.6283   58.841   15.189   62.165   12.449   36.740   5.2182   38.262   4.0530 -1.521488 6.607337 
1 1 1   18    5   47 o   33.990   3.5983   48.792   9.8187   35.740   16.360   56.140   12.275   27.714   7.1832   36.255   4.2332 -8.540953 8.337785 
1 1 1   18    5   48 f   21.755   5.1010   21.070   8.8878   28.307   14.504   16.718   11.247   24.742   6.9213   19.514   6.2505 5.227875 9.325924 
1 1 1   18    5   49 o   28.327   4.0704   34.462   9.1291   19.143   14.552   44.402   11.723   20.929   7.1270   32.003   4.6279 -11.07358 8.497731 
1 1 1   18    5   50 o   65.869   2.1313  178.778   11.428  153.074   17.151  199.302   15.326   60.384   3.4995   69.317   2.7177 -8.933270 4.430853 
1 1 1   18    5   51 o   46.408   2.8940   89.775   10.893   96.251   19.901   87.005   13.016   46.882   5.3002   45.433   3.5426 1.449135 6.375134 
1 1 1   18    5   52 o   52.300   4.1682  116.690   17.623   0.0000   0.0000  116.690   17.623  ?   ?    52.300   4.1682 0.000000 4.168230 
1 1 1   18    5   53 o   33.780   4.9395   50.113   13.199   56.338   23.754   47.332   15.876   33.629   8.6246   32.131   6.2865 1.498028 10.67258 
1 1 1   18    5   54 o   38.486   3.8287   63.156   11.852   78.666   17.540   50.122   16.079   42.255   5.2019   33.095   6.1875 9.160492 8.083641 
1 1 1   18    5   55 o   10.095   4.6561  -5.9439   8.9128   3.4382   15.464 -10.6105   10.906   15.911   6.7805   10.428   4.9201 5.482509 8.377468 
1 1 1   18    5   56 o   51.837   2.6826  111.931   11.296  122.558   19.785  106.790   13.760   53.162   4.6112   50.315   3.3744 2.846992 5.713993 
1 1 1   18    5   57 o   37.198   3.4105   58.668   10.226   55.356   17.617   60.351   12.559   34.466   6.5090   37.370   4.1951 -2.904793 7.743760 
1 1 1   18    5   58 o   54.138   2.5782  122.002   11.345  139.870   19.638  113.051   13.899   56.978   4.2591   51.760   3.3116 5.218029 5.395058 
1 1 1   18    5   59 o   37.287   3.5248   59.202   10.586   80.946   18.379   48.406   12.950   42.503   5.4285   32.995   4.9689 9.507244 7.359203 
1 1 1   18    5   60 o   17.219   5.7873   12.971   9.5942   18.189   16.126   10.113   11.936   20.326   7.4471   16.553   6.3349 3.772617 9.777050 
1 1 1   18    5   61 o   14.913   5.6723   7.9840   9.5325   34.109   16.494  -5.1191   11.681   26.293   7.3902   11.932   5.4386 14.36070 9.175663 
1 1 1   18    5   62 o   28.887   4.4847   36.874   10.218   19.682   16.817   46.935   12.865   20.813   7.6083   32.351   5.0429 -11.53750 9.127803 
1 1 1   18    5   63 o   19.919   5.7342   18.484   9.8127   8.4384   16.781   23.704   12.096   17.367   7.2104   22.281   6.3516 -4.913509 9.608940 
1 1 1   18    5   64 o   36.209   3.5866   56.275   10.447   64.405   17.509   51.780   13.018   37.226   5.9720   34.046   4.8260 3.180069 7.678252 
1 1 1   18    5   65 o   25.852   5.0447   30.488   10.249   20.850   17.546   35.479   12.627   21.052   7.7587   27.492   5.8162 -6.439865 9.696703 
1 1 1   18    5   66 o   9.8898   4.6382  -7.8578   9.4392 -10.9677   16.123  -6.2361   11.643   12.920   6.0600   11.551   5.3257 1.368523 8.067657 
1 1 1   18    5   67 o   8.7990   4.2659 -13.9913   9.5037 -28.1655   17.031  -7.5819   11.453   11.098   5.4506   11.141   5.1867 -0.4364967E-01 7.524043 
1 1 1   18    5   69 o   28.367   4.9299   36.956   10.986   34.204   18.718   38.402   13.568   25.078   8.0666   28.130   6.0938 -3.051861 10.10959 
1 1 1   18    5   70 o   18.927   6.9035   17.087   13.835  -0.9461   18.950   37.669   20.244   15.472   7.0025   25.842   8.3955 -10.37015 10.93252 
1 1 1   18    5   71 o   10.799   5.1787 -14.0147   13.119 -29.4157   17.852   4.0723   19.346   11.174   5.5061   16.433   7.2814 -5.259075 9.128844 
1 1 1   18    5   72 o   17.670   6.9677   13.721   14.779   7.8988   23.327   17.625   19.102   17.940   7.9698   19.364   7.8249 -1.424374 11.16900 
1 1 1   18    5   73 o   24.417   6.1894   30.157   12.333   24.613   23.595   32.241   14.467   21.244   8.6553   24.669   6.9169 -3.425045 11.07963 
1 1 1   18    5   74 o   22.607   6.4066   26.479   12.343   28.189   24.104   25.871   14.370   21.910   8.8124   21.898   7.0701 0.1169395E-01 11.29803 
1 1 1   18    5   75 o   11.678   5.3714  -4.2488   11.747  -1.8992   23.286  -5.0508   13.604   16.018   7.4361   12.371   5.7225 3.646542 9.383157 
1 1 1   18    5   76 o   27.325   5.9681   37.806   12.920   35.947   25.021   38.481   15.088   23.235   9.0949   26.658   6.8927 -3.423094 11.41163 
1 1 1   18    5   77 o   14.773   5.9394   8.6095   10.944   2.2199   17.793   12.498   13.881   15.032   6.7961   16.635   6.6886 -1.603493 9.535394 
1 1 1   18    5   78 o   13.627   5.7346   5.4921   10.833 -19.9472   17.736   20.629   13.681   11.732   5.7193   19.352   6.8898 -7.619922 8.954364 
1 1 1   18    5   79 o   11.196   5.1228  -2.7987   10.496 -11.5359   17.228   2.3581   13.236   12.512   5.9826   13.532   6.0079 -1.019636 8.478598 
1 1 1   18    5   80 o   8.2220   4.1142 -26.7321   11.588 -44.5143   22.733 -20.4893   13.470   11.317   5.6770   9.8120   4.8248 1.504487 7.450286 
1 1 1   18    5   81 o   24.463   7.8998   37.792   17.940   37.792   17.940   0.0000   0.0000   24.463   7.8998  ?   ?  0.000000 7.899765 
1 1 1   18    5   82 o   17.839   8.0055   14.409   24.173   14.409   24.173   0.0000   0.0000   17.839   8.0055  ?   ?  0.000000 8.005543 
1 1 1   18    5   83 o   13.903   6.7314 -13.9311   23.463 -13.9311   23.463   0.0000   0.0000   13.903   6.7314  ?   ?  0.000000 6.731420 
1 1 1   18    5   84 o   22.309   8.9797   38.368   25.049   38.368   25.049   0.0000   0.0000   22.309   8.9797  ?   ?  0.000000 8.979726 
1 1 1   18    5   85 o   18.143   7.3631   19.076   16.997   19.076   16.997   0.0000   0.0000   18.143   7.3631  ?   ?  0.000000 7.363093 
1 1 1   18    5   86 o   16.631   6.7871   14.221   14.538   14.221   14.538   0.0000   0.0000   16.631   6.7871  ?   ?  0.000000 6.787100 
1 1 1   18    5   87 o   11.086   5.2998  -9.7436   13.509  -9.7436   13.509   0.0000   0.0000   11.086   5.2998  ?   ?  0.000000 5.299821 
1 1 1   18    5   88 o   26.540   6.8318   40.928   14.867   40.928   14.867   0.0000   0.0000   26.540   6.8318  ?   ?  0.000000 6.831836 
1 1 1   18    5   89 o   13.147   5.9888   1.0352   14.139   1.0352   14.139   0.0000   0.0000   13.147   5.9888  ?   ?  0.000000 5.988845 
1 1 1   18    5   90 f   14.807   6.3168   8.9595   13.447   8.9595   13.447   0.0000   0.0000   14.807   6.3168  ?   ?  0.000000 6.316808 
1 1 1   18    5   91 o   10.557   5.1208 -13.5827   13.743 -13.5827   13.743   0.0000   0.0000   10.557   5.1208  ?   ?  0.000000 5.120756 
1 1 1   18    5   92 o   26.678   6.8579   42.235   14.995   42.235   14.995   0.0000   0.0000   26.678   6.8579  ?   ?  0.000000 6.857903 
1 1 1   18    5   93 o   13.135   6.0193   1.0705   14.564   1.0705   14.564   0.0000   0.0000   13.135   6.0193  ?   ?  0.000000 6.019311 
1 1 1   18    5   94 o   13.029   6.3881 -17.0678   23.073 -17.0678   23.073   0.0000   0.0000   13.029   6.3881  ?   ?  0.000000 6.388128 
1 1 1   18    5   95 o   11.828   5.8955 -31.1017   22.789 -31.1017   22.789   0.0000   0.0000   11.828   5.8955  ?   ?  0.000000 5.895541 
1 1 1   18    6  -92 o   21.601   9.0403   42.254   26.692   42.254   26.692   0.0000   0.0000   21.601   9.0403  ?   ?  0.000000 9.040336 
1 1 1   18    6  -91 o   18.227   8.0014   23.049   22.851   23.049   22.851   0.0000   0.0000   18.227   8.0014  ?   ?  0.000000 8.001440 
1 1 1   18    6  -90 o   21.619   8.7258   39.573   23.723   39.573   23.723   0.0000   0.0000   21.619   8.7258  ?   ?  0.000000 8.725832 
1 1 1   18    6  -89 o   18.351   8.0791   23.635   23.453   23.635   23.453   0.0000   0.0000   18.351   8.0791  ?   ?  0.000000 8.079119 
1 1 1   18    6  -88 o   14.105   6.7769  -5.7062   22.709  -5.7062   22.709   0.0000   0.0000   14.105   6.7769  ?   ?  0.000000 6.776934 
1 1 1   18    6  -87 o   14.635   6.9678  -1.8884   22.853  -1.8884   22.853   0.0000   0.0000   14.635   6.9678  ?   ?  0.000000 6.967803 
1 1 1   18    6  -86 o   18.524   8.0923   23.038   23.124   23.038   23.124   0.0000   0.0000   18.524   8.0923  ?   ?  0.000000 8.092313 
1 1 1   18    6  -85 o   10.576   5.3298 -44.6277   21.261 -44.6277   21.261   0.0000   0.0000   10.576   5.3298  ?   ?  0.000000 5.329796 
1 1 1   18    6  -84 o   13.272   6.4607 -14.7307   22.397 -14.7307   22.397   0.0000   0.0000   13.272   6.4607  ?   ?  0.000000 6.460651 
1 1 1   18    6  -83 o   17.580   7.8256   16.666   22.607   16.666   22.607   0.0000   0.0000   17.580   7.8256  ?   ?  0.000000 7.825637 
1 1 1   18    6  -82 o   12.374   6.1201 -26.7301   22.770 -26.7301   22.770   0.0000   0.0000   12.374   6.1201  ?   ?  0.000000 6.120062 
1 1 1   18    6  -81 f   33.147   9.2539   79.139   25.955   79.139   25.955   0.0000   0.0000   33.147   9.2539  ?   ?  0.000000 9.253923 
1 1 1   18    6  -80 o   24.203   9.0791   45.754   24.228   45.754   24.228   0.0000   0.0000   24.203   9.0791  ?   ?  0.000000 9.079139 
1 1 1   18    6  -79 o   15.140   6.7569   6.2314   16.966   6.2314   16.966   0.0000   0.0000   15.140   6.7569  ?   ?  0.000000 6.756876 
1 1 1   18    6  -78 o   20.204   6.7963   23.522   13.231   9.9905   17.165   43.333   20.769   16.051   6.9926   25.060   8.5147 -9.009855 11.01800 
1 1 1   18    6  -77 f   19.007   6.8606   20.520   13.616   22.300   17.266   17.593   22.142   19.319   7.5571   18.238   7.9439 1.080788 10.96429 
1 1 1   18    6  -76 o   14.379   6.5158   2.2712   16.468   2.2712   16.468   0.0000   0.0000   14.379   6.5158  ?   ?  0.000000 6.515819 
1 1 1   18    6  -75 o   16.627   6.7838   13.089   14.519  -1.2317   16.797   55.421   28.878   13.883   6.3994   26.034   9.8797 -12.15085 11.77123 
1 1 1   18    6  -74 o   32.739   6.0700   55.377   15.603   46.898   18.156   79.323   30.512   28.016   7.7089   31.856   10.304 -3.839449 12.86822 
1 1 1   18    6  -73 o   16.869   6.8529   13.258   14.741   10.005   17.215   22.199   28.537   16.405   7.0752   19.838   8.8139 -3.432995 11.30235 
1 1 1   18    6  -72 o   26.910   5.5666   36.049   11.808   26.709   17.471   43.902   16.020   21.263   7.7575   28.281   6.9898 -7.018059 10.44206 
1 1 1   18    6  -71 o   21.654   6.2326   24.507   11.593   24.245   17.012   24.735   15.842   20.677   7.6363   20.951   7.4186 -0.2744370 10.64651 
1 1 1   18    6  -70 o   14.785   6.0107   7.9016   11.349   15.554   16.781   1.4514   15.407   18.159   7.3355   14.357   6.4211 3.801942 9.748868 
1 1 1   18    6  -69 o   24.730   4.4424   28.225   8.6263   14.098   18.253   32.288   9.7883   18.070   7.5125   26.283   4.7432 -8.213146 8.884598 
1 1 1   18    6  -68 o   35.964   3.1399   55.840   9.1128   36.968   17.733   62.613   10.623   25.561   7.7995   37.860   3.4810 -12.29922 8.541044 
1 1 1   18    6  -67 o   11.099   4.6992   1.8637   7.3461  -7.7348   11.286   8.9209   9.6769   10.834   5.0779   14.867   5.7003 -4.032874 7.634022 
1 1 1   18    6  -66 o   17.463   5.0609   14.419   7.6200  -0.7510   11.829   25.178   9.9623   12.673   5.6498   22.877   5.4250 -10.20426 7.832707 
1 1 1   18    6  -65 o   33.878   2.9518   49.002   8.0704   41.169   12.432   54.706   10.610   29.566   5.3556   35.341   3.7395 -5.775227 6.531954 
1 1 1   18    6  -64 o   31.577   3.1162   42.748   7.9165   38.858   12.333   45.473   10.324   28.701   5.4714   32.061   4.0398 -3.360092 6.801240 
1 1 1   18    6  -63 o   37.971   2.6458   60.785   8.1382   62.082   12.569   59.849   10.679   37.472   4.1864   37.181   3.5672 0.2911148 5.500056 
1 1 1   18    6  -62 o   24.571   3.8831   26.626   7.5192   19.865   11.699   31.384   9.8147   20.228   6.3625   26.256   4.7610 -6.027821 7.946655 
1 1 1   18    6  -61 o   12.509   4.8359   5.2059   7.0054   13.492   10.554  -1.3204   9.3662   17.343   6.0622   11.416   5.0620 5.927256 7.897739 
1 1 1   18    6  -60 o   15.639   4.9865   10.919   7.1643  -0.8755   10.739   20.378   9.6174   12.331   5.4464   20.807   5.5631 -8.475233 7.785294 
1 1 1   18    6  -59 o   31.173   3.3985   41.665   8.4960   39.620   11.413   44.206   12.724   29.638   4.8949   31.161   5.1917 -1.522854 7.135414 
1 1 1   18    6  -58 f   14.423   5.4306   7.7329   8.6856   1.3757   10.929   18.630   14.309   13.112   5.6461   20.037   7.0545 -6.924764 9.035728 
1 1 1   18    6  -57 o   28.663   3.7743   35.590   8.6043   40.616   11.602   29.447   12.827   30.083   4.8995   24.811   6.3244 5.272694 8.000189 
1 1 1   18    6  -56 o   19.411   4.7088   17.060   7.3735   10.941   11.067   21.945   9.8879   16.560   6.1512   21.736   5.5593 -5.175840 8.291107 
1 1 1   18    6  -55 o   36.801   2.6587   56.702   7.9218   61.046   11.846   53.188   10.655   37.627   3.9195   35.168   3.7758 2.458420 5.442408 
1 1 1   18    6  -54 o   32.254   2.9665   43.884   7.7119   29.010   11.578   55.745   10.339   24.987   5.7968   36.131   3.5567 -11.14416 6.800959 
1 1 1   18    6  -53 o   15.581   5.0170   10.569   7.2393   18.273   11.134   4.9279   9.5281   19.892   6.1998   13.712   5.5316 6.180325 8.308767 
1 1 1   18    6  -52 o   27.904   3.3169   33.177   7.3971   27.903   11.155   37.318   9.8825   24.592   5.6792   29.223   4.2751 -4.630650 7.108450 
1 1 1   18    6  -51 o   16.403   4.9682   11.934   7.2136   7.8361   10.988   15.038   9.5630   15.433   6.0310   18.281   5.7527 -2.848567 8.334709 
1 1 1   18    6  -50 f   19.330   4.6520   16.747   7.2410   23.824   11.068   11.451   9.5743   22.669   5.9247   16.545   5.7746 6.123308 8.273349 
1 1 1   18    6  -49 o   21.894   4.2341   21.092   7.2832   19.222   11.329   22.410   9.5083   20.451   6.2328   22.200   5.3231 -1.748899 8.196577 
1 1 1   18    6  -48 f   15.088   4.9684   9.6489   7.0789   2.5781   10.622   15.299   9.4950   13.507   5.6811   18.477   5.7198 -4.969486 8.061729 
1 1 1   18    6  -47 o   39.608   2.6723   65.394   8.5774   50.349   12.093   80.628   12.168   34.041   4.4656   43.692   3.4444 -9.651371 5.639609 
1 1 1   18    6  -46 o   43.603   2.6263   79.094   9.2915   63.093   14.319   90.733   12.212   38.062   4.7158   46.471   3.2441 -8.409122 5.723897 
1 1 1   18    6  -45 o   13.767   5.2170   6.3834   8.0456   5.9967   12.654   6.6458   10.424   15.579   6.3417   14.889   5.8577 0.6898985 8.633044 
1 1 1   18    6  -44 o   23.810   4.5451   24.921   8.4998   32.600   16.418   22.108   9.9349   26.204   7.3759   22.100   5.5291 4.104404 9.218138 
1 1 1   18    6  -43 o   24.760   4.8706   27.114   9.4800   35.468   29.118   26.123   10.026   27.189   9.9994   24.163   5.2415 3.026047 11.28984 
1 1 1   18    6  -42 o   51.260   2.4943  108.807   10.391  121.091   21.590  105.104   11.854   52.826   5.0763   50.236   2.9072 2.589520 5.849857 
1 1 1   18    6  -41 o   29.749   3.8289   37.752   9.0702   41.163   19.678   36.832   10.221   29.287   8.0123   29.162   4.4394 0.1249847 9.160010 
1 1 1   18    6  -40 o   10.137   4.5298  -2.6320   7.6500   2.1811   13.154  -5.0921   9.4039   14.758   6.2700   10.702   4.8786 4.056049 7.944416 
1 1 1   18    6  -39 o   33.854   3.0172   47.929   8.2391   49.681   13.877   46.975   10.239   33.663   5.2266   33.253   3.8484 0.4107018 6.490569 
1 1 1   18    6  -38 o   37.322   2.7926   57.950   8.4341   62.730   14.259   55.377   10.460   38.169   4.6807   36.240   3.5880 1.928741 5.897646 
1 1 1   18    6  -37 o   24.528   4.1578   25.958   8.0165   26.513   13.693   25.668   9.8883   24.085   6.7204   24.065   5.1933 0.2029228E-01 8.493204 
1 1 1   18    6  -36 o   9.9908   4.5082  -3.5594   7.7847   5.9673   14.260  -7.6039   9.2914   16.412   6.7127   10.066   4.6814 6.345159 8.183893 
1 1 1   18    6  -35 o   61.657   1.9756  156.186   9.9164  173.731   16.576  146.407   12.375   64.640   3.1555   59.533   2.5560 5.106495 4.060817 
1 1 1   18    6  -34 o   27.345   3.7049   31.724   8.0463   42.859   13.775   25.957   9.9134   31.177   5.6272   24.261   5.1709 6.915262 7.642248 
1 1 1   18    6  -33 o   32.156   3.1779   43.252   8.2211   33.850   13.723   48.515   10.267   27.433   6.2737   33.902   3.7795 -6.469557 7.324214 
1 1 1   18    6  -32 o   54.845   2.1126  123.666   9.4269  103.216   15.660  135.287   11.805   49.568   3.9074   57.260   2.5355 -7.691734 4.657972 
1 1 1   18    6  -31 o   38.963   3.1852   63.265   10.028   69.511   16.996   59.929   12.421   40.102   5.3311   37.638   4.1153 2.463943 6.734719 
1 1 1   18    6  -30 o   31.513   3.6922   41.850   9.3048   77.082   17.159   27.174   11.074   42.394   5.0656   24.772   5.6145 17.62139 7.561895 
1 1 1   18    6  -29 o   43.986   2.5626   79.895   9.1483   86.060   17.428   77.550   10.748   44.938   4.8336   43.210   3.0715 1.727589 5.726957 
1 1 1   18    6  -28 o   10.171   4.5430  -2.8330   7.6854   2.3054   13.745  -5.1702   9.2699   15.265   6.4438   10.675   4.8574 4.590031 8.069492 
1 1 1   18    6  -27 o   48.664   3.0258   98.146   11.944  128.028   16.357   64.017   17.481   55.412   3.6415   38.368   5.7677 17.04395 6.821046 
1 1 1   18    6  -26 o   74.721   2.0747  229.099   12.624  250.949   18.830  211.259   17.015   77.935   2.9694   71.512   2.9250 6.423012 4.168148 
1 1 1   18    6  -25 o   28.584   4.2077   34.771   9.5110   43.730   14.431   27.892   12.646   31.599   5.8169   25.035   6.2235 6.564096 8.518744 
1 1 1   18    6  -24 o   26.095   5.1567   29.642   10.580   33.156   14.164   25.206   15.912   27.266   6.4707   23.905   7.4053 3.361137 9.834104 
1 1 1   18    6  -23 o   52.914   2.4712  115.259   10.629  111.593   16.255  117.999   14.050   51.687   3.8864   53.350   3.2460 -1.663502 5.063711 
1 1 1   18    6  -22 o   34.109   3.4731   48.609   9.5218   50.746   14.997   47.166   12.325   34.237   5.5646   33.267   4.6736 0.9697456 7.266859 
1 1 1   18    6  -21 o   49.891   2.5390  102.514   10.292  112.340   16.141   95.782   13.360   51.896   3.8429   48.012   3.4364 3.884293 5.155276 
1 1 1   18    6  -20 o   43.771   3.1228   79.395   11.069   71.038   21.030   82.597   13.018   40.241   6.6427   44.526   3.6178 -4.285049 7.564046 
1 1 1   18    6  -19 o   20.736   4.8154   18.696   7.9829   28.119   12.030   11.282   10.671   25.263   5.9419   17.224   6.0896 8.039133 8.508181 
1 1 1   18    6  -18 o   49.576   2.2973  101.001   9.2583  116.089   13.650   88.148   12.599   52.966   3.1762   46.080   3.3776 6.885784 4.636469 
1 1 1   18    6  -17 o   11.730   4.8819   1.5273   7.7193   10.885   11.841  -5.3899   10.180   17.450   6.3832   11.285   5.1176 6.164172 8.181385 
1 1 1   18    6  -16 o   26.772   3.8829   30.292   8.2268   26.130   12.370   33.592   11.016   24.339   6.2143   27.922   5.0247 -3.583286 7.991552 
1 1 1   18    6  -15 o   78.959   1.7988  255.013   11.578  266.078   16.635  244.619   16.123   80.471   2.5391   77.148   2.5674 3.323563 3.610953 
1 1 1   18    6  -14 o   19.973   4.9698   17.337   8.0585   15.595   12.314   18.643   10.657   19.558   6.5563   20.731   5.9784 -1.172626 8.872799 
1 1 1   18    6  -13 o  102.854   1.6801  432.484   14.086  412.579   19.653  453.514   20.200  100.301   2.4037  105.172   2.3563 -4.870850 3.365962 
1 1 1   18    6  -12 o   84.652   1.7769  293.047   12.261  293.659   17.571  292.467   17.118   84.552   2.5522   84.396   2.4910 0.1564178 3.566379 
1 1 1   18    6  -11 o   12.819   5.0134   4.2850   7.5972  -2.3193   12.301   8.3575   9.6597   13.386   5.8735   15.619   5.7568 -2.233474 8.224275 
1 1 1   18    6  -10 o  105.322   1.6637  453.417   14.284  451.014   22.618  455.011   18.422  104.779   2.6502  105.407   2.1440 -0.6283417 3.408889 
1 1 1   18    6   -9 o   81.833   1.8455  273.891   12.311  273.636   17.368  274.149   17.452   81.610   2.6142   81.684   2.6245 -0.7386780E-01 3.704293 
1 1 1   18    6   -8 o   50.673   2.3945  105.495   9.8625  105.621   14.194  105.378   13.714   50.483   3.4704   50.452   3.3536 0.3084946E-01 4.825988 
1 1 1   18    6   -7 o   30.595   4.0242   39.404   9.7930   36.962   16.411   40.755   12.204   28.853   7.0407   30.865   5.0234 -2.011705 8.649029 
1 1 1   18    6   -6 o   49.168   2.4414   99.359   9.7542   90.414   17.269  103.550   11.820   46.388   4.6287   50.111   2.9062 -3.722652 5.465450 
1 1 1   18    6   -5 o   40.044   2.8501   66.210   9.2425   53.507   16.741   71.780   11.085   35.147   6.0622   41.615   3.2946 -6.467934 6.899580 
1 1 1   18    6   -4 o   39.893   2.8696   65.722   9.2692   54.351   16.548   70.920   11.189   35.475   5.9319   41.354   3.3479 -5.879265 6.811488 
1 1 1   18    6   -3 o   39.944   2.6526   65.764   8.5880   78.861   13.918   57.711   10.914   43.478   3.9708   37.215   3.6443 6.262642 5.389587 
1 1 1   18    6   -2 o   21.874   4.5621   20.608   7.8709   34.870   12.911   12.174   9.9291   28.308   5.7907   17.478   5.8875 10.83003 8.258032 
1 1 1   18    6   -1 o   11.341   4.7957   0.5925   7.6343   6.4639   12.483  -2.9156   9.6491   16.120   6.3888   11.602   5.1414 4.517950 8.200644 
1 1 1   18    6    0 o   30.446   3.6441   38.796   8.8647   61.905   16.575   29.538   10.491   38.054   5.5029   26.167   5.1018 11.88701 7.503980 
1 1 1   18    6    1 o   98.071   1.9604  393.485   15.672  449.771   28.250  368.461   18.836  104.432   3.3227   94.773   2.4403 9.659592 4.122546 
1 1 1   18    6    2 o   48.098   2.6858   95.247   10.488   88.024   17.611   99.217   13.057   45.724   4.7962   48.972   3.2899 -3.247398 5.816097 
1 1 1   18    6    3 o   97.401   1.7608  387.850   13.980  381.340   23.654  391.344   17.331   96.250   3.0186   97.761   2.1748 -1.510780 3.720448 
1 1 1   18    6    4 o   18.601   5.3682   14.842   8.5897   13.720   15.832   15.310   10.226   19.820   7.3581   19.063   5.9415 0.7570133 9.457382 
1 1 1   18    6    5 o   36.651   2.8643   55.525   8.4894   65.655   13.514   48.921   10.911   39.564   4.2571   34.154   3.9946 5.410400 5.837801 
1 1 1   18    6    6 o   57.778   2.0634  136.813   9.7025  134.611   15.104  138.361   12.660   57.076   3.2600   57.994   2.6853 -0.9183197 4.223566 
1 1 1   18    6    7 o   39.141   2.7267   63.207   8.6452   60.846   13.614   64.802   11.192   38.008   4.4800   39.478   3.5144 -1.470421 5.694013 
1 1 1   18    6    8 o   9.9827   4.5276  -4.4101   7.9723  -4.1376   13.659  -4.5509   9.8183   13.715   6.0953   11.272   5.0767 2.442360 7.932575 
1 1 1   18    6    9 o   89.387   1.8362  326.785   13.379  381.324   24.459  303.498   15.982   96.195   3.1233   86.033   2.2810 10.16232 3.867564 
1 1 1   18    6   10 o   48.458   2.4935   96.574   9.8162  115.749   17.932   88.369   11.730   52.648   4.2136   46.226   3.1314 6.422329 5.249787 
1 1 1   18    6   11 o   35.766   3.6407   53.385   10.467   64.310   16.764   46.407   13.399   38.778   5.4539   32.924   5.1622 5.854874 7.509587 
1 1 1   18    6   12 o   49.583   2.7889  101.340   11.226  118.476   17.935   90.300   14.396   53.273   4.1630   46.559   3.8268 6.714382 5.654700 
1 1 1   18    6   13 o   53.037   2.6695  115.812   11.504  112.480   18.019  118.106   14.947   51.852   4.3017   53.382   3.4534 -1.530167 5.516407 
1 1 1   18    6   14 o   49.408   2.8135  100.670   11.284   99.659   17.819  101.347   14.580   48.706   4.5405   49.379   3.6480 -0.6728249 5.824462 
1 1 1   18    6   15 o   21.785   4.9496   20.621   8.5887   20.949   16.034   20.489   10.171   22.399   7.4810   21.643   5.6907 0.7556343 9.399421 
1 1 1   18    6   16 o   78.536   1.9263  252.441   12.332  273.753   22.504  243.296   14.742   81.358   3.4009   76.987   2.3519 4.371193 4.134872 
1 1 1   18    6   17 o   42.235   2.7054   73.604   9.2652   66.089   16.006   77.391   11.362   39.387   5.1055   43.197   3.2506 -3.810440 6.052490 
1 1 1   18    6   18 o   60.337   2.1043  149.325   10.334  147.684   17.421  150.215   12.836   59.642   3.6000   60.413   2.6126 -0.7716789 4.448133 
1 1 1   18    6   19 o   37.316   3.0038   57.721   9.0601   66.598   15.756   53.335   11.074   39.557   4.9977   35.661   3.8717 3.895615 6.321940 
1 1 1   18    6   20 o   36.901   3.0395   56.485   9.0617   76.222   15.843   46.889   11.047   42.459   4.6536   33.331   4.1561 9.128120 6.239382 
1 1 1   18    6   21 o   91.695   1.9378  344.273   14.484  387.978   21.880  310.182   19.324   97.071   2.7680   86.797   2.7347 10.27398 3.891054 
1 1 1   18    6   22 o   80.133   1.8365  262.830   11.996  267.059   19.764  260.364   15.095   80.431   3.0198   79.621   2.3282 0.8103180 3.813137 
1 1 1   18    6   23 o   25.242   4.7080   27.502   9.3310   20.462   19.004   29.739   10.711   22.655   8.1143   26.134   5.2107 -3.479895 9.643294 
1 1 1   18    6   24 o   53.234   2.3085  116.530   9.9938  107.126   16.295  122.201   12.653   50.592   3.9833   54.389   2.8641 -3.796421 4.906047 
1 1 1   18    6   25 o  100.992   1.7348  417.404   14.281  434.577   22.930  406.521   18.254  102.700   2.7414   99.529   2.2500 3.171783 3.546535 
1 1 1   18    6   26 o   41.193   2.9785   70.365   9.9338   70.430   15.230   70.317   13.105   40.713   4.6739   40.907   3.9804 -0.1941605 6.139143 
1 1 1   18    6   27 o   72.299   2.0754  214.526   12.218  221.036   18.581  209.566   16.218   73.070   3.1268   71.256   2.7975 1.813728 4.195599 
1 1 1   18    6   28 o   12.134   5.1495   0.7482   8.8562  -7.1532   14.018   5.9965   11.425   13.140   5.9771   15.338   6.1013 -2.197520 8.541162 
1 1 1   18    6   29 o   23.078   5.5107   23.548   10.223   27.763   14.608   19.501   14.313   24.817   6.9475   21.353   7.0661 3.464376 9.909429 
1 1 1   18    6   30 o   60.391   2.2600  150.018   11.106  138.963   17.120  158.050   14.593   57.689   3.6595   61.806   2.9046 -4.116360 4.672139 
1 1 1   18    6   31 o   34.113   3.4580   48.792   9.4831   47.743   18.895   49.145   10.964   32.315   7.3406   34.072   4.0252 -1.756802 8.371817 
1 1 1   18    6   32 o   50.408   2.5660  104.935   10.509   83.621   20.500  112.533   12.240   43.748   5.8988   52.115   2.8926 -8.366688 6.569842 
1 1 1   18    6   33 o   57.858   2.3235  137.892   10.936  113.076   21.356  146.712   12.732   51.304   5.1774   59.596   2.6274 -8.292217 5.805878 
1 1 1   18    6   34 o   80.725   2.0498  267.704   13.477  264.226   20.181  270.503   18.107   79.792   3.1087   80.893   2.7500 -1.100647 4.150456 
1 1 1   18    6   35 o   46.530   2.8244   89.821   10.662   87.130   16.347   91.814   14.066   45.225   4.4936   46.747   3.7220 -1.522339 5.834842 
1 1 1   18    6   36 o   44.854   3.3918   84.188   12.309   84.313   15.981   84.006   19.300   44.469   4.4693   43.897   5.5152 0.5721092 7.098763 
1 1 1   18    6   37 o   57.380   2.4214  135.929   11.300  158.410   17.545  119.993   14.772   61.527   3.5129   53.569   3.4005 7.958385 4.889141 
1 1 1   18    6   38 o   17.219   5.3804   12.805   8.3800   10.469   14.392   14.003   10.307   17.826   6.9205   18.137   5.9962 -0.3111439 9.156869 
1 1 1   18    6   39 o   14.840   5.4159   8.1115   8.5165   29.765   14.053  -4.4575   10.707   25.428   6.6906   11.706   5.2841 13.72219 8.525621 
1 1 1   18    6   40 o   16.977   5.4797   12.335   8.6327   14.153   13.857   11.182   11.036   18.913   6.9075   17.008   6.1714 1.905233 9.262802 
1 1 1   18    6   41 o   24.541   5.2063   26.826   10.092   13.746   21.744   30.417   11.393   20.740   8.3601   26.045   5.5371 -5.305178 10.02747 
1 1 1   18    6   42 o   35.762   3.3691   53.862   9.7056   44.866   16.382   58.726   12.048   31.216   6.6423   37.099   4.0495 -5.882858 7.779388 
1 1 1   18    6   43 o   92.508   2.2018  352.630   16.603  391.107   25.430  324.041   21.920   96.771   3.2283   88.187   3.0540 8.583588 4.443923 
1 1 1   18    6   44 o   27.501   4.9981   33.459   10.792   37.653   25.177   32.515   11.945   27.590   9.3747   26.837   5.6396 0.7528839 10.94029 
1 1 1   18    6   45 o   13.607   5.6330   3.3704   10.201   31.887   23.713  -3.1049   11.300   25.771   9.0807   12.320   5.5053 13.45026 10.61917 
1 1 1   18    6   46 o   62.587   2.6228  162.664   13.351  200.676   30.123  153.372   14.894   67.469   5.5256   60.585   3.0255 6.884041 6.299696 
1 1 1   18    6   47 o   26.747   6.0795   32.979   12.954   64.427   23.876   19.862   15.420   36.155   8.2800   21.074   7.3301 15.08109 11.05843 
1 1 1   18    6   48 f   30.602   4.8415   41.323   11.676   44.585   17.036   38.434   16.034   30.667   6.9733   28.428   6.9729 2.238894 9.861468 
1 1 1   18    6   49 o   27.099   5.3126   33.114   11.316   24.467   16.208   41.338   15.806   22.773   7.5187   29.609   6.7050 -6.836180 10.07414 
1 1 1   18    6   50 f   16.108   5.7015   10.629   9.3565   10.513   15.360   10.698   11.798   17.774   7.0730   16.804   6.3287 0.9700909 9.491053 
1 1 1   18    6   51 o   11.409   5.0437  -1.6042   9.2306 -17.9621   15.120   8.1156   11.655   11.590   5.5587   15.774   6.1974 -4.183163 8.325040 
1 1 1   18    6   52 o   83.255   2.1226  286.451   14.393  302.723   23.954  277.256   18.006   84.615   3.4804   81.553   2.7124 3.062569 4.412512 
1 1 1   18    6   53 o   14.462   5.6150   6.9023   9.4747   11.904   16.439   4.4147   11.594   18.388   7.3174   14.459   5.9972 3.929086 9.461047 
1 1 1   18    6   54 o   27.822   4.5088   34.203   9.8757   63.209   17.505   20.661   11.961   37.060   5.9995   20.979   6.4063 16.08043 8.776921 
1 1 1   18    6   55 o   28.390   4.4913   35.613   10.048   20.577   17.333   43.225   12.332   21.201   7.7281   31.039   5.0474 -9.837523 9.230380 
1 1 1   18    6   56 o   24.605   5.1026   27.553   9.8981   7.8876   17.304   37.117   12.067   17.415   7.2831   28.503   5.3913 -11.08735 9.061455 
1 1 1   18    6   57 o   39.451   3.3934   66.309   10.806   70.824   18.690   64.042   13.245   39.048   6.0687   38.261   4.3224 0.7874985 7.450636 
1 1 1   18    6   58 f   18.771   5.8060   16.329   9.7856   21.164   17.165   14.002   11.911   21.184   7.6953   17.911   6.4228 3.272987 10.02342 
1 1 1   18    6   59 o   24.247   5.1456   27.015   9.8549   17.403   17.095   31.799   12.061   19.893   7.5891   25.975   5.8385 -6.081865 9.575070 
1 1 1   18    6   60 o   48.068   2.9014   97.454   11.316   98.447   19.357   96.939   13.947   46.664   5.1759   47.494   3.6299 -0.8298683 6.321870 
1 1 1   18    6   61 o   35.443   3.6893   54.403   10.503   32.221   17.255   67.460   13.238   24.883   7.7119   39.169   4.2123 -14.28668 8.787343 
1 1 1   18    6   62 o   13.308   5.8329   0.5497   12.101 -11.7667   23.131   5.1904   14.199   15.367   7.2238   15.383   6.5241 -0.1653385E-01 9.733782 
1 1 1   18    6   63 o   20.122   6.5356   19.846   12.269   31.402   24.110   15.808   14.252   23.811   9.0293   18.631   6.9686 5.180161 11.40564 
1 1 1   18    6   64 o   19.129   6.4999   17.728   12.103   60.525   24.124   3.3314   13.992   32.562   8.8563   14.704   6.3600 17.85817 10.90344 
1 1 1   18    6   65 o   25.040   5.7448   30.364   11.477   34.451   18.860   27.961   14.462   24.877   8.1049   23.174   7.0380 1.702929 10.73419 
1 1 1   18    6   66 o   24.971   8.1944   35.434   19.263   35.434   19.263   0.0000   0.0000   24.971   8.1944  ?   ?  0.000000 8.194361 
1 1 1   18    6   67 o   22.579   6.0563   25.569   11.376   56.800   19.267   8.8544   14.095   32.614   7.4154   16.014   6.6246 16.60060 9.943549 
1 1 1   18    6   68 o   11.005   5.1131  -6.0544   11.043  -2.0343   18.367  -8.3302   13.819   14.795   6.7722   11.954   5.6082 2.840456 8.792862 
1 1 1   18    6   69 o   19.434   6.1815   19.198   11.015   14.824   17.736   21.945   14.055   18.186   7.4676   20.329   7.0017 -2.143488 10.23664 
1 1 1   18    6   71 o   26.072   6.7433   36.483   14.438   24.097   18.169   57.705   23.782   20.564   7.8289   29.914   9.0124 -9.349257 11.93793 
1 1 1   18    6   72 o   21.132   6.9484   24.827   13.847   34.201   17.869   10.734   21.909   23.775   7.8962   17.467   7.7437 6.308340 11.05958 
1 1 1   18    6   73 o   16.216   6.6140   11.538   13.796   12.392   17.414   10.098   22.609   17.003   7.2186   17.299   7.7545 -0.2965984 10.59441 
1 1 1   18    6   74 o   19.823   6.1638   21.011   11.013   20.975   17.851   21.033   13.993   19.166   7.6257   19.364   6.9594 -0.1982746 10.32400 
1 1 1   18    6   75 o   13.200   5.6700   4.2514   10.971   2.2158   17.838   5.4899   13.914   14.783   6.7312   14.439   6.2930 0.3439522 9.214696 
1 1 1   18    6   76 o   13.087   5.8276   1.8773   12.547   25.001   17.332 -23.5832   18.187   20.201   7.6567   11.399   5.6056 8.801300 9.489345 
1 1 1   18    6   77 f   17.450   7.9791   11.310   25.407   11.310   25.407   0.0000   0.0000   17.450   7.9791  ?   ?  0.000000 7.979124 
1 1 1   18    6   78 o   20.359   8.7182   28.853   25.789   28.853   25.789   0.0000   0.0000   20.359   8.7182  ?   ?  0.000000 8.718163 
1 1 1   18    6   79 o   16.918   7.7519   9.8910   24.143   9.8910   24.143   0.0000   0.0000   16.918   7.7519  ?   ?  0.000000 7.751894 
1 1 1   18    6   80 o   24.916   9.3683   50.484   25.828   50.484   25.828   0.0000   0.0000   24.916   9.3683  ?   ?  0.000000 9.368307 
1 1 1   18    6   81 f   16.201   7.5603   5.7254   24.563   5.7254   24.563   0.0000   0.0000   16.201   7.5603  ?   ?  0.000000 7.560299 
1 1 1   18    6   82 o   16.905   7.8180   10.465   25.369   10.465   25.369   0.0000   0.0000   16.905   7.8180  ?   ?  0.000000 7.817978 
1 1 1   18    6   83 o   16.020   7.5421   4.2904   25.380   4.2904   25.380   0.0000   0.0000   16.020   7.5421  ?   ?  0.000000 7.542107 
1 1 1   18    6   84 o   20.122   8.6464   31.103   25.530   31.103   25.530   0.0000   0.0000   20.122   8.6464  ?   ?  0.000000 8.646391 
1 1 1   18    6   85 o   13.561   6.1069   3.1133   14.203   3.1133   14.203   0.0000   0.0000   13.561   6.1069  ?   ?  0.000000 6.106949 
1 1 1   18    6   86 o   13.987   6.2022   5.3292   14.061   5.3292   14.061   0.0000   0.0000   13.987   6.2022  ?   ?  0.000000 6.202157 
1 1 1   18    6   87 o   21.116   7.0648   28.013   14.299   28.013   14.299   0.0000   0.0000   21.116   7.0648  ?   ?  0.000000 7.064771 
1 1 1   18    6   88 o   16.047   6.6204   13.596   14.026   13.596   14.026   0.0000   0.0000   16.047   6.6204  ?   ?  0.000000 6.620430 
1 1 1   18    6   89 o   10.271   5.0047 -14.6159   13.535 -14.6159   13.535   0.0000   0.0000   10.271   5.0047  ?   ?  0.000000 5.004679 
1 1 1   18    6   90 o   10.422   5.0459 -12.2662   13.185 -12.2662   13.185   0.0000   0.0000   10.422   5.0459  ?   ?  0.000000 5.045946 
1 1 1   18    6   91 o   12.191   5.6842  -2.5678   13.836  -2.5678   13.836   0.0000   0.0000   12.191   5.6842  ?   ?  0.000000 5.684150 
1 1 1   18    6   92 o   13.778   6.4473  -0.2733   18.066  -0.2733   18.066   0.0000   0.0000   13.778   6.4473  ?   ?  0.000000 6.447255 
1 1 1   18    7  -88 o   11.961   5.9493 -28.3806   22.714 -28.3806   22.714   0.0000   0.0000   11.961   5.9493  ?   ?  0.000000 5.949298 
1 1 1   18    7  -87 o   19.195   8.3191   29.095   24.034   29.095   24.034   0.0000   0.0000   19.195   8.3191  ?   ?  0.000000 8.319122 
1 1 1   18    7  -86 o   13.362   6.5104 -12.0281   22.892 -12.0281   22.892   0.0000   0.0000   13.362   6.5104  ?   ?  0.000000 6.510387 
1 1 1   18    7  -85 o   14.261   6.8269  -2.9527   22.580  -2.9527   22.580   0.0000   0.0000   14.261   6.8269  ?   ?  0.000000 6.826934 
1 1 1   18    7  -84 o   23.077   9.0563   46.972   24.863   46.972   24.863   0.0000   0.0000   23.077   9.0563  ?   ?  0.000000 9.056318 
1 1 1   18    7  -83 o   11.331   5.6697 -35.0428   22.000 -35.0428   22.000   0.0000   0.0000   11.331   5.6697  ?   ?  0.000000 5.669714 
1 1 1   18    7  -82 o   16.014   7.4011   8.9149   22.685   8.9149   22.685   0.0000   0.0000   16.014   7.4011  ?   ?  0.000000 7.401100 
1 1 1   18    7  -81 o   12.190   6.0243 -24.1301   21.916 -24.1301   21.916   0.0000   0.0000   12.190   6.0243  ?   ?  0.000000 6.024308 
1 1 1   18    7  -80 o   11.659   5.7655 -24.8519   20.179 -24.8519   20.179   0.0000   0.0000   11.659   5.7655  ?   ?  0.000000 5.765515 
1 1 1   18    7  -79 o   18.238   7.9128   20.931   21.791   20.931   21.791   0.0000   0.0000   18.238   7.9128  ?   ?  0.000000 7.912793 
1 1 1   18    7  -78 o   18.253   7.8956   20.638   21.565   20.638   21.565   0.0000   0.0000   18.253   7.8956  ?   ?  0.000000 7.895556 
1 1 1   18    7  -77 o   14.053   6.6589  -4.0085   20.386  -4.0085   20.386   0.0000   0.0000   14.053   6.6589  ?   ?  0.000000 6.658877 
1 1 1   18    7  -76 o   13.263   6.4010 -11.6095   20.796   0.0000   0.0000 -11.6095   20.796  ?   ?    13.263   6.4010 0.000000 6.400988 
1 1 1   18    7  -75 o   12.487   5.8172  -3.5347   14.447 -11.9150   20.000   5.6085   20.891   13.057   6.2954   15.650   7.1857 -2.593344 9.553330 
1 1 1   18    7  -74 o   11.279   5.4168 -11.4881   14.468 -22.4196   20.250  -0.0894   20.678   12.087   5.9380   14.814   6.9209 -2.727467 9.119073 
1 1 1   18    7  -73 o   18.473   7.1266   19.655   15.191   41.747   21.713  -1.5243   21.260   24.112   8.6687   14.806   6.9492 9.305596 11.11031 
1 1 1   18    7  -72 o   9.7484   4.7627 -16.6612   12.491  -6.5143   15.718 -34.0481   20.576   12.550   5.9167   11.272   5.6157 1.277924 8.157442 
1 1 1   18    7  -71 o   12.309   5.6013  -1.0256   12.326  -1.8276   15.577   0.3178   20.160   13.311   6.1453   14.911   6.9212 -1.599813 9.255708 
1 1 1   18    7  -70 o   14.927   6.2313   8.6208   12.633 -15.6458   15.703   53.142   21.270   11.330   5.4906   28.380   8.5171 -17.05024 10.13344 
1 1 1   18    7  -69 o   10.759   4.7853  -0.2548   8.4341 -14.1903   15.598   5.5026   10.026   11.504   5.5498   13.271   5.5465 -1.767813 7.846286 
1 1 1   18    7  -68 o   22.298   5.3755   24.993   9.6555   39.294   20.331   20.828   10.972   24.432   8.4208   19.762   6.1536 4.669582 10.42966 
1 1 1   18    7  -67 o   15.098   5.5169   10.586   8.8413   7.4093   16.134   11.949   10.570   15.612   6.7908   15.909   5.9905 -0.2962713 9.055465 
1 1 1   18    7  -66 o   21.667   4.7955   22.519   8.2453   15.052   12.259   28.687   11.142   17.363   6.4693   23.737   5.8069 -6.374180 8.693219 
1 1 1   18    7  -65 f   22.411   4.5821   23.632   8.0880   20.646   11.868   26.223   11.052   19.825   6.4271   22.673   5.9179 -2.848309 8.736668 
1 1 1   18    7  -64 o   15.582   5.2946   11.396   8.0307   3.5911   11.846   18.033   10.924   13.618   5.8711   18.817   6.1707 -5.199662 8.517458 
1 1 1   18    7  -63 o   12.406   5.0019   4.7575   7.7862   9.6110   11.590   0.7647   10.512   15.489   6.1504   12.317   5.4161 3.172126 8.195208 
1 1 1   18    7  -62 o   10.357   4.6303  -1.4620   8.0034  -5.5521   12.013   1.8021   10.732   11.600   5.3698   12.746   5.5414 -1.146616 7.716400 
1 1 1   18    7  -61 o   11.186   4.9996  -1.3739   9.3249   4.7692   12.267  -9.7824   14.352   14.255   6.0555   11.983   5.6507 2.271576 8.282487 
1 1 1   18    7  -60 o   32.770   3.8840   47.539   10.173   38.661   13.526   59.103   15.438   27.947   6.1084   35.233   5.5592 -7.286552 8.259411 
1 1 1   18    7  -59 o   39.540   2.6661   66.146   8.5429   61.390   13.601   69.244   10.979   36.769   4.6411   40.011   3.3983 -3.241978 5.752244 
1 1 1   18    7  -58 o   11.712   4.8604   2.8644   7.6207   4.2656   12.119   1.9480   9.8009   14.223   6.0296   12.515   5.3671 1.708468 8.072247 
1 1 1   18    7  -57 o   34.314   3.0054   50.224   8.3215   48.834   13.289   51.121   10.673   32.480   5.1941   34.113   3.9089 -1.632545 6.500603 
1 1 1   18    7  -56 f   17.125   5.2246   13.604   7.9577   6.8731   12.598   18.072   10.265   15.282   6.2865   19.406   5.9363 -4.124529 8.646378 
1 1 1   18    7  -55 o   37.706   2.7400   59.991   8.3641   39.143   12.168   78.667   11.516   29.039   5.3371   42.874   3.3211 -13.83505 6.286025 
1 1 1   18    7  -54 o   11.534   4.8152   2.2864   7.5440  -6.2706   11.349   9.0601   10.098   11.357   5.2440   15.345   5.8377 -3.987930 7.847224 
1 1 1   18    7  -53 o   15.702   5.1476   10.935   7.6022   12.345   11.736   9.9159   9.9786   17.121   6.3391   15.711   5.8399 1.409903 8.619126 
1 1 1   18    7  -52 o   20.674   4.6775   19.435   7.6979   15.969   12.009   21.852   10.029   18.691   6.4706   21.548   5.6438 -2.856974 8.586089 
1 1 1   18    7  -51 f   20.380   4.6500   18.842   7.5537   23.079   11.800   15.900   9.8322   21.941   6.2793   18.542   5.8329 3.398928 8.570442 
1 1 1   18    7  -50 o   17.771   4.9826   14.405   7.5075   11.180   11.870   16.555   9.6923   16.807   6.3441   18.904   5.7657 -2.096914 8.572655 
1 1 1   18    7  -49 o   24.499   4.0047   26.317   7.7214   25.234   12.169   27.047   9.9901   22.990   6.3052   24.309   5.1990 -1.318647 8.172208 
1 1 1   18    7  -48 o   18.493   5.1633   15.624   8.0797   46.014   14.476   1.8718   9.7378   31.544   5.8448   12.706   5.3963 18.83860 7.954971 
1 1 1   18    7  -47 o   30.416   3.7797   39.919   9.1698   15.947   18.859   47.342   10.494   20.009   7.8767   33.066   3.9727 -13.05711 8.821869 
1 1 1   18    7  -46 f   15.590   5.4811   10.071   8.6359   16.849   18.770   8.2511   9.7265   20.288   7.8958   15.093   5.7323 5.195313 9.757183 
1 1 1   18    7  -45 o   15.268   5.5055   9.3080   8.7655   24.442   18.870   5.1439   9.8982   22.673   8.0896   13.952   5.6346 8.720664 9.858502 
1 1 1   18    7  -44 o   31.853   3.2863   43.094   8.4105   50.242   14.493   39.464   10.327   33.290   5.5354   30.024   4.3459 3.265692 7.037562 
1 1 1   18    7  -43 o   28.864   3.6440   35.759   8.3829   15.764   14.479   45.841   10.281   19.256   7.0563   32.596   3.9499 -13.33994 8.086648 
1 1 1   18    7  -42 o   27.618   3.7999   32.894   8.3281   38.711   14.149   29.810   10.302   28.830   6.2046   25.734   5.0913 3.096699 8.026134 
1 1 1   18    7  -41 o   50.119   2.4883  104.393   10.134  109.648   15.938  100.826   13.130   50.679   3.8878   48.891   3.3142 1.787655 5.108665 
1 1 1   18    7  -40 o   40.856   2.9936   70.039   9.9005   69.692   17.160   70.211   12.121   39.484   5.4791   40.603   3.7031 -1.118202 6.613110 
1 1 1   18    7  -39 o   28.599   3.8739   35.213   8.7989   27.531   13.918   40.326   11.356   24.130   6.7911   30.254   4.7619 -6.124868 8.294279 
1 1 1   18    7  -38 o   24.663   4.1757   26.525   8.0956   22.933   13.694   28.456   10.037   22.183   6.8694   25.216   5.0593 -3.033213 8.531447 
1 1 1   18    7  -37 o   35.444   3.1201   52.841   8.9226   56.602   16.812   51.366   10.528   35.287   6.0630   34.693   3.7840 0.5947571 7.146924 
1 1 1   18    7  -36 o   44.220   2.9940   81.814   10.728   92.565   18.434   76.307   13.193   46.037   4.9920   42.336   3.8655 3.700977 6.313641 
1 1 1   18    7  -35 f   60.781   2.4205  152.934   11.969  172.368   20.844  143.375   14.619   63.677   4.0365   58.571   3.0726 5.106003 5.072854 
1 1 1   18    7  -34 o   50.461   2.9850  106.300   12.223  110.495   19.187  103.435   15.857   50.582   4.7076   49.325   3.9776 1.256756 6.163002 
1 1 1   18    7  -33 o   34.691   3.3781   50.771   9.4318   34.165   14.990   61.655   12.135   27.051   6.8050   38.025   3.9737 -10.97452 7.880200 
1 1 1   18    7  -32 o   22.306   5.7388   22.569   10.495   18.991   13.582   27.871   16.532   20.690   6.8846   24.384   7.5472 -3.694157 10.21555 
1 1 1   18    7  -31 o   47.212   2.7226   92.620   10.433   92.456   15.290   92.763   14.272   46.630   4.0632   46.842   3.7695 -0.2119141 5.542469 
1 1 1   18    7  -30 o   28.892   4.2766   36.026   9.7681   33.903   14.534   37.775   13.192   27.087   6.6356   28.986   5.7859 -1.899361 8.803882 
1 1 1   18    7  -29 o   58.880   2.4321  143.309   11.648  154.967   17.136  133.297   15.881   60.797   3.4722   56.372   3.4729 4.424683 4.910905 
1 1 1   18    7  -28 o   11.166   4.7941   0.1181   7.8370 -14.5896   13.738   7.2139   9.5420   11.506   5.4563   14.834   5.6672 -3.328113 7.866925 
1 1 1   18    7  -27 o   84.767   1.7505  294.687   12.096  286.993   19.848  299.233   15.256   83.140   2.9332   85.239   2.1975 -2.099106 3.665073 
1 1 1   18    7  -26 o   17.077   5.2513   12.644   8.0191 -11.6871   14.128   24.207   9.7401   12.223   5.7136   23.319   5.2509 -11.09582 7.759963 
1 1 1   18    7  -25 o   44.853   2.6143   83.359   9.5171   83.937   18.320   83.145   11.138   43.974   5.2122   44.655   3.0786 -0.6813507 6.053497 
1 1 1   18    7  -24 o   58.793   2.2032  142.381   10.540  157.959   20.049  136.431   12.391   61.188   4.0423   57.413   2.6548 3.774372 4.836120 
1 1 1   18    7  -23 f   48.196   2.4697   95.994   9.6703   84.917   17.950  100.524   11.478   44.354   5.0547   49.204   2.8744 -4.850246 5.814829 
1 1 1   18    7  -22 o   29.387   3.5705   36.507   8.3778   31.054   15.048   38.957   10.085   26.003   6.9614   30.167   4.2163 -4.163952 8.138700 
1 1 1   18    7  -21 f   57.461   2.4203  136.220   11.311  121.363   16.947  148.153   15.189   53.710   3.8974   59.689   3.1327 -5.978733 5.000353 
1 1 1   18    7  -20 o   37.939   2.8729   59.839   8.8185   54.239   14.971   62.815   10.913   35.254   5.3797   38.697   3.4973 -3.442417 6.416565 
1 1 1   18    7  -19 o   49.488   2.3363  100.978   9.3981   88.906   16.106  107.210   11.572   45.768   4.3702   50.870   2.8016 -5.101688 5.191135 
1 1 1   18    7  -18 o   22.047   4.6380   21.240   8.0707   31.006   14.570   16.917   9.6938   26.100   6.7860   19.602   5.7162 6.497583 8.872731 
1 1 1   18    7  -17 o   22.715   4.5073   22.438   8.0511   32.368   14.646   18.138   9.6378   26.692   6.7332   20.247   5.6341 6.445127 8.779506 
1 1 1   18    7  -16 o   70.913   2.0752  206.576   11.983  211.722   25.672  205.143   13.549   70.792   4.4716   70.585   2.3582 0.2069626 5.055352 
1 1 1   18    7  -15 o   53.214   2.2465  116.561   9.7229  107.313   16.749  121.261   11.941   50.473   4.1062   54.157   2.7135 -3.683727 4.921834 
1 1 1   18    7  -14 o   15.808   5.2364   10.249   7.8594   4.8175   14.363   12.570   9.3900   16.210   6.6949   17.371   5.7223 -1.160414 8.807154 
1 1 1   18    7  -13 o   27.879   3.8030   32.952   8.4174   45.342   15.296   27.570   10.081   31.978   6.0904   25.086   5.1038 6.892580 7.946178 
1 1 1   18    7  -12 o   20.597   4.9442   18.633   8.1956  -1.8035   15.260   26.917   9.7157   14.921   6.5446   24.821   4.9753 -9.900636 8.221024 
1 1 1   18    7  -11 o   23.515   4.5004   23.954   8.3125   9.2353   15.457   29.943   9.8597   17.976   7.1140   26.276   4.7792 -8.300398 8.570286 
1 1 1   18    7  -10 o   63.363   2.3376  165.226   12.053  104.149   33.734  174.164   12.905   47.080   9.1197   65.029   2.4388 -17.94910 9.440117 
1 1 1   18    7   -9 o   22.432   4.6416   21.901   8.2073   20.025   14.909   22.718   9.8311   21.637   7.2133   22.681   5.3962 -1.043953 9.008358 
1 1 1   18    7   -8 o   32.502   3.2850   44.180   8.5841   38.468   15.104   46.905   10.433   29.290   6.4964   33.328   3.9148 -4.037472 7.584751 
1 1 1   18    7   -7 o   65.022   2.0289  173.548   10.741  173.301   18.362  173.676   13.243   64.525   3.5042   64.925   2.5069 -0.4002533 4.308617 
1 1 1   18    7   -6 o   14.189   5.2520   6.9074   8.0547   14.446   15.138   3.9305   9.5131   19.621   7.2110   13.648   5.5196 5.972747 9.081005 
1 1 1   18    7   -5 o   18.691   5.0080   15.279   7.7839   21.187   12.563   11.598   9.9169   21.903   6.5391   17.060   5.8812 4.842373 8.794758 
1 1 1   18    7   -4 o   44.718   2.4115   82.435   8.7576   76.725   13.523   86.559   11.493   42.736   3.9258   45.658   3.1065 -2.922607 5.006265 
1 1 1   18    7   -3 o   44.652   2.7640   82.480   10.011   78.198   13.569   87.596   14.831   43.157   3.8990   45.653   4.0265 -2.495262 5.604911 
1 1 1   18    7   -2 o   10.855   4.8260  -2.6924   8.5696  -0.4572   11.938  -5.0691   12.309   13.577   5.8736   12.627   5.6859 0.9492521 8.174925 
1 1 1   18    7   -1 f   14.487   5.4814   6.7572   8.8736   2.3556   12.198   11.705   12.932   14.523   6.0970   18.003   6.6564 -3.480198 9.026671 
1 1 1   18    7    0 o   28.240   3.8289   33.764   8.5874   34.225   12.687   33.375   11.666   27.843   5.7792   27.613   5.3765 0.2299366 7.893426 
1 1 1   18    7    1 f   12.221   5.0532   2.1342   8.1963  -9.3614   12.231   11.505   11.043   11.665   5.4064   17.346   6.1884 -5.680634 8.217381 
1 1 1   18    7    2 o   17.815   5.3666   13.662   8.4331   11.401   12.809   15.392   11.204   17.848   6.6199   19.108   6.2483 -1.259956 9.103000 
1 1 1   18    7    3 o   56.059   2.2350  129.230   10.193  119.856   14.853  137.573   14.013   53.667   3.4130   57.644   2.9925 -3.977776 4.539121 
1 1 1   18    7    4 o   48.632   2.4633   97.501   9.7331  100.834   14.379   94.681   13.223   49.142   3.6148   47.669   3.4258 1.472343 4.980292 
1 1 1   18    7    5 o   17.031   5.4295   12.209   8.4942   14.206   12.857   10.663   11.315   18.949   6.6857   17.073   6.2408 1.876270 9.145830 
1 1 1   18    7    6 o   42.461   3.1263   74.939   10.745   69.045   13.928   83.603   16.887   40.398   4.2955   44.324   4.7477 -3.925941 6.402451 
1 1 1   18    7    7 o   32.954   3.6014   45.624   9.5168   53.155   13.368   37.885   13.552   35.227   4.7783   29.276   5.8829 5.951038 7.578979 
1 1 1   18    7    8 o   15.532   5.6096   8.8826   9.1044   8.1695   12.929   9.5842   12.823   16.709   6.5385   17.168   6.5670 -0.4582729 9.267016 
1 1 1   18    7    9 o   50.676   2.2648  105.691   9.3321   97.634   14.466  111.434   12.213   48.310   3.7016   51.880   2.8996 -3.569935 4.702081 
1 1 1   18    7   10 o   54.539   2.1587  122.287   9.5782  130.932   14.887  116.180   12.512   56.130   3.2677   52.971   2.9089 3.159435 4.374878 
1 1 1   18    7   11 o   63.133   1.9622  163.571   10.086  179.248   15.787  152.760   13.110   65.811   2.9503   60.835   2.6500 4.975880 3.965696 
1 1 1   18    7   12 o   36.490   2.9011   55.315   8.5584   56.664   13.396   54.385   11.125   36.425   4.6152   35.921   3.8597 0.5035591 6.016456 
1 1 1   18    7   13 o   17.006   5.3393   12.289   8.2424 -11.4088   14.031   24.775   10.185   12.307   5.7333   23.679   5.3972 -11.37187 7.874040 
1 1 1   18    7   14 o   55.425   2.2066  126.373   9.9493  121.930   16.537  128.893   12.456   53.958   3.7838   55.835   2.7451 -1.877052 4.674713 
1 1 1   18    7   15 o   9.3458   4.3498  -6.8829   8.0470 -27.7206   13.873   3.6827   9.8786   9.9064   4.8762   13.723   5.5969 -3.816392 7.423106 
1 1 1   18    7   16 o   54.259   2.2528  121.196   9.9422  140.486   17.061  111.277   12.234   57.980   3.6281   51.814   2.9083 6.165451 4.649835 
1 1 1   18    7   17 o   81.646   2.2055  274.092   14.665  235.916   25.985  291.933   17.764   74.835   4.2775   84.123   2.5936 -9.287605 5.002363 
1 1 1   18    7   18 o   78.515   2.2362  253.586   14.297  227.835   25.308  265.657   17.327   73.542   4.2396   80.214   2.6536 -6.671745 5.001586 
1 1 1   18    7   19 o  103.382   1.8635  438.221   15.704  440.143   23.773  436.733   20.918  103.170   2.8295  102.964   2.4923 0.2058945 3.770629 
1 1 1   18    7   20 o   48.919   2.6626   99.034   10.577  112.801   16.797   89.986   13.617   51.738   4.0141   46.320   3.6354 5.417957 5.415644 
1 1 1   18    7   21 f   11.167   4.8365  -0.5317   8.1119   23.109   14.318 -11.7056   9.8440   22.683   7.0244   9.6283   4.5810 13.05447 8.386132 
1 1 1   18    7   22 o   39.896   2.8318   66.141   9.1494   77.805   15.733   60.180   11.247   42.656   4.5972   37.788   3.6985 4.867676 5.900274 
1 1 1   18    7   23 f   46.130   2.5203   88.010   9.4408   86.993   16.143   88.539   11.639   45.182   4.4405   46.093   3.1160 -0.9110107 5.424717 
1 1 1   18    7   24 o   10.593   4.7766  -3.8046   8.7224 -16.8821   18.317   0.0307   9.9193   13.547   6.3869   12.476   5.3755 1.071621 8.347910 
1 1 1   18    7   25 o   33.135   4.0145   46.755   10.622   52.033   19.281   44.456   12.728   33.522   7.2661   31.906   5.0626 1.616011 8.855839 
1 1 1   18    7   26 o   11.243   4.9361  -1.4487   8.6987 -12.9262   17.610   2.2559   10.005   13.786   6.4227   13.218   5.5336 0.5680113 8.477710 
1 1 1   18    7   27 o   11.350   4.9803  -1.3979   8.8453   10.188   17.657  -5.2795   10.220   18.743   7.5411   11.201   5.0983 7.542151 9.102837 
1 1 1   18    7   28 o   46.892   2.5183   91.048   9.5905   84.206   15.985   94.895   11.988   44.342   4.4839   47.685   3.1009 -3.342995 5.451701 
1 1 1   18    7   29 o   16.348   5.4585   11.179   8.5365   21.967   15.196   6.2043   10.319   22.104   7.2793   14.750   5.8203 7.353311 9.320130 
1 1 1   18    7   30 o   25.718   4.7083   29.007   9.5068   30.311   15.711   28.253   11.941   25.448   7.2333   24.933   5.9570 0.5144806 9.370521 
1 1 1   18    7   31 o   52.053   2.4323  112.107   10.292  103.598   18.252  116.074   12.462   49.092   4.6150   52.801   2.9067 -3.708950 5.454127 
1 1 1   18    7   32 o   22.280   4.9711   22.104   8.7986   30.959   16.223   18.415   10.473   25.620   7.3725   20.215   5.9542 5.404711 9.476563 
1 1 1   18    7   33 o   33.575   3.5066   47.707   9.4556   39.235   17.045   51.474   11.365   28.803   7.2625   34.661   4.1018 -5.857988 8.340794 
1 1 1   18    7   34 o   30.946   3.7283   40.824   9.2157   51.295   16.859   36.362   11.006   33.468   6.4130   28.746   4.8706 4.721880 8.052913 
1 1 1   18    7   35 f   15.324   5.5064   9.1310   8.7594   27.490   15.990   1.2590   10.470   24.137   7.4140   13.064   5.5736 11.07246 9.275352 
1 1 1   18    7   36 o   24.750   4.6498   27.028   9.0365   25.726   16.633   27.573   10.764   23.414   7.6102   24.680   5.4918 -1.266211 9.384840 
1 1 1   18    7   37 o   21.742   5.5252   21.513   9.8111   2.8737   23.787   25.334   10.770   18.693   8.1858   23.555   5.6764 -4.862030 9.961382 
1 1 1   18    7   38 o   15.925   5.7714   9.9434   9.6479   20.845   24.177   7.8786   10.522   22.633   8.9158   15.354   5.9291 7.279745 10.70730 
1 1 1   18    7   39 o   19.686   6.9129   16.917   13.734   42.857   24.298   4.7385   16.648   28.852   9.1814   16.667   7.0663 12.18487 11.58578 
1 1 1   18    7   40 o   61.559   2.5170  157.368   12.603  186.923   21.824  142.579   15.438   66.136   4.0679   58.220   3.2661 7.915321 5.216783 
1 1 1   18    7   41 o   17.535   6.3748   12.549   11.783   19.402   16.270   4.9915   17.087   20.891   7.5049   16.831   7.1484 4.059223 10.36450 
1 1 1   18    7   42 o   25.223   5.1464   28.718   10.222   30.853   16.846   27.474   12.861   25.120   7.5888   24.131   6.4247 0.9893284 9.943165 
1 1 1   18    7   43 o   21.198   5.7545   20.781   10.196   23.296   16.822   19.321   12.820   22.239   7.6600   20.461   6.6833 1.777950 10.16573 
1 1 1   18    7   44 o   17.324   5.8182   13.141   9.6970   26.538   23.096   10.274   10.684   23.645   8.8655   16.260   6.0432 7.384493 10.72926 
1 1 1   18    7   45 o   12.230   5.1668   1.8033   8.8482   3.4179   16.196   1.1165   10.564   16.022   6.8859   12.940   5.5612 3.082232 8.851097 
1 1 1   18    7   46 f   14.974   5.5840   8.4394   9.1372  -1.0938   17.542   11.989   10.704   15.515   6.9008   16.957   6.0877 -1.442365 9.202291 
1 1 1   18    7   47 o   28.168   4.1871   34.732   9.3221   35.799   17.417   34.304   11.036   26.770   7.6182   27.555   5.1010 -0.7848663 9.168295 
1 1 1   18    7   48 o   34.662   3.5551   51.426   9.9024   67.099   18.311   44.948   11.772   38.034   6.1132   31.839   4.6751 6.195318 7.695979 
1 1 1   18    7   49 o   41.963   3.0311   74.307   10.298   82.456   18.502   70.649   12.396   42.688   5.4408   40.523   3.7969 2.164871 6.634640 
1 1 1   18    7   50 o   15.944   5.6657   10.659   9.2471  -0.0376   17.611   14.731   10.866   15.634   6.9362   18.096   6.1585 -2.462247 9.275602 
1 1 1   18    7   51 f   35.768   3.4023   54.693   9.8006   66.071   18.878   50.495   11.467   37.311   6.4399   33.930   4.2382 3.381062 7.709385 
1 1 1   18    7   52 o   8.6992   4.1942 -12.1881   8.8748  -4.7722   17.098 -14.9229   10.383   14.441   6.5812   9.2511   4.4788 5.189960 7.960663 
1 1 1   18    7   53 o   14.055   5.5035   6.5875   9.1648  -1.0408   17.316   9.5556   10.802   15.198   6.8015   15.791   6.0304 -0.5929832 9.089853 
1 1 1   18    7   54 o   28.593   4.5224   36.628   10.190   16.260   17.458   47.155   12.551   19.423   7.5987   32.255   4.9297 -12.83168 9.057704 
1 1 1   18    7   55 o   12.898   5.3123   3.9338   9.0103   4.6975   16.928   3.6319   10.643   16.176   6.9964   13.542   5.6908 2.634072 9.018614 
1 1 1   18    7   56 f   27.096   4.8289   33.554   10.274   23.867   17.690   38.486   12.622   21.657   7.8196   28.543   5.6248 -6.886353 9.632463 
1 1 1   18    7   57 o   21.633   6.5659   23.414   12.590   83.720   25.948   4.8451   14.399   39.366   8.3456   15.258   6.5235 24.10843 10.59269 
1 1 1   18    7   58 o   16.171   6.3327   10.283   12.135 -12.6184   23.106   19.006   14.260   15.049   7.1186   19.665   7.0306 -4.616025 10.00523 
1 1 1   18    7   59 o   14.494   6.0627   5.5131   11.994   20.411   23.804   0.4437   13.885   20.692   8.5889   13.873   6.1569 6.819060 10.56769 
1 1 1   18    7   60 o   22.349   6.4350   25.447   12.356   3.9628   23.690   33.476   14.482   17.391   7.8541   25.357   6.8473 -7.965996 10.41985 
1 1 1   18    7   61 o   27.818   5.7052   37.688   12.502   25.674   23.889   42.220   14.672   21.552   8.7356   28.885   6.3998 -7.333158 10.82900 
1 1 1   18    7   62 o   19.340   6.2805   18.937   11.330   30.705   18.629   12.029   14.273   23.087   8.0551   16.915   6.7888 6.172075 10.53438 
1 1 1   18    7   63 o   22.836   6.0816   26.549   11.522   34.232   18.458   21.643   14.749   24.192   8.0250   20.152   7.1558 4.039934 10.75206 
1 1 1   18    7   64 o   15.475   6.0955   9.9195   11.300   3.5852   17.588   14.372   14.745   15.446   6.8876   17.558   6.9484 -2.111996 9.783628 
1 1 1   18    7   65 f   25.303   5.7128   32.012   11.503   28.313   17.611   34.764   15.191   22.005   7.8189   25.074   7.1080 -3.069529 10.56688 
1 1 1   18    7   66 o   10.260   4.8745  -9.3372   11.068  -6.0100   17.413 -11.5925   14.337   13.519   6.3271   11.479   5.4801 2.039842 8.370370 
1 1 1   18    7   67 o   10.857   5.0591  -5.6025   10.938 -25.1503   17.037   8.1033   14.266   10.933   5.3857   15.355   6.5268 -4.421892 8.461975 
1 1 1   18    7   68 o   25.926   5.6195   34.043   11.533   18.856   18.168   44.294   14.926   18.616   7.5911   28.712   6.5259 -10.09618 10.01054 
1 1 1   18    7   69 o   12.231   5.4400   0.8302   10.901 -20.9561   17.380   14.959   13.996   11.404   5.5815   17.161   6.7764 -5.756751 8.779051 
1 1 1   18    7   70 o   17.604   6.6291   16.539   12.943   13.372   17.905   20.005   18.732   17.035   7.2788   18.719   7.6793 -1.684214 10.58074 
1 1 1   18    7   71 o   12.160   5.7359  -7.0346   14.811  -9.7605   26.357  -5.7765   17.906   15.011   7.2349   13.402   6.3172 1.609256 9.604746 
1 1 1   18    7   72 o   15.226   7.3042  -6.8455   26.148  -6.8455   26.148   0.0000   0.0000   15.226   7.3042  ?   ?  0.000000 7.304164 
1 1 1   18    7   73 o   17.533   8.0192   12.705   25.686   12.705   25.686   0.0000   0.0000   17.533   8.0192  ?   ?  0.000000 8.019238 
1 1 1   18    7   74 o   20.264   8.8098   30.026   27.125   30.026   27.125   0.0000   0.0000   20.264   8.8098  ?   ?  0.000000 8.809823 
1 1 1   18    7   75 o   14.789   7.1146  -7.3626   25.211  -7.3626   25.211   0.0000   0.0000   14.789   7.1146  ?   ?  0.000000 7.114565 
1 1 1   18    7   76 o   16.021   7.5467   3.7382   25.471   3.7382   25.471   0.0000   0.0000   16.021   7.5467  ?   ?  0.000000 7.546700 
1 1 1   18    7   77 o   16.302   7.6083   6.9074   24.889   6.9074   24.889   0.0000   0.0000   16.302   7.6083  ?   ?  0.000000 7.608324 
1 1 1   18    7   78 o   13.762   6.7264 -16.0323   24.985 -16.0323   24.985   0.0000   0.0000   13.762   6.7264  ?   ?  0.000000 6.726397 
1 1 1   18    7   79 o   15.204   7.2643  -1.6787   25.296  -1.6787   25.296   0.0000   0.0000   15.204   7.2643  ?   ?  0.000000 7.264266 
1 1 1   18    7   80 o   19.665   8.5840   29.866   25.973   29.866   25.973   0.0000   0.0000   19.665   8.5840  ?   ?  0.000000 8.584031 
1 1 1   18    7   81 o   17.159   7.9145   14.677   25.755   14.677   25.755   0.0000   0.0000   17.159   7.9145  ?   ?  0.000000 7.914527 
1 1 1   18    7   82 o   25.137   9.5121   56.928   26.724   56.928   26.724   0.0000   0.0000   25.137   9.5121  ?   ?  0.000000 9.512092 
1 1 1   18    7   83 o   24.192   9.4089   53.628   26.640   53.628   26.640   0.0000   0.0000   24.192   9.4089  ?   ?  0.000000 9.408931 
1 1 1   18    7   84 o   14.679   7.0496  -2.7435   24.510  -2.7435   24.510   0.0000   0.0000   14.679   7.0496  ?   ?  0.000000 7.049597 
1 1 1   18    7   85 o   13.721   6.1713   4.5307   14.454   4.5307   14.454   0.0000   0.0000   13.721   6.1713  ?   ?  0.000000 6.171312 
1 1 1   18    7   86 o   10.280   5.0248 -15.6792   13.949 -15.6792   13.949   0.0000   0.0000   10.280   5.0248  ?   ?  0.000000 5.024799 
1 1 1   18    7   87 o   19.178   7.1357   24.004   14.905   24.004   14.905   0.0000   0.0000   19.178   7.1357  ?   ?  0.000000 7.135682 
1 1 1   18    7   88 o   14.846   6.7773   6.3294   18.232   6.3294   18.232   0.0000   0.0000   14.846   6.7773  ?   ?  0.000000 6.777349 
1 1 1   18    8  -83 o   15.580   7.2611   7.7706   22.541   7.7706   22.541   0.0000   0.0000   15.580   7.2611  ?   ?  0.000000 7.261056 
1 1 1   18    8  -82 o   25.026   9.1533   54.848   24.346   54.848   24.346   0.0000   0.0000   25.026   9.1533  ?   ?  0.000000 9.153289 
1 1 1   18    8  -81 o   24.887   9.1747   54.726   24.537   54.726   24.537   0.0000   0.0000   24.887   9.1747  ?   ?  0.000000 9.174689 
1 1 1   18    8  -80 o   14.051   6.7343  -3.5610   22.111  -3.5610   22.111   0.0000   0.0000   14.051   6.7343  ?   ?  0.000000 6.734302 
1 1 1   18    8  -79 o   14.289   6.8209  -2.1227   22.199  -2.1227   22.199   0.0000   0.0000   14.289   6.8209  ?   ?  0.000000 6.820887 
1 1 1   18    8  -78 o   11.457   5.6807 -25.5430   20.081 -25.5430   20.081   0.0000   0.0000   11.457   5.6807  ?   ?  0.000000 5.680746 
1 1 1   18    8  -77 o   15.619   7.1617   8.4273   20.659   8.4273   20.659   0.0000   0.0000   15.619   7.1617  ?   ?  0.000000 7.161750 
1 1 1   18    8  -76 o   20.330   8.5283   33.192   23.837   33.192   23.837   0.0000   0.0000   20.330   8.5283  ?   ?  0.000000 8.528308 
1 1 1   18    8  -75 o   17.552   7.1609   18.526   16.177   19.517   22.991   17.554   22.768   17.780   7.9047   17.429   7.7994 0.3511143 11.10472 
1 1 1   18    8  -74 o   14.415   6.4237   6.0389   15.273 -19.1011   20.663   36.315   22.675   12.312   6.0384   21.479   8.5785 -9.166495 10.49059 
1 1 1   18    8  -73 o   19.389   8.2433   26.907   22.763   0.0000   0.0000   26.907   22.763  ?   ?    19.389   8.2433 0.000000 8.243346 
1 1 1   18    8  -72 o   13.399   6.1142   1.3036   14.820   26.316   20.856 -24.2067   21.062   19.502   8.0621   12.026   5.9365 7.476089 10.01200 
1 1 1   18    8  -71 o   13.741   6.1729   3.4378   14.413  -9.2888   19.792   17.808   21.031   13.201   6.3388   17.671   7.7186 -4.469516 9.987857 
1 1 1   18    8  -70 f   10.655   5.1578 -13.4019   13.759  -9.3080   19.525 -17.4399   19.392   13.167   6.3153   12.214   5.9600 0.9532309 8.683581 
1 1 1   18    8  -69 o   15.634   6.6086   10.824   14.490   6.2232   20.101   15.801   20.906   15.588   7.1162   17.429   7.6521 -1.841130 10.44959 
1 1 1   18    8  -68 o   12.761   5.9011  -2.1351   14.448   0.7207   20.148  -5.1588   20.731   14.788   6.8829   14.104   6.6925 0.6842995 9.600211 
1 1 1   18    8  -67 o   10.659   5.1662 -14.4226   13.912 -20.0891   19.553  -8.6130   19.799   12.107   5.9245   13.468   6.4325 -1.360486 8.745066 
1 1 1   18    8  -66 o   20.279   6.0969   22.415   10.892   12.084   20.259   26.616   12.918   16.859   7.4617   21.558   6.6713 -4.698551 10.00921 
1 1 1   18    8  -65 o   12.745   5.4302   4.2800   9.9145   7.0986   16.366   2.6459   12.461   15.254   6.7309   13.182   5.8422 2.071946 8.912675 
1 1 1   18    8  -64 o   18.912   6.6522   20.017   12.722   14.833   16.503   27.610   19.972   17.201   7.1466   20.604   8.1075 -3.403492 10.80763 
1 1 1   18    8  -63 o   38.085   4.0886   66.692   12.495   45.681   17.227   90.011   18.149   27.800   7.4511   42.700   5.3299 -14.89960 9.161111 
1 1 1   18    8  -62 o   13.772   5.3092   8.0164   8.4265   9.0964   12.465   7.1075   11.435   15.101   6.2368   14.230   5.9336 0.8710032 8.608393 
1 1 1   18    8  -61 o   9.5645   4.4342  -4.4387   8.2372 -16.4078   11.811   6.8948   11.494   9.5246   4.6486   14.243   5.9446 -4.718620 7.546362 
1 1 1   18    8  -60 o   12.773   5.1708   5.4633   8.3581   7.0696   12.141   4.0164   11.523   14.542   6.0923   13.451   5.7949 1.090174 8.408130 
1 1 1   18    8  -59 o   17.178   5.4941   14.616   8.6921   17.940   12.429   11.434   12.161   18.530   6.5700   16.048   6.3228 2.482813 9.118238 
1 1 1   18    8  -58 o   9.6447   4.4664  -4.6472   8.3227   0.0869   12.192  -8.7784   11.389   12.801   5.7194   10.571   4.9998 2.229129 7.596622 
1 1 1   18    8  -57 o   22.495   4.9608   24.231   8.8518   6.1779   12.710   41.236   12.335   14.639   6.1889   29.181   5.3842 -14.54147 8.203151 
1 1 1   18    8  -56 o   19.001   5.3523   17.685   8.6416   1.6347   12.746   31.337   11.756   13.484   5.9455   25.026   5.8655 -11.54227 8.351798 
1 1 1   18    8  -55 o   31.503   3.6296   43.788   9.1505   36.360   13.483   50.130   12.459   26.721   6.2945   32.860   4.7925 -6.138968 7.911305 
1 1 1   18    8  -54 o   32.333   3.5580   45.880   9.2226   21.501   13.631   66.462   12.524   20.311   6.8980   38.596   4.0407 -18.28497 7.994397 
1 1 1   18    8  -53 o   10.910   4.8258  -0.6651   8.4607  -1.6446   12.768   0.1018   11.297   12.851   5.7882   12.605   5.5758 0.2453918 8.037001 
1 1 1   18    8  -52 o   20.559   5.1566   20.134   8.6256   10.916   12.939   27.507   11.572   16.469   6.5116   23.559   6.0078 -7.090450 8.859775 
1 1 1   18    8  -51 o   21.366   5.3050   21.781   9.1968   38.355   15.976   13.566   11.247   27.095   7.1359   17.221   6.2328 9.873909 9.474684 
1 1 1   18    8  -50 o   25.738   6.3180   32.892   13.155   12.814   27.159   39.047   15.037   19.817   8.7103   27.796   6.7130 -7.979136 10.99697 
1 1 1   18    8  -49 o   11.670   5.1897  -1.2590   9.9159   17.019   18.602  -8.5140   11.720   19.532   7.7802   11.039   5.1743 8.492687 9.343699 
1 1 1   18    8  -48 o   19.319   5.4118   17.670   8.8605   25.823   13.233   11.044   11.929   22.686   6.6961   16.502   6.3285 6.184183 9.213438 
1 1 1   18    8  -47 o   24.008   4.9176   26.532   9.2999   21.003   13.599   31.390   12.747   20.657   6.8892   25.380   6.2124 -4.722128 9.276596 
1 1 1   18    8  -46 o   27.044   4.4754   32.811   9.5210   31.170   14.220   34.144   12.818   24.977   6.8022   26.666   6.0379 -1.689203 9.095428 
1 1 1   18    8  -45 o   21.061   5.3065   20.735   9.1046   9.4410   13.554   30.021   12.290   16.513   6.6197   24.986   6.0904 -8.473766 8.995217 
1 1 1   18    8  -44 o   12.463   5.0663   3.8590   8.0625   17.980   13.632  -3.7382   9.9989   19.620   6.8873   11.182   5.0713 8.437210 8.552965 
1 1 1   18    8  -43 o   14.876   5.4667   8.7887   8.7003   9.7726   16.611   8.4167   10.213   17.536   7.2166   15.189   5.8478 2.346459 9.288501 
1 1 1   18    8  -42 o   46.281   2.5522   89.564   9.5910   88.399   16.104   90.205   11.939   44.840   4.4651   46.119   3.1957 -1.279072 5.490906 
1 1 1   18    8  -41 o   49.323   2.4206  101.389   9.7026  113.975   16.344   94.540   12.057   51.400   3.9307   47.266   3.1473 4.134556 5.035469 
1 1 1   18    8  -40 o   21.240   4.9806   20.621   8.4728   34.980   14.697   13.472   10.369   26.833   6.7314   17.469   6.0142 9.364532 9.026763 
1 1 1   18    8  -39 o   32.187   3.3637   44.219   8.6953   49.219   14.800   41.583   10.745   32.663   5.7695   30.716   4.4187 1.947783 7.267201 
1 1 1   18    8  -38 o   56.804   2.2068  133.783   10.199  139.869   17.168  130.464   12.678   57.219   3.7008   55.809   2.7958 1.410221 4.638082 
1 1 1   18    8  -37 o   59.875   2.2959  148.781   11.185  175.871   17.722  130.849   14.419   64.441   3.3857   55.680   3.1902 8.760365 4.651903 
1 1 1   18    8  -36 o   28.502   4.3366   35.707   9.7583   46.713   14.691   27.016   13.054   31.802   5.8835   23.765   6.5358 8.037863 8.793897 
1 1 1   18    8  -35 o   37.272   3.6972   59.518   11.085   56.228   14.953   63.531   16.517   35.308   5.3639   37.422   5.5853 -2.113659 7.743859 
1 1 1   18    8  -34 o   59.995   2.6197  150.054   12.781  163.006   17.450  135.065   18.772   62.024   3.4651   55.983   4.1429 6.040443 5.401031 
1 1 1   18    8  -33 o   20.291   5.1970   18.801   8.6330   22.829   13.845   16.238   11.042   21.934   6.9246   18.937   6.2037 2.997274 9.297068 
1 1 1   18    8  -32 o   38.843   2.7950   63.220   8.7907   86.202   15.206   51.685   10.773   44.652   4.2282   34.658   3.8799 9.993446 5.738557 
1 1 1   18    8  -31 o   40.888   2.6853   69.852   8.9007   69.350   15.113   70.118   11.013   39.732   4.7609   40.693   3.3499 -0.9608612 5.821344 
1 1 1   18    8  -30 o   39.769   3.1499   66.666   10.128   73.247   15.210   61.424   13.575   40.939   4.6396   37.513   4.5310 3.426483 6.484983 
1 1 1   18    8  -29 o   48.497   2.3902   97.622   9.4196   98.959   16.080   96.923   11.622   47.972   4.1531   48.083   2.9799 -0.1113892 5.111563 
1 1 1   18    8  -28 o   24.507   4.6447   26.649   8.9393   38.184   14.234   19.136   11.487   28.642   6.2709   20.398   6.2873 8.243969 8.879992 
1 1 1   18    8  -27 o   25.710   4.2092   28.857   8.5166   29.014   16.132   28.797   10.028   24.544   7.4288   25.349   5.0306 -0.8050079 8.971821 
1 1 1   18    8  -26 f   44.552   2.6357   82.672   9.5292   94.047   18.065   78.287   11.217   46.394   4.8482   43.125   3.2139 3.269451 5.816769 
1 1 1   18    8  -25 o   22.862   4.6867   23.239   8.4405   24.607   16.554   22.758   9.8117   22.894   7.6002   22.363   5.4360 0.5305138 9.344152 
1 1 1   18    8  -24 f   25.864   4.2852   29.201   8.7183   14.604   17.488   34.029   10.057   19.669   7.6307   27.837   4.5921 -8.168375 8.905866 
1 1 1   18    8  -23 o   20.451   5.0824   18.837   8.4356   17.994   16.752   19.124   9.7639   20.618   7.5841   20.493   5.6589 0.1253624 9.462642 
1 1 1   18    8  -22 o   47.550   2.4376   93.760   9.4166   89.041   16.624   95.989   11.426   45.383   4.5554   47.929   2.9388 -2.546547 5.421052 
1 1 1   18    8  -21 o   20.270   4.9993   18.434   8.2078   27.446   15.041   14.613   9.7948   24.120   7.1437   18.208   5.8331 5.912140 9.222686 
1 1 1   18    8  -20 o   28.166   3.7517   33.960   8.3997   25.935   15.270   37.441   10.058   23.514   7.2492   29.377   4.3300 -5.862650 8.443946 
1 1 1   18    8  -19 o   24.334   4.4334   25.944   8.4700   31.880   17.339   24.084   9.7069   25.810   7.6767   23.139   5.2652 2.670389 9.308859 
1 1 1   18    8  -18 o   34.595   3.5929   50.754   9.9847   75.144   31.737   48.074   10.519   37.876   10.096   33.537   3.9218 4.339176 10.83116 
1 1 1   18    8  -17 o   29.166   5.2373   37.797   11.994   46.438   30.283   36.189   13.062   29.970   10.279   28.248   5.8646 1.721174 11.83446 
1 1 1   18    8  -16 o   45.493   2.8712   86.280   10.593   47.616   31.453   91.227   11.251   30.288   10.472   46.749   2.9677 -16.46021 10.88473 
1 1 1   18    8  -15 o   11.679   5.0110   0.3493   8.5511  -1.6703   20.056   0.7980   9.4534   16.709   7.4082   12.373   5.2879 4.335752 9.101772 
1 1 1   18    8  -14 o   39.637   2.7372   65.411   8.7895   88.532   15.971   55.366   10.527   45.455   4.3639   36.160   3.6201 9.294991 5.669981 
1 1 1   18    8  -13 o   38.685   3.0975   62.678   9.6860   63.972   21.807   62.360   10.811   36.864   7.5122   38.449   3.4873 -1.584625 8.282132 
1 1 1   18    8  -12 o   56.685   2.1780  132.533   10.045  130.240   17.457  133.669   12.283   55.480   3.8845   56.762   2.6620 -1.281265 4.709126 
1 1 1   18    8  -11 o   46.222   2.4674   88.490   9.2629  106.874   16.464   79.976   11.204   50.154   4.0620   43.708   3.1662 6.445438 5.150202 
1 1 1   18    8  -10 o   25.486   4.3555   28.247   8.7237   46.929   17.506   22.075   10.062   31.786   6.9505   22.114   5.5823 9.671988 8.914645 
1 1 1   18    8   -9 o   8.5302   4.0681  -9.7188   7.8571 -18.2302   14.279  -6.0226   9.4097   11.237   5.3926   10.469   4.8124 0.7685318 7.227682 
1 1 1   18    8   -8 o   54.274   2.2615  121.597   9.9830  110.275   17.211  127.337   12.255   50.902   4.1848   55.386   2.7228 -4.483936 4.992667 
1 1 1   18    8   -7 o   30.044   3.6229   38.329   8.6937   35.337   15.068   39.822   10.644   27.612   6.7519   30.342   4.4345 -2.729939 8.077927 
1 1 1   18    8   -6 f   28.491   3.5646   34.469   8.0978   38.838   12.695   31.472   10.515   29.539   5.4739   26.700   5.0151 2.838692 7.423989 
1 1 1   18    8   -5 o   13.561   5.2301   5.6835   8.1799   7.0706   12.411   4.6183   10.876   15.920   6.3506   14.425   5.8767 1.495192 8.652480 
1 1 1   18    8   -4 o   21.355   4.7122   20.156   7.9824   19.150   12.364   20.875   10.453   20.694   6.5451   21.490   5.8232 -0.7956524 8.760595 
1 1 1   18    8   -3 o   24.164   4.2308   25.342   8.0302   26.034   12.417   24.844   10.528   23.851   6.2956   23.488   5.5817 0.3628883 8.413687 
1 1 1   18    8   -2 o   75.238   1.8770  232.448   11.511  238.138   18.673  228.961   14.620   75.644   3.0345   74.454   2.4121 1.189636 3.876420 
1 1 1   18    8   -1 f   44.118   2.5010   80.630   8.9573   97.238   14.008   69.141   11.650   48.063   3.6016   40.501   3.5653 7.562546 5.067855 
1 1 1   18    8    0 o   30.268   3.8898   39.100   9.3755   37.609   13.188   40.624   13.331   28.934   5.7939   30.172   5.6271 -1.238466 8.076773 
1 1 1   18    8    1 f   22.299   5.0419   22.121   8.9488   30.231   12.575   13.801   12.737   25.774   6.0839   18.503   6.6411 7.270380 9.006564 
1 1 1   18    8    2 o   49.329   2.5826  100.846   10.349   98.239   14.374  103.652   14.911   48.277   3.6804   49.580   3.7166 -1.302986 5.230498 
1 1 1   18    8    3 o   31.554   3.5578   42.153   8.9916   44.258   13.230   40.347   12.258   31.659   5.3146   30.266   5.1529 1.393047 7.402544 
1 1 1   18    8    4 o   63.194   2.1217  164.508   10.914  187.535   15.671  142.824   15.208   67.186   2.8681   58.477   3.2027 8.709259 4.299192 
1 1 1   18    8    5 o   51.164   2.4372  108.286   10.135  123.385   14.714   94.653   13.981   54.279   3.3418   47.391   3.6472 6.887856 4.946696 
1 1 1   18    8    6 f   12.514   5.1857   2.4854   8.6566   2.0414   12.808   2.8588   11.745   14.539   6.1824   14.268   5.9859 0.2710705 8.605402 
1 1 1   18    8    7 o   45.740   2.6202   86.807   9.7285   81.052   14.110   92.022   13.432   43.677   4.0077   46.759   3.5505 -3.081673 5.354198 
1 1 1   18    8    8 o   62.403   2.1594  160.514   10.968  157.277   15.579  163.695   15.444   61.397   3.1231   62.681   3.0316 -1.284824 4.352501 
1 1 1   18    8    9 o   41.879   2.8554   73.077   9.6894   71.896   14.159   74.118   13.288   40.981   4.3028   41.770   3.9495 -0.7893028 5.840590 
1 1 1   18    8   10 o   39.025   3.0058   63.656   9.4882   78.586   14.008   51.000   12.897   42.974   4.0465   34.261   4.7454 8.713463 6.236407 
1 1 1   18    8   11 o   13.757   5.3565   5.6652   8.6418   5.4398   12.621   5.8642   11.858   15.452   6.3170   15.267   6.1666 0.1844292 8.827906 
1 1 1   18    8   12 o   32.083   3.2525   43.347   8.3888   50.907   13.275   38.322   10.824   34.145   4.9106   29.662   4.6275 4.482981 6.747412 
1 1 1   18    8   13 o   30.795   3.4418   40.129   8.4921   37.541   13.580   41.791   10.883   28.770   5.9856   31.078   4.4202 -2.308659 7.440840 
1 1 1   18    8   14 o   55.054   2.1747  125.045   9.7403  124.241   15.362  125.586   12.596   54.367   3.4847   54.948   2.8216 -0.5811462 4.483835 
1 1 1   18    8   15 o   8.6895   4.1208  -8.8388   7.8380   1.3951   12.791 -14.9926   9.9184   14.314   6.1348   9.0685   4.3873 5.245320 7.542191 
1 1 1   18    8   16 o   11.188   4.8106   0.1302   7.9120   1.2613   12.649  -0.5968   10.141   14.202   6.0941   12.344   5.3763 1.858435 8.126635 
1 1 1   18    8   17 o   9.6669   4.4488  -5.3657   8.0723  -3.5725   13.643  -6.3316   10.013   13.490   6.0371   10.777   4.9578 2.713333 7.811996 
1 1 1   18    8   18 o   8.8431   4.2287 -10.9391   8.6110 -12.6573   13.998  -9.8930   10.922   11.908   5.6047   10.609   4.9799 1.299334 7.497447 
1 1 1   18    8   19 o   33.329   3.8614   47.441   10.297   42.049   19.203   49.617   12.199   29.468   7.8528   33.810   4.5410 -4.342026 9.071184 
1 1 1   18    8   20 o   51.209   2.8156  109.251   11.708  112.696   22.181  107.921   13.785   50.546   5.4707   50.666   3.3566 -0.1199493 6.418340 
1 1 1   18    8   21 o   16.871   5.8448   11.843   9.7995   17.119   18.938   9.9145   11.452   20.799   7.9745   16.505   6.2310 4.294117 10.12016 
1 1 1   18    8   22 o   19.987   5.9103   18.133   10.302   27.107   14.996   10.112   14.177   23.960   7.1423   17.420   6.8378 6.540665 9.887737 
1 1 1   18    8   23 o   19.232   5.4906   16.707   9.0327   22.103   14.540   13.316   11.527   21.883   7.1155   17.877   6.3282 4.005278 9.522473 
1 1 1   18    8   24 f   47.696   2.7331   94.804   10.582   74.316   16.285  109.773   13.920   41.175   4.9513   51.053   3.3637 -9.877750 5.985816 
1 1 1   18    8   25 o   15.395   5.7787   8.6196   9.8186   15.396   19.149   6.2024   11.436   20.243   7.9467   15.089   6.0696 5.154463 9.999517 
1 1 1   18    8   26 f   12.153   5.1941   0.9250   9.1213 -13.7525   15.466   8.7533   11.295   12.430   5.8629   15.945   6.1468 -3.514449 8.494500 
1 1 1   18    8   27 o   60.617   2.4218  152.383   11.943  185.043   20.308  135.117   14.766   66.006   3.7904   56.706   3.2075 9.300034 4.965406 
1 1 1   18    8   28 o   39.714   3.2462   66.551   10.417   54.647   18.126   72.422   12.730   34.102   6.7594   41.167   3.8376 -7.065193 7.772830 
1 1 1   18    8   29 o   37.786   3.7152   60.957   11.296   24.208   24.821   70.556   12.685   23.371   9.0840   40.595   3.8807 -17.22422 9.878237 
1 1 1   18    8   30 o   19.296   6.4005   16.768   11.741   55.511   24.145   4.7695   13.437   32.786   8.8361   15.381   6.4241 17.40504 10.92454 
1 1 1   18    8   31 o   15.221   5.8847   7.8886   10.374   2.0358   23.235   9.3457   11.593   18.139   8.0112   16.194   6.2315 1.944637 10.14946 
1 1 1   18    8   32 o   15.744   5.7249   9.8388   9.5036   15.261   16.637   7.2124   11.579   19.480   7.4729   15.400   6.1369 4.080145 9.669843 
1 1 1   18    8   33 o   14.402   5.5995   6.7944   9.4327  -6.0962   16.340   13.237   11.552   14.067   6.4197   17.692   6.3275 -3.624460 9.013855 
1 1 1   18    8   34 o   26.626   4.3798   31.240   9.1759   41.197   17.284   27.333   10.828   28.986   7.3159   24.345   5.5763 4.640394 9.198783 
1 1 1   18    8   35 o   37.053   3.7084   58.842   11.050   89.400   19.128   43.535   13.538   44.651   5.3626   30.870   5.5855 13.78086 7.743046 
1 1 1   18    8   36 o   48.276   2.9457   97.911   11.536   97.511   19.536   98.125   14.295   46.737   5.2166   47.928   3.6874 -1.190414 6.388239 
1 1 1   18    8   37 o   18.598   5.9222   15.788   10.108   6.2446   16.656   21.352   12.718   16.823   7.0971   21.230   6.6275 -4.406652 9.710386 
1 1 1   18    8   38 o   35.209   3.3689   52.805   9.5512   74.306   18.027   44.414   11.262   40.408   5.6252   31.746   4.4759 8.662125 7.188679 
1 1 1   18    8   39 o   20.687   5.3871   19.794   9.1726   28.173   16.971   16.336   10.902   23.793   7.6833   18.873   6.1631 4.919992 9.849717 
1 1 1   18    8   40 o   56.516   2.3901  132.919   10.986  153.458   20.369  124.493   13.046   59.465   4.2298   54.398   2.9532 5.066837 5.158715 
1 1 1   18    8   41 o   36.035   3.3477   55.386   9.7212   34.001   17.685   64.646   11.637   25.822   7.7700   38.752   3.7299 -12.93022 8.618824 
1 1 1   18    8   42 o   10.043   4.7473  -9.8027   10.241 -17.5578   16.481  -4.9250   13.071   12.171   5.8281   12.621   5.7526 -0.4498072 8.188938 
1 1 1   18    8   43 o   39.428   3.4847   66.596   11.084   94.714   18.611   51.141   13.798   45.919   5.0557   33.521   5.2197 12.39846 7.266750 
1 1 1   18    8   44 o   14.943   5.8234   7.8356   10.221   11.100   17.037   6.0002   12.775   17.968   7.3419   15.225   6.3034 2.743426 9.676594 
1 1 1   18    8   45 o   17.424   5.9805   13.705   10.251   12.503   16.895   14.405   12.897   18.267   7.3670   18.100   6.6550 0.1672630 9.927850 
1 1 1   18    8   46 o   11.134   4.9821  -2.1364   9.2874  -9.2092   17.002   0.8717   11.088   13.528   6.3053   12.942   5.6294 0.5866156 8.452644 
1 1 1   18    8   47 o   27.815   4.7501   35.131   10.384   43.167   24.653   33.398   11.449   27.281   9.2766   26.692   5.4464 0.5888805 10.75726 
1 1 1   18    8   48 o   33.944   3.6936   50.144   10.055   47.974   18.540   51.048   11.968   30.352   7.5298   33.784   4.4545 -3.431673 8.748733 
1 1 1   18    8   49 o   23.055   5.5987   25.455   10.415   56.248   18.166   10.376   12.712   33.477   6.8871   16.404   6.4641 17.07320 9.445415 
1 1 1   18    8   50 o   17.683   5.9837   14.714   10.256   35.131   17.775   4.5233   12.557   25.447   7.8170   14.471   6.1362 10.97657 9.937716 
1 1 1   18    8   51 o   23.666   6.3378   28.093   12.470   52.192   25.167   20.251   14.356   29.227   9.3489   20.073   7.0662 9.153761 11.71895 
1 1 1   18    8   52 o   20.310   6.2451   20.628   11.342 -14.3044   23.432   31.316   12.961   14.812   7.0532   24.919   6.3604 -10.10626 9.497458 
1 1 1   18    8   53 o   34.318   4.2854   53.029   11.727   52.256   24.654   53.255   13.332   28.955   9.2521   33.857   4.9795 -4.901920 10.50692 
1 1 1   18    8   54 o   12.051   5.3812  -0.9286   10.776   8.1693   24.300  -3.1557   12.023   18.031   8.0642   12.128   5.5239 5.903131 9.774688 
1 1 1   18    8   55 o   24.770   5.7289   30.315   11.337   7.6741   24.230   36.660   12.827   17.832   8.0077   27.119   5.9651 -9.287430 9.985265 
1 1 1   18    8   56 o   36.583   4.0656   60.132   11.919   72.095   26.629   57.135   13.329   33.684   9.3620   35.046   4.7912 -1.362728 10.51680 
1 1 1   18    8   57 o   22.017   6.0229   24.786   11.120   12.509   23.878   28.185   12.565   18.393   8.1225   23.188   6.4259 -4.794968 10.35697 
1 1 1   18    8   58 o   22.395   5.9833   25.705   11.130   28.824   24.390   24.885   12.509   21.620   8.8031   21.614   6.5415 0.6433487E-02 10.96755 
1 1 1   18    8   59 o   18.751   5.9534   18.038   10.221   11.778   17.854   21.090   12.466   17.109   7.2880   19.844   6.5956 -2.735634 9.829409 
1 1 1   18    8   60 o   16.365   5.9290   13.074   10.181   23.321   17.567   7.8922   12.493   20.083   7.6853   14.883   6.2036 5.199920 9.876703 
1 1 1   18    8   61 o   19.433   5.9377   19.770   10.273   5.1484   18.300   26.497   12.414   15.559   6.9754   22.048   6.4796 -6.489100 9.520535 
1 1 1   18    8   62 o   10.701   4.9273  -3.5891   9.9209   5.4660   17.326  -8.0066   12.101   15.304   6.8293   10.915   5.1596 4.389592 8.559258 
1 1 1   18    8   63 o   11.080   5.0102  -1.3730   9.6751   18.581   16.985 -10.9581   11.772   18.323   7.3876   10.236   4.9079 8.086898 8.869314 
1 1 1   18    8   64 o   17.776   6.1919   16.892   11.005   58.023   26.762   8.5217   12.073   27.145   9.6393   14.737   6.1169 12.40766 11.41634 
1 1 1   18    8   65 o   12.002   5.5146  -2.3647   12.332 -43.5047   26.415   9.1013   13.945   12.323   6.1727   15.249   6.4663 -2.926300 8.939568 
1 1 1   18    8   66 o   26.945   5.9868   38.412   12.808   27.157   27.493   41.531   14.475   19.890   8.7523   27.370   6.5712 -7.479876 10.94458 
1 1 1   18    8   67 o   13.997   5.9863   6.3065   12.132   0.1858   25.807   8.0428   13.745   15.840   7.5017   14.858   6.3637 0.9819708 9.837291 
1 1 1   18    8   68 o   12.499   5.6173   0.8842   11.948 -21.4468   26.340   6.6700   13.407   13.762   6.7631   14.378   6.2226 -0.6163473 9.190207 
1 1 1   18    8   69 o   17.901   6.5254   18.039   12.358   13.189   27.294   19.289   13.860   17.482   8.0933   18.243   6.8619 -0.7611465 10.61068 
1 1 1   18    8   70 f   18.702   7.4474   21.671   17.040   44.500   28.175   8.5054   21.397   22.530   9.3473   16.092   7.3445 6.438080 11.88754 
1 1 1   18    8   71 o   15.434   6.7529   9.4217   16.155   5.4912   27.248   11.552   20.062   16.349   7.7327   16.392   7.3293 -0.4229736E-01 10.65429 
1 1 1   18    8   72 o   10.298   5.1204 -27.6561   16.762 -69.9843   26.487   0.6197   21.649   10.785   5.4895   14.873   6.9908 -4.088526 8.888550 
1 1 1   18    8   73 o   14.602   6.5712   5.6142   16.413  -8.1808   25.727   15.082   21.314   14.573   7.0542   17.058   7.5957 -2.484513 10.36612 
1 1 1   18    8   74 o   17.684   7.3520   18.837   17.481 -19.5239   25.228   54.265   24.245   13.410   6.5960   25.773   9.1723 -12.36310 11.29772 
1 1 1   18    8   75 o   11.698   5.6403 -11.3158   16.052 -35.9594   25.470   4.9216   20.674   12.224   6.1143   15.160   7.0273 -2.936067 9.314882 
1 1 1   18    8   76 o   14.573   6.5728   6.0012   16.526   41.501   25.486 -19.7581   21.709   21.817   8.9545   12.468   6.1296 9.349218 10.85151 
1 1 1   18    8   77 o   16.671   7.0296   15.589   16.328   0.4017   25.029   26.840   21.543   15.154   7.2364   19.163   8.0771 -4.009009 10.84464 
1 1 1   18    8   78 o   14.049   6.3955   4.1417   16.090  -2.4371   25.778   8.3404   20.594   14.902   7.1754   15.538   7.1341 -0.6356850 10.11838 
1 1 1   18    8   79 o   12.673   6.0026  -4.5113   16.530   21.268   25.710 -22.6782   21.583   17.788   8.0925   12.087   5.9744 5.701261 10.05890 
1 1 1   18    8   80 o   8.5506   4.3308 -40.7385   15.128 -49.3241   24.863 -35.6918   19.063   11.148   5.6356   10.314   5.1775 0.8340178 7.652834 
1 1 1   18    8   81 o   15.154   6.6649   10.158   15.923  -8.2274   24.919   22.845   20.701   14.059   6.8373   18.072   7.7760 -4.012874 10.35446 
1 1 1   18    9  -78 o   15.313   7.1221   7.2413   21.515   7.2413   21.515   0.0000   0.0000   15.313   7.1221  ?   ?  0.000000 7.122104 
1 1 1   18    9  -77 o   22.837   8.6545   44.030   22.141   44.030   22.141   0.0000   0.0000   22.837   8.6545  ?   ?  0.000000 8.654471 
1 1 1   18    9  -76 o   15.729   7.2111   10.682   20.934   10.682   20.934   0.0000   0.0000   15.729   7.2111  ?   ?  0.000000 7.211143 
1 1 1   18    9  -75 o   11.602   5.7370 -22.1221   19.976 -22.1221   19.976   0.0000   0.0000   11.602   5.7370  ?   ?  0.000000 5.737043 
1 1 1   18    9  -74 o   9.8374   4.9776 -46.0498   19.676 -46.0498   19.676   0.0000   0.0000   9.8374   4.9776  ?   ?  0.000000 4.977637 
1 1 1   18    9  -73 o   11.179   5.4232 -12.7343   15.423 -16.0616   20.892  -8.7491   22.864   12.465   6.1047   13.641   6.6140 -1.175591 9.000730 
1 1 1   18    9  -72 f   15.250   6.6626   10.385   15.679   41.855   22.069 -21.6884   22.279   22.598   8.6221   12.354   6.0998 10.24346 10.56164 
1 1 1   18    9  -71 o   15.390   6.6877   10.855   15.616   18.648   20.834   0.8634   23.590   17.386   7.6357   14.927   7.0991 2.458678 10.42597 
1 1 1   18    9  -70 o   16.893   7.6612   15.245   22.820   0.0000   0.0000   15.245   22.820  ?   ?    16.893   7.6612 0.000000 7.661175 
1 1 1   18    9  -69 o   12.823   5.9778  -1.8219   15.295  -4.1035   21.089   0.7099   22.215   13.949   6.6557   14.769   6.9843 -0.8203764 9.647692 
1 1 1   18    9  -68 o   14.878   6.5945   7.8871   15.880   9.7433   21.154   5.4903   24.038   15.979   7.2968   15.718   7.3809 0.2615347 10.37888 
1 1 1   18    9  -67 o   11.647   5.6017 -10.6519   15.603 -17.5889   21.126  -2.3276   23.143   12.569   6.1519   14.657   6.9877 -2.088322 9.309918 
1 1 1   18    9  -66 o   20.783   7.4416   28.263   15.983   10.250   21.997   48.405   23.261   16.265   7.4325   24.597   8.9546 -8.331762 11.63734 
1 1 1   18    9  -65 o   14.815   6.4890   7.9111   14.954   3.3892   19.598   14.213   23.136   14.843   6.8669   17.041   7.7224 -2.197243 10.33392 
1 1 1   18    9  -64 o   12.345   5.9998 -14.9198   19.109 -14.9198   19.109   0.0000   0.0000   12.345   5.9998  ?   ?  0.000000 5.999777 
1 1 1   18    9  -63 o   11.508   5.3986  -5.2137   12.803  -3.1382   19.171  -6.8845   17.201   13.865   6.5361   12.793   6.0777 1.072497 8.925192 
1 1 1   18    9  -62 o   10.751   5.1418  -9.7545   12.741   1.1372   19.949 -17.2578   16.558   14.721   6.8505   11.302   5.5135 3.418462 8.793641 
1 1 1   18    9  -61 o   10.227   4.9464 -12.9791   12.586  -3.7930   19.015 -20.1419   16.791   13.830   6.5163   11.103   5.4450 2.726601 8.491777 
1 1 1   18    9  -60 o   14.683   6.2706   7.8981   13.276  -6.8814   19.619   20.384   18.033   13.604   6.4712   18.492   7.5543 -4.887513 9.947061 
1 1 1   18    9  -59 o   24.276   5.3410   29.984   10.282   24.729   14.540   35.240   14.541   20.276   7.1135   24.558   6.9515 -4.282328 9.946092 
1 1 1   18    9  -58 o   26.227   5.0551   34.075   10.415   20.082   14.887   47.492   14.577   18.611   7.0863   29.792   6.2044 -11.18094 9.418576 
1 1 1   18    9  -57 o   11.093   4.8851   0.8041   8.5796  -1.3836   12.267   2.8990   12.004   12.185   5.5614   13.092   5.7713 -0.9067011 8.014780 
1 1 1   18    9  -56 o   13.414   5.3545   7.0730   8.8291   14.979   12.849   0.0010   12.153   16.989   6.5543   12.475   5.6305 4.514443 8.640654 
1 1 1   18    9  -55 f   34.001   3.5263   51.718   9.6317   41.261   13.935   61.285   13.328   27.770   6.3009   35.911   4.6629 -8.140957 7.838624 
1 1 1   18    9  -54 o   15.227   5.9777   10.384   10.835 -20.2956   27.453   16.045   11.792   14.435   7.0543   17.508   6.3755 -3.073150 9.508483 
1 1 1   18    9  -53 o   22.358   5.9608   26.147   11.061   85.832   28.070   15.175   12.035   35.532   9.5058   17.247   6.4131 18.28527 11.46677 
1 1 1   18    9  -52 o   11.006   4.9856  -1.9587   9.6299   3.2172   16.357  -4.7042   11.913   14.772   6.6107   11.522   5.3387 3.249462 8.497211 
1 1 1   18    9  -51 o   12.295   5.3322   2.1175   9.8871   2.1811   17.200   2.0861   12.083   14.885   6.7103   13.190   5.8033 1.695072 8.871716 
1 1 1   18    9  -50 o   16.527   5.8350   13.231   9.7947   3.6302   16.544   18.413   12.154   15.058   6.6994   18.795   6.5093 -3.736191 9.340914 
1 1 1   18    9  -49 o   11.566   5.1361  -0.2801   9.6782   1.8396   16.653  -1.3613   11.893   14.783   6.6385   12.347   5.5718 2.435358 8.666895 
1 1 1   18    9  -48 o   29.494   4.3159   39.794   10.069   48.787   17.673   35.472   12.252   29.838   7.3220   26.688   5.7983 3.149998 9.339747 
1 1 1   18    9  -47 o   19.224   5.7858   18.476   9.8053   14.227   17.019   20.587   11.997   17.900   7.3288   19.936   6.4618 -2.035364 9.770693 
1 1 1   18    9  -46 o   26.143   4.7619   31.927   9.7739   34.373   17.457   30.811   11.796   24.574   7.7778   24.833   5.9127 -0.2583656 9.770079 
1 1 1   18    9  -45 o   23.573   5.1760   26.576   9.6730   13.693   16.899   32.854   11.797   17.890   7.3113   25.861   5.7454 -7.970528 9.298643 
1 1 1   18    9  -44 o   31.972   3.8964   45.392   9.9452   53.866   17.483   41.339   12.092   32.339   6.8459   29.589   5.2033 2.750076 8.598923 
1 1 1   18    9  -43 o   33.103   3.5530   47.889   9.4374   51.605   14.885   45.391   12.204   32.688   5.7987   31.277   4.9513 1.410133 7.624951 
1 1 1   18    9  -42 o   14.001   5.3735   7.4460   8.6050   19.686   13.707  -0.5149   11.055   19.804   6.9096   12.384   5.4948 7.419813 8.828129 
1 1 1   18    9  -41 o   27.218   5.4932   35.251   11.767   53.611   14.579   0.9381   19.930   33.713   5.4942   16.065   7.2342 17.64832 9.084036 
1 1 1   18    9  -40 o   13.879   5.7139   5.2696   10.418  -3.6665   13.950   16.540   15.666   13.064   5.9502   18.927   7.2538 -5.862484 9.382022 
1 1 1   18    9  -39 o   32.184   4.5563   46.712   11.620   37.075   16.600   55.971   16.270   26.579   7.3934   34.093   6.0774 -7.514986 9.570641 
1 1 1   18    9  -38 o   24.446   4.6965   27.326   9.0188   29.181   14.424   26.136   11.556   23.903   6.9734   23.137   6.0575 0.7666550 9.236958 
1 1 1   18    9  -37 o   12.459   5.0961   3.8420   8.2187   17.170   14.015  -3.1444   10.147   19.135   6.9529   11.343   5.1299 7.791855 8.640584 
1 1 1   18    9  -36 o   36.799   3.0973   57.707   9.2046   69.489   17.489   53.193   10.825   38.524   5.7447   34.900   3.8701 3.623516 6.926717 
1 1 1   18    9  -35 o   39.878   2.8286   67.176   9.1350   80.062   15.704   60.585   11.231   42.374   4.6212   37.378   3.7361 4.995899 5.942530 
1 1 1   18    9  -34 o   17.423   5.2923   13.999   8.1774   6.1886   14.339   17.764   9.9549   15.777   6.6162   19.377   5.8293 -3.599326 8.817868 
1 1 1   18    9  -33 o   11.738   4.9342   2.0831   8.0052 -10.3708   13.986   8.1507   9.7624   12.000   5.6337   14.898   5.7220 -2.897331 8.029903 
1 1 1   18    9  -32 o   14.600   5.2681   8.6605   8.0273   12.475   14.014   6.7978   9.7930   17.666   6.8370   14.382   5.6716 3.283859 8.883231 
1 1 1   18    9  -31 o   37.593   2.9836   59.808   9.0679   60.920   15.507   59.230   11.178   36.519   5.3693   37.017   3.7566 -0.4985275 6.552931 
1 1 1   18    9  -30 o   36.668   3.0380   56.964   8.9992   68.868   15.516   50.930   11.047   39.174   4.9708   34.163   4.0453 5.010754 6.408878 
1 1 1   18    9  -29 o   34.237   3.3640   50.096   9.2672   45.166   14.936   53.182   11.817   30.915   6.1436   34.822   4.2510 -3.907673 7.470935 
1 1 1   18    9  -28 o   18.395   5.4647   15.602   8.7907   31.049   14.556   6.7324   11.029   25.127   6.8977   14.886   5.9701 10.24142 9.122518 
1 1 1   18    9  -27 o   22.894   5.5030   24.383   10.142   34.278   14.939   15.925   13.813   26.457   6.8679   18.985   6.9020 7.471855 9.736831 
1 1 1   18    9  -26 o   14.804   5.4713   8.4836   8.7357   2.0017   14.143   12.482   11.108   14.760   6.3895   17.170   6.1968 -2.409578 8.900892 
1 1 1   18    9  -25 o   33.143   3.2758   46.765   8.7343   24.796   14.989   58.060   10.747   22.552   7.2150   36.789   3.6312 -14.23661 8.077223 
1 1 1   18    9  -24 o   24.217   4.3987   26.062   8.3637   32.334   14.673   23.043   10.179   25.758   6.8644   22.242   5.6146 3.516056 8.868142 
1 1 1   18    9  -23 o   14.976   5.5372   8.6598   8.9491   2.4129   19.987   10.226   10.008   17.017   7.4763   15.979   5.8648 1.038006 9.502172 
1 1 1   18    9  -22 o   38.982   3.1104   64.230   9.8017   75.698   22.055   61.408   10.942   39.664   7.0811   37.890   3.5852 1.774265 7.937027 
1 1 1   18    9  -21 f   26.939   4.3094   31.963   9.1443   41.442   21.542   29.880   10.099   28.149   8.5976   25.712   4.9986 2.436575 9.945134 
1 1 1   18    9  -20 o   36.109   3.1332   55.169   9.1311   68.159   16.381   49.313   10.998   38.934   5.2990   33.694   4.0879 5.239613 6.692524 
1 1 1   18    9  -19 o   16.494   5.3738   11.988   8.2910   9.7572   14.865   12.995   9.9890   17.252   6.9268   17.255   5.9041 -0.3116608E-02 9.101595 
1 1 1   18    9  -18 o   25.790   4.2688   29.274   8.6603   45.273   15.549   22.079   10.427   31.003   6.3660   21.764   5.7806 9.238228 8.598938 
1 1 1   18    9  -17 o   23.495   4.6466   24.697   8.5838   22.139   15.260   25.881   10.382   21.632   7.2987   23.705   5.4822 -2.072924 9.128343 
1 1 1   18    9  -16 o   40.078   2.8431   67.406   9.2280   64.612   15.905   68.824   11.330   37.948   5.2850   40.210   3.4912 -2.261917 6.334036 
1 1 1   18    9  -15 o   41.068   2.8493   70.757   9.4792   61.198   16.531   75.439   11.570   36.654   5.7197   42.164   3.3951 -5.510136 6.651397 
1 1 1   18    9  -14 f   56.209   2.7549  132.030   12.584  122.937   20.526  137.507   15.929   52.920   4.8109   56.973   3.4460 -4.052914 5.917735 
1 1 1   18    9  -13 o   12.587   5.1974   3.0849   8.6535  -2.2169   16.900   4.9690   10.074   15.060   6.7310   13.974   5.6696 1.086269 8.800620 
1 1 1   18    9  -12 o   7.7933   3.8466 -18.2649   8.8348 -21.4586   20.809 -17.5627   9.7579   13.701   6.5577   8.5163   4.1711 5.184833 7.771797 
1 1 1   18    9  -11 o   41.198   3.1276   71.561   10.425   42.644   23.300   78.798   11.656   28.544   8.9791   43.143   3.3405 -14.59842 9.580360 
1 1 1   18    9  -10 o   31.185   3.9492   42.021   9.8144   46.665   22.453   40.924   10.912   30.036   8.6822   30.509   4.5248 -0.4722176 9.790481 
1 1 1   18    9   -9 o   19.573   5.7392   17.579   9.7487   4.2594   28.012   19.415   10.399   19.801   8.7685   20.487   5.9046 -0.6852608 10.57127 
1 1 1   18    9   -8 o   36.656   3.3484   56.979   9.8949   61.591   16.208   54.239   12.493   36.946   5.5536   35.246   4.4471 1.699600 7.114679 
1 1 1   18    9   -7 o   19.128   5.8103   16.693   9.8563   10.007   15.199   21.546   12.948   17.529   7.0158   21.439   6.6862 -3.909975 9.691572 
1 1 1   18    9   -6 o   64.429   2.3845  172.197   12.501  189.044   19.091  159.550   16.541   66.835   3.5165   61.517   3.3109 5.318336 4.829891 
1 1 1   18    9   -5 o   30.021   4.4171   39.472   10.487   34.016   15.847   43.722   13.987   26.497   7.1659   30.930   5.7596 -4.432526 9.193651 
1 1 1   18    9   -4 o   70.287   2.5928  205.518   14.830  225.860   20.113  181.286   21.952   73.175   3.3811   64.973   4.1667 8.202263 5.365993 
1 1 1   18    9   -3 o   12.084   5.1917   0.6728   9.2010   23.272   14.964 -13.0659   11.667   22.192   7.2186   10.427   4.9684 11.76497 8.763135 
1 1 1   18    9   -2 o   15.967   5.7441   10.258   9.5353 -16.7429   14.985   28.629   12.361   11.696   5.5888   24.740   6.1544 -13.04443 8.313348 
1 1 1   18    9   -1 o   43.856   2.9796   80.727   10.589   60.525   16.525   94.800   13.792   36.532   5.7381   47.230   3.6097 -10.69834 6.779074 
1 1 1   18    9    0 o   27.169   4.5463   32.566   9.7133   22.443   15.402   39.250   12.516   21.885   7.3324   29.458   5.4116 -7.573067 9.113134 
1 1 1   18    9    1 o   16.014   5.4795   10.834   8.6038  -1.3394   15.508   16.248   10.341   14.711   6.5187   18.938   5.9853 -4.227016 8.849708 
1 1 1   18    9    2 o   38.197   2.8119   61.120   8.6939   64.622   13.879   58.858   11.153   38.495   4.5082   37.099   3.7392 1.396446 5.857038 
1 1 1   18    9    3 o   14.991   5.2683   9.1300   7.9777   11.476   12.730   7.6129   10.237   17.329   6.5634   15.072   5.8408 2.256830 8.785976 
1 1 1   18    9    4 o   21.166   4.9203   20.224   8.3277   6.0241   13.089   29.881   10.794   15.611   6.4133   25.650   5.3366 -10.03922 8.343244 
1 1 1   18    9    5 o   21.613   4.7724   20.977   8.1829   10.426   13.132   27.674   10.462   17.063   6.6144   24.651   5.3598 -7.587698 8.513429 
1 1 1   18    9    6 o   26.771   4.0265   31.154   8.5151   41.596   13.615   24.445   10.913   30.153   5.7489   22.964   5.8226 7.188944 8.182437 
1 1 1   18    9    7 o   68.176   1.9552  191.699   10.854  189.225   16.631  193.535   14.326   67.174   3.0452   68.205   2.5814 -1.031334 3.992114 
1 1 1   18    9    8 o   50.922   2.3460  107.603   9.7118  110.261   15.208  105.772   12.621   50.891   3.6910   50.154   3.1022 0.7367210 4.821538 
1 1 1   18    9    9 o   30.696   3.8172   40.572   9.3457   56.696   13.819   26.983   12.687   35.820   4.8580   23.898   6.3893 11.92165 8.026421 
1 1 1   18    9   10 o   10.829   4.8565  -2.8294   8.8793   11.014   13.291 -13.9880   11.933   17.287   6.6670   10.423   4.9824 6.864577 8.323033 
1 1 1   18    9   11 o   40.907   2.9830   70.347   9.8784   82.963   14.586   59.657   13.426   43.853   4.1289   36.907   4.5597 6.946281 6.151323 
1 1 1   18    9   12 o   38.213   3.1528   61.661   9.7335   62.374   14.169   61.024   13.394   37.651   4.7201   37.366   4.4871 0.2846756 6.512564 
1 1 1   18    9   13 o   36.238   3.4364   55.869   10.030   53.508   20.442   56.617   11.510   32.851   7.7585   36.238   3.9611 -3.387383 8.711130 
1 1 1   18    9   14 f   35.752   3.3087   54.236   9.5331   56.636   17.416   53.209   11.391   34.824   6.3698   35.067   4.0600 -0.2431717 7.553705 
1 1 1   18    9   15 o   48.441   2.5717   97.828   10.118  126.851   18.473   85.389   12.094   54.198   4.2145   44.907   3.3274 9.291252 5.369639 
1 1 1   18    9   16 o   26.873   4.0326   31.475   8.5612   37.870   13.841   27.512   10.895   28.439   6.1500   24.412   5.5952 4.027395 8.314326 
1 1 1   18    9   17 o   21.244   4.8551   20.423   8.2235   8.3856   13.158   28.138   10.534   16.308   6.5275   24.791   5.3685 -8.482988 8.451617 
1 1 1   18    9   18 o   27.189   4.2774   32.480   9.1673   29.786   13.560   34.748   12.441   24.934   6.5777   27.406   5.7527 -2.472282 8.738407 
1 1 1   18    9   19 o   13.281   5.2833   5.0334   8.5673   9.7812   15.667   3.0081   10.233   17.492   7.0800   13.344   5.5919 4.148447 9.022002 
1 1 1   18    9   20 o   27.819   4.0806   33.789   8.9787   29.623   16.226   35.628   10.779   24.486   7.4585   28.209   4.8635 -3.722729 8.904041 
1 1 1   18    9   21 f   17.839   5.7610   14.345   9.5408   43.522   23.558   8.6200   10.435   28.548   9.0351   15.456   5.9210 13.09221 10.80234 
1 1 1   18    9   22 o   14.196   5.5764   6.3988   9.4341   9.8204   22.362   5.6580   10.405   19.241   8.1749   14.318   5.7790 4.923140 10.01122 
1 1 1   18    9   23 o   51.881   2.5323  112.247   10.677  125.367   19.696  106.788   12.706   53.523   4.5578   50.310   3.1135 3.212524 5.519721 
1 1 1   18    9   24 o   23.377   4.9249   24.787   9.0881   15.625   16.552   28.741   10.874   19.407   7.4515   24.941   5.4969 -5.533928 9.259639 
1 1 1   18    9   25 o   17.460   5.5698   13.767   8.9376   11.383   16.782   14.710   10.560   18.172   7.3374   18.080   6.0715 0.9224319E-01 9.523708 
1 1 1   18    9   26 o   23.530   5.3174   25.518   9.9581   20.415   24.151   26.563   10.930   21.861   8.8111   23.837   5.7021 -1.975880 10.49519 
1 1 1   18    9   27 o   20.345   5.4022   19.207   9.1083   24.722   16.633   16.845   10.885   22.445   7.6199   19.070   6.1531 3.375269 9.794047 
1 1 1   18    9   28 o   37.908   3.2438   61.099   9.9272   71.034   18.317   56.967   11.813   39.149   5.9248   36.167   4.0778 2.981342 7.192469 
1 1 1   18    9   29 o   25.172   5.3758   29.296   10.695   38.479   17.772   24.081   13.392   27.473   7.6527   22.240   6.7762 5.233208 10.22161 
1 1 1   18    9   30 o   46.579   3.1187   91.883   11.773  103.441   19.713   85.475   14.678   47.971   5.1203   44.312   4.1106 3.659168 6.566119 
1 1 1   18    9   31 o   33.436   4.6795   49.910   12.406   62.946   18.796   39.850   16.513   36.173   6.6185   28.225   7.1656 7.947939 9.754495 
1 1 1   18    9   32 o   30.761   3.9293   41.316   9.6280   82.010   19.049   27.354   11.158   42.144   5.6904   24.039   5.7680 18.10440 8.102502 
1 1 1   18    9   33 o   13.777   5.4531   6.0040   9.0831   3.7937   16.934   6.8968   10.762   16.078   6.9757   14.764   5.9056 1.313952 9.139807 
1 1 1   18    9   34 o   12.624   5.2739   3.0105   9.0597 -19.6210   17.207   11.691   10.656   12.160   5.8570   16.590   6.0577 -4.430236 8.426116 
1 1 1   18    9   35 o   16.857   5.6862   12.844   9.2616   22.798   17.370   8.8900   10.948   21.441   7.7477   15.513   6.0321 5.928267 9.818982 
1 1 1   18    9   36 o   11.099   4.9426  -1.6361   9.0260   12.839   17.056  -7.2661   10.637   18.270   7.3901   10.714   4.9915 7.556314 8.917835 
1 1 1   18    9   37 o   35.548   3.4366   54.469   9.8341   54.328   18.004   54.529   11.740   32.979   6.9184   35.122   4.1828 -2.142838 8.084532 
1 1 1   18    9   38 o   28.921   4.1707   37.197   9.5486   71.821   18.317   24.276   11.189   38.859   5.9734   22.316   6.0155 16.54391 8.477512 
1 1 1   18    9   39 o   15.168   5.6196   9.4932   9.2260   11.121   17.169   8.8323   10.940   17.672   7.3111   15.368   6.0143 2.303525 9.466993 
1 1 1   18    9   40 o   15.039   5.6057   9.2866   9.2065   0.5078   17.269   12.773   10.882   15.196   6.7970   16.884   6.1279 -1.687711 9.151572 
1 1 1   18    9   41 o   32.432   4.1834   46.923   10.802   58.768   18.247   40.532   13.403   34.155   6.7930   28.943   5.8819 5.211523 8.985658 
1 1 1   18    9   42 o   32.334   4.1495   46.677   10.685   52.781   18.085   43.404   13.244   31.907   7.1328   30.147   5.5954 1.760317 9.065609 
1 1 1   18    9   43 o   9.8131   4.6337  -8.4147   9.7107 -23.3767   16.363  -0.2809   12.065   11.121   5.4373   12.882   5.7267 -1.760643 7.896784 
1 1 1   18    9   44 o   12.691   5.4403   2.4624   10.062  -4.6583   17.409   6.0339   12.329   14.093   6.5029   14.668   6.1419 -0.5746641 8.944878 
1 1 1   18    9   45 o   31.655   5.4618   47.998   13.584   68.449   25.246   39.665   16.116   33.661   9.0193   27.199   7.1689 6.462746 11.52135 
1 1 1   18    9   46 o   33.295   4.4828   50.709   11.858   32.377   25.446   55.794   13.402   22.879   9.1040   34.606   4.8868 -11.72725 10.33266 
1 1 1   18    9   47 o   9.9301   4.9243 -28.4870   15.110 -37.4234   22.883 -21.5781   20.121   12.189   6.0472   12.668   6.1567 -0.4787855 8.629768 
1 1 1   18    9   48 o   17.872   6.6580   15.759   12.983   24.769   22.940   11.513   15.748   20.878   8.5238   16.885   6.9953 3.993477 11.02679 
1 1 1   18    9   49 o   13.916   6.0879   3.0888   13.128   5.2740   23.568   2.1059   15.807   17.057   7.7551   14.578   6.5130 2.478456 10.12723 
1 1 1   18    9   50 o   17.093   6.6542   13.830   13.334   5.7390   23.992   17.446   16.040   17.115   7.7983   18.497   7.2695 -1.382128 10.66109 
1 1 1   18    9   51 o   21.700   6.1710   24.688   11.432   30.050   24.220   23.152   12.968   21.679   8.7926   20.632   6.7205 1.046413 11.06680 
1 1 1   18    9   52 o   33.715   5.1636   54.954   13.740   18.513   23.685   73.437   16.868   19.032   8.2536   38.631   5.5130 -19.59854 9.925426 
1 1 1   18    9   53 o   16.030   6.4622   11.469   12.994 -19.2381   22.745   26.345   15.832   13.418   6.5271   21.149   7.4223 -7.730323 9.884005 
1 1 1   18    9   54 o   55.930   3.4985  138.772   15.870  104.136   27.768  155.574   19.340   41.013   8.5819   58.375   4.0904 -17.36191 9.506844 
1 1 1   18    9   55 f   41.083   3.9680   77.032   13.123   57.098   19.316   94.118   17.884   30.966   7.6881   44.013   5.0776 -13.04721 9.213544 
1 1 1   18    9   56 o   9.1245   4.4857 -18.2468   11.619  -9.8485   17.534 -24.8223   15.515   12.717   6.0684   10.219   5.0535 2.498839 7.897068 
1 1 1   18    9   57 o   13.745   6.0918   3.5431   13.549   1.7792   27.437   4.1120   15.582   16.387   7.7532   14.435   6.4565 1.952243 10.08949 
1 1 1   18    9   58 o   32.907   5.7061   55.610   14.751   34.868   29.409   62.583   17.052   21.070   9.1666   34.107   6.3673 -13.03676 11.16104 
1 1 1   18    9   59 o   17.847   7.3302   17.808   17.094 -19.6390   27.588   41.141   21.777   14.223   6.9760   23.789   8.6638 -9.565676 11.12322 
1 1 1   18    9   60 o   17.843   7.2426   17.994   16.448   6.5847   27.143   24.614   20.676   16.735   7.8539   19.463   8.0348 -2.727730 11.23579 
1 1 1   18    9   61 o   19.060   7.4222   22.334   16.594 -20.8106   26.853   48.989   21.107   13.897   6.8292   26.368   8.5729 -12.47141 10.96046 
1 1 1   18    9   62 o   11.479   5.5494 -13.4208   15.799  -6.7739   26.592 -17.0474   19.642   15.046   7.2555   12.353   6.0214 2.692801 9.428667 
1 1 1   18    9   63 o   15.390   6.7594   8.9725   16.327  -1.5281   27.672   14.580   20.222   15.680   7.5201   17.025   7.4984 -1.344426 10.61969 
1 1 1   18    9   64 o   20.743   7.6573   28.673   17.102   7.4336   28.412   40.741   21.416   16.659   7.8841   23.235   8.5704 -6.576227 11.64517 
1 1 1   18    9   65 o   13.332   6.2053  -1.3239   16.379 -15.0190   27.591   6.1291   20.354   14.307   7.0085   15.412   7.0823 -1.105136 9.963874 
1 1 1   18    9   66 o   16.526   7.0147   14.277   16.438   32.611   28.850   5.4647   20.002   19.935   8.8593   15.221   7.0043 4.713361 11.29364 
1 1 1   18    9   67 o   17.661   8.2133   17.248   28.599   17.248   28.599   0.0000   0.0000   17.661   8.2133  ?   ?  0.000000 8.213273 
1 1 1   18    9   68 o   14.024   6.8892 -16.3191   27.251 -16.3191   27.251   0.0000   0.0000   14.024   6.8892  ?   ?  0.000000 6.889225 
1 1 1   18   10  -70 o   15.829   7.4794   9.2645   25.381   0.0000   0.0000   9.2645   25.381  ?   ?    15.829   7.4794 0.000000 7.479414 
1 1 1   18   10  -69 o   10.377   5.1093 -18.5882   15.266 -22.8219   19.641 -12.1266   24.264   11.403   5.6477   13.439   6.5812 -2.035851 8.672312 
1 1 1   18   10  -68 o   12.441   5.8858  -3.8743   15.809 -23.3820   20.840   22.565   24.262   11.713   5.8042   17.705   7.9766 -5.991539 9.864807 
1 1 1   18   10  -67 o   11.968   5.7060  -6.4872   15.432   11.490   20.534 -29.8189   23.393   15.825   7.2121   11.912   5.9431 3.912858 9.345306 
1 1 1   18   10  -66 o   10.815   5.2795 -15.0938   15.254 -37.3937   19.863   16.964   23.816   10.435   5.2447   16.956   7.7427 -6.520959 9.351822 
1 1 1   18   10  -65 o   13.950   6.3321   4.5379   15.632   23.355   20.489 -21.6735   24.182   18.238   7.7895   12.772   6.3151 5.466012 10.02773 
1 1 1   18   10  -64 o   9.3097   4.6732 -32.3923   15.525 -21.8829   20.450 -46.6900   23.853   11.837   5.8444   11.051   5.5786 0.7860842 8.079451 
1 1 1   18   10  -63 o   15.170   6.6790   9.7775   16.031  -1.9659   20.632   27.667   25.466   14.025   6.6613   18.861   8.3559 -4.835619 10.68615 
1 1 1   18   10  -62 o   17.908   7.1837   20.243   15.973   12.476   20.723   31.612   25.072   16.259   7.3442   19.696   8.5166 -3.437355 11.24587 
1 1 1   18   10  -61 o   17.081   7.0927   17.132   16.242   21.571   21.279   10.937   25.140   18.063   7.8282   16.463   7.6712 1.599939 10.96025 
1 1 1   18   10  -60 o   13.861   6.3759   2.1297   16.553   6.8493   22.080  -3.9265   25.011   15.612   7.2454   14.731   7.0867 0.8807678 10.13496 
1 1 1   18   10  -59 o   19.399   6.6681   22.644   12.745   15.079   21.520   26.730   15.818   16.941   7.5818   20.179   7.3783 -3.237938 10.57940 
1 1 1   18   10  -58 o   17.764   6.4799   18.281   12.189   19.207   21.050   17.814   14.951   17.743   7.7367   17.411   6.9618 0.3324375 10.40780 
1 1 1   18   10  -57 o   13.666   5.8506   6.4146   11.609 -21.0345   19.449   21.604   14.468   11.777   5.7922   18.731   7.0182 -6.954031 9.099689 
1 1 1   18   10  -56 o   21.084   7.1895   28.033   14.810   0.0000   0.0000   28.033   14.810  ?   ?    21.084   7.1895 0.000000 7.189528 
1 1 1   18   10  -55 o   18.844   6.5040   20.579   12.130   5.8649   21.124   27.818   14.816   15.555   7.1722   21.071   7.1909 -5.516745 10.15626 
1 1 1   18   10  -54 o   30.281   5.2731   46.398   12.543   66.760   22.245   36.906   15.188   31.496   8.4781   24.659   7.1447 6.837339 11.08713 
1 1 1   18   10  -53 o   12.078   5.4577   0.0778   11.458 -19.7665   20.117   9.6053   13.939   12.226   5.9880   15.196   6.4552 -2.970430 8.804933 
1 1 1   18   10  -52 o   11.149   5.1915  -4.3510   11.483 -17.9404   20.171   2.1643   13.967   12.446   6.0744   13.429   6.0509 -0.9833231 8.573889 
1 1 1   18   10  -51 o   14.562   5.8894   9.2239   10.831   3.2880   20.898   11.404   12.665   15.306   7.0845   15.583   6.3441 -0.2770452 9.509834 
1 1 1   18   10  -50 o   13.496   5.6829   6.1036   10.648   3.7817   20.670   6.9423   12.423   15.374   7.0910   14.220   6.0691 1.153800 9.333672 
1 1 1   18   10  -49 o   28.882   4.8587   40.697   11.033   84.369   22.184   26.344   12.718   38.054   7.4182   21.452   6.6161 16.60217 9.939905 
1 1 1   18   10  -48 o   16.514   6.0675   14.094   10.717   5.0464   21.591   17.051   12.345   15.844   7.2859   17.678   6.5092 -1.833538 9.770061 
1 1 1   18   10  -47 o   14.013   5.6654   7.8788   10.019   18.434   16.998   2.2600   12.402   18.151   7.3644   13.077   5.8102 5.073859 9.380494 
1 1 1   18   10  -46 o   25.246   5.9774   33.601   12.109   49.251   17.379   18.831   16.883   29.040   7.3392   18.337   7.3752 10.70330 10.40473 
1 1 1   18   10  -45 o   15.124   6.1518   9.6491   11.896   15.424   17.260   4.4233   16.418   17.521   7.2964   14.831   6.6310 2.689847 9.859424 
1 1 1   18   10  -44 o   31.559   5.7525   50.501   14.253   25.207   17.864   94.816   23.645   20.390   7.7627   41.136   7.3196 -20.74636 10.66943 
1 1 1   18   10  -43 o   15.174   5.7507   10.538   9.7764  -3.5095   17.125   17.330   11.908   13.696   6.3648   18.113   6.4300 -4.416774 9.047387 
1 1 1   18   10  -42 o   11.903   5.2202   1.2201   9.7060  -0.4691   17.234   2.0047   11.746   14.314   6.5552   12.981   5.7161 1.333267 8.697334 
1 1 1   18   10  -41 o   28.201   4.6494   37.416   10.316   49.885   18.075   31.392   12.563   29.626   7.4836   24.429   6.2759 5.197132 9.766841 
1 1 1   18   10  -40 o   33.354   3.9332   50.162   10.488   50.708   17.989   49.881   12.910   30.094   7.3884   32.293   5.0712 -2.199524 8.961320 
1 1 1   18   10  -39 o   30.373   4.2698   42.270   10.280   36.269   17.785   45.281   12.597   24.759   7.8522   30.654   5.2287 -5.895359 9.433786 
1 1 1   18   10  -38 f   15.623   5.7451   11.181   9.6114   10.072   17.121   11.691   11.614   16.702   7.1265   16.142   6.2304 0.5605545 9.465970 
1 1 1   18   10  -37 o   17.706   5.8632   15.565   9.8539   18.726   16.958   13.954   12.108   19.072   7.4810   17.101   6.4175 1.971153 9.856447 
1 1 1   18   10  -36 o   13.312   5.3448   6.0000   8.8499   17.690   13.903  -1.9643   11.475   18.658   6.9011   12.059   5.4544 6.598495 8.796307 
1 1 1   18   10  -35 o   37.049   3.2897   59.694   9.8318   61.640   15.252   58.309   12.860   35.895   5.3780   35.656   4.5266 0.2394104 7.029412 
1 1 1   18   10  -34 o   16.524   5.5746   12.981   8.9016   16.258   14.128   10.825   11.463   18.263   6.9151   15.941   6.1797 2.322296 9.273946 
1 1 1   18   10  -33 f   8.7125   4.1881 -10.6182   8.6957 -21.6009   13.774  -3.3407   11.212   10.057   4.9319   11.683   5.3264 -1.626189 7.259024 
1 1 1   18   10  -32 o   14.471   5.4919   8.4941   8.9233   14.156   14.362   4.9343   11.388   17.684   6.8998   13.985   5.8823 3.699203 9.066936 
1 1 1   18   10  -31 o   11.132   4.9313  -0.7143   8.8683   1.8608   14.211  -2.3566   11.349   14.240   6.2784   12.021   5.4321 2.218685 8.302166 
1 1 1   18   10  -30 o   12.728   5.2458   4.1809   8.7937 -14.4685   14.107   16.034   11.246   11.197   5.3699   18.191   6.2633 -6.993501 8.250131 
1 1 1   18   10  -29 o   14.811   5.7097   8.5711   9.7458 -11.3983   19.168   15.533   11.318   13.779   6.5077   18.011   6.2789 -4.231375 9.042938 
1 1 1   18   10  -28 o   21.358   5.6611   22.177   10.014   16.331   19.770   24.194   11.613   19.287   7.8981   22.009   6.2065 -2.722128 10.04494 
1 1 1   18   10  -27 o   33.225   3.9862   48.854   10.581   21.994   19.668   59.793   12.552   20.840   8.0903   36.574   4.2917 -15.73404 9.158124 
1 1 1   18   10  -26 o   37.367   3.2717   60.084   9.8653   59.917   15.275   60.204   12.922   35.780   5.4056   36.639   4.4155 -0.8591194 6.979780 
1 1 1   18   10  -25 o   17.080   5.9252   13.423   10.072   26.266   14.758   2.2240   13.781   22.525   7.1539   14.334   6.2548 8.190806 9.502690 
1 1 1   18   10  -24 o   9.2102   4.3268  -7.0573   8.2746 -13.3478   14.095  -3.7496   10.221   11.453   5.4581   11.201   5.0984 0.2513351 7.468945 
1 1 1   18   10  -23 o   11.870   5.0286   2.0446   8.4199 -25.7312   14.246   16.957   10.438   9.9612   4.9105   18.808   6.0213 -8.847099 7.769717 
1 1 1   18   10  -22 o   26.457   4.6307   31.801   9.6231   23.942   15.271   36.978   12.394   21.677   7.3014   27.928   5.6385 -6.250481 9.225154 
1 1 1   18   10  -21 o   13.438   5.4303   5.2345   9.1999   7.7302   14.933   3.7079   11.680   16.262   6.7808   13.969   5.9205 2.292977 9.001766 
1 1 1   18   10  -20 o   13.610   5.4566   5.6412   9.2107   10.449   14.892   2.6622   11.722   17.053   6.9025   13.696   5.8715 3.357640 9.061969 
1 1 1   18   10  -19 o   22.093   5.0248   22.659   8.8441   14.459   15.470   26.640   10.779   18.443   7.1708   23.650   5.6658 -5.207506 9.139008 
1 1 1   18   10  -18 o   14.361   5.3925   7.9530   8.5516   14.893   14.739   4.4311   10.500   18.486   7.0479   13.743   5.7043 4.742885 9.067107 
1 1 1   18   10  -17 o   14.582   5.5860   7.8808   9.2873   17.946   15.160   1.8345   11.750   19.619   7.2152   13.517   5.8374 6.102276 9.280887 
1 1 1   18   10  -16 o   20.573   5.5513   20.018   9.5232   23.315   15.235   17.903   12.200   21.627   7.2929   19.408   6.5262 2.218973 9.786576 
1 1 1   18   10  -15 o   37.059   3.4575   59.014   10.324   60.132   16.329   58.269   13.325   35.860   5.7829   36.109   4.6338 -0.2489090 7.410397 
1 1 1   18   10  -14 o   15.607   5.7072   10.054   9.4640   6.2809   15.127   12.480   12.132   16.063   6.7692   17.213   6.4312 -1.149563 9.337157 
1 1 1   18   10  -13 o   37.458   4.0658   61.375   12.215   49.190   16.259   77.166   18.509   31.890   6.4760   40.775   5.7264 -8.884750 8.644634 
1 1 1   18   10  -12 o   57.012   3.0120  137.407   13.948  146.182   20.376  129.670   19.133   57.695   4.3649   54.331   4.3567 3.363564 6.167067 
1 1 1   18   10  -11 o   26.750   4.8762   32.525   10.241   26.463   15.249   37.505   13.822   22.941   7.2702   27.927   6.2303 -4.985947 9.574562 
1 1 1   18   10  -10 o   28.056   4.9025   35.724   10.804   30.552   17.838   38.721   13.578   24.286   7.8800   28.536   6.0265 -4.250387 9.920319 
1 1 1   18   10   -9 o   13.574   5.3347   5.9391   8.6382   7.6410   15.114   5.1136   10.527   16.472   6.8411   14.052   5.7599 2.419277 8.942965 
1 1 1   18   10   -8 o   10.463   4.7120  -2.8004   8.4578 -24.8344   14.692   8.1214   10.344   10.371   5.0875   15.092   5.8648 -4.720913 7.763926 
1 1 1   18   10   -7 o   21.192   5.1306   20.792   8.7669   28.397   15.245   17.034   10.716   23.774   7.2270   19.055   6.1009 4.718300 9.457875 
1 1 1   18   10   -6 o   32.751   4.1453   47.074   10.819   37.218   34.760   48.131   11.385   25.789   10.506   33.015   4.3350 -7.225883 11.36524 
1 1 1   18   10   -5 o   17.027   5.6541   13.061   9.1619  -1.4033   19.026   17.428   10.454   15.763   7.0860   19.251   6.0085 -3.488080 9.290443 
1 1 1   18   10   -4 o   18.163   5.6756   15.266   9.3246   2.0093   18.799   19.592   10.739   16.355   7.2154   20.302   6.0421 -3.947021 9.411094 
1 1 1   18   10   -3 o   33.086   3.7095   47.359   9.8325   61.427   19.856   42.789   11.317   35.265   7.1524   30.948   4.6282 4.317659 8.519219 
1 1 1   18   10   -2 f   17.712   5.5184   14.424   8.8223   18.391   15.757   12.612   10.648   19.999   7.3558   17.043   6.0771 2.956654 9.541421 
1 1 1   18   10   -1 o   14.873   5.5076   8.6917   8.8599  -8.7471   15.418   17.289   10.826   12.993   6.0384   19.193   6.1307 -6.200380 8.605079 
1 1 1   18   10    0 o   19.339   5.4093   17.432   8.8595   15.657   15.395   18.310   10.833   19.026   7.2152   19.681   6.1124 -0.6548691 9.456204 
1 1 1   18   10    1 o   15.229   5.4679   9.5882   8.6354   33.014   15.833  -0.3314   10.303   25.597   7.2565   12.262   5.3779 13.33582 9.032063 
1 1 1   18   10    2 f   14.939   5.4311   9.0277   8.5529  -0.7828   15.407   13.398   10.283   14.534   6.4656   17.335   5.9881 -2.801406 8.812596 
1 1 1   18   10    3 o   9.8767   4.5841  -6.1544   8.8410  -3.6256   17.180  -7.0654   10.311   14.668   6.6502   10.618   4.9357 4.050743 8.281728 
1 1 1   18   10    4 o   42.059   2.9937   74.813   10.197   55.771   18.963   82.558   12.094   33.553   7.1522   43.965   3.4010 -10.41216 7.919605 
1 1 1   18   10    5 o   36.571   3.3602   57.193   9.9053   54.642   18.919   58.156   11.626   33.150   7.2073   36.552   3.9654 -3.402020 8.226114 
1 1 1   18   10    6 o   23.222   5.4771   25.230   10.199   85.550   28.719   16.525   10.910   39.701   9.0729   18.827   6.1662 20.87413 10.96998 
1 1 1   18   10    7 o   35.073   3.8374   53.390   10.792   40.590   29.183   55.418   11.616   26.589   9.9664   35.604   4.0756 -9.015602 10.76749 
1 1 1   18   10    8 o   37.006   3.6512   59.064   10.871   28.500   29.300   63.942   11.706   23.804   9.6648   38.439   3.7850 -14.63530 10.37957 
1 1 1   18   10    9 o   32.642   4.3814   47.183   11.364   0.0000   0.0000   47.183   11.364  ?   ?    32.642   4.3814 0.000000 4.381416 
1 1 1   18   10   10 o   19.160   5.4883   17.180   9.0104   31.257   16.468   11.165   10.765   24.717   7.5107   16.422   6.0728 8.295872 9.658655 
1 1 1   18   10   11 o   16.283   5.5760   11.693   8.9101   16.551   15.464   9.2780   10.902   19.271   7.2482   15.696   6.0421 3.574562 9.436241 
1 1 1   18   10   12 o   13.585   5.2952   6.1764   8.4523   6.1472   13.509   6.1951   10.835   15.497   6.4545   14.534   5.8861 0.9626284 8.735313 
1 1 1   18   10   13 o   12.339   5.0853   3.3290   8.2641  -4.3522   12.922   8.6442   10.750   12.603   5.7350   15.395   5.9798 -2.792092 8.285464 
1 1 1   18   10   14 o   47.638   2.6985   95.374   10.436   90.863   14.867   99.757   14.653   45.655   4.0363   48.045   3.7717 -2.390228 5.524241 
1 1 1   18   10   15 o   37.667   3.1959   60.507   9.7203   61.662   13.988   59.428   13.517   37.088   4.7348   36.457   4.6544 0.6314812 6.639421 
1 1 1   18   10   16 o   14.681   5.5915   8.0998   9.2707 -13.2868   14.012   24.749   12.363   11.511   5.4735   22.472   6.4262 -10.96134 8.441334 
1 1 1   18   10   17 o   12.897   5.3597   3.5359   9.2850   5.3072   14.204   2.2144   12.269   15.448   6.5373   13.851   5.9733 1.596777 8.855288 
1 1 1   18   10   18 o   15.617   5.6862   10.217   9.3799  -9.3180   14.208   25.310   12.488   12.236   5.7229   22.664   6.4514 -10.42821 8.623913 
1 1 1   18   10   19 o   11.203   4.9005  -0.2229   8.5035 -11.9438   14.244   6.2676   10.600   11.806   5.5860   14.402   5.8256 -2.595535 8.071015 
1 1 1   18   10   20 o   12.256   5.1471   2.6377   8.6980   7.1479   14.427   0.0622   10.902   15.967   6.6619   12.586   5.5259 3.381014 8.655412 
1 1 1   18   10   21 o   45.078   2.6986   85.642   9.8706   94.343   15.963   80.256   12.559   46.199   4.2878   43.079   3.6097 3.120098 5.604914 
1 1 1   18   10   22 o   34.624   3.7768   52.333   10.487   44.676   15.212   59.268   14.477   30.203   6.3791   35.963   5.0797 -5.760292 8.154573 
1 1 1   18   10   23 o   29.494   4.3226   38.925   10.084   32.607   14.804   44.394   13.774   25.243   6.9669   30.566   5.7388 -5.322607 9.026151 
1 1 1   18   10   24 o   24.039   5.1900   27.113   9.8717   9.4813   14.281   43.246   13.661   16.507   6.7306   30.100   5.7776 -13.59348 8.870304 
1 1 1   18   10   25 o   14.278   5.5474   7.4469   9.2531   18.278   17.325   3.1246   10.945   19.681   7.6060   13.418   5.7107 6.263385 9.511264 
1 1 1   18   10   26 o   13.689   5.6019   5.2960   9.9369   10.665   23.246   4.0955   10.992   18.723   8.1475   13.717   5.7750 5.005709 9.986620 
1 1 1   18   10   27 o   42.690   3.0752   77.907   10.630   92.947   19.816   71.831   12.595   44.414   5.5976   40.444   3.8674 3.970119 6.803632 
1 1 1   18   10   28 o   30.910   4.0375   42.479   9.9299   61.700   18.460   34.653   11.779   35.050   6.7052   26.907   5.5547 8.142748 8.707092 
1 1 1   18   10   29 o   39.738   3.2373   68.003   10.395   82.583   18.903   61.682   12.446   41.625   5.7225   37.186   4.1783 4.438549 7.085532 
1 1 1   18   10   30 o   19.594   5.6474   18.728   9.5125   11.973   17.347   21.632   11.375   17.671   7.3332   20.755   6.2285 -3.083427 9.621361 
1 1 1   18   10   31 o   11.658   5.1148   0.2175   9.3265   30.122   17.654 -11.3607   10.985   23.244   7.8504   10.023   4.7883 13.22132 9.195489 
1 1 1   18   10   32 o   24.967   5.3223   29.899   10.501   38.161   17.776   25.471   13.014   26.105   7.7747   22.119   6.6675 3.986361 10.24215 
1 1 1   18   10   33 f   15.130   5.8819   9.2170   10.408   24.636   17.741   1.1267   12.851   21.210   7.8044   13.480   5.9556 7.730344 9.817238 
1 1 1   18   10   34 o   12.371   5.4159   1.0460   10.406   5.9656   17.505  -1.6422   12.940   16.056   7.0270   12.840   5.8014 3.215699 9.112368 
1 1 1   18   10   35 o   10.204   4.7842  -7.0501   10.031 -24.3212   16.669   2.7534   12.559   11.042   5.4172   13.711   5.9772 -2.668900 8.066790 
1 1 1   18   10   36 o   17.369   5.9926   14.780   10.297  -1.9505   16.661   25.122   13.098   14.133   6.4620   21.721   6.7170 -7.588395 9.320729 
1 1 1   18   10   37 o   14.119   5.6818   7.1480   10.026   2.8872   16.615   9.5882   12.574   15.019   6.6959   15.642   6.3384 -0.6222906 9.220160 
1 1 1   18   10   38 f   21.867   5.7428   24.115   10.366   19.237   17.131   26.933   13.020   19.165   7.5185   22.425   6.6479 -3.259153 10.03608 
1 1 1   18   10   39 o   20.332   6.2496   21.613   11.359   53.139   23.878   12.391   12.914   28.379   9.1091   16.554   6.5178 11.82479 11.20073 
1 1 1   18   10   40 o   11.938   5.3945  -1.5163   11.194   6.2151   21.951  -4.2334   13.013   16.751   7.5632   12.171   5.6181 4.579990 9.421488 
1 1 1   18   10   41 o   22.690   6.1009   26.867   11.527   0.3704   23.485   35.276   13.230   16.088   7.4684   25.911   6.3210 -9.823288 9.784280 
1 1 1   18   10   42 o   17.026   6.2718   14.501   11.463  -6.9748   22.611   21.930   13.298   14.822   7.0204   19.953   6.8126 -5.130972 9.782528 
1 1 1   18   10   43 o   14.108   5.9008   6.5786   11.361   19.616   21.941   1.8019   13.280   19.013   8.0886   13.445   5.9907 5.568393 10.06551 
1 1 1   18   10   44 o   44.539   4.2681   91.553   15.306   75.641   26.518   99.502   18.743   33.096   9.3943   45.256   5.1737 -12.16019 10.72475 
1 1 1   18   10   45 o   15.733   6.1422   11.637   11.387 -35.3997   22.495   27.841   13.204   11.856   5.9008   22.218   6.7199 -10.36268 8.942964 
1 1 1   18   10   46 o   10.284   4.8777  -8.2152   10.989  -4.2382   22.550  -9.4537   12.584   14.849   7.0265   10.850   5.1671 3.999070 8.721896 
1 1 1   18   10   47 o   22.476   6.1178   27.313   11.506   48.812   23.404   20.460   13.214   25.751   9.0255   18.980   6.7697 6.770445 11.28225 
1 1 1   18   10   48 o   36.378   4.9840   64.578   14.391   85.412   25.732   55.096   17.360   35.898   8.8507   31.132   7.0101 4.765848 11.29052 
1 1 1   18   10   49 o   16.208   6.5142   12.978   13.161   0.0000   0.0000   12.978   13.161  ?   ?    16.208   6.5142 0.000000 6.514233 
1 1 1   18   10   50 o   14.538   6.2154   7.5374   13.068   0.0000   0.0000   7.5374   13.068  ?   ?    14.538   6.2154 0.000000 6.215352 
1 1 1   18   10   51 o   21.101   7.1962   27.306   14.837  -2.9410   28.674   38.367   17.339   15.849   7.6151   24.405   7.7547 -8.555506 10.86856 
1 1 1   18   10   52 o   14.215   6.5252   1.6561   17.214  -1.8526   28.440   3.6848   21.625   15.883   7.6191   15.464   7.1746 0.4192038 10.46543 
1 1 1   18   10   53 o   20.919   7.7890   29.099   17.765   1.5682   28.325   46.951   22.809   16.175   7.7167   24.825   8.8898 -8.650421 11.77180 
1 1 1   18   10   54 o   12.919   5.8338   1.3735   13.065   4.0185   27.555   0.6065   14.839   16.272   7.7197   13.312   6.0912 2.960047 9.833405 
1 1 1   18   10   55 o   14.430   6.4482   5.4675   15.502   0.0000   0.0000   5.4675   15.502  ?   ?    14.430   6.4482 0.000000 6.448211 
1 1 1   18   10   56 o   15.641   6.7134   11.043   15.358   0.0000   0.0000   11.043   15.358  ?   ?    15.641   6.7134 0.000000 6.713402 
1 1 1   18   10   57 o   20.025   7.3364   25.938   15.650   0.0000   0.0000   25.938   15.650  ?   ?    20.025   7.3364 0.000000 7.336427 
1 1 1   18   10   58 o   11.963   5.6762  -6.7109   14.908   0.0000   0.0000  -6.7109   14.908  ?   ?    11.963   5.6762 0.000000 5.676223 
1 1 1   18   10   59 o   17.055   7.0249   16.712   15.758   0.0000   0.0000   16.712   15.758  ?   ?    17.055   7.0249 0.000000 7.024877 
1 1 1   18   10   60 o   32.005   6.7499   59.203   17.054   0.0000   0.0000   59.203   17.054  ?   ?    32.005   6.7499 0.000000 6.749899 
1 1 1   18   10   61 o   13.603   6.2372   2.0519   15.667   0.0000   0.0000   2.0519   15.667  ?   ?    13.603   6.2372 0.000000 6.237237 
1 1 1   18   10   62 o   18.725   7.3561   23.139   16.418   0.0000   0.0000   23.139   16.418  ?   ?    18.725   7.3561 0.000000 7.356100 
1 1 1   18   10   63 o   22.983   8.7713   44.195   22.842   0.0000   0.0000   44.195   22.842  ?   ?    22.983   8.7713 0.000000 8.771267 
1 1 1   18   10   64 o   18.173   8.0582   23.566   23.735   0.0000   0.0000   23.566   23.735  ?   ?    18.173   8.0582 0.000000 8.058221 
1 1 1   18   10   65 o   21.630   8.6187   39.529   22.835   0.0000   0.0000   39.529   22.835  ?   ?    21.630   8.6187 0.000000 8.618665 
1 1 1   18   10   66 o   21.768   8.7716   41.856   23.929   0.0000   0.0000   41.856   23.929  ?   ?    21.768   8.7716 0.000000 8.771592 
1 1 1   18   10   67 o   14.921   6.9981   4.8210   21.493   0.0000   0.0000   4.8210   21.493  ?   ?    14.921   6.9981 0.000000 6.998115 
1 1 1   18   10   68 o   25.050   9.0995   55.432   24.001   0.0000   0.0000   55.432   24.001  ?   ?    25.050   9.0995 0.000000 9.099506 
1 1 1   18   10   69 o   16.009   7.3328   12.754   21.579   0.0000   0.0000   12.754   21.579  ?   ?    16.009   7.3328 0.000000 7.332794 
1 1 1   18   10   70 o   13.401   6.4837  -7.3352   21.673   0.0000   0.0000  -7.3352   21.673  ?   ?    13.401   6.4837 0.000000 6.483743 
1 1 1   18   11  -63 o   14.480   7.0156  -2.5067   25.596   0.0000   0.0000  -2.5067   25.596  ?   ?    14.480   7.0156 0.000000 7.015628 
1 1 1   18   11  -62 f   16.445   7.6420   15.342   24.686   0.0000   0.0000   15.342   24.686  ?   ?    16.445   7.6420 0.000000 7.641974 
1 1 1   18   11  -61 o   17.393   7.9221   21.626   24.731   0.0000   0.0000   21.626   24.731  ?   ?    17.393   7.9221 0.000000 7.922091 
1 1 1   18   11  -60 o   11.518   5.7840 -36.8411   23.907   0.0000   0.0000 -36.8411   23.907  ?   ?    11.518   5.7840 0.000000 5.784021 
1 1 1   18   11  -59 o   21.059   8.8172   41.556   25.406   0.0000   0.0000   41.556   25.406  ?   ?    21.059   8.8172 0.000000 8.817182 
1 1 1   18   11  -58 o   12.086   6.0280 -29.3478   24.002   0.0000   0.0000 -29.3478   24.002  ?   ?    12.086   6.0280 0.000000 6.028023 
1 1 1   18   11  -57 o   23.228   9.3107   52.512   26.810   0.0000   0.0000   52.512   26.810  ?   ?    23.228   9.3107 0.000000 9.310693 
1 1 1   18   11  -56 o   16.533   7.7559   12.958   26.424   0.0000   0.0000   12.958   26.424  ?   ?    16.533   7.7559 0.000000 7.755947 
1 1 1   18   11  -55 o   12.675   5.9673  -3.0482   15.891   0.0000   0.0000  -3.0482   15.891  ?   ?    12.675   5.9673 0.000000 5.967316 
1 1 1   18   11  -54 o   14.969   6.6434   8.9257   16.168   0.0000   0.0000   8.9257   16.168  ?   ?    14.969   6.6434 0.000000 6.643436 
1 1 1   18   11  -53 o   18.505   7.3540   22.649   16.582   0.0000   0.0000   22.649   16.582  ?   ?    18.505   7.3540 0.000000 7.353954 
1 1 1   18   11  -52 o   16.571   6.5524   15.586   13.102   50.564   23.204  -0.7854   15.875   24.714   8.9514   13.117   6.1067 11.59641 10.83601 
1 1 1   18   11  -51 o   13.356   5.9437   4.1844   13.033   10.144   22.171   1.0379   16.110   16.051   7.3816   13.518   6.2440 2.532270 9.668328 
1 1 1   18   11  -50 o   18.420   7.3251   21.846   16.463   11.414   21.081   38.152   26.356   16.190   7.3506   20.915   8.8803 -4.725664 11.52779 
1 1 1   18   11  -49 o   12.468   5.8995  -5.2421   15.891  -4.6727   21.378  -5.9452   23.756   13.958   6.6715   14.291   6.8832 -0.3329353 9.585782 
1 1 1   18   11  -48 o   14.115   6.0497   7.4893   12.438   21.299   21.235   0.2773   15.346   18.111   7.8345   13.242   6.1083 4.869115 9.934343 
1 1 1   18   11  -47 o   9.6474   4.7014 -14.3132   11.952 -44.6096   20.551   1.1710   14.692   10.325   5.2079   13.253   6.0630 -2.928020 7.992590 
1 1 1   18   11  -46 o   12.923   5.7261   3.2467   11.964   35.058   21.526 -10.9725   14.392   21.460   8.4253   11.176   5.3763 10.28391 9.994509 
1 1 1   18   11  -45 o   18.047   6.5135   18.801   12.272 -13.2544   21.574   34.136   14.922   13.181   6.3991   23.500   7.1513 -10.31831 9.596340 
1 1 1   18   11  -44 o   19.797   6.1580   22.036   10.991   1.2974   21.501   29.372   12.787   14.952   7.0083   22.497   6.5666 -7.545258 9.604031 
1 1 1   18   11  -43 o   12.577   5.5090   3.1607   10.780 -24.5891   20.354   13.979   12.709   11.814   5.8323   16.325   6.4538 -4.511744 8.698708 
1 1 1   18   11  -42 o   12.354   5.4796   2.0033   10.983   3.1706   21.167   1.5733   12.847   15.231   7.0774   12.903   5.8095 2.328232 9.156367 
1 1 1   18   11  -41 o   11.870   5.3487   0.1300   10.915  -2.4928   21.602   1.0293   12.649   14.560   6.8859   12.730   5.7451 1.829998 8.967841 
1 1 1   18   11  -40 o   14.543   5.9603   9.0198   11.271  -1.3332   21.545   12.920   13.224   14.722   6.9367   16.084   6.5066 -1.361579 9.510715 
1 1 1   18   11  -39 o   9.2991   4.5183 -13.2987   10.819 -10.1461   21.244 -14.4025   12.571   13.590   6.5360   10.020   4.8691 3.569353 8.150312 
1 1 1   18   11  -38 o   25.206   5.8093   33.537   11.691   41.642   23.365   30.830   13.503   23.336   8.8795   23.059   6.7527 0.2769661 11.15545 
1 1 1   18   11  -37 o   33.652   4.5536   54.051   12.171   70.655   24.565   48.648   14.012   31.707   9.0554   30.543   5.8406 1.163895 10.77559 
1 1 1   18   11  -36 o   20.365   5.9647   22.407   10.535   25.231   17.655   20.845   13.128   19.981   7.6895   19.054   6.7528 0.9264469 10.23371 
1 1 1   18   11  -35 o   14.372   5.7828   8.7135   10.384   15.508   17.877   5.2541   12.756   17.374   7.3423   13.915   6.0456 3.459106 9.510955 
1 1 1   18   11  -34 o   12.219   5.4725   0.5223   11.232 -58.8292   26.541   13.471   12.397   11.515   5.8214   16.405   6.4075 -4.889506 8.657104 
1 1 1   18   11  -33 o   15.924   6.1883   12.248   11.517   54.130   27.236   3.1288   12.709   25.985   9.6503   13.432   5.9291 12.55245 11.32619 
1 1 1   18   11  -32 o   16.124   6.5356   12.015   13.372   43.084   28.035   2.8644   15.215   23.320   9.4592   14.179   6.3581 9.140888 11.39742 
1 1 1   18   11  -31 o   19.425   6.3469   20.492   11.561   17.677   17.427   22.705   15.451   18.183   7.4271   19.767   7.2816 -1.583630 10.40110 
1 1 1   18   11  -30 o   9.9877   4.7235  -7.7316   10.164  -6.4056   13.586  -9.4174   15.319   11.880   5.5692   12.095   5.7432 -0.2154522 8.000000 
1 1 1   18   11  -29 o   14.737   5.8071   9.2064   10.260   8.1733   13.704   10.524   15.475   15.194   6.4250   16.188   6.8357 -0.9947891 9.381238 
1 1 1   18   11  -28 o   33.935   4.0745   52.538   11.046   34.746   14.709   75.542   16.726   24.919   6.9701   39.341   5.3544 -14.42250 8.789314 
1 1 1   18   11  -27 o   10.731   4.8625  -2.0939   9.1692  -1.1127   13.452  -2.9453   12.531   12.928   5.8706   12.169   5.5790 0.7596083 8.098727 
1 1 1   18   11  -26 o   13.760   5.4596   7.2366   9.1256   8.4202   13.541   6.2520   12.352   15.338   6.4305   14.397   6.0944 0.9409733 8.859677 
1 1 1   18   11  -25 o   15.455   5.6820   11.058   9.4006   34.839   14.020  -8.3657   12.671   25.407   6.6818   11.239   5.3029 14.16762 8.530374 
1 1 1   18   11  -24 o   16.822   5.9964   13.886   10.366  -0.8672   13.965   31.991   15.470   13.243   6.0007   23.730   7.2930 -10.48718 9.444381 
1 1 1   18   11  -23 o   9.5844   4.5145  -7.0956   9.1137 -14.0819   13.738  -1.6041   12.180   10.881   5.2390   12.378   5.6069 -1.496872 7.673577 
1 1 1   18   11  -22 o   21.265   5.4222   22.433   9.4264   24.852   14.389   20.614   12.476   21.199   7.0870   19.719   6.5992 1.480345 9.683747 
1 1 1   18   11  -21 o   14.770   5.6478   9.2695   9.4823   2.5755   14.481   14.295   12.546   14.239   6.3049   17.218   6.5171 -2.979661 9.067770 
1 1 1   18   11  -20 o   8.5562   4.1453 -12.1690   8.9341   1.8977   13.974 -21.8932   11.619   13.933   6.1802   8.8377   4.3711 5.094889 7.569786 
1 1 1   18   11  -19 o   19.861   6.1716   20.315   11.042   22.572   14.730   17.418   16.685   20.381   7.1589   18.660   7.3892 1.721186 10.28836 
1 1 1   18   11  -18 o   28.078   6.7731   41.728   15.322   41.728   15.322   0.0000   0.0000   28.078   6.7731  ?   ?  0.000000 6.773146 
1 1 1   18   11  -17 o   11.990   5.3504  -0.5985   10.635   5.9404   14.313  -8.6572   15.890   15.084   6.4777   12.703   5.9766 2.380158 8.813677 
1 1 1   18   11  -16 o   20.037   5.6097   19.961   9.5235   28.081   15.004   14.482   12.324   22.582   7.2180   17.380   6.4844 5.202028 9.702920 
1 1 1   18   11  -15 f   11.813   5.2411  -0.2702   10.056 -13.2628   14.189   12.844   14.255   11.298   5.4093   17.088   6.8094 -5.790143 8.696448 
1 1 1   18   11  -14 o   25.657   5.2858   31.697   10.687   13.116   14.767   52.132   15.486   17.280   6.9156   32.327   6.1003 -15.04708 9.221624 
1 1 1   18   11  -13 o   11.814   5.2445  -0.3891   10.082 -14.2257   14.559   12.359   13.975   11.353   5.4475   16.935   6.7442 -5.582173 8.669464 
1 1 1   18   11  -12 o   29.676   4.1864   39.829   9.8460   37.420   15.335   41.519   12.843   26.479   6.9995   29.245   5.5912 -2.765560 8.958484 
1 1 1   18   11  -11 o   8.1665   4.0244 -17.7487   9.5410  -4.2422   16.608 -24.4025   11.657   13.799   6.3615   8.6302   4.2875 5.168664 7.671439 
1 1 1   18   11  -10 o   14.700   5.5086   9.0883   8.9144  -2.0731   14.826   15.408   11.156   13.544   6.1553   17.782   6.2315 -4.238340 8.758921 
1 1 1   18   11   -9 f   12.157   5.1427   2.7656   8.7850   7.3224   14.630   0.1962   10.986   15.670   6.6331   12.438   5.5004 3.232083 8.616956 
1 1 1   18   11   -8 o   32.338   3.6562   46.068   9.4688   20.536   15.534   61.161   11.944   19.895   7.3059   37.029   4.0216 -17.13376 8.339638 
1 1 1   18   11   -7 o   24.077   5.3395   27.913   10.205   37.110   15.502   20.879   13.556   26.398   7.0650   20.082   6.8778 6.316072 9.859936 
1 1 1   18   11   -6 o   14.765   5.4865   9.2271   8.8059  -2.7831   15.139   15.369   10.826   13.561   6.1850   17.796   6.1443 -4.235227 8.718203 
1 1 1   18   11   -5 o   12.070   5.1264   2.4536   8.7886  -1.1277   15.016   4.3196   10.839   13.850   6.2543   13.586   5.7279 0.2643518 8.480899 
1 1 1   18   11   -4 o   19.748   5.4068   18.943   8.9569   20.579   14.877   18.014   11.218   19.959   7.1756   19.000   6.2543 0.9588642 9.518694 
1 1 1   18   11   -3 o   23.613   4.9756   26.311   9.2743   28.987   15.596   24.848   11.536   23.106   7.3560   22.180   6.1609 0.9262352 9.595137 
1 1 1   18   11   -2 o   22.871   5.4079   25.293   9.9225   19.928   20.633   26.907   11.317   20.036   8.1194   23.243   5.9489 -3.206110 10.06554 
1 1 1   18   11   -1 o   8.9419   4.2622  -9.1262   8.6015  -6.4712   14.644 -10.5247   10.628   12.689   5.8930   9.9522   4.7421 2.737097 7.564085 
1 1 1   18   11    0 o   10.156   4.7161  -5.6843   9.3737   3.3814   19.403  -8.4444   10.706   16.162   7.2185   10.376   4.8891 5.785572 8.718421 
1 1 1   18   11    1 o   11.522   5.1763  -1.8067   10.135   1.3200   31.489  -2.1681   10.705   18.427   8.5858   11.730   5.2903 6.696746 10.08477 
1 1 1   18   11    2 o   12.749   5.4795   2.3758   10.257 -11.0511   29.308   4.2500   10.950   16.596   7.8986   13.618   5.7502 2.978001 9.769979 
1 1 1   18   11    3 o   33.171   3.8756   48.806   10.282   51.842   19.872   47.697   12.015   30.502   7.9225   32.186   4.7198 -1.684322 9.221897 
1 1 1   18   11    4 o   22.202   5.1863   23.601   9.2156   17.948   15.610   26.626   11.418   19.071   7.2574   23.064   6.0126 -3.993406 9.424497 
1 1 1   18   11    5 o   11.574   5.1084  -0.1976   9.4322 -10.0740   18.406   3.3194   10.984   13.584   6.4039   13.338   5.7001 0.2466078 8.573240 
1 1 1   18   11    6 o   26.219   4.5626   31.659   9.3973   30.344   15.647   32.400   11.753   23.603   7.3485   25.694   5.7548 -2.091324 9.333694 
1 1 1   18   11    7 o   37.086   3.2963   59.628   9.8612   44.996   16.100   68.412   12.475   29.401   6.8461   39.243   3.9536 -9.842073 7.905694 
1 1 1   18   11    8 o   9.6247   4.5096  -6.6503   8.8877  -4.0347   15.082  -8.0417   11.001   13.284   6.1016   10.600   4.9824 2.684553 7.877440 
1 1 1   18   11    9 f   16.714   5.6725   13.260   9.2177   5.6823   15.228   17.642   11.580   15.420   6.6524   18.774   6.3581 -3.354274 9.202168 
1 1 1   18   11   10 o   12.175   5.2912   1.3393   9.7772  -9.7302   14.937   9.6384   12.933   12.220   5.7631   15.892   6.4326 -3.672485 8.636655 
1 1 1   18   11   11 o   14.182   5.4973   7.8080   9.0707   16.025   14.961   3.0325   11.406   18.291   7.0683   13.385   5.7658 4.906089 9.121716 
1 1 1   18   11   12 o   14.072   5.5919   7.1583   9.5872  -0.4891   17.209   10.600   11.545   14.674   6.6540   15.883   6.1892 -1.209697 9.087439 
1 1 1   18   11   13 o   33.947   3.7569   51.048   10.222   52.806   18.315   50.253   12.319   31.305   7.3105   32.954   4.7208 -1.649090 8.702276 
1 1 1   18   11   14 o   26.629   4.7729   33.159   9.9796   19.651   17.612   39.547   12.112   19.537   7.6355   28.659   5.3821 -9.121418 9.341689 
1 1 1   18   11   15 f   25.490   5.5051   31.739   11.104   28.298   18.182   33.786   14.022   22.198   7.9385   25.310   6.6945 -3.112032 10.38436 
1 1 1   18   11   16 o   11.182   5.1307  -3.9718   10.626 -12.9180   17.053   1.7067   13.586   12.552   5.9880   13.814   6.1124 -1.262104 8.556754 
1 1 1   18   11   17 o   11.788   5.2873  -1.1845   10.528 -13.3597   16.813   6.6703   13.504   12.384   5.9183   15.044   6.3706 -2.660052 8.695438 
1 1 1   18   11   18 o   16.068   5.8342   12.007   9.8651   43.180   17.242  -3.1642   12.028   27.837   7.4514   12.036   5.4984 15.80128 9.260426 
1 1 1   18   11   19 o   52.103   2.6753  115.522   11.324  120.478   19.897  113.148   13.772   50.843   4.8600   50.977   3.3326 -0.1335564 5.892853 
1 1 1   18   11   20 o   35.202   3.3189   54.157   9.4110   64.599   14.557   46.659   12.336   37.049   4.9434   31.391   4.9874 5.657871 7.022205 
1 1 1   18   11   21 o   28.809   4.4587   38.386   10.133   51.163   14.613   26.553   14.062   32.119   5.7946   21.992   6.9831 10.12718 9.074211 
1 1 1   18   11   22 o   21.222   5.8555   22.963   10.459   22.058   13.720   24.219   16.161   20.176   6.9188   20.741   7.4759 -0.5646667 10.18626 
1 1 1   18   11   23 o   13.700   5.6263   6.1288   10.069   22.961   13.150 -17.7327   15.656   20.590   6.7712   11.259   5.4625 9.330953 8.699846 
1 1 1   18   11   24 o   15.706   5.9325   11.258   10.384   1.7090   13.403   25.594   16.422   13.607   6.0432   21.109   7.5450 -7.502435 9.666840 
1 1 1   18   11   25 o   15.616   5.7208   11.385   9.5161   13.516   13.369   9.1958   13.548   16.918   6.6405   15.592   6.4764 1.326880 9.275764 
1 1 1   18   11   26 o   22.289   5.3626   24.684   9.6243   17.128   13.437   32.645   13.792   18.158   6.7714   24.492   6.7107 -6.333780 9.533422 
1 1 1   18   11   27 o   29.845   4.6420   41.908   10.926   32.216   16.745   49.094   14.418   23.275   7.6403   31.143   5.8955 -7.867445 9.650446 
1 1 1   18   11   28 o   16.420   6.0029   13.208   10.469   33.363   16.539  -0.2673   13.524   23.698   7.5786   13.109   5.9260 10.58938 9.620485 
1 1 1   18   11   29 o   24.766   5.4387   30.684   10.678   59.126   16.939   11.926   13.756   33.500   6.4368   16.300   6.6207 17.20052 9.233963 
1 1 1   18   11   30 o   22.232   5.7577   25.564   10.517   12.327   15.989   35.658   13.962   16.684   6.9906   25.481   6.6518 -8.797409 9.649614 
1 1 1   18   11   31 o   25.214   5.2280   31.520   10.392   43.911   16.158   22.780   13.571   27.792   7.1057   20.044   6.8810 7.747362 9.891397 
1 1 1   18   11   32 o   18.602   6.3304   18.729   11.481   12.644   21.585   21.130   13.558   17.352   7.6898   19.334   6.8613 -1.982006 10.30588 
1 1 1   18   11   33 o   21.581   6.3007   25.514   11.771   6.9900   21.914   33.027   13.956   16.340   7.4480   24.112   6.8052 -7.772680 10.08878 
1 1 1   18   11   34 o   12.817   5.6334   2.6630   11.360   36.772   21.840  -9.9862   13.300   22.770   8.6030   11.069   5.2826 11.70136 10.09545 
1 1 1   18   11   35 o   17.900   6.3844   17.512   11.752   19.813   22.076   16.602   13.883   18.537   8.0035   17.493   6.7954 1.044540 10.49923 
1 1 1   18   11   36 o   13.850   5.8844   6.2792   11.585   28.077   22.509  -1.5758   13.513   20.258   8.3752   12.582   5.7777 7.676360 10.17475 
1 1 1   18   11   37 o   13.530   5.8118   5.3113   11.527  -7.9548   21.511   10.654   13.652   13.981   6.6850   15.548   6.4832 -1.567147 9.312434 
1 1 1   18   11   38 o   9.8949   4.7561 -10.7797   11.209   6.6359   21.993 -16.8914   13.028   16.026   7.3637   9.9261   4.8527 6.100269 8.818846 
1 1 1   18   11   39 o   13.783   5.8343   6.5357   11.318 -10.1981   21.359   13.069   13.346   13.613   6.5489   16.169   6.5380 -2.555724 9.253839 
1 1 1   18   11   40 o   25.512   7.7070   41.574   17.375   0.0000   0.0000   41.574   17.375  ?   ?    25.512   7.7070 0.000000 7.706967 
1 1 1   18   11   41 o   21.661   6.8688   27.961   13.610   0.0000   0.0000   27.961   13.610  ?   ?    21.661   6.8688 0.000000 6.868816 
1 1 1   18   11   42 o   17.877   6.7734   18.376   13.561   0.0000   0.0000   18.376   13.561  ?   ?    17.877   6.7734 0.000000 6.773401 
1 1 1   18   11   43 o   24.781   6.7814   35.872   14.094   0.0000   0.0000   35.872   14.094  ?   ?    24.781   6.7814 0.000000 6.781352 
1 1 1   18   11   44 o   14.417   6.2400   7.3066   13.485   0.0000   0.0000   7.3066   13.485  ?   ?    14.417   6.2400 0.000000 6.240033 
1 1 1   18   11   45 o   16.145   6.5572   13.512   13.492   0.0000   0.0000   13.512   13.492  ?   ?    16.145   6.5572 0.000000 6.557217 
1 1 1   18   11   46 o   16.716   6.9900   15.151   15.937   0.0000   0.0000   15.151   15.937  ?   ?    16.716   6.9900 0.000000 6.990001 
1 1 1   18   11   47 o   14.417   6.5120   5.1122   16.291   0.0000   0.0000   5.1122   16.291  ?   ?    14.417   6.5120 0.000000 6.512035 
1 1 1   18   11   48 o   16.370   6.9613   14.094   16.240   0.0000   0.0000   14.094   16.240  ?   ?    16.370   6.9613 0.000000 6.961321 
1 1 1   18   11   49 o   12.040   5.7463  -7.8352   15.738   0.0000   0.0000  -7.8352   15.738  ?   ?    12.040   5.7463 0.000000 5.746316 
1 1 1   18   11   50 o   10.545   5.1913 -20.1194   15.745   0.0000   0.0000 -20.1194   15.745  ?   ?    10.545   5.1913 0.000000 5.191317 
1 1 1   18   11   51 o   10.729   5.2723 -19.1178   16.000   0.0000   0.0000 -19.1178   16.000  ?   ?    10.729   5.2723 0.000000 5.272330 
1 1 1   18   11   52 o   12.721   5.9869  -3.3828   15.967   0.0000   0.0000  -3.3828   15.967  ?   ?    12.721   5.9869 0.000000 5.986895 
1 1 1   18   11   53 o   14.503   6.5301   6.4395   16.231   0.0000   0.0000   6.4395   16.231  ?   ?    14.503   6.5301 0.000000 6.530098 
1 1 1   18   11   54 o   23.235   7.7068   37.409   17.023   0.0000   0.0000   37.409   17.023  ?   ?    23.235   7.7068 0.000000 7.706844 
1 1 1   18   11   55 o   22.472   9.0086   46.010   25.101   0.0000   0.0000   46.010   25.101  ?   ?    22.472   9.0086 0.000000 9.008600 
1 1 1   18   11   56 o   13.252   6.4603 -11.8470   22.629   0.0000   0.0000 -11.8470   22.629  ?   ?    13.252   6.4603 0.000000 6.460320 
1 1 1   18   11   57 o   20.990   8.6861   39.043   24.243   0.0000   0.0000   39.043   24.243  ?   ?    20.990   8.6861 0.000000 8.686101 
1 1 1   18   11   58 o   16.269   6.9216   15.151   16.067   0.0000   0.0000   15.151   16.067  ?   ?    16.269   6.9216 0.000000 6.921554 
1 1 1   18   11   59 o   21.173   8.6652   40.144   23.779   0.0000   0.0000   40.144   23.779  ?   ?    21.173   8.6652 0.000000 8.665159 
1 1 1   18   11   60 o   19.811   8.3758   33.808   23.282   0.0000   0.0000   33.808   23.282  ?   ?    19.811   8.3758 0.000000 8.375833 
1 1 1   18   11   61 o   15.658   7.3359   9.7988   23.513   0.0000   0.0000   9.7988   23.513  ?   ?    15.658   7.3359 0.000000 7.335935 
1 1 1   18   11   62 f   17.835   7.9179   24.162   22.985   0.0000   0.0000   24.162   22.985  ?   ?    17.835   7.9179 0.000000 7.917918 
1 1 1   18   11   63 o   18.237   8.0624   26.564   23.586   0.0000   0.0000   26.564   23.586  ?   ?    18.237   8.0624 0.000000 8.062366 
1 1 1   18   12  -54 f   12.937   6.4378 -22.6557   26.714   0.0000   0.0000 -22.6557   26.714  ?   ?    12.937   6.4378 0.000000 6.437754 
1 1 1   18   12  -53 o   16.619   7.8042   17.227   26.875   0.0000   0.0000   17.227   26.875  ?   ?    16.619   7.8042 0.000000 7.804155 
1 1 1   18   12  -52 o   21.427   7.7721   34.578   17.501   0.0000   0.0000   34.578   17.501  ?   ?    21.427   7.7721 0.000000 7.772141 
1 1 1   18   12  -51 f   19.885   8.2639   33.776   22.075   0.0000   0.0000   33.776   22.075  ?   ?    19.885   8.2639 0.000000 8.263899 
1 1 1   18   12  -50 o   13.676   6.5529  -3.0071   20.910   0.0000   0.0000  -3.0071   20.910  ?   ?    13.676   6.5529 0.000000 6.552940 
1 1 1   18   12  -49 o   17.216   7.6624   19.978   21.665   0.0000   0.0000   19.978   21.665  ?   ?    17.216   7.6624 0.000000 7.662446 
1 1 1   18   12  -48 o   13.233   6.0824   2.1752   15.023 -13.0454   22.110   15.228   20.475   12.926   6.3196   16.387   7.3597 -3.460949 9.700695 
1 1 1   18   12  -47 f   10.323   5.0776 -18.1492   14.955  -4.2811   22.362 -29.3694   20.115   13.893   6.6881   11.036   5.5069 2.856975 8.663516 
1 1 1   18   12  -46 o   12.627   5.9398  -2.5366   15.683 -32.3763   22.893   23.850   21.528   11.596   5.7996   18.091   7.8569 -6.495263 9.765578 
1 1 1   18   12  -45 o   15.912   6.8312   13.678   15.908 -19.8645   22.896   44.981   22.119   12.554   6.1956   23.122   8.6746 -10.56804 10.65997 
1 1 1   18   12  -44 o   15.478   6.4642   12.494   13.604   10.834   22.928   13.396   16.901   15.977   7.4039   15.946   6.9429 0.3080273E-01 10.14995 
1 1 1   18   12  -43 o   15.279   6.4035   11.742   13.420   41.347   23.035  -3.4706   16.512   21.980   8.6890   12.779   6.0366 9.201530 10.58012 
1 1 1   18   12  -42 o   17.907   6.7415   19.768   13.384   11.848   22.311   24.220   16.728   16.159   7.4218   18.865   7.4209 -2.705526 10.49537 
1 1 1   18   12  -41 o   13.992   6.1540   6.6157   13.577 -19.2393   22.045   22.415   17.233   12.493   6.1488   18.316   7.4211 -5.823633 9.637500 
1 1 1   18   12  -40 o   12.783   5.8241   1.3710   13.380   31.757   23.366 -13.4515   16.320   19.855   8.3926   11.438   5.5557 8.416866 10.06486 
1 1 1   18   12  -39 o   21.585   7.6617   32.354   16.906   0.0000   0.0000   32.354   16.906  ?   ?    21.585   7.6617 0.000000 7.661733 
1 1 1   18   12  -38 o   12.538   5.9365  -4.9329   16.143   0.0000   0.0000  -4.9329   16.143  ?   ?    12.538   5.9365 0.000000 5.936467 
1 1 1   18   12  -37 o   28.941   5.3604   43.507   12.180   6.8089   21.990   59.749   14.630   15.510   7.2094   33.819   5.4954 -18.30832 9.064997 
1 1 1   18   12  -36 o   17.898   6.4362   18.799   11.970   20.442   21.924   18.101   14.287   17.826   7.8308   17.407   6.8549 0.4186440 10.40727 
1 1 1   18   12  -35 o   11.611   5.3421  -1.6315   11.628   4.0330   21.926  -3.8481   13.715   15.176   7.1018   11.967   5.6055 3.209286 9.047512 
1 1 1   18   12  -34 o   30.563   5.1756   47.507   12.435   27.408   23.011   55.797   14.778   19.269   8.2428   32.350   5.8180 -13.08175 10.08928 
1 1 1   18   12  -33 o   12.135   5.4933   0.5216   11.669 -10.9973   21.771   5.1646   13.822   13.384   6.4809   13.861   6.1476 -0.4774504 8.932837 
1 1 1   18   12  -32 o   16.606   6.3249   15.178   11.862   7.5819   21.639   18.442   14.183   15.766   7.2659   17.665   6.8668 -1.899072 9.997297 
1 1 1   18   12  -31 o   14.674   6.0721   9.5365   11.847   15.070   22.164   7.3236   14.017   17.085   7.6665   14.470   6.3112 2.614714 9.930120 
1 1 1   18   12  -30 o   15.590   6.2022   12.239   11.807   6.4453   22.384   14.472   13.897   15.771   7.3111   16.458   6.6658 -0.6869612 9.893707 
1 1 1   18   12  -29 o   18.206   6.4594   19.067   12.015  -7.0957   21.941   30.274   14.360   13.954   6.6934   22.176   7.0584 -8.221560 9.727365 
1 1 1   18   12  -28 o   19.184   6.4832   21.348   12.040   31.053   22.765   17.579   14.186   20.403   8.4277   17.493   6.8480 2.909983 10.85914 
1 1 1   18   12  -27 o   15.880   6.2458   12.909   11.849  -8.6633   22.463   21.225   13.947   13.932   6.7060   18.802   6.9195 -4.869687 9.635830 
1 1 1   18   12  -26 o   13.625   6.1220   3.1474   14.183 -26.0981   22.276   23.087   18.393   12.236   6.0521   18.946   7.6703 -6.709804 9.770467 
1 1 1   18   12  -25 o   27.005   6.7070   41.835   14.697   39.584   22.932   43.405   19.147   22.574   8.7434   25.148   8.1643 -2.574430 11.96256 
1 1 1   18   12  -24 o   15.015   6.3755   9.3041   13.586   8.3369   21.888   9.9103   17.329   16.123   7.3851   15.767   6.9431 0.3557310 10.13634 
1 1 1   18   12  -23 o   11.752   5.2994  -0.0151   10.737  -4.0913   16.776   2.8133   13.974   13.100   6.1562   13.530   6.0782 -0.4303522 8.651272 
1 1 1   18   12  -22 o   14.143   5.8245   8.1344   10.830   16.803   14.434  -3.0312   16.382   17.355   6.8726   13.165   6.1534 4.190013 9.224826 
1 1 1   18   12  -21 o   9.2556   4.4283  -8.9007   9.4709  -3.6834   13.884 -13.4417   12.953   12.241   5.7028   10.319   4.9972 1.922711 7.582515 
1 1 1   18   12  -20 o   22.084   5.6012   25.634   10.096   33.705   14.740   18.500   13.858   23.685   7.0859   17.985   6.8396 5.700155 9.848305 
1 1 1   18   12  -19 o   16.064   5.8385   13.286   9.8831   24.527   14.259   2.8907   13.711   20.171   7.0465   13.532   6.0542 6.639915 9.290157 
1 1 1   18   12  -18 o   25.782   4.9526   32.875   10.030   21.689   14.460   43.248   13.925   19.100   7.0427   28.278   6.2114 -9.178221 9.390476 
1 1 1   18   12  -17 o   21.743   5.5192   24.623   9.7975   27.738   14.190   21.785   13.544   21.510   7.0316   19.293   6.8568 2.216339 9.821353 
1 1 1   18   12  -16 o   11.982   5.2437   2.1550   9.7464   22.424   14.185 -15.9697   13.414   19.452   7.0051   10.229   4.9840 9.223149 8.597219 
1 1 1   18   12  -15 o   32.513   3.9941   48.831   10.363   67.357   15.276   33.034   14.106   36.792   5.2417   23.818   6.8808 12.97400 8.649924 
1 1 1   18   12  -14 o   12.073   5.2307   2.7421   9.4938  -4.2500   13.754   9.1059   13.121   12.168   5.6712   15.038   6.3190 -2.870399 8.490706 
1 1 1   18   12  -13 o   16.938   5.8109   14.993   9.6776   25.136   14.317   6.4584   13.132   20.546   7.0670   14.326   6.1791 6.219825 9.387444 
1 1 1   18   12  -12 o   18.539   5.7665   18.197   9.6376   14.958   13.929   21.173   13.349   16.964   6.7406   19.202   6.8088 -2.237614 9.580988 
1 1 1   18   12  -11 o   12.920   5.8382   0.5636   13.110   0.0000   0.0000   0.5636   13.110  ?   ?    12.920   5.8382 0.000000 5.838187 
1 1 1   18   12  -10 o   14.235   5.6184   8.7113   9.6174   5.3874   13.938   11.732   13.287   14.304   6.2648   15.916   6.4912 -1.612282 9.021291 
1 1 1   18   12   -9 o   10.809   4.9061  -1.7331   9.3821  -0.5662   13.660  -2.7750   12.908   12.897   5.8795   12.169   5.6094 0.7283306 8.126132 
1 1 1   18   12   -8 o   20.933   5.9179   23.344   10.545   27.265   14.231   18.569   15.704   21.534   7.0419   18.224   7.1835 3.310362 10.05935 
1 1 1   18   12   -7 o   9.2486   4.5377 -17.6263   11.706 -37.5375   17.874  -2.6695   15.491   10.080   5.0536   13.144   6.0891 -3.063135 7.913059 
1 1 1   18   12   -6 o   23.038   6.3513   29.088   12.311   8.7430   18.543   45.126   16.463   16.082   7.1272   27.916   7.1908 -11.83386 10.12447 
1 1 1   18   12   -5 o   13.179   5.6417   4.5520   10.793   0.1966   17.809   7.0806   13.569   14.343   6.6034   14.690   6.3078 -0.3467493 9.132028 
1 1 1   18   12   -4 o   14.727   5.6943   9.7886   9.7142   7.2865   14.138   12.026   13.370   14.885   6.4157   16.084   6.5293 -1.198611 9.153904 
1 1 1   18   12   -3 f   11.461   5.2222  -1.9119   10.758  -7.9539   13.784   7.5057   17.209   11.628   5.4997   15.605   6.8932 -3.976545 8.818323 
1 1 1   18   12   -2 o   29.210   4.3340   39.981   10.007   42.363   14.276   37.681   14.030   28.030   6.3906   26.139   6.5881 1.890804 9.178414 
1 1 1   18   12   -1 o   30.644   4.1937   43.607   10.201   52.761   14.727   35.162   14.144   32.032   5.8560   24.988   6.7751 7.043669 8.955107 
1 1 1   18   12    0 o   17.065   5.8626   15.068   9.8516  -8.2076   14.130   37.085   13.743   11.734   5.5553   26.030   6.4975 -14.29572 8.548638 
1 1 1   18   12    1 o   35.070   4.1927   56.969   11.748   26.290   18.257   78.650   15.348   20.492   7.8365   40.631   4.7219 -20.13946 9.149195 
1 1 1   18   12    2 o   39.214   3.7671   69.536   11.894   47.019   18.838   84.461   15.337   27.430   7.9599   42.374   4.5093 -14.94426 9.148386 
1 1 1   18   12    3 f   10.672   4.8925  -2.9175   9.6344 -16.2889   13.689   10.207   13.562   10.389   5.0556   15.570   6.4747 -5.181720 8.214642 
1 1 1   18   12    4 o   12.199   5.2762   2.7504   9.6275  -0.6878   13.640   6.1637   13.591   12.899   5.8784   14.463   6.2620 -1.563648 8.588853 
1 1 1   18   12    5 o   7.8966   3.9079 -17.8276   9.3381  -7.7535   13.260 -27.7393   13.153   11.433   5.4034   8.8905   4.4387 2.542217 6.992783 
1 1 1   18   12    6 o   37.339   3.8427   63.389   11.529   39.350   14.811  100.353   18.366   26.415   6.8289   45.447   5.0424 -19.03215 8.488787 
1 1 1   18   12    7 o   7.9300   3.9018 -15.2733   8.8547 -18.2613   13.400 -12.9573   11.797   10.001   4.8960   9.9268   4.7982 0.7399940E-01 6.855200 
1 1 1   18   12    8 o   11.090   5.1259  -3.7610   10.882  -3.9375   17.418  -3.6480   13.937   13.534   6.3322   12.410   5.7585 1.123881 8.559072 
1 1 1   18   12    9 o   15.954   6.6125   11.430   14.080   18.253   22.376   6.9567   18.117   18.338   7.9865   15.608   6.9729 2.729858 10.60213 
1 1 1   18   12   10 o   10.331   5.0364 -16.7439   13.755   16.001   21.906 -38.0565   17.673   17.843   7.8334   9.9488   4.9929 7.894450 9.289325 
1 1 1   18   12   11 o   33.873   4.2805   53.664   11.555   43.443   17.162   62.141   15.629   26.727   7.5475   34.882   5.6929 -8.154442 9.453793 
1 1 1   18   12   12 o   14.673   5.8704   9.3846   10.637   14.274   16.086   5.5855   14.179   16.927   7.0461   14.388   6.3098 2.538776 9.458391 
1 1 1   18   12   13 o   27.104   5.1824   36.629   11.033   60.172   17.068   19.733   14.459   33.229   6.5344   18.535   7.0006 14.69395 9.576376 
1 1 1   18   12   14 o   17.251   6.1206   15.886   10.788   2.3418   16.182   26.722   14.474   14.181   6.4392   21.100   7.1083 -6.918630 9.591216 
1 1 1   18   12   15 o   18.545   6.1282   18.804   10.767   33.485   16.299   7.4390   14.341   23.098   7.5353   14.824   6.4254 8.274302 9.902802 
1 1 1   18   12   16 o   17.629   6.4261   17.062   11.985   40.040   16.593  -8.0003   17.329   25.492   7.4911   12.796   6.0851 12.69642 9.651138 
1 1 1   18   12   17 o   22.921   5.7927   27.873   10.826   35.359   16.445   22.146   14.383   23.703   7.5545   19.301   7.0391 4.401300 10.32563 
1 1 1   18   12   18 o   14.099   5.7635   8.0666   10.505   12.571   15.916   4.5893   13.984   16.329   6.9156   14.007   6.1994 2.322407 9.287471 
1 1 1   18   12   19 o   20.617   5.9859   23.166   10.651   22.730   16.118   23.504   14.191   19.241   7.3619   19.795   7.0201 -0.5538425 10.17251 
1 1 1   18   12   20 o   13.046   5.5843   4.8279   10.573   7.8892   16.043   2.4768   14.059   15.196   6.6865   13.529   6.0856 1.667538 9.041173 
1 1 1   18   12   21 o  ?   ?  -38.4862   9.9754 -32.7160   15.249 -42.8022   13.189   9.3211   4.6722   7.7002   3.9149 1.620942 6.095546 
1 1 1   18   12   22 o   14.446   5.8487   9.0949   10.695   4.5646   16.157   12.628   14.269   14.476   6.5166   16.082   6.6603 -1.605944 9.318026 
1 1 1   18   12   23 o   12.997   5.5551   4.9353   10.435   25.369   16.103  -9.8541   13.700   19.988   7.4209   11.136   5.3273 8.852067 9.135076 
1 1 1   18   12   24 o   19.323   6.1043   20.783   10.758   12.589   16.427   26.937   14.236   16.262   6.9607   20.983   7.0495 -4.721329 9.906887 
1 1 1   18   12   25 o   17.025   6.4004   15.940   12.055   34.505   23.393   9.2279   14.066   21.208   8.6266   15.064   6.4445 6.143693 10.76795 
1 1 1   18   12   26 o   26.828   5.9128   38.543   12.581   36.055   23.583   39.533   14.875   21.507   8.6932   25.896   6.9162 -4.388105 11.10885 
1 1 1   18   12   27 o   16.589   6.3969   14.842   12.235   22.155   23.274   12.049   14.382   18.549   8.1105   15.849   6.6348 2.699942 10.47860 
1 1 1   18   12   28 o   11.052   5.2980 -10.1658   13.702 -46.4289   22.710   10.589   17.181   10.929   5.5078   15.823   6.9422 -4.893788 8.861732 
1 1 1   18   12   29 o   17.195   6.7677   16.715   13.920   38.841   24.061   5.5852   17.066   21.953   8.8133   14.759   6.6659 7.193840 11.05031 
1 1 1   18   12   30 o   15.716   6.5487   11.970   13.916  -2.2577   22.359   20.965   17.779   14.598   6.9335   18.307   7.4926 -3.709669 10.20844 
1 1 1   18   12   31 o   13.266   6.0177   1.9236   14.090   0.0000   0.0000   1.9236   14.090  ?   ?    13.266   6.0177 0.000000 6.017666 
1 1 1   18   12   32 o   13.578   6.0843   3.7156   13.907   0.0000   0.0000   3.7156   13.907  ?   ?    13.578   6.0843 0.000000 6.084331 
1 1 1   18   12   33 o   11.384   5.4108  -7.4510   13.662   0.0000   0.0000  -7.4510   13.662  ?   ?    11.384   5.4108 0.000000 5.410765 
1 1 1   18   12   34 o   16.556   6.7245   15.165   14.190   0.0000   0.0000   15.165   14.190  ?   ?    16.556   6.7245 0.000000 6.724549 
1 1 1   18   12   35 o   13.895   6.1895   5.1690   14.166   0.0000   0.0000   5.1690   14.166  ?   ?    13.895   6.1895 0.000000 6.189512 
1 1 1   18   12   36 o   18.243   7.4415   21.627   17.466   0.0000   0.0000   21.627   17.466  ?   ?    18.243   7.4415 0.000000 7.441526 
1 1 1   18   12   37 o   15.641   6.5684   12.333   14.164   0.0000   0.0000   12.333   14.164  ?   ?    15.641   6.5684 0.000000 6.568374 
1 1 1   18   12   38 o   25.704   6.7978   39.598   14.459   0.0000   0.0000   39.598   14.459  ?   ?    25.704   6.7978 0.000000 6.797757 
1 1 1   18   12   39 o   18.089   7.4277   21.374   17.546   0.0000   0.0000   21.374   17.546  ?   ?    18.089   7.4277 0.000000 7.427746 
1 1 1   18   12   40 o   16.800   7.1655   16.392   17.297   0.0000   0.0000   16.392   17.297  ?   ?    16.800   7.1655 0.000000 7.165456 
1 1 1   18   12   41 o   20.840   7.7376   31.009   17.508   0.0000   0.0000   31.009   17.508  ?   ?    20.840   7.7376 0.000000 7.737571 
1 1 1   18   12   42 o   18.950   7.4673   24.632   16.964   0.0000   0.0000   24.632   16.964  ?   ?    18.950   7.4673 0.000000 7.467337 
1 1 1   18   12   43 o   11.574   5.6066 -11.9698   16.329   0.0000   0.0000 -11.9698   16.329  ?   ?    11.574   5.6066 0.000000 5.606637 
1 1 1   18   12   44 o   13.187   6.1783  -0.9292   16.679   0.0000   0.0000  -0.9292   16.679  ?   ?    13.187   6.1783 0.000000 6.178347 
1 1 1   18   12   45 o   23.908   7.7530   40.164   17.269   0.0000   0.0000   40.164   17.269  ?   ?    23.908   7.7530 0.000000 7.752980 
1 1 1   18   12   46 o   14.297   6.5011   5.9135   16.567   0.0000   0.0000   5.9135   16.567  ?   ?    14.297   6.5011 0.000000 6.501091 
1 1 1   18   12   47 f   12.772   6.0342  -2.9476   16.507   0.0000   0.0000  -2.9476   16.507  ?   ?    12.772   6.0342 0.000000 6.034225 
1 1 1   18   12   48 o   14.426   6.5117   7.0615   16.259   0.0000   0.0000   7.0615   16.259  ?   ?    14.426   6.5117 0.000000 6.511716 
1 1 1   18   12   49 o   12.324   5.8816  -5.7461   16.486   0.0000   0.0000  -5.7461   16.486  ?   ?    12.324   5.8816 0.000000 5.881610 
1 1 1   18   12   50 o   16.825   7.0929   17.973   16.617   0.0000   0.0000   17.973   16.617  ?   ?    16.825   7.0929 0.000000 7.092933 
1 1 1   18   12   51 f   17.702   7.2352   21.410   16.551   0.0000   0.0000   21.410   16.551  ?   ?    17.702   7.2352 0.000000 7.235151 
1 1 1   18   12   52 o   12.634   5.9901  -3.1657   16.545   0.0000   0.0000  -3.1657   16.545  ?   ?    12.634   5.9901 0.000000 5.990148 
1 1 1   18   12   54 f   14.850   6.6464   9.8117   16.540   0.0000   0.0000   9.8117   16.540  ?   ?    14.850   6.6464 0.000000 6.646400 
1 1 1   18   12   55 o   11.233   5.6599 -40.2346   23.931   0.0000   0.0000 -40.2346   23.931  ?   ?    11.233   5.6599 0.000000 5.659928 
1 1 1   18   13  -47 o   14.042   6.7220  -0.0958   21.885   0.0000   0.0000  -0.0958   21.885  ?   ?    14.042   6.7220 0.000000 6.721965 
1 1 1   18   13  -46 o   12.623   6.1512 -10.3221   20.456   0.0000   0.0000 -10.3221   20.456  ?   ?    12.623   6.1512 0.000000 6.151193 
1 1 1   18   13  -45 o   17.479   7.7218   23.268   21.600   0.0000   0.0000   23.268   21.600  ?   ?    17.479   7.7218 0.000000 7.721801 
1 1 1   18   13  -44 o   19.503   7.5750   28.890   17.249   0.0000   0.0000   28.890   17.249  ?   ?    19.503   7.5750 0.000000 7.574978 
1 1 1   18   13  -43 o   10.640   5.2591 -19.9090   16.727   0.0000   0.0000 -19.9090   16.727  ?   ?    10.640   5.2591 0.000000 5.259086 
1 1 1   18   13  -42 o   15.420   6.4688   13.495   13.716   24.508   23.438   7.7587   16.914   17.575   7.8855   14.406   6.5577 3.169572 10.25591 
1 1 1   18   13  -41 o   10.748   5.1782  -9.1852   13.466 -15.0778   23.029  -6.1231   16.601   12.747   6.2758   12.172   5.8342 0.5743494 8.568795 
1 1 1   18   13  -40 o   11.299   5.3829  -6.0926   13.685   23.947   23.203 -22.1142   16.945   17.599   7.8748   10.536   5.2231 7.062887 9.449451 
1 1 1   18   13  -39 o   25.417   6.7912   40.341   14.338   40.736   24.171   40.126   17.810   20.766   8.6401   23.106   7.8842 -2.340872 11.69668 
1 1 1   18   13  -38 o   12.954   5.9064   2.8723   13.791   14.543   23.375  -3.3591   17.080   16.189   7.4928   12.731   6.0507 3.457489 9.630869 
1 1 1   18   13  -37 o   17.447   6.7905   19.589   13.884   15.247   22.665   22.197   17.566   16.308   7.4866   17.778   7.3787 -1.469933 10.51167 
1 1 1   18   13  -36 o   13.395   6.0371   4.6208   13.914 -13.2671   23.103   14.801   17.429   13.039   6.3926   16.061   7.0207 -3.022129 9.495054 
1 1 1   18   13  -35 f   11.979   5.6087  -2.4153   13.705 -12.2276   23.144   2.8833   17.007   13.155   6.4389   13.734   6.3688 -0.5794230 9.056592 
1 1 1   18   13  -34 o   21.226   7.0726   29.932   14.333   12.926   23.174   40.469   18.241   16.078   7.4481   23.240   7.9775 -7.162369 10.91399 
1 1 1   18   13  -33 o   15.475   6.4840   12.932   13.754   17.061   22.762   10.558   17.261   16.711   7.6071   15.214   6.8008 1.497518 10.20391 
1 1 1   18   13  -32 o   18.197   7.5095   23.476   18.053 -11.5694   22.812   82.209   29.531   13.193   6.4436   28.680   10.131 -15.48755 12.00679 
1 1 1   18   13  -31 o   14.000   6.4853   3.4499   17.568 -11.5753   22.962   24.658   27.281   13.240   6.4664   17.886   8.2120 -4.645998 10.45232 
1 1 1   18   13  -30 o   25.754   7.2006   42.629   15.702   51.018   24.789   37.007   20.292   23.472   9.0906   21.444   8.2462 2.027790 12.27354 
1 1 1   18   13  -29 o   14.543   6.1550   9.7939   12.593   27.677   23.282   2.3980   14.973   18.705   8.1465   13.296   6.0967 5.409155 10.17524 
1 1 1   18   13  -28 o   23.818   6.5352   33.987   13.069   25.862   24.279   37.302   15.508   18.332   8.1382   23.782   7.3007 -5.449989 10.93303 
1 1 1   18   13  -27 f   13.074   5.8359   4.0138   12.661 -15.3323   23.048   12.374   15.152   12.988   6.3715   15.548   6.6706 -2.559134 9.224579 
1 1 1   18   13  -26 o   10.469   5.0204  -8.9752   12.325 -19.4563   22.457  -4.4570   14.744   12.506   6.1651   12.076   5.7044 0.4304991 8.399299 
1 1 1   18   13  -25 o   15.224   6.3173   11.796   12.873   34.401   24.106   2.7793   15.225   20.077   8.5073   13.483   6.1695 6.594700 10.50889 
1 1 1   18   13  -24 o   15.428   6.3473   12.423   12.845   31.694   23.547   4.2597   15.326   19.643   8.3687   13.807   6.2683 5.835201 10.45591 
1 1 1   18   13  -23 o   14.993   6.2896   10.885   12.966   3.8475   23.410   13.998   15.572   15.152   7.1666   16.060   6.8225 -0.9079571 9.894798 
1 1 1   18   13  -22 o   17.735   6.6108   19.073   12.804 -10.6533   23.708   31.315   15.213   13.634   6.6389   21.725   7.2874 -8.091895 9.858088 
1 1 1   18   13  -21 o   18.624   6.6172   21.250   12.614  -1.1862   22.873   31.055   15.121   14.488   6.9180   21.675   7.2651 -7.187420 10.03197 
1 1 1   18   13  -20 o   14.984   6.4396   10.210   14.166   4.7638   23.463   13.334   17.770   15.309   7.2210   16.082   7.0580 -0.7730474 10.09746 
1 1 1   18   13  -19 o   23.525   6.4812   32.663   12.825   19.325   23.914   38.048   15.194   17.448   7.8847   24.475   7.1619 -7.026865 10.65181 
1 1 1   18   13  -18 o   19.670   6.7048   23.923   12.880 -13.9580   23.525   40.140   15.392   13.314   6.5115   25.240   7.1547 -11.92533 9.674162 
1 1 1   18   13  -17 o   26.236   6.0533   38.328   12.683   27.091   23.257   43.084   15.131   18.900   8.1874   26.669   6.9060 -7.768591 10.71109 
1 1 1   18   13  -16 o   13.391   5.7697   6.1017   11.428   3.9295   17.465   7.7278   15.111   14.271   6.5590   14.574   6.4477 -0.3032675 9.197459 
1 1 1   18   13  -15 o   30.237   4.8609   45.759   11.575   34.397   17.821   54.050   15.223   21.933   7.8574   31.161   6.2111 -9.227379 10.01582 
1 1 1   18   13  -14 o   18.901   6.5948   21.647   12.487   39.595   25.415   15.937   14.336   21.213   8.8455   16.669   6.7632 4.543869 11.13485 
1 1 1   18   13  -13 o   11.284   5.2913  -4.4319   12.277   13.087   24.249 -10.4703   14.236   16.625   7.6723   11.093   5.3390 5.531981 9.347169 
1 1 1   18   13  -12 o   12.680   5.7063   2.1495   12.377 -15.0882   24.169   8.2773   14.410   13.419   6.5706   14.622   6.3880 -1.203288 9.164008 
1 1 1   18   13  -11 o   9.9282   4.7353  -8.0187   10.652   9.2459   16.671 -19.9287   13.846   15.210   6.7484   9.7880   4.8282 5.422248 8.297757 
1 1 1   18   13  -10 o   17.225   6.1774   16.869   11.018   14.518   16.861   18.621   14.556   16.425   7.0419   17.548   6.9164 -1.122988 9.870385 
1 1 1   18   13   -9 o   25.139   5.6934   33.959   11.395   31.481   17.696   35.715   14.894   21.134   7.7913   23.870   7.1185 -2.735296 10.55353 
1 1 1   18   13   -8 o   27.398   5.3248   38.890   11.464   48.556   17.824   32.071   14.971   27.251   7.6905   22.355   7.2163 4.896498 10.54600 
1 1 1   18   13   -7 o   16.890   6.1469   16.011   10.960   28.104   17.082   7.5500   14.288   20.235   7.6165   14.464   6.3389 5.770869 9.909193 
1 1 1   18   13   -6 o   16.151   6.0702   14.181   10.842   19.665   16.646   10.141   14.288   17.785   7.2609   15.115   6.4813 2.669892 9.732806 
1 1 1   18   13   -5 o   9.7502   4.7328 -12.8197   11.792 -14.2654   16.145 -11.1661   17.266   11.341   5.5127   12.088   5.8333 -0.7461405 8.026067 
1 1 1   18   13   -4 o   16.867   6.7428   16.275   14.022  -4.5944   22.891   28.810   17.740   14.269   6.8422   20.331   7.7369 -6.062241 10.32841 
1 1 1   18   13   -3 o   13.846   5.8093   7.6550   11.064   13.812   14.230  -1.7578   17.595   16.129   6.6629   13.474   6.3234 2.655444 9.185781 
1 1 1   18   13   -2 o   14.070   5.8463   8.3637   11.045   8.8106   14.274   7.6968   17.438   14.789   6.4103   15.071   6.7784 -0.2820358 9.329458 
1 1 1   18   13   -1 o   15.111   6.2249   10.969   12.375   13.635   14.358   3.2664   24.405   16.090   6.6740   15.451   7.3107 0.6398001 9.898922 
1 1 1   18   13    0 o   15.718   6.3148   12.852   12.362   13.015   14.366   12.387   24.267   15.916   6.6447   16.645   7.6794 -0.7293396 10.15506 
1 1 1   18   13    1 o   11.309   5.3797  -7.5269   13.566  -7.5269   13.566   0.0000   0.0000   11.309   5.3797  ?   ?  0.000000 5.379715 
1 1 1   18   13    2 o   13.226   5.8544   4.1408   12.475   8.3008   14.191 -10.0056   26.169   14.647   6.3700   14.335   6.9794 0.3119936 9.449230 
1 1 1   18   13    3 o   16.795   6.4903   15.973   12.615   20.537   14.488   1.6706   25.648   18.236   6.9792   15.430   7.3564 2.806021 10.14028 
1 1 1   18   13    4 o   11.470   5.2247  -0.6990   10.760  -2.5538   13.780   2.1977   17.221   12.221   5.6896   14.020   6.4686 -1.798570 8.614762 
1 1 1   18   13    5 o   15.836   6.4054   13.158   12.813   18.634   18.706   8.3174   17.587   17.491   7.4557   15.205   6.8256 2.286436 10.10825 
1 1 1   18   13    6 o   21.172   6.4223   26.301   12.048   22.667   16.682   30.262   17.418   18.640   7.3863   20.855   7.7224 -2.214905 10.68615 
1 1 1   18   13    7 o   21.047   6.4859   26.207   12.225   33.552   16.845   18.033   17.770   22.155   7.6636   17.331   7.3219 4.824314 10.59914 
1 1 1   18   13    8 o   34.885   4.6769   59.751   12.965   63.779   17.731   55.123   19.005   33.157   6.7890   28.930   7.8575 4.226936 10.38416 
1 1 1   18   13    9 o   19.302   6.5423   22.317   12.261   20.720   16.853   24.113   17.871   18.037   7.3276   18.885   7.5906 -0.8473072 10.55041 
1 1 1   18   13   10 o   11.601   5.3539  -1.9310   11.807 -10.5538   16.103   8.0969   17.365   11.767   5.6671   15.091   6.7777 -3.324209 8.834801 
1 1 1   18   13   11 o   29.126   5.4334   44.277   12.426   27.795   16.775   64.313   18.496   20.154   7.5558   32.708   7.1382 -12.55373 10.39445 
1 1 1   18   13   12 o   12.155   5.5239   0.4771   11.939   2.1734   16.001  -1.6531   17.931   13.681   6.2841   13.520   6.3569 0.1610689 8.938702 
1 1 1   18   13   13 o   8.1277   4.0768 -26.6708   11.706 -13.8235   15.826 -42.1921   17.396   11.245   5.4641   9.3522   4.7261 1.892920 7.224416 
1 1 1   18   13   14 o   32.452   5.9824   57.342   15.242   14.833   24.492   84.214   19.473   16.876   7.7601   38.780   6.3818 -21.90448 10.04724 
1 1 1   18   13   15 o   11.268   5.3870  -8.4356   13.959 -22.6655   23.046  -0.1902   17.543   12.487   6.1723   13.620   6.3667 -1.133051 8.867455 
1 1 1   18   13   16 o   26.928   6.7370   43.033   14.750   31.911   24.536   49.328   18.458   19.740   8.4792   26.934   7.8971 -7.194592 11.58709 
1 1 1   18   13   17 o   13.294   5.8320   5.1244   12.123   18.697   16.581 -10.4623   17.769   17.376   7.1863   12.249   5.9127 5.127205 9.306035 
1 1 1   18   13   18 o   15.910   6.6398   13.523   14.338   16.280   22.699   11.692   18.495   16.935   7.6643   15.829   7.0602 1.105600 10.42057 
1 1 1   18   13   19 o   9.1446   4.5565 -24.8000   13.566 -34.5678   21.782 -18.6107   17.339   11.232   5.6232   11.196   5.4991 0.3553391E-01 7.865172 
1 1 1   18   13   20 o   9.8307   4.8453 -19.1983   13.851  -4.2728   23.578 -27.0629   17.115   14.270   6.8690   10.332   5.1431 3.938595 8.581070 
1 1 1   18   13   21 o   18.665   7.0319   22.433   14.568   12.795   23.837   28.178   18.404   16.426   7.5900   19.729   7.7768 -3.303255 10.86681 
1 1 1   18   13   22 o   17.635   6.8909   19.306   14.343   21.420   23.175   17.993   18.260   17.769   7.9159   17.117   7.3331 0.6522369 10.79057 
1 1 1   18   13   23 o   12.423   5.7781  -1.4927   14.160 -31.1821   22.961   16.730   17.988   11.762   5.8713   16.805   7.2400 -5.043131 9.321437 
1 1 1   18   13   24 o   14.013   6.2528   6.0625   14.521   2.3487   23.425   8.3800   18.505   14.950   7.0997   15.138   6.8786 -0.1884489 9.885345 
1 1 1   18   13   25 o   18.972   7.1475   23.820   15.051   10.133   24.339   32.295   19.151   16.017   7.4911   20.631   7.9904 -4.613604 10.95277 
1 1 1   18   13   26 o   14.516   6.3723   8.4093   14.495   6.2362   24.238   9.6191   18.085   15.486   7.3151   15.275   6.8839 0.2109709 10.04482 
1 1 1   18   13   27 f   12.244   5.6156   0.1802   12.712 -19.3556   24.154   7.6639   14.949   12.888   6.3609   14.406   6.3910 -1.517981 9.016988 
1 1 1   18   13   28 o   16.252   6.4565   15.185   12.778   52.476   24.642   1.4712   14.944   24.039   9.1255   13.129   6.0460 10.90971 10.94664 
1 1 1   18   13   29 o   16.297   6.4796   15.381   12.880  -6.1002   23.951   24.120   15.277   14.008   6.7866   18.929   7.1852 -4.921511 9.883574 
1 1 1   18   13   30 o   17.617   6.6440   19.266   13.012   26.673   24.825   16.460   15.280   18.354   8.1836   16.561   6.8784 1.792627 10.69035 
1 1 1   18   13   31 o   9.6450   4.7201 -14.9385   12.422   25.592   23.541 -30.5781   14.623   18.206   8.0514   9.0323   4.5342 9.173864 9.240317 
1 1 1   18   13   32 o   18.644   7.5534   25.061   17.851   37.161   25.427   13.300   25.069   20.090   8.6309   16.287   7.6126 3.803301 11.50841 
1 1 1   18   13   33 o   16.248   6.6938   15.569   14.311   16.579   23.637   14.984   17.981   16.659   7.6470   16.181   7.1005 0.4789658 10.43522 
1 1 1   18   13   34 o   13.161   6.5000 -17.4872   25.361   0.0000   0.0000 -17.4872   25.361  ?   ?    13.161   6.5000 0.000000 6.500011 
1 1 1   18   13   35 f   17.111   7.9316   19.821   26.338   0.0000   0.0000   19.821   26.338  ?   ?    17.111   7.9316 0.000000 7.931603 
1 1 1   18   13   36 o   14.393   6.9915  -3.7020   25.851   0.0000   0.0000  -3.7020   25.851  ?   ?    14.393   6.9915 0.000000 6.991462 
1 1 1   18   13   37 o   23.471   8.0319   41.900   18.486   0.0000   0.0000   41.900   18.486  ?   ?    23.471   8.0319 0.000000 8.031895 
1 1 1   18   13   38 o   12.499   5.9867  -5.6879   17.412   0.0000   0.0000  -5.6879   17.412  ?   ?    12.499   5.9867 0.000000 5.986716 
1 1 1   18   13   39 o   16.559   7.1896   17.516   18.016   0.0000   0.0000   17.516   18.016  ?   ?    16.559   7.1896 0.000000 7.189620 
1 1 1   18   13   40 o   12.563   6.0145  -5.1679   17.531   0.0000   0.0000  -5.1679   17.531  ?   ?    12.563   6.0145 0.000000 6.014468 
1 1 1   18   13   41 o   17.157   7.3442   20.532   18.287   0.0000   0.0000   20.532   18.287  ?   ?    17.157   7.3442 0.000000 7.344170 
1 1 1   18   13   42 o   20.667   7.8980   34.166   18.536   0.0000   0.0000   34.166   18.536  ?   ?    20.667   7.8980 0.000000 7.897992 
1 1 1   18   13   43 o   14.759   6.7058   9.2129   17.584   0.0000   0.0000   9.2129   17.584  ?   ?    14.759   6.7058 0.000000 6.705846 
1 1 1   18   13   44 o   15.686   6.9431   13.935   17.544   0.0000   0.0000   13.935   17.544  ?   ?    15.686   6.9431 0.000000 6.943100 
1 1 1   18   13   45 o   11.238   5.5199 -16.2258   17.474   0.0000   0.0000 -16.2258   17.474  ?   ?    11.238   5.5199 0.000000 5.519937 
1 1 1   18   13   46 o   13.664   6.6623  -6.8145   24.086   0.0000   0.0000  -6.8145   24.086  ?   ?    13.664   6.6623 0.000000 6.662285 
1 1 1   18   13   47 o   20.669   8.7148   41.962   25.092   0.0000   0.0000   41.962   25.092  ?   ?    20.669   8.7148 0.000000 8.714818 
1 1 1   18   14  -34 o   13.644   6.6328  -5.2696   23.397   0.0000   0.0000  -5.2696   23.397  ?   ?    13.644   6.6328 0.000000 6.632810 
1 1 1   18   14  -33 o   14.935   7.0705   7.1943   22.883   0.0000   0.0000   7.1943   22.883  ?   ?    14.935   7.0705 0.000000 7.070457 
1 1 1   18   14  -32 o   22.518   8.9701   51.114   24.729   0.0000   0.0000   51.114   24.729  ?   ?    22.518   8.9701 0.000000 8.970150 
1 1 1   18   14  -31 o   16.754   7.3133   19.602   18.854   0.0000   0.0000   19.602   18.854  ?   ?    16.754   7.3133 0.000000 7.313303 
1 1 1   18   14  -30 o   12.033   5.6531  -1.8819   14.129   10.326   23.279  -9.0006   17.777   15.338   7.2217   12.048   5.8393 3.290632 9.287107 
1 1 1   18   14  -29 o   11.924   5.6358  -3.0785   14.428  -6.7359   23.188  -0.7683   18.429   13.425   6.5438   13.231   6.2875 0.1938696 9.074964 
1 1 1   18   14  -28 o   8.3244   4.2062 -33.9516   13.752 -44.8697   22.508 -27.4483   17.371   10.512   5.3196   10.153   5.0742 0.3586416 7.351545 
1 1 1   18   14  -27 o   11.260   5.3956  -6.9189   14.181   24.406   23.774 -24.2216   17.669   17.376   7.8559   10.510   5.2307 6.866508 9.437957 
1 1 1   18   14  -26 o   10.387   5.0842 -14.3657   14.435 -21.3893   23.275  -9.9755   18.401   12.195   6.0586   12.094   5.8801 0.1012278 8.442886 
1 1 1   18   14  -25 o   13.360   6.0607   4.9551   14.295 -12.1562   23.482   15.032   18.019   12.998   6.3872   15.833   7.0209 -2.835217 9.491536 
1 1 1   18   14  -24 o   10.510   5.1225 -12.7793   14.206 -30.9956   23.531  -2.3325   17.820   11.610   5.8171   12.921   6.1520 -1.310888 8.466722 
1 1 1   18   14  -23 o   14.483   6.3727   9.7275   14.572   12.631   23.955   8.0217   18.360   15.752   7.3878   14.602   6.7160 1.149720 9.984200 
1 1 1   18   14  -22 o   17.095   6.8226   19.269   14.332   9.6694   23.771   24.752   17.964   15.378   7.2580   18.146   7.4901 -2.767999 10.42977 
1 1 1   18   14  -21 o   15.530   6.8895   13.305   17.371   0.0000   0.0000   13.305   17.371  ?   ?    15.530   6.8895 0.000000 6.889485 
1 1 1   18   14  -20 o   14.598   6.6859   8.0639   17.936   0.0000   0.0000   8.0639   17.936  ?   ?    14.598   6.6859 0.000000 6.685923 
1 1 1   18   14  -19 o   10.512   5.2252 -23.8244   17.401   0.0000   0.0000 -23.8244   17.401  ?   ?    10.512   5.2252 0.000000 5.225160 
1 1 1   18   14  -18 o   12.534   5.8362  -0.0491   14.511 -16.4796   23.687   9.8212   18.359   12.765   6.3001   14.986   6.8257 -2.220890 9.288747 
1 1 1   18   14  -17 o   11.920   5.6254  -3.3372   14.276   8.5023   23.948  -9.8647   17.782   15.336   7.2523   12.040   5.8367 3.296184 9.309291 
1 1 1   18   14  -16 o   11.470   5.4714  -6.1706   14.227  -4.6327   23.924  -7.0121   17.697   13.898   6.7451   12.370   5.9534 1.528707 8.996623 
1 1 1   18   14  -15 o   13.482   6.1059   4.8563   14.434  -1.1950   23.826   8.3650   18.143   14.247   6.8699   14.749   6.7436 -0.5014820 9.626597 
1 1 1   18   14  -14 o   13.826   6.2134   6.2872   14.617   35.503   24.889  -9.0967   18.061   19.538   8.4667   12.229   5.9172 7.308881 10.32950 
1 1 1   18   14  -13 o   15.764   6.6374   14.330   14.524   1.7510   23.997   21.600   18.244   14.605   7.0041   17.494   7.4063 -2.889076 10.19365 
1 1 1   18   14  -12 o   21.004   7.2125   30.440   14.910   52.764   25.044   18.181   18.558   23.279   9.1029   16.711   7.2758 6.567591 11.65330 
1 1 1   18   14  -11 o   15.689   6.6432   13.992   14.683   28.241   24.991   6.4804   18.144   18.269   8.1737   14.453   6.6581 3.816097 10.54229 
1 1 1   18   14  -10 o   14.493   6.3604   9.3006   14.430   19.627   24.334   3.7002   17.921   16.950   7.7723   13.967   6.4976 2.982645 10.13054 
1 1 1   18   14   -9 o   16.628   6.7838   17.287   14.518   68.647   25.313  -7.8901   17.723   27.492   9.3989   12.303   5.9304 15.18898 11.11349 
1 1 1   18   14   -8 o   13.378   6.0715   4.2705   14.363   9.0206   24.065   1.6419   17.901   15.499   7.3112   13.650   6.3972 1.848392 9.714839 
1 1 1   18   14   -7 o   11.747   5.4400  -1.0536   12.347   1.6392   17.290  -3.8553   17.636   13.531   6.3236   12.806   6.1037 0.7251501 8.788833 
1 1 1   18   14   -6 o   13.706   6.1585   5.8147   14.355   3.0794   17.253   11.967   25.876   13.758   6.3918   15.998   7.5571 -2.239739 9.897668 
1 1 1   18   14   -5 o   17.969   6.9758   21.567   14.623   20.811   17.632   23.230   26.169   17.399   7.3190   17.478   8.0312 -0.7824898E-01 10.86586 
1 1 1   18   14   -4 o   15.111   6.5157   11.678   14.595   3.4086   17.219   32.773   27.503   13.810   6.4056   18.802   8.4797 -4.991507 10.62716 
1 1 1   18   14   -3 o   19.278   7.0303   25.143   14.346   21.889   17.539   31.721   24.939   17.685   7.3592   18.927   8.3320 -1.242128 11.11663 
1 1 1   18   14   -2 o   14.475   6.1322   10.087   12.521   15.461   17.416   4.3367   18.014   16.156   7.0411   14.107   6.5462 2.048967 9.614058 
1 1 1   18   14   -1 o   17.395   6.5451   18.934   12.612   7.5074   17.346   31.748   18.369   14.548   6.6296   20.245   7.8297 -5.696496 10.25944 
1 1 1   18   14    0 o   18.944   6.6441   22.951   12.684   12.544   17.421   34.690   18.503   15.534   6.8951   21.088   7.9293 -5.553345 10.50789 
1 1 1   18   14    1 o   11.165   5.2642  -4.4059   12.446  -0.1811   17.194  -9.0570   18.040   13.239   6.2249   12.260   5.9280 0.9785156 8.595983 
1 1 1   18   14    2 o   26.010   6.2747   39.563   13.149   70.605   18.710   9.2681   18.484   33.901   7.0025   15.007   6.8406 18.89367 9.789238 
1 1 1   18   14    3 o   19.077   6.6880   23.417   12.852   28.275   17.639   17.919   18.763   19.419   7.6258   16.698   7.2921 2.721407 10.55122 
1 1 1   18   14    4 o   10.242   4.9343  -9.5749   12.227  -1.7686   16.818 -18.3249   17.806   12.910   6.0967   11.199   5.5147 1.710974 8.220778 
1 1 1   18   14    5 o   11.653   5.5177  -4.6245   13.949  -0.9761   16.659 -13.1817   25.513   12.990   6.1138   13.460   6.6227 -0.4699850 9.013263 
1 1 1   18   14    6 o   18.175   7.0360   22.328   14.845   39.643   17.720 -18.4249   27.185   23.058   7.8643   13.345   6.6155 9.713501 10.27673 
1 1 1   18   14    7 o   18.603   7.0987   23.706   14.960   24.040   17.973   22.953   26.992   18.173   7.4958   17.410   8.0558 0.7638054 11.00374 
1 1 1   18   14    8 o   13.947   6.2116   7.0134   14.262   2.0152   16.968   19.042   26.323   13.522   6.3013   16.889   7.8629 -3.366902 10.07625 
1 1 1   18   14    9 o   19.991   7.2938   28.177   15.445   62.182   25.524   8.5325   19.399   25.520   9.3660   14.965   6.8906 10.55519 11.62761 
1 1 1   18   14   10 o   17.891   6.6507   20.499   12.942   7.6570   17.647   35.441   19.036   14.593   6.6641   21.075   8.0157 -6.481575 10.42413 
1 1 1   18   14   11 o   22.938   7.2172   35.502   15.052   52.224   25.036   26.036   18.837   23.166   9.0888   18.530   7.6612 4.636616 11.88701 
1 1 1   18   14   12 o   23.401   7.2518   36.971   15.258   17.868   25.068   48.213   19.230   16.685   7.7353   25.118   8.1840 -8.433880 11.26113 
1 1 1   18   14   13 o   14.863   6.4791   10.756   14.755  -5.1869   24.016   20.422   18.700   13.887   6.7441   17.191   7.3937 -3.304029 10.00748 
1 1 1   18   14   14 o   9.7312   4.8185 -20.5149   14.267  -1.2188   23.695 -31.4887   17.869   14.237   6.8612   10.084   5.0551 4.152443 8.522388 
1 1 1   18   14   15 o   22.590   7.2708   34.962   15.205   19.987   25.391   43.336   18.986   16.947   7.8317   23.540   8.1366 -6.593231 11.29336 
1 1 1   18   14   16 o   11.077   5.3437  -9.4881   14.456   10.837   24.224 -20.7305   18.016   15.669   7.3741   11.002   5.4416 4.667171 9.164520 
1 1 1   18   14   17 o   13.019   5.9762   2.6237   14.440   10.699   23.370  -2.3633   18.366   15.572   7.3014   13.117   6.2456 2.454223 9.608216 
1 1 1   18   14   18 o   15.429   6.5545   13.319   14.373  -7.1511   22.866   26.689   18.480   13.443   6.5404   18.647   7.6360 -5.203146 10.05410 
1 1 1   18   14   19 o   14.694   6.4338   10.359   14.690  -5.1575   24.017   19.635   18.569   13.816   6.7176   16.921   7.3231 -3.104630 9.937473 
1 1 1   18   14   20 o   12.621   5.8677   0.4527   14.580   14.294   23.404  -8.3254   18.639   16.005   7.4386   12.408   6.0055 3.597091 9.560316 
1 1 1   18   14   21 o   16.143   7.1309   16.118   18.416   0.0000   0.0000   16.118   18.416  ?   ?    16.143   7.1309 0.000000 7.130893 
1 1 1   18   14   22 o   17.977   7.4955   24.251   18.246   0.0000   0.0000   24.251   18.246  ?   ?    17.977   7.4955 0.000000 7.495519 
1 1 1   18   14   23 o   14.110   6.5268   5.6265   17.695   0.0000   0.0000   5.6265   17.695  ?   ?    14.110   6.5268 0.000000 6.526767 
1 1 1   18   14   24 o   15.660   6.6659   14.479   14.916   26.877   25.662   8.1533   18.331   17.715   8.0692   14.601   6.7138 3.114217 10.49706 
1 1 1   18   14   25 o   16.792   7.2190   19.447   17.813   2.0188   24.675   38.417   25.743   14.528   7.0015   19.574   8.5450 -5.046501 11.04704 
1 1 1   18   14   26 o   11.892   5.7736  -9.8430   17.568 -29.8852   24.035   13.148   25.742   11.769   5.8944   15.821   7.4926 -4.051772 9.533243 
1 1 1   18   14   27 o   13.053   6.1845  -0.7548   17.575 -31.9568   23.939   35.723   25.884   11.614   5.8259   19.025   8.4267 -7.411729 10.24451 
1 1 1   18   14   28 o   12.371   5.9221  -4.7595   16.991   11.550   23.387 -22.9898   24.726   15.500   7.2792   12.379   6.1656 3.120269 9.539430 
1 1 1   18   14   29 o   13.993   6.4707   5.5219   17.374 -17.3740   23.838   31.463   25.374   12.623   6.2464   18.399   8.2336 -5.775763 10.33486 
1 1 1   18   14   30 o   13.774   6.4119   4.0758   17.494   18.990   24.823 -10.6399   24.657   16.549   7.6811   13.321   6.5458 3.228207 10.09190 
1 1 1   18   14   31 o   11.228   5.6562 -37.9870   23.830   0.0000   0.0000 -37.9870   23.830  ?   ?    11.228   5.6562 0.000000 5.656180 
1 1 1   18   14   32 o   11.764   5.9018 -31.9622   24.588   0.0000   0.0000 -31.9622   24.588  ?   ?    11.764   5.9018 0.000000 5.901843 
1 1 1   18   14   33 o   18.749   8.3843   34.026   26.262   0.0000   0.0000   34.026   26.262  ?   ?    18.749   8.3843 0.000000 8.384296 
1 1 1   18   14   34 o   17.681   8.1386   27.140   27.033   0.0000   0.0000   27.140   27.033  ?   ?    17.681   8.1386 0.000000 8.138623 
1 1 1   18   15   -5 o   12.519   6.0987  -9.2943   20.062   0.0000   0.0000  -9.2943   20.062  ?   ?    12.519   6.0987 0.000000 6.098712 
1 1 1   18   15   -4 f   11.852   5.7976 -12.5555   18.676   0.0000   0.0000 -12.5555   18.676  ?   ?    11.852   5.7976 0.000000 5.797640 
1 1 1   18   15   -3 o   34.316   7.6140   79.167   20.741   0.0000   0.0000   79.167   20.741  ?   ?    34.316   7.6140 0.000000 7.613971 
1 1 1   18   15   -2 o   12.672   6.0953  -4.8166   18.490   0.0000   0.0000  -4.8166   18.490  ?   ?    12.672   6.0953 0.000000 6.095287 
1 1 1   18   15   -1 o   11.093   5.4843 -19.1255   18.228   0.0000   0.0000 -19.1255   18.228  ?   ?    11.093   5.4843 0.000000 5.484294 
1 1 1   18   15    0 o   11.891   5.7964 -11.0105   18.207   0.0000   0.0000 -11.0105   18.207  ?   ?    11.891   5.7964 0.000000 5.796400 
1 1 1   18   15    1 o   17.889   7.5561   25.117   18.918   0.0000   0.0000   25.117   18.918  ?   ?    17.889   7.5561 0.000000 7.556087 
1 1 1   18   15    2 o   13.743   6.4524   3.3286   18.354   0.0000   0.0000   3.3286   18.354  ?   ?    13.743   6.4524 0.000000 6.452405 
1 1 1   18   15    3 o   16.499   7.3388   18.922   19.841   0.0000   0.0000   18.922   19.841  ?   ?    16.499   7.3388 0.000000 7.338751 
1 1 1   18   15    4 f   10.653   5.3104 -25.2945   18.513   0.0000   0.0000 -25.2945   18.513  ?   ?    10.653   5.3104 0.000000 5.310416 
1 1 1   18   15    5 o   12.346   6.0339 -11.0898   20.102   0.0000   0.0000 -11.0898   20.102  ?   ?    12.346   6.0339 0.000000 6.033926 
1 1 1   18   15    6 o   14.356   7.0456  -3.4325   28.281   0.0000   0.0000  -3.4325   28.281  ?   ?    14.356   7.0456 0.000000 7.045611 
1 1 1   19    0 -105 o   16.259   10.004   25.483   25.747   25.483   25.747   25.483   25.747   16.259   10.004   16.259   10.004 0.000000 0.000000 
1 1 1   19    0 -104 o   9.7427   6.9612 -21.8273   25.043 -21.8273   25.043 -21.8273   25.043   9.7427   6.9612   9.7427   6.9612 0.000000 0.000000 
1 1 1   19    0 -103 o   12.341   8.3717   3.2406   25.226   3.2406   25.226   3.2406   25.226   12.341   8.3717   12.341   8.3717 0.000000 0.000000 
1 1 1   19    0 -102 o   17.652   10.715   32.757   28.653   32.757   28.653   32.757   28.653   17.652   10.715   17.652   10.715 0.000000 0.000000 
1 1 1   19    0 -101 o   15.495   9.7712   21.448   26.152   21.448   26.152   21.448   26.152   15.495   9.7712   15.495   9.7712 0.000000 0.000000 
1 1 1   19    0 -100 o   13.739   9.0543   11.308   25.956   11.308   25.956   11.308   25.956   13.739   9.0543   13.739   9.0543 0.000000 0.000000 
1 1 1   19    0  -99 o   14.467   9.3020   15.694   25.113   15.694   25.113   15.694   25.113   14.467   9.3020   14.467   9.3020 0.000000 0.000000 
1 1 1   19    0  -98 o   9.1770   6.6025 -28.3619   24.224 -28.3619   24.224 -28.3619   24.224   9.1770   6.6025   9.1770   6.6025 0.000000 0.000000 
1 1 1   19    0  -97 o   21.332   9.9071   35.673   19.086   35.673   19.086   35.673   19.086   21.332   9.9071   21.332   9.9071 0.000000 0.000000 
1 1 1   19    0  -96 o   8.9368   6.3014 -14.0065   18.252 -14.0065   18.252 -14.0065   18.252   8.9368   6.3014   8.9368   6.3014 0.000000 0.000000 
1 1 1   19    0  -95 o   16.024   9.1830   21.455   19.014   21.455   19.014   21.455   19.014   16.024   9.1830   16.024   9.1830 0.000000 0.000000 
1 1 1   19    0  -94 o   9.4748   6.8524 -37.0387   27.748 -37.0387   27.748 -37.0387   27.748   9.4748   6.8524   9.4748   6.8524 0.000000 0.000000 
1 1 1   19    0  -93 o   10.316   7.0169  -3.3536   17.975  -3.3536   17.975  -3.3536   17.975   10.316   7.0169   10.316   7.0169 0.000000 0.000000 
1 1 1   19    0  -92 o   7.5007   5.4233 -27.2708   17.328 -27.2708   17.328 -27.2708   17.328   7.5007   5.4233   7.5007   5.4233 0.000000 0.000000 
1 1 1   19    0  -91 o   11.341   7.4666   2.8362   17.583   2.8362   17.583   2.8362   17.583   11.341   7.4666   11.341   7.4666 0.000000 0.000000 
1 1 1   19    0  -90 o   17.476   9.4910   24.760   19.031   24.760   19.031   24.760   19.031   17.476   9.4910   17.476   9.4910 0.000000 0.000000 
1 1 1   19    0  -89 o   8.2470   5.8825 -20.1125   17.591 -20.1125   17.591 -20.1125   17.591   8.2470   5.8825   8.2470   5.8825 0.000000 0.000000 
1 1 1   19    0  -88 o   12.124   7.8145   5.6035   17.863   5.6035   17.863   5.6035   17.863   12.124   7.8145   12.124   7.8145 0.000000 0.000000 
1 1 1   19    0  -87 o   13.413   8.3239   10.496   18.196   10.496   18.196   10.496   18.196   13.413   8.3239   13.413   8.3239 0.000000 0.000000 
1 1 1   19    0  -86 o   20.365   9.6292   30.108   18.091   30.108   18.091   30.108   18.091   20.365   9.6292   20.365   9.6292 0.000000 0.000000 
1 1 1   19    0  -85 o   15.261   8.8160   16.566   17.735   16.566   17.735   16.566   17.735   15.261   8.8160   15.261   8.8160 0.000000 0.000000 
1 1 1   19    0  -84 f   19.000   9.4088   26.192   17.536   26.192   17.536   26.192   17.536   19.000   9.4088   19.000   9.4088 0.000000 0.000000 
1 1 1   19    0  -83 o   30.174   6.9796   45.652   14.937   45.652   14.937   45.652   14.937   30.174   6.9796   30.174   6.9796 0.000000 0.000000 
1 1 1   19    0  -82 o   36.343   4.1700   57.789   11.932   57.789   11.932   57.789   11.932   36.343   4.1700   36.343   4.1700 0.000000 0.000000 
1 1 1   19    0  -81 o   43.687   3.3844   80.929   11.881   80.929   11.881   80.929   11.881   43.687   3.3844   43.687   3.3844 0.000000 0.000000 
1 1 1   19    0  -80 o   32.037   5.0910   46.643   12.291   46.643   12.291   46.643   12.291   32.037   5.0910   32.037   5.0910 0.000000 0.000000 
1 1 1   19    0  -79 o   25.883   5.7299   32.230   10.571   32.230   10.571   32.230   10.571   25.883   5.7299   25.883   5.7299 0.000000 0.000000 
1 1 1   19    0  -78 o   16.211   7.3869   16.731   10.588   16.731   10.588   16.731   10.588   16.211   7.3869   16.211   7.3869 0.000000 0.000000 
1 1 1   19    0  -77 o   17.505   7.4132   18.841   10.703   18.841   10.703   18.841   10.703   17.505   7.4132   17.505   7.4132 0.000000 0.000000 
1 1 1   19    0  -76 o   54.414   3.0762  123.581   13.544  123.581   13.544  123.581   13.544   54.414   3.0762   54.414   3.0762 0.000000 0.000000 
1 1 1   19    0  -75 o   29.829   5.2397   40.673   11.566   40.673   11.566   40.673   11.566   29.829   5.2397   29.829   5.2397 0.000000 0.000000 
1 1 1   19    0  -74 o   36.822   5.8766   61.664   16.294   61.664   16.294   61.664   16.294   36.822   5.8766   36.822   5.8766 0.000000 0.000000 
1 1 1   19    0  -73 o   39.251   4.4350   66.781   13.724   66.781   13.724   66.781   13.724   39.251   4.4350   39.251   4.4350 0.000000 0.000000 
1 1 1   19    0  -72 o   9.5879   6.2724  -0.4960   12.116  -0.4960   12.116  -0.4960   12.116   9.5879   6.2724   9.5879   6.2724 0.000000 0.000000 
1 1 1   19    0  -71 o   7.0791   5.0695 -20.2469   13.586 -20.2469   13.586 -20.2469   13.586   7.0791   5.0695   7.0791   5.0695 0.000000 0.000000 
1 1 1   19    0  -70 o   31.202   6.9074   46.851   15.362   46.851   15.362   46.851   15.362   31.202   6.9074   31.202   6.9074 0.000000 0.000000 
1 1 1   19    0  -69 o   8.2716   5.8581 -19.1978   16.358 -19.1978   16.358 -19.1978   16.358   8.2716   5.8581   8.2716   5.8581 0.000000 0.000000 
1 1 1   19    0  -68 o   48.819   4.1358  101.054   16.176  101.054   16.176  101.054   16.176   48.819   4.1358   48.819   4.1358 0.000000 0.000000 
1 1 1   19    0  -67 o   41.114   4.7313   73.159   15.312   73.159   15.312   73.159   15.312   41.114   4.7313   41.114   4.7313 0.000000 0.000000 
1 1 1   19    0  -66 o  115.782   2.2262  549.790   20.993  549.790   20.993  549.790   20.993  115.782   2.2262  115.782   2.2262 0.000000 0.000000 
1 1 1   19    0  -65 o   12.229   6.9743   8.5401   10.893   8.5401   10.893   8.5401   10.893   12.229   6.9743   12.229   6.9743 0.000000 0.000000 
1 1 1   19    0  -64 o   15.191   7.4885   14.557   11.087   14.557   11.087   14.557   11.087   15.191   7.4885   15.191   7.4885 0.000000 0.000000 
1 1 1   19    0  -63 o   37.474   4.0351   59.998   11.965   59.998   11.965   59.998   11.965   37.474   4.0351   37.474   4.0351 0.000000 0.000000 
1 1 1   19    0  -62 o   11.746   6.8597   7.2539   10.924   7.2539   10.924   7.2539   10.924   11.746   6.8597   11.746   6.8597 0.000000 0.000000 
1 1 1   19    0  -61 o   11.748   6.8608   7.2200   10.928   7.2200   10.928   7.2200   10.928   11.748   6.8608   11.748   6.8608 0.000000 0.000000 
1 1 1   19    0  -60 o   41.365   3.6628   72.057   12.118   72.057   12.118   72.057   12.118   41.365   3.6628   41.365   3.6628 0.000000 0.000000 
1 1 1   19    0  -59 o   60.580   2.7798  151.350   13.661  151.350   13.661  151.350   13.661   60.580   2.7798   60.580   2.7798 0.000000 0.000000 
1 1 1   19    0  -58 o   42.370   3.5926   75.365   12.195   75.365   12.195   75.365   12.195   42.370   3.5926   42.370   3.5926 0.000000 0.000000 
1 1 1   19    0  -57 o   19.020   7.4050   20.662   10.942   20.662   10.942   20.662   10.942   19.020   7.4050   19.020   7.4050 0.000000 0.000000 
1 1 1   19    0  -56 f   60.919   2.7401  152.867   13.544  152.867   13.544  152.867   13.544   60.919   2.7401   60.919   2.7401 0.000000 0.000000 
1 1 1   19    0  -55 o   44.862   3.5228   84.112   12.695   84.112   12.695   84.112   12.695   44.862   3.5228   44.862   3.5228 0.000000 0.000000 
1 1 1   19    0  -54 o   44.210   3.6302   81.824   12.873   81.824   12.873   81.824   12.873   44.210   3.6302   44.210   3.6302 0.000000 0.000000 
1 1 1   19    0  -53 o   67.484   2.8176  187.347   15.438  187.347   15.438  187.347   15.438   67.484   2.8176   67.484   2.8176 0.000000 0.000000 
1 1 1   19    0  -52 o   26.542   6.6374   34.035   12.423   34.035   12.423   34.035   12.423   26.542   6.6374   26.542   6.6374 0.000000 0.000000 
1 1 1   19    0  -51 o   44.341   3.9021   82.533   13.842   82.533   13.842   82.533   13.842   44.341   3.9021   44.341   3.9021 0.000000 0.000000 
1 1 1   19    0  -50 o   32.194   5.3711   46.067   12.917   46.067   12.917   46.067   12.917   32.194   5.3711   32.194   5.3711 0.000000 0.000000 
1 1 1   19    0  -49 o   74.735   2.8066  229.356   17.043  229.356   17.043  229.356   17.043   74.735   2.8066   74.735   2.8066 0.000000 0.000000 
1 1 1   19    0  -48 f   57.202   3.3508  135.327   15.500  135.327   15.500  135.327   15.500   57.202   3.3508   57.202   3.3508 0.000000 0.000000 
1 1 1   19    0  -47 f   18.228   7.5251   19.286   11.088   19.286   11.088   19.286   11.088   18.228   7.5251   18.228   7.5251 0.000000 0.000000 
1 1 1   19    0  -46 o   73.484   2.5030  221.363   14.953  221.363   14.953  221.363   14.953   73.484   2.5030   73.484   2.5030 0.000000 0.000000 
1 1 1   19    0  -45 o   41.403   4.0216   72.208   13.259   72.208   13.259   72.208   13.259   41.403   4.0216   41.403   4.0216 0.000000 0.000000 
1 1 1   19    0  -44 o   43.626   3.8511   79.746   13.439   79.746   13.439   79.746   13.439   43.626   3.8511   43.626   3.8511 0.000000 0.000000 
1 1 1   19    0  -43 o   9.0676   6.0440  -3.6906   12.116  -3.6906   12.116  -3.6906   12.116   9.0676   6.0440   9.0676   6.0440 0.000000 0.000000 
1 1 1   19    0  -42 o   67.172   2.9670  185.475   16.173  185.475   16.173  185.475   16.173   67.172   2.9670   67.172   2.9670 0.000000 0.000000 
1 1 1   19    0  -41 o   64.569   2.7409  171.217   14.367  171.217   14.367  171.217   14.367   64.569   2.7409   64.569   2.7409 0.000000 0.000000 
1 1 1   19    0  -40 o   11.395   6.8016   5.7377   11.164   5.7377   11.164   5.7377   11.164   11.395   6.8016   11.395   6.8016 0.000000 0.000000 
1 1 1   19    0  -39 o  119.736   2.5361  586.153   24.728  586.153   24.728  586.153   24.728  119.736   2.5361  119.736   2.5361 0.000000 0.000000 
1 1 1   19    0  -38 o   11.695   6.8768   6.5608   11.106   6.5608   11.106   6.5608   11.106   11.695   6.8768   11.695   6.8768 0.000000 0.000000 
1 1 1   19    0  -37 o   15.312   7.4781   14.250   11.016   14.250   11.016   14.250   11.016   15.312   7.4781   15.312   7.4781 0.000000 0.000000 
1 1 1   19    0  -36 o   26.615   5.8282   32.882   11.071   32.882   11.071   32.882   11.071   26.615   5.8282   26.615   5.8282 0.000000 0.000000 
1 1 1   19    0  -35 o   10.670   6.5091   4.1426   10.690   4.1426   10.690   4.1426   10.690   10.670   6.5091   10.670   6.5091 0.000000 0.000000 
1 1 1   19    0  -34 o   34.884   5.0577   52.896   13.502   52.896   13.502   52.896   13.502   34.884   5.0577   34.884   5.0577 0.000000 0.000000 
1 1 1   19    0  -33 o   28.224   5.5026   36.112   11.281   36.112   11.281   36.112   11.281   28.224   5.5026   28.224   5.5026 0.000000 0.000000 
1 1 1   19    0  -32 o  101.013   3.0932  417.938   25.416  417.938   25.416  417.938   25.416  101.013   3.0932  101.013   3.0932 0.000000 0.000000 
1 1 1   19    0  -31 o   12.858   7.8105   6.3621   15.250   6.3621   15.250   6.3621   15.250   12.858   7.8105   12.858   7.8105 0.000000 0.000000 
1 1 1   19    0  -30 o  108.155   3.0339  478.816   26.700  478.816   26.700  478.816   26.700  108.155   3.0339  108.155   3.0339 0.000000 0.000000 
1 1 1   19    0  -29 o   11.867   7.4838   2.6802   15.344   2.6802   15.344   2.6802   15.344   11.867   7.4838   11.867   7.4838 0.000000 0.000000 
1 1 1   19    0  -28 o   14.400   7.4305   12.490   11.185   12.490   11.185   12.490   11.185   14.400   7.4305   14.400   7.4305 0.000000 0.000000 
1 1 1   19    0  -27 o   58.562   2.8008  140.954   13.300  140.954   13.300  140.954   13.300   58.562   2.8008   58.562   2.8008 0.000000 0.000000 
1 1 1   19    0  -26 f  206.558   2.3496  1741.56   39.549  1741.56   39.549  1741.56   39.549  206.558   2.3496  206.558   2.3496 0.000000 0.000000 
1 1 1   19    0  -25 o  128.164   2.1320  670.632   22.259  670.632   22.259  670.632   22.259  128.164   2.1320  128.164   2.1320 0.000000 0.000000 
1 1 1   19    0  -24 o   31.318   5.0475   43.130   11.883   43.130   11.883   43.130   11.883   31.318   5.0475   31.318   5.0475 0.000000 0.000000 
1 1 1   19    0  -23 f   14.990   7.6124   13.584   11.626   13.584   11.626   13.584   11.626   14.990   7.6124   14.990   7.6124 0.000000 0.000000 
1 1 1   19    0  -22 o  118.319   2.1541  571.633   20.760  571.633   20.760  571.633   20.760  118.319   2.1541  118.319   2.1541 0.000000 0.000000 
1 1 1   19    0  -21 o   70.584   2.5808  204.117   14.804  204.117   14.804  204.117   14.804   70.584   2.5808   70.584   2.5808 0.000000 0.000000 
1 1 1   19    0  -20 o   14.967   7.6213   13.527   11.670   13.527   11.670   13.527   11.670   14.967   7.6213   14.967   7.6213 0.000000 0.000000 
1 1 1   19    0  -19 o  182.766   2.5921  1363.86   38.599  1363.86   38.599  1363.86   38.599  182.766   2.5921  182.766   2.5921 0.000000 0.000000 
1 1 1   19    0  -18 o   11.664   6.9914   5.7590   11.891   5.7590   11.891   5.7590   11.891   11.664   6.9914   11.664   6.9914 0.000000 0.000000 
1 1 1   19    0  -17 o  240.915   2.9221  2370.02   57.366  2370.02   57.366  2370.02   57.366  240.915   2.9221  240.915   2.9221 0.000000 0.000000 
1 1 1   19    0  -16 o  221.157   2.7945  1997.02   50.360  1997.02   50.360  1997.02   50.360  221.157   2.7945  221.157   2.7945 0.000000 0.000000 
1 1 1   19    0  -15 o   51.125   3.6430  108.374   15.002  108.374   15.002  108.374   15.002   51.125   3.6430   51.125   3.6430 0.000000 0.000000 
1 1 1   19    0  -14 o  204.317   3.2566  1705.68   54.207  1705.68   54.207  1705.68   54.207  204.317   3.2566  204.317   3.2566 0.000000 0.000000 
1 1 1   19    0  -13 o   12.370   7.3220   7.0192   12.739   7.0192   12.739   7.0192   12.739   12.370   7.3220   12.370   7.3220 0.000000 0.000000 
1 1 1   19    0  -12 o   22.441   7.7690   26.917   12.813   26.917   12.813   26.917   12.813   22.441   7.7690   22.441   7.7690 0.000000 0.000000 
1 1 1   19    0  -11 o  136.593   3.0266  762.652   33.661  762.652   33.661  762.652   33.661  136.593   3.0266  136.593   3.0266 0.000000 0.000000 
1 1 1   19    0  -10 o   77.058   3.5274  244.000   22.050  244.000   22.050  244.000   22.050   77.058   3.5274   77.058   3.5274 0.000000 0.000000 
1 1 1   19    0   -9 o  106.114   3.1127  460.807   26.872  460.807   26.872  460.807   26.872  106.114   3.1127  106.114   3.1127 0.000000 0.000000 
1 1 1   19    0   -8 o   59.580   4.0368  147.018   19.395  147.018   19.395  147.018   19.395   59.580   4.0368   59.580   4.0368 0.000000 0.000000 
1 1 1   19    0   -7 o  105.275   2.4935  452.899   21.370  452.899   21.370  452.899   21.370  105.275   2.4935  105.275   2.4935 0.000000 0.000000 
1 1 1   19    0   -6 o  107.649   2.4979  473.522   21.893  473.522   21.893  473.522   21.893  107.649   2.4979  107.649   2.4979 0.000000 0.000000 
1 1 1   19    0   -5 o  311.209   3.4278  3955.92   86.934  3955.92   86.934  3955.92   86.934  311.209   3.4278  311.209   3.4278 0.000000 0.000000 
1 1 1   19    0   -4 o   32.041   5.8228   45.935   13.721   45.935   13.721   45.935   13.721   32.041   5.8228   32.041   5.8228 0.000000 0.000000 
1 1 1   19    0   -3 o   51.758   3.5999  110.972   15.017  110.972   15.017  110.972   15.017   51.758   3.5999   51.758   3.5999 0.000000 0.000000 
1 1 1   19    0   -2 o   56.062   3.4101  129.736   15.450  129.736   15.450  129.736   15.450   56.062   3.4101   56.062   3.4101 0.000000 0.000000 
1 1 1   19    0   -1 o   85.267   2.6902  297.534   18.656  297.534   18.656  297.534   18.656   85.267   2.6902   85.267   2.6902 0.000000 0.000000 
1 1 1   19    0    0 o  102.088   2.5349  425.971   21.066  425.971   21.066  425.971   21.066  102.088   2.5349  102.088   2.5349 0.000000 0.000000 
1 1 1   19    0    1 o   92.264   2.6120  348.145   19.609  348.145   19.609  348.145   19.609   92.264   2.6120   92.264   2.6120 0.000000 0.000000 
1 1 1   19    0    2 o   76.114   2.8323  237.387   17.518  237.387   17.518  237.387   17.518   76.114   2.8323   76.114   2.8323 0.000000 0.000000 
1 1 1   19    0    3 o   82.463   2.7481  278.398   18.426  278.398   18.426  278.398   18.426   82.463   2.7481   82.463   2.7481 0.000000 0.000000 
1 1 1   19    0    4 o   54.788   3.4475  124.008   15.255  124.008   15.255  124.008   15.255   54.788   3.4475   54.788   3.4475 0.000000 0.000000 
1 1 1   19    0    5 o   7.9762   5.5513 -11.8038   12.879 -11.8038   12.879 -11.8038   12.879   7.9762   5.5513   7.9762   5.5513 0.000000 0.000000 
1 1 1   19    0    6 o   6.9147   4.9489 -20.1915   12.870 -20.1915   12.870 -20.1915   12.870   6.9147   4.9489   6.9147   4.9489 0.000000 0.000000 
1 1 1   19    0    7 o  102.720   2.5462  431.266   21.290  431.266   21.290  431.266   21.290  102.720   2.5462  102.720   2.5462 0.000000 0.000000 
1 1 1   19    0    8 o   42.330   4.3494   75.519   14.614   75.519   14.614   75.519   14.614   42.330   4.3494   42.330   4.3494 0.000000 0.000000 
1 1 1   19    0    9 o  177.649   2.5949  1288.45   37.559  1288.45   37.559  1288.45   37.559  177.649   2.5949  177.649   2.5949 0.000000 0.000000 
1 1 1   19    0   10 o   46.450   4.1833   90.292   15.529   90.292   15.529   90.292   15.529   46.450   4.1833   46.450   4.1833 0.000000 0.000000 
1 1 1   19    0   11 o  198.030   2.6910  1601.06   43.422  1601.06   43.422  1601.06   43.422  198.030   2.6910  198.030   2.6910 0.000000 0.000000 
1 1 1   19    0   12 o   49.111   3.8630  100.343   15.238  100.343   15.238  100.343   15.238   49.111   3.8630   49.111   3.8630 0.000000 0.000000 
1 1 1   19    0   13 o  114.338   3.0630  534.774   28.501  534.774   28.501  534.774   28.501  114.338   3.0630  114.338   3.0630 0.000000 0.000000 
1 1 1   19    0   14 o  207.878   3.3375  1765.81   56.521  1765.81   56.521  1765.81   56.521  207.878   3.3375  207.878   3.3375 0.000000 0.000000 
1 1 1   19    0   15 o  106.580   3.1126  464.898   26.989  464.898   26.989  464.898   26.989  106.580   3.1126  106.580   3.1126 0.000000 0.000000 
1 1 1   19    0   16 o  238.718   2.9558  2327.06   57.497  2327.06   57.497  2327.06   57.497  238.718   2.9558  238.718   2.9558 0.000000 0.000000 
1 1 1   19    0   17 o  253.522   3.0236  2624.79   62.466  2624.79   62.466  2624.79   62.466  253.522   3.0236  253.522   3.0236 0.000000 0.000000 
1 1 1   19    0   18 o   71.549   3.0412  210.104   17.664  210.104   17.664  210.104   17.664   71.549   3.0412   71.549   3.0412 0.000000 0.000000 
1 1 1   19    0   19 o   67.711   3.7269  189.004   20.427  189.004   20.427  189.004   20.427   67.711   3.7269   67.711   3.7269 0.000000 0.000000 
1 1 1   19    0   20 o   47.959   4.8972   97.024   18.649   97.024   18.649   97.024   18.649   47.959   4.8972   47.959   4.8972 0.000000 0.000000 
1 1 1   19    0   21 o  182.880   3.2122  1366.96   47.852  1366.96   47.852  1366.96   47.852  182.880   3.2122  182.880   3.2122 0.000000 0.000000 
1 1 1   19    0   22 o   15.443   9.8250   3.2879   27.121   3.2879   27.121   3.2879   27.121   15.443   9.8250   15.443   9.8250 0.000000 0.000000 
1 1 1   19    0   23 f   73.557   3.6382  222.686   21.693  222.686   21.693  222.686   21.693   73.557   3.6382   73.557   3.6382 0.000000 0.000000 
1 1 1   19    0   24 o   41.550   5.6203   74.516   18.055   74.516   18.055   74.516   18.055   41.550   5.6203   41.550   5.6203 0.000000 0.000000 
1 1 1   19    0   25 o   25.619   7.7910   33.451   14.201   33.451   14.201   33.451   14.201   25.619   7.7910   25.619   7.7910 0.000000 0.000000 
1 1 1   19    0   26 f   7.1512   5.0971 -18.9426   13.114 -18.9426   13.114 -18.9426   13.114   7.1512   5.0971   7.1512   5.0971 0.000000 0.000000 
1 1 1   19    0   27 o   85.033   2.8031  296.129   19.382  296.129   19.382  296.129   19.382   85.033   2.8031   85.033   2.8031 0.000000 0.000000 
1 1 1   19    0   28 o   75.956   3.5108  237.240   21.631  237.240   21.631  237.240   21.631   75.956   3.5108   75.956   3.5108 0.000000 0.000000 
1 1 1   19    0   29 o   10.319   6.7169  -1.0734   13.645  -1.0734   13.645  -1.0734   13.645   10.319   6.7169   10.319   6.7169 0.000000 0.000000 
1 1 1   19    0   30 o  143.550   2.5175  841.781   29.438  841.781   29.438  841.781   29.438  143.550   2.5175  143.550   2.5175 0.000000 0.000000 
1 1 1   19    0   31 o   15.985   8.2927   15.427   13.982   15.427   13.982   15.427   13.982   15.985   8.2927   15.985   8.2927 0.000000 0.000000 
1 1 1   19    0   32 o   12.907   8.1034   3.7580   17.768   3.7580   17.768   3.7580   17.768   12.907   8.1034   12.907   8.1034 0.000000 0.000000 
1 1 1   19    0   33 o   71.926   3.9110  213.453   22.774  213.453   22.774  213.453   22.774   71.926   3.9110   71.926   3.9110 0.000000 0.000000 
1 1 1   19    0   34 o  235.983   3.6339  2278.43   69.864  2278.43   69.864  2278.43   69.864  235.983   3.6339  235.983   3.6339 0.000000 0.000000 
1 1 1   19    0   35 o   69.584   3.1471  199.025   17.767  199.025   17.767  199.025   17.767   69.584   3.1471   69.584   3.1471 0.000000 0.000000 
1 1 1   19    0   36 o   12.578   7.5195   6.9411   13.685   6.9411   13.685   6.9411   13.685   12.578   7.5195   12.578   7.5195 0.000000 0.000000 
1 1 1   19    0   37 o   31.319   6.2561   44.761   14.175   44.761   14.175   44.761   14.175   31.319   6.2561   31.319   6.2561 0.000000 0.000000 
1 1 1   19    0   38 o   13.693   7.8427   9.9903   13.858   9.9903   13.858   9.9903   13.858   13.693   7.8427   13.693   7.8427 0.000000 0.000000 
1 1 1   19    0   39 o   78.744   2.8833  254.314   18.451  254.314   18.451  254.314   18.451   78.744   2.8833   78.744   2.8833 0.000000 0.000000 
1 1 1   19    0   40 o   20.039   8.4444   23.483   13.900   23.483   13.900   23.483   13.900   20.039   8.4444   20.039   8.4444 0.000000 0.000000 
1 1 1   19    0   41 o   9.1131   6.1721  -6.6856   13.603  -6.6856   13.603  -6.6856   13.603   9.1131   6.1721   9.1131   6.1721 0.000000 0.000000 
1 1 1   19    0   42 o   82.038   2.9037  276.054   19.363  276.054   19.363  276.054   19.363   82.038   2.9037   82.038   2.9037 0.000000 0.000000 
1 1 1   19    0   43 o   90.658   2.8475  336.854   20.996  336.854   20.996  336.854   20.996   90.658   2.8475   90.658   2.8475 0.000000 0.000000 
1 1 1   19    0   44 o   36.883   5.4452   59.444   15.325   59.444   15.325   59.444   15.325   36.883   5.4452   36.883   5.4452 0.000000 0.000000 
1 1 1   19    0   45 o   10.154   6.6783  -2.2691   14.014  -2.2691   14.014  -2.2691   14.014   10.154   6.6783   10.154   6.6783 0.000000 0.000000 
1 1 1   19    0   46 o   9.8109   6.6760  -8.8140   16.301  -8.8140   16.301  -8.8140   16.301   9.8109   6.6760   9.8109   6.6760 0.000000 0.000000 
1 1 1   19    0   47 f   20.792   8.3178   24.838   13.670   24.838   13.670   24.838   13.670   20.792   8.3178   20.792   8.3178 0.000000 0.000000 
1 1 1   19    0   48 f   47.614   3.9585   94.872   15.111   94.872   15.111   94.872   15.111   47.614   3.9585   47.614   3.9585 0.000000 0.000000 
1 1 1   19    0   49 o   18.932   8.2338   21.353   13.159   21.353   13.159   21.353   13.159   18.932   8.2338   18.932   8.2338 0.000000 0.000000 
1 1 1   19    0   50 o   11.810   7.1515   5.7075   12.701   5.7075   12.701   5.7075   12.701   11.810   7.1515   11.810   7.1515 0.000000 0.000000 
1 1 1   19    0   51 o   64.802   3.0167  172.987   15.856  172.987   15.856  172.987   15.856   64.802   3.0167   64.802   3.0167 0.000000 0.000000 
1 1 1   19    0   52 o   9.7414   6.4588  -3.1319   13.532  -3.1319   13.532  -3.1319   13.532   9.7414   6.4588   9.7414   6.4588 0.000000 0.000000 
1 1 1   19    0   53 o   20.479   8.5332   24.713   14.226   24.713   14.226   24.713   14.226   20.479   8.5332   20.479   8.5332 0.000000 0.000000 
1 1 1   19    0   54 o   15.543   8.1666   14.879   13.687   14.879   13.687   14.879   13.687   15.543   8.1666   15.543   8.1666 0.000000 0.000000 
1 1 1   19    0   55 o   97.577   2.5739  390.366   20.440  390.366   20.440  390.366   20.440   97.577   2.5739   97.577   2.5739 0.000000 0.000000 
1 1 1   19    0   56 f   24.302   7.5413   30.746   13.084   30.746   13.084   30.746   13.084   24.302   7.5413   24.302   7.5413 0.000000 0.000000 
1 1 1   19    0   57 o   36.307   4.7718   57.173   13.446   57.173   13.446   57.173   13.446   36.307   4.7718   36.307   4.7718 0.000000 0.000000 
1 1 1   19    0   58 o   44.850   3.8905   84.649   13.967   84.649   13.967   84.649   13.967   44.850   3.8905   44.850   3.8905 0.000000 0.000000 
1 1 1   19    0   59 o   67.992   3.0222  190.770   16.674  190.770   16.674  190.770   16.674   67.992   3.0222   67.992   3.0222 0.000000 0.000000 
1 1 1   19    0   60 o   83.044   2.7269  283.579   18.414  283.579   18.414  283.579   18.414   83.044   2.7269   83.044   2.7269 0.000000 0.000000 
1 1 1   19    0   61 o   51.439   3.4755  110.351   14.418  110.351   14.418  110.351   14.418   51.439   3.4755   51.439   3.4755 0.000000 0.000000 
1 1 1   19    0   62 o   27.700   6.6040   36.999   12.939   36.999   12.939   36.999   12.939   27.700   6.6040   27.700   6.6040 0.000000 0.000000 
1 1 1   19    0   63 o   8.9561   5.9923  -3.6684   12.108  -3.6684   12.108  -3.6684   12.108   8.9561   5.9923   8.9561   5.9923 0.000000 0.000000 
1 1 1   19    0   64 o   14.516   7.7541   13.191   12.508   13.191   12.508   13.191   12.508   14.516   7.7541   14.516   7.7541 0.000000 0.000000 
1 1 1   19    0   65 o   58.297   3.2384  141.224   15.280  141.224   15.280  141.224   15.280   58.297   3.2384   58.297   3.2384 0.000000 0.000000 
1 1 1   19    0   66 o   47.807   3.6427   96.016   14.001   96.016   14.001   96.016   14.001   47.807   3.6427   47.807   3.6427 0.000000 0.000000 
1 1 1   19    0   67 o   22.934   7.3228   28.057   12.059   28.057   12.059   28.057   12.059   22.934   7.3228   22.934   7.3228 0.000000 0.000000 
1 1 1   19    0   68 o   43.202   5.2904   81.680   17.884   81.680   17.884   81.680   17.884   43.202   5.2904   43.202   5.2904 0.000000 0.000000 
1 1 1   19    0   69 o   49.393   4.7840  104.809   18.819  104.809   18.819  104.809   18.819   49.393   4.7840   49.393   4.7840 0.000000 0.000000 
1 1 1   19    0   70 o   45.315   3.8901   87.060   14.116   87.060   14.116   87.060   14.116   45.315   3.8901   45.315   3.8901 0.000000 0.000000 
1 1 1   19    0   71 o   19.637   7.9352   23.081   12.401   23.081   12.401   23.081   12.401   19.637   7.9352   19.637   7.9352 0.000000 0.000000 
1 1 1   19    0   72 o   37.575   4.6254   61.648   13.592   61.648   13.592   61.648   13.592   37.575   4.6254   37.575   4.6254 0.000000 0.000000 
1 1 1   19    0   73 o   62.227   3.1536  161.210   15.902  161.210   15.902  161.210   15.902   62.227   3.1536   62.227   3.1536 0.000000 0.000000 
1 1 1   19    0   74 o   11.972   7.1517   7.4094   12.362   7.4094   12.362   7.4094   12.362   11.972   7.1517   11.972   7.1517 0.000000 0.000000 
1 1 1   19    0   75 o   27.366   6.7487   37.107   13.033   37.107   13.033   37.107   13.033   27.366   6.7487   27.366   6.7487 0.000000 0.000000 
1 1 1   19    0   76 o   33.279   5.2410   50.021   13.164   50.021   13.164   50.021   13.164   33.279   5.2410   33.279   5.2410 0.000000 0.000000 
1 1 1   19    0   77 o   22.766   7.7663   29.049   12.929   29.049   12.929   29.049   12.929   22.766   7.7663   22.766   7.7663 0.000000 0.000000 
1 1 1   19    0   78 o   9.9699   6.4237   1.4066   12.056   1.4066   12.056   1.4066   12.056   9.9699   6.4237   9.9699   6.4237 0.000000 0.000000 
1 1 1   19    0   79 o   9.7553   6.2883   1.3351   11.570   1.3351   11.570   1.3351   11.570   9.7553   6.2883   9.7553   6.2883 0.000000 0.000000 
1 1 1   19    0   80 o   14.220   8.2851   12.754   15.875   12.754   15.875   12.754   15.875   14.220   8.2851   14.220   8.2851 0.000000 0.000000 
1 1 1   19    0   81 o   7.1175   5.1291 -24.2255   14.893 -24.2255   14.893 -24.2255   14.893   7.1175   5.1291   7.1175   5.1291 0.000000 0.000000 
1 1 1   19    0   82 o   26.094   9.7033   42.072   19.182   42.072   19.182   42.072   19.182   26.094   9.7033   26.094   9.7033 0.000000 0.000000 
1 1 1   19    0   83 o   8.9460   6.1704  -8.5109   15.025  -8.5109   15.025  -8.5109   15.025   8.9460   6.1704   8.9460   6.1704 0.000000 0.000000 
1 1 1   19    0   84 f   14.818   7.6712   15.153   11.948   15.153   11.948   15.153   11.948   14.818   7.6712   14.818   7.6712 0.000000 0.000000 
1 1 1   19    0   85 o   18.806   7.7879   22.430   11.867   22.430   11.867   22.430   11.867   18.806   7.7879   18.806   7.7879 0.000000 0.000000 
1 1 1   19    0   86 o   7.3243   4.9548  -3.1337   8.7156  -3.1337   8.7156  -3.1337   8.7156   7.3243   4.9548   7.3243   4.9548 0.000000 0.000000 
1 1 1   19    0   87 o   13.918   6.7309   12.963   8.8943   12.963   8.8943   12.963   8.8943   13.918   6.7309   13.918   6.7309 0.000000 0.000000 
1 1 1   19    0   88 o   10.318   6.0621   6.3240   8.6177   6.3240   8.6177   6.3240   8.6177   10.318   6.0621   10.318   6.0621 0.000000 0.000000 
1 1 1   19    0   89 o   31.141   4.0043   43.255   9.7040   43.255   9.7040   43.255   9.7040   31.141   4.0043   31.141   4.0043 0.000000 0.000000 
1 1 1   19    0   90 o   22.693   5.8829   26.551   9.4035   26.551   9.4035   26.551   9.4035   22.693   5.8829   22.693   5.8829 0.000000 0.000000 
1 1 1   19    0   91 o   14.189   6.8127   13.761   9.0917   13.761   9.0917   13.761   9.0917   14.189   6.8127   14.189   6.8127 0.000000 0.000000 
1 1 1   19    0   92 o   10.337   6.3948   5.4347   10.657   5.4347   10.657   5.4347   10.657   10.337   6.3948   10.337   6.3948 0.000000 0.000000 
1 1 1   19    0   93 o   12.833   7.9473   10.452   16.502   10.452   16.502   10.452   16.502   12.833   7.9473   12.833   7.9473 0.000000 0.000000 
1 1 1   19    0   94 o   17.648   9.0308   24.557   16.435   24.557   16.435   24.557   16.435   17.648   9.0308   17.648   9.0308 0.000000 0.000000 
1 1 1   19    0   95 o   14.470   8.4524   16.308   16.592   16.308   16.592   16.308   16.592   14.470   8.4524   14.470   8.4524 0.000000 0.000000 
1 1 1   19    0   96 o   21.336   10.852   40.162   23.646   40.162   23.646   40.162   23.646   21.336   10.852   21.336   10.852 0.000000 0.000000 
1 1 1   19    0   97 o   8.9507   6.4195 -24.9154   22.135 -24.9154   22.135 -24.9154   22.135   8.9507   6.4195   8.9507   6.4195 0.000000 0.000000 
1 1 1   19    0   98 o   9.2315   6.6010 -22.8836   22.691 -22.8836   22.691 -22.8836   22.691   9.2315   6.6010   9.2315   6.6010 0.000000 0.000000 
1 1 1   19    0   99 o   10.751   7.4623  -7.2884   22.859  -7.2884   22.859  -7.2884   22.859   10.751   7.4623   10.751   7.4623 0.000000 0.000000 
1 1 1   19    0  100 o   15.072   9.4404   19.189   23.968   19.189   23.968   19.189   23.968   15.072   9.4404   15.072   9.4404 0.000000 0.000000 
1 1 1   19    0  101 o   14.759   9.2619   18.066   23.186   18.066   23.186   18.066   23.186   14.759   9.2619   14.759   9.2619 0.000000 0.000000 
1 1 1   19    0  102 o   9.6417   6.8227 -15.4861   22.032 -15.4861   22.032 -15.4861   22.032   9.6417   6.8227   9.6417   6.8227 0.000000 0.000000 
1 1 1   19    0  103 o   7.2008   5.2887 -46.6646   20.922 -46.6646   20.922 -46.6646   20.922   7.2008   5.2887   7.2008   5.2887 0.000000 0.000000 
1 1 1   19    0  104 o   11.058   7.6087  -3.2567   22.512  -3.2567   22.512  -3.2567   22.512   11.058   7.6087   11.058   7.6087 0.000000 0.000000 
1 1 1   19    0  105 o   16.877   9.9302   27.190   23.183   27.190   23.183   27.190   23.183   16.877   9.9302   16.877   9.9302 0.000000 0.000000 
1 1 1   19    1 -103 o   15.296   6.9419   7.0926   18.780   30.164   26.552 -16.0028   26.566   19.697   8.6363   14.004   6.8637 5.692526 11.03162 
1 1 1   19    1 -102 o   18.969   7.6735   23.985   18.392   59.553   26.283 -10.1438   25.746   26.209   9.5219   14.328   6.9637 11.88129 11.79653 
1 1 1   19    1 -101 o   16.544   7.2410   13.860   18.590   15.718   26.078   11.940   26.508   17.351   7.9892   16.870   7.8662 0.4813213 11.21175 
1 1 1   19    1 -100 o   13.440   6.3684  -4.4156   18.641   24.449   25.463 -37.7513   27.364   18.736   8.3250   12.603   6.3089 6.133003 10.44549 
1 1 1   19    1  -99 o   18.966   7.7768   23.751   19.198   44.387   27.998   5.4380   26.375   22.278   9.2866   16.173   7.6368 6.105570 12.02338 
1 1 1   19    1  -98 o   18.415   7.6927   21.122   19.273   16.953   28.189   24.781   26.409   17.882   8.2594   19.011   8.4607 -1.129229 11.82381 
1 1 1   19    1  -97 o   12.758   6.1489 -11.5891   19.032   27.185   27.650 -46.4975   26.236   19.454   8.6577   11.932   6.0012 7.521571 10.53418 
1 1 1   19    1  -96 o   25.645   9.7230   57.196   27.954   57.196   27.954   0.0000   0.0000   25.645   9.7230  ?   ?  0.000000 9.722992 
1 1 1   19    1  -95 o   22.406   8.1982   34.692   19.533   40.346   27.667   29.072   27.582   22.106   9.2245   20.012   8.7877 2.093998 12.74023 
1 1 1   19    1  -94 o   14.310   6.4002   4.1597   15.307  -2.7984   18.990   17.066   25.863   14.045   6.5843   18.145   8.1995 -4.099738 10.51588 
1 1 1   19    1  -93 f   12.523   5.7118  -0.8513   12.912   3.8721   18.305  -5.5287   18.215   14.995   6.8242   13.462   6.3537 1.532242 9.324127 
1 1 1   19    1  -92 o   10.725   5.1405 -11.0419   12.890 -12.7479   18.389  -9.3938   18.074   12.611   6.0692   12.936   6.1696 -0.3258238 8.654411 
1 1 1   19    1  -91 o   25.988   7.2863   39.696   16.054   30.213   30.568   43.309   18.866   20.623   9.1447   26.063   8.0616 -5.440105 12.19077 
1 1 1   19    1  -90 o   13.995   6.0845   4.8156   12.939   5.7900   18.789   3.9367   17.845   15.667   7.0422   15.109   6.8209 0.5575380 9.803928 
1 1 1   19    1  -89 o   21.023   6.7892   24.889   13.251   37.781   19.028   12.751   18.463   24.273   8.1501   17.103   7.3512 7.170263 10.97558 
1 1 1   19    1  -88 o   24.952   6.5556   33.850   13.504   38.552   19.253   29.297   18.946   24.596   8.1972   21.631   8.0459 2.964117 11.48606 
1 1 1   19    1  -87 o   13.286   5.9233   1.3407   13.002  -6.2813   18.275   9.1540   18.503   13.687   6.4300   16.493   7.2211 -2.805900 9.668977 
1 1 1   19    1  -86 o   19.465   6.8182   20.439   13.355   47.898   18.927  -6.7847   18.846   28.509   7.8812   13.879   6.5232 14.63008 10.23061 
1 1 1   19    1  -85 o   34.839   4.9457   57.256   13.651   71.235   19.275   43.188   19.336   37.063   6.6231   26.867   8.1334 10.19651 10.48894 
1 1 1   19    1  -84 o   12.605   5.6866  -1.4777   12.381   20.029   17.436 -23.3488   17.583   19.608   7.6159   11.522   5.6337 8.086108 9.473114 
1 1 1   19    1  -83 o   20.725   6.6878   22.369   12.859   30.449   18.136   14.199   18.236   23.110   7.9539   18.206   7.5337 4.904169 10.95537 
1 1 1   19    1  -82 o   26.498   6.0282   34.824   12.726   41.850   18.529   28.550   17.509   27.349   7.8817   22.697   7.8150 4.651871 11.09935 
1 1 1   19    1  -81 o   19.047   5.8916   17.734   10.076   30.684   16.956   10.664   12.528   23.707   7.6821   16.301   6.4191 7.406765 10.01095 
1 1 1   19    1  -80 o   14.314   5.3001   8.3124   8.2042   0.6628   11.326   16.759   11.901   12.867   5.6412   18.659   6.4421 -5.791606 8.562980 
1 1 1   19    1  -79 o   13.217   5.1263   6.0551   7.8909   3.9398   10.457   8.8523   12.025   13.503   5.6555   15.719   6.2573 -2.215481 8.434339 
1 1 1   19    1  -78 o   19.545   4.9082   17.713   7.8079   15.572   10.327   20.570   11.929   18.225   6.0009   20.533   6.4200 -2.307684 8.787954 
1 1 1   19    1  -77 o   20.560   4.7625   19.377   7.8248   15.020   10.367   25.144   11.928   18.037   6.0153   22.758   6.2427 -4.721313 8.669182 
1 1 1   19    1  -76 o   53.922   2.2020  120.804   9.6582  125.841   12.903  114.386   14.564   54.654   2.9068   51.741   3.4733 2.912739 4.529160 
1 1 1   19    1  -75 o   18.531   5.5325   15.856   8.9927   9.6518   10.756   30.263   16.391   15.895   6.0301   24.539   7.5006 -8.644153 9.623967 
1 1 1   19    1  -74 o   11.063   4.9318  -2.1139   9.0120  -2.9555   10.779  -0.1596   16.426   11.893   5.3408   15.191   6.7214 -3.298520 8.584992 
1 1 1   19    1  -73 o   23.744   5.2353   25.780   9.8597   27.210   12.257   23.158   16.597   23.964   6.2208   22.025   7.6076 1.939447 9.827188 
1 1 1   19    1  -72 o   32.631   3.2125   45.149   8.4341   47.913   11.415   41.827   12.516   33.121   4.3319   30.462   5.2287 2.658974 6.790035 
1 1 1   19    1  -71 o   19.461   5.0437   17.191   8.0661   8.5269   10.949   27.476   11.929   15.662   6.0481   24.244   6.0545 -8.582391 8.557842 
1 1 1   19    1  -70 o   16.491   5.4314   11.811   8.4598   12.445   12.561   11.286   11.445   17.652   6.5539   16.918   6.2607 0.7340584 9.063693 
1 1 1   19    1  -69 o   35.486   3.7566   53.856   10.702   62.115   19.692   50.394   12.749   36.295   6.9081   33.850   4.7509 2.444733 8.384066 
1 1 1   19    1  -68 o   41.802   3.3117   73.736   11.192   61.366   19.606   79.716   13.632   36.136   6.9076   43.188   3.9146 -7.051895 7.939690 
1 1 1   19    1  -67 o   59.587   2.6159  147.539   12.675  100.712   22.498  169.314   15.341   47.312   5.9659   63.669   2.9641 -16.35730 6.661621 
1 1 1   19    1  -66 o   12.409   5.3594   0.1929   9.9049   6.5168   15.618  -4.0621   12.811   16.836   6.9697   12.911   5.8083 3.924292 9.072693 
1 1 1   19    1  -65 o   48.230   3.0885   97.330   12.078  115.976   18.907   84.474   15.699   51.930   4.5112   44.325   4.4033 7.605598 6.303928 
1 1 1   19    1  -64 o   36.663   3.7587   57.075   11.074   51.472   13.546   68.364   19.229   34.281   4.9944   38.883   6.2808 -4.602142 8.024500 
1 1 1   19    1  -63 o   56.769   2.3255  133.110   10.738  140.903   13.495  119.659   17.730   58.218   2.8524   53.064   4.1315 5.153603 5.020501 
1 1 1   19    1  -62 o   44.403   2.7247   81.892   9.8144   79.142   12.590   86.152   15.670   43.349   3.5952   44.922   4.3330 -1.572918 5.630269 
1 1 1   19    1  -61 o   17.466   5.4306   13.236   8.5486   6.8045   11.048   22.829   13.494   15.315   6.0289   22.426   6.7957 -7.111155 9.084579 
1 1 1   19    1  -60 o   16.406   5.4355   11.228   8.4685   8.1749   11.099   15.482   13.101   15.876   6.1002   19.335   6.7545 -3.459969 9.101419 
1 1 1   19    1  -59 o   37.165   3.1284   57.688   9.3897   57.407   12.311   58.077   14.519   36.730   4.1863   36.632   4.9921 0.9875488E-01 6.515093 
1 1 1   19    1  -58 o   38.923   2.7691   62.873   8.7284   58.152   12.340   67.599   12.348   37.007   4.1628   40.049   3.8288 -3.042000 5.655893 
1 1 1   19    1  -57 o   33.535   3.1332   46.961   8.4657   46.329   11.864   47.616   12.083   32.881   4.5482   33.335   4.5667 -0.4546013 6.445210 
1 1 1   19    1  -56 o   37.965   2.8240   59.792   8.6767   60.990   12.102   58.524   12.447   38.029   3.9621   37.175   4.1797 0.8545303 5.759178 
1 1 1   19    1  -55 o   40.241   2.7571   67.046   8.9891   68.479   12.553   65.538   12.878   40.373   3.8614   39.426   4.0653 0.9477310 5.606912 
1 1 1   19    1  -54 o   61.334   2.0323  154.387   10.147  155.734   13.978  152.886   14.753   61.412   2.7996   60.792   2.9862 0.6194839 4.093316 
1 1 1   19    1  -53 o   52.534   2.2171  113.428   9.4728  115.207   13.077  111.464   13.741   52.750   3.0542   51.824   3.2694 0.9257507 4.474073 
1 1 1   19    1  -52 o   43.841   2.3385   79.106   8.3267   80.572   12.427   77.912   11.217   43.987   3.4945   43.325   3.1988 0.6615982 4.737491 
1 1 1   19    1  -51 o   23.857   4.1069   24.300   7.6986   20.407   11.815   27.173   10.149   21.613   6.3129   24.994   5.1526 -3.380985 8.148773 
1 1 1   19    1  -50 f   78.187   1.6877  249.979   10.757  264.999   16.204  238.145   14.382   80.312   2.4781   76.169   2.3191 4.143829 3.394057 
1 1 1   19    1  -49 o  106.132   1.7453  460.628   15.099  422.585   26.513  478.890   18.369  101.200   3.2181  108.138   2.0839 -6.937912 3.833864 
1 1 1   19    1  -48 o   34.666   3.0300   49.816   8.4762   52.590   13.383   47.957   10.953   35.203   4.7876   33.783   4.0587 1.420021 6.276519 
1 1 1   19    1  -47 o   73.431   1.8146  220.491   10.862  196.121   16.860  237.779   14.201   68.994   3.0051   76.148   2.2904 -7.153763 3.778464 
1 1 1   19    1  -46 o   76.344   1.7322  238.227   10.780  212.148   15.854  260.651   14.701   71.847   2.7120   79.745   2.2639 -7.898232 3.532714 
1 1 1   19    1  -45 o   17.036   5.3191   12.079   8.1918   25.415   11.927   0.1706   11.271   24.114   6.0724   13.513   5.7744 10.60043 8.379621 
1 1 1   19    1  -44 o   15.189   5.2759   8.7216   7.9870   15.871   12.292   3.4971   10.508   19.765   6.5486   14.163   5.7739 5.601746 8.730491 
1 1 1   19    1  -43 o   12.673   4.9552   4.1096   7.4207   6.5461   10.339   1.5208   10.657   15.218   5.8772   13.592   5.7020 1.626504 8.188674 
1 1 1   19    1  -42 o   28.182   3.5540   33.199   7.9833   33.951   11.478   32.494   11.111   28.139   5.1956   27.527   5.1407 0.6123657 7.309014 
1 1 1   19    1  -41 o   70.379   1.7857  202.501   10.236  199.897   14.250  205.279   14.713   69.819   2.5078   70.746   2.5555 -0.9265747 3.580477 
1 1 1   19    1  -40 o   40.963   2.7056   69.056   8.9838   57.353   12.714   80.724   12.696   37.024   4.2924   44.159   3.5570 -7.135193 5.574651 
1 1 1   19    1  -39 f   56.055   2.4838  128.879   11.321  126.497   15.590  131.536   16.467   55.367   3.4719   56.438   3.5981 -1.070698 5.000009 
1 1 1   19    1  -38 f   91.734   2.0247  343.941   15.140  321.655   21.638  365.317   21.192   88.513   3.0033   94.389   2.7572 -5.875633 4.077020 
1 1 1   19    1  -37 o   32.019   3.9263   42.820   10.034   49.026   13.413   34.935   15.119   34.065   4.9773   28.320   6.6614 5.745461 8.315538 
1 1 1   19    1  -36 o  101.311   2.0607  419.456   17.018  423.188   21.290  412.851   28.322  101.652   2.5714  100.203   3.4727 1.448677 4.321025 
1 1 1   19    1  -35 o   63.486   2.1419  164.917   11.069  146.092   14.450  191.646   17.218   59.635   2.9820   68.302   3.1007 -8.667408 4.301927 
1 1 1   19    1  -34 o   97.810   1.7435  390.617   13.901  394.433   21.473  387.865   18.239   98.128   2.6871   97.400   2.2972 0.7286148 3.535169 
1 1 1   19    1  -33 o  159.042   1.8227  1032.89   23.630  1017.68   33.433  1048.08   33.404  157.711   2.6006  160.059   2.5603 -2.347748 3.649406 
1 1 1   19    1  -32 o   71.410   1.9438  208.428   11.304  211.252   17.707  206.485   14.686   71.747   3.0344   71.004   2.5415 0.7424164 3.958164 
1 1 1   19    1  -31 o   76.268   1.8666  237.530   11.605  254.039   18.262  226.350   15.029   78.724   2.8505   74.357   2.4830 4.367546 3.780332 
1 1 1   19    1  -30 o  141.496   1.5194  817.006   17.525  789.798   24.731  844.448   24.838  139.030   2.1822  143.770   2.1194 -4.739883 3.042019 
1 1 1   19    1  -29 o   79.196   1.6965  256.011   10.952  254.069   15.729  257.838   15.258   78.794   2.4520   79.388   2.3604 -0.5945206 3.403481 
1 1 1   19    1  -28 o   64.477   1.8955  169.890   9.9515  166.542   14.341  173.000   13.821   63.741   2.7666   64.987   2.6143 -1.245819 3.806435 
1 1 1   19    1  -27 o  114.165   1.7492  532.013   16.278  558.462   23.468  507.484   22.600  116.882   2.4631  111.416   2.4884 5.465698 3.501274 
1 1 1   19    1  -26 o   81.754   1.9248  272.899   12.828  288.330   18.526  258.686   17.779   83.917   2.7118   79.477   2.7484 4.440483 3.861055 
1 1 1   19    1  -25 o   93.402   1.8336  356.128   13.960  334.448   19.602  378.442   19.887   90.396   2.6631   96.181   2.5387 -5.784592 3.679300 
1 1 1   19    1  -24 o   30.281   3.8906   38.238   9.3818   46.895   13.557   30.280   12.997   33.341   5.1542   26.511   6.1357 6.830378 8.013268 
1 1 1   19    1  -23 o   48.350   2.4166   95.768   9.4944   72.013   14.340  114.307   12.669   41.647   4.2852   52.772   2.9568 -11.12493 5.206358 
1 1 1   19    1  -22 o  118.150   1.6261  569.615   15.661  569.515   23.908  569.690   20.728  118.047   2.4846  118.105   2.1530 -0.5846405E-01 3.287648 
1 1 1   19    1  -21 o  142.200   1.6186  825.089   18.762  870.234   29.121  793.052   24.532  145.931   2.4481  139.350   2.1597 6.581284 3.264564 
1 1 1   19    1  -20 o   34.795   3.2325   49.989   9.0635   43.104   14.210   54.710   11.768   31.840   5.6836   36.290   4.0469 -4.450678 6.977166 
1 1 1   19    1  -19 o  117.884   1.7307  567.110   16.630  610.381   29.054  546.024   20.281  122.156   2.9178  115.632   2.1517 6.524261 3.625400 
1 1 1   19    1  -18 o  112.338   1.6360  514.931   14.981  509.850   22.893  518.737   19.813  111.697   2.5144  112.706   2.1566 -1.008705 3.312537 
1 1 1   19    1  -17 o  143.125   1.9344  836.205   22.568  837.816   36.453  835.203   28.738  143.084   3.1254  142.970   2.4659 0.1142578 3.981015 
1 1 1   19    1  -16 o  131.935   1.7599  710.366   18.927  704.072   33.413  713.339   22.967  131.170   3.1250  132.172   2.1317 -1.001938 3.782794 
1 1 1   19    1  -15 o   97.503   1.8581  388.022   14.768  433.360   26.979  368.625   17.646  102.848   3.2221   95.002   2.2787 7.846207 3.946414 
1 1 1   19    1  -14 o  110.147   2.5780  495.810   23.147  560.400   40.555  464.603   28.189  116.753   4.2684  106.491   3.2512 10.26245 5.365607 
1 1 1   19    1  -13 o  151.169   1.7877  932.579   22.028  939.755   30.999  925.258   31.309  151.655   2.5076  150.474   2.5525 1.181137 3.578170 
1 1 1   19    1  -12 o  142.002   1.7886  822.898   20.704  817.482   28.925  828.588   29.647  141.447   2.5086  142.398   2.5541 -0.9510651 3.580074 
1 1 1   19    1  -11 o  155.480   1.7926  986.516   22.720  963.679   31.533  1011.17   32.764  153.575   2.5188  157.308   2.5551 -3.732956 3.587891 
1 1 1   19    1  -10 o  175.116   1.8153  1251.45   25.912  1241.24   36.740  1261.56   36.551  174.284   2.5861  175.711   2.5519 -1.426849 3.633179 
1 1 1   19    1   -9 o  139.169   1.7485  790.330   19.835  829.179   28.928  755.858   27.250  142.462   2.4910  136.022   2.4576 6.440079 3.499310 
1 1 1   19    1   -8 o   29.771   4.0843   37.021   9.6507   41.128   13.796   33.085   13.505   31.111   5.6479   27.763   6.1315 3.348656 8.336329 
1 1 1   19    1   -7 o  123.637   1.7418  623.748   17.554  634.246   25.108  613.709   24.552  124.600   2.4721  122.568   2.4574 2.032181 3.485703 
1 1 1   19    1   -6 o   46.969   2.7167   90.465   10.357   86.054   14.993   94.490   14.324   45.628   4.0740   47.884   3.6983 -2.256706 5.502246 
1 1 1   19    1   -5 o   23.054   5.5037   22.779   10.199   30.359   16.532   18.122   12.959   26.614   7.3690   21.083   6.7046 5.531393 9.962577 
1 1 1   19    1   -4 o   41.999   3.2338   72.600   10.986   63.471   17.734   78.284   13.995   38.811   5.7816   43.517   3.9896 -4.705227 7.024565 
1 1 1   19    1   -3 o  106.555   1.9459  463.421   16.902  463.103   26.976  463.626   21.687  106.355   3.1149  106.530   2.4974 -0.1743164 3.992432 
1 1 1   19    1   -2 o   68.933   2.1424  194.192   12.024  204.586   17.452  184.800   16.589   70.662   3.0370   67.152   3.0384 3.510635 4.295971 
1 1 1   19    1   -1 o  203.744   1.9210  1694.25   31.904  1677.66   45.195  1710.73   45.043  202.600   2.7366  204.594   2.7008 -1.994141 3.844956 
1 1 1   19    1    0 o  205.832   1.9259  1729.16   32.314  1766.89   46.415  1693.68   45.014  207.918   2.7386  203.570   2.7127 4.347946 3.854723 
1 1 1   19    1    1 o   59.688   2.3449  145.727   11.387  140.130   16.176  151.224   16.032   58.410   3.4122   60.706   3.2517 -2.296310 4.713491 
1 1 1   19    1    2 o  100.397   1.8172  411.323   14.872  428.032   21.545  396.118   20.553  102.318   2.5853   98.430   2.5638 3.888268 3.640989 
1 1 1   19    1    3 o   34.752   3.5539   49.965   9.9258   43.458   14.494   55.712   13.621   31.981   5.7723   36.531   4.6815 -4.550131 7.432119 
1 1 1   19    1    4 o   82.910   1.9435  280.568   13.135  288.116   18.982  273.634   18.194   83.910   2.7790   81.777   2.7332 2.132942 3.897845 
1 1 1   19    1    5 o   71.689   2.2571  210.074   13.173  205.615   17.435  216.007   20.109   70.840   3.0263   72.561   3.4094 -1.720993 4.558753 
1 1 1   19    1    6 o  138.765   1.7587  785.741   19.893  814.363   28.827  759.717   27.487  141.185   2.5048  136.370   2.4727 4.815018 3.519717 
1 1 1   19    1    7 o  137.115   1.9164  767.333   21.419  732.733   27.654  819.218   33.863  133.917   2.5333  141.541   2.9350 -7.623459 3.877084 
1 1 1   19    1    8 o   96.639   2.0141  381.234   15.866  366.341   20.987  401.100   24.238   94.633   2.7235   98.985   3.0074 -4.352257 4.057312 
1 1 1   19    1    9 o   74.537   2.4637  227.219   14.948  253.915   22.130  204.816   20.273   78.673   3.4592   70.631   3.5323 8.041252 4.944058 
1 1 1   19    1   10 o  144.373   2.1394  851.048   25.178  881.779   36.612  823.475   34.680  146.820   3.0592  141.893   2.9983 4.926743 4.283509 
1 1 1   19    1   11 o   66.799   2.3675  182.491   12.871  168.750   20.518  191.406   16.527   64.030   3.9503   68.346   2.9735 -4.316536 4.944412 
1 1 1   19    1   12 o  105.560   2.0120  454.887   17.313  427.102   22.487  495.325   27.128  102.184   2.7020  109.999   3.0284 -7.815216 4.058585 
1 1 1   19    1   13 o  155.454   1.7963  986.218   22.762  999.418   32.743  973.872   31.666  156.386   2.5685  154.382   2.5163 2.003433 3.595680 
1 1 1   19    1   14 o  229.856   2.2330  2157.71   41.839  2139.71   53.991  2184.77   66.196  228.738   2.8957  230.950   3.5162 -2.211349 4.555092 
1 1 1   19    1   15 o  161.407   1.8044  1063.23   23.741  1100.23   34.473  1029.86   32.743  164.079   2.5774  158.752   2.5302 5.326508 3.611808 
1 1 1   19    1   16 o   54.795   2.5022  122.943   11.147  116.928   16.468  128.030   15.144   53.268   3.8179   55.820   3.3435 -2.551777 5.074907 
1 1 1   19    1   17 o  104.727   1.8220  447.630   15.554  441.532   22.338  453.370   21.672  103.899   2.6397  105.329   2.5241 -1.430229 3.652243 
1 1 1   19    1   18 o   17.524   5.7864   12.125   9.5997   9.0057   14.196   14.753   13.031   17.916   6.8951   19.660   6.7429 -1.744284 9.644183 
1 1 1   19    1   19 o   96.839   1.8634  382.781   14.710  389.477   21.421  376.806   20.235   97.567   2.6960   95.980   2.5887 1.586998 3.737607 
1 1 1   19    1   20 o   92.164   1.8967  346.740   14.249  350.972   20.647  342.891   19.690   92.607   2.7381   91.547   2.6413 1.060188 3.804445 
1 1 1   19    1   21 o   56.423   2.4485  130.334   11.235  138.095   16.744  123.979   15.152   57.940   3.5624   54.911   3.4017 3.029514 4.925683 
1 1 1   19    1   22 o   15.962   5.7206   8.9692   9.4473   11.813   14.223   6.7234   12.638   18.896   6.9816   16.458   6.4574 2.438332 9.510046 
1 1 1   19    1   23 o   46.784   3.4502   90.167   13.065   89.268   20.282   90.805   17.082   46.174   5.4963   46.770   4.5374 -0.5966377 7.127189 
1 1 1   19    1   24 o   14.498   5.8070   4.2972   10.421   25.476   13.981 -22.1761   15.631   24.381   6.7862   11.769   5.6461 12.61249 8.827899 
1 1 1   19    1   25 o   61.630   2.9156  155.768   14.606  157.879   16.818  149.288   29.460   61.987   3.3408   59.696   6.1416 2.291504 6.991447 
1 1 1   19    1   26 o   20.282   5.9486   17.358   10.472   2.0966   14.148   35.848   15.572   15.732   6.5829   28.783   6.7541 -13.05112 9.431435 
1 1 1   19    1   27 o   79.833   3.7776  262.155   24.513  262.155   24.513   0.0000   0.0000   79.833   3.7776  ?   ?  0.000000 3.777583 
1 1 1   19    1   28 o   68.142   2.8381  190.346   15.730  181.137   22.811  198.695   21.720   66.233   4.2476   69.458   3.8513 -3.225662 5.733629 
1 1 1   19    1   29 o  140.250   2.5880  804.473   29.587  810.224   37.250  794.645   48.699  140.611   3.2499  138.904   4.3062 1.707047 5.394885 
1 1 1   19    1   30 o   60.430   2.9859  149.901   14.663  134.729   20.778  164.953   20.696   57.016   4.5072   63.220   4.0371 -6.203320 6.050834 
1 1 1   19    1   31 o   39.250   3.8160   63.868   12.055   58.042   22.795   66.130   14.204   36.466   7.8977   39.827   4.4513 -3.360832 9.065765 
1 1 1   19    1   32 o   88.013   2.0942  316.494   15.024  301.430   24.174  325.974   19.178   85.642   3.4700   89.219   2.6400 -3.577164 4.360088 
1 1 1   19    1   33 o   56.513   2.7335  131.029   12.555  111.696   20.079  143.440   16.088   51.793   4.8108   59.040   3.3567 -7.246746 5.866154 
1 1 1   19    1   34 o  150.095   1.9798  920.341   24.223  909.001   38.463  927.796   31.185  148.898   3.1690  150.589   2.5405 -1.690918 4.061554 
1 1 1   19    1   35 o   76.059   2.3407  236.793   14.495  214.871   23.406  250.430   18.461   72.149   3.9954   78.132   2.9036 -5.982735 4.939044 
1 1 1   19    1   36 o   15.140   5.8294   6.4484   10.150   3.8494   15.144   8.5677   13.675   16.648   6.8749   17.469   6.7558 -0.8207455 9.638729 
1 1 1   19    1   37 o   17.950   6.0348   12.680   10.432   6.5436   15.108   18.273   14.423   17.408   6.9853   21.309   7.0946 -3.900982 9.956296 
1 1 1   19    1   38 f   34.763   3.9720   50.411   11.054   36.920   15.969   62.822   15.316   29.074   6.8509   38.631   4.9794 -9.557013 8.469352 
1 1 1   19    1   39 f   33.199   4.1308   46.139   10.938   35.125   15.754   56.387   15.197   28.336   6.8886   36.486   5.2616 -8.150154 8.668169 
1 1 1   19    1   40 o  109.373   1.8728  488.821   16.697  504.180   24.086  474.612   23.166  110.931   2.6636  107.634   2.6404 3.297096 3.750565 
1 1 1   19    1   41 o   73.346   2.1308  220.212   12.726  210.914   18.420  228.704   17.603   71.593   3.1641   74.613   2.8997 -3.019600 4.291821 
1 1 1   19    1   42 o   31.007   4.0411   40.338   9.9711   43.131   14.805   38.019   13.489   31.604   5.9657   29.672   5.7849 1.932055 8.309910 
1 1 1   19    1   43 o   13.428   5.5731   2.1370   10.020  -1.8566   13.570   6.9265   14.860   14.267   6.2165   17.348   6.9392 -3.080144 9.316504 
1 1 1   19    1   44 o   89.895   1.9026  330.397   13.942  356.370   20.623  308.537   18.920   93.172   2.7183   86.697   2.6805 6.475006 3.817610 
1 1 1   19    1   45 o   38.220   3.1501   60.467   9.7270   58.691   14.338   61.982   13.240   37.265   4.8337   38.451   4.2977 -1.185089 6.467978 
1 1 1   19    1   46 o   58.764   2.4346  141.772   11.637  157.256   18.716  132.014   14.857   61.598   3.7452   56.542   3.2370 5.055756 4.950195 
1 1 1   19    1   47 o   21.899   5.2329   20.855   9.2132   26.997   12.778   14.205   13.296   24.782   6.3098   19.265   6.7987 5.517307 9.275542 
1 1 1   19    1   48 o   14.674   5.6786   6.1098   9.6669  -3.6212   14.455   13.983   13.002   14.256   6.3066   19.076   6.7239 -4.820505 9.218678 
1 1 1   19    1   49 o   57.803   3.4840  138.476   16.340   0.0000   0.0000  138.476   16.340  ?   ?    57.803   3.4840 0.000000 3.484035 
1 1 1   19    1   50 f   62.387   2.5147  160.046   12.762  144.869   18.841  172.912   17.348   58.968   3.9424   64.647   3.3029 -5.679501 5.143185 
1 1 1   19    1   51 o   43.428   2.7077   77.842   9.5377   78.975   13.850   76.820   13.153   43.440   3.9547   42.881   3.8024 0.5589485 5.486167 
1 1 1   19    1   52 o   20.706   5.1326   18.754   8.6195   24.608   12.701   13.757   11.736   23.558   6.4339   18.562   6.3978 4.995195 9.073412 
1 1 1   19    1   53 o   31.689   3.5071   42.087   8.9078   36.377   13.318   46.711   11.983   28.742   5.8826   33.109   4.5611 -4.366529 7.443674 
1 1 1   19    1   54 o   36.634   3.0911   55.816   9.1445   64.253   13.926   49.420   12.125   38.924   4.4702   34.076   4.4729 4.847626 6.323713 
1 1 1   19    1   55 o   57.618   2.2557  136.533   10.574  133.625   15.464  139.088   14.491   56.690   3.3614   57.932   3.0797 -1.242092 4.558898 
1 1 1   19    1   56 o   46.208   2.6124   88.226   9.7998   78.435   14.302   96.891   13.455   43.119   4.1191   48.194   3.4476 -5.075241 5.371509 
1 1 1   19    1   57 o   56.457   2.2799  131.232   10.471  127.291   15.466  134.566   14.227   55.243   3.4518   56.938   3.0768 -1.694427 4.623975 
1 1 1   19    1   58 o   43.024   2.8178   76.802   9.8279   73.303   14.572   79.721   13.311   41.518   4.3712   43.533   3.7888 -2.015518 5.784672 
1 1 1   19    1   59 o   78.712   1.9555  254.288   12.547  232.475   17.971  275.031   17.525   74.873   2.9504   81.585   2.6386 -6.712715 3.958156 
1 1 1   19    1   60 o   28.108   4.0147   33.793   8.9374   8.3960   13.304   54.684   12.066   16.782   6.6129   35.803   4.2149 -19.02091 7.841918 
1 1 1   19    1   61 o   24.729   4.5832   26.703   8.8986   16.350   13.425   34.816   11.885   19.706   6.8403   28.014   5.4003 -8.307388 8.715095 
1 1 1   19    1   62 o   11.835   5.0111   1.0764   8.3535  -4.8138   12.475   5.8645   11.247   12.648   5.7070   15.042   6.0302 -2.393870 8.302579 
1 1 1   19    1   63 o   10.598   4.8676  -6.0142   9.5967  -5.8871   12.687  -6.1842   14.672   12.509   5.6885   13.499   6.1303 -0.9901772 8.362963 
1 1 1   19    1   64 o   53.682   3.1192  120.432   13.590  145.178   20.463  100.902   18.179   58.305   4.3366   48.378   4.6676 9.926929 6.371203 
1 1 1   19    1   65 o   17.435   6.2746   12.208   11.379  -9.8318   17.315   28.963   15.097   14.037   6.4799   24.797   7.1044 -10.76002 9.615704 
1 1 1   19    1   66 o   14.321   5.4068   7.1029   8.6226   11.642   12.681   3.1999   11.759   17.520   6.5692   14.293   5.9924 3.227429 8.891767 
1 1 1   19    1   67 o   52.708   2.4180  115.170   10.361  107.590   15.107  121.902   14.238   50.371   3.7051   53.865   3.2580 -3.493877 4.933813 
1 1 1   19    1   68 o   36.189   3.1374   55.166   9.1638   45.898   13.377   63.361   12.579   32.034   5.3086   38.390   4.0823 -6.355927 6.696741 
1 1 1   19    1   69 o   12.774   5.1737   3.8526   8.3723   5.8110   12.640   2.3217   11.175   15.400   6.3118   13.671   5.7925 1.728976 8.566947 
1 1 1   19    1   70 o   22.347   4.9595   22.522   8.7985   14.260   13.145   29.228   11.842   18.474   6.7307   25.121   5.8866 -6.647490 8.941706 
1 1 1   19    1   71 o   38.794   3.0554   63.381   9.5840   54.479   14.052   71.123   13.105   34.978   5.0767   40.654   4.0066 -5.676243 6.467258 
1 1 1   19    1   72 o   41.513   2.9351   72.413   9.8682   80.865   14.413   64.954   13.539   43.261   4.1376   38.604   4.3798 4.656815 6.025148 
1 1 1   19    1   73 o   39.681   3.0124   66.369   9.6709   66.108   14.210   66.595   13.199   38.786   4.5830   39.152   4.2014 -0.3666458 6.217377 
1 1 1   19    1   74 o   41.222   2.9382   71.571   9.8082   57.866   14.440   83.309   13.364   35.913   5.0740   44.051   3.7575 -8.137997 6.313809 
1 1 1   19    1   75 o   35.037   3.2914   52.308   9.2902   47.673   13.911   56.040   12.482   32.243   5.4892   35.701   4.3808 -3.457527 7.022946 
1 1 1   19    1   76 o   13.717   5.3443   6.2729   8.6069  -4.2332   12.786   14.977   11.638   12.597   5.7215   18.210   6.3659 -5.612597 8.559258 
1 1 1   19    1   77 o   30.927   3.6859   41.506   9.1095   25.079   13.754   54.344   12.159   22.472   6.8710   35.048   4.3492 -12.57558 8.131815 
1 1 1   19    1   78 o   51.845   2.7821  113.315   11.714  115.140   15.436  110.837   17.989   51.618   3.6930   50.000   4.4604 1.618248 5.790767 
1 1 1   19    1   79 o   22.557   6.3724   25.232   12.231   22.023   15.352   30.809   20.239   20.935   7.3119   23.767   8.3879 -2.831985 11.12744 
1 1 1   19    1   80 o   27.273   5.3198   35.026   11.402   26.226   13.742   54.469   20.427   22.609   6.8593   31.756   7.9186 -9.147150 10.47631 
1 1 1   19    1   81 o   17.234   6.1789   13.783   11.023   8.3401   13.195   26.355   20.053   15.715   6.4458   21.986   8.2573 -6.270677 10.47525 
1 1 1   19    1   82 o   14.139   5.6678   6.8404   9.9354   7.4379   15.497   6.4233   12.946   16.016   6.8050   14.994   6.2870 1.022174 9.264714 
1 1 1   19    1   83 o   13.156   5.3004   5.5427   8.7357   15.256   12.279  -4.4109   12.430   17.791   6.5016   12.044   5.5347 5.747177 8.538424 
1 1 1   19    1   84 o   10.430   4.8063  -4.4870   9.4673   10.329   12.076 -28.1159   15.251   15.849   6.2831   10.033   4.9702 5.816806 8.011260 
1 1 1   19    1   85 o   10.809   4.7593  -0.0216   8.1409  -8.6298   12.055   7.1943   11.038   10.949   5.1678   14.412   5.9015 -3.463244 7.844383 
1 1 1   19    1   86 o   12.841   5.1507   5.6674   8.2107   11.729   12.289   0.7794   11.035   16.161   6.3595   12.426   5.5029 3.734954 8.409781 
1 1 1   19    1   87 o   9.4498   4.2732  -2.0188   7.0389  -1.3938   9.1118  -2.9437   11.085   10.874   4.8945   11.498   5.2624 -0.6245308 7.186732 
1 1 1   19    1   88 o   13.248   4.7072   7.8106   6.3829   4.6400   9.2747   10.664   8.7979   12.769   5.3354   15.089   5.5050 -2.319872 7.666260 
1 1 1   19    1   89 o   10.362   4.3662   2.0410   6.2918   0.7861   9.0821   3.1990   8.7245   11.418   5.0272   12.018   5.1062 -0.6001196 7.165637 
1 1 1   19    1   90 o   20.066   5.0368   19.980   8.2250   19.398   9.5005   21.722   16.434   19.340   5.6643   19.347   7.4257 -0.6402969E-02 9.339452 
1 1 1   19    1   91 o   14.339   5.2714   9.4882   8.0907   9.5626   9.2460   9.2452   16.715   14.563   5.5749   15.906   6.9153 -1.342583 8.882605 
1 1 1   19    1   92 o   32.476   5.0075   51.491   12.830   60.186   14.765   24.682   25.928   34.704   5.3945   19.614   8.5686 15.09052 10.12533 
1 1 1   19    1   93 f   19.922   7.6155   24.757   17.238   30.694   24.415   18.857   24.340   20.724   8.6579   18.422   8.1648 2.302650 11.90054 
1 1 1   19    1   94 o   15.304   6.7854   7.2310   16.826   22.491   23.527  -8.7473   24.075   19.016   8.2363   14.507   6.9722 4.509111 10.79113 
1 1 1   19    1   95 o   14.964   6.6503   6.4262   16.258 -15.2747   23.061   27.870   22.924   13.542   6.5838   20.051   8.3839 -6.508698 10.66005 
1 1 1   19    1   96 o   19.677   7.5885   24.694   17.219   20.364   24.720   28.776   23.999   18.436   8.1965   20.046   8.4909 -1.609789 11.80156 
1 1 1   19    1   97 o   13.006   6.1046  -3.9643   16.408   2.6429   23.665 -10.0808   22.769   15.588   7.3213   13.904   6.7070 1.684933 9.928991 
1 1 1   19    1   98 o   25.164   7.7546   41.218   17.476   48.324   25.010   34.438   24.429   24.200   9.1918   21.009   8.7089 3.191196 12.66234 
1 1 1   19    1   99 o   23.838   7.7828   37.905   17.386   9.6363   25.688   61.800   23.618   16.623   7.7484   28.637   9.0444 -12.01459 11.90963 
1 1 1   19    1  100 o   14.773   6.6017   6.7574   16.252  -3.1410   23.029   16.578   22.939   14.574   6.9543   17.366   7.7956 -2.792436 10.44668 
1 1 1   19    1  101 o   11.664   5.6093 -10.6545   15.642   23.110   22.229 -43.7668   22.013   18.530   8.0159   10.828   5.4523 7.702627 9.694468 
1 1 1   19    1  102 o   11.472   5.5581 -13.3517   16.069  -3.3820   23.248 -22.4739   22.237   14.561   6.9590   12.429   6.1287 2.131889 9.273022 
1 1 1   19    2 -100 o   13.719   6.7278 -16.6013   25.634 -16.6013   25.634   0.0000   0.0000   13.719   6.7278  ?   ?  0.000000 6.727823 
1 1 1   19    2  -99 o   15.107   7.2774  -3.1117   26.581  -3.1117   26.581   0.0000   0.0000   15.107   7.2774  ?   ?  0.000000 7.277372 
1 1 1   19    2  -98 f   16.225   7.6502   7.4455   26.295   7.4455   26.295   0.0000   0.0000   16.225   7.6502  ?   ?  0.000000 7.650209 
1 1 1   19    2  -97 o   15.621   7.4618   1.1657   26.655   1.1657   26.655   0.0000   0.0000   15.621   7.4618  ?   ?  0.000000 7.461799 
1 1 1   19    2  -96 o   11.800   5.7432 -15.5267   17.678 -26.2699   25.444  -5.5008   24.580   12.968   6.4235   14.639   7.0381 -1.671361 9.528717 
1 1 1   19    2  -95 o   16.482   7.2756   12.590   19.139   54.742   27.351 -27.8489   26.790   24.880   9.5721   13.208   6.5511 11.67229 11.59923 
1 1 1   19    2  -94 o   14.080   6.5612  -0.4239   18.395 -25.8823   27.409   20.439   24.812   13.523   6.6930   18.307   8.1707 -4.783728 10.56204 
1 1 1   19    2  -93 o   15.229   6.9140   5.7721   18.648  -1.6814   25.703   14.056   27.097   15.438   7.3613   17.550   8.1034 -2.112083 10.94781 
1 1 1   19    2  -92 o   9.5244   4.8135 -45.6124   18.063 -56.5251   25.370 -34.3925   25.725   11.210   5.6700   12.622   6.2867 -1.411436 8.465939 
1 1 1   19    2  -91 o   14.863   6.7782   3.6312   18.178 -18.9828   25.707   26.250   25.709   13.854   6.7822   19.640   8.5571 -5.785604 10.91889 
1 1 1   19    2  -90 o   19.911   7.1745   23.854   14.882   35.248   18.743   4.4139   24.481   22.935   8.0738   16.173   7.5474 6.761297 11.05212 
1 1 1   19    2  -89 o   21.279   8.1328   30.222   19.656   56.987   30.344   10.870   25.802   25.390   9.9926   17.335   7.9689 8.055645 12.78100 
1 1 1   19    2  -88 o   17.497   6.6658   16.328   13.177   18.785   18.934   14.021   18.351   18.371   7.6456   17.195   7.3586 1.175190 10.61151 
1 1 1   19    2  -87 o   15.264   6.3317   9.4523   12.925   6.3400   18.171   12.639   18.388   15.609   6.9776   16.966   7.3147 -1.357536 10.10902 
1 1 1   19    2  -86 o   18.655   6.6716   19.067   12.842   23.806   18.328   14.498   17.999   19.888   7.7843   17.413   7.3635 2.474922 10.71527 
1 1 1   19    2  -85 o   19.372   6.7661   20.781   13.146   27.972   18.688   13.736   18.496   21.193   7.9687   17.364   7.4081 3.828829 10.88020 
1 1 1   19    2  -84 o   22.820   6.6802   28.704   13.217   40.386   18.981   17.711   18.414   25.413   8.1180   18.429   7.5927 6.983656 11.11535 
1 1 1   19    2  -83 o   13.258   5.8850   1.5419   12.693 -12.2786   17.916   15.470   17.986   12.773   6.1058   17.957   7.4608 -5.183723 9.640748 
1 1 1   19    2  -82 o   13.371   5.9128   1.6902   12.695   15.550   17.721 -12.9223   18.196   18.110   7.4536   12.872   6.1529 5.238173 9.665053 
1 1 1   19    2  -81 o   12.445   5.6519  -2.2377   12.472   9.1471   17.465 -14.0879   17.818   16.645   7.1520   12.670   6.0653 3.974938 9.377577 
1 1 1   19    2  -80 o   12.147   5.5507  -3.4391   12.270  -0.4470   17.039  -6.6611   17.682   14.611   6.6238   13.757   6.4181 0.8538494 9.223184 
1 1 1   19    2  -79 o   11.487   5.4259  -9.8706   13.335 -28.1871   16.850   20.826   21.814   10.789   5.3229   20.289   8.3010 -9.499755 9.861012 
1 1 1   19    2  -78 o   35.429   3.7907   55.305   10.778   46.256   17.945   60.411   13.480   29.321   7.4838   36.387   4.6508 -7.065392 8.811155 
1 1 1   19    2  -77 o   26.885   4.0649   32.289   8.6304   28.247   11.972   36.662   12.452   23.858   6.1251   27.578   5.7267 -3.719849 8.385264 
1 1 1   19    2  -76 o   12.813   5.1259   4.9659   8.1096   3.9751   11.094   6.1025   11.884   13.747   5.7955   14.717   6.0849 -0.9696341 8.403234 
1 1 1   19    2  -75 o   23.604   4.5527   25.335   8.4422   36.551   11.707   13.185   12.185   27.984   5.3268   17.364   6.4536 10.62016 8.368015 
1 1 1   19    2  -74 o   16.982   5.1344   13.280   7.7091   18.477   10.478   7.1467   11.383   19.655   5.9947   15.011   6.0495 4.644095 8.516646 
1 1 1   19    2  -73 o   8.5880   4.0987  -9.3597   8.0068  -6.3060   11.322 -12.4147   11.324   11.348   5.2390   10.204   4.8711 1.143946 7.153617 
1 1 1   19    2  -72 o   17.923   5.2796   14.794   8.2337   3.0399   11.267   28.267   12.062   13.734   5.8176   24.307   6.0987 -10.57292 8.428455 
1 1 1   19    2  -71 o   26.771   3.9537   31.323   8.3685   21.258   11.196   44.068   12.598   21.161   6.1350   31.195   5.1327 -10.03400 7.998929 
1 1 1   19    2  -70 o   26.548   4.0647   30.867   8.5166   44.598   11.681   15.285   12.444   31.694   4.6604   18.577   6.5752 13.11754 8.059293 
1 1 1   19    2  -69 o   28.326   4.2566   35.206   9.5250   45.359   14.728   27.907   12.488   31.239   6.0021   24.246   6.2716 6.992367 8.680920 
1 1 1   19    2  -68 o   45.712   2.8156   87.538   10.441   70.474   15.839  100.649   13.884   39.857   4.9838   48.663   3.5239 -8.806450 6.103824 
1 1 1   19    2  -67 o   13.244   5.3922   4.1375   9.1499  -0.4936   14.019   7.5741   12.077   14.212   6.2521   15.706   6.2647 -1.493934 8.850672 
1 1 1   19    2  -66 o   40.451   2.7241   68.411   8.9301   66.535   12.097   70.658   13.238   39.423   3.8119   40.506   4.0642 -1.083042 5.572109 
1 1 1   19    2  -65 o   19.516   5.1061   17.258   8.2148   20.273   11.115   13.629   12.195   20.923   6.1263   18.053   6.4960 2.870256 8.929100 
1 1 1   19    2  -64 o   11.084   4.9278  -2.1634   8.9357   15.096   13.385 -16.0392   12.002   18.896   6.8047   10.176   4.8988 8.720675 8.384637 
1 1 1   19    2  -63 o   23.387   4.8509   24.414   8.9443   35.779   13.323   15.090   12.068   27.883   6.0371   18.702   6.4858 9.180586 8.860730 
1 1 1   19    2  -62 o   53.000   2.6143  116.737   11.260  108.715   18.319  121.608   14.274   50.189   4.5264   53.808   3.2699 -3.619400 5.583922 
1 1 1   19    2  -61 o   41.179   3.5303   71.679   11.736   75.685   17.589   68.463   15.756   41.414   5.3339   39.545   4.9995 1.869385 7.310639 
1 1 1   19    2  -60 o   42.622   3.4245   76.518   11.798  100.922   17.889   57.733   15.695   48.399   4.5892   36.052   5.5157 12.34662 7.175210 
1 1 1   19    2  -59 o   22.915   5.8598   23.879   10.987   30.369   16.519   18.729   14.714   25.375   7.4790   20.734   7.1632 4.640463 10.35597 
1 1 1   19    2  -58 o   15.914   5.5188   10.235   8.7377   13.047   12.954   7.8880   11.836   18.253   6.6767   15.981   6.2553 2.272014 9.149137 
1 1 1   19    2  -57 o   52.657   2.3124  114.474   9.9015  103.322   13.322  128.236   14.800   49.687   3.3081   55.382   3.2931 -5.695667 4.667791 
1 1 1   19    2  -56 f   19.053   5.1831   16.110   8.2618   20.369   11.512   11.587   11.864   21.274   6.2363   17.444   6.3881 3.830496 8.927475 
1 1 1   19    2  -55 o   39.004   2.8860   63.317   9.1109   63.304   12.588   63.332   13.204   38.615   4.0597   38.541   4.2745 0.7352066E-01 5.895154 
1 1 1   19    2  -54 o   11.538   4.9208   0.4852   8.1555   2.0307   11.227  -1.2417   11.867   13.834   5.8308   13.242   5.7907 0.5917320 8.217687 
1 1 1   19    2  -53 o   56.146   2.0269  129.570   9.2612  126.457   13.919  132.044   12.406   55.155   3.1084   56.498   2.7016 -1.342789 4.118365 
1 1 1   19    2  -52 o   22.769   4.6212   22.599   8.2838   17.444   12.095   27.153   11.368   20.102   6.4861   24.684   5.7564 -4.581501 8.672080 
1 1 1   19    2  -51 o   57.655   2.0820  136.583   9.7687  131.857   13.699  141.471   13.934   56.405   2.9901   58.449   2.9340 -2.043243 4.189171 
1 1 1   19    2  -50 o   49.957   2.3018  102.742   9.3484  113.437   13.569   93.081   12.897   52.261   3.2007   47.272   3.3691 4.988445 4.647027 
1 1 1   19    2  -49 o   39.675   2.7262   65.139   8.7632   62.538   12.700   67.503   12.108   38.502   4.1098   40.128   3.7447 -1.626305 5.559986 
1 1 1   19    2  -48 o   45.410   2.4978   85.018   9.2103   90.259   13.265   80.139   12.798   46.535   3.5232   43.807   3.6161 2.727676 5.048682 
1 1 1   19    2  -47 o   15.365   5.3050   9.1884   8.0702   12.432   11.831   6.3655   11.037   18.014   6.4077   15.337   6.0294 2.677083 8.798410 
1 1 1   19    2  -46 o  107.182   1.6961  469.916   14.819  447.614   19.952  497.355   22.131  104.436   2.3437  110.045   2.4671 -5.609062 3.402835 
1 1 1   19    2  -45 o   65.704   2.0347  176.993   10.884  161.860   14.884  194.387   15.957   62.632   2.9234   68.667   2.8571 -6.035591 4.087693 
1 1 1   19    2  -44 o   22.648   4.8630   22.249   8.7095   17.190   12.771   26.648   11.909   20.309   6.6726   24.596   5.9950 -4.287624 8.970145 
1 1 1   19    2  -43 o   42.299   2.8032   73.867   9.6109   60.094   13.809   86.806   13.384   37.707   4.5870   45.684   3.6239 -7.976906 5.845807 
1 1 1   19    2  -42 o   41.933   2.5649   72.427   8.7254   81.786   14.020   66.510   11.147   44.272   3.9254   40.003   3.4524 4.269684 5.227608 
1 1 1   19    2  -41 o   20.742   4.6568   18.600   7.6801   15.887   12.284   20.341   9.8406   19.710   6.5470   21.602   5.5569 -1.891272 8.587355 
1 1 1   19    2  -40 o   45.387   2.3603   84.634   8.7022   75.183   13.437   91.461   11.421   42.461   3.9267   47.076   2.9917 -4.614521 4.936518 
1 1 1   19    2  -39 o   39.314   2.4926   63.605   7.9469   58.043   11.260   69.126   11.218   37.314   3.7527   40.828   3.4015 -3.513878 5.064892 
1 1 1   19    2  -38 o  100.046   1.5783  408.851   12.871  436.368   19.144  386.148   17.389  103.234   2.2749   97.128   2.1963 6.106720 3.162107 
1 1 1   19    2  -37 o   33.281   3.4066   46.056   9.1116   70.983   15.648   33.270   11.207   41.076   4.7617   27.845   5.1265 13.23079 6.996737 
1 1 1   19    2  -36 o  108.725   1.6231  482.856   14.385  453.642   21.198  507.789   19.584  105.233   2.4712  111.404   2.1566 -6.170578 3.279902 
1 1 1   19    2  -35 o  153.435   1.6024  961.516   20.042  938.649   29.285  981.660   27.487  151.413   2.3728  154.899   2.1769 -3.485596 3.220080 
1 1 1   19    2  -34 o   60.464   2.1493  149.728   10.576  143.338   16.163  154.513   13.986   58.947   3.3778   61.320   2.8055 -2.373470 4.390976 
1 1 1   19    2  -33 o  142.089   1.8418  824.982   21.333  846.796   31.134  805.678   29.288  143.757   2.6569  140.249   2.5619 3.507477 3.690816 
1 1 1   19    2  -32 o  121.697   1.9535  605.313   19.379  546.653   28.674  654.640   26.294  115.379   3.0514  126.434   2.5513 -11.05518 3.977457 
1 1 1   19    2  -31 o   70.451   2.1686  203.157   12.439  207.445   20.737  200.746   15.547   70.928   3.5984   69.943   2.7321 0.9847412 4.518055 
1 1 1   19    2  -30 o  142.626   1.5346  830.434   17.842  804.899   24.429  859.625   26.120  140.309   2.1359  144.984   2.2101 -4.675339 3.073571 
1 1 1   19    2  -29 o   85.209   1.7207  296.510   11.952  266.175   16.511  329.901   17.322   80.604   2.5160   89.769   2.3693 -9.165215 3.456024 
1 1 1   19    2  -28 o   14.990   5.5148   7.4970   8.8579   13.020   14.014   3.8220   11.431   19.176   6.9549   14.817   6.0290 4.359315 9.204354 
1 1 1   19    2  -27 o   30.900   3.6975   39.794   9.1286   49.568   14.431   33.275   11.786   34.179   5.3557   27.869   5.3830 6.309385 7.593441 
1 1 1   19    2  -26 o   43.304   2.7330   77.080   9.5980   84.556   15.195   72.117   12.381   45.120   4.1788   41.734   3.6769 3.385670 5.566139 
1 1 1   19    2  -25 o  107.661   1.8229  473.356   15.998  477.892   28.701  471.312   19.268  107.890   3.2673  107.379   2.2014 0.5104141 3.939685 
1 1 1   19    2  -24 o   43.930   2.9285   79.395   10.427   63.365   19.252   86.049   12.404   38.506   6.3550   45.677   3.3547 -7.171757 7.186122 
1 1 1   19    2  -23 o   63.121   2.2639  163.072   11.629  187.831   21.264  152.506   13.891   67.486   3.8818   60.969   2.8025 6.516495 4.787714 
1 1 1   19    2  -22 o   43.508   3.2024   78.008   11.278   84.569   18.903   74.382   14.052   44.910   5.2633   42.323   4.1256 2.587334 6.687520 
1 1 1   19    2  -21 o   55.071   2.6815  124.391   12.001  133.538   20.116  119.336   14.954   56.776   4.3804   53.829   3.4259 2.946720 5.561005 
1 1 1   19    2  -20 o   39.924   3.0826   65.683   9.9545   60.363   14.481   70.450   13.707   37.961   4.7860   41.183   4.1390 -3.222267 6.327500 
1 1 1   19    2  -19 o   96.826   1.9709  382.902   15.555  397.467   24.762  373.408   19.993   98.454   3.0892   95.514   2.5702 2.939514 4.018625 
1 1 1   19    2  -18 o  119.051   1.9391  578.800   18.818  615.479   29.706  554.217   24.320  122.602   2.9724  116.410   2.5629 6.192505 3.924753 
1 1 1   19    2  -17 o   18.623   6.0427   13.981   10.489   16.697   16.155   12.002   13.792   21.209   7.4933   18.783   6.8862 2.425676 10.17690 
1 1 1   19    2  -16 f  127.813   1.9239  667.081   20.044  683.021   31.358  656.070   26.063  129.161   2.9784  126.668   2.5242 2.493378 3.904188 
1 1 1   19    2  -15 o   68.847   2.3321  193.939   13.069  200.452   20.018  189.100   17.253   69.824   3.5285   67.877   3.1266 1.946556 4.714497 
1 1 1   19    2  -14 o   91.876   1.8554  344.628   13.896  362.772   23.943  335.413   17.063   94.064   3.1269   90.567   2.3132 3.497375 3.889520 
1 1 1   19    2  -13 o  135.784   1.7627  752.601   19.510  728.451   27.842  775.900   27.347  133.475   2.5590  137.774   2.4350 -4.299408 3.532350 
1 1 1   19    2  -12 o  146.740   1.6491  878.775   19.726  897.395   30.733  865.730   25.724  148.151   2.5448  145.577   2.1677 2.574554 3.342918 
1 1 1   19    2  -11 o   91.061   1.9147  338.563   14.212  389.918   21.079  295.759   19.245   97.609   2.6517   84.982   2.7818 12.62695 3.843206 
1 1 1   19    2  -10 o  100.298   1.7157  410.584   14.027  387.518   21.466  427.772   18.530   97.301   2.7091  102.327   2.2215 -5.026634 3.503496 
1 1 1   19    2   -9 o  108.706   1.6835  482.274   14.918  465.294   22.778  495.029   19.741  106.673   2.6195  110.081   2.2000 -3.408485 3.420783 
1 1 1   19    2   -8 o  101.736   1.7097  422.430   14.178  421.516   21.915  423.088   18.594  101.494   2.6511  101.765   2.2415 -0.2712555 3.471728 
1 1 1   19    2   -7 o   68.169   2.0172  189.928   11.197  193.439   17.279  187.387   14.701   68.669   3.0948   67.641   2.6715 1.028801 4.088315 
1 1 1   19    2   -6 o  103.357   1.6854  435.972   14.200  454.795   22.175  422.889   18.487  105.471   2.5793  101.744   2.2291 3.727173 3.408991 
1 1 1   19    2   -5 o   43.338   2.7445   77.121   9.6456   79.405   15.240   75.594   12.459   43.741   4.3310   42.789   3.6054 0.9518051 5.635304 
1 1 1   19    2   -4 f   72.102   1.9448  212.407   11.420  216.390   17.962  209.705   14.796   72.647   3.0399   71.579   2.5398 1.067917 3.961242 
1 1 1   19    2   -3 f  117.152   1.6459  560.072   15.718  590.845   24.691  539.103   20.381  120.227   2.5194  114.884   2.1764 5.342361 3.329272 
1 1 1   19    2   -2 o   78.495   1.9829  251.735   12.677  244.852   18.531  257.790   17.381   77.299   2.9463   79.353   2.6910 -2.053810 3.990241 
1 1 1   19    2   -1 o   81.870   1.9515  273.660   13.024  261.255   18.892  284.895   17.979   79.856   2.9071   83.431   2.6470 -3.575150 3.931590 
1 1 1   19    2    0 o   78.308   1.9957  250.545   12.728  249.602   18.566  251.381   17.484   78.050   2.9234   78.353   2.7417 -0.3028946 4.007860 
1 1 1   19    2    1 o   23.926   5.3973   24.562   10.275   32.361   14.250   16.116   14.829   27.380   6.4854   20.670   7.1884 6.710056 9.681613 
1 1 1   19    2    2 o   67.206   2.3375  184.769   12.786  176.521   17.337  194.605   18.932   65.572   3.2538   68.837   3.3843 -3.264931 4.694716 
1 1 1   19    2    3 f   53.741   2.7089  118.406   11.828  123.527   16.360  112.798   17.121   54.760   3.6866   52.257   4.0510 2.502800 5.477384 
1 1 1   19    2    4 f  115.425   2.1539  544.171   20.266  537.734   29.587  549.859   27.815  114.554   3.1716  115.882   2.9470 -1.327652 4.329370 
1 1 1   19    2    5 o   64.409   2.4181  169.779   12.673  149.761   20.666  181.843   16.044   60.222   4.2369   66.595   2.9629 -6.372612 5.170147 
1 1 1   19    2    6 o  149.583   1.9401  913.555   23.657  930.527   38.564  903.315   29.955  150.753   3.1382  148.662   2.4719 2.091660 3.994792 
1 1 1   19    2    7 o  132.216   1.9257  713.722   20.754  716.937   33.882  711.791   26.257  132.323   3.1412  131.968   2.4409 0.3554230 3.978047 
1 1 1   19    2    8 o   66.807   2.1682  182.502   11.792  204.035   17.791  165.632   15.748   70.527   3.1023   63.537   3.0494 6.989563 4.350098 
1 1 1   19    2    9 o  124.806   1.7677  635.798   17.984  609.144   25.826  660.890   25.058  122.057   2.5957  127.163   2.4174 -5.105476 3.547071 
1 1 1   19    2   10 o   37.380   3.3043   57.684   9.9646   49.894   14.913   63.967   13.393   34.327   5.5164   39.223   4.2572 -4.895714 6.968102 
1 1 1   19    2   11 o   13.857   5.5040   4.2507   9.2841   5.9101   14.039   2.9608   12.377   16.813   6.7382   15.079   6.2200 1.734330 9.170115 
1 1 1   19    2   12 o   15.081   5.6336   7.1622   9.3083   38.203   14.329 -15.5018   12.244   29.826   6.0995   10.728   5.1056 19.09834 7.954267 
1 1 1   19    2   13 o  114.310   1.7839  533.403   16.622  563.864   24.580  507.735   22.563  117.430   2.5678  111.444   2.4838 5.986313 3.572516 
1 1 1   19    2   14 o   79.868   2.0088  260.672   13.068  243.819   19.060  275.622   17.951   77.109   3.0383   82.044   2.6878 -4.934654 4.056525 
1 1 1   19    2   15 o   67.707   2.1761  187.482   11.995  185.146   17.819  189.417   16.220   67.141   3.2656   67.962   2.9347 -0.8214111 4.390500 
1 1 1   19    2   16 f   87.253   1.9455  310.888   13.837  289.792   20.139  329.753   19.044   84.085   2.9427   89.755   2.6057 -5.669815 3.930546 
1 1 1   19    2   17 o   13.004   5.4274   1.4785   9.5811   16.321   14.692  -9.5033   12.638   20.681   7.1571   12.067   5.5580 8.614972 9.061775 
1 1 1   19    2   18 o  159.486   1.8067  1038.47   23.488  1044.64   33.949  1032.81   32.529  159.811   2.6061  158.924   2.5110 0.8874664 3.618948 
1 1 1   19    2   19 o  113.483   1.8044  525.805   16.692  525.718   24.530  525.879   22.778  113.359   2.6547  113.406   2.4640 -0.4677582E-01 3.621948 
1 1 1   19    2   20 o   58.062   2.3985  138.066   11.328  144.533   17.180  133.091   15.067   59.239   3.5743   56.888   3.2629 2.351238 4.839633 
1 1 1   19    2   21 o   47.776   3.0595   93.888   11.852   96.713   21.674   92.682   14.156   47.977   5.6501   47.367   3.6956 0.6103325 6.751407 
1 1 1   19    2   22 o   49.731   2.9557  101.647   11.928   92.652   21.246  105.786   14.413   46.935   5.6678   50.651   3.5127 -3.716770 6.668086 
1 1 1   19    2   23 o   69.039   2.8456  195.495   15.980  201.836   24.009  190.452   21.411   69.888   4.2342   67.957   3.8812 1.931412 5.743939 
1 1 1   19    2   24 o  147.834   3.1444  895.902   37.892   0.0000   0.0000  895.902   37.892  ?   ?   147.834   3.1444 0.000000 3.144393 
1 1 1   19    2   25 o   94.265   2.1677  363.185   16.656  369.107   21.914  355.084   25.632   94.893   2.8362   92.959   3.3883 1.934952 4.418634 
1 1 1   19    2   26 o   43.018   3.5991   76.540   12.505   80.682   16.503   70.956   19.163   43.960   4.6772   40.892   5.9212 3.068031 7.545636 
1 1 1   19    2   27 o  119.929   2.2367  588.068   21.866  612.554   31.834  566.196   30.087  122.159   3.1997  117.456   3.1453 4.702545 4.486725 
1 1 1   19    2   28 o   53.806   3.5023  119.426   15.277  123.147   17.596  108.033   30.790   54.546   3.9850   49.979   7.8134 4.567638 8.770976 
1 1 1   19    2   29 o   72.304   2.9874  214.703   17.569  214.100   22.621  215.619   27.893   72.018   3.8675   72.036   4.7771 -0.1830292E-01 6.146354 
1 1 1   19    2   30 o   61.855   2.7542  157.058   13.852  178.813   19.170  133.289   20.038   65.850   3.5849   56.653   4.3729 9.197765 5.654508 
1 1 1   19    2   31 o   79.862   2.3811  261.228   15.484  268.578   20.773  252.040   23.226   80.830   3.1589   78.184   3.6544 2.645638 4.830433 
1 1 1   19    2   32 o   37.876   3.5640   59.519   10.874   79.763   16.543   44.117   14.430   43.640   4.7257   32.065   5.7310 11.57493 7.428069 
1 1 1   19    2   33 o   10.928   5.0279  -7.5108   10.300  -5.0438   17.277  -8.8711   12.830   15.482   6.8695   12.264   5.6310 3.217906 8.882454 
1 1 1   19    2   34 o   61.104   2.3619  153.065   11.742  125.958   17.620  174.720   15.749   55.121   3.9476   65.183   2.9718 -10.06188 4.941154 
1 1 1   19    2   35 o   22.789   5.3313   22.491   9.7263   15.421   14.802   27.863   12.903   20.225   7.1699   25.261   6.2904 -5.036070 9.538183 
1 1 1   19    2   36 o   34.358   3.5500   49.118   9.7994   50.310   15.175   48.265   12.834   34.273   5.6270   33.774   4.7964 0.4989929 7.393822 
1 1 1   19    2   37 o   53.331   2.5136  116.807   10.897  117.533   16.683  116.267   14.390   53.223   3.8719   53.054   3.3445 0.1696548 5.116387 
1 1 1   19    2   38 o   76.208   2.0205  237.729   12.540  263.082   18.891  217.755   16.768   79.991   2.9021   72.780   2.8317 7.210533 4.054719 
1 1 1   19    2   39 o   56.770   2.5706  132.425   11.865  137.130   16.070  126.785   17.592   57.591   3.4388   55.245   3.9322 2.345016 5.223686 
1 1 1   19    2   40 o   17.007   5.5663   11.755   8.8909   24.489   13.945   3.0345   11.540   23.686   6.8412   14.530   6.0010 9.156346 9.100193 
1 1 1   19    2   41 o   19.072   5.4482   15.660   8.8911   31.146   13.843   4.7866   11.600   26.582   6.4543   15.129   6.1033 11.45278 8.883018 
1 1 1   19    2   42 o   87.774   2.0398  315.387   14.594  335.095   20.598  295.518   20.681   90.258   2.8031   84.698   3.0003 5.559860 4.105935 
1 1 1   19    2   43 o   16.630   6.0582   9.8640   10.649  -4.1999   19.376   15.950   12.747   16.489   7.2976   19.799   6.6708 -3.309792 9.887096 
1 1 1   19    2   44 o   13.758   5.7316   2.2561   10.656   1.0130   19.820   2.7616   12.638   17.739   7.6203   14.955   6.2371 2.783376 9.847380 
1 1 1   19    2   45 o   37.339   3.9710   58.509   11.901   46.804   21.328   63.801   14.342   32.040   8.1488   38.818   4.6231 -6.778839 9.368863 
1 1 1   19    2   46 o   36.998   3.3073   56.989   9.8692   61.290   17.377   54.941   11.991   37.585   5.8632   36.104   4.1496 1.481155 7.183058 
1 1 1   19    2   47 o  114.466   1.9079  536.596   17.802  539.859   29.083  534.641   22.513  114.313   3.1240  114.091   2.4207 0.2221985 3.952093 
1 1 1   19    2   48 o   16.547   5.6620   10.890   9.1866   21.220   15.710   5.5226   11.324   22.292   7.4040   15.149   6.0583 7.143704 9.566738 
1 1 1   19    2   49 o   47.139   2.6048   91.724   9.9702   87.420   15.018   95.114   13.332   45.598   4.0838   47.782   3.4460 -2.184448 5.343422 
1 1 1   19    2   50 o  115.801   1.7638  549.115   16.649  553.608   24.170  545.058   22.967  115.976   2.5566  115.124   2.4474 0.8520813 3.539179 
1 1 1   19    2   51 o   41.905   2.8601   72.818   9.7110   72.434   14.536   73.129   13.050   41.324   4.3820   41.697   3.8843 -0.3723946 5.855715 
1 1 1   19    2   52 o   29.093   3.8937   35.940   9.0025   32.479   13.568   38.662   12.033   26.864   6.3049   29.782   5.1423 -2.917387 8.136048 
1 1 1   19    2   53 o   70.476   2.0347  204.069   11.677  217.113   17.426  193.439   15.731   72.377   2.9599   68.360   2.8292 4.016914 4.094530 
1 1 1   19    2   54 o   46.906   2.6115   91.061   9.9456   94.852   14.714   87.872   13.495   47.465   3.8356   45.744   3.6494 1.720673 5.294353 
1 1 1   19    2   55 o   61.214   2.2334  154.379   11.126  151.041   16.476  157.177   15.084   60.136   3.3746   61.496   3.0183 -1.360332 4.527434 
1 1 1   19    2   56 f   34.169   3.3700   49.100   9.2643   50.172   13.682   48.193   12.589   33.895   5.1107   33.350   4.7664 0.5451584 6.988419 
1 1 1   19    2   57 o   42.584   2.8284   75.445   9.7623   78.899   14.739   72.746   13.030   43.011   4.2597   41.433   3.9041 1.578018 5.778189 
1 1 1   19    2   58 o   32.256   3.5937   44.069   9.2887   39.285   13.983   47.848   12.427   29.474   6.0235   33.193   4.7262 -3.719292 7.656321 
1 1 1   19    2   59 o   15.443   6.1425   6.7321   11.579  -3.4634   18.190   13.678   15.014   15.639   6.9869   18.963   7.1399 -3.323681 9.989771 
1 1 1   19    2   60 o   53.169   3.1462  118.266   13.575  120.869   20.936  116.377   17.831   52.792   4.9218   52.207   4.2260 0.5852776 6.487195 
1 1 1   19    2   61 o   94.691   2.3664  370.431   18.266  363.480   27.414  375.981   24.495   92.895   3.6273   94.841   3.1729 -1.946167 4.819206 
1 1 1   19    2   62 o   59.417   2.2389  145.916   10.824  142.742   15.804  148.719   14.855   58.274   3.3412   59.627   3.0667 -1.352947 4.535173 
1 1 1   19    2   63 o   25.855   4.3780   29.277   8.8980   32.747   13.448   26.575   11.867   26.524   6.3115   23.960   6.0701 2.564291 8.756820 
1 1 1   19    2   64 o   26.885   4.0983   31.402   8.6979   33.540   13.250   29.784   11.530   26.864   6.1796   25.501   5.6912 1.363531 8.400977 
1 1 1   19    2   65 o   37.009   3.0900   57.686   9.2369   56.435   13.939   58.666   12.334   35.753   4.9125   36.843   4.1806 -1.090675 6.450617 
1 1 1   19    2   66 o   25.480   4.4088   28.606   8.8257   17.558   13.185   37.575   11.880   19.769   6.7826   28.887   5.2379 -9.117580 8.569640 
1 1 1   19    2   67 o   21.779   5.0960   21.556   8.8857   23.050   13.609   20.445   11.732   22.052   6.8512   20.928   6.3352 1.124361 9.331369 
1 1 1   19    2   68 o   36.960   3.1980   57.805   9.5404   37.375   13.922   75.894   13.100   28.217   6.2203   42.048   3.8652 -13.83046 7.323418 
1 1 1   19    2   69 o   12.970   5.2542   4.1859   8.6368   7.5576   13.061   1.5660   11.513   15.982   6.4660   13.519   5.8078 2.462296 8.691368 
1 1 1   19    2   70 o   15.058   5.4854   9.0112   8.7306   3.4047   13.423   13.122   11.494   14.848   6.3219   17.530   6.3066 -2.681732 8.929738 
1 1 1   19    2   71 o   60.539   2.2453  152.172   11.061  150.161   16.410  153.846   14.974   59.438   3.4011   60.406   3.0510 -0.9684029 4.569014 
1 1 1   19    2   72 o   58.250   2.3443  141.263   11.109  127.290   16.158  153.788   15.297   54.471   3.6602   60.296   3.1230 -5.825348 4.811506 
1 1 1   19    2   73 o   15.968   5.4939   11.159   8.6524  -3.6899   13.140   22.529   11.497   12.855   5.8231   21.597   6.2037 -8.742107 8.508537 
1 1 1   19    2   74 o   38.559   3.0229   63.161   9.4253   88.081   14.610   45.396   12.336   44.895   4.0352   31.584   4.9542 13.31132 6.389564 
1 1 1   19    2   75 o   18.318   5.8647   15.874   9.9023   23.659   15.349   10.323   12.960   21.590   7.3200   16.498   6.5188 5.092243 9.801931 
1 1 1   19    2   76 o   37.078   4.5039   61.741   13.334   53.721   16.545   76.603   22.522   33.112   6.3608   38.562   7.4346 -5.449226 9.784297 
1 1 1   19    2   77 o   17.549   6.2367   14.387   11.205   12.934   13.961   17.017   18.783   17.406   6.7994   19.351   7.7805 -1.945236 10.33289 
1 1 1   19    2   78 o   17.170   6.1670   13.745   10.986   31.048   13.766 -16.5934   18.229   24.502   6.7009   12.696   6.0926 11.80608 9.056614 
1 1 1   19    2   79 o   18.810   6.2482   17.632   11.188   25.903   13.361  -1.7776   20.468   22.225   6.7677   15.515   7.1195 6.710331 9.822923 
1 1 1   19    2   80 o   13.571   5.3681   6.5839   8.7970   3.1989   12.767   9.6439   12.138   13.934   6.0509   15.667   6.2700 -1.732963 8.713552 
1 1 1   19    2   81 o   13.801   5.4391   7.1103   9.0013   6.0563   12.573   8.2184   12.892   14.584   6.1601   15.317   6.3360 -0.7333717 8.836945 
1 1 1   19    2   82 o   30.573   4.2050   42.693   10.202   16.451   15.283   63.788   13.702   18.143   7.1061   37.039   4.6399 -18.89623 8.486759 
1 1 1   19    2   83 o   9.6745   4.5216  -5.7530   8.8420   7.4882   12.670 -18.3247   12.345   14.842   6.2212   9.5958   4.6981 5.246037 7.795850 
1 1 1   19    2   84 o   30.209   4.0722   41.765   9.7724   42.056   13.532   41.448   14.128   28.594   5.9975   28.030   6.3330 0.5640717 8.722138 
1 1 1   19    2   85 o   10.579   4.7928  -1.9283   8.9049  -4.6858   12.437   0.9720   12.755   11.705   5.4342   13.038   5.8358 -1.332689 7.974164 
1 1 1   19    2   86 o   15.148   5.7725   10.598   9.8835   14.996   12.455   3.1175   16.242   17.103   6.4888   14.558   6.5452 2.544847 9.216530 
1 1 1   19    2   87 o   10.932   5.1962  -9.1637   12.601  -9.1637   12.601   0.0000   0.0000   10.932   5.1962  ?   ?  0.000000 5.196208 
1 1 1   19    2   88 o   15.371   6.3799   9.8528   13.134   10.818   15.042   6.7572   26.941   15.973   6.7417   17.026   7.9361 -1.053682 10.41310 
1 1 1   19    2   89 o   15.924   6.3884   12.063   12.633   6.3459   14.673   28.445   24.837   14.706   6.4348   20.306   8.6209 -5.599504 10.75766 
1 1 1   19    2   90 o   22.438   5.4836   26.004   9.9433   35.092   10.877 -20.2080   24.528   26.447   5.2308   13.499   6.6119 12.94788 8.430789 
1 1 1   19    2   91 o   13.881   5.8338   6.8178   11.187   2.5650   12.578   22.911   24.468   13.137   5.8432   19.044   8.3218 -5.907254 10.16837 
1 1 1   19    2   92 o   23.074   7.7630   34.706   17.263   22.781   23.815   47.910   25.059   18.919   8.2394   24.418   9.2175 -5.499454 12.36329 
1 1 1   19    2   93 o   14.843   6.7051   5.1487   17.278  -9.1669   24.073   20.358   24.813   14.320   6.9049   18.397   8.1934 -4.076954 10.71488 
1 1 1   19    2   94 o   18.457   7.4637   20.969   17.393   43.019   24.427  -1.7069   24.772   23.057   8.9977   15.207   7.2443 7.849752 11.55152 
1 1 1   19    2   95 o   12.449   5.9502  -8.7423   17.004  -7.4034   24.194 -10.0493   23.904   14.426   6.9475   14.091   6.8158 0.3343849 9.732609 
1 1 1   19    2   96 o   19.501   7.6606   25.307   17.805   47.168   25.449   4.3454   24.920   23.518   9.1820   15.827   7.4580 7.691014 11.82925 
1 1 1   19    2   97 o   14.421   6.5593   4.4161   16.880 -13.8233   23.947   22.428   23.797   13.623   6.6425   18.379   8.1130 -4.756047 10.48537 
1 1 1   19    2   98 f   16.654   7.0669   15.125   16.674   32.330   24.603   0.5081   22.677   20.122   8.5629   14.878   7.0421 5.243773 11.08669 
1 1 1   19    2   99 o   15.587   7.2745   5.7313   22.750   0.0000   0.0000   5.7313   22.750  ?   ?    15.587   7.2745 0.000000 7.274457 
1 1 1   19    2  100 o   13.195   6.4338 -14.6024   22.466   0.0000   0.0000 -14.6024   22.466  ?   ?    13.195   6.4338 0.000000 6.433832 
1 1 1   19    3  -97 o   19.276   8.6919   29.713   28.882   29.713   28.882   0.0000   0.0000   19.276   8.6919  ?   ?  0.000000 8.691909 
1 1 1   19    3  -96 o   18.078   8.3490   21.529   28.788   21.529   28.788   0.0000   0.0000   18.078   8.3490  ?   ?  0.000000 8.349041 
1 1 1   19    3  -95 o   20.822   9.0476   39.547   28.580   39.547   28.580   0.0000   0.0000   20.822   9.0476  ?   ?  0.000000 9.047633 
1 1 1   19    3  -94 o   16.161   7.7235   4.6078   28.638   4.6078   28.638   0.0000   0.0000   16.161   7.7235  ?   ?  0.000000 7.723535 
1 1 1   19    3  -93 o   16.464   7.7015   9.1384   25.746   9.1384   25.746   0.0000   0.0000   16.464   7.7015  ?   ?  0.000000 7.701476 
1 1 1   19    3  -92 o   15.543   7.4444  -0.7370   26.920  -0.7370   26.920   0.0000   0.0000   15.543   7.4444  ?   ?  0.000000 7.444373 
1 1 1   19    3  -91 o   16.208   7.6784   4.6283   27.078   4.6283   27.078   0.0000   0.0000   16.208   7.6784  ?   ?  0.000000 7.678432 
1 1 1   19    3  -90 o   15.485   7.3510   0.2001   25.068   0.2001   25.068   0.0000   0.0000   15.485   7.3510  ?   ?  0.000000 7.351039 
1 1 1   19    3  -89 o   16.143   7.5877   4.4909   25.509   4.4909   25.509   0.0000   0.0000   16.143   7.5877  ?   ?  0.000000 7.587745 
1 1 1   19    3  -88 o   20.267   8.6693   30.077   25.449   30.077   25.449   0.0000   0.0000   20.267   8.6693  ?   ?  0.000000 8.669252 
1 1 1   19    3  -87 o   14.631   7.0298  -7.8360   24.438  -7.8360   24.438   0.0000   0.0000   14.631   7.0298  ?   ?  0.000000 7.029777 
1 1 1   19    3  -86 o   14.958   6.8144   3.7834   18.311   0.0040   26.332   7.3225   25.481   15.923   7.5519   16.712   7.7654 -0.7887487 10.83206 
1 1 1   19    3  -85 o   20.219   7.2692   24.590   15.268   16.972   19.227   37.592   25.118   17.861   7.5842   22.285   8.9845 -4.423862 11.75761 
1 1 1   19    3  -84 o   13.353   6.0869  -0.1220   14.639   11.175   18.411 -19.5438   24.140   16.581   7.2325   13.594   6.6370 2.986884 9.816273 
1 1 1   19    3  -83 o   27.047   6.3327   39.273   13.714   25.031   18.983   54.823   19.835   20.107   7.9065   29.849   7.9930 -9.742062 11.24282 
1 1 1   19    3  -82 o   16.603   6.7247   13.118   14.145   16.472   17.185   6.0726   24.906   17.834   7.3399   16.802   7.7616 1.032028 10.68254 
1 1 1   19    3  -81 f   9.4927   4.6623 -19.2150   12.458 -13.6085   17.411 -25.0970   17.833   12.312   5.9204   11.199   5.5156 1.113132 8.091490 
1 1 1   19    3  -80 o   18.890   6.7692   19.358   13.228   25.308   18.390   12.980   19.040   20.548   7.8633   17.361   7.4637 3.186728 10.84153 
1 1 1   19    3  -79 o   12.369   5.6221  -1.8165   12.374 -11.9386   16.786   10.230   18.312   12.419   5.9293   16.786   7.2684 -4.366920 9.380115 
1 1 1   19    3  -78 o   16.893   6.0131   13.941   10.420   7.1184   16.939   18.094   13.217   15.936   6.9445   18.654   6.7559 -2.718441 9.688546 
1 1 1   19    3  -77 o   11.023   5.0206  -3.0193   9.9317 -23.9526   17.123   7.5937   12.192   11.246   5.5116   14.939   6.1688 -3.693110 8.272352 
1 1 1   19    3  -76 o   8.8195   4.2925 -14.5265   9.8760 -20.3758   16.650 -11.3515   12.267   11.490   5.5878   10.670   5.0870 0.8198271 7.556560 
1 1 1   19    3  -75 o   20.235   5.9878   20.503   10.571   34.301   17.859   13.061   13.115   24.605   7.8759   17.111   6.6163 7.493994 10.28616 
1 1 1   19    3  -74 o   11.422   4.9328   1.0640   8.3904   17.369   11.347 -18.6044   12.463   18.761   6.2937   9.7859   4.7759 8.974985 7.900656 
1 1 1   19    3  -73 o   41.366   2.8490   72.736   9.5480   82.512   13.110   61.694   13.934   43.443   3.7384   36.768   4.7607 6.674900 6.053068 
1 1 1   19    3  -72 o   16.917   5.5812   13.295   8.9315   14.944   12.649   11.655   12.613   18.012   6.5961   16.784   6.4888 1.227703 9.252774 
1 1 1   19    3  -71 o   19.427   5.3873   17.883   8.8287   33.118   12.448   2.4613   12.524   26.173   5.9673   13.950   6.0256 12.22314 8.480375 
1 1 1   19    3  -70 o   7.5456   3.7102 -15.1470   7.9626 -13.7191   10.694 -16.9238   11.929   9.5828   4.6161   9.8322   4.7697 -0.2494793 6.637637 
1 1 1   19    3  -69 o   21.283   5.3939   21.275   9.3681   10.739   13.829   30.210   12.735   16.983   6.7265   24.936   6.2721 -7.952682 9.197024 
1 1 1   19    3  -68 o   22.866   5.2378   24.243   9.5527   19.031   14.087   28.679   12.998   20.067   7.0045   24.265   6.4580 -4.197802 9.527242 
1 1 1   19    3  -67 o   26.222   4.0669   30.220   8.4116   32.614   11.033   26.897   13.000   26.656   5.2642   23.540   6.5407 3.115892 8.395970 
1 1 1   19    3  -66 o   15.647   5.3316   10.533   8.1442   12.339   10.772   8.1226   12.443   17.030   6.1080   15.885   6.3512 1.145202 8.811682 
1 1 1   19    3  -65 o   20.212   5.0575   18.692   8.3115   25.908   11.070   9.3679   12.583   23.523   5.8085   16.398   6.4404 7.124758 8.672838 
1 1 1   19    3  -64 o   47.046   2.4638   92.174   9.4157   87.154   12.713   98.272   14.013   45.273   3.4714   48.010   3.6071 -2.737148 5.006220 
1 1 1   19    3  -63 o   9.3909   4.3678  -6.2624   8.0916  -9.2810   10.961  -2.6467   11.996   10.654   4.9970   12.686   5.6702 -2.031639 7.557857 
1 1 1   19    3  -62 o   18.436   5.2725   15.433   8.3221   15.811   11.471   15.012   12.092   18.803   6.3281   18.544   6.4884 0.2589779 9.063351 
1 1 1   19    3  -61 o   15.052   5.3054   9.1963   8.0950   8.1901   10.765   10.506   12.280   15.481   5.9921   16.837   6.4298 -1.356168 8.789096 
1 1 1   19    3  -60 o   60.060   2.0879  149.001   10.206  139.725   13.516  161.309   15.568   57.812   2.8771   62.009   3.0897 -4.197201 4.221808 
1 1 1   19    3  -59 o   25.358   3.7732   27.743   7.5620   21.464   11.195   33.013   10.256   21.526   6.1015   27.290   4.7847 -5.763390 7.753829 
1 1 1   19    3  -58 o   33.191   3.2301   46.534   8.6290   49.041   11.607   43.436   12.902   33.629   4.3350   31.188   5.2621 2.440981 6.817723 
1 1 1   19    3  -57 f   31.161   3.3465   41.130   8.3673   41.155   11.245   41.098   12.524   30.656   4.6454   30.356   5.2514 0.3000851 7.011218 
1 1 1   19    3  -56 o   23.851   5.6550   25.895   10.826   26.849   16.374   25.153   14.431   23.850   7.5305   23.188   7.0278 0.6622219 10.30035 
1 1 1   19    3  -55 o   31.297   3.9768   41.999   9.9167   27.101   16.780   49.995   12.293   24.006   7.6287   33.940   4.5586 -9.933815 8.886945 
1 1 1   19    3  -54 o   34.741   4.1850   51.791   11.613   33.905   17.018   67.379   15.887   26.708   7.5066   39.252   5.0845 -12.54362 9.066495 
1 1 1   19    3  -53 o   27.818   4.3594   33.533   9.5607   32.706   14.520   34.166   12.703   26.556   6.7068   27.495   5.8481 -0.9385338 8.898392 
1 1 1   19    3  -52 o   55.625   2.3978  127.874   10.847  113.730   15.928  140.104   14.811   51.915   3.7900   57.945   3.1476 -6.030369 4.926646 
1 1 1   19    3  -51 o   26.790   4.4243   31.125   9.3247   37.377   14.051   26.205   12.465   28.706   6.1873   23.960   6.3001 4.746029 8.830231 
1 1 1   19    3  -50 o   31.222   3.6242   41.260   9.0528   33.499   14.538   46.175   11.569   27.017   6.6476   32.763   4.4467 -5.746132 7.997740 
1 1 1   19    3  -49 o   20.819   4.8621   19.147   8.1011   6.6013   13.814   25.723   10.001   16.405   6.6453   24.078   5.2445 -7.672878 8.465468 
1 1 1   19    3  -48 o   64.545   1.8653  171.014   9.8038  170.783   14.872  171.192   13.038   64.198   2.8490   64.400   2.4882 -0.2022095 3.782634 
1 1 1   19    3  -47 o   33.866   2.9377   47.791   8.0296   58.157   12.401   40.308   10.536   36.998   4.1855   30.676   4.3343 6.321825 6.025325 
1 1 1   19    3  -46 o   49.356   2.2124  100.295   8.8782  109.014   13.602   93.823   11.719   51.159   3.2790   47.519   3.0413 3.639824 4.472272 
1 1 1   19    3  -45 o   18.639   4.8751   15.232   7.4901   18.770   11.805   12.848   9.6905   20.693   6.3729   17.570   5.8142 3.123714 8.626637 
1 1 1   19    3  -44 f   36.854   2.7215   56.281   8.1181   41.360   12.442   67.341   10.712   30.877   5.1230   40.184   3.2994 -9.307589 6.093483 
1 1 1   19    3  -43 o   53.361   2.0736  116.964   9.0021  114.466   13.800  118.814   11.877   52.493   3.2408   53.631   2.7258 -1.138073 4.234755 
1 1 1   19    3  -42 o   60.706   1.9209  151.141   9.4934  143.389   14.459  157.015   12.587   58.856   3.0238   61.742   2.5061 -2.886047 3.927341 
1 1 1   19    3  -41 o   37.132   2.9159   57.187   8.7551   46.338   15.219   62.552   10.703   32.489   5.9664   38.721   3.4264 -6.231747 6.880325 
1 1 1   19    3  -40 o   41.576   2.8382   71.520   9.5610   96.377   16.362   58.632   11.782   47.891   4.2349   37.357   3.9277 10.53357 5.775941 
1 1 1   19    3  -39 o   64.025   2.2125  168.303   11.529  158.762   20.106  172.978   14.073   61.662   4.0221   64.802   2.6699 -3.139999 4.827617 
1 1 1   19    3  -38 o   53.768   2.4622  118.938   10.763  115.048   19.000  120.777   13.061   52.312   4.4994   54.067   2.9749 -1.755520 5.393897 
1 1 1   19    3  -37 o   49.789   2.3743  101.928   9.6085   96.417   14.703  106.037   12.694   48.096   3.7806   50.633   3.0904 -2.537121 4.882980 
1 1 1   19    3  -36 o   78.396   2.0650  251.875   13.185  194.678   21.889  284.446   16.518   68.406   3.9422   83.226   2.4374 -14.82018 4.634880 
1 1 1   19    3  -35 o   92.598   1.8396  350.760   13.885  327.986   21.070  368.242   18.461   89.252   2.9000   94.727   2.3927 -5.475357 3.759654 
1 1 1   19    3  -34 o  100.005   1.5902  408.701   12.963  403.841   19.113  412.842   17.641   99.250   2.3624  100.399   2.1555 -1.149139 3.198041 
1 1 1   19    3  -33 o   66.531   1.8894  181.208   10.237  169.765   15.756  189.566   13.466   64.172   3.0205   67.951   2.4350 -3.778900 3.879777 
1 1 1   19    3  -32 o   20.768   4.7174   18.651   7.8035   11.592   12.481   23.181   9.9990   18.001   6.5584   23.075   5.4104 -5.074030 8.502031 
1 1 1   19    3  -31 f   35.529   3.0852   52.290   8.8466   46.138   15.088   55.514   10.921   32.660   5.8835   36.485   3.7242 -3.824795 6.963152 
1 1 1   19    3  -30 o   61.601   2.7628  156.053   13.838  159.419   19.484  152.627   19.657   61.999   3.8747   60.624   4.0001 1.374771 5.569016 
1 1 1   19    3  -29 o   67.337   1.8894  185.538   10.361  175.223   15.563  193.748   13.885   65.254   2.9333   68.714   2.4830 -3.460419 3.843078 
1 1 1   19    3  -28 o   38.260   2.8204   60.393   8.7345   59.735   13.235   60.902   11.626   37.729   4.3850   38.240   3.7790 -0.5109215 5.788714 
1 1 1   19    3  -27 o   28.167   3.7626   33.281   8.4231   42.520   12.905   26.424   11.118   31.553   5.1982   24.659   5.6523 6.894789 7.679154 
1 1 1   19    3  -26 o   63.442   1.9778  164.736   10.216  168.209   15.406  162.010   13.648   63.943   2.9638   62.806   2.6719 1.136597 3.990374 
1 1 1   19    3  -25 o   65.941   2.1096  178.040   11.325  175.102   19.286  179.587   13.991   65.097   3.6491   66.148   2.5998 -1.051888 4.480468 
1 1 1   19    3  -24 o   58.117   2.2760  138.437   10.762  121.531   14.997  156.384   15.452   54.253   3.4084   61.636   3.0853 -7.382717 4.597371 
1 1 1   19    3  -23 o   44.066   2.6418   79.851   9.4457   94.406   14.441   68.968   12.487   47.728   3.7417   40.737   3.8045 6.991211 5.336147 
1 1 1   19    3  -22 o   14.420   5.6519   5.3023   9.6732  -4.5679   13.373   16.134   14.009   13.522   6.0192   20.318   6.9907 -6.796317 9.224947 
1 1 1   19    3  -21 o   42.490   3.1710   74.536   10.904   72.652   15.028   76.630   15.845   41.679   4.4944   42.788   4.6158 -1.109104 6.442462 
1 1 1   19    3  -20 o   67.482   2.2526  186.492   12.374  202.448   17.049  168.730   17.987   70.189   2.9867   63.973   3.4622 6.216030 4.572412 
1 1 1   19    3  -19 o  101.294   1.8725  419.233   15.461  414.754   20.953  424.586   22.909  100.611   2.5569  101.752   2.7646 -1.141205 3.765692 
1 1 1   19    3  -18 o   74.253   2.1074  225.594   12.743  224.387   17.713  226.889   18.346   73.917   2.9456   74.311   3.0350 -0.3943100 4.229398 
1 1 1   19    3  -17 o   56.923   2.6023  132.951   12.043  146.516   17.793  121.483   16.360   59.570   3.6824   54.214   3.7246 5.356014 5.237598 
1 1 1   19    3  -16 o   63.767   2.3940  166.602   12.422  184.429   17.982  150.330   17.180   66.942   3.3055   60.383   3.5054 6.558998 4.818112 
1 1 1   19    3  -15 o   86.003   2.0076  302.270   14.074  300.677   20.088  303.805   19.725   85.607   2.8828   86.065   2.8154 -0.4577255 4.029555 
1 1 1   19    3  -14 o  111.637   1.9999  509.283   18.200  529.610   29.043  496.140   23.354  113.583   3.1398  110.087   2.6025 3.496033 4.078137 
1 1 1   19    3  -13 o   97.975   1.7706  392.027   14.140  388.443   22.097  394.513   18.402   97.342   2.7877   98.217   2.2984 -0.8755951 3.613007 
1 1 1   19    3  -12 o   52.060   2.4805  111.146   10.496  138.325   16.799   93.741   13.443   57.914   3.5759   47.650   3.4851 10.26400 4.993310 
1 1 1   19    3  -11 o   12.941   5.3392   2.1578   9.1226   4.9173   14.807   0.4696   11.582   16.803   6.8525   13.845   5.8829 2.957604 9.031361 
1 1 1   19    3  -10 o   36.188   3.4880   54.267   10.162   40.402   17.606   61.194   12.444   30.410   7.2122   38.348   4.0417 -7.937706 8.267460 
1 1 1   19    3   -9 o   71.700   2.1126  210.290   12.334  211.869   21.401  209.505   15.093   71.709   3.6734   71.501   2.5939 0.2081985 4.496880 
1 1 1   19    3   -8 o   70.366   2.1213  202.544   12.154  256.118   21.766  178.273   14.650   78.922   3.3913   65.930   2.7320 12.99257 4.354789 
1 1 1   19    3   -7 o  113.582   1.9753  527.054   18.288  493.611   28.195  551.343   24.029  109.673   3.1571  116.080   2.5395 -6.407021 4.051722 
1 1 1   19    3   -6 o  129.455   1.9669  684.638   20.756  685.041   32.686  684.365   26.868  129.269   3.1019  129.327   2.5486 -0.5793762E-01 4.014674 
1 1 1   19    3   -5 o   54.862   2.5776  123.433   11.495  151.618   17.324  101.265   15.364   60.667   3.5184   49.482   3.8391 11.18473 5.207442 
1 1 1   19    3   -4 o   60.959   2.4002  152.211   11.904  161.855   17.506  143.918   16.234   62.703   3.4381   59.126   3.3825 3.577526 4.823040 
1 1 1   19    3   -3 o   55.996   2.3554  128.444   10.727  119.060   17.117  134.514   13.766   53.659   3.9407   57.224   2.9613 -3.564400 4.929342 
1 1 1   19    3   -2 o   9.0288   4.3069 -11.5953   8.8179 -14.3932   14.215  -9.8451   11.243   12.103   5.6810   11.089   5.1545 1.013686 7.670937 
1 1 1   19    3   -1 o   49.381   2.5461  100.032   10.214  112.650   16.351   91.958   13.080   52.202   3.8702   47.215   3.4218 4.987179 5.165955 
1 1 1   19    3    0 o   66.387   2.2671  180.384   12.251  190.685   22.404  175.991   14.632   67.950   4.0635   65.508   2.7462 2.441360 4.904427 
1 1 1   19    3    1 o   19.537   5.7736   16.121   9.8334   39.007   18.724   7.4039   11.555   29.861   7.6567   16.167   6.2212 13.69375 9.865525 
1 1 1   19    3    2 o   48.811   2.8222   97.885   11.181   87.153   20.766  102.266   13.268   45.463   5.7306   49.825   3.2852 -4.362461 6.605501 
1 1 1   19    3    3 o   79.618   2.0780  259.201   13.475  245.655   24.599  265.007   16.106   77.185   3.9227   80.453   2.4587 -3.268562 4.629550 
1 1 1   19    3    4 o   91.276   1.8292  340.244   13.610  323.062   21.462  351.800   17.601   88.747   2.9709   92.726   2.3305 -3.979073 3.775887 
1 1 1   19    3    5 o   33.285   3.6852   46.066   9.8314   56.909   16.121   39.645   12.405   36.634   5.5741   30.544   5.1665 6.090055 7.600235 
1 1 1   19    3    6 o   59.886   2.4343  146.931   11.858  126.690   18.017  162.399   15.751   55.341   4.0214   62.868   3.0829 -7.527134 5.067088 
1 1 1   19    3    7 o   39.107   3.3276   63.197   10.507   69.779   16.560   58.761   13.594   40.755   5.0957   37.472   4.5431 3.282940 6.826856 
1 1 1   19    3    8 o  112.139   1.8486  513.609   16.898  514.006   25.032  513.276   22.905  112.042   2.7408  112.005   2.5087 0.3783417E-01 3.715609 
1 1 1   19    3    9 o   74.109   2.1398  224.665   12.913  233.583   19.635  217.868   17.141   75.398   3.2019   72.868   2.8915 2.530128 4.314306 
1 1 1   19    3   10 o   42.385   3.1217   74.056   10.710   55.387   16.249   88.395   14.241   36.084   5.7145   46.208   3.8147 -10.12388 6.870756 
1 1 1   19    3   11 o   30.228   4.3171   38.409   10.336   17.290   15.887   53.906   13.609   21.289   7.4380   35.808   4.7818 -14.51940 8.842515 
1 1 1   19    3   12 o   25.022   5.1335   26.860   10.119   17.260   15.748   33.612   13.207   21.239   7.4064   27.891   5.9878 -6.651945 9.524154 
1 1 1   19    3   13 o   82.055   2.0554  275.342   13.737  262.738   20.618  285.403   18.421   79.969   3.1693   83.439   2.7120 -3.470657 4.171217 
1 1 1   19    3   14 o   36.988   3.5810   56.741   10.662   28.725   16.621   76.332   13.899   25.781   7.4754   42.867   4.0246 -17.08603 8.489906 
1 1 1   19    3   15 o   54.487   2.8544  121.987   12.634  109.871   22.991  127.228   15.121   51.101   5.6115   55.565   3.3541 -4.463608 6.537562 
1 1 1   19    3   16 o   55.115   2.8874  124.837   12.927  117.042   23.424  128.251   15.501   52.777   5.5266   55.772   3.4261 -2.995468 6.502442 
1 1 1   19    3   17 o   44.094   3.4169   80.346   12.186   97.325   22.284   73.103   14.555   47.987   5.8153   41.869   4.3269 6.118614 7.248445 
1 1 1   19    3   18 o   48.171   3.0168   95.541   11.786  102.432   18.464   90.802   15.312   49.558   4.6240   46.762   4.0571 2.795101 6.151561 
1 1 1   19    3   19 o   78.228   2.4352  250.715   15.510  240.411   20.733  263.809   23.371   76.428   3.3359   80.007   3.5928 -3.578636 4.902683 
1 1 1   19    3   20 o   33.935   4.6276   48.498   12.468   63.117   17.051   31.703   18.277   38.546   5.5897   26.977   7.8438 11.56864 9.631674 
1 1 1   19    3   21 o   36.160   4.2857   54.739   12.387   53.721   16.945   55.908   18.154   35.358   6.0995   35.995   6.4227 -0.6374054 8.857496 
1 1 1   19    3   22 o   13.455   5.5776   2.1691   10.020  -2.4926   15.531   5.4936   13.116   15.167   6.6288   16.160   6.5001 -0.9925470 9.283992 
1 1 1   19    3   23 o   52.657   2.6451  113.906   11.317  113.046   17.207  114.561   15.024   52.177   4.0781   52.651   3.5209 -0.4732857 5.387708 
1 1 1   19    3   24 o   23.725   5.6771   24.438   10.832   38.287   20.672   19.196   12.718   29.419   8.2751   21.331   6.6226 8.087950 10.59886 
1 1 1   19    3   25 o   19.222   5.8126   15.621   9.8794   20.120   15.271   12.382   12.956   22.123   7.2980   18.529   6.6918 3.593933 9.901507 
1 1 1   19    3   26 o   71.146   2.1677  207.296   12.557  213.173   19.111  202.833   16.656   71.931   3.2680   70.239   2.9155 1.692085 4.379467 
1 1 1   19    3   27 o   35.585   3.5427   52.659   10.140   52.255   15.740   52.946   13.258   34.906   5.7306   35.418   4.7085 -0.5128212 7.416880 
1 1 1   19    3   28 o  119.148   2.0149  580.645   19.569  537.977   25.357  643.488   30.773  114.522   2.7162  125.158   3.0163 -10.63493 4.059069 
1 1 1   19    3   29 o   59.989   2.3400  147.608   11.421  144.547   17.336  149.955   15.180   59.103   3.6157   60.322   3.0976 -1.218849 4.761135 
1 1 1   19    3   30 o   63.559   2.4101  165.763   12.464  170.204   17.277  160.944   17.998   64.216   3.3118   62.381   3.5542 1.835678 4.858037 
1 1 1   19    3   31 f   44.825   3.6472   83.450   13.212   92.296   15.214   56.325   26.642   47.069   4.0032   35.147   9.1952 11.92168 10.02881 
1 1 1   19    3   32 o   65.543   2.3552  176.263   12.563  166.335   16.894  188.542   18.788   63.468   3.2766   67.543   3.4236 -4.075111 4.738937 
1 1 1   19    3   33 o   55.787   2.6345  128.017   11.946  151.260   15.978   98.556   17.989   60.511   3.2513   48.448   4.6106 12.06218 5.641672 
1 1 1   19    3   34 o   76.126   2.2084  237.601   13.689  236.944   18.432  238.409   20.443   75.834   2.9875   75.976   3.3089 -0.1419525 4.458013 
1 1 1   19    3   35 o   27.657   4.6638   32.723   10.141   37.680   14.079   27.380   14.618   29.321   6.0898   24.884   6.9440 4.437891 9.236124 
1 1 1   19    3   36 o   28.170   4.8324   34.055   10.697   50.565   16.805   22.808   13.870   33.991   6.2967   22.871   6.8809 11.11991 9.327144 
1 1 1   19    3   37 o   52.645   2.5564  114.087   10.938  113.175   15.455  115.002   15.481   52.166   3.6578   52.594   3.6333 -0.4283485 5.155607 
1 1 1   19    3   38 o   19.735   5.8533   16.830   10.092   14.176   16.153   18.529   12.925   19.950   7.4275   20.882   6.7017 -0.9318638 10.00396 
1 1 1   19    3   39 o   10.736   4.8942  -5.5814   9.4661   15.568   16.087 -16.7839   11.708   20.377   7.4424   10.074   4.8468 10.30326 8.881423 
1 1 1   19    3   40 o   61.976   2.3310  157.893   11.755  158.076   20.017  157.797   14.524   61.504   4.0145   61.817   2.8902 -0.3131294 4.946693 
1 1 1   19    3   41 o   43.753   2.9198   79.275   10.354   88.693   18.628   75.065   12.455   45.589   5.0999   42.384   3.6403 3.204906 6.265822 
1 1 1   19    3   42 o   13.047   5.2367   3.7799   8.4929   5.6863   13.167   2.4215   11.114   16.017   6.4877   13.993   5.8434 2.023582 8.731283 
1 1 1   19    3   43 o   37.754   3.1282   59.320   9.5406   74.802   15.032   48.876   12.346   42.012   4.4574   33.825   4.5965 8.187038 6.402787 
1 1 1   19    3   44 f   45.938   2.6392   87.210   9.8413  101.698   15.629   77.692   12.668   49.226   3.9275   43.078   3.6417 6.147110 5.356030 
1 1 1   19    3   45 o   54.183   2.4851  121.089   10.947  139.683   18.654  111.323   13.519   57.682   3.9920   51.738   3.2215 5.943893 5.129736 
1 1 1   19    3   46 o   25.881   4.3825   28.874   8.9159   15.498   13.960   38.089   11.587   19.631   6.9628   29.608   4.9772 -9.976656 8.558825 
1 1 1   19    3   47 o   58.279   2.2565  139.870   10.699  140.247   16.421  139.591   14.105   57.946   3.4927   57.996   2.9936 -0.4995728E-01 4.600095 
1 1 1   19    3   48 o   79.255   1.9398  257.766   12.532  265.999   18.886  251.288   16.752   80.126   2.8963   77.984   2.6390 2.141884 3.918298 
1 1 1   19    3   49 o   12.502   5.1743   2.4215   8.6041  -2.5525   13.312   5.9906   11.276   13.668   6.0489   15.147   6.0495 -1.479597 8.554865 
1 1 1   19    3   50 o   25.590   4.4196   28.413   8.8859   36.355   13.745   22.711   11.647   28.365   6.1242   22.399   6.1786 5.965916 8.699492 
1 1 1   19    3   51 o   20.074   5.3365   17.997   8.8818   9.3131   13.750   24.215   11.635   17.195   6.7387   23.089   6.0940 -5.893785 9.085536 
1 1 1   19    3   52 o   48.820   2.5536   98.740   10.127  101.262   15.450   96.841   13.408   48.919   3.9070   48.029   3.4477 0.8901443 5.210705 
1 1 1   19    3   53 o   94.265   1.8508  364.892   14.221  365.017   20.958  364.786   19.361   93.824   2.7433   93.914   2.5314 -0.8921814E-01 3.732754 
1 1 1   19    3   54 o   39.476   3.9721   66.380   12.608   55.643   19.436   74.181   16.567   34.513   7.1441   41.238   5.0325 -6.724457 8.738655 
1 1 1   19    3   55 o   18.871   6.3270   15.485   11.468   9.4675   18.200   19.448   14.769   18.533   7.5824   20.948   7.1786 -2.414110 10.44150 
1 1 1   19    3   56 o   26.138   5.7303   31.069   11.872   23.361   18.686   36.286   15.373   22.719   8.0559   27.781   6.8357 -5.061958 10.56524 
1 1 1   19    3   57 f   13.695   5.4590   5.0778   9.1645 -16.0432   14.056   20.695   12.087   11.369   5.4272   21.209   6.4325 -9.840219 8.416129 
1 1 1   19    3   58 o   17.166   5.5524   12.885   8.8602   20.015   13.611   7.6417   11.672   20.932   6.8892   15.682   6.1895 5.249691 9.261250 
1 1 1   19    3   59 o   53.590   3.0377  120.359   13.216  160.956   19.693   87.095   17.826   61.430   3.9537   44.508   4.9997 16.92222 6.374025 
1 1 1   19    3   60 o   21.616   5.4475   21.383   9.5934   18.246   16.843   22.890   11.672   20.560   7.5974   22.145   6.2141 -1.584173 9.815084 
1 1 1   19    3   61 o   41.408   3.1285   72.242   10.482   72.535   17.645   72.082   13.030   40.162   5.5371   40.972   3.9504 -0.8101692 6.801790 
1 1 1   19    3   62 o   12.789   5.3369   2.7241   9.2612   9.5320   16.371  -0.4798   11.231   17.709   7.2118   12.853   5.6266 4.856688 9.147049 
1 1 1   19    3   63 o   39.878   3.1594   67.165   10.186   58.166   16.908   72.292   12.762   35.500   6.0600   41.036   3.8607 -5.535587 7.185302 
1 1 1   19    3   64 o   9.0571   4.3416 -11.6591   9.1989  -7.9178   15.595 -13.6554   11.392   13.355   6.1597   10.127   4.8484 3.227919 7.838930 
1 1 1   19    3   65 o   75.840   2.1880  238.280   13.512  255.277   22.344  228.481   16.966   77.492   3.5467   73.866   2.8229 3.625931 4.532981 
1 1 1   19    3   66 o   20.272   5.6141   19.166   9.5947   20.162   16.189   18.627   11.912   20.803   7.4845   19.928   6.4374 0.8752842 9.872042 
1 1 1   19    3   67 o   41.673   2.9675   73.309   10.014   80.923   15.366   67.687   13.204   42.898   4.4591   39.379   4.1770 3.518715 6.109936 
1 1 1   19    3   68 o   48.228   2.6737   97.582   10.470  102.226   15.766   93.920   14.003   48.511   4.0232   46.703   3.7086 1.807289 5.471770 
1 1 1   19    3   69 o   46.252   2.8012   90.151   10.512  110.247   15.777   74.110   14.096   50.439   3.8667   41.031   4.2772 9.407936 5.765905 
1 1 1   19    3   70 o   48.159   3.1252   98.655   12.202   95.960   19.148  100.499   15.834   45.847   5.2162   47.906   4.0940 -2.058849 6.630921 
1 1 1   19    3   71 o   15.211   5.8838   8.7678   10.375   15.962   17.090   4.5693   13.056   19.071   7.5011   14.739   6.2537 4.332126 9.765985 
1 1 1   19    3   72 o   13.663   5.6458   4.8475   10.221   10.008   17.000   1.9258   12.792   17.296   7.2249   13.860   6.0375 3.435091 9.415471 
1 1 1   19    3   73 o   28.211   4.8992   36.821   10.858   18.794   17.270   48.604   13.962   19.685   7.5975   31.986   5.5565 -12.30064 9.412575 
1 1 1   19    3   74 o   14.303   5.7093   7.1429   10.038   27.621   16.543  -4.7917   12.629   22.524   7.5994   12.123   5.5737 10.40093 9.424339 
1 1 1   19    3   75 o   9.9291   4.6192  -5.7764   9.0587   4.4812   13.227 -14.8382   12.432   14.499   6.2267   10.255   4.9491 4.243742 7.953956 
1 1 1   19    3   76 o   16.775   6.2485   13.018   11.435   10.671   13.445   19.156   21.742   16.297   6.5721   19.728   8.2003 -3.431637 10.50894 
1 1 1   19    3   77 o   20.989   6.2016   22.712   11.346   16.582   13.323   38.894   21.647   18.219   6.7526   24.927   8.6841 -6.707531 11.00046 
1 1 1   19    3   78 o   21.257   6.1437   23.472   11.243   32.424   13.360   1.7469   20.813   24.727   6.5321   15.837   7.2340 8.890516 9.746734 
1 1 1   19    3   79 o   10.709   4.8575  -2.2699   9.1788  -1.4482   12.966  -3.0953   12.995   12.696   5.7644   12.363   5.6732 0.3321590 8.087831 
1 1 1   19    3   80 o   19.858   5.6448   20.195   9.5675   18.380   13.496   22.030   13.565   18.506   6.8073   19.909   6.8778 -1.402668 9.676956 
1 1 1   19    3   81 f   16.148   5.9645   12.750   10.379 -14.8237   15.802   33.670   13.764   11.546   5.5742   24.715   6.6758 -13.16861 8.697076 
1 1 1   19    3   82 o   18.790   6.0622   18.758   10.566   15.561   16.276   21.087   13.892   17.521   7.1696   19.329   6.9357 -1.808271 9.975337 
1 1 1   19    3   83 o   9.3176   4.5174 -13.1683   10.660 -13.5233   13.383 -12.5521   17.632   10.632   5.1321   12.449   5.9788 -1.816867 7.879355 
1 1 1   19    3   84 o   11.126   5.4138 -17.1717   15.683 -17.1717   15.683   0.0000   0.0000   11.126   5.4138  ?   ?  0.000000 5.413755 
1 1 1   19    3   85 o   19.344   8.1358   23.293   21.783   23.293   21.783   0.0000   0.0000   19.344   8.1358  ?   ?  0.000000 8.135804 
1 1 1   19    3   86 o   16.024   7.3226   6.6848   21.352   6.6848   21.352   0.0000   0.0000   16.024   7.3226  ?   ?  0.000000 7.322575 
1 1 1   19    3   87 o   19.339   6.7016   21.619   12.883   21.619   12.883   0.0000   0.0000   19.339   6.7016  ?   ?  0.000000 6.701573 
1 1 1   19    3   88 o   14.711   6.2555   8.2285   13.112   8.2285   13.112   0.0000   0.0000   14.711   6.2555  ?   ?  0.000000 6.255502 
1 1 1   19    3   89 o   14.572   6.2101   7.9867   12.972   7.9867   12.972   0.0000   0.0000   14.572   6.2101  ?   ?  0.000000 6.210083 
1 1 1   19    3   90 o   14.579   6.0222   9.0637   11.625   9.0637   11.625   0.0000   0.0000   14.579   6.0222  ?   ?  0.000000 6.022154 
1 1 1   19    3   91 o   24.450   7.2587   37.015   15.514   37.015   15.514   0.0000   0.0000   24.450   7.2587  ?   ?  0.000000 7.258674 
1 1 1   19    3   92 o   24.896   8.0132   42.263   18.469   20.324   24.971   68.758   27.442   18.138   8.1384   28.370   9.7831 -10.23224 12.72570 
1 1 1   19    3   93 o   17.195   7.2495   16.911   17.362 -12.9668   23.812   50.826   25.370   13.682   6.6603   24.338   9.2544 -10.65618 11.40197 
1 1 1   19    3   94 o   16.470   7.1145   14.121   17.460   4.8592   24.087   24.377   25.346   15.652   7.3620   18.608   8.2847 -2.956399 11.08310 
1 1 1   19    3   95 o   11.632   5.6542 -14.2361   16.990 -18.9556   23.951  -9.4553   24.106   13.081   6.4327   13.986   6.7839 -0.9049578 9.348866 
1 1 1   19    3   96 o   11.155   5.4603 -17.4991   16.649 -38.2312   23.421   3.6772   23.671   11.526   5.7793   15.389   7.2569 -3.862889 9.277043 
1 1 1   19    3   97 o   12.209   5.8846 -10.7589   17.435  -9.0733   24.509 -12.4858   24.808   14.136   6.8525   13.869   6.7620 0.2663641 9.627132 
1 1 1   19    4  -94 o   11.660   5.8493 -39.0690   24.145 -39.0690   24.145   0.0000   0.0000   11.660   5.8493  ?   ?  0.000000 5.849257 
1 1 1   19    4  -93 o   16.165   7.5703   9.0001   24.995   9.0001   24.995   0.0000   0.0000   16.165   7.5703  ?   ?  0.000000 7.570262 
1 1 1   19    4  -92 o   13.891   6.7683 -11.2810   24.740 -11.2810   24.740   0.0000   0.0000   13.891   6.7683  ?   ?  0.000000 6.768337 
1 1 1   19    4  -91 o   13.191   6.4859 -18.4319   24.326 -18.4319   24.326   0.0000   0.0000   13.191   6.4859  ?   ?  0.000000 6.485935 
1 1 1   19    4  -90 o   16.283   7.6160   8.9680   25.163   8.9680   25.163   0.0000   0.0000   16.283   7.6160  ?   ?  0.000000 7.615954 
1 1 1   19    4  -89 o   17.088   7.8843   13.994   25.583   13.994   25.583   0.0000   0.0000   17.088   7.8843  ?   ?  0.000000 7.884300 
1 1 1   19    4  -88 o   16.611   7.7387   10.027   25.565   10.027   25.565   0.0000   0.0000   16.611   7.7387  ?   ?  0.000000 7.738716 
1 1 1   19    4  -87 f   18.176   8.1617   20.376   25.167   20.376   25.167   0.0000   0.0000   18.176   8.1617  ?   ?  0.000000 8.161675 
1 1 1   19    4  -86 o   12.425   6.1847 -32.2859   24.729 -32.2859   24.729   0.0000   0.0000   12.425   6.1847  ?   ?  0.000000 6.184688 
1 1 1   19    4  -85 o   19.354   8.4206   25.952   24.821   25.952   24.821   0.0000   0.0000   19.354   8.4206  ?   ?  0.000000 8.420560 
1 1 1   19    4  -84 o   16.307   7.5884   6.5575   24.474   6.5575   24.474   0.0000   0.0000   16.307   7.5884  ?   ?  0.000000 7.588389 
1 1 1   19    4  -83 o   16.228   7.6240   4.3133   25.697   4.3133   25.697   0.0000   0.0000   16.228   7.6240  ?   ?  0.000000 7.623960 
1 1 1   19    4  -82 o   17.121   7.8257   11.308   24.407   11.308   24.407   0.0000   0.0000   17.121   7.8257  ?   ?  0.000000 7.825695 
1 1 1   19    4  -81 o   13.924   6.4573  -1.3115   17.490  -1.3115   17.490   0.0000   0.0000   13.924   6.4573  ?   ?  0.000000 6.457276 
1 1 1   19    4  -80 o   29.363   7.9100   53.264   19.355   53.264   19.355   0.0000   0.0000   29.363   7.9100  ?   ?  0.000000 7.909984 
1 1 1   19    4  -79 o   15.591   6.9092   7.2304   17.423   7.2304   17.423   0.0000   0.0000   15.591   6.9092  ?   ?  0.000000 6.909230 
1 1 1   19    4  -78 o   18.850   7.0434   20.030   14.552   26.941   17.343   3.5903   26.750   20.887   7.7110   16.701   7.8246 4.185823 10.98563 
1 1 1   19    4  -77 o   14.408   5.8382   8.1909   10.667   7.5132   17.240   8.6113   13.578   15.737   6.9275   15.220   6.4136 0.5165691 9.440549 
1 1 1   19    4  -76 o   14.508   5.8649   8.2975   10.736   11.492   17.237   6.2725   13.724   16.712   7.1413   14.680   6.3240 2.032425 9.538906 
1 1 1   19    4  -75 o   19.930   6.1410   20.889   10.960   35.214   18.179   12.710   13.737   23.980   7.9646   16.640   6.6665 7.340208 10.38638 
1 1 1   19    4  -74 o   12.286   5.4053   1.0947   10.481   2.1608   16.527   0.3775   13.555   14.726   6.6132   13.365   5.9966 1.360987 8.927145 
1 1 1   19    4  -73 f   11.162   5.1027  -3.3734   10.383  -5.2024   16.878  -2.2599   13.170   13.598   6.3191   12.717   5.7880 0.8808680 8.569253 
1 1 1   19    4  -72 o   8.4238   4.1733 -21.4867   10.755 -40.4878   19.803 -13.5368   12.809   10.867   5.4288   10.588   5.0879 0.2791595 7.440353 
1 1 1   19    4  -71 o   22.705   4.8695   24.349   8.7421   32.924   11.588   13.020   13.319   25.935   5.6420   17.075   6.6495 8.860388 8.720493 
1 1 1   19    4  -70 o   9.9835   4.7169  -8.6010   10.089   2.0114   16.264 -15.2390   12.863   14.954   6.6484   10.433   5.0349 4.520614 8.339762 
1 1 1   19    4  -69 o   16.392   5.9321   12.136   10.188  -1.5297   16.862   19.991   12.785   14.524   6.5862   19.889   6.6807 -5.365491 9.381330 
1 1 1   19    4  -68 o   13.106   5.2540   5.3293   8.5380   2.8223   11.598   8.2953   12.615   13.561   5.8275   15.584   6.3365 -2.023590 8.608761 
1 1 1   19    4  -67 o   8.3215   4.0213 -11.5582   8.2733 -13.2143   11.171  -9.5460   12.313   9.9026   4.7567   11.158   5.2530 -1.255234 7.086641 
1 1 1   19    4  -66 o   48.218   2.5454   97.634   9.9694   76.592   13.429  123.470   14.880   41.799   3.9896   53.620   3.4223 -11.82078 5.256334 
1 1 1   19    4  -65 o   32.719   3.4706   46.200   9.1154   47.615   12.417   44.545   13.424   32.410   4.8487   30.875   5.5374 1.535316 7.360201 
1 1 1   19    4  -64 o   16.535   5.4112   12.358   8.4025   14.788   11.055   9.0327   12.930   17.985   6.2091   16.178   6.4724 1.806664 8.969046 
1 1 1   19    4  -63 o   31.135   3.5068   41.756   8.7456   40.088   12.084   43.591   12.673   29.597   5.1983   30.874   5.2218 -1.276987 7.368151 
1 1 1   19    4  -62 o   61.413   2.1122  156.335   10.558  135.333   14.296  181.531   15.659   56.580   3.1117   65.681   2.9321 -9.101162 4.275533 
1 1 1   19    4  -61 o   39.413   2.8308   65.366   9.0342   74.977   12.254   53.921   13.372   41.815   3.6310   34.738   4.8546 7.077061 6.062310 
1 1 1   19    4  -60 o   14.875   5.1169   9.3073   7.5056  -0.9017   11.175   17.699   10.131   12.638   5.5698   19.509   5.8832 -6.871295 8.101538 
1 1 1   19    4  -59 o   27.761   4.1470   33.735   9.0971   22.135   11.506   53.080   14.858   21.646   6.2023   34.143   5.5275 -12.49667 8.307930 
1 1 1   19    4  -58 o   39.965   2.9176   67.147   9.4392   81.745   13.443   52.951   13.257   43.662   3.8154   34.547   4.8402 9.115105 6.163194 
1 1 1   19    4  -57 o   45.889   2.3334   87.459   8.6997   73.859   12.674   99.575   11.963   41.527   3.7858   48.668   3.0305 -7.141331 4.849345 
1 1 1   19    4  -56 o   52.461   2.1104  113.830   9.0061  114.905   13.209  112.896   12.311   52.264   3.1147   51.900   2.9218 0.3638077 4.270687 
1 1 1   19    4  -55 o   40.111   2.5591   67.073   8.3236   68.641   12.350   65.767   11.267   40.036   3.8310   39.314   3.5542 0.7220917 5.225779 
1 1 1   19    4  -54 o   32.361   3.0260   44.136   7.8897   47.155   11.676   41.600   10.703   32.847   4.4770   30.868   4.3763 1.979061 6.260640 
1 1 1   19    4  -53 o   48.000   2.2560   95.416   8.8024   95.135   13.105   95.647   11.881   47.453   3.4108   47.740   3.0694 -0.2873993 4.588558 
1 1 1   19    4  -52 o   18.339   5.1038   15.120   7.9083   26.831   11.425   4.3480   10.957   24.139   5.8651   14.245   5.8617 9.893727 8.292119 
1 1 1   19    4  -51 o   40.711   2.4909   68.872   8.2264   69.206   12.324   68.603   11.048   40.307   3.7957   40.303   3.3943 0.4043579E-02 5.091972 
1 1 1   19    4  -50 o   28.724   3.8358   35.399   8.7570   24.337   13.432   43.577   11.549   22.850   6.7467   31.590   4.6216 -8.739866 8.177832 
1 1 1   19    4  -49 o   12.687   5.1451   3.5831   8.2919  -0.6106   12.956   6.4927   10.792   13.832   6.0497   14.986   5.9399 -1.153197 8.478280 
1 1 1   19    4  -48 o   10.536   4.7025  -2.5729   8.2190   13.377   12.602 -14.3780   10.842   18.226   6.5974   9.7698   4.6912 8.455772 8.095247 
1 1 1   19    4  -47 o   12.525   5.0070   3.8700   7.7322   0.9103   12.663   5.6293   9.7636   14.130   6.0809   14.253   5.6498 -0.1232738 8.300426 
1 1 1   19    4  -46 o   22.427   4.3013   21.960   7.5774   16.886   11.590   25.748   10.014   19.589   6.3514   24.005   5.2631 -4.416046 8.248679 
1 1 1   19    4  -45 o   21.120   4.8814   19.794   8.2353   8.7064   14.487   25.087   10.010   17.230   6.8650   23.690   5.3147 -6.460224 8.681845 
1 1 1   19    4  -44 o   33.922   2.9615   48.087   8.1071   57.644   12.549   41.241   10.621   36.705   4.2740   30.956   4.3271 5.749048 6.082005 
1 1 1   19    4  -43 o   32.127   3.5493   43.601   9.1402   19.888   18.994   50.747   10.427   21.976   8.0771   34.619   3.7550 -12.64236 8.907305 
1 1 1   19    4  -42 o   48.564   2.5576   97.594   10.089  112.906   20.855   92.915   11.528   51.170   5.0664   47.245   3.0089 3.924801 5.892516 
1 1 1   19    4  -41 o   72.324   2.0717  215.058   12.201  202.421   24.571  219.194   14.056   69.129   4.3829   72.920   2.3679 -3.790840 4.981688 
1 1 1   19    4  -40 o   26.763   3.8965   30.555   8.2510   28.916   14.009   31.426   10.210   25.185   6.7052   26.846   4.8438 -1.660395 8.271795 
1 1 1   19    4  -39 o   28.230   3.9151   33.917   8.7671   25.633   14.155   39.071   11.167   23.790   6.8989   30.074   4.7095 -6.284060 8.353154 
1 1 1   19    4  -38 o   10.037   4.5145  -3.3444   7.7363  -2.0415   12.890  -4.0779   9.6720   13.632   5.9959   11.199   5.0418 2.432329 7.833923 
1 1 1   19    4  -37 o   56.423   2.1225  130.870   9.7447  115.927   16.075  139.552   12.253   52.609   3.7736   58.146   2.5916 -5.537838 4.577804 
1 1 1   19    4  -36 o   16.976   5.1648   12.352   7.7837   9.4319   13.192   13.911   9.6408   17.232   6.6430   18.102   5.7858 -0.8703136 8.809359 
1 1 1   19    4  -35 o   93.803   1.6935  360.171   12.949  350.506   21.050  366.055   16.425   92.149   2.8056   94.447   2.1334 -2.297279 3.524581 
1 1 1   19    4  -34 o   14.296   5.1680   7.3941   7.7298   12.990   13.327   4.5571   9.4890   18.608   6.7774   13.879   5.5473 4.728529 8.758214 
1 1 1   19    4  -33 o   38.291   2.8865   60.794   8.9433   67.805   16.747   57.996   10.578   39.696   5.3083   37.238   3.5269 2.458118 6.373121 
1 1 1   19    4  -32 o   26.356   4.0458   29.567   8.4148   4.9733   15.483   39.876   10.024   16.814   6.9483   30.672   4.1131 -13.85721 8.074420 
1 1 1   19    4  -31 o   16.827   5.3726   11.829   8.3144   17.011   15.308   9.6599   9.9025   20.668   7.2948   16.214   5.8510 4.454065 9.351369 
1 1 1   19    4  -30 o   65.799   1.8476  177.374   9.9002  171.225   14.714  182.459   13.382   64.430   2.8084   66.603   2.4692 -2.172447 3.739512 
1 1 1   19    4  -29 o   44.405   2.5843   81.300   9.3139   87.025   13.083   75.417   13.262   45.723   3.5378   42.454   3.8750 3.268360 5.247063 
1 1 1   19    4  -28 o   74.199   1.7538  225.226   10.607  207.528   15.524  240.725   14.528   70.997   2.6873   76.566   2.3304 -5.568871 3.557022 
1 1 1   19    4  -27 o   94.376   2.0430  364.805   15.717  367.621   18.021  355.853   32.127   94.668   2.3352   92.354   4.2791 2.314209 4.874859 
1 1 1   19    4  -26 o   16.414   5.5752   10.669   8.9043   12.644   11.583   7.8172   13.922   18.093   6.3489   17.116   6.7585 0.9769459 9.272860 
1 1 1   19    4  -25 o   44.265   2.7809   80.863   9.9836   70.204   12.690   98.172   16.172   40.994   3.8425   48.450   4.1343 -7.456139 5.644227 
1 1 1   19    4  -24 o   44.588   2.7928   82.031   10.100   85.737   13.025   76.442   15.994   45.421   3.5460   42.560   4.6878 2.860573 5.877847 
1 1 1   19    4  -23 o   25.141   4.7332   27.181   9.3443   27.554   11.936   26.592   15.018   25.056   5.9359   24.575   7.0999 0.4805641 9.254418 
1 1 1   19    4  -22 o   23.308   4.9548   23.523   9.1237   0.0576   14.219   39.945   11.895   15.031   6.4557   30.560   4.9439 -15.52907 8.131327 
1 1 1   19    4  -21 o   68.425   1.9321  191.700   10.766  176.478   15.072  207.555   15.382   65.476   2.8306   71.057   2.6604 -5.580750 3.884607 
1 1 1   19    4  -20 o   33.480   3.1793   46.547   8.5726   39.371   12.414   53.088   11.852   30.276   5.2186   35.554   4.1687 -5.277979 6.679228 
1 1 1   19    4  -19 o   69.192   1.8333  195.902   10.331  204.751   15.574  188.948   13.806   70.574   2.7122   67.836   2.5010 2.738441 3.689263 
1 1 1   19    4  -18 o   80.305   1.7175  263.586   11.243  274.220   17.003  255.324   14.986   81.731   2.5554   78.909   2.3325 2.821434 3.459790 
1 1 1   19    4  -17 o   32.965   3.4086   45.235   9.0274   56.709   13.168   35.061   12.400   36.697   4.4959   28.469   5.5428 8.227737 7.136913 
1 1 1   19    4  -16 o   74.731   1.7923  228.296   10.918  229.659   16.432  227.219   14.609   74.766   2.7007   74.427   2.4111 0.3386383 3.620400 
1 1 1   19    4  -15 o  128.362   1.6809  673.272   17.588  662.600   23.910  685.858   25.964  127.197   2.3060  129.366   2.4622 -2.169563 3.373443 
1 1 1   19    4  -14 o   50.775   2.6068  105.989   10.753  110.599   16.528  102.606   14.160   51.586   3.9608   49.781   3.5120 1.804905 5.293587 
1 1 1   19    4  -13 o   45.129   2.7279   83.854   9.9882   75.063   14.259   92.322   13.995   42.392   4.1808   47.176   3.6682 -4.783943 5.561897 
1 1 1   19    4  -12 f   54.393   2.3835  121.416   10.543  118.935   14.854  123.934   14.966   53.641   3.4148   54.771   3.3683 -1.130188 4.796493 
1 1 1   19    4  -11 o   41.209   2.9618   70.089   9.8825   71.965   13.947   68.198   14.005   41.507   4.1791   40.360   4.3242 1.146599 6.013575 
1 1 1   19    4  -10 o   46.992   2.8013   90.926   10.682   92.437   15.922   89.688   14.405   47.091   4.1915   46.464   3.8374 0.6269608 5.682798 
1 1 1   19    4   -9 o  171.955   1.8580  1208.68   26.043  1176.48   37.086  1240.01   36.580  169.378   2.6861  173.932   2.5800 -4.554138 3.724481 
1 1 1   19    4   -8 o   94.964   1.9127  368.696   14.806  382.534   21.847  356.940   20.135   96.525   2.7795   93.268   2.6511 3.256821 3.841100 
1 1 1   19    4   -7 o   25.676   4.4428   28.059   8.9623   23.085   14.944   30.853   11.200   23.245   7.1722   26.752   5.3234 -3.507185 8.931949 
1 1 1   19    4   -6 o   9.5058   4.4315  -7.7014   8.4060   2.9016   13.882 -13.8402   10.563   15.708   6.5427   9.8502   4.7029 5.857335 8.057553 
1 1 1   19    4   -5 o   53.239   2.5989  116.442   11.245  137.196   21.422  108.549   13.211   57.335   4.6227   51.297   3.1750 6.038319 5.608023 
1 1 1   19    4   -4 o  143.929   1.8305  846.660   21.477  847.528   38.808  846.276   25.785  143.550   3.3165  143.808   2.1996 -0.2582703 3.979655 
1 1 1   19    4   -3 o  117.744   1.8304  566.606   17.568  558.985   32.052  569.878   21.004  116.515   3.3783  118.014   2.1834 -1.498909 4.022474 
1 1 1   19    4   -2 o   10.007   4.6538  -8.0603   9.1826   4.2325   18.439 -12.1145   10.589   18.096   7.5393   10.178   4.8158 7.918392 8.946095 
1 1 1   19    4   -1 o   23.801   4.8186   24.338   9.0275   32.775   14.978   19.524   11.313   27.325   6.7615   21.309   6.1640 6.016150 9.149472 
1 1 1   19    4    0 o   38.057   3.2134   59.943   9.8756   67.279   17.860   56.712   11.852   39.740   5.6745   36.851   4.0102 2.888779 6.948493 
1 1 1   19    4    1 o   51.094   2.5840  107.252   10.727  112.784   19.367  104.804   12.884   51.956   4.6211   50.408   3.1513 1.548016 5.593346 
1 1 1   19    4    2 o   86.684   1.9333  307.201   13.661  323.266   24.437  299.898   16.476   88.577   3.3908   85.550   2.3649 3.026749 4.133986 
1 1 1   19    4    3 o   25.615   4.7091   28.046   9.4704   15.466   17.229   33.493   11.337   20.902   7.6910   27.942   5.1676 -7.039749 9.265775 
1 1 1   19    4    4 o   54.451   2.4950  121.718   11.045  141.407   20.415  113.570   13.133   58.299   4.3266   52.493   3.0828 5.806461 5.312589 
1 1 1   19    4    5 o   75.817   2.0606  235.279   12.723  269.644   23.266  220.617   15.197   80.842   3.5391   73.332   2.5461 7.510757 4.359852 
1 1 1   19    4    6 o   34.673   3.4247   49.945   9.5532   41.197   15.942   54.846   11.933   30.700   6.5689   36.205   4.1164 -5.505100 7.752124 
1 1 1   19    4    7 o   18.338   5.9953   13.684   10.315   38.875   19.896   4.4236   12.063   29.585   8.0412   15.283   6.2029 14.30202 10.15561 
1 1 1   19    4    8 o   55.812   2.5442  127.913   11.544  103.149   22.246  137.039   13.505   49.356   5.6299   57.713   2.8797 -8.356495 6.323698 
1 1 1   19    4    9 o   58.943   2.4318  142.557   11.659  130.784   22.464  146.897   13.640   55.850   4.9868   59.770   2.8075 -3.919933 5.722818 
1 1 1   19    4   10 o   48.963   2.7541   98.652   10.948  100.650   21.631   97.964   12.694   48.767   5.5395   48.707   3.2151 0.5979538E-01 6.404942 
1 1 1   19    4   11 o   34.470   3.3638   49.351   9.3314   52.884   15.382   47.293   11.738   35.162   5.5506   33.511   4.4035 1.650597 7.085199 
1 1 1   19    4   12 f   56.282   2.2830  129.906   10.452  128.943   17.318  130.458   13.109   55.762   3.8332   56.302   2.8658 -0.5402832 4.786046 
1 1 1   19    4   13 o   89.160   1.8047  324.940   13.116  361.519   21.539  303.381   16.536   93.809   2.8200   86.032   2.3602 7.777191 3.677308 
1 1 1   19    4   14 o   56.061   2.5239  129.078   11.504  163.771   17.216  101.089   15.464   62.983   3.3655   49.325   3.8771 13.65810 5.134069 
1 1 1   19    4   15 o   26.638   4.7926   30.369   10.024   14.393   14.929   43.484   13.527   19.833   7.1805   31.837   5.4052 -12.00395 8.987544 
1 1 1   19    4   16 o   50.638   2.9122  105.669   11.970  109.522   16.512  101.400   17.379   51.317   3.9783   49.262   4.3732 2.054760 5.912038 
1 1 1   19    4   17 o   22.310   5.1537   21.592   9.1839   37.013   14.873   12.088   11.676   29.041   6.4504   17.960   6.3680 11.08089 9.064141 
1 1 1   19    4   18 o   61.439   2.2424  154.791   11.212  144.807   17.402  161.875   14.659   59.128   3.6281   62.709   2.8755 -3.581478 4.629401 
1 1 1   19    4   19 o   41.692   2.9009   71.762   9.7973   84.345   15.874   64.020   12.452   44.868   4.3966   39.145   3.9565 5.722759 5.914733 
1 1 1   19    4   20 o   82.223   1.9507  276.594   13.075  278.968   19.970  274.812   17.297   82.316   2.9811   81.798   2.5975 0.5172195 3.953929 
1 1 1   19    4   21 o   76.738   2.0132  241.166   12.582  225.726   18.934  253.377   16.838   73.982   3.1468   78.526   2.6342 -4.543312 4.103839 
1 1 1   19    4   22 o   79.739   1.9791  260.206   12.864  268.008   19.565  254.266   17.073   80.664   2.9807   78.649   2.6669 2.015175 3.999597 
1 1 1   19    4   23 o   70.865   2.0611  205.774   11.893  214.570   18.261  199.295   15.673   72.120   3.1135   69.589   2.7685 2.530739 4.166346 
1 1 1   19    4   24 o   75.185   1.9992  231.560   12.241  218.660   18.424  241.756   16.380   72.796   3.1119   76.684   2.6242 -3.888100 4.070722 
1 1 1   19    4   25 o   24.074   5.2449   25.234   10.001   32.792   18.824   22.261   11.805   27.093   7.9834   22.526   6.2228 4.566235 10.12216 
1 1 1   19    4   26 o   13.617   5.3700   4.6711   8.7790   17.898   14.116  -3.6714   11.211   20.851   7.0199   12.372   5.5090 8.479044 8.923464 
1 1 1   19    4   27 o   26.722   4.3373   30.457   9.1241   13.283   14.188   42.569   11.915   19.087   6.9865   31.570   4.7793 -12.48267 8.464789 
1 1 1   19    4   28 o   86.229   1.9179  304.403   13.481  293.138   20.121  313.578   18.159   84.320   2.9319   87.333   2.5536 -3.013588 3.888049 
1 1 1   19    4   29 o   57.843   2.3203  137.498   10.918  125.709   16.433  146.814   14.609   54.955   3.6898   59.607   3.0165 -4.652260 4.765879 
1 1 1   19    4   30 o   11.828   5.1377  -0.9809   9.2078 -13.5859   13.587   9.7239   12.521   11.733   5.5222   17.191   6.5098 -5.457650 8.536507 
1 1 1   19    4   31 o   76.670   2.1479  241.238   13.410  225.305   18.240  259.985   19.785   73.838   3.0368   79.316   3.0659 -5.477745 4.315318 
1 1 1   19    4   32 o   62.175   2.3682  158.997   11.981  163.848   16.680  153.827   17.219   62.864   3.2662   60.834   3.4871 2.030315 4.777826 
1 1 1   19    4   33 o   53.394   4.5330  120.352   19.543  120.352   19.543   0.0000   0.0000   53.394   4.5330  ?   ?  0.000000 4.532954 
1 1 1   19    4   34 o   19.751   6.2268   16.775   11.199   9.9325   16.680   22.390   15.111   18.649   7.3870   22.631   7.2448 -3.982639 10.34673 
1 1 1   19    4   35 o   60.050   2.7694  148.974   13.519  124.360   19.975  169.779   18.365   54.222   4.5617   63.848   3.5425 -9.626827 5.775659 
1 1 1   19    4   36 o   9.3147   4.4872 -14.7126   10.108  -6.4974   16.043 -20.1208   13.016   14.304   6.4613   10.355   5.0136 3.948785 8.178323 
1 1 1   19    4   37 o   37.264   3.5477   58.225   10.647   42.070   14.650   76.307   15.499   30.776   6.0555   42.349   4.5616 -11.57232 7.581355 
1 1 1   19    4   38 o   43.602   3.1213   79.122   11.021   70.474   15.107   88.959   16.112   40.625   4.6454   45.810   4.3675 -5.184986 6.376078 
1 1 1   19    4   39 o   54.155   2.9546  121.674   12.993   94.415   19.158  144.895   17.682   46.853   5.0983   58.823   3.7064 -11.97002 6.303170 
1 1 1   19    4   40 o   38.811   2.9903   62.728   9.3876   66.967   14.779   59.861   12.155   39.525   4.6776   37.584   4.0302 1.940609 6.174346 
1 1 1   19    4   41 o   11.364   4.9395  -0.7520   8.5235   4.0682   13.785  -3.7354   10.845   15.655   6.5202   12.000   5.3756 3.654463 8.450482 
1 1 1   19    4   42 o   28.267   4.0553   34.205   9.0767   14.539   14.333   47.372   11.728   19.245   7.0256   33.207   4.4442 -13.96210 8.313289 
1 1 1   19    4   43 o   30.683   3.6757   39.912   9.0105   42.572   14.229   38.131   11.642   30.855   5.8719   29.506   5.0200 1.348783 7.725234 
1 1 1   19    4   44 o   22.294   5.1195   22.120   9.1071   29.032   15.902   18.747   11.109   24.981   7.3314   20.464   6.1585 4.517181 9.574767 
1 1 1   19    4   45 o   39.817   2.9540   66.151   9.5194   68.655   15.025   64.471   12.304   39.879   4.7131   38.964   3.9274 0.9152565 6.134964 
1 1 1   19    4   46 o   27.264   4.1068   32.020   8.8439   53.660   14.482   19.150   11.168   34.937   5.2470   20.616   6.1680 14.32074 8.097892 
1 1 1   19    4   47 o   21.358   5.1284   20.415   8.8156   9.8137   14.006   27.371   11.345   17.370   6.8030   24.567   5.7649 -7.196804 8.917090 
1 1 1   19    4   48 o   25.288   5.0235   28.413   9.9899 -18.5224   18.905   46.596   11.767   13.464   6.3895   32.777   4.5246 -19.31274 7.829344 
1 1 1   19    4   49 o   15.389   6.1789   6.4316   11.828   24.975   18.098  -7.3938   15.627   23.255   7.9473   13.671   6.2537 9.583424 10.11280 
1 1 1   19    4   50 o   48.443   3.4323   98.899   13.466  105.965   20.420   93.462   17.912   49.159   5.1732   46.363   4.8093 2.795578 7.063419 
1 1 1   19    4   51 o   72.341   2.3823  216.634   14.029  217.862   18.707  215.057   21.207   72.107   3.1906   71.335   3.6593 0.7719040 4.854889 
1 1 1   19    4   52 o   45.152   2.7817   85.100   10.189   75.955   15.295   92.396   13.661   41.824   4.5600   46.683   3.6182 -4.858509 5.821115 
1 1 1   19    4   53 o   20.638   5.3613   19.398   9.0995   22.254   14.073   17.346   11.928   21.834   6.9918   19.616   6.4489 2.217693 9.511757 
1 1 1   19    4   54 o   30.112   3.9381   39.133   9.4350   49.359   15.060   32.527   12.105   32.893   5.8302   26.611   5.7487 6.282602 8.187697 
1 1 1   19    4   55 o   58.200   2.3627  140.512   11.186  140.804   17.040  140.291   14.827   57.572   3.6499   57.759   3.1613 -0.1868057 4.828613 
1 1 1   19    4   56 o   25.813   4.5655   29.529   9.2550   19.117   14.285   37.062   12.150   20.468   7.0584   28.568   5.4156 -8.100405 8.896552 
1 1 1   19    4   57 o   10.723   4.8326  -3.2601   8.9126 -13.1490   14.134   3.2673   11.483   11.768   5.5670   14.047   5.9075 -2.278281 8.117246 
1 1 1   19    4   58 o   14.323   5.5305   6.9221   9.1540   10.117   14.286   4.6966   11.923   17.211   6.8304   14.663   6.0818 2.548774 9.145620 
1 1 1   19    4   59 o   34.182   3.7636   50.295   10.313   71.075   17.466   39.172   12.779   39.566   5.5694   29.215   5.5692 10.35111 7.876181 
1 1 1   19    4   60 o   23.244   5.0702   24.657   9.3355   20.964   14.367   27.356   12.282   21.027   7.0820   23.968   6.2298 -2.940361 9.432143 
1 1 1   19    4   61 o   14.527   5.5163   7.6990   9.0061   9.5304   13.867   6.3628   11.844   16.774   6.7054   15.074   6.1358 1.699650 9.089021 
1 1 1   19    4   62 o   31.752   3.7923   43.698   9.6214   64.774   15.410   30.234   12.317   37.893   5.1199   25.197   6.0693 12.69585 7.940423 
1 1 1   19    4   63 o   51.369   2.5184  110.331   10.513  102.701   15.949  116.194   13.981   48.589   4.0639   52.255   3.2991 -3.665749 5.234439 
1 1 1   19    4   64 o   14.031   5.4898   6.6553   9.1132   3.5801   13.904   8.9713   12.066   14.908   6.3931   15.901   6.2878 -0.9930792 8.967057 
1 1 1   19    4   65 o   12.149   5.3561  -0.5478   10.342 -14.8172   16.015   9.6617   13.546   12.217   5.8211   16.494   6.6159 -4.277779 8.812235 
1 1 1   19    4   66 o   23.515   5.7123   26.526   10.840   23.927   16.931   28.331   14.111   21.633   7.6684   23.609   6.9000 -1.975861 10.31569 
1 1 1   19    4   67 o   22.720   5.8093   25.041   10.800   21.326   16.826   27.643   14.083   20.635   7.5991   23.221   6.9214 -2.585854 10.27875 
1 1 1   19    4   68 o   19.699   6.1475   19.115   10.944  -4.4651   16.693   36.890   14.493   13.994   6.4246   26.969   6.6380 -12.97487 9.237885 
1 1 1   19    4   69 o   37.822   3.8847   63.139   11.807   71.525   18.224   57.074   15.499   38.372   6.0244   34.498   5.7113 3.874680 8.301401 
1 1 1   19    4   70 o   11.973   5.3014  -0.2828   10.237   22.218   16.061 -15.6771   13.285   20.536   7.4460   10.587   5.1109 9.948964 9.031287 
1 1 1   19    4   71 o   10.202   4.8007  -7.8584   10.262  -1.0502   15.589 -13.0650   13.633   14.022   6.3484   11.099   5.3112 2.922833 8.277086 
1 1 1   19    4   72 o   28.185   5.0224   37.605   11.116   38.189   16.427   37.113   15.097   26.277   7.3716   26.330   6.9379 -0.5274773E-01 10.12298 
1 1 1   19    4   73 f   14.959   5.8655   9.1112   10.422   20.568   15.572  -0.1840   14.027   19.618   7.2948   13.501   6.0754 6.117097 9.493393 
1 1 1   19    4   74 o   13.177   5.5875   4.2153   10.411   5.8275   15.719   2.9554   13.896   15.292   6.6763   14.078   6.2076 1.213503 9.116336 
1 1 1   19    4   75 o   16.683   6.0571   13.712   10.633   27.937   15.913   2.2349   14.293   21.886   7.4526   13.961   6.2182 7.924683 9.706063 
1 1 1   19    4   76 o   14.780   5.9994   8.7022   11.287   14.764   13.434  -5.8432   20.811   17.173   6.6809   14.421   6.8016 2.752168 9.533939 
1 1 1   19    4   77 o   19.523   6.3846   20.704   11.698   20.240   13.739   21.927   22.306   19.067   6.8904   19.398   8.1998 -0.3310814 10.71044 
1 1 1   19    4   78 o   14.242   6.1813   5.4425   13.307   5.4425   13.307   0.0000   0.0000   14.242   6.1813  ?   ?  0.000000 6.181293 
1 1 1   19    4   79 o   21.121   6.5920   25.041   12.583   14.938   16.640   38.535   19.230   17.284   7.1783   24.209   8.1934 -6.924889 10.89306 
1 1 1   19    4   80 o   17.581   8.0416   12.007   25.834   12.007   25.834   0.0000   0.0000   17.581   8.0416  ?   ?  0.000000 8.041612 
1 1 1   19    4   81 o   12.791   6.3266 -28.7150   24.352 -28.7150   24.352   0.0000   0.0000   12.791   6.3266  ?   ?  0.000000 6.326602 
1 1 1   19    4   83 o   18.192   8.2519   18.026   26.493   18.026   26.493   0.0000   0.0000   18.192   8.2519  ?   ?  0.000000 8.251888 
1 1 1   19    4   84 o   16.455   7.7023   6.3701   25.816   6.3701   25.816   0.0000   0.0000   16.455   7.7023  ?   ?  0.000000 7.702284 
1 1 1   19    4   85 o   15.631   7.4011   1.0840   25.089   1.0840   25.089   0.0000   0.0000   15.631   7.4011  ?   ?  0.000000 7.401094 
1 1 1   19    4   86 o   15.324   7.2925  -0.8655   24.969  -0.8655   24.969   0.0000   0.0000   15.324   7.2925  ?   ?  0.000000 7.292511 
1 1 1   19    4   87 f   11.004   5.1496  -4.8395   11.529  -4.8395   11.529   0.0000   0.0000   11.004   5.1496  ?   ?  0.000000 5.149632 
1 1 1   19    4   88 o   10.511   4.9609  -6.3430   11.105  -6.3430   11.105   0.0000   0.0000   10.511   4.9609  ?   ?  0.000000 4.960879 
1 1 1   19    4   89 o   18.707   6.4569   20.448   11.955   20.448   11.955   0.0000   0.0000   18.707   6.4569  ?   ?  0.000000 6.456940 
1 1 1   19    4   90 o   9.7734   4.7928 -17.0674   13.010 -17.0674   13.010   0.0000   0.0000   9.7734   4.7928  ?   ?  0.000000 4.792837 
1 1 1   19    4   91 o   16.455   7.6718   10.850   25.203   10.850   25.203   0.0000   0.0000   16.455   7.6718  ?   ?  0.000000 7.671756 
1 1 1   19    4   92 o   17.847   8.0956   20.731   25.498   20.731   25.498   0.0000   0.0000   17.847   8.0956  ?   ?  0.000000 8.095635 
1 1 1   19    4   93 o   20.188   8.6347   34.022   25.243   34.022   25.243   0.0000   0.0000   20.188   8.6347  ?   ?  0.000000 8.634656 
1 1 1   19    5  -90 o   17.747   8.0526   20.382   25.252   20.382   25.252   0.0000   0.0000   17.747   8.0526  ?   ?  0.000000 8.052620 
1 1 1   19    5  -89 o   13.453   6.5529 -11.9493   23.139 -11.9493   23.139   0.0000   0.0000   13.453   6.5529  ?   ?  0.000000 6.552898 
1 1 1   19    5  -88 o   11.500   5.7539 -34.4384   22.635 -34.4384   22.635   0.0000   0.0000   11.500   5.7539  ?   ?  0.000000 5.753923 
1 1 1   19    5  -87 o   16.376   7.5789   11.472   23.908   11.472   23.908   0.0000   0.0000   16.376   7.5789  ?   ?  0.000000 7.578885 
1 1 1   19    5  -86 o   11.859   5.8926 -28.0396   22.051 -28.0396   22.051   0.0000   0.0000   11.859   5.8926  ?   ?  0.000000 5.892551 
1 1 1   19    5  -85 o   15.060   7.1151   1.5193   22.956   1.5193   22.956   0.0000   0.0000   15.060   7.1151  ?   ?  0.000000 7.115144 
1 1 1   19    5  -84 o   14.796   7.0646  -2.2640   23.840  -2.2640   23.840   0.0000   0.0000   14.796   7.0646  ?   ?  0.000000 7.064583 
1 1 1   19    5  -83 o   16.444   7.6333   9.6284   24.525   9.6284   24.525   0.0000   0.0000   16.444   7.6333  ?   ?  0.000000 7.633280 
1 1 1   19    5  -82 o   13.220   6.4749 -18.0407   23.518 -18.0407   23.518   0.0000   0.0000   13.220   6.4749  ?   ?  0.000000 6.474923 
1 1 1   19    5  -80 o   15.441   7.3406  -0.6473   25.173  -0.6473   25.173   0.0000   0.0000   15.441   7.3406  ?   ?  0.000000 7.340626 
1 1 1   19    5  -79 o   17.389   7.8869   14.354   24.194   14.354   24.194   0.0000   0.0000   17.389   7.8869  ?   ?  0.000000 7.886876 
1 1 1   19    5  -78 o   36.138   9.1742   90.807   27.069   90.807   27.069   0.0000   0.0000   36.138   9.1742  ?   ?  0.000000 9.174202 
1 1 1   19    5  -77 o   19.887   8.2646   26.465   22.078   26.465   22.078   0.0000   0.0000   19.887   8.2646  ?   ?  0.000000 8.264647 
1 1 1   19    5  -76 o   13.482   6.1259   0.7991   14.677   6.7300   20.774  -5.1119   20.739   15.996   7.2760   14.222   6.7324 1.773888 9.912920 
1 1 1   19    5  -75 o   13.125   5.8491   2.0335   12.665   15.011   16.306 -17.7008   20.107   17.206   7.1221   12.601   6.1312 4.604517 9.397689 
1 1 1   19    5  -74 o   20.117   6.7180   22.978   12.931   33.829   16.865   7.5005   20.142   23.303   7.6684   16.127   7.2664 7.176464 10.56437 
1 1 1   19    5  -73 o   14.245   6.4408   2.1204   15.983   2.1204   15.983   0.0000   0.0000   14.245   6.4408  ?   ?  0.000000 6.440782 
1 1 1   19    5  -72 f   15.972   6.6740   10.687   14.512   13.395   17.220   4.0530   26.955   17.077   7.2109   16.877   7.8900 0.2002716 10.68872 
1 1 1   19    5  -71 o   18.764   7.4956   19.281   17.315   6.1239   21.482   43.682   29.255   16.388   7.4326   23.676   9.6408 -7.287395 12.17328 
1 1 1   19    5  -70 o   16.608   6.8059   12.153   14.693   18.941   17.003  -7.8635   29.198   18.800   7.4547   16.191   7.7541 2.609642 10.75635 
1 1 1   19    5  -69 o   23.970   6.0055   29.530   11.709   1.3522   16.480   58.251   16.638   14.548   6.5623   33.691   6.2896 -19.14306 9.089746 
1 1 1   19    5  -68 o   29.135   4.1898   38.678   9.6645   23.001   11.814   70.394   16.804   20.956   6.3603   38.028   5.5873 -17.07175 8.465881 
1 1 1   19    5  -67 o   37.591   3.1720   61.226   9.6291   51.784   12.745   73.783   14.697   33.298   4.8370   40.064   4.5828 -6.765167 6.663277 
1 1 1   19    5  -66 o   51.204   2.2292  109.948   9.2820  102.143   14.261  115.684   12.226   48.224   3.6551   52.030   2.8941 -3.805515 4.662130 
1 1 1   19    5  -65 o   31.565   3.2884   43.287   8.3371   26.424   12.576   56.510   11.136   22.625   6.4848   35.685   3.8913 -13.05929 7.562746 
1 1 1   19    5  -64 o   12.673   5.0172   5.2788   7.6906 -10.5229   11.677   17.382   10.220   10.558   5.0135   18.807   5.9509 -8.249090 7.781255 
1 1 1   19    5  -63 o   13.008   5.0816   5.8585   7.7980 -10.6380   12.006   17.895   10.256   10.748   5.0981   19.126   5.9484 -8.377378 7.834178 
1 1 1   19    5  -62 o   13.666   5.1292   7.2519   7.7349   7.1383   12.312   7.3259   9.9416   15.159   6.2231   14.441   5.7084 0.7174425 8.444687 
1 1 1   19    5  -61 o   41.106   2.9718   71.863   9.8905   65.628   13.666   78.721   14.333   38.300   4.4606   42.164   4.2271 -3.863937 6.145415 
1 1 1   19    5  -60 o   16.727   5.5264   12.804   8.7559   0.5418   12.168   25.970   12.609   13.308   5.8404   22.873   6.4728 -9.565530 8.718235 
1 1 1   19    5  -59 o   16.137   5.2206   11.782   7.8328   12.270   12.335   11.452   10.139   17.113   6.4655   16.332   5.9169 0.7814503 8.764292 
1 1 1   19    5  -58 o   52.630   2.1061  115.015   9.0172   92.211   12.923  136.654   12.588   46.399   3.4412   57.033   2.7155 -10.63387 4.383600 
1 1 1   19    5  -57 o   23.603   4.2701   24.838   7.9134   31.065   11.625   19.462   10.802   25.698   5.6991   20.222   6.0699 5.476295 8.326037 
1 1 1   19    5  -56 o   21.684   4.6564   21.306   7.9847   40.949   12.225   6.6922   10.544   29.969   5.1922   14.661   5.8518 15.30835 7.823195 
1 1 1   19    5  -55 o   28.576   3.7933   35.451   8.6179   28.173   12.170   42.769   12.205   24.305   6.1415   30.768   5.0407 -6.462908 7.945194 
1 1 1   19    5  -54 o   38.241   2.6819   61.320   8.3070   47.903   12.318   72.511   11.250   32.805   4.7442   41.275   3.3731 -8.470654 5.821124 
1 1 1   19    5  -53 o   26.732   3.7004   30.914   7.8473   33.835   11.826   28.616   10.489   27.100   5.5407   24.982   5.3143 2.117895 7.677320 
1 1 1   19    5  -52 o   11.958   4.8888   3.0737   7.5596  -7.6261   11.500   11.215   10.031   11.284   5.2342   16.443   5.8946 -5.159099 7.883096 
1 1 1   19    5  -51 o   17.526   5.0327   13.885   7.5675   17.810   11.665   11.033   9.9437   19.665   6.3718   16.360   5.8683 3.304302 8.662388 
1 1 1   19    5  -50 o   19.349   4.7945   16.921   7.5231   17.809   11.652   16.286   9.8520   19.688   6.3671   18.881   5.8231 0.8062897 8.628380 
1 1 1   19    5  -49 o   27.598   3.5197   32.646   7.7382   39.938   12.170   27.697   10.026   29.788   5.2014   24.727   5.1419 5.060474 7.313893 
1 1 1   19    5  -48 o   34.630   2.8636   50.362   8.0114   30.845   12.057   65.792   10.720   25.811   5.8644   39.400   3.3702 -13.58955 6.763783 
1 1 1   19    5  -47 o   36.960   2.7399   57.154   8.1958   46.018   12.724   65.049   10.714   32.170   5.0158   39.183   3.3877 -7.013168 6.052710 
1 1 1   19    5  -46 o   13.198   5.1616   5.2463   8.0532   15.577   14.273   0.4218   9.7541   19.226   7.0122   12.343   5.3245 6.883491 8.804585 
1 1 1   19    5  -45 o   15.145   5.4738   8.9446   8.6709   6.4582   14.005   10.490   11.042   16.151   6.6345   16.540   6.1441 -0.3884315 9.042485 
1 1 1   19    5  -44 o   23.502   4.8498   24.647   8.9827   8.4112   14.157   35.588   11.622   16.825   6.7583   28.178   5.2528 -11.35348 8.559604 
1 1 1   19    5  -43 o   20.514   4.9710   18.902   8.2243   34.722   11.909   4.4768   11.372   27.757   5.4579   14.502   5.9699 13.25527 8.088768 
1 1 1   19    5  -42 f   44.068   2.7483   80.929   9.8233   61.637   14.704   96.479   13.201   37.512   4.9279   47.857   3.4063 -10.34537 5.990569 
1 1 1   19    5  -41 o   26.711   3.8913   30.692   8.2239   47.225   13.693   21.363   10.286   32.602   5.3368   21.659   5.7359 10.94340 7.834666 
1 1 1   19    5  -40 o   37.386   2.9072   58.421   8.7903   34.063   14.195   73.572   11.195   27.114   6.5057   41.834   3.3100 -14.71990 7.299354 
1 1 1   19    5  -39 o   56.558   2.3175  132.182   10.662  116.802   19.840  138.427   12.642   52.044   4.7282   57.744   2.6933 -5.700054 5.441475 
1 1 1   19    5  -38 o   76.423   1.8522  239.848   11.538  232.749   18.503  244.365   14.759   74.748   3.0432   76.925   2.3565 -2.177132 3.848908 
1 1 1   19    5  -37 o   41.731   2.6743   72.357   9.0494   70.198   15.063   73.576   11.320   40.331   4.6679   41.860   3.3452 -1.528648 5.742825 
1 1 1   19    5  -36 o   15.819   5.3911   10.249   8.3271   18.815   15.304   6.6468   9.9249   20.915   7.3007   14.753   5.7415 6.162160 9.287882 
1 1 1   19    5  -35 o   45.287   2.4853   84.895   9.1393   68.508   15.037   94.495   11.509   39.856   4.7199   47.629   2.9792 -7.773125 5.581531 
1 1 1   19    5  -34 o   75.869   1.8343  236.191   11.344  252.591   18.769  226.752   14.239   77.989   2.9578   74.139   2.3591 3.849426 3.783366 
1 1 1   19    5  -33 o   13.091   5.0926   4.9696   7.8058   24.255   13.264  -5.2484   9.6547   23.077   6.6739   10.850   4.9451 12.22669 8.306311 
1 1 1   19    5  -32 o   44.900   2.4650   83.358   8.9872   75.686   14.990   87.663   11.229   42.108   4.4335   45.888   3.0189 -3.779690 5.363736 
1 1 1   19    5  -31 o   14.984   5.2424   8.7701   7.8937  -6.5328   13.240   17.209   9.8322   12.751   5.8034   19.713   5.7592 -6.962581 8.176023 
1 1 1   19    5  -30 o   31.776   4.1597   43.079   10.516   41.217   14.219   45.326   15.624   30.403   5.9507   31.790   6.2521 -1.386684 8.631339 
1 1 1   19    5  -29 o   12.077   5.1451   0.6321   8.9001   1.7928   13.504  -0.2593   11.834   14.921   6.3466   13.509   5.8462 1.412648 8.628864 
1 1 1   19    5  -28 o   45.409   3.3669   86.103   12.374   85.415   17.539   86.785   17.460   44.642   4.9003   45.032   4.8321 -0.3900299 6.881986 
1 1 1   19    5  -27 o   36.293   3.0613   54.886   8.9723   55.198   16.298   54.750   10.747   35.422   5.8486   36.066   3.7085 -0.6439285 6.925250 
1 1 1   19    5  -26 o   47.930   2.5264   94.854   9.8360   97.481   18.043   93.743   11.733   47.858   4.6849   47.510   3.0456 0.3486252 5.587837 
1 1 1   19    5  -25 o   55.416   2.5787  126.739   11.617  148.953   19.277  114.073   14.556   59.585   3.9919   52.314   3.4325 7.271832 5.264690 
1 1 1   19    5  -24 o   38.938   2.9707   62.986   9.3580   62.672   12.817   63.345   13.695   38.499   4.1496   38.612   4.4313 -0.1125793 6.070908 
1 1 1   19    5  -23 o   76.322   2.1055  239.186   13.086  244.302   16.132  229.341   22.380   76.994   2.5739   74.155   3.7142 2.839066 4.518918 
1 1 1   19    5  -22 o   92.156   1.7574  347.734   13.202  348.556   17.940  346.763   19.496   92.055   2.3929   91.738   2.6098 0.3162537 3.540728 
1 1 1   19    5  -21 o   47.554   2.4653   93.229   9.5240  125.464   13.755   63.544   13.200   55.021   3.0792   38.766   4.2466 16.25471 5.245461 
1 1 1   19    5  -20 o   19.128   4.8871   15.997   7.6471   25.814   12.066   9.4066   9.8862   24.077   6.1320   16.070   5.8396 8.007570 8.467743 
1 1 1   19    5  -19 o   35.893   3.0521   53.560   8.8452   34.670   15.099   63.430   10.914   27.775   6.7386   38.975   3.4716 -11.20014 7.580230 
1 1 1   19    5  -18 o   73.060   1.7685  218.492   10.532  210.604   16.015  224.503   13.981   71.459   2.7545   73.907   2.3235 -2.448051 3.603619 
1 1 1   19    5  -17 o   42.356   2.4702   73.966   8.4917   67.383   13.170   78.650   11.110   40.015   4.0952   43.527   3.1525 -3.512672 5.168086 
1 1 1   19    5  -16 o   29.353   3.3684   36.090   7.9139   37.915   12.572   34.893   10.185   29.512   5.4261   28.552   4.5268 0.9597225 7.066437 
1 1 1   19    5  -15 o   45.429   2.3740   84.959   8.7606   84.622   13.731   85.191   11.377   44.998   3.7783   45.333   3.0973 -0.3351517 4.885591 
1 1 1   19    5  -14 o   39.550   2.6067   64.582   8.3571   56.092   13.235   70.212   10.778   36.352   4.5668   41.106   3.2428 -4.753208 5.600970 
1 1 1   19    5  -13 o   60.881   2.0481  152.040   10.149  171.079   16.915  141.328   12.687   64.284   3.2384   58.564   2.6646 5.720043 4.193763 
1 1 1   19    5  -12 o   53.965   2.1374  119.555   9.3835  103.136   14.569  131.193   12.266   49.773   3.6156   56.421   2.6747 -6.647881 4.497398 
1 1 1   19    5  -11 o  105.305   1.6883  453.557   14.492  449.259   20.476  457.872   20.514  104.617   2.4011  105.620   2.3827 -1.003746 3.382674 
1 1 1   19    5  -10 o   43.029   2.8662   76.550   9.9959   75.336   17.050   77.186   12.339   42.059   5.0755   43.048   3.5479 -0.9885025 6.192572 
1 1 1   19    5   -9 o   34.387   3.3886   49.318   9.3752   41.291   15.980   53.531   11.577   30.498   6.6184   35.671   4.0532 -5.173817 7.760921 
1 1 1   19    5   -8 f   66.349   2.1670  180.628   11.704  180.209   19.224  180.874   14.754   65.890   3.5928   66.263   2.7374 -0.3731842 4.516796 
1 1 1   19    5   -7 o   20.164   5.3808   17.743   9.0083   8.9106   15.490   22.256   11.074   18.047   7.1280   22.493   5.9491 -4.446205 9.284382 
1 1 1   19    5   -6 o   37.445   2.9714   58.096   8.9952   47.346   12.997   67.978   12.462   33.275   4.9416   40.316   3.8383 -7.040409 6.257142 
1 1 1   19    5   -5 o   94.544   2.0021  366.040   15.430  385.742   21.396  344.688   22.273   96.827   2.7134   91.432   2.9925 5.395309 4.039527 
1 1 1   19    5   -4 o   25.254   4.5987   27.408   9.1180   27.921   12.542   26.833   13.279   25.137   6.1681   24.608   6.5175 0.5289345 8.973484 
1 1 1   19    5   -3 o   33.320   3.6742   46.494   9.8139   51.744   13.893   41.265   13.865   34.787   5.0465   30.784   5.7363 4.002117 7.640183 
1 1 1   19    5   -2 f   11.731   4.9996   0.2844   8.4084   11.554   13.809  -6.3556   10.600   18.347   6.8601   11.329   5.1702 7.017888 8.590263 
1 1 1   19    5   -1 o   53.092   2.4085  115.898   10.396   99.735   19.823  122.030   12.210   48.497   5.0902   54.407   2.7622 -5.910915 5.791333 
1 1 1   19    5    0 o   55.350   2.3684  125.908   10.661  150.726   21.129  117.431   12.349   60.005   4.3493   53.350   2.8498 6.654663 5.199775 
1 1 1   19    5    1 o   34.699   3.3644   50.167   9.3967   51.160   19.017   49.846   10.808   33.884   7.1121   34.454   3.9180 -0.5698967 8.119839 
1 1 1   19    5    2 f   36.908   3.2266   56.608   9.6098   74.569   19.415   50.779   11.060   41.575   5.8937   34.764   3.9742 6.811672 7.108471 
1 1 1   19    5    3 o   26.239   4.0828   29.245   8.4485   49.639   14.300   18.310   10.471   33.965   5.3412   20.524   5.9282 13.44157 7.979489 
1 1 1   19    5    4 o  106.566   1.7797  464.586   15.460  469.577   23.041  460.500   20.849  106.897   2.6443  105.931   2.4145 0.9661255 3.580786 
1 1 1   19    5    5 o   23.524   4.4966   23.816   8.3084   20.851   13.965   25.440   10.337   22.023   6.9546   24.124   5.3923 -2.101347 8.800195 
1 1 1   19    5    6 o   25.965   4.0984   28.664   8.3871   25.973   13.945   30.189   10.498   24.217   6.7913   26.409   5.0608 -2.191376 8.469530 
1 1 1   19    5    7 o   67.968   1.9478  189.291   10.781  212.827   17.966  176.049   13.476   71.793   3.0771   65.424   2.5317 6.368614 3.984755 
1 1 1   19    5    8 f   45.103   2.8718   84.066   10.504   82.475   15.081   85.564   14.637   44.322   4.2254   45.215   4.0131 -0.8927650 5.827415 
1 1 1   19    5    9 o   56.961   2.4502  133.445   11.350  127.718   16.474  138.620   15.660   55.412   3.6679   57.837   3.3357 -2.424858 4.957848 
1 1 1   19    5   10 o   24.214   5.0581   25.498   9.6610   16.453   13.868   34.025   13.466   20.191   6.9551   27.766   6.1153 -7.575562 9.261164 
1 1 1   19    5   11 o   16.186   5.7691   9.7793   9.5948   12.911   13.946   6.9649   13.221   18.854   6.9225   16.519   6.5659 2.335302 9.541121 
1 1 1   19    5   12 o   74.069   1.8941  224.755   11.427  213.315   18.617  231.670   14.474   71.821   3.1878   75.093   2.3675 -3.272331 3.970781 
1 1 1   19    5   13 o   76.869   1.9431  242.133   12.165  248.168   21.909  239.443   14.628   77.364   3.4831   76.344   2.3533 1.019424 4.203539 
1 1 1   19    5   14 o   55.059   2.2920  124.602   10.264  139.829   18.657  117.993   12.292   57.858   3.9801   53.458   2.8308 4.399860 4.884141 
1 1 1   19    5   15 o   32.784   3.4150   44.930   8.9925   50.707   16.832   42.623   10.638   33.927   6.3188   31.713   4.2197 2.213661 7.598193 
1 1 1   19    5   16 o   50.835   2.4217  106.382   10.006  102.097   18.383  108.187   11.928   49.151   4.6434   51.163   2.8716 -2.012753 5.459586 
1 1 1   19    5   17 o   81.466   1.9057  271.822   12.655  280.062   22.922  268.209   15.178   82.174   3.4295   80.798   2.3068 1.376076 4.133110 
1 1 1   19    5   18 o   98.906   1.8084  400.506   14.580  435.959   26.568  385.228   17.441  102.664   3.1786   96.895   2.2082 5.768814 3.870325 
1 1 1   19    5   19 o   48.670   2.5690   97.700   10.156  120.120   19.104   88.869   11.991   53.390   4.4296   46.258   3.1996 7.131615 5.464305 
1 1 1   19    5   20 o   66.222   2.0106  179.932   10.841  180.744   18.089  179.477   13.543   65.976   3.3747   66.013   2.5214 -0.3696442E-01 4.212570 
1 1 1   19    5   21 o   42.781   2.6452   75.635   9.1794  101.202   15.694   62.341   11.317   49.126   3.9525   38.577   3.6420 10.54892 5.374602 
1 1 1   19    5   22 o   57.752   2.1678  137.076   10.187  132.729   17.135  139.451   12.669   56.362   3.7509   58.123   2.6812 -1.761406 4.610656 
1 1 1   19    5   23 o   98.317   2.1429  396.711   17.174  408.073   25.780  387.647   23.028   99.249   3.1906   96.859   2.9199 2.390869 4.325046 
1 1 1   19    5   24 o   66.742   2.1391  183.022   11.623  179.770   17.570  185.552   15.498   65.788   3.2867   66.997   2.8443 -1.208878 4.346569 
1 1 1   19    5   25 o   48.949   2.5786   98.944   10.253  100.991   15.874   97.479   13.429   49.009   4.0086   48.343   3.4300 0.6661339 5.275788 
1 1 1   19    5   26 o   14.538   5.6362   6.2494   9.5358   15.363   18.498   2.9510   11.128   20.721   7.8968   14.124   5.8684 6.597255 9.838614 
1 1 1   19    5   27 o   45.342   2.5327   84.940   9.3239  103.129   15.865   75.342   11.524   49.516   3.9636   42.475   3.3557 7.040352 5.193353 
1 1 1   19    5   28 o   72.304   2.2293  215.073   13.124  184.756   22.680  230.334   16.091   66.208   4.2244   74.686   2.6473 -8.478371 4.985313 
1 1 1   19    5   29 o   34.281   4.2224   50.054   11.550   49.365   18.848   50.469   14.616   32.792   7.2446   33.954   5.4665 -1.161808 9.075659 
1 1 1   19    5   30 o   50.811   2.7461  106.951   11.332   95.774   20.261  112.039   13.670   47.007   5.3848   51.843   3.2510 -4.836273 6.290054 
1 1 1   19    5   31 o   56.160   2.5709  130.377   11.738  118.717   16.758  141.609   16.447   53.098   3.8988   58.198   3.4828 -5.099792 5.227869 
1 1 1   19    5   32 o   66.063   2.3522  179.970   12.647  160.729   17.614  200.443   18.169   61.989   3.5001   69.377   3.2216 -7.388496 4.757051 
1 1 1   19    5   33 o   70.376   2.1153  203.811   12.121  200.483   18.566  206.283   16.002   69.329   3.2947   70.555   2.7879 -1.226089 4.315916 
1 1 1   19    5   34 o   38.376   3.1495   61.603   9.7658   56.084   15.549   65.198   12.550   35.678   5.5251   39.195   3.9832 -3.516937 6.811242 
1 1 1   19    5   35 o   31.534   3.6671   42.157   9.2505   8.1971   14.353   66.287   12.099   17.046   6.8193   39.580   3.7964 -22.53389 7.804869 
1 1 1   19    5   36 o   20.495   5.9526   18.885   10.531   26.056   14.445   10.748   15.387   23.756   6.9916   18.165   7.1257 5.591513 9.982836 
1 1 1   19    5   37 o   33.335   4.1763   47.638   11.100   45.420   15.308   50.097   16.120   31.679   6.1498   33.300   6.1655 -1.621424 8.708260 
1 1 1   19    5   38 o   81.642   1.9794  274.021   13.173  275.988   20.199  272.565   17.377   81.401   3.0495   81.117   2.6316 0.2846222 4.027961 
1 1 1   19    5   39 o   32.232   4.1114   44.587   10.557   55.929   15.078   33.683   14.785   35.579   5.3657   26.891   6.7548 8.687731 8.626564 
1 1 1   19    5   40 o   14.873   5.7661   7.0227   9.9805   10.583   14.416   3.7455   13.831   17.717   6.9127   15.422   6.4845 2.295080 9.478082 
1 1 1   19    5   41 o   67.842   2.3836  190.378   13.161  194.114   18.258  186.338   18.988   68.051   3.3013   66.549   3.5128 1.501480 4.820602 
1 1 1   19    5   42 f   32.167   5.4208   46.200   13.709   45.069   31.091   46.473   15.274   29.367   10.393   31.917   6.0930 -2.550154 12.04768 
1 1 1   19    5   43 o   43.437   3.1850   79.279   11.199   94.622   21.636   73.664   13.089   45.899   5.9205   41.548   3.9107 4.350842 7.095451 
1 1 1   19    5   44 o   23.823   6.6098   26.652   13.286   33.282   25.147   24.084   15.649   26.005   9.3317   22.669   7.3826 3.335752 11.89885 
1 1 1   19    5   45 o   17.828   6.1302   13.649   10.772   10.387   14.802   17.321   15.707   17.620   6.9654   20.135   7.3540 -2.515053 10.12907 
1 1 1   19    5   46 o   15.401   5.9450   8.0612   10.575   28.134   14.801 -12.8750   15.116   24.255   7.0604   12.373   5.8237 11.88178 9.152333 
1 1 1   19    5   47 o   37.645   3.2381   59.878   9.8400   51.138   15.040   66.420   13.011   33.561   5.7014   39.243   4.1292 -5.682308 7.039597 
1 1 1   19    5   48 o   37.870   3.2772   60.686   10.017   53.931   15.548   65.479   13.098   34.424   5.7432   38.905   4.1964 -4.481285 7.112953 
1 1 1   19    5   49 o   82.865   1.9819  283.151   13.387  307.014   20.123  264.204   17.931   85.686   2.8852   79.561   2.7690 6.125092 3.998928 
1 1 1   19    5   50 o   15.231   5.6269   8.9132   9.2380   7.0869   14.558   10.144   11.953   16.406   6.7543   16.562   6.3390 -0.1564579 9.263035 
1 1 1   19    5   51 o   32.566   3.8161   45.699   9.9382   49.983   15.348   42.606   13.041   32.906   5.9406   30.624   5.4227 2.282585 8.043406 
1 1 1   19    5   52 o   34.451   3.5563   50.775   9.8436   56.546   15.440   46.824   12.777   35.258   5.5560   32.344   5.0079 2.913826 7.479816 
1 1 1   19    5   53 o   25.258   4.7920   28.678   9.5053   36.288   15.347   23.943   12.107   27.303   6.8951   22.419   6.3422 4.884790 9.368348 
1 1 1   19    5   54 o   11.913   5.2481  -0.9869   9.9105   2.2120   14.796  -3.5898   13.347   15.079   6.5314   13.085   5.9039 1.993645 8.804271 
1 1 1   19    5   55 o   17.640   5.6165   14.166   9.0916   15.771   14.141   13.035   11.870   18.954   6.9688   17.514   6.3936 1.440418 9.457352 
1 1 1   19    5   56 o   11.661   5.0837  -0.1001   9.0852   1.2068   14.385  -0.9673   11.718   14.598   6.3798   12.845   5.6806 1.752671 8.542320 
1 1 1   19    5   57 o   13.426   5.4051   5.0821   9.0773   19.116   14.899  -3.2028   11.447   20.152   7.1884   12.128   5.4701 8.024417 9.032996 
1 1 1   19    5   58 o   14.592   5.5468   7.9860   9.1119   1.0877   14.366   12.629   11.786   14.469   6.3482   17.195   6.3551 -2.725965 8.982588 
1 1 1   19    5   59 o   15.605   5.6348   10.287   9.1857   14.580   14.480   7.3963   11.883   18.338   6.9872   15.260   6.1698 3.077732 9.321316 
1 1 1   19    5   60 o   44.522   3.4516   85.266   12.429   89.146   19.994   82.823   15.867   43.597   5.7675   43.029   4.5947 0.5687141 7.373934 
1 1 1   19    5   61 o   17.349   6.1233   13.774   10.786   22.052   17.351   8.5606   13.769   20.937   7.7156   16.102   6.5924 4.834211 10.14838 
1 1 1   19    5   62 o   11.143   5.1167  -4.8148   10.597 -33.4692   17.085   13.105   13.511   10.506   5.2145   17.441   6.7230 -6.934654 8.508197 
1 1 1   19    5   63 o   11.319   5.1608  -3.7188   10.529   3.1776   17.238  -7.8222   13.297   15.635   6.9032   11.903   5.5571 3.732408 8.862058 
1 1 1   19    5   64 o   18.832   6.2014   17.521   11.028   26.295   18.058   12.302   13.927   21.916   7.9022   17.074   6.7542 4.842241 10.39536 
1 1 1   19    5   65 o   14.909   5.9177   8.3604   10.725   36.241   17.198  -9.3835   13.720   25.504   7.6596   11.748   5.5352 13.75609 9.450269 
1 1 1   19    5   66 o   12.594   5.5362   0.9118   10.975 -13.2266   16.954   11.109   14.399   12.517   5.9713   16.631   6.7668 -4.113633 9.024696 
1 1 1   19    5   67 o   19.680   6.2179   19.845   11.162   25.821   16.862   15.185   14.891   21.451   7.6478   17.886   7.0118 3.564140 10.37565 
1 1 1   19    5   68 o   18.618   6.2121   17.690   11.057  -8.4862   16.400   39.505   14.971   12.885   6.0650   27.228   6.7732 -14.34351 9.091752 
1 1 1   19    5   69 o   19.009   6.2838   18.824   11.320   13.368   16.903   23.260   15.243   17.390   7.2295   20.414   7.2720 -3.024218 10.25422 
1 1 1   19    5   70 o   10.345   4.8029  -5.0045   9.7172   3.1432   13.496 -13.7746   14.002   13.909   6.1258   10.988   5.2904 2.920161 8.094069 
1 1 1   19    5   71 o   15.081   5.8102   10.182   10.087   1.3387   13.752   20.483   14.842   13.504   6.0508   19.172   7.1230 -5.668776 9.346144 
1 1 1   19    5   72 f   8.4794   4.1609 -15.9249   9.8540 -16.3742   13.909 -15.4721   13.962   10.520   5.1143   10.660   5.1687 -0.1399078 7.271237 
1 1 1   19    5   73 o   18.616   6.3489   18.778   11.549   19.356   14.284   17.689   19.625   18.618   6.9739   18.229   7.6976 0.3897820 10.38696 
1 1 1   19    5   74 o   15.878   6.4297   11.603   12.928   13.801   17.310   8.8303   19.440   17.036   7.2133   16.255   7.2451 0.7807751 10.22366 
1 1 1   19    5   75 o   14.177   6.0773   6.2615   12.556   3.7250   17.154   9.1891   18.429   14.775   6.6772   16.114   7.1250 -1.338465 9.764756 
1 1 1   19    5   76 o   16.292   7.0587   11.091   17.292   11.091   17.292   0.0000   0.0000   16.292   7.0587  ?   ?  0.000000 7.058734 
1 1 1   19    5   77 o   17.931   7.3706   18.068   17.300   18.068   17.300   0.0000   0.0000   17.931   7.3706  ?   ?  0.000000 7.370636 
1 1 1   19    5   78 o   15.691   6.9274   8.9711   17.357   8.9711   17.357   0.0000   0.0000   15.691   6.9274  ?   ?  0.000000 6.927371 
1 1 1   19    5   79 o   17.653   7.3470   17.629   17.484   17.629   17.484   0.0000   0.0000   17.653   7.3470  ?   ?  0.000000 7.347037 
1 1 1   19    5   80 o   17.656   7.4465   17.699   18.328   17.699   18.328   0.0000   0.0000   17.656   7.4465  ?   ?  0.000000 7.446523 
1 1 1   19    5   81 o   12.057   5.8304 -13.1424   17.465 -13.1424   17.465   0.0000   0.0000   12.057   5.8304  ?   ?  0.000000 5.830398 
1 1 1   19    5   82 o   28.771   7.7123   52.455   18.455   52.455   18.455   0.0000   0.0000   28.771   7.7123  ?   ?  0.000000 7.712348 
1 1 1   19    5   83 o   14.405   6.5759   3.8336   17.163   3.8336   17.163   0.0000   0.0000   14.405   6.5759  ?   ?  0.000000 6.575875 
1 1 1   19    5   84 o   19.286   8.3650   27.492   24.337   27.492   24.337   0.0000   0.0000   19.286   8.3650  ?   ?  0.000000 8.364974 
1 1 1   19    5   85 o   15.311   6.8202   8.8916   17.201   8.8916   17.201   0.0000   0.0000   15.311   6.8202  ?   ?  0.000000 6.820240 
1 1 1   19    5   86 o   14.068   6.4778   2.6584   17.149   2.6584   17.149   0.0000   0.0000   14.068   6.4778  ?   ?  0.000000 6.477762 
1 1 1   19    5   87 o   13.478   5.8571   5.8200   11.979   5.8200   11.979   0.0000   0.0000   13.478   5.8571  ?   ?  0.000000 5.857098 
1 1 1   19    5   88 o   19.839   6.5240   23.719   12.207   23.719   12.207   0.0000   0.0000   19.839   6.5240  ?   ?  0.000000 6.524049 
1 1 1   19    5   89 o   12.995   5.9023   2.0208   13.609   2.0208   13.609   0.0000   0.0000   12.995   5.9023  ?   ?  0.000000 5.902282 
1 1 1   19    5   90 o   22.581   9.0868   45.966   25.641   45.966   25.641   0.0000   0.0000   22.581   9.0868  ?   ?  0.000000 9.086768 
1 1 1   19    6  -86 o   15.372   7.3009   3.6190   24.788   3.6190   24.788   0.0000   0.0000   15.372   7.3009  ?   ?  0.000000 7.300911 
1 1 1   19    6  -85 o   14.572   7.0037  -2.5619   24.299  -2.5619   24.299   0.0000   0.0000   14.572   7.0037  ?   ?  0.000000 7.003704 
1 1 1   19    6  -84 o   17.465   7.9685   19.476   25.159   19.476   25.159   0.0000   0.0000   17.465   7.9685  ?   ?  0.000000 7.968505 
1 1 1   19    6  -83 o   14.738   7.0095   0.5400   23.003   0.5400   23.003   0.0000   0.0000   14.738   7.0095  ?   ?  0.000000 7.009545 
1 1 1   19    6  -82 o   19.429   8.4724   30.454   25.248   30.454   25.248   0.0000   0.0000   19.429   8.4724  ?   ?  0.000000 8.472431 
1 1 1   19    6  -81 o   13.676   6.6353 -10.2477   23.103 -10.2477   23.103   0.0000   0.0000   13.676   6.6353  ?   ?  0.000000 6.635318 
1 1 1   19    6  -80 o   17.624   7.8257   18.963   22.465   18.963   22.465   0.0000   0.0000   17.624   7.8257  ?   ?  0.000000 7.825652 
1 1 1   19    6  -79 o   13.323   6.4442 -10.5785   21.369 -10.5785   21.369   0.0000   0.0000   13.323   6.4442  ?   ?  0.000000 6.444223 
1 1 1   19    6  -77 o   13.611   6.5555  -9.1413   21.549  -9.1413   21.549   0.0000   0.0000   13.611   6.5555  ?   ?  0.000000 6.555529 
1 1 1   19    6  -76 o   22.388   8.7113   39.165   22.845   39.165   22.845   0.0000   0.0000   22.388   8.7113  ?   ?  0.000000 8.711346 
1 1 1   19    6  -75 o   15.272   7.1695   1.8385   22.652   1.8385   22.652   0.0000   0.0000   15.272   7.1695  ?   ?  0.000000 7.169510 
1 1 1   19    6  -74 o   18.988   7.2737   22.193   15.746   25.956   22.843   18.785   21.736   19.431   8.2593   17.982   7.8509 1.449327 11.39530 
1 1 1   19    6  -73 o   21.574   7.3253   29.068   15.372   30.862   21.560   27.213   21.923   20.803   8.3457   19.879   8.2461 0.9240341 11.73239 
1 1 1   19    6  -72 o   17.980   7.0307   18.420   14.939   5.4316   20.663   32.644   21.624   15.637   7.1673   21.379   8.4289 -5.741915 11.06415 
1 1 1   19    6  -71 o   16.153   6.7413   12.095   14.780   13.753   20.518   10.308   21.309   17.186   7.5618   16.636   7.4870 0.5491943 10.64117 
1 1 1   19    6  -70 o   18.100   7.0190   18.387   14.792   22.970   20.652   13.558   21.197   19.255   7.9969   17.276   7.6400 1.979053 11.05981 
1 1 1   19    6  -69 o   19.713   5.7461   20.501   9.7972   9.6803   16.653   26.229   12.116   15.910   6.9099   21.733   6.4051 -5.823597 9.421885 
1 1 1   19    6  -68 o   9.7267   4.5635  -5.9249   9.1532 -18.7979   16.302   0.0018   11.061   11.182   5.4582   12.046   5.4099 -0.8643503 7.684957 
1 1 1   19    6  -67 o   21.419   5.3140   23.170   9.2335   23.854   16.401   22.852   11.172   19.994   7.4761   20.574   6.1723 -0.5802135 9.694837 
1 1 1   19    6  -66 o   12.353   5.1743   4.1276   8.7546   6.8924   16.046   2.9559   10.446   15.345   6.7214   12.654   5.4845 2.690315 8.675044 
1 1 1   19    6  -65 o   9.3071   4.2962  -3.8787   7.6100 -12.4717   11.170   3.5637   10.396   9.7553   4.7039   12.868   5.5232 -3.112485 7.254783 
1 1 1   19    6  -64 o   9.6136   4.5224  -6.7486   9.0938  -3.9646   11.258 -11.9769   15.427   11.382   5.2438   11.864   5.6698 -0.4820852 7.722952 
1 1 1   19    6  -63 f   19.536   5.6626   19.273   9.5388   29.212   11.902   1.4242   15.950   23.767   6.1100   14.418   6.4839 9.349059 8.909120 
1 1 1   19    6  -62 o   11.328   5.0341  -0.4763   9.3152  -2.8467   11.601   3.8267   15.630   11.881   5.4171   14.906   6.5776 -3.024840 8.521117 
1 1 1   19    6  -61 o   35.349   3.1271   54.100   8.9177   44.731   12.770   63.019   12.459   30.507   5.3288   37.363   4.1612 -6.856144 6.761109 
1 1 1   19    6  -60 o   29.450   3.6560   38.380   8.5881   40.593   12.603   36.461   11.734   28.917   5.5485   27.460   5.4347 1.457529 7.766696 
1 1 1   19    6  -59 o   12.565   5.1262   4.4992   8.2897   23.094   12.263 -11.1496   11.249   21.145   6.4922   10.178   4.8578 10.96707 8.108445 
1 1 1   19    6  -58 o   17.617   5.4108   14.897   8.5168  -4.9883   12.554   31.851   11.592   12.031   5.5409   25.541   5.7113 -13.50976 7.957452 
1 1 1   19    6  -57 o   28.046   3.9706   35.039   8.8238   33.340   13.445   36.325   11.695   25.665   6.4383   27.639   5.3845 -1.973164 8.393097 
1 1 1   19    6  -56 o   27.729   3.7545   33.879   8.2687   41.741   13.222   28.830   10.596   29.511   5.7030   24.580   5.4331 4.930208 7.876753 
1 1 1   19    6  -55 o   14.740   5.2882   9.2288   8.0754   14.446   13.016   5.9643   10.297   17.871   6.6646   14.082   5.7251 3.788620 8.786000 
1 1 1   19    6  -54 o   16.780   5.3067   13.034   8.1282   1.0401   13.128   20.489   10.351   13.819   6.0655   20.564   5.8797 -6.745228 8.447596 
1 1 1   19    6  -53 o   31.278   3.2236   41.982   8.1013   40.640   12.185   43.044   10.845   29.620   5.2384   31.027   4.4124 -1.406404 6.849091 
1 1 1   19    6  -52 o   16.680   5.2076   12.749   7.8520   5.4249   11.939   18.332   10.424   14.645   6.0812   19.583   5.9805 -4.937868 8.529174 
1 1 1   19    6  -51 o   18.716   5.0089   16.216   7.7921  -4.2125   11.878   31.650   10.324   12.092   5.5008   26.288   5.0006 -14.19633 7.434016 
1 1 1   19    6  -50 o   48.752   2.2747   98.946   9.0147   86.747   13.368  109.120   12.208   44.879   3.6866   50.839   2.9587 -5.959972 4.727041 
1 1 1   19    6  -49 o   21.243   5.0316   20.777   8.5779   19.197   15.119   21.527   10.417   20.243   7.2389   21.318   5.8284 -1.075794 9.293709 
1 1 1   19    6  -48 o   17.857   5.2877   14.638   8.2411   14.618   14.578   14.647   9.9909   18.592   7.0277   17.930   5.9024 0.6620159 9.177490 
1 1 1   19    6  -47 o   11.980   4.8878   3.2495   7.5372   6.2443   11.791   1.1800   9.8014   15.017   6.1185   12.482   5.3603 2.535769 8.134400 
1 1 1   19    6  -46 o   14.823   5.1604   9.1572   7.6433  -1.4287   12.020   16.342   9.9031   12.932   5.7344   18.818   5.8441 -5.885682 8.187621 
1 1 1   19    6  -45 o   11.410   4.7913   1.7534   7.5355 -17.3403   11.514   16.060   9.9664   9.6285   4.6744   18.705   5.8710 -9.076634 7.504562 
1 1 1   19    6  -44 f   15.698   5.1918   10.694   7.7270   0.6400   11.882   18.061   10.171   13.437   5.8364   19.730   5.8824 -6.292458 8.286496 
1 1 1   19    6  -43 o   13.119   5.1677   5.1365   8.1220   4.3534   14.238   5.5143   9.8887   15.490   6.5496   14.067   5.6490 1.423076 8.649186 
1 1 1   19    6  -42 o   35.769   3.0679   54.016   8.8586   64.787   15.339   48.625   10.851   38.141   5.0584   33.494   4.0569 4.646244 6.484298 
1 1 1   19    6  -41 o   32.141   3.3658   43.975   8.6876   38.599   14.918   46.734   10.687   28.502   6.5573   32.828   4.0816 -4.326241 7.723845 
1 1 1   19    6  -40 o   10.087   4.5547  -3.2479   7.9629 -13.7833   13.533   2.3315   9.8483   11.356   5.3941   12.962   5.4621 -1.605386 7.676641 
1 1 1   19    6  -39 o   17.645   5.6357   13.887   9.1484   2.3919   16.079   19.389   11.124   15.779   6.8217   20.456   6.1640 -4.676790 9.194069 
1 1 1   19    6  -38 o   45.053   2.7535   84.816   10.064   74.513   15.451   92.410   13.264   41.274   4.6745   46.682   3.5114 -5.408005 5.846472 
1 1 1   19    6  -37 o   11.705   5.0231   0.5758   8.5947   3.5043   13.039  -1.6742   11.429   14.872   6.2770   12.679   5.6084 2.193136 8.417570 
1 1 1   19    6  -36 o   36.876   3.2595   57.434   9.6971   39.829   14.684   71.051   12.914   29.242   6.3430   40.732   3.9385 -11.48980 7.466290 
1 1 1   19    6  -35 o   22.947   5.1323   23.757   9.3593   21.427   14.216   25.539   12.434   21.528   7.0382   23.378   6.3581 -1.849453 9.484836 
1 1 1   19    6  -34 o   56.197   3.0245  132.154   13.804  154.322   19.820  111.274   19.236   60.123   4.0682   50.615   4.7166 9.507771 6.228667 
1 1 1   19    6  -33 f   42.572   4.4989   78.417   15.377   77.082   18.329   81.590   28.253   41.602   5.5425   40.366   8.8326 1.236412 10.42757 
1 1 1   19    6  -32 o   57.975   3.0265  140.494   14.253  135.017   19.948  146.205   20.372   56.061   4.4005   58.409   4.3092 -2.348446 6.159044 
1 1 1   19    6  -31 o   38.381   3.0503   61.767   9.4647   54.239   17.520   64.869   11.247   34.327   6.4991   39.143   3.5640 -4.816181 7.412143 
1 1 1   19    6  -30 o   18.422   5.2281   15.166   8.2138   9.2051   14.336   18.079   10.022   17.223   6.8400   19.994   5.8068 -2.770941 8.972409 
1 1 1   19    6  -29 o   53.295   2.3499  117.486   10.184  143.033   19.059  107.277   12.048   58.005   4.0564   50.717   2.9267 7.287483 5.001997 
1 1 1   19    6  -28 o   36.835   2.9681   56.763   8.8366   51.907   15.171   59.257   10.871   34.097   5.6563   37.415   3.6092 -3.317886 6.709735 
1 1 1   19    6  -27 o   21.601   5.2833   20.959   9.2245   9.6851   14.703   28.277   11.846   17.552   6.9408   24.919   5.9199 -7.367182 9.122534 
1 1 1   19    6  -26 o   28.188   3.7305   33.904   8.3615   40.062   14.488   30.828   10.239   29.660   6.1928   26.431   4.9336 3.228333 7.917764 
1 1 1   19    6  -25 o   42.190   2.6661   73.954   9.1221   73.362   15.318   74.279   11.355   41.246   4.6361   42.058   3.3395 -0.8117790 5.713641 
1 1 1   19    6  -24 o   45.258   2.5308   84.887   9.2994   86.686   15.905   83.953   11.463   45.005   4.3912   44.802   3.1591 0.2035141 5.409495 
1 1 1   19    6  -23 o   26.067   4.1056   29.294   8.4354   13.751   14.665   36.979   10.312   18.956   7.0731   29.217   4.4720 -10.26104 8.368245 
1 1 1   19    6  -22 o   77.330   1.9558  245.816   12.319  244.627   22.671  246.314   14.674   76.341   3.6537   77.270   2.3324 -0.9291534 4.334730 
1 1 1   19    6  -21 o   78.198   1.9451  251.161   12.399  265.381   23.099  245.407   14.695   79.586   3.5697   77.130   2.3399 2.455750 4.268283 
1 1 1   19    6  -20 o   33.718   3.9052   48.330   10.535   69.507   17.741   36.795   13.094   39.728   5.6364   28.652   5.8054 11.07621 8.091434 
1 1 1   19    6  -19 o   51.317   2.2613  108.625   9.4360  103.302   15.475  111.776   11.905   49.477   3.8677   51.885   2.8255 -2.408268 4.789878 
1 1 1   19    6  -18 o   56.942   2.0309  133.382   9.4118  131.009   14.850  134.974   12.167   56.026   3.2659   57.107   2.6208 -1.081848 4.187437 
1 1 1   19    6  -17 o   36.063   2.8140   54.124   8.2069   47.165   13.132   58.584   10.513   32.896   5.0590   37.326   3.4959 -4.430103 6.149384 
1 1 1   19    6  -16 o   21.145   4.6581   19.650   7.8115   36.071   12.890   10.120   9.8200   28.430   5.7598   16.242   5.8310 12.18832 8.196076 
1 1 1   19    6  -15 o   11.606   4.9035   1.0288   7.9705   11.343   15.018  -3.0163   9.4045   18.354   7.0845   11.275   5.0314 7.078754 8.689363 
1 1 1   19    6  -14 f   54.682   2.2381  123.198   9.9549  127.246   18.174  121.462   11.899   54.895   4.0909   54.161   2.7036 0.7335358 4.903591 
1 1 1   19    6  -13 o   54.545   2.3494  122.700   10.421  161.590   22.209  111.719   11.801   61.721   4.4440   51.913   2.7991 9.807751 5.252090 
1 1 1   19    6  -12 o   18.356   5.2328   14.805   8.2103   20.691   15.282   12.416   9.7345   21.794   7.3038   17.314   5.8295 4.480064 9.344937 
1 1 1   19    6  -11 o   15.473   5.3164   9.5617   8.1015 -16.4581   14.956   20.368   9.6381   11.944   5.6724   21.389   5.4981 -9.444834 7.899678 
1 1 1   19    6  -10 o   73.660   1.9001  222.692   11.399  196.033   19.042  237.583   14.231   68.570   3.4175   75.962   2.3010 -7.391518 4.119901 
1 1 1   19    6   -9 o   39.369   2.8702   64.404   9.1476   64.813   16.233   64.213   11.073   38.638   5.2929   39.126   3.5092 -0.4883728 6.350476 
1 1 1   19    6   -8 o   18.691   5.2074   15.364   8.2279   37.020   15.572   6.9757   9.6912   28.499   6.7985   14.878   5.7045 13.62117 8.874709 
1 1 1   19    6   -7 o   31.660   3.2819   42.028   8.3471   38.625   13.206   44.292   10.771   29.544   5.6902   32.235   4.1991 -2.691029 7.071805 
1 1 1   19    6   -6 o   19.555   4.9660   16.849   7.9294   17.371   12.727   16.517   10.137   20.140   6.6631   19.425   5.8909 0.7150249 8.893836 
1 1 1   19    6   -5 o   49.478   2.2764  100.863   9.1567   84.678   14.186  112.421   11.988   44.841   3.9206   52.091   2.8340 -7.250076 4.837602 
1 1 1   19    6   -4 o   69.367   1.8568  197.401   10.490  212.599   16.301  186.660   13.704   71.698   2.7946   67.273   2.5035 4.425499 3.751931 
1 1 1   19    6   -3 f   10.732   4.6902  -1.1794   7.7744 -12.5976   12.550   5.9315   9.9037   11.218   5.2881   14.564   5.7157 -3.346225 7.786730 
1 1 1   19    6   -2 o   17.563   5.1589   13.408   7.8709   3.3617   12.297   20.380   10.244   14.816   6.1634   21.399   5.7504 -6.582952 8.429448 
1 1 1   19    6   -1 o   84.124   1.7166  289.862   11.771  288.685   17.792  290.779   15.698   83.642   2.6127   84.064   2.2930 -0.4214630 3.476254 
1 1 1   19    6    0 o   31.935   3.5269   42.913   9.0283   41.506   13.388   44.087   12.227   30.722   5.5500   31.948   4.8471 -1.225550 7.368641 
1 1 1   19    6    1 o   40.272   3.0473   67.496   9.9291   66.513   13.492   68.657   14.665   39.596   4.2464   40.115   4.5659 -0.5196075 6.235329 
1 1 1   19    6    2 o   55.659   2.3036  127.605   10.429  148.081   15.257  109.647   14.288   59.702   3.1463   51.251   3.4401 8.451141 4.661857 
1 1 1   19    6    3 f   68.223   2.4694  191.895   13.710  186.757   17.787  199.415   21.519   67.016   3.2659   68.995   3.8415 -1.979202 5.042083 
1 1 1   19    6    4 o   22.548   5.3050   22.515   9.5866   56.774   14.168  -6.4180   13.020   36.300   4.9141   12.687   5.7666 23.61358 7.576432 
1 1 1   19    6    5 o   36.076   3.4265   54.559   9.9557   54.772   14.579   54.372   13.628   35.535   5.1857   35.542   4.8288 -0.6969452E-02 7.085781 
1 1 1   19    6    6 o   27.181   3.9752   31.517   8.5473   1.1151   13.791   50.477   10.891   14.888   6.3753   34.532   3.9396 -19.64402 7.494360 
1 1 1   19    6    7 o   33.328   3.2448   46.499   8.7037   54.703   14.538   41.916   10.866   35.509   5.1747   31.285   4.3808 4.223494 6.780087 
1 1 1   19    6    8 o   45.455   2.5538   85.422   9.4245  105.754   15.811   74.216   11.738   50.143   3.8988   42.108   3.4499 8.034931 5.205978 
1 1 1   19    6    9 o   16.549   5.4924   11.351   8.6458  -7.8055   13.712   23.993   11.139   12.773   5.8485   23.138   5.8913 -10.36500 8.301355 
1 1 1   19    6   10 o   17.436   5.4990   13.016   8.7335   10.477   13.934   14.660   11.208   17.765   6.8328   18.674   6.2550 -0.9084148 9.263466 
1 1 1   19    6   11 o   30.076   3.7953   38.359   9.0980   40.478   14.222   36.890   11.837   30.111   6.0048   29.016   5.1954 1.094831 7.940442 
1 1 1   19    6   12 o   43.730   2.7284   79.283   9.6774   75.811   15.005   81.755   12.663   42.182   4.4299   44.156   3.5480 -1.974594 5.675601 
1 1 1   19    6   13 o   24.774   4.5259   26.669   8.8031   25.825   13.825   27.245   11.417   23.825   6.7897   24.659   5.7808 -0.8340607 8.917331 
1 1 1   19    6   14 f   9.2381   4.3331  -7.9067   8.2429  -8.0924   13.315  -7.7913   10.496   12.473   5.7305   10.838   5.0180 1.634961 7.617072 
1 1 1   19    6   15 o   11.323   4.9974  -1.9677   9.0263  -2.9453   13.280  -1.1282   12.306   13.567   6.0209   13.500   5.9004 0.6671143E-01 8.430101 
1 1 1   19    6   16 o   11.564   5.0676  -1.3741   9.1309   0.4617   13.746  -2.8237   12.215   14.639   6.3179   13.015   5.7754 1.623808 8.559910 
1 1 1   19    6   17 o   42.481   3.0708   75.249   10.562   69.801   15.267   80.250   14.627   40.283   4.7400   43.470   4.1792 -3.186947 6.319247 
1 1 1   19    6   18 o   41.296   3.1696   71.259   10.588   70.131   15.589   72.225   14.426   40.322   4.8396   41.131   4.3693 -0.8096428 6.520204 
1 1 1   19    6   19 o   27.874   4.0963   33.338   9.0300   55.836   14.732   19.799   11.429   35.751   5.2081   21.005   6.2286 14.74628 8.119095 
1 1 1   19    6   20 o   80.485   1.9777  266.099   12.975  292.956   20.401  247.856   16.814   83.980   2.9849   77.385   2.6696 6.595413 4.004527 
1 1 1   19    6   21 o   66.840   2.1608  184.014   11.758  181.412   18.330  185.833   15.326   65.846   3.4268   66.926   2.8156 -1.080475 4.435113 
1 1 1   19    6   22 o   28.064   4.1304   33.861   9.1666   30.003   14.799   36.263   11.676   25.437   6.9441   28.664   5.1881 -3.226883 8.668195 
1 1 1   19    6   23 o   42.561   3.1318   75.744   10.789  107.672   20.602   63.679   12.665   49.798   5.1495   38.660   4.0804 11.13845 6.570161 
1 1 1   19    6   24 o   62.983   2.4242  163.962   12.423  194.606   23.115  151.516   14.731   67.702   4.2093   60.316   3.0057 7.386208 5.172259 
1 1 1   19    6   25 o   19.106   5.8211   16.216   9.8831   9.7716   17.933   19.027   11.844   18.634   7.5627   20.585   6.3910 -1.951157 9.901504 
1 1 1   19    6   26 o   32.044   4.1985   44.127   10.703   44.112   15.417   44.141   14.870   31.108   6.2963   31.234   6.0592 -0.1258640 8.738262 
1 1 1   19    6   27 o   14.838   5.5742   7.6982   9.1396   13.638   18.841   5.8704   10.452   19.909   7.8620   14.650   5.8331 5.259176 9.789563 
1 1 1   19    6   28 o   10.933   4.8160  -1.5501   8.3450   16.446   14.188 -11.0684   10.319   19.748   7.0179   10.007   4.7404 9.741416 8.468966 
1 1 1   19    6   29 o   40.670   3.2234   69.457   10.599   83.028   17.963   62.208   13.128   43.548   5.1603   38.037   4.3099 5.511356 6.723413 
1 1 1   19    6   30 o   81.521   2.1299  273.987   14.141  275.072   23.235  273.349   17.823   80.880   3.5327   81.146   2.6982 -0.2664642 4.445273 
1 1 1   19    6   31 o   45.176   2.7386   85.002   10.037  110.458   18.578   74.509   11.928   50.616   4.5514   41.990   3.5172 8.625706 5.752000 
1 1 1   19    6   32 o   24.543   4.9677   26.861   9.5968   33.299   16.859   23.776   11.672   26.323   7.4968   22.692   6.1555 3.630091 9.700114 
1 1 1   19    6   33 f   49.489   2.5788  101.787   10.367   99.074   18.929  102.949   12.391   47.622   4.9483   49.569   3.0819 -1.946877 5.829561 
1 1 1   19    6   34 o   23.504   4.9153   24.700   9.1138   27.445   16.768   23.549   10.858   23.974   7.6269   22.627   5.8455 1.347164 9.609363 
1 1 1   19    6   35 o   29.684   4.3308   38.373   10.171   27.874   24.433   40.573   11.186   24.414   9.1257   30.389   4.6643 -5.975090 10.24866 
1 1 1   19    6   36 o   44.558   3.0754   83.373   11.102   72.868   26.898   85.530   12.188   37.840   8.8749   45.013   3.3457 -7.172298 9.484550 
1 1 1   19    6   37 o   66.461   2.3710  183.077   12.825  209.010   31.256  177.827   14.063   68.449   5.6522   65.367   2.6447 3.081520 6.240302 
1 1 1   19    6   38 o   17.919   5.4360   14.443   8.6311   9.6319   15.545   16.587   10.378   17.542   7.0693   19.109   5.9900 -1.567430 9.265801 
1 1 1   19    6   39 o   44.832   3.2417   84.833   11.767   86.516   16.272   82.990   17.035   44.557   4.5437   43.408   4.8998 1.148754 6.682310 
1 1 1   19    6   40 o   9.5671   4.5243  -9.4855   9.3221 -31.5747   14.210   7.2033   12.351   9.5235   4.7317   15.679   6.3075 -6.155312 7.885041 
1 1 1   19    6   41 o   10.774   4.9062  -4.4834   9.4794  -3.5620   14.038  -5.2558   12.852   13.506   6.0775   12.548   5.7136 0.9576063 8.341537 
1 1 1   19    6   42 o   27.020   4.4754   32.264   9.5124   30.919   15.129   33.143   12.233   25.201   7.0758   26.755   5.7783 -1.554291 9.135427 
1 1 1   19    6   43 o   38.839   3.4296   64.182   10.746   65.422   18.279   63.527   13.285   37.553   6.1866   38.164   4.3479 -0.6111259 7.561610 
1 1 1   19    6   44 f   17.192   5.9780   12.787   10.256   31.019   14.650  -4.7373   14.362   25.255   6.9148   13.374   6.0701 11.88093 9.201166 
1 1 1   19    6   45 o   16.361   6.2156   10.190   11.438   10.823   19.047   9.8328   14.304   18.631   7.7036   17.068   6.8145 1.563223 10.28504 
1 1 1   19    6   46 o   35.819   4.0134   55.675   11.517   38.073   15.809   75.577   16.811   27.882   6.9742   41.054   5.1356 -13.17138 8.661018 
1 1 1   19    6   47 o   14.651   5.6389   7.5762   9.4944  -9.6948   14.858   19.494   12.343   12.621   5.8864   20.307   6.5521 -7.685796 8.807935 
1 1 1   19    6   48 o   11.852   5.1809  -0.2674   9.4908   4.7826   14.568  -3.9917   12.510   15.591   6.6100   12.539   5.6810 3.051296 8.715866 
1 1 1   19    6   49 o   55.425   2.5533  128.420   11.505  121.037   17.160  134.450   15.507   52.845   4.0135   56.176   3.4023 -3.331135 5.261579 
1 1 1   19    6   50 o   21.654   5.4157   21.949   9.5338   29.698   14.794   16.445   12.468   24.364   7.0492   18.890   6.5899 5.473169 9.649769 
1 1 1   19    6   51 o   39.419   3.2033   66.234   10.204   58.321   15.586   72.170   13.500   35.471   5.5740   40.583   4.1387 -5.111271 6.942492 
1 1 1   19    6   52 o   14.785   5.5828   8.4469   9.1942   3.4020   14.099   12.180   12.128   14.892   6.4127   17.040   6.4168 -2.147414 9.071821 
1 1 1   19    6   53 o   15.099   5.7631   8.8000   9.8621   12.623   13.994   5.0277   13.901   17.527   6.8186   15.202   6.4516 2.325424 9.386976 
1 1 1   19    6   54 o   15.303   5.8503   9.1814   10.173   17.810   14.151  -0.0495   14.636   19.311   6.9909   14.179   6.3052 5.132487 9.414248 
1 1 1   19    6   55 o   21.853   6.1352   23.572   11.375   19.607   17.850   26.282   14.759   20.125   7.7354   22.523   7.1542 -2.398470 10.53656 
1 1 1   19    6   56 o   32.310   4.6409   47.478   11.873   50.557   18.604   45.363   15.421   30.942   7.4630   30.165   6.4659 0.7766533 9.874463 
1 1 1   19    6   57 o   31.343   4.8814   45.376   12.066   9.2455   18.352   72.882   16.013   17.240   7.3677   39.665   5.0682 -22.42511 8.942586 
1 1 1   19    6   58 o   28.845   5.1860   39.270   11.746   27.391   17.975   48.123   15.517   22.244   7.8997   30.991   6.3558 -8.746340 10.13910 
1 1 1   19    6   59 o   16.588   6.1765   12.518   11.171   13.345   17.853   11.987   14.321   17.940   7.4417   16.941   6.7999 0.9993973 10.08054 
1 1 1   19    6   60 o   34.176   4.5052   53.486   12.245   58.875   19.014   49.667   16.007   33.201   7.2309   31.146   6.5145 2.055059 9.732717 
1 1 1   19    6   61 o   16.931   6.5329   13.153   12.767 -21.8920   23.894   27.155   15.104   13.839   6.7222   22.176   7.2548 -8.336523 9.890405 
1 1 1   19    6   62 o   31.141   5.5861   47.473   13.659   44.374   26.000   48.654   16.053   25.381   9.4282   30.479   6.6487 -5.098471 11.53674 
1 1 1   19    6   63 f   29.293   5.9105   43.205   13.626   70.153   26.684   33.700   15.848   32.385   9.4952   24.344   7.3619 8.040689 12.01482 
1 1 1   19    6   64 o   10.976   5.1902  -8.6495   12.265 -13.9277   23.453  -6.6624   14.390   14.280   6.8678   12.265   5.7439 2.015159 8.953153 
1 1 1   19    6   65 o   10.626   5.0748 -10.6743   12.318   15.685   24.028 -20.0714   14.346   18.440   8.1455   10.316   5.0536 8.124510 9.585837 
1 1 1   19    6   66 o   35.213   5.0277   59.915   14.022   61.347   26.862   59.379   16.439   28.562   9.6836   33.748   6.2044 -5.185427 11.50076 
1 1 1   19    6   67 o   20.861   6.3451   23.820   11.749  -1.1278   17.950   42.520   15.541   14.213   6.5742   27.472   6.9389 -13.25862 9.558706 
1 1 1   19    6   68 o   13.831   6.0892   3.9677   13.322  -2.3210   18.107   11.389   19.670   14.011   6.5225   16.795   7.3964 -2.784218 9.861538 
1 1 1   19    6   69 o   21.086   7.4356   27.279   15.902   23.433   26.875   29.351   19.725   19.389   8.5872   21.063   8.1222 -1.673677 11.81987 
1 1 1   19    6   70 o   15.869   6.7849   10.410   15.576   54.125   27.765  -9.6658   18.816   25.517   9.6865   13.101   6.2608 12.41669 11.53374 
1 1 1   19    6   71 o   12.555   5.8860  -5.0466   15.179 -27.2565   25.922   6.5439   18.726   13.271   6.5575   15.550   7.0065 -2.278898 9.596437 
1 1 1   19    6   72 o   12.630   5.9164  -4.5698   15.285 -38.8489   26.398   12.719   18.747   12.524   6.2583   16.708   7.2929 -4.183545 9.610031 
1 1 1   19    6   73 o   18.751   7.2405   21.200   15.691   19.806   26.493   21.953   19.474   18.402   8.3089   18.765   7.7769 -0.3626614 11.38059 
1 1 1   19    6   74 o   17.416   8.0946   13.069   27.715   13.069   27.715   0.0000   0.0000   17.416   8.0946  ?   ?  0.000000 8.094593 
1 1 1   19    6   75 o   17.769   8.1665   16.476   27.074   16.476   27.074   0.0000   0.0000   17.769   8.1665  ?   ?  0.000000 8.166529 
1 1 1   19    6   76 o   18.215   8.3433   19.931   27.939   19.931   27.939   0.0000   0.0000   18.215   8.3433  ?   ?  0.000000 8.343271 
1 1 1   19    6   77 o   15.676   7.5033   0.1630   27.248   0.1630   27.248   0.0000   0.0000   15.676   7.5033  ?   ?  0.000000 7.503283 
1 1 1   19    6   78 o   12.692   6.3256 -32.1972   26.223 -32.1972   26.223   0.0000   0.0000   12.692   6.3256  ?   ?  0.000000 6.325646 
1 1 1   19    6   79 o   13.266   6.5505 -22.1209   25.716 -22.1209   25.716   0.0000   0.0000   13.266   6.5505  ?   ?  0.000000 6.550519 
1 1 1   19    6   80 o   19.157   8.4257   27.919   25.452   27.919   25.452   0.0000   0.0000   19.157   8.4257  ?   ?  0.000000 8.425690 
1 1 1   19    6   81 o   14.973   7.1739  -1.2741   25.047  -1.2741   25.047   0.0000   0.0000   14.973   7.1739  ?   ?  0.000000 7.173891 
1 1 1   19    6   82 o   13.374   6.5412 -14.3265   23.749 -14.3265   23.749   0.0000   0.0000   13.374   6.5412  ?   ?  0.000000 6.541245 
1 1 1   19    6   83 o   18.225   8.2235   24.195   25.904   24.195   25.904   0.0000   0.0000   18.225   8.2235  ?   ?  0.000000 8.223546 
1 1 1   19    6   84 o   14.119   6.8597  -8.0314   24.918  -8.0314   24.918   0.0000   0.0000   14.119   6.8597  ?   ?  0.000000 6.859655 
1 1 1   19    7  -81 o   10.183   5.1596 -50.4582   21.592 -50.4582   21.592   0.0000   0.0000   10.183   5.1596  ?   ?  0.000000 5.159608 
1 1 1   19    7  -80 o   14.609   6.9657   0.1842   23.015   0.1842   23.015   0.0000   0.0000   14.609   6.9657  ?   ?  0.000000 6.965673 
1 1 1   19    7  -79 o   21.048   8.4713   37.041   22.289   37.041   22.289   0.0000   0.0000   21.048   8.4713  ?   ?  0.000000 8.471271 
1 1 1   19    7  -78 o   18.079   7.8971   23.085   22.015   23.085   22.015   0.0000   0.0000   18.079   7.8971  ?   ?  0.000000 7.897058 
1 1 1   19    7  -77 o   23.128   8.7936   45.052   22.905   45.052   22.905   0.0000   0.0000   23.128   8.7936  ?   ?  0.000000 8.793578 
1 1 1   19    7  -76 o   16.430   7.4288   13.332   21.267   13.332   21.267   0.0000   0.0000   16.430   7.4288  ?   ?  0.000000 7.428824 
1 1 1   19    7  -74 o   18.701   8.1509   25.030   23.344   25.030   23.344   0.0000   0.0000   18.701   8.1509  ?   ?  0.000000 8.150906 
1 1 1   19    7  -73 o   16.262   7.5382   9.7406   23.791   9.7406   23.791   0.0000   0.0000   16.262   7.5382  ?   ?  0.000000 7.538152 
1 1 1   19    7  -72 o   13.142   6.1197  -1.4857   15.958 -13.2934   21.979   11.678   23.207   13.217   6.4263   16.561   7.5927 -3.343824 9.947191 
1 1 1   19    7  -71 o   17.476   7.1556   17.877   16.225 -18.5632   21.790   63.218   24.306   12.692   6.2199   28.541   9.1933 -15.84841 11.09968 
1 1 1   19    7  -70 o   13.396   6.1377   0.8872   15.134  -7.2247   20.418   10.777   22.544   13.580   6.4986   16.477   7.5274 -2.896938 9.944546 
1 1 1   19    7  -69 o   17.847   7.0755   18.797   15.315   3.4345   20.826   36.888   22.600   15.131   7.0272   21.858   8.6171 -6.726956 11.11920 
1 1 1   19    7  -68 o   15.068   6.5798   8.3383   15.273   15.803   21.458   0.6757   21.742   17.356   7.6808   14.963   7.0243 2.393715 10.40839 
1 1 1   19    7  -67 o   18.094   7.0440   19.102   14.943  -0.4945   20.128   43.165   22.304   14.529   6.8006   23.920   8.7591 -9.391804 11.08916 
1 1 1   19    7  -66 o   12.761   5.9145  -2.4380   14.641 -14.1524   19.585   12.403   22.044   12.696   6.1479   16.962   7.6257 -4.265125 9.795295 
1 1 1   19    7  -65 o   14.744   6.5009   6.3019   15.238   6.2751   20.694   6.3336   22.519   15.808   7.2180   16.111   7.4201 -0.3027668 10.35172 
1 1 1   19    7  -64 o   11.659   5.2127   0.2882   10.144 -33.3678   19.038   13.633   11.988   10.772   5.3720   16.361   6.3258 -5.589701 8.299089 
1 1 1   19    7  -63 o   16.402   6.0914   13.801   10.852   39.426   20.867   4.3019   12.705   23.713   8.5015   13.660   5.9822 10.05228 10.39531 
1 1 1   19    7  -62 o   23.387   4.9644   26.970   9.1709   30.226   12.531   23.214   13.458   23.427   6.3875   20.056   6.8533 3.370583 9.368472 
1 1 1   19    7  -61 o   15.886   5.4419   12.573   8.4868   14.222   12.325   11.085   11.704   16.724   6.4277   15.539   6.1772 1.185114 8.914814 
1 1 1   19    7  -60 o   18.503   5.4278   17.480   8.7177   20.174   12.696   15.077   11.991   19.083   6.6505   17.090   6.3921 1.993422 9.224293 
1 1 1   19    7  -59 o   22.793   4.7980   25.109   8.6322   22.793   12.067   27.537   12.354   20.418   6.4669   22.502   6.4201 -2.084421 9.112593 
1 1 1   19    7  -58 o   16.779   5.4691   14.013   8.5873  -2.2418   12.096   30.528   12.193   12.103   5.5233   24.066   6.1827 -11.96283 8.290551 
1 1 1   19    7  -57 f   12.391   5.1236   4.3384   8.4259 -13.8018   11.824   23.054   12.010   9.9411   4.8048   20.752   6.4344 -10.81051 8.030441 
1 1 1   19    7  -56 o   7.6179   3.7536 -15.4258   8.2918 -17.2352   11.707 -13.6046   11.745   9.4319   4.6087   9.9589   4.8073 -0.5270462 6.659632 
1 1 1   19    7  -55 o   22.397   4.9394   24.048   8.7752   34.918   12.808   14.431   12.047   26.134   6.1205   17.244   6.4154 8.889721 8.866699 
1 1 1   19    7  -54 o   25.615   4.4179   30.292   8.8913   21.837   12.789   38.202   12.370   20.329   6.6772   27.872   5.6384 -7.543209 8.739364 
1 1 1   19    7  -53 o   13.877   5.3973   7.3922   8.7662   14.001   12.916   1.7483   11.936   17.298   6.5971   13.207   5.7908 4.090490 8.778122 
1 1 1   19    7  -52 o   9.6712   4.5783  -8.5204   9.5923   1.3795   16.973 -13.1661   11.627   14.968   6.7134   10.051   4.8345 4.916525 8.272934 
1 1 1   19    7  -51 o   29.707   4.3833   40.134   10.296   39.785   18.456   40.292   12.406   26.502   7.9290   28.986   5.4504 -2.484476 9.621606 
1 1 1   19    7  -50 o   28.623   4.1170   36.768   9.3299   29.616   14.258   42.124   12.339   23.726   6.9362   29.861   5.2612 -6.134085 8.705824 
1 1 1   19    7  -49 o   18.177   5.5407   15.869   8.9523   7.3158   13.455   22.664   11.992   15.489   6.4456   21.187   6.4033 -5.698042 9.085593 
1 1 1   19    7  -48 f   14.461   5.5336   8.0873   9.1070   10.163   13.785   6.4799   12.131   16.497   6.6540   14.866   6.1474 1.631252 9.059067 
1 1 1   19    7  -47 f   8.5728   4.1571 -13.1630   9.0383  -8.7435   11.671 -19.7839   14.285   10.947   5.1415   10.643   5.1760 0.3041458 7.295585 
1 1 1   19    7  -46 o   12.063   5.1868   1.3935   9.1973   5.4497   13.580  -2.0437   12.501   15.144   6.3996   12.792   5.7476 2.351895 8.601708 
1 1 1   19    7  -45 o   12.935   5.4040   3.4685   9.5124   7.9927   14.228  -0.1885   12.792   16.122   6.6612   13.398   5.9295 2.723751 8.917998 
1 1 1   19    7  -44 o   30.659   4.0590   41.450   9.8949   46.033   14.492   37.447   13.543   31.096   5.9337   27.833   6.1347 3.262745 8.534850 
1 1 1   19    7  -43 o   34.612   3.8606   52.243   10.707   39.437   17.316   60.170   13.624   27.615   7.5003   36.647   4.6662 -9.032133 8.833328 
1 1 1   19    7  -42 o   41.118   2.8361   71.353   9.4477   58.213   15.323   79.412   12.000   35.527   5.4661   43.043   3.4490 -7.516079 6.463286 
1 1 1   19    7  -41 o   42.449   2.7543   75.819   9.4789   77.417   15.391   74.843   12.031   41.767   4.5965   41.735   3.5708 0.3239059E-01 5.820575 
1 1 1   19    7  -40 o   45.280   2.6190   85.933   9.6253   75.131   15.993   92.068   12.052   40.962   4.8860   46.565   3.1946 -5.602852 5.837674 
1 1 1   19    7  -39 o   28.051   4.3996   34.930   9.7294   33.050   14.267   36.564   13.302   25.988   6.6940   27.774   6.0476 -1.785719 9.021214 
1 1 1   19    7  -38 o   38.160   3.3379   62.079   10.278   45.246   15.180   76.331   13.968   30.884   6.2445   41.864   4.1475 -10.97946 7.496425 
1 1 1   19    7  -37 o   16.177   5.9670   10.569   10.381   32.090   14.952  -9.4615   14.425   25.521   6.9850   12.451   5.8048 13.07025 9.082136 
1 1 1   19    7  -36 o   12.249   5.0463   3.0790   8.1333   2.5336   14.177   3.3465   9.9298   14.911   6.4258   13.266   5.5302 1.645581 8.477798 
1 1 1   19    7  -35 o   10.768   4.7302  -0.9267   7.9978 -15.9742   14.004   6.3567   9.7429   11.218   5.3721   14.289   5.6502 -3.070626 7.796389 
1 1 1   19    7  -34 o   17.454   5.2649   13.804   8.1125   29.452   14.060   5.9939   9.9327   24.646   6.7847   14.239   5.6808 10.40617 8.848941 
1 1 1   19    7  -33 o   16.952   5.3608   12.856   8.2947  -0.1728   14.394   19.333   10.149   14.389   6.3323   20.374   5.8213 -5.984633 8.601459 
1 1 1   19    7  -32 o   54.351   2.4170  122.852   10.681  119.533   16.708  125.146   13.890   52.769   3.9122   54.486   3.1408 -1.717598 5.016956 
1 1 1   19    7  -31 o   52.769   2.4487  115.850   10.504  135.694   16.953  103.486   13.383   56.394   3.7085   49.433   3.3408 6.961143 4.991381 
1 1 1   19    7  -30 o   30.543   3.7833   40.216   9.2180   26.781   15.104   48.191   11.637   23.486   7.2040   33.165   4.4138 -9.679468 8.448645 
1 1 1   19    7  -29 o   53.345   2.2844  118.030   9.9106  127.920   16.877  112.825   12.244   54.713   3.8079   51.875   2.9071 2.837818 4.790806 
1 1 1   19    7  -28 o   40.783   2.7324   69.598   9.0314   74.456   15.381   67.042   11.157   41.209   4.6605   39.705   3.4825 1.503880 5.817935 
1 1 1   19    7  -27 o   27.457   3.8722   32.624   8.4263   27.992   14.350   35.062   10.410   24.129   6.9307   28.115   4.7087 -3.985220 8.378946 
1 1 1   19    7  -26 o   16.916   5.3262   12.689   8.1964   19.908   14.245   9.1159   10.022   20.803   7.0517   15.600   5.8418 5.202812 9.157142 
1 1 1   19    7  -25 o   31.042   3.8393   41.464   9.5080   37.753   14.770   44.090   12.425   28.281   6.5376   31.472   5.0111 -3.190742 8.237149 
1 1 1   19    7  -24 o   30.022   3.7600   38.717   9.0003   31.275   17.802   41.272   10.432   25.238   7.8352   30.792   4.2709 -5.553795 8.923622 
1 1 1   19    7  -23 o   47.996   2.5585   95.860   9.9738   83.588   19.181  100.408   11.677   43.189   5.5784   48.966   2.9389 -5.776978 6.305222 
1 1 1   19    7  -22 o   17.945   5.3850   14.453   8.5031   15.652   16.996   14.053   9.8206   19.792   7.5629   17.853   5.8505 1.939743 9.561693 
1 1 1   19    7  -21 o   31.267   3.6133   41.742   9.0403   39.666   17.736   42.471   10.508   28.549   7.5186   31.290   4.2279 -2.740631 8.625838 
1 1 1   19    7  -20 o   23.093   5.1560   24.073   9.4598   14.126   28.788   25.278   10.016   21.940   9.2967   23.608   5.3312 -1.668007 10.71684 
1 1 1   19    7  -19 o   36.883   3.1870   57.322   9.4878   40.338   21.549   61.407   10.567   28.312   8.5893   38.082   3.4412 -9.770708 9.253009 
1 1 1   19    7  -18 o   36.621   3.4952   56.866   10.307   7.9064   20.231   74.029   11.978   18.620   7.8366   41.799   3.5491 -23.17894 8.602817 
1 1 1   19    7  -17 o   22.270   5.3343   22.481   9.5559   40.802   14.968   9.8748   12.416   29.660   6.3803   16.756   6.4484 12.90419 9.071410 
1 1 1   19    7  -16 o   12.933   5.1784   4.2648   8.2840   3.7472   16.550   4.4378   9.5691   16.430   7.0083   13.643   5.5292 2.786409 8.926847 
1 1 1   19    7  -15 o   43.293   2.7665   78.167   9.7119   78.858   18.831   77.917   11.336   42.049   5.6357   43.037   3.2554 -0.9882164 6.508387 
1 1 1   19    7  -14 o   59.373   2.2363  145.670   10.804  149.305   20.486  144.270   12.716   59.049   4.2851   58.922   2.6542 0.1273155 5.040573 
1 1 1   19    7  -13 o   99.539   1.8391  407.212   14.922  426.022   27.504  399.365   17.764  100.791   3.3523   98.391   2.2149 2.400482 4.017945 
1 1 1   19    7  -12 o   49.030   2.4602   99.673   9.8012   98.627   17.429  100.157   11.853   47.823   4.5249   48.954   2.9845 -1.131638 5.420509 
1 1 1   19    7  -11 o   31.011   3.2799   40.629   8.1654   40.099   12.981   40.977   10.504   29.890   5.5314   30.765   4.3062 -0.8750286 7.010022 
1 1 1   19    7  -10 o   44.086   2.4967   80.652   8.9357  102.734   14.457   67.001   11.367   49.310   3.6221   39.804   3.5402 9.505802 5.064804 
1 1 1   19    7   -9 o   40.330   2.7217   67.760   8.8952   71.771   14.196   65.167   11.414   40.859   4.3280   39.228   3.6099 1.630947 5.635818 
1 1 1   19    7   -8 o   31.058   3.3735   40.813   8.4037   38.193   13.303   42.553   10.841   29.038   5.8230   31.351   4.3597 -2.313061 7.274221 
1 1 1   19    7   -7 o   47.534   2.3763   93.547   9.1782   71.174   14.163  109.745   12.051   40.691   4.3367   51.306   2.8932 -10.61533 5.213240 
1 1 1   19    7   -6 o   13.459   5.1790   5.7252   8.0077   4.3759   12.969   6.5564   10.180   15.227   6.3317   14.766   5.7948 0.4608135 8.583128 
1 1 1   19    7   -5 o   48.678   2.3606   98.067   9.3390  107.580   14.447   91.237   12.240   50.527   3.5298   46.636   3.2400 3.891499 4.791396 
1 1 1   19    7   -4 o   56.456   2.1336  131.473   9.8011  136.026   14.998  128.079   12.949   56.986   3.2421   55.452   2.8744 1.534172 4.332820 
1 1 1   19    7   -3 o   51.067   2.7276  108.433   11.313  100.819   14.462  120.436   18.159   48.852   3.6584   53.111   4.2294 -4.259075 5.592108 
1 1 1   19    7   -2 o   57.734   2.4996  138.083   11.736  130.154   15.011  150.547   18.821   55.705   3.3209   59.614   3.8944 -3.909428 5.118081 
1 1 1   19    7   -1 o   11.186   4.9552  -2.0450   8.9542   12.876   12.598 -17.2795   12.729   18.026   6.5857   10.475   5.0435 7.550540 8.295068 
1 1 1   19    7    0 o   26.113   3.9735   29.389   8.1917   15.221   12.735   39.388   10.699   18.988   6.6576   30.102   4.4978 -11.11486 8.034546 
1 1 1   19    7    1 o   39.821   2.7212   66.035   8.7799   54.380   13.446   74.699   11.593   35.324   4.7931   42.118   3.4056 -6.793980 5.879797 
1 1 1   19    7    2 o   22.200   4.6406   21.790   8.1269   24.580   12.741   19.876   10.552   23.064   6.4996   20.915   5.9225 2.149412 8.793195 
1 1 1   19    7    3 o   55.297   2.1372  126.139   9.6154  109.839   14.500  138.933   12.846   51.074   3.5041   57.820   2.7333 -6.746071 4.444073 
1 1 1   19    7    4 o   47.216   2.3997   92.318   9.2058   88.766   14.086   94.966   12.163   45.752   3.8114   47.621   3.1510 -1.869530 4.945260 
1 1 1   19    7    5 o   47.386   2.3878   92.974   9.1935   94.537   14.281   91.867   12.014   47.256   3.7378   46.827   3.1661 0.4293938 4.898449 
1 1 1   19    7    6 o   49.276   2.7531  101.035   11.015  102.963   14.517   98.418   16.910   49.376   3.6322   47.893   4.3798 1.483150 5.689919 
1 1 1   19    7    7 o   29.500   4.2460   37.632   9.9166   32.756   12.920   44.621   15.470   26.746   6.0663   31.209   6.2983 -4.463272 8.744662 
1 1 1   19    7    8 o   13.359   5.7217   1.0845   11.112 -28.0079   17.484   20.800   14.393   11.626   5.6703   21.435   7.0856 -9.808520 9.075111 
1 1 1   19    7    9 o   28.627   4.6241   35.853   10.423   56.934   14.626   14.099   14.857   35.965   5.1345   18.994   7.1129 16.97068 8.772432 
1 1 1   19    7   10 o   14.112   5.3331   6.8147   8.3939   7.4437   13.852   6.4497   10.552   16.495   6.6643   14.869   5.8799 1.626554 8.887368 
1 1 1   19    7   11 o   11.970   5.0103   1.8572   8.2004   15.372   13.894  -5.3671   10.158   19.227   6.9317   11.080   5.0585 8.146502 8.581201 
1 1 1   19    7   12 o   42.459   2.6877   75.063   9.2546   80.606   15.482   71.982   11.544   43.234   4.4569   41.289   3.4618 1.944447 5.643382 
1 1 1   19    7   13 o   27.922   3.9338   33.557   8.7056   38.499   14.723   30.900   10.795   28.821   6.4303   26.270   5.2251 2.550989 8.285539 
1 1 1   19    7   14 o   40.668   2.8284   69.066   9.3178   77.642   15.657   64.363   11.595   42.324   4.6128   38.921   3.6990 3.403275 5.912677 
1 1 1   19    7   15 o   15.823   5.3875   10.438   8.3155   32.513   14.018  -1.5473   10.329   26.369   6.5508   12.145   5.3537 14.22413 8.460208 
1 1 1   19    7   16 o   42.942   2.7182   76.866   9.4659   87.446   15.843   70.993   11.805   45.051   4.3690   40.931   3.5739 4.120686 5.644501 
1 1 1   19    7   17 o   24.176   4.8673   26.043   9.2596   35.016   18.857   23.192   10.629   26.732   8.0186   22.488   5.7705 4.243919 9.879076 
1 1 1   19    7   18 o   15.123   5.5408   8.6823   8.9271   9.7322   18.487   8.3631   10.194   18.555   7.6223   15.423   5.8660 3.131967 9.618182 
1 1 1   19    7   19 o   15.238   5.5601   8.9126   8.9755   14.615   18.425   7.1384   10.277   19.851   7.7944   14.960   5.8367 4.891368 9.737587 
1 1 1   19    7   20 o   14.719   5.3586   8.2809   8.3300   10.522   14.289   7.1272   10.253   17.515   6.8679   14.937   5.8291 2.578407 9.008172 
1 1 1   19    7   21 o   23.228   4.7813   24.083   8.7513   31.207   15.142   20.510   10.724   25.537   7.0451   21.092   5.9696 4.444933 9.234156 
1 1 1   19    7   22 o   59.954   2.7882  149.941   13.589  177.142   18.559  118.504   19.953   64.738   3.5303   52.153   4.7453 12.58464 5.914459 
1 1 1   19    7   23 o   31.692   3.5618   42.852   9.0421   33.788   15.571   47.463   11.106   26.509   7.0745   33.090   4.2129 -6.581013 8.233940 
1 1 1   19    7   24 o   11.138   4.8613  -0.6365   8.3287  -6.5702   14.462   2.3078   10.188   13.149   6.0154   13.161   5.5512 -0.1154327E-01 8.185364 
1 1 1   19    7   25 o   16.550   5.4392   11.916   8.4857   22.160   14.630   6.7230   10.417   21.745   7.1417   14.802   5.8457 6.943111 9.229100 
1 1 1   19    7   26 o   48.844   2.5001   99.252   9.9210   92.961   16.540  102.788   12.399   46.271   4.4395   49.446   3.0917 -3.174660 5.410003 
1 1 1   19    7   27 o   12.495   5.2452   2.2385   9.0266   0.5631   18.969   2.7289   10.263   16.439   7.2505   13.308   5.5901 3.131144 9.155280 
1 1 1   19    7   28 o   57.228   2.4202  136.057   11.264  130.307   22.549  137.970   13.003   54.228   5.1634   57.454   2.7847 -3.225853 5.866434 
1 1 1   19    7   29 o   13.585   5.4498   5.0154   9.1929  -7.0381   19.322   8.5422   10.452   15.134   6.9344   15.473   5.9262 -0.3390226 9.121731 
1 1 1   19    7   30 o   11.420   4.9441   0.0772   8.4697   2.2601   14.381  -1.0820   10.480   15.012   6.4704   12.257   5.3982 2.754974 8.426497 
1 1 1   19    7   31 o   29.872   3.7931   38.517   9.0283   50.820   15.484   32.180   11.113   33.174   5.9444   26.574   5.3159 6.599899 7.974607 
1 1 1   19    7   32 o   61.068   2.1979  154.511   10.923  178.044   18.457  141.825   13.551   64.760   3.5094   58.173   2.8666 6.587189 4.531395 
1 1 1   19    7   33 o   17.177   6.1541   12.458   10.932   33.076   15.417  -8.3971   15.505   25.988   7.0846   13.215   6.1115 12.77343 9.356384 
1 1 1   19    7   34 o   29.815   4.3833   39.136   10.335   35.892   15.401   41.793   13.941   27.137   6.9366   29.980   5.9146 -2.842623 9.115871 
1 1 1   19    7   35 o   32.907   4.0672   47.117   10.678   36.254   16.036   55.770   14.313   27.118   7.1528   35.220   5.1365 -8.101961 8.805993 
1 1 1   19    7   36 o   32.294   3.6210   44.852   9.3683   51.796   16.162   41.338   11.497   33.208   6.1985   30.409   4.7968 2.798595 7.837824 
1 1 1   19    7   37 o   39.451   3.0994   65.883   9.8871   61.082   16.740   68.455   12.253   36.337   5.8500   39.842   3.8194 -3.505356 6.986481 
1 1 1   19    7   38 o   43.240   2.8129   78.618   9.8608   85.201   16.728   75.112   12.207   43.818   4.7596   41.847   3.6141 1.971176 5.976214 
1 1 1   19    7   39 o   45.269   2.7280   86.038   10.020   92.984   17.297   82.529   12.292   45.801   4.6995   43.946   3.4593 1.854229 5.835430 
1 1 1   19    7   40 o   13.492   5.3402   5.6308   8.7110   11.861   14.879   2.3815   10.745   17.687   6.9859   13.281   5.6556 4.405821 8.988215 
1 1 1   19    7   41 o   22.810   4.9679   23.889   8.9748   36.088   15.444   17.669   11.028   26.901   6.9829   19.345   6.1886 7.555574 9.330538 
1 1 1   19    7   42 o   16.663   5.8583   12.194   9.8656  -7.7657   14.658   28.724   13.339   12.765   5.9170   24.139   6.5939 -11.37429 8.859440 
1 1 1   19    7   43 o   29.790   4.1450   39.216   9.7931   56.121   17.887   31.980   11.703   33.824   6.7245   25.997   5.6815 7.826555 8.803282 
1 1 1   19    7   44 o   9.1762   4.3579  -9.1893   8.8274 -12.0373   14.497  -7.5112   11.128   11.912   5.6359   10.945   5.1013 0.9671211 7.601752 
1 1 1   19    7   45 o   40.002   3.0680   68.168   9.9279   86.440   16.091   56.936   12.615   43.987   4.5534   35.718   4.4276 8.268810 6.351164 
1 1 1   19    7   46 o   35.243   3.3789   53.560   9.5882   55.970   15.477   52.059   12.214   34.402   5.7199   34.038   4.5133 0.3635445 7.286075 
1 1 1   19    7   47 f   14.949   5.9367   7.9013   10.799   12.385   14.869   2.8952   15.711   17.487   6.9590   15.183   6.6506 2.303791 9.625946 
1 1 1   19    7   48 f   11.075   5.2128  -9.2165   12.111  -9.7264   22.520  -9.0090   14.366   15.193   7.1376   12.228   5.7307 2.964821 9.153461 
1 1 1   19    7   49 o   14.093   6.0764   3.2838   12.691   35.004   24.176  -8.7815   14.910   24.226   9.0732   12.476   5.8443 11.74994 10.79251 
1 1 1   19    7   50 o   18.059   6.7343   15.422   13.289   7.4313   25.648   18.355   15.538   18.310   8.2292   19.272   7.2618 -0.9624214 10.97513 
1 1 1   19    7   51 o   15.187   6.0408   8.7413   11.199   36.043   25.196   2.0204   12.501   24.040   9.2030   13.590   5.9431 10.45075 10.95515 
1 1 1   19    7   52 o   22.106   6.1203   24.816   11.405   18.560   25.540   26.374   12.746   19.986   8.6187   22.492   6.5534 -2.506357 10.82722 
1 1 1   19    7   53 o   25.200   6.4898   33.003   13.412   89.103   26.523   13.730   15.546   39.203   8.5417   17.568   7.0732 21.63498 11.09018 
1 1 1   19    7   54 o   13.998   5.8619   5.5770   11.233  -5.6234   25.164   8.3641   12.553   15.959   7.5124   15.270   6.2777 0.6896276 9.790058 
1 1 1   19    7   55 o   17.646   6.2382   15.524   11.198   43.584   24.072   7.7754   12.650   25.569   9.1353   15.062   6.2573 10.50749 11.07285 
1 1 1   19    7   56 o   32.544   4.6789   49.499   12.056   47.024   26.995   50.116   13.474   25.604   9.5879   32.173   5.3238 -6.569414 10.96677 
1 1 1   19    7   57 f   15.043   6.0076   9.2593   11.120   18.966   23.691   6.5165   12.593   19.237   8.2982   14.549   6.1562 4.687285 10.33241 
1 1 1   19    7   58 o   14.335   5.8815   7.4997   10.990 -26.4261   22.314   18.363   12.627   12.657   6.2212   18.549   6.6176 -5.891416 9.082673 
1 1 1   19    7   59 o   22.015   6.0258   25.578   11.127   1.6839   24.250   31.950   12.523   16.177   7.5366   24.479   6.2540 -8.301683 9.793498 
1 1 1   19    7   60 o   13.997   5.8003   6.9688   10.831  -1.8941   24.082   9.2160   12.126   15.564   7.3333   15.041   6.1755 0.5225773 9.587150 
1 1 1   19    7   61 o   15.861   6.1365   12.123   11.287   26.300   25.319   8.6076   12.609   20.045   8.6120   14.906   6.2241 5.139636 10.62567 
1 1 1   19    7   62 o   11.902   5.6317  -7.8163   14.485   0.0000   0.0000  -7.8163   14.485  ?   ?    11.902   5.6317 0.000000 5.631711 
1 1 1   19    7   63 o   23.137   8.3892   37.096   20.388   0.0000   0.0000   37.096   20.388  ?   ?    23.137   8.3892 0.000000 8.389231 
1 1 1   19    7   64 o   19.542   7.3625   23.179   15.970   42.510   27.089   12.881   19.772   22.863   9.2893   16.936   7.4385 5.926634 11.90049 
1 1 1   19    7   65 o   27.198   7.4601   44.904   17.034   24.487   27.678   57.352   21.611   19.322   8.6264   29.122   8.5468 -9.799395 12.14343 
1 1 1   19    7   66 o   26.955   7.4603   44.417   16.948   15.367   28.313   60.641   21.158   17.917   8.2765   30.426   8.3018 -12.50920 11.72260 
1 1 1   19    7   67 o   24.541   7.5513   38.079   16.579   45.788   28.757   34.241   20.290   22.790   9.4482   21.919   8.2896 0.8709850 12.56926 
1 1 1   19    7   68 o   18.239   7.2991   20.035   16.449   2.5214   27.776   29.495   20.414   16.133   7.6811   20.462   8.1505 -4.329550 11.19952 
1 1 1   19    7   69 o   21.610   7.5366   30.514   16.307   18.500   27.510   37.023   20.247   18.001   8.2578   22.528   8.3290 -4.527138 11.72871 
1 1 1   19    7   70 o   18.676   8.5122   23.468   28.612   23.468   28.612   0.0000   0.0000   18.676   8.5122  ?   ?  0.000000 8.512200 
1 1 1   19    7   71 o   28.882   10.074   74.682   29.136   74.682   29.136   0.0000   0.0000   28.882   10.074  ?   ?  0.000000 10.07406 
1 1 1   19    7   72 o   12.945   6.4459 -30.7743   26.968 -30.7743   26.968   0.0000   0.0000   12.945   6.4459  ?   ?  0.000000 6.445946 
1 1 1   19    7   73 o   13.718   6.7591 -19.2598   26.885 -19.2598   26.885   0.0000   0.0000   13.718   6.7591  ?   ?  0.000000 6.759099 
1 1 1   19    7   74 o   11.853   5.9635 -43.7793   26.044 -43.7793   26.044   0.0000   0.0000   11.853   5.9635  ?   ?  0.000000 5.963528 
1 1 1   19    7   75 o   13.472   6.6638 -21.8268   27.020 -21.8268   27.020   0.0000   0.0000   13.472   6.6638  ?   ?  0.000000 6.663796 
1 1 1   19    7   76 o   13.775   6.7785 -16.6828   26.747 -16.6828   26.747   0.0000   0.0000   13.775   6.7785  ?   ?  0.000000 6.778486 
1 1 1   19    7   77 o   13.935   6.8142 -11.8638   25.729 -11.8638   25.729   0.0000   0.0000   13.935   6.8142  ?   ?  0.000000 6.814178 
1 1 1   19    7   78 o   12.954   6.4106 -21.8321   25.119 -21.8321   25.119   0.0000   0.0000   12.954   6.4106  ?   ?  0.000000 6.410612 
1 1 1   19    7   79 o   19.390   8.5263   32.305   26.050   32.305   26.050   0.0000   0.0000   19.390   8.5263  ?   ?  0.000000 8.526273 
1 1 1   19    7   80 o   10.453   5.3057 -55.8276   23.542 -55.8276   23.542   0.0000   0.0000   10.453   5.3057  ?   ?  0.000000 5.305740 
1 1 1   19    7   81 o   15.128   7.2784   0.4327   26.396   0.4327   26.396   0.0000   0.0000   15.128   7.2784  ?   ?  0.000000 7.278441 
1 1 1   19    8  -71 o   19.243   7.4048   25.317   16.370   18.741   22.648   32.512   23.688   17.279   7.7520   19.826   8.4183 -2.547010 11.44386 
1 1 1   19    8  -70 o   15.461   6.7407   11.154   15.975   7.1949   21.527   16.007   23.834   15.425   7.1571   16.953   7.7429 -1.527978 10.54405 
1 1 1   19    8  -69 o   10.890   5.3188 -15.8798   15.543  -3.0630   20.834 -31.9703   23.343   13.943   6.6424   11.862   5.9209 2.080954 8.898280 
1 1 1   19    8  -68 o   13.229   6.1412  -0.1880   15.879   25.044   21.154 -32.7617   24.035   18.744   7.9569   12.006   5.9950 6.738252 9.962547 
1 1 1   19    8  -67 o   13.524   6.2501   0.8702   16.173   8.3926   21.897  -8.1607   23.992   15.784   7.2866   14.081   6.8149 1.703342 9.976878 
1 1 1   19    8  -66 o   19.747   7.4508   25.910   16.369   21.475   21.652   31.827   25.007   18.123   7.8752   19.950   8.5646 -1.826080 11.63494 
1 1 1   19    8  -65 o   18.321   7.2379   21.021   15.974   29.302   20.993   9.6327   24.620   19.989   8.1566   16.374   7.6167 3.614864 11.15995 
1 1 1   19    8  -64 o   19.813   7.3995   25.544   16.057   35.394   21.865   14.015   23.656   21.455   8.4705   16.994   7.7432 4.461185 11.47634 
1 1 1   19    8  -63 o   16.061   6.7898   12.792   15.296   24.959   20.544  -2.3449   22.914   19.104   7.9584   14.670   6.9825 4.433528 10.58732 
1 1 1   19    8  -62 o   14.073   5.8923   7.8182   11.346  -3.0928   19.562   13.349   13.928   13.907   6.5699   16.142   6.6218 -2.234490 9.328034 
1 1 1   19    8  -61 o   12.740   5.6016   3.2017   11.241 -15.2771   19.476   12.433   13.765   12.443   6.0495   15.906   6.5601 -3.462892 8.923627 
1 1 1   19    8  -60 o   19.059   6.7793   21.399   13.243   28.058   19.471   15.667   18.064   20.274   7.9966   17.162   7.3214 3.111578 10.84198 
1 1 1   19    8  -59 o   26.294   6.5507   38.883   13.988   28.839   20.422   47.762   19.200   20.449   8.1497   26.899   8.0963 -6.450245 11.48775 
1 1 1   19    8  -58 o   18.421   6.2591   18.816   11.223   18.027   14.211   20.124   18.296   17.847   6.8909   18.394   7.5722 -0.5466423 10.23827 
1 1 1   19    8  -57 o   26.131   5.6569   35.453   11.700   30.287   14.682   44.441   19.365   22.399   7.1379   25.781   8.1957 -3.382137 10.86828 
1 1 1   19    8  -56 o   9.0761   4.5059 -23.6187   12.790 -23.4283   18.922 -23.7789   17.356   11.578   5.6981   10.990   5.4180 0.5878744 7.862773 
1 1 1   19    8  -55 o   11.004   5.0799  -3.4908   10.642 -17.5272   20.493   1.6920   12.453   12.696   6.1803   12.935   5.7798 -0.2389317 8.461805 
1 1 1   19    8  -54 o   10.035   4.7071  -5.9405   9.7296   3.7544   16.169 -11.4440   12.182   14.533   6.5327   10.332   4.9640 4.201737 8.204715 
1 1 1   19    8  -53 o   15.410   5.5464   11.588   8.8913   10.628   12.583   12.546   12.565   15.518   6.3215   16.148   6.4066 -0.6292334 9.000269 
1 1 1   19    8  -52 o   11.580   4.9992   2.1136   8.6109   14.095   12.314  -9.3510   12.045   16.742   6.4274   10.648   5.0665 6.093755 8.184210 
1 1 1   19    8  -51 o   14.364   5.4710   9.0771   8.8755   10.719   12.769   7.5418   12.346   15.716   6.3804   14.641   6.1394 1.074370 8.854494 
1 1 1   19    8  -50 o   10.730   4.7887  -0.7044   8.5213   6.4677   12.061  -7.8531   12.041   14.303   6.0369   10.969   5.1737 3.333504 7.950517 
1 1 1   19    8  -49 f   16.218   5.8374   12.732   9.8490   8.8133   16.141   15.056   12.432   16.009   6.8770   17.338   6.5036 -1.328548 9.465200 
1 1 1   19    8  -48 o   33.468   4.0120   50.684   10.727   47.232   17.652   52.706   13.508   28.921   7.4441   33.115   5.1731 -4.193768 9.065078 
1 1 1   19    8  -47 o   17.480   5.8446   15.227   9.7864  -0.7990   15.791   25.220   12.470   13.949   6.3445   21.756   6.5195 -7.806613 9.097048 
1 1 1   19    8  -46 o   11.806   5.1776   0.7795   9.5469  -0.6712   16.015   1.5792   11.890   14.096   6.4026   13.072   5.7540 1.023471 8.608240 
1 1 1   19    8  -45 o   23.807   5.2717   27.506   9.9601   38.213   16.894   21.801   12.331   26.030   7.5334   20.378   6.5465 5.652025 9.980415 
1 1 1   19    8  -44 o   36.109   3.6114   57.441   10.487   61.062   17.294   55.335   13.189   34.769   6.3353   34.471   4.8258 0.2978210 7.963916 
1 1 1   19    8  -43 o   12.169   5.4845  -1.7107   11.483   9.1133   16.737 -11.3376   15.784   16.599   7.0631   12.312   5.8413 4.287157 9.165576 
1 1 1   19    8  -42 o   24.584   5.9229   30.074   11.728   17.148   17.139   41.455   16.083   18.907   7.4884   27.954   7.0578 -9.046999 10.29023 
1 1 1   19    8  -41 o   11.982   5.3026  -0.2500   10.227   8.3480   13.813 -10.6840   15.216   15.794   6.5481   12.239   5.7855 3.555733 8.737801 
1 1 1   19    8  -40 o   17.993   5.8569   15.655   9.8500   14.997   14.557   16.210   13.378   18.084   6.9763   18.383   6.7749 -0.2994709 9.724616 
1 1 1   19    8  -39 o   28.816   4.1705   37.226   9.5117   39.321   14.973   35.808   12.316   27.764   6.6943   27.208   5.7344 0.5558281 8.814599 
1 1 1   19    8  -38 o   36.955   3.2549   58.810   9.7051   60.118   15.466   57.961   12.465   35.722   5.4864   35.963   4.3397 -0.2408257 6.995227 
1 1 1   19    8  -37 o   11.003   4.8799  -1.0646   8.7084   2.0076   14.080  -2.9678   11.082   14.368   6.2948   11.830   5.3545 2.538351 8.264104 
1 1 1   19    8  -36 o   23.599   4.9155   25.840   9.1481   28.285   14.848   24.344   11.614   23.358   7.1387   22.197   6.1879 1.161400 9.447313 
1 1 1   19    8  -35 o   24.140   4.8008   26.816   9.1144   34.768   14.911   22.072   11.516   26.130   6.8997   21.171   6.2460 4.958925 9.306884 
1 1 1   19    8  -34 o   17.995   5.3296   15.197   8.3716  -0.0948   14.070   23.577   10.416   13.966   6.1978   22.149   5.7270 -8.182953 8.438713 
1 1 1   19    8  -33 o   8.6340   4.1278  -9.6861   8.1948 -18.9152   14.137  -5.0159   10.057   10.739   5.2055   10.849   4.9827 -0.1099005 7.205850 
1 1 1   19    8  -32 o   10.989   4.8048  -0.2700   8.1677   5.4973   14.021  -3.2324   10.049   15.413   6.5074   11.285   5.1041 4.128386 8.270339 
1 1 1   19    8  -31 o   47.934   2.4769   96.162   9.6453   96.127   16.433   96.181   11.913   46.671   4.3704   47.598   3.0871 -0.9271431 5.350744 
1 1 1   19    8  -30 o   9.6820   4.4556  -4.7616   8.0963 -27.6368   14.073   6.5563   9.8986   9.7355   4.8143   14.297   5.6817 -4.561313 7.447124 
1 1 1   19    8  -29 o   12.959   5.1445   5.0477   8.1064   12.213   14.258   1.6249   9.8541   17.604   6.8728   12.581   5.3882 5.023031 8.733200 
1 1 1   19    8  -28 o   16.621   5.3329   12.495   8.1847   17.366   14.422   10.181   9.9405   19.447   7.0551   15.812   5.8378 3.634664 9.157184 
1 1 1   19    8  -27 o   25.636   4.2235   29.138   8.5187   24.517   14.734   31.459   10.441   22.252   7.1568   26.225   5.0674 -3.972269 8.769160 
1 1 1   19    8  -26 o   9.5598   4.4529  -6.4134   8.4587  -1.7020   14.314  -8.9414   10.485   13.880   6.1998   10.349   4.8647 3.531036 7.880506 
1 1 1   19    8  -25 o   17.313   5.8456   13.432   9.7882   2.7560   20.018   16.786   11.221   16.941   7.4609   19.005   6.2552 -2.064032 9.736150 
1 1 1   19    8  -24 o   32.603   4.7262   47.442   12.195   29.745   20.894   56.584   15.018   24.052   8.5194   35.212   5.4045 -11.16001 10.08911 
1 1 1   19    8  -23 o   36.885   3.3325   58.003   9.9118   46.384   21.642   61.086   11.150   29.564   8.5175   37.684   3.6764 -8.120159 9.277101 
1 1 1   19    8  -22 o   29.782   3.7418   38.383   8.8837   47.577   16.017   34.299   10.676   31.592   6.4384   27.558   4.9339 4.034258 8.111490 
1 1 1   19    8  -21 o   35.290   3.1841   52.881   9.0610   55.001   16.436   51.955   10.860   34.293   6.1035   34.629   3.9161 -0.3361320 7.251755 
1 1 1   19    8  -20 o   23.030   4.8327   24.025   8.7827   12.479   15.988   29.016   10.511   18.283   7.2353   25.140   5.2963 -6.857361 8.966649 
1 1 1   19    8  -19 o   23.654   4.6850   25.162   8.7138   22.807   15.866   26.180   10.427   21.779   7.4411   23.770   5.4919 -1.990438 9.248348 
1 1 1   19    8  -18 o   34.222   3.2820   49.830   9.0432   64.722   16.617   43.563   10.779   37.680   5.5784   31.504   4.3103 6.175989 7.049608 
1 1 1   19    8  -17 o   41.514   2.8070   72.357   9.4430   81.425   16.701   68.096   11.449   42.852   4.8674   39.917   3.5557 2.935394 6.027794 
1 1 1   19    8  -16 o   23.769   4.6299   25.315   8.6478   8.0286   15.271   33.477   10.492   16.828   6.9217   27.289   4.8969 -10.46071 8.478779 
1 1 1   19    8  -15 o   46.072   2.5997   88.665   9.7236   77.997   16.747   94.090   11.943   41.856   5.0077   47.215   3.1206 -5.359257 5.900438 
1 1 1   19    8  -14 o   45.813   2.6079   87.677   9.6986   94.421   16.598   84.181   11.951   46.513   4.4312   44.556   3.3143 1.957664 5.533542 
1 1 1   19    8  -13 o   19.412   6.0514   17.425   10.607   20.003   17.600   15.955   13.292   21.013   7.7660   19.013   6.7888 1.999960 10.31501 
1 1 1   19    8  -12 o   34.611   3.3787   51.022   9.4111   25.065   18.667   59.869   10.897   22.769   8.0537   37.401   3.6197 -14.63173 8.829730 
1 1 1   19    8  -11 o   52.991   2.4808  116.926   10.686  117.937   20.767  116.561   12.463   51.600   5.0000   52.699   2.9125 -1.099041 5.786400 
1 1 1   19    8  -10 o   11.487   4.9926  -0.1373   8.7073  -6.7837   17.157   2.1684   10.105   14.250   6.5313   13.005   5.5092 1.244902 8.544498 
1 1 1   19    8   -9 o   41.256   4.2578   73.961   14.113   0.0000   0.0000   73.961   14.113  ?   ?    41.256   4.2578 0.000000 4.257781 
1 1 1   19    8   -8 o   66.831   3.0846  187.834   16.759  155.964   29.817  202.552   20.262   58.013   6.4120   69.012   3.6144 -10.99903 7.360567 
1 1 1   19    8   -7 f   21.261   6.3734   21.303   11.916   49.054   24.133   12.357   13.702   30.341   9.0644   17.798   6.7932 12.54296 11.32739 
1 1 1   19    8   -6 o   50.402   2.7580  106.285   11.288  125.487   14.747   79.117   17.541   54.459   3.3381   42.067   5.2279 12.39200 6.202756 
1 1 1   19    8   -5 o   62.756   2.0090  162.689   10.264  196.515   16.216  140.079   13.258   68.484   2.9114   57.851   2.8199 10.63348 4.053133 
1 1 1   19    8   -4 o   18.924   5.4728   16.404   8.9193   18.768   13.348   14.496   11.989   20.188   6.8262   18.264   6.4549 1.924074 9.394846 
1 1 1   19    8   -3 o   42.069   2.8494   74.257   9.7136   71.143   14.101   77.069   13.400   40.422   4.3479   42.330   3.9283 -1.907825 5.859689 
1 1 1   19    8   -2 o   29.444   3.9052   37.541   9.1419   36.309   13.567   38.565   12.373   27.831   6.1447   29.112   5.4130 -1.281076 8.188896 
1 1 1   19    8   -1 o   13.690   5.3327   5.9830   8.5682   13.960   12.852  -0.3983   11.495   18.211   6.6521   12.987   5.6887 5.224124 8.752822 
1 1 1   19    8    0 o   21.579   4.7641   20.990   8.1559   25.825   13.033   17.879   10.456   23.256   6.5808   19.669   5.9864 3.586855 8.896318 
1 1 1   19    8    1 o   25.830   4.1189   29.204   8.3815   24.908   13.694   31.778   10.599   22.791   6.8324   26.526   5.0868 -3.734585 8.518043 
1 1 1   19    8    2 o   22.775   4.5755   23.177   8.1993   12.028   13.360   29.915   10.385   17.610   6.7110   25.693   5.1384 -8.082996 8.452267 
1 1 1   19    8    3 o   32.027   3.2894   43.608   8.4655   60.420   13.673   33.158   10.780   37.066   4.6258   27.119   5.0627 9.946989 6.857755 
1 1 1   19    8    4 o   18.416   5.1594   15.436   8.0529   31.703   13.281   5.9774   10.127   25.860   6.3479   14.348   5.7321 11.51229 8.552957 
1 1 1   19    8    5 o   37.869   2.8881   60.280   8.8478   60.430   13.983   60.180   11.426   36.996   4.7458   37.431   3.7973 -0.4344025 6.078004 
1 1 1   19    8    6 o   48.643   2.3570   98.323   9.3181   87.571   14.638  105.649   12.083   45.077   4.0259   50.149   2.9690 -5.071545 5.002335 
1 1 1   19    8    7 f   17.530   5.2787   13.886   8.1602   20.500   13.436   10.021   10.271   20.900   6.8430   16.001   5.9293 4.898787 9.054456 
1 1 1   19    8    8 o   13.579   5.2340   6.1250   8.1885  -2.4782   13.033   11.736   10.525   13.235   5.9135   16.796   6.0359 -3.561117 8.449968 
1 1 1   19    8    9 o   36.594   3.0096   56.480   8.8984   45.685   14.065   63.684   11.490   31.567   5.6748   38.551   3.7018 -6.983788 6.775439 
1 1 1   19    8   10 o   45.682   2.5168   87.006   9.3357  103.542   14.921   76.368   11.967   49.196   3.7491   42.346   3.4982 6.849579 5.127646 
1 1 1   19    8   11 o   29.416   3.9939   37.611   9.3296   23.478   16.584   44.155   11.285   22.143   7.6065   31.661   4.4990 -9.517246 8.837394 
1 1 1   19    8   12 o   36.209   3.4914   55.960   10.177   56.618   20.746   55.751   11.679   33.717   7.7158   35.859   4.0674 -2.141869 8.722209 
1 1 1   19    8   13 o   15.796   5.8997   9.6270   10.208   8.4858   19.173   10.078   12.059   18.127   7.6290   16.516   6.3553 1.611023 9.929378 
1 1 1   19    8   14 o   14.654   5.5718   7.7213   9.1957   0.0810   14.727   12.603   11.773   14.586   6.4126   17.408   6.3654 -2.822295 9.035437 
1 1 1   19    8   15 o   14.729   5.5995   7.8290   9.2867   20.341   15.024   0.0928   11.814   20.864   7.2366   13.246   5.7855 7.617502 9.265046 
1 1 1   19    8   16 o   39.440   2.9266   65.489   9.3416   74.928   16.076   60.677   11.479   41.083   4.8966   37.546   3.8028 3.536953 6.199836 
1 1 1   19    8   17 o   28.187   3.9394   34.573   8.8047   38.982   15.379   32.423   10.739   28.407   6.7431   26.729   5.1149 1.677927 8.463538 
1 1 1   19    8   18 o   10.910   4.9862  -4.8807   9.9055   20.506   19.677 -13.4978   11.464   21.351   8.1427   10.177   4.8698 11.17452 9.487856 
1 1 1   19    8   19 o   16.116   5.6398   11.030   9.1363   2.2179   19.499   13.508   10.342   16.786   7.3792   17.496   6.0068 -0.7103424 9.514941 
1 1 1   19    8   20 o   14.456   5.5498   7.3424   9.1805  -7.6229   19.699   11.495   10.376   15.061   6.9380   16.593   5.9892 -1.532072 9.165457 
1 1 1   19    8   21 o   27.937   4.0549   34.149   8.9647   38.571   15.856   32.071   10.869   28.049   6.9665   26.494   5.2183 1.554918 8.704185 
1 1 1   19    8   22 o   23.364   4.7287   24.652   8.6965   11.225   15.363   30.983   10.550   17.714   7.0657   26.052   5.1504 -8.337193 8.743596 
1 1 1   19    8   23 o   18.547   5.3681   15.872   8.5781   5.0837   15.164   20.949   10.402   15.903   6.7433   21.078   5.8488 -5.174836 8.926409 
1 1 1   19    8   24 o   20.699   5.1553   19.777   8.6654   19.131   15.498   20.070   10.452   20.310   7.3211   20.616   5.9128 -0.3063297 9.410553 
1 1 1   19    8   25 o   14.792   5.4589   8.5839   8.6909   5.8054   15.260   9.9177   10.573   16.090   6.7908   15.918   5.9921 0.1721783 9.056489 
1 1 1   19    8   26 o   41.938   2.8368   74.084   9.6407   72.184   16.394   75.089   11.919   39.969   5.1515   41.859   3.5260 -1.889698 6.242655 
1 1 1   19    8   27 o   10.314   4.7755  -6.1491   9.5085   10.366   14.675 -18.1013   12.484   17.164   6.8855   10.032   4.8695 7.132422 8.433433 
1 1 1   19    8   28 o   21.892   6.0002   22.941   11.024   34.084   19.967   18.056   13.221   25.334   8.3444   19.603   6.7892 5.731491 10.75742 
1 1 1   19    8   29 o   26.078   4.9927   31.094   10.227   47.520   15.518   18.483   13.597   31.509   6.2626   19.776   6.8829 11.73260 9.305614 
1 1 1   19    8   30 o   27.609   4.1948   33.760   9.1438   32.746   15.643   34.287   11.270   25.399   7.2172   27.237   5.2663 -1.838333 8.934300 
1 1 1   19    8   31 o   29.596   3.8782   38.340   9.1312   48.773   15.629   32.933   11.251   31.867   6.2402   26.586   5.3766 5.280596 8.236961 
1 1 1   19    8   32 o   11.554   5.0119   0.4332   8.7384 -19.1897   15.042   10.429   10.736   11.169   5.4032   16.032   6.0373 -4.863349 8.102111 
1 1 1   19    8   33 o   34.619   3.4253   51.644   9.5393   37.891   15.607   59.845   12.053   27.359   6.9774   36.890   4.0760 -9.530697 8.080736 
1 1 1   19    8   34 o   13.552   5.5352   5.0127   9.6793   12.768   14.952  -0.5824   12.699   17.741   7.0044   13.258   5.8856 4.483352 9.148890 
1 1 1   19    8   35 o   64.865   2.2903  175.608   12.091  170.904   22.011  177.641   14.469   62.099   4.3763   64.913   2.7406 -2.813560 5.163634 
1 1 1   19    8   36 o   18.429   5.6448   16.192   9.2775   12.694   15.274   18.238   11.679   17.692   7.0490   19.348   6.3821 -1.655718 9.508941 
1 1 1   19    8   37 o   12.710   5.2549   3.8746   8.8616   13.395   14.609  -1.6672   11.146   17.732   6.9470   12.178   5.4528 5.553927 8.831416 
1 1 1   19    8   38 o   24.075   4.9161   26.995   9.3211   33.541   15.645   23.393   11.606   25.213   7.2351   21.651   6.2372 3.561951 9.552439 
1 1 1   19    8   39 o   18.864   6.0284   17.391   10.466   22.676   17.550   14.473   13.039   20.880   7.7481   17.763   6.6610 3.117378 10.21772 
1 1 1   19    8   40 o   33.891   4.0820   51.220   11.050   76.419   18.730   37.767   13.685   39.710   5.9711   27.496   6.2483 12.21461 8.642594 
1 1 1   19    8   41 o   28.616   4.8897   38.126   10.997   48.224   18.371   32.487   13.727   29.798   7.5544   25.078   6.6195 4.719873 10.04423 
1 1 1   19    8   42 o   24.767   5.4000   29.608   10.594   26.102   17.439   31.659   13.337   21.741   7.7745   24.768   6.5184 -3.027443 10.14555 
1 1 1   19    8   43 o   16.059   6.1939   11.133   11.473   45.097   24.690   1.7790   12.957   26.354   9.2676   13.648   6.0069 12.70589 11.04404 
1 1 1   19    8   44 o   40.961   3.7592   74.237   12.412  122.872   26.007   59.891   14.124   49.006   6.6843   35.735   4.9842 13.27043 8.337996 
1 1 1   19    8   45 o   17.720   6.7213   15.232   13.362   41.898   24.309   3.6884   15.994   25.219   9.1581   15.034   6.6432 10.18484 11.31382 
1 1 1   19    8   46 o   11.244   5.1623  -3.8945   10.781 -41.2890   23.474   6.1019   12.137   12.027   5.9929   14.418   6.0691 -2.391230 8.529237 
1 1 1   19    8   47 o   16.412   6.1150   12.700   10.953   21.607   22.937   10.069   12.466   19.959   8.3686   15.705   6.3301 4.254202 10.49302 
1 1 1   19    8   48 o   14.296   5.8696   7.1127   10.955 -14.5684   23.377   13.214   12.401   14.266   6.8600   16.728   6.4428 -2.461689 9.411068 
1 1 1   19    8   49 f   20.920   6.8255   24.155   13.373  -5.5664   23.696   38.045   16.200   15.318   7.2346   25.781   7.3507 -10.46318 10.31369 
1 1 1   19    8   50 o   15.108   6.0280   9.6247   11.185 -20.7147   22.651   19.409   12.863   13.279   6.4714   18.939   6.6867 -5.659736 9.305460 
1 1 1   19    8   51 o   22.985   6.7925   29.616   13.611   36.873   26.012   26.880   15.971   22.554   9.1250   21.255   7.4554 1.299257 11.78342 
1 1 1   19    8   52 o   28.519   6.0619   42.514   13.658   60.153   25.713   35.582   16.119   28.566   9.4717   24.398   7.4344 4.168104 12.04088 
1 1 1   19    8   53 o   12.299   5.6462  -2.2216   12.891   1.5216   24.728  -3.6184   15.106   16.028   7.5138   12.859   5.9763 3.169156 9.600711 
1 1 1   19    8   54 o   27.895   5.3342   39.001   11.687   78.774   25.653   28.584   13.129   34.021   9.0808   22.434   6.6818 11.58764 11.27413 
1 1 1   19    8   55 o   16.406   6.4794   13.509   12.799   0.0000   0.0000   13.509   12.799  ?   ?    16.406   6.4794 0.000000 6.479414 
1 1 1   19    8   56 o   20.771   6.7019   24.909   12.914   0.0000   0.0000   24.909   12.914  ?   ?    20.771   6.7019 0.000000 6.701944 
1 1 1   19    8   57 o   17.786   6.9924   17.758   14.844   0.0000   0.0000   17.758   14.844  ?   ?    17.786   6.9924 0.000000 6.992416 
1 1 1   19    8   58 o   20.131   7.2446   24.870   15.169   0.0000   0.0000   24.870   15.169  ?   ?    20.131   7.2446 0.000000 7.244649 
1 1 1   19    8   59 o   12.466   5.8202  -3.8936   14.589   0.0000   0.0000  -3.8936   14.589  ?   ?    12.466   5.8202 0.000000 5.820245 
1 1 1   19    8   60 o   10.338   4.9831 -11.7779   12.512 -18.2742   26.876  -9.9802   14.138   14.038   6.8852   11.297   5.4067 2.740761 8.754332 
1 1 1   19    8   61 o   12.469   5.6899  -0.2838   12.833  -7.1746   28.085   1.5347   14.427   15.175   7.3514   13.358   6.0713 1.816680 9.534364 
1 1 1   19    8   62 o   13.355   5.9176   3.8600   12.777  -6.1312   27.742   6.5501   14.395   15.153   7.3324   14.406   6.3365 0.7462482 9.690945 
1 1 1   19    8   63 o   9.2988   4.5900 -19.7864   12.588 -47.2780   28.020 -12.8351   14.090   12.222   6.1539   10.810   5.2295 1.412115 8.075727 
1 1 1   19    8   64 o   26.292   6.6014   39.820   14.126   12.415   29.197   48.195   16.140   17.167   8.0844   28.503   6.9990 -11.33521 10.69321 
1 1 1   19    8   65 o   15.055   6.3528   10.170   13.352   20.183   28.557   7.3684   15.104   18.021   8.3202   14.648   6.4649 3.373025 10.53661 
1 1 1   19    8   66 o   11.773   5.5149  -4.1383   13.277   10.618   28.163  -8.3553   15.056   16.750   7.9037   11.744   5.6094 5.005291 9.691957 
1 1 1   19    8   67 o   21.807   7.9023   33.864   18.087   3.4682   29.124   52.946   23.076   16.005   7.6859   25.641   8.9639 -9.636192 11.80777 
1 1 1   19    8   68 o   13.889   6.6317  -4.0404   21.007   0.0000   0.0000  -4.0404   21.007  ?   ?    13.889   6.6317 0.000000 6.631658 
1 1 1   19    8   69 o   11.071   5.5327 -32.5644   20.645   0.0000   0.0000 -32.5644   20.645  ?   ?    11.071   5.5327 0.000000 5.532697 
1 1 1   19    8   70 o   12.954   6.3080 -12.7833   21.404   0.0000   0.0000 -12.7833   21.404  ?   ?    12.954   6.3080 0.000000 6.308003 
1 1 1   19    8   71 o   12.541   6.1374 -15.5366   21.001   0.0000   0.0000 -15.5366   21.001  ?   ?    12.541   6.1374 0.000000 6.137425 
1 1 1   19    8   72 o   14.723   6.9275   3.1908   21.360   0.0000   0.0000   3.1908   21.360  ?   ?    14.723   6.9275 0.000000 6.927510 
1 1 1   19    8   73 o   13.575   6.5028  -4.2501   20.555   0.0000   0.0000  -4.2501   20.555  ?   ?    13.575   6.5028 0.000000 6.502764 
1 1 1   19    8   74 o   12.112   5.9768 -20.1960   21.284   0.0000   0.0000 -20.1960   21.284  ?   ?    12.112   5.9768 0.000000 5.976779 
1 1 1   19    9  -68 o   12.196   6.0467 -22.9390   22.735   0.0000   0.0000 -22.9390   22.735  ?   ?    12.196   6.0467 0.000000 6.046676 
1 1 1   19    9  -67 o   11.329   5.6852 -35.8018   22.899   0.0000   0.0000 -35.8018   22.899  ?   ?    11.329   5.6852 0.000000 5.685187 
1 1 1   19    9  -66 o   16.245   7.5423   12.933   23.964   0.0000   0.0000   12.933   23.964  ?   ?    16.245   7.5423 0.000000 7.542335 
1 1 1   19    9  -65 o   26.927   9.3675   63.977   25.184   0.0000   0.0000   63.977   25.184  ?   ?    26.927   9.3675 0.000000 9.367527 
1 1 1   19    9  -64 o   10.202   5.1801 -55.3565   22.556   0.0000   0.0000 -55.3565   22.556  ?   ?    10.202   5.1801 0.000000 5.180081 
1 1 1   19    9  -63 o   22.754   9.0924   47.717   25.487   0.0000   0.0000   47.717   25.487  ?   ?    22.754   9.0924 0.000000 9.092420 
1 1 1   19    9  -62 o   21.680   8.8892   42.166   25.083   0.0000   0.0000   42.166   25.083  ?   ?    21.680   8.8892 0.000000 8.889235 
1 1 1   19    9  -61 f   13.582   6.6208 -11.7243   23.748   0.0000   0.0000 -11.7243   23.748  ?   ?    13.582   6.6208 0.000000 6.620830 
1 1 1   19    9  -60 o   15.439   7.2902   4.4317   24.035   0.0000   0.0000   4.4317   24.035  ?   ?    15.439   7.2902 0.000000 7.290160 
1 1 1   19    9  -59 o   15.168   7.1850   2.2308   23.699   0.0000   0.0000   2.2308   23.699  ?   ?    15.168   7.1850 0.000000 7.185015 
1 1 1   19    9  -58 o   16.796   6.8483   16.046   14.785   0.0000   0.0000   16.046   14.785  ?   ?    16.796   6.8483 0.000000 6.848264 
1 1 1   19    9  -57 o   20.083   7.2450   26.058   15.182   0.0000   0.0000   26.058   15.182  ?   ?    20.083   7.2450 0.000000 7.245048 
1 1 1   19    9  -56 o   18.405   7.1103   21.057   15.137   0.0000   0.0000   21.057   15.137  ?   ?    18.405   7.1103 0.000000 7.110271 
1 1 1   19    9  -55 o   14.944   6.1489   10.360   12.056   6.4013   20.330   12.507   14.973   15.391   7.0748   15.916   6.7224 -0.5242090 9.759307 
1 1 1   19    9  -54 o   14.038   5.9670   7.3662   11.923   25.898   20.556  -2.0299   14.637   19.334   7.9993   12.682   5.8902 6.651814 9.933943 
1 1 1   19    9  -53 o   15.323   6.1946   11.330   11.977 -21.5020   20.236   29.032   14.859   12.021   5.9115   21.506   7.2019 -9.485039 9.317321 
1 1 1   19    9  -52 o   24.705   6.0706   33.345   12.136   34.206   20.591   32.887   15.023   21.684   8.3149   23.055   7.2039 -1.371496 11.00151 
1 1 1   19    9  -51 o   10.624   5.0469  -8.0146   11.853   1.5797   20.404 -12.9018   14.562   14.864   6.9208   11.060   5.3424 3.803136 8.742931 
1 1 1   19    9  -50 o   14.994   6.1719   9.9216   12.153   30.845   21.272  -0.2163   14.807   20.806   8.3091   13.190   6.0537 7.616192 10.28048 
1 1 1   19    9  -49 o   13.952   5.8009   7.4223   10.884   9.1442   21.035   6.7928   12.718   16.252   7.3643   14.215   6.1054 2.036549 9.566075 
1 1 1   19    9  -48 o   12.624   5.5412   2.8433   10.956 -10.9247   20.506   8.3437   12.961   13.330   6.4137   14.721   6.2380 -1.391769 8.946926 
1 1 1   19    9  -47 o   15.412   6.3641   10.582   12.976  -6.6367   19.844   23.444   17.151   13.710   6.5176   19.429   7.5515 -5.719652 9.975163 
1 1 1   19    9  -46 o   19.139   6.7992   21.118   13.317   46.246   20.757   3.5416   17.360   25.867   8.5073   14.702   6.6733 11.16464 10.81232 
1 1 1   19    9  -45 o   9.2753   4.4496  -9.8198   9.7040 -12.9180   15.396  -7.7774   12.500   11.495   5.5374   11.050   5.2296 0.4445162 7.616509 
1 1 1   19    9  -44 o   9.8618   4.7011  -8.9726   10.469  -1.5645   15.976 -14.5479   13.860   13.470   6.2205   10.664   5.1656 2.806542 8.085643 
1 1 1   19    9  -43 o   12.265   5.3252   2.6042   9.8833   3.4399   16.056   2.0944   12.541   14.499   6.5141   13.136   5.8391 1.362938 8.748071 
1 1 1   19    9  -42 o   15.270   5.8225   10.859   10.060   8.8337   16.200   12.130   12.834   15.778   6.8341   16.118   6.4484 -0.3407707 9.396067 
1 1 1   19    9  -41 o   49.260   2.9513  105.132   11.796   99.124   19.300  108.715   14.904   44.913   5.3786   49.226   3.7424 -4.312962 6.552417 
1 1 1   19    9  -40 o   35.930   4.4731   60.186   12.818   33.915   17.613   89.766   18.689   23.501   7.8404   42.659   5.5026 -19.15812 9.578636 
1 1 1   19    9  -39 o   11.086   5.0183  -1.8748   9.7373 -33.8385   16.134   16.437   12.212   9.7882   4.8914   17.830   6.4887 -8.041544 8.125807 
1 1 1   19    9  -38 o   21.648   5.6914   23.822   10.174   25.313   17.143   23.011   12.641   20.845   7.6714   20.602   6.6293 0.2428799 10.13895 
1 1 1   19    9  -37 o   29.432   4.4023   40.085   10.238   23.754   17.159   49.112   12.757   20.410   7.6439   32.057   5.0488 -11.64659 9.160789 
1 1 1   19    9  -36 o   9.5497   4.5449  -9.1324   9.7034 -15.1005   16.203  -5.7953   12.116   11.826   5.6929   11.480   5.3413 0.3456259 7.806369 
1 1 1   19    9  -35 o   19.648   5.7484   19.507   9.7891   16.358   16.840   21.114   12.030   18.295   7.3633   20.024   6.4693 -1.728310 9.801533 
1 1 1   19    9  -34 f   10.085   4.6445  -4.1734   8.8201  -6.1991   13.343  -2.6011   11.755   12.014   5.5949   12.015   5.4683 -0.7705688E-03 7.823320 
1 1 1   19    9  -33 o   10.099   4.6426  -4.0170   8.7584   2.6462   13.926  -8.3774   11.265   14.134   6.2241   10.615   5.0059 3.519418 7.987345 
1 1 1   19    9  -32 o   13.512   5.3825   6.4268   8.9035  -4.2271   14.301   13.170   11.377   12.842   5.9142   16.776   6.2359 -3.933614 8.594414 
1 1 1   19    9  -31 o   24.170   4.8730   27.582   9.2689   14.692   14.603   36.278   11.995   17.755   6.9488   27.260   5.5858 -9.504593 8.915539 
1 1 1   19    9  -30 o   29.801   4.3952   40.523   10.357   3.9068   19.644   54.620   12.188   16.215   7.2513   34.643   4.4164 -18.42859 8.490309 
1 1 1   19    9  -29 o   14.085   5.6453   6.8824   9.8554   18.572   19.039   2.6034   11.519   19.472   7.8318   13.332   5.7687 6.139715 9.727037 
1 1 1   19    9  -28 o   15.684   5.8043   10.794   9.8371  -3.8309   19.072   16.095   11.482   14.776   6.8139   18.147   6.3245 -3.370910 9.296663 
1 1 1   19    9  -27 o   10.555   4.7821  -2.7967   8.8660   13.419   14.555 -12.3631   11.179   17.530   6.9139   9.9697   4.7810 7.559767 8.405950 
1 1 1   19    9  -26 o   20.207   5.4479   19.766   9.1766   11.254   14.835   25.042   11.679   16.958   6.8800   22.316   6.1993 -5.358288 9.260962 
1 1 1   19    9  -25 o   36.498   3.3977   57.752   9.9925   55.369   15.604   59.409   13.010   33.862   5.8657   36.237   4.5011 -2.375145 7.393659 
1 1 1   19    9  -24 o   30.137   4.0617   40.471   9.7242   37.947   15.753   42.025   12.360   26.936   7.0822   29.905   5.2625 -2.968527 8.823342 
1 1 1   19    9  -23 o   15.109   5.8305   8.9399   10.170   3.3996   14.849   13.835   13.957   14.941   6.5067   17.712   6.8316 -2.770283 9.434352 
1 1 1   19    9  -22 o   14.208   5.5150   7.4477   9.1388   18.936   15.048   0.7339   11.503   19.633   7.1937   12.955   5.6823 6.678354 9.167202 
1 1 1   19    9  -21 o   16.912   5.6635   13.286   9.1890   11.774   14.965   14.201   11.642   17.298   6.9484   17.570   6.3438 -0.2717648 9.408738 
1 1 1   19    9  -20 o   12.329   5.2379   2.3014   9.1796  -7.3882   14.766   8.4053   11.719   12.729   5.9136   15.416   6.1638 -2.687181 8.541864 
1 1 1   19    9  -19 o   10.653   4.8211  -2.9927   8.9810 -11.8145   14.614   2.3606   11.384   11.934   5.6499   13.395   5.7651 -1.461460 8.072030 
1 1 1   19    9  -18 o   27.134   4.4993   33.296   9.6033   26.191   15.337   37.878   12.316   22.488   7.3077   28.306   5.5363 -5.818373 9.168002 
1 1 1   19    9  -17 o   18.697   6.0058   16.717   10.378   35.543   15.431   1.1663   14.024   26.319   7.0509   14.217   6.2537 12.10169 9.424661 
1 1 1   19    9  -16 f   29.109   4.3089   37.873   9.9158   19.484   15.600   50.340   12.845   20.042   7.3274   33.240   4.8861 -13.19842 8.807142 
1 1 1   19    9  -15 o   24.438   5.9493   28.908   11.738   26.887   15.702   31.468   17.673   22.807   7.3928   24.307   7.8399 -1.499214 10.77575 
1 1 1   19    9  -14 o   31.704   4.7763   45.578   11.961   39.022   15.822   54.320   18.271   27.730   7.0000   32.860   7.0336 -5.130480 9.923249 
1 1 1   19    9  -13 o   63.684   4.2651  178.421   22.013  178.421   22.013   0.0000   0.0000   63.684   4.2651  ?   ?  0.000000 4.265071 
1 1 1   19    9  -12 o   33.608   3.9667   49.546   10.658   46.148   15.791   52.389   14.444   30.686   6.5143   33.568   5.4666 -2.881844 8.504140 
1 1 1   19    9  -11 o   24.680   4.6052   27.627   8.9239   27.890   15.246   27.489   11.006   23.353   7.2510   24.014   5.7072 -0.6609554 9.227641 
1 1 1   19    9  -10 o   13.567   5.5624   4.7713   9.8211  -5.6349   14.588   13.398   13.282   13.082   6.0058   17.707   6.7047 -4.625470 9.001284 
1 1 1   19    9   -9 o   16.014   5.6032   11.218   9.0178   26.078   14.793   2.4301   11.376   22.700   7.1566   13.509   5.7876 9.191086 9.203979 
1 1 1   19    9   -8 o   10.380   4.6825  -2.8241   8.3911   5.3386   14.720  -6.7535   10.213   15.632   6.6367   10.580   4.9162 5.051374 8.259219 
1 1 1   19    9   -7 f   13.003   5.2511   4.6778   8.5961 -25.1122   15.090   18.989   10.459   10.502   5.1525   19.926   5.9707 -9.423755 7.886554 
1 1 1   19    9   -6 o   17.426   5.5046   14.022   8.7481   25.852   15.840   8.8307   10.494   22.568   7.4322   15.358   5.9237 7.209805 9.504053 
1 1 1   19    9   -5 o   26.112   4.7924   31.005   9.8249 -12.7331   20.211   44.538   11.243   14.278   6.7246   31.587   4.4930 -17.30845 8.087510 
1 1 1   19    9   -4 o   14.638   5.4250   8.4742   8.5992   1.1842   15.059   12.002   10.475   14.752   6.4850   16.669   6.0175 -1.916446 8.846780 
1 1 1   19    9   -3 o   13.303   5.3813   4.9043   9.0452   15.063   18.556   1.7382   10.359   19.257   7.7366   12.847   5.5138 6.409839 9.500362 
1 1 1   19    9   -2 o   20.040   5.5235   18.951   9.3124   10.543   19.394   21.470   10.616   18.285   7.6828   21.164   5.9220 -2.878832 9.700278 
1 1 1   19    9   -1 o   41.345   3.5481   73.552   11.842   0.0000   0.0000   73.552   11.842  ?   ?    41.345   3.5481 0.000000 3.548096 
1 1 1   19    9    0 o   23.965   4.6891   26.096   8.8322   11.935   15.890   32.427   10.625   17.841   7.1622   26.557   5.0933 -8.715755 8.788515 
1 1 1   19    9    1 o   24.407   4.7740   27.137   9.1576   6.4061   16.453   36.441   11.023   16.495   7.0105   28.265   4.9652 -11.76957 8.590693 
1 1 1   19    9    2 o   15.408   5.3448   10.261   8.1958   22.977   13.140   2.1631   10.486   21.596   6.7356   13.039   5.5707 8.557378 8.740804 
1 1 1   19    9    3 o   8.6139   4.1127  -9.4560   8.0790 -15.2575   13.392  -6.1365   10.130   10.896   5.2271   10.673   4.9374 0.2225094 7.190295 
1 1 1   19    9    4 o   23.613   4.7061   25.378   8.7403   23.914   15.075   26.119   10.727   21.868   7.2525   23.464   5.6719 -1.595621 9.207006 
1 1 1   19    9    5 o   54.512   2.5179  124.383   11.158  159.723   22.753  113.192   12.804   59.914   4.6962   51.678   3.0531 8.235970 5.601397 
1 1 1   19    9    6 o   47.642   2.7428   95.545   10.607  118.485   21.457   88.127   12.202   51.046   5.2307   45.416   3.3188 5.629906 6.194692 
1 1 1   19    9    7 f   26.712   4.7894   32.430   10.045   29.108   28.577   32.898   10.730   23.630   9.5629   26.725   5.1117 -3.094812 10.84335 
1 1 1   19    9    8 o   26.675   4.4782   31.956   9.3925   19.561   18.397   36.326   10.923   20.474   7.8572   28.217   4.9284 -7.743227 9.274949 
1 1 1   19    9    9 o   15.855   5.7433   10.648   9.5526   19.648   23.191   8.8092   10.483   21.024   8.5751   15.327   5.9184 5.696459 10.41920 
1 1 1   19    9   10 o   25.191   4.7833   28.956   9.4632   28.806   18.360   29.011   11.043   23.421   8.0047   24.754   5.6036 -1.333679 9.771208 
1 1 1   19    9   11 o   36.192   3.1268   55.875   9.1342   53.986   14.535   57.108   11.743   34.147   5.4014   36.053   4.0664 -1.906483 6.760961 
1 1 1   19    9   12 o   13.268   5.2493   5.5947   8.4134   16.654   13.506  -1.4176   10.755   18.920   6.8326   12.127   5.3980 6.793686 8.707603 
1 1 1   19    9   13 o   19.357   5.2417   17.610   8.4727   26.448   13.772   12.227   10.747   22.911   6.8481   16.747   6.0882 6.164555 9.163133 
1 1 1   19    9   14 o   21.838   5.2068   22.377   9.1376   18.720   13.381   25.573   12.508   19.681   6.8294   22.711   6.4536 -3.030298 9.396233 
1 1 1   19    9   15 o   44.271   2.6380   82.502   9.4766   88.863   14.748   78.029   12.368   44.997   4.0645   42.470   3.6067 2.527336 5.433972 
1 1 1   19    9   16 f   41.864   2.9222   74.364   9.9095   72.860   16.531   75.207   12.380   39.800   5.2213   41.625   3.6868 -1.825943 6.391752 
1 1 1   19    9   17 o   15.812   5.5406   11.028   8.8192   10.299   15.231   11.395   10.817   17.022   6.9470   16.361   6.0806 0.6609745 9.232243 
1 1 1   19    9   18 o   9.1333   4.3355  -8.8942   8.7168   12.249   15.059 -19.5480   10.690   17.543   6.9961   8.7225   4.2909 8.820507 8.207110 
1 1 1   19    9   19 o   25.072   5.0153   29.211   9.8919   32.441   15.690   27.079   12.744   24.905   7.2749   23.244   6.4826 1.661398 9.744140 
1 1 1   19    9   20 o   27.472   4.6564   34.411   10.055   30.284   15.805   37.217   13.033   23.976   7.3721   27.716   5.9468 -3.740561 9.471641 
1 1 1   19    9   21 o   10.714   5.0110  -7.6544   10.894  -2.9969   14.507 -13.6762   16.496   13.433   6.0984   12.475   5.9341 0.9573479 8.509053 
1 1 1   19    9   22 o   15.236   5.7708   9.4211   9.8415  -1.7527   14.581   18.771   13.338   13.702   6.1774   19.505   6.8151 -5.803582 9.198153 
1 1 1   19    9   23 o   23.974   5.3382   27.349   10.164   36.480   15.414   20.325   13.520   26.482   7.0257   20.096   6.8689 6.386583 9.825606 
1 1 1   19    9   24 o   27.901   4.2179   34.987   9.2938   30.350   15.923   37.383   11.446   23.804   7.4133   28.240   5.1624 -4.436245 9.033632 
1 1 1   19    9   25 o   8.0271   3.9368 -15.4336   8.7828 -30.9272   15.101  -7.5128   10.797   9.7921   4.8673   10.644   4.9819 -0.8520679 6.964845 
1 1 1   19    9   26 o   10.256   4.6821  -3.6108   8.7028 -13.9369   15.088   1.5380   10.654   11.731   5.6064   12.720   5.5258 -0.9889040 7.871855 
1 1 1   19    9   27 o   18.961   5.4855   17.442   8.9591   22.906   15.279   14.579   11.060   20.861   7.2939   17.510   6.1987 3.351000 9.572106 
1 1 1   19    9   28 o   10.700   4.8206  -2.1869   8.8611  -4.2748   15.031  -1.0746   10.970   13.243   6.0858   12.128   5.4215 1.115278 8.150397 
1 1 1   19    9   29 o   16.474   5.7988   12.672   9.6679   23.647   19.582   9.1348   11.117   20.901   8.0839   15.288   6.0386 5.613357 10.09033 
1 1 1   19    9   30 o   14.408   5.6652   7.8763   9.7456   36.361   15.381 -11.2303   12.597   26.041   7.0669   10.871   5.1750 15.17009 8.759155 
1 1 1   19    9   31 o   23.235   5.3267   26.193   9.8729   27.664   15.200   25.119   12.985   22.450   7.2732   21.821   6.6771 0.6292019 9.873388 
1 1 1   19    9   32 o   20.484   5.9273   21.223   10.459   43.991   17.739   9.0884   12.950   28.044   7.5803   15.631   6.3956 12.41352 9.917879 
1 1 1   19    9   33 o   31.335   4.3794   44.966   10.881   71.055   18.493   31.150   13.457   37.548   6.2623   24.270   6.6203 13.27844 9.112839 
1 1 1   19    9   34 f   26.418   5.1201   33.477   10.628   14.821   17.631   44.126   13.320   18.020   7.4272   29.943   5.6646 -11.92351 9.340859 
1 1 1   19    9   35 o   24.156   5.4660   28.781   10.511   52.390   17.466   15.377   13.161   31.183   7.0387   17.666   6.6775 13.51725 9.702152 
1 1 1   19    9   36 o   27.181   5.0042   35.325   10.679   40.770   17.515   32.102   13.473   26.553   7.6662   24.520   6.5972 2.033703 10.11403 
1 1 1   19    9   37 o   21.871   6.2473   25.160   11.691   14.314   23.852   28.590   13.412   18.458   8.1361   22.915   6.7353 -4.456617 10.56219 
1 1 1   19    9   38 o   11.615   5.2908  -2.4732   11.034 -41.3493   22.136   10.380   12.728   11.484   5.7373   15.763   6.3810 -4.279253 8.581005 
1 1 1   19    9   39 o   15.603   6.0794   10.905   11.138   4.6964   22.266   12.977   12.863   16.413   7.4916   16.594   6.5134 -0.1814976 9.927158 
1 1 1   19    9   40 o   10.985   5.1091  -5.2045   11.071 -47.3953   22.735   7.9106   12.676   11.202   5.6273   14.877   6.2284 -3.675521 8.394019 
1 1 1   19    9   41 o   12.662   5.5454   2.2922   10.919   24.532   23.108  -4.1014   12.390   20.001   8.3940   11.793   5.4571 8.208747 10.01194 
1 1 1   19    9   42 o   33.611   4.5227   53.189   12.077   86.000   25.877   44.052   13.656   36.669   8.7748   29.183   5.9426 7.485474 10.59772 
1 1 1   19    9   43 o   36.125   4.2248   60.533   12.206   97.535   25.935   50.006   13.834   40.009   8.2273   31.439   5.6034 8.569256 9.954273 
1 1 1   19    9   44 o   12.782   5.5725   3.1268   10.917 -11.9627   21.442   8.4072   12.684   13.607   6.5500   14.815   6.2183 -1.207728 9.031597 
1 1 1   19    9   45 o   20.745   6.2608   23.739   11.470  -7.7880   22.674   34.581   13.297   14.354   6.8632   24.982   6.4763 -10.62897 9.436421 
1 1 1   19    9   46 o   43.860   4.2744   89.852   15.089   87.229   26.208   91.152   18.454   36.011   8.9634   42.593   5.4390 -6.581997 10.48453 
1 1 1   19    9   47 o   14.156   6.1217   6.1736   12.956   0.0000   0.0000   6.1736   12.956  ?   ?    14.156   6.1217 0.000000 6.121728 
1 1 1   19    9   48 o   13.983   6.3048   3.0088   15.193   0.0000   0.0000   3.0088   15.193  ?   ?    13.983   6.3048 0.000000 6.304760 
1 1 1   19    9   49 o   21.376   6.7726   26.827   13.233   0.0000   0.0000   26.827   13.233  ?   ?    21.376   6.7726 0.000000 6.772561 
1 1 1   19    9   50 o   10.152   4.9244 -13.8300   12.709   0.0000   0.0000 -13.8300   12.709  ?   ?    10.152   4.9244 0.000000 4.924352 
1 1 1   19    9   51 o   22.653   7.3978   32.385   15.708   0.0000   0.0000   32.385   15.708  ?   ?    22.653   7.3978 0.000000 7.397841 
1 1 1   19    9   52 o   15.583   6.7341   10.302   15.655   0.0000   0.0000   10.302   15.655  ?   ?    15.583   6.7341 0.000000 6.734093 
1 1 1   19    9   53 o   21.376   7.3711   29.308   15.579   0.0000   0.0000   29.308   15.579  ?   ?    21.376   7.3711 0.000000 7.371114 
1 1 1   19    9   54 o   18.232   7.1960   20.387   15.777   0.0000   0.0000   20.387   15.777  ?   ?    18.232   7.1960 0.000000 7.196042 
1 1 1   19    9   55 o   24.279   9.0022   48.177   23.683   0.0000   0.0000   48.177   23.683  ?   ?    24.279   9.0022 0.000000 9.002155 
1 1 1   19    9   56 o   28.300   8.9855   61.083   23.284   0.0000   0.0000   61.083   23.284  ?   ?    28.300   8.9855 0.000000 8.985484 
1 1 1   19    9   57 o   10.616   5.3499 -44.0378   21.431   0.0000   0.0000 -44.0378   21.431  ?   ?    10.616   5.3499 0.000000 5.349932 
1 1 1   19    9   58 o   14.115   6.3898   4.4590   15.790   0.0000   0.0000   4.4590   15.790  ?   ?    14.115   6.3898 0.000000 6.389786 
1 1 1   19    9   59 o   13.630   6.2589   1.9871   15.856   0.0000   0.0000   1.9871   15.856  ?   ?    13.630   6.2589 0.000000 6.258918 
1 1 1   19    9   60 o   13.909   6.3262   3.8272   15.701   0.0000   0.0000   3.8272   15.701  ?   ?    13.909   6.3262 0.000000 6.326178 
1 1 1   19    9   61 f   15.182   6.6667   9.9642   15.874   0.0000   0.0000   9.9642   15.874  ?   ?    15.182   6.6667 0.000000 6.666711 
1 1 1   19    9   62 o   12.049   5.7405  -6.6824   15.562   0.0000   0.0000  -6.6824   15.562  ?   ?    12.049   5.7405 0.000000 5.740533 
1 1 1   19    9   63 o   19.668   8.3253   31.312   23.047   0.0000   0.0000   31.312   23.047  ?   ?    19.668   8.3253 0.000000 8.325274 
1 1 1   19    9   64 o   18.269   8.0669   24.801   23.546   0.0000   0.0000   24.801   23.546  ?   ?    18.269   8.0669 0.000000 8.066919 
1 1 1   19    9   65 o   14.620   6.9106   2.3764   21.703   0.0000   0.0000   2.3764   21.703  ?   ?    14.620   6.9106 0.000000 6.910607 
1 1 1   19    9   66 o   15.385   7.1608   8.1707   21.811   0.0000   0.0000   8.1707   21.811  ?   ?    15.385   7.1608 0.000000 7.160796 
1 1 1   19    9   67 o   12.953   6.3052 -10.7939   21.335   0.0000   0.0000 -10.7939   21.335  ?   ?    12.953   6.3052 0.000000 6.305248 
1 1 1   19    9   68 o   21.180   8.4795   38.659   22.209   0.0000   0.0000   38.659   22.209  ?   ?    21.180   8.4795 0.000000 8.479524 
1 1 1   19   10  -61 f   18.755   8.3044   30.517   25.118   0.0000   0.0000   30.517   25.118  ?   ?    18.755   8.3044 0.000000 8.304434 
1 1 1   19   10  -60 o   15.458   7.3300   7.7666   24.787   0.0000   0.0000   7.7666   24.787  ?   ?    15.458   7.3300 0.000000 7.329954 
1 1 1   19   10  -59 o   17.514   7.9326   22.335   24.370   0.0000   0.0000   22.335   24.370  ?   ?    17.514   7.9326 0.000000 7.932578 
1 1 1   19   10  -58 o   15.249   7.2294   5.7296   24.087   0.0000   0.0000   5.7296   24.087  ?   ?    15.249   7.2294 0.000000 7.229432 
1 1 1   19   10  -57 o   12.412   6.1530 -22.8415   23.510   0.0000   0.0000 -22.8415   23.510  ?   ?    12.412   6.1530 0.000000 6.153019 
1 1 1   19   10  -56 o   14.361   6.9016  -2.2284   23.579   0.0000   0.0000  -2.2284   23.579  ?   ?    14.361   6.9016 0.000000 6.901586 
1 1 1   19   10  -55 o   11.166   5.4190 -12.5926   15.439   0.0000   0.0000 -12.5926   15.439  ?   ?    11.166   5.4190 0.000000 5.418967 
1 1 1   19   10  -54 o   10.494   5.1527 -17.7128   15.186   0.0000   0.0000 -17.7128   15.186  ?   ?    10.494   5.1527 0.000000 5.152739 
1 1 1   19   10  -53 o   14.723   6.5885   7.9125   16.246   0.0000   0.0000   7.9125   16.246  ?   ?    14.723   6.5885 0.000000 6.588456 
1 1 1   19   10  -52 o   15.879   6.8630   12.948   16.267   0.0000   0.0000   12.948   16.267  ?   ?    15.879   6.8630 0.000000 6.862995 
1 1 1   19   10  -51 o   20.244   7.5867   28.522   16.909   9.8553   22.284   53.857   25.961   15.920   7.3498   24.247   9.3264 -8.327373 11.87438 
1 1 1   19   10  -50 o   12.550   5.9169  -3.9691   15.724  -2.5598   20.786  -5.8544   24.041   14.006   6.6617   14.255   6.8804 -0.2494183 9.576959 
1 1 1   19   10  -49 o   14.762   6.2073   9.8533   12.676  -0.1300   21.001   15.575   15.898   14.396   6.8027   16.628   6.9693 -2.232077 9.738935 
1 1 1   19   10  -48 o   12.934   5.7908   2.8915   12.568 -32.7158   20.624   23.924   15.851   11.094   5.5420   19.125   7.3048 -8.030709 9.169137 
1 1 1   19   10  -47 o   9.7882   4.7627 -13.7035   12.135 -21.4537   20.780  -9.6922   14.949   12.057   5.9412   11.498   5.5178 0.5590639 8.108302 
1 1 1   19   10  -46 o   11.974   5.4922  -0.9307   12.161   7.6133   20.719  -5.4210   15.020   15.559   7.1484   12.169   5.7512 3.390256 9.174735 
1 1 1   19   10  -45 o   11.847   5.4383  -1.2601   11.957  -0.3356   20.414  -1.7430   14.752   14.364   6.7629   12.718   5.9091 1.646302 8.980765 
1 1 1   19   10  -44 o   15.670   6.3195   12.457   12.432   52.282   22.523  -4.9905   14.908   26.044   8.8666   12.247   5.7701 13.79787 10.57877 
1 1 1   19   10  -43 o   16.119   6.3343   13.721   12.177   15.802   21.482   12.736   14.782   17.196   7.6432   16.005   6.7149 1.191242 10.17392 
1 1 1   19   10  -42 o   14.807   5.9395   10.247   10.919   2.7164   21.473   12.873   12.680   15.119   7.0596   15.897   6.3924 -0.7780075 9.523705 
1 1 1   19   10  -41 o   11.819   5.3387   0.0167   10.950   0.0987   21.279  -0.0129   12.771   14.761   6.9356   12.499   5.6928 2.261815 8.972795 
1 1 1   19   10  -40 o   16.305   6.1400   14.055   11.104   2.4572   21.485   18.282   12.971   15.158   7.0724   17.859   6.6544 -2.701597 9.710792 
1 1 1   19   10  -39 o   13.048   5.6188   4.6999   10.825   29.095   21.699  -3.3837   12.491   20.231   8.2784   11.737   5.4481 8.493918 9.910284 
1 1 1   19   10  -38 o   30.836   4.8053   46.477   11.685   37.431   22.686   49.744   13.633   22.186   8.6672   31.046   5.5925 -8.860014 10.31487 
1 1 1   19   10  -37 o   31.247   4.7066   47.347   11.616   36.682   22.381   51.279   13.590   22.116   8.6177   31.715   5.4533 -9.599121 10.19818 
1 1 1   19   10  -36 o   10.237   4.8366  -6.9408   10.608 -20.4774   20.917  -2.2530   12.309   12.426   6.0902   11.928   5.4909 0.4978323 8.200045 
1 1 1   19   10  -35 o   18.206   6.6060   18.731   12.645   0.0000   0.0000   18.731   12.645  ?   ?    18.206   6.6060 0.000000 6.606022 
1 1 1   19   10  -34 o   35.742   4.3803   60.292   12.496   29.486   29.337   67.120   13.811   20.076   8.9272   37.449   4.6224 -17.37243 10.05292 
1 1 1   19   10  -33 o   23.454   5.5088   28.378   10.351   46.484   17.750   19.045   12.743   27.469   7.6468   18.389   6.6371 9.079824 10.12547 
1 1 1   19   10  -32 o   11.526   5.1563   0.0970   9.9415 -10.1078   16.788   5.6081   12.337   12.372   5.9129   13.887   5.9894 -1.515265 8.416418 
1 1 1   19   10  -31 o   13.609   5.6267   6.6267   10.160   10.988   17.088   4.2418   12.637   16.272   7.0336   13.649   5.9721 2.622606 9.226955 
1 1 1   19   10  -30 o   10.550   4.9674  -6.8202   11.017   4.0883   16.620 -15.3703   14.714   14.741   6.6250   10.940   5.3047 3.801592 8.487071 
1 1 1   19   10  -29 o   19.956   6.3458   21.836   11.609   10.598   17.128   31.387   15.790   16.296   7.0428   22.794   7.4151 -6.498171 10.22668 
1 1 1   19   10  -28 o   13.342   5.5818   5.5817   10.170   7.8790   13.687   2.7504   15.195   14.999   6.3849   14.171   6.3542 0.8279953 9.007976 
1 1 1   19   10  -27 o   26.821   5.0988   35.220   10.740   28.996   14.498   42.790   15.990   22.379   7.0885   27.458   7.0939 -5.078320 10.02848 
1 1 1   19   10  -26 o   26.295   5.1529   33.913   10.650   16.853   13.904   58.125   16.564   17.883   6.8388   33.272   6.3388 -15.38931 9.324663 
1 1 1   19   10  -25 o   18.688   5.7285   17.972   9.5522   24.713   14.162   12.346   12.938   20.857   7.0315   16.325   6.4931 4.531925 9.570893 
1 1 1   19   10  -24 o   37.686   3.3323   62.479   10.131   57.378   14.625   67.185   14.048   34.162   5.4337   37.834   4.6529 -3.671551 7.153647 
1 1 1   19   10  -23 o   17.614   5.7337   15.706   9.4398   18.148   13.884   13.607   12.873   18.484   6.8851   16.821   6.5410 1.662483 9.496861 
1 1 1   19   10  -22 o   21.222   5.4178   22.533   9.4032   27.953   13.716   17.726   12.916   22.457   6.8606   18.370   6.6750 4.086637 9.571992 
1 1 1   19   10  -21 o   12.676   5.6723   0.1298   12.040  -7.8969   13.639   28.479   25.632   11.752   5.5317   21.226   8.8695 -9.473446 10.45312 
1 1 1   19   10  -20 o   16.864   6.0983   13.982   10.764   15.951   14.252   11.369   16.423   17.828   6.8962   16.761   7.0579 1.067116 9.867680 
1 1 1   19   10  -19 f   13.941   5.7708   6.2692   10.704  -2.7492   13.893   19.443   16.792   12.834   5.8806   19.090   7.4570 -6.255794 9.496760 
1 1 1   19   10  -18 o   19.309   5.6705   18.832   9.5103   15.384   14.070   21.733   12.905   17.679   6.8483   20.105   6.7113 -2.426651 9.588531 
1 1 1   19   10  -17 o   10.629   4.8223  -2.4422   9.0526 -13.5636   13.564   6.4892   12.156   10.881   5.2306   14.491   6.0852 -3.609724 8.024268 
1 1 1   19   10  -16 o   26.275   4.6342   32.346   9.5628   44.649   14.535   22.957   12.698   29.515   6.2368   20.710   6.6423 8.804827 9.111449 
1 1 1   19   10  -15 o   18.524   5.7268   17.225   9.5220   30.290   14.443   7.1811   12.664   23.472   7.0123   14.878   6.2269 8.594543 9.378003 
1 1 1   19   10  -14 o   16.340   5.7561   12.759   9.5274 -15.7818   14.486   34.517   12.648   11.030   5.3279   26.027   6.0731 -14.99688 8.078909 
1 1 1   19   10  -13 o   18.297   6.2542   16.970   11.208   9.0506   17.013   23.043   14.898   16.473   7.0681   20.529   7.2005 -4.056522 10.08984 
1 1 1   19   10  -12 o   19.253   6.0168   18.858   10.479   23.274   14.803   14.423   14.837   20.651   7.1821   17.579   6.9657 3.072054 10.00517 
1 1 1   19   10  -11 o   13.059   5.5206   3.9636   10.112   12.331   14.478  -4.0056   14.129   16.893   6.8174   12.780   5.8831 4.113150 9.004858 
1 1 1   19   10  -10 o   29.735   4.2543   40.305   10.018   50.192   15.405   33.060   13.188   31.487   6.2227   25.223   6.4038 6.264364 8.929189 
1 1 1   19   10   -9 o   45.715   3.2901   90.815   12.179   45.659   21.478  112.212   14.785   27.180   8.6301   50.520   3.6142 -23.33964 9.356339 
1 1 1   19   10   -8 o   11.852   5.1778   0.9527   9.4680   20.282   14.872 -12.2197   12.277   19.606   7.1567   10.506   5.0306 9.100154 8.747906 
1 1 1   19   10   -7 o   30.878   4.0593   42.977   9.9702   40.403   15.254   44.896   13.173   27.622   6.8171   30.416   5.5163 -2.794662 8.769348 
1 1 1   19   10   -6 o   15.541   6.0353   10.176   10.949   6.9240   15.029   13.854   15.983   15.564   6.6599   17.641   7.1471 -2.077258 9.769098 
1 1 1   19   10   -5 o   10.703   4.8080  -1.7211   8.7430  -2.6982   14.865  -1.2044   10.811   13.368   6.1091   11.940   5.3565 1.427685 8.124807 
1 1 1   19   10   -4 o   18.231   5.5491   16.342   8.9840   19.757   15.108   14.473   11.174   19.468   7.1952   17.308   6.2193 2.159983 9.510542 
1 1 1   19   10   -3 o   10.866   4.8567  -1.2733   8.8003   4.6528   15.011  -4.3766   10.863   15.019   6.5412   11.230   5.1656 3.788170 8.334885 
1 1 1   19   10   -2 o   30.480   4.2206   42.137   10.205   30.723   20.547   45.875   11.758   22.733   8.3930   31.429   4.7365 -8.696829 9.637237 
1 1 1   19   10   -1 o   24.003   5.2133   27.739   9.9078   25.410   19.511   28.548   11.501   21.234   8.1058   23.824   5.9424 -2.590078 10.05067 
1 1 1   19   10    0 o   13.232   5.4320   5.1831   9.3808   15.893   19.250   1.8478   10.743   18.653   7.7316   12.733   5.5399 5.920396 9.511414 
1 1 1   19   10    1 o   17.735   5.5715   15.384   8.9737   1.9101   15.218   22.567   11.111   14.463   6.4304   21.033   6.1159 -6.570556 8.874390 
1 1 1   19   10    2 o   17.366   5.5796   14.678   8.9573  -2.1786   14.911   24.195   11.204   13.500   6.1500   21.799   6.0778 -8.299169 8.646514 
1 1 1   19   10    3 o   18.103   5.7718   16.196   9.5986   2.5108   18.405   21.309   11.250   15.548   6.9808   20.394   6.2100 -4.846211 9.343201 
1 1 1   19   10    4 o   12.907   5.3928   4.1806   9.4737 -12.8391   18.117   10.586   11.114   12.985   6.1884   15.743   6.0899 -2.757406 8.682357 
1 1 1   19   10    5 o   9.7613   4.6065  -7.8796   9.5708 -15.7924   18.009  -4.7648   11.299   12.557   6.0339   11.366   5.2425 1.191490 7.993226 
1 1 1   19   10    6 o   28.902   4.2571   38.043   9.7292   26.272   16.174   44.717   12.179   21.711   7.5096   30.771   5.0289 -9.060301 9.037947 
1 1 1   19   10    7 o   23.108   5.0200   25.537   9.1848   22.163   14.934   27.589   11.648   20.303   7.2015   23.271   6.0761 -2.967701 9.422351 
1 1 1   19   10    8 o   10.383   4.7376  -3.2288   8.8932  -9.4691   14.747   0.3377   11.149   12.108   5.7152   12.477   5.5280 -0.3689499 7.951245 
1 1 1   19   10    9 o   36.022   3.3346   56.622   9.6803   52.713   15.803   58.970   12.247   32.298   6.2282   36.054   4.2486 -3.756416 7.539311 
1 1 1   19   10   10 o   13.180   5.3601   5.5099   9.0294  -0.2170   12.694   11.375   12.846   12.994   5.8186   16.311   6.4758 -3.317747 8.705844 
1 1 1   19   10   11 o   14.672   5.3892   9.4473   8.4536   11.745   12.681   7.6094   11.341   16.395   6.4576   14.683   5.9938 1.711879 8.810572 
1 1 1   19   10   12 o   13.794   5.3274   7.4989   8.4958  -5.9688   12.570   18.826   11.528   11.711   5.4459   19.122   6.3420 -7.410648 8.359344 
1 1 1   19   10   13 o   22.653   4.9041   24.505   8.7926   23.058   13.128   25.682   11.841   20.751   6.7621   22.219   6.2674 -1.467615 9.219872 
1 1 1   19   10   14 o   22.280   5.2510   24.236   9.3795   39.122   12.601   5.7424   14.045   28.109   5.6951   14.893   6.4065 13.21583 8.571884 
1 1 1   19   10   15 o   15.075   5.5849   10.134   9.1120   18.413   12.145  -0.5288   13.783   18.847   6.5079   13.306   6.0018 5.541455 8.852935 
1 1 1   19   10   16 o   13.288   5.4164   5.7214   9.2454   5.3413   12.328   6.2100   13.977   14.223   6.0574   14.960   6.4126 -0.7371006 8.821144 
1 1 1   19   10   17 o   37.568   3.0007   60.979   9.1129   40.523   12.940   81.109   12.836   28.494   5.7692   42.729   3.7224 -14.23535 6.865842 
1 1 1   19   10   18 o   14.411   5.3569   9.0660   8.3962   4.5322   12.081   13.302   11.677   13.883   5.9564   16.703   6.2951 -2.820385 8.666441 
1 1 1   19   10   19 f   13.972   5.3306   8.1073   8.4346   3.6632   11.998   12.450   11.860   13.599   5.8859   16.385   6.3033 -2.786129 8.624112 
1 1 1   19   10   20 o   14.580   5.6399   8.9396   9.5326   13.034   13.667   5.0606   13.302   16.808   6.6774   14.387   6.2121 2.420754 9.120191 
1 1 1   19   10   21 o   15.887   5.7439   12.007   9.5486   11.037   13.726   12.915   13.292   16.162   6.5954   16.691   6.5997 -0.5288925 9.330328 
1 1 1   19   10   22 o   22.970   5.4114   26.273   9.9646   8.6241   14.300   42.929   13.893   15.561   6.5710   28.908   6.0883 -13.34687 8.957969 
1 1 1   19   10   23 o   12.914   5.4106   4.5810   9.5766   1.9501   13.952   6.9246   13.169   13.776   6.1391   14.786   6.2775 -1.010566 8.780366 
1 1 1   19   10   24 o   7.8504   3.8922 -18.9954   9.4202 -26.0620   13.705 -12.6669   12.970   9.3896   4.6621   10.649   5.1179 -1.259486 6.922990 
1 1 1   19   10   25 o   20.108   6.0515   21.323   10.727   23.203   14.301   18.905   16.219   20.242   7.0580   18.652   7.3161 1.589996 10.16562 
1 1 1   19   10   26 o   22.355   6.1634   26.614   11.593   40.894   16.368   12.242   16.421   26.580   7.3218   16.742   7.0541 9.837881 10.16702 
1 1 1   19   10   27 o   39.151   4.0037   69.896   12.598   63.369   17.905   76.295   17.728   34.336   6.6372   38.859   5.7719 -4.522793 8.795850 
1 1 1   19   10   28 o   9.6705   4.6110  -9.0860   10.084 -26.1157   15.762   2.7115   13.119   10.238   5.0687   13.521   5.9934 -3.282761 7.849341 
1 1 1   19   10   29 o   10.562   4.8858  -4.0824   9.9186 -21.9266   15.623   7.9666   12.838   10.583   5.2025   14.789   6.2344 -4.205422 8.119932 
1 1 1   19   10   30 o   16.111   6.1835   12.815   11.395   21.503   23.838   10.242   12.973   19.070   8.2751   15.450   6.3698 3.620922 10.44275 
1 1 1   19   10   31 o   15.418   6.0746   11.097   11.225   25.623   21.786   5.8475   13.097   19.887   8.2323   14.197   6.1472 5.689914 10.27421 
1 1 1   19   10   32 o   16.585   6.1879   14.260   11.224   12.877   21.744   14.762   13.104   17.173   7.6577   16.839   6.5847 0.3332672 10.09943 
1 1 1   19   10   33 o   12.205   5.4717   0.6138   11.261 -11.0990   21.737   4.9109   13.166   13.700   6.5947   13.915   6.0919 -0.2153482 8.977822 
1 1 1   19   10   34 o   15.695   6.1151   12.078   11.269   16.170   22.554   10.717   13.009   17.747   7.8628   15.464   6.3774 2.283014 10.12402 
1 1 1   19   10   35 o   23.293   5.9625   29.195   11.368   24.082   22.089   31.037   13.259   19.258   8.1510   23.261   6.6558 -4.003437 10.52320 
1 1 1   19   10   36 o   14.470   5.9468   8.7402   11.259  -1.2709   21.309   12.618   13.262   14.713   6.9219   16.021   6.5032 -1.307592 9.497565 
1 1 1   19   10   37 o   15.271   6.0771   11.105   11.339   16.902   21.325   8.8201   13.388   17.657   7.7410   14.894   6.3266 2.763590 9.997412 
1 1 1   19   10   38 o   16.199   6.5531   13.305   13.414   61.218   23.194 -10.7718   16.442   29.090   8.9282   12.047   5.7827 17.04323 10.63730 
1 1 1   19   10   39 o   13.406   5.9724   3.2853   13.194   0.0000   0.0000   3.2853   13.194  ?   ?    13.406   5.9724 0.000000 5.972434 
1 1 1   19   10   40 o   12.778   5.8111   0.4684   13.243   0.0000   0.0000   0.4684   13.243  ?   ?    12.778   5.8111 0.000000 5.811084 
1 1 1   19   10   41 o   10.435   5.0514 -13.0848   13.196   0.0000   0.0000 -13.0848   13.196  ?   ?    10.435   5.0514 0.000000 5.051376 
1 1 1   19   10   42 o   12.343   5.8881  -8.1742   16.484   0.0000   0.0000  -8.1742   16.484  ?   ?    12.343   5.8881 0.000000 5.888132 
1 1 1   19   10   43 o   12.819   5.8207   1.0044   13.223   0.0000   0.0000   1.0044   13.223  ?   ?    12.819   5.8207 0.000000 5.820703 
1 1 1   19   10   44 o   27.675   6.3826   43.027   14.105   0.0000   0.0000   43.027   14.105  ?   ?    27.675   6.3826 0.000000 6.382600 
1 1 1   19   10   45 o   21.559   7.6273   31.420   16.743   0.0000   0.0000   31.420   16.743  ?   ?    21.559   7.6273 0.000000 7.627329 
1 1 1   19   10   46 o   12.944   6.0378  -1.8373   15.640   0.0000   0.0000  -1.8373   15.640  ?   ?    12.944   6.0378 0.000000 6.037771 
1 1 1   19   10   47 o   21.399   7.5098   30.764   16.207   0.0000   0.0000   30.764   16.207  ?   ?    21.399   7.5098 0.000000 7.509812 
1 1 1   19   10   48 o   19.348   7.4753   25.101   16.732   0.0000   0.0000   25.101   16.732  ?   ?    19.348   7.4753 0.000000 7.475338 
1 1 1   19   10   49 o   16.992   7.1268   16.913   16.643   0.0000   0.0000   16.913   16.643  ?   ?    16.992   7.1268 0.000000 7.126817 
1 1 1   19   10   50 o   13.291   6.1663   0.1273   15.975   0.0000   0.0000   0.1273   15.975  ?   ?    13.291   6.1663 0.000000 6.166348 
1 1 1   19   10   51 o   21.871   7.6999   33.483   17.047   0.0000   0.0000   33.483   17.047  ?   ?    21.871   7.6999 0.000000 7.699896 
1 1 1   19   10   52 o   17.631   7.2194   19.789   16.516   0.0000   0.0000   19.789   16.516  ?   ?    17.631   7.2194 0.000000 7.219371 
1 1 1   19   10   53 o   14.363   6.4822   6.2516   16.105   0.0000   0.0000   6.2516   16.105  ?   ?    14.363   6.4822 0.000000 6.482195 
1 1 1   19   10   54 o   8.3845   4.2551 -42.9681   15.090   0.0000   0.0000 -42.9681   15.090  ?   ?    8.3845   4.2551 0.000000 4.255074 
1 1 1   19   10   55 o   18.393   7.3009   22.830   16.326   0.0000   0.0000   22.830   16.326  ?   ?    18.393   7.3009 0.000000 7.300916 
1 1 1   19   10   56 o   15.021   6.6402   9.8616   15.996   0.0000   0.0000   9.8616   15.996  ?   ?    15.021   6.6402 0.000000 6.640206 
1 1 1   19   10   57 o   13.301   6.1826   0.9666   16.174   0.0000   0.0000   0.9666   16.174  ?   ?    13.301   6.1826 0.000000 6.182576 
1 1 1   19   10   58 o   16.079   7.3844   13.104   22.083   0.0000   0.0000   13.104   22.083  ?   ?    16.079   7.3844 0.000000 7.384366 
1 1 1   19   10   59 o   13.038   6.3349  -9.4729   21.263   0.0000   0.0000  -9.4729   21.263  ?   ?    13.038   6.3349 0.000000 6.334922 
1 1 1   19   10   60 o   12.839   6.2708 -11.8341   21.604   0.0000   0.0000 -11.8341   21.604  ?   ?    12.839   6.2708 0.000000 6.270827 
1 1 1   19   10   61 f   11.998   5.9429 -21.8071   21.768   0.0000   0.0000 -21.8071   21.768  ?   ?    11.998   5.9429 0.000000 5.942918 
1 1 1   19   11  -53 o   12.694   6.3091 -22.2673   25.345   0.0000   0.0000 -22.2673   25.345  ?   ?    12.694   6.3091 0.000000 6.309056 
1 1 1   19   11  -52 o   15.317   7.2831   7.4124   24.808   0.0000   0.0000   7.4124   24.808  ?   ?    15.317   7.2831 0.000000 7.283107 
1 1 1   19   11  -51 o   14.486   6.5012   8.4312   15.943   0.0000   0.0000   8.4312   15.943  ?   ?    14.486   6.5012 0.000000 6.501250 
1 1 1   19   11  -50 o   13.059   6.1256  -0.2417   16.475   0.0000   0.0000  -0.2417   16.475  ?   ?    13.059   6.1256 0.000000 6.125557 
1 1 1   19   11  -49 o   22.109   7.7442   36.061   17.229   0.0000   0.0000   36.061   17.229  ?   ?    22.109   7.7442 0.000000 7.744239 
1 1 1   19   11  -48 o   10.180   4.9454 -12.3160   12.943  -4.6379   22.952 -15.8961   15.673   13.861   6.6982   10.784   5.2825 3.077725 8.530617 
1 1 1   19   11  -47 o   10.253   5.0486 -18.4174   14.914 -38.6909   21.621  -0.0116   20.601   10.795   5.4317   14.023   6.6591 -3.227834 8.593451 
1 1 1   19   11  -46 o   12.890   6.0109  -0.3748   15.487 -35.0880   22.439   31.202   21.401   11.264   5.6491   19.608   8.1418 -8.344191 9.909698 
1 1 1   19   11  -45 o   11.706   5.6015  -7.5005   15.165  -6.9251   21.869  -8.0336   21.049   13.501   6.5277   13.210   6.3910 0.2912769 9.135366 
1 1 1   19   11  -44 o   13.900   6.3149   4.8603   15.589   2.6464   22.256   6.9926   21.841   14.707   6.9656   15.232   7.1150 -0.5249767 9.957061 
1 1 1   19   11  -43 o   13.349   6.1504   1.9562   15.490   20.802   22.390 -15.3466   21.454   17.498   7.7888   12.602   6.1747 4.896626 9.939453 
1 1 1   19   11  -42 o   13.968   6.3311   5.0035   15.557 -12.7316   23.093   19.739   21.050   13.243   6.4714   17.366   7.6495 -4.123275 10.01969 
1 1 1   19   11  -41 o   16.217   6.5327   14.905   13.268   20.187   22.354   12.032   16.486   17.494   7.7850   15.630   6.8303 1.864398 10.35662 
1 1 1   19   11  -40 o   16.931   7.1559   17.297   16.985   0.0000   0.0000   17.297   16.985  ?   ?    16.931   7.1559 0.000000 7.155906 
1 1 1   19   11  -39 o   14.965   6.6721   8.7261   16.499   0.0000   0.0000   8.7261   16.499  ?   ?    14.965   6.6721 0.000000 6.672109 
1 1 1   19   11  -38 o   10.883   5.1992  -8.2554   12.948   12.309   21.622 -19.7548   16.168   16.225   7.3966   10.683   5.2594 5.541817 9.075889 
1 1 1   19   11  -37 o   14.423   6.2083   8.4772   13.205   24.843   22.130  -0.5712   16.455   18.563   8.0140   13.284   6.1954 5.278839 10.12950 
1 1 1   19   11  -36 o   11.158   5.2810  -6.1906   12.753   2.7446   21.353 -11.1458   15.901   14.808   6.9546   11.593   5.5953 3.215199 8.926038 
1 1 1   19   11  -35 o   27.928   5.6893   41.732   12.512   83.400   23.975   26.137   14.667   34.743   8.5295   20.083   7.1356 14.65941 11.12070 
1 1 1   19   11  -34 o   18.188   6.4518   19.577   11.987   35.927   22.898   13.405   14.068   21.002   8.5378   15.942   6.6088 5.059896 10.79673 
1 1 1   19   11  -33 o   11.274   5.2281  -2.8769   11.462 -21.9459   21.622   4.5773   13.518   12.231   6.0334   13.583   6.0488 -1.352121 8.543432 
1 1 1   19   11  -32 o   18.297   6.4285   19.655   11.878   44.161   22.635   10.342   13.953   23.331   8.7705   15.129   6.4437 8.202419 10.88319 
1 1 1   19   11  -31 o   30.180   5.1206   46.154   12.148   24.426   22.730   54.841   14.372   18.684   8.0940   32.251   5.6740 -13.56723 9.884676 
1 1 1   19   11  -30 o   16.515   6.2753   15.008   11.660   23.081   21.706   11.734   13.823   18.503   7.9619   15.551   6.5070 2.951638 10.28264 
1 1 1   19   11  -29 o   9.5116   4.6176 -12.7913   11.236 -15.3736   20.991 -11.7544   13.301   12.757   6.2200   10.611   5.1205 2.146579 8.056498 
1 1 1   19   11  -28 o   27.320   5.6933   39.501   12.267   73.173   23.472   26.847   14.389   32.358   8.7082   20.705   7.0860 11.65252 11.22691 
1 1 1   19   11  -27 o   14.252   6.2046   6.8388   13.494 -13.2280   20.590   21.944   17.864   12.914   6.2650   18.548   7.5409 -5.634882 9.803850 
1 1 1   19   11  -26 o   13.733   6.0912   4.5666   13.572  -9.9806   20.932   15.119   17.828   13.374   6.4464   16.866   7.2361 -3.492114 9.691082 
1 1 1   19   11  -25 o   18.092   6.8560   19.346   13.895   26.241   22.109   14.845   17.864   19.361   8.1727   16.826   7.2315 2.534815 10.91271 
1 1 1   19   11  -24 o   12.808   5.6247   3.4494   11.302   23.436   21.188  -4.5001   13.362   18.827   7.9765   11.831   5.5389 6.996172 9.711041 
1 1 1   19   11  -23 f   9.8138   4.7317 -11.2255   11.298   7.1287   21.352 -18.3619   13.314   15.798   7.2576   9.8211   4.8228 5.976657 8.713876 
1 1 1   19   11  -22 o   15.613   6.1413   12.233   11.456 -24.2759   21.858   26.061   13.452   12.268   6.0542   20.820   6.8486 -8.552160 9.140930 
1 1 1   19   11  -21 o   11.591   5.2065   0.2412   10.250   2.9074   16.104  -1.5747   13.290   14.084   6.4062   12.372   5.6990 1.711815 8.574219 
1 1 1   19   11  -20 o   11.575   5.2180  -0.1066   10.402   6.5106   13.749  -8.9636   15.906   14.311   6.2460   12.082   5.7694 2.228291 8.502862 
1 1 1   19   11  -19 o   26.287   4.9492   34.332   10.216   12.992   14.145   57.603   14.771   16.142   6.6530   33.373   5.6297 -17.23034 8.715277 
1 1 1   19   11  -18 o   16.986   5.8276   15.412   9.7336   25.673   13.902   5.5437   13.633   20.606   6.9664   14.072   6.1786 6.534434 9.311581 
1 1 1   19   11  -17 o   13.540   5.5068   7.2896   9.5310   20.997   13.720  -5.4931   13.250   18.851   6.8751   11.667   5.4790 7.184405 8.791266 
1 1 1   19   11  -16 f   17.893   5.8449   17.256   9.8054   11.695   13.926   22.725   13.809   15.793   6.5635   19.514   6.9246 -3.720846 9.540939 
1 1 1   19   11  -15 o   10.764   4.9105  -1.9337   9.5493  -4.9694   13.878   0.7959   13.160   12.020   5.6329   12.876   5.8309 -0.8566608 8.107321 
1 1 1   19   11  -14 o   11.524   5.1725   0.0433   10.095 -20.6714   15.845   14.197   13.098   10.684   5.2494   16.521   6.5453 -5.837219 8.390304 
1 1 1   19   11  -13 o   11.152   5.0169  -0.4579   9.5576 -17.5396   13.856   15.048   13.201   10.213   4.9953   16.822   6.5998 -6.608864 8.277082 
1 1 1   19   11  -12 o   26.158   4.8190   33.521   9.8968   41.636   14.239   25.936   13.766   27.391   6.4792   20.867   6.9307 6.524136 9.487574 
1 1 1   19   11  -11 o   14.168   5.6054   8.7759   9.5937   5.9279   13.848   11.404   13.304   14.299   6.2541   15.687   6.4574 -1.388289 8.989507 
1 1 1   19   11  -10 o   10.295   4.7588  -3.6458   9.3835   14.283   13.862 -18.8112   12.749   16.642   6.6865   9.5685   4.7028 7.073727 8.174748 
1 1 1   19   11   -9 o   14.413   5.5981   9.4434   9.4207   0.5026   13.718   17.424   12.960   13.044   5.9252   17.708   6.6408 -4.663334 8.899935 
1 1 1   19   11   -8 o   14.908   5.9270   10.124   10.776 -13.9852   18.008   23.571   13.449   12.250   5.9229   20.037   6.8510 -7.787390 9.056326 
1 1 1   19   11   -7 o   16.559   6.0617   14.321   10.681   25.371   17.544   7.8145   13.463   19.993   7.6729   14.725   6.3021 5.268135 9.929250 
1 1 1   19   11   -6 o   21.227   6.4565   25.417   12.165   9.6343   18.121   38.366   16.413   16.026   7.0767   24.961   7.4797 -8.934641 10.29684 
1 1 1   19   11   -5 o   13.110   5.5685   5.0587   10.371   8.0204   13.735   1.1316   15.816   14.856   6.3621   13.842   6.3165 1.014050 8.965185 
1 1 1   19   11   -4 o   22.897   5.7900   27.701   10.812   29.792   14.281   24.895   16.548   22.403   7.0273   20.020   7.5048 2.383009 10.28129 
1 1 1   19   11   -3 o   15.015   5.7540   10.668   9.8565   19.529   14.091   2.1777   13.792   18.467   6.9246   13.466   6.0447 5.001159 9.191782 
1 1 1   19   11   -2 o   12.306   5.4444   1.7356   10.775   12.797   13.624 -16.7471   17.610   16.224   6.5893   11.827   5.7507 4.397537 8.745771 
1 1 1   19   11   -1 o   14.422   5.6443   9.2741   9.6357   3.7352   13.782   14.571   13.477   13.819   6.1333   16.781   6.6422 -2.961480 9.040833 
1 1 1   19   11    0 o   34.535   3.7590   54.264   10.411   49.642   15.035   58.523   14.432   30.395   6.2761   34.180   5.3555 -3.785164 8.250544 
1 1 1   19   11    1 o   15.970   6.0306   12.806   10.729  -0.2560   17.834   20.214   13.431   14.161   6.5509   18.786   6.8093 -4.624950 9.448884 
1 1 1   19   11    2 o   16.005   6.0282   12.902   10.705  -7.9109   17.381   25.622   13.588   12.860   6.1095   20.906   6.8834 -8.046059 9.203646 
1 1 1   19   11    3 o   13.622   5.5234   7.2517   9.5547   3.2118   13.798   10.973   13.244   13.699   6.1050   15.614   6.4366 -1.914762 8.871337 
1 1 1   19   11    4 o   21.083   5.6361   23.329   9.8724   26.523   14.192   20.334   13.742   21.094   7.0379   18.782   6.8758 2.311588 9.839104 
1 1 1   19   11    5 o   14.034   5.6245   8.2253   9.7819   2.3605   13.850   14.062   13.817   13.515   6.0628   16.620   6.6765 -3.105759 9.018517 
1 1 1   19   11    6 o   25.324   5.4275   32.737   10.867   29.957   14.215   36.647   16.858   22.473   7.0053   24.095   7.6452 -1.621918 10.36935 
1 1 1   19   11    7 o   19.837   6.2424   21.830   11.260   19.175   14.220   26.294   18.438   18.294   6.9350   20.156   7.8309 -1.861649 10.46028 
1 1 1   19   11    8 o   26.612   5.3641   35.932   11.234   46.948   14.439   19.040   17.880   29.575   6.1885   18.164   7.4824 11.41157 9.709973 
1 1 1   19   11    9 o   17.936   6.5002   17.902   12.238   25.527   14.177  -4.3968   24.244   20.634   7.0344   14.983   7.1457 5.650493 10.02715 
1 1 1   19   11   10 o   23.299   6.3983   30.339   12.521   32.795   17.887   27.979   17.534   22.269   7.8832   20.765   7.7369 1.504269 11.04556 
1 1 1   19   11   11 o   21.291   6.4845   25.764   12.266   26.891   18.049   24.798   16.719   20.321   7.7867   19.863   7.5221 0.4584885 10.82653 
1 1 1   19   11   12 o   14.644   6.0951   8.7335   12.035   18.747   17.675   0.0787   16.432   18.029   7.4344   13.762   6.3384 4.266710 9.769687 
1 1 1   19   11   13 o   14.472   6.0814   8.1168   12.153 -12.5861   17.668   26.710   16.743   12.272   5.9169   20.442   7.5711 -8.170329 9.608908 
1 1 1   19   11   14 o   22.937   5.4908   27.316   10.130   41.122   14.648   14.665   14.023   26.896   6.7051   16.724   6.7233 10.17201 9.495292 
1 1 1   19   11   15 o   9.8041   4.6316  -6.7417   9.7230  -9.9238   14.019  -3.7921   13.497   11.283   5.3954   12.085   5.6276 -0.8019180 7.796166 
1 1 1   19   11   16 f   21.075   5.7214   23.704   10.079   18.003   14.279   29.364   14.229   17.770   6.8949   22.054   7.0269 -4.283466 9.844644 
1 1 1   19   11   17 o   19.359   5.9011   20.418   10.155   29.149   14.733   12.517   14.016   21.762   7.1678   16.024   6.6153 5.737244 9.753901 
1 1 1   19   11   18 o   20.412   5.8601   22.613   10.262   24.966   14.715   20.385   14.317   20.130   7.1477   18.538   6.9739 1.591246 9.986275 
1 1 1   19   11   19 o   14.180   5.6685   8.8379   9.9094   20.719   14.182  -2.4956   13.852   18.649   6.9564   12.413   5.7532 6.236420 9.027179 
1 1 1   19   11   20 o   15.417   5.5613   12.058   8.9450   10.347   11.607   14.561   14.037   14.994   6.0849   16.589   6.7063 -1.594934 9.055375 
1 1 1   19   11   21 o   11.665   5.0548   2.5759   8.8708  -5.1821   11.470   14.122   13.993   10.938   5.1245   16.438   6.6772 -5.499305 8.417022 
1 1 1   19   11   22 o   12.444   5.3203   4.1826   9.5762   22.017   13.219 -15.5154   13.892   19.235   6.7797   10.421   5.0761 8.814769 8.469396 
1 1 1   19   11   23 f   11.790   5.3819  -1.0433   11.494   14.835   15.659 -19.5908   16.924   16.720   6.9554   11.138   5.4628 5.582301 8.844187 
1 1 1   19   11   24 o   15.119   6.0847   10.874   11.499   16.183   20.811   8.5416   13.796   17.313   7.6169   14.796   6.3570 2.517441 9.921078 
1 1 1   19   11   25 o   19.635   6.4496   22.353   11.932   38.678   22.384   15.873   14.102   22.336   8.6418   16.928   6.7637 5.408255 10.97398 
1 1 1   19   11   26 o   12.706   5.8104  -0.0009   13.475 -12.3413   22.056   7.3494   17.022   13.396   6.4956   15.086   6.7479 -1.689380 9.366243 
1 1 1   19   11   27 o   33.604   4.7664   55.368   12.691   45.042   23.619   59.559   15.047   23.573   8.9374   33.758   5.6688 -10.18485 10.58360 
1 1 1   19   11   28 o   10.742   5.0578  -5.8418   11.419   11.688   21.880 -12.4038   13.387   16.476   7.4838   10.569   5.1091 5.907907 9.061466 
1 1 1   19   11   29 o   18.088   6.9203   19.729   14.242   0.0000   0.0000   19.729   14.242  ?   ?    18.088   6.9203 0.000000 6.920277 
1 1 1   19   11   30 o   19.886   7.6242   26.773   17.311   0.0000   0.0000   26.773   17.311  ?   ?    19.886   7.6242 0.000000 7.624178 
1 1 1   19   11   31 o   11.434   5.5563 -14.2933   16.369   0.0000   0.0000 -14.2933   16.369  ?   ?    11.434   5.5563 0.000000 5.556284 
1 1 1   19   11   32 o   12.339   5.8970  -7.8513   16.694   0.0000   0.0000  -7.8513   16.694  ?   ?    12.339   5.8970 0.000000 5.897034 
1 1 1   19   11   33 o   15.495   6.8599   10.193   17.136   0.0000   0.0000   10.193   17.136  ?   ?    15.495   6.8599 0.000000 6.859918 
1 1 1   19   11   34 o   14.297   6.2549   7.3427   13.859   0.0000   0.0000   7.3427   13.859  ?   ?    14.297   6.2549 0.000000 6.254878 
1 1 1   19   11   35 o   14.384   6.3141   7.4925   14.228   0.0000   0.0000   7.4925   14.228  ?   ?    14.384   6.3141 0.000000 6.314070 
1 1 1   19   11   36 o   20.239   7.1541   26.645   14.727   0.0000   0.0000   26.645   14.727  ?   ?    20.239   7.1541 0.000000 7.154061 
1 1 1   19   11   37 o   21.673   7.2253   30.657   14.958   0.0000   0.0000   30.657   14.958  ?   ?    21.673   7.2253 0.000000 7.225293 
1 1 1   19   11   38 o   20.242   8.6783   35.519   25.610   0.0000   0.0000   35.519   25.610  ?   ?    20.242   8.6783 0.000000 8.678302 
1 1 1   19   11   39 o   23.520   7.8053   38.834   17.461   0.0000   0.0000   38.834   17.461  ?   ?    23.520   7.8053 0.000000 7.805326 
1 1 1   19   11   40 o   13.048   6.1285  -1.8959   16.588   0.0000   0.0000  -1.8959   16.588  ?   ?    13.048   6.1285 0.000000 6.128479 
1 1 1   19   11   41 o   11.889   5.7464 -10.8562   16.916   0.0000   0.0000 -10.8562   16.916  ?   ?    11.889   5.7464 0.000000 5.746413 
1 1 1   19   11   42 o   23.794   7.9531   40.999   18.121   0.0000   0.0000   40.999   18.121  ?   ?    23.794   7.9531 0.000000 7.953060 
1 1 1   19   11   43 o   14.886   6.6935   8.5552   16.990   0.0000   0.0000   8.5552   16.990  ?   ?    14.886   6.6935 0.000000 6.693536 
1 1 1   19   11   44 o   12.642   5.9865  -3.7294   16.423   0.0000   0.0000  -3.7294   16.423  ?   ?    12.642   5.9865 0.000000 5.986533 
1 1 1   19   11   45 o   10.604   5.2304 -19.9272   16.242   0.0000   0.0000 -19.9272   16.242  ?   ?    10.604   5.2304 0.000000 5.230428 
1 1 1   19   11   46 o   14.525   6.5685   7.3122   16.633   0.0000   0.0000   7.3122   16.633  ?   ?    14.525   6.5685 0.000000 6.568520 
1 1 1   19   11   47 o   10.615   5.2312 -19.1588   16.122   0.0000   0.0000 -19.1588   16.122  ?   ?    10.615   5.2312 0.000000 5.231161 
1 1 1   19   11   48 o   18.007   7.3599   22.635   17.127   0.0000   0.0000   22.635   17.127  ?   ?    18.007   7.3599 0.000000 7.359873 
1 1 1   19   11   49 o   17.604   7.2221   21.085   16.569   0.0000   0.0000   21.085   16.569  ?   ?    17.604   7.2221 0.000000 7.222108 
1 1 1   19   11   50 o   11.865   5.7060  -7.9930   16.181   0.0000   0.0000  -7.9930   16.181  ?   ?    11.865   5.7060 0.000000 5.706038 
1 1 1   19   11   51 o   14.196   6.4584   6.6357   16.375   0.0000   0.0000   6.6357   16.375  ?   ?    14.196   6.4584 0.000000 6.458431 
1 1 1   19   11   52 o   15.087   6.7010   11.066   16.481   0.0000   0.0000   11.066   16.481  ?   ?    15.087   6.7010 0.000000 6.701040 
1 1 1   19   11   53 o   12.130   5.7944  -5.6193   16.082   0.0000   0.0000  -5.6193   16.082  ?   ?    12.130   5.7944 0.000000 5.794384 
1 1 1   19   11   54 o   17.458   7.9317   23.295   24.595   0.0000   0.0000   23.295   24.595  ?   ?    17.458   7.9317 0.000000 7.931679 
1 1 1   19   12  -45 o   16.617   7.5330   18.394   22.038   0.0000   0.0000   18.394   22.038  ?   ?    16.617   7.5330 0.000000 7.533034 
1 1 1   19   12  -44 o   18.543   7.9727   28.813   21.730   0.0000   0.0000   28.813   21.730  ?   ?    18.543   7.9727 0.000000 7.972713 
1 1 1   19   12  -43 o   12.038   5.6275  -1.4294   13.709   4.6351   23.509  -4.5543   16.876   14.761   7.0389   12.430   5.9372 2.331470 9.208519 
1 1 1   19   12  -42 f   10.113   4.9274 -12.7542   13.109   3.3908   22.730 -20.8012   16.047   14.522   6.9237   10.322   5.1111 4.199226 8.605888 
1 1 1   19   12  -41 o   17.040   6.7299   18.867   13.807   31.887   23.225   11.750   17.171   18.925   8.1902   15.194   6.7881 3.731649 10.63752 
1 1 1   19   12  -40 o   13.737   6.0927   7.0520   13.577 -14.0833   22.552   19.067   17.004   12.704   6.2462   16.834   7.1394 -4.129566 9.486151 
1 1 1   19   12  -39 o   9.0496   4.5102 -23.3423   13.324 -44.9003   23.141 -12.6519   16.296   10.735   5.4277   11.272   5.4922 -0.5370798 7.721667 
1 1 1   19   12  -38 o   9.5813   4.7267 -18.0383   13.283 -14.2161   21.812 -20.2913   16.746   12.582   6.1773   10.635   5.2577 1.946571 8.111860 
1 1 1   19   12  -37 o   9.0388   4.4975 -22.2958   13.028 -15.3647   22.014 -26.0316   16.162   12.540   6.1668   9.9284   4.9512 2.612026 7.908444 
1 1 1   19   12  -36 o   14.060   6.1755   8.0139   13.630   17.615   22.598   2.5231   17.089   16.617   7.5703   13.615   6.3376 3.002010 9.872880 
1 1 1   19   12  -35 o   14.648   6.3043   10.253   13.613   5.0611   22.462   13.267   17.114   14.850   7.0227   15.663   6.8984 -0.8132639 9.844111 
1 1 1   19   12  -34 o   19.695   7.0432   26.135   14.312   16.137   23.499   32.031   18.045   16.495   7.5910   20.476   7.8006 -3.981186 10.88448 
1 1 1   19   12  -33 o   15.321   6.8478   11.235   17.493   3.9942   22.958   21.258   27.010   14.830   7.0385   17.278   8.0171 -2.448842 10.66835 
1 1 1   19   12  -32 o   15.930   6.9893   14.105   17.416   29.889   23.161  -6.4366   26.421   18.929   8.1853   14.246   6.9528 4.683114 10.73967 
1 1 1   19   12  -31 o   10.918   5.3646 -17.5431   16.554  -9.4217   22.056 -28.0177   25.049   13.217   6.4287   12.330   6.1513 0.8866606 8.897586 
1 1 1   19   12  -30 o   13.592   6.0852   5.3915   13.875 -26.8616   23.010   23.820   17.393   11.956   5.9536   18.347   7.4476 -6.391333 9.534739 
1 1 1   19   12  -29 f   20.246   7.0238   27.147   14.154   20.067   23.656   31.094   17.665   17.228   7.8078   20.447   7.7344 -3.219090 10.99011 
1 1 1   19   12  -28 o   20.089   6.6932   25.471   12.836   16.264   23.980   29.168   15.197   16.680   7.6732   20.659   7.2704 -3.979061 10.57050 
1 1 1   19   12  -27 o   13.431   5.8863   5.9744   12.321  -4.2527   23.008   10.086   14.589   14.008   6.7534   14.861   6.4608 -0.8531275 9.346123 
1 1 1   19   12  -26 o   14.877   6.2214   10.929   12.626 -31.3519   23.245   28.625   15.038   11.752   5.8726   20.584   7.2331 -8.831505 9.316971 
1 1 1   19   12  -25 o   13.571   5.9466   6.1916   12.571   0.1218   23.683   8.5726   14.833   14.641   7.0042   14.571   6.4197 0.6957150E-01 9.501114 
1 1 1   19   12  -24 o   12.950   5.7876   3.7008   12.493   26.312   24.147  -4.5651   14.600   18.435   8.1533   11.997   5.6698 6.438488 9.930963 
1 1 1   19   12  -23 o   12.727   5.7371   2.6013   12.572   19.494   23.719  -3.9989   14.826   17.316   7.8360   12.168   5.7394 5.148400 9.713039 
1 1 1   19   12  -22 o   10.971   5.1941  -5.9594   12.353   2.9886   23.667  -9.3099   14.482   15.025   7.1354   11.266   5.4127 3.758632 8.956125 
1 1 1   19   12  -21 o   13.404   5.9102   5.3377   12.597   37.156   23.958  -6.8190   14.809   20.699   8.6064   11.746   5.5971 8.953382 10.26635 
1 1 1   19   12  -20 o   17.968   6.5708   19.667   12.545  -3.5780   23.391   29.054   14.864   14.264   6.8599   20.945   7.2010 -6.680981 9.945462 
1 1 1   19   12  -19 o   15.017   6.1920   11.225   12.260   30.844   22.702   3.1467   14.567   19.613   8.2805   13.420   6.0997 6.193660 10.28458 
1 1 1   19   12  -18 o   16.474   6.6636   15.619   13.869   16.266   22.648   15.231   17.543   16.871   7.6437   16.460   7.1206 0.4118137 10.44644 
1 1 1   19   12  -17 o   15.711   6.2765   13.333   12.142   27.456   22.493   7.5250   14.424   18.952   8.1293   14.351   6.3262 4.601075 10.30080 
1 1 1   19   12  -16 o   16.715   6.4315   16.180   12.349   31.630   22.591   9.5962   14.747   19.842   8.3115   14.900   6.4865 4.942391 10.54302 
1 1 1   19   12  -15 o   13.921   6.2181   5.6158   14.399   0.0000   0.0000   5.6158   14.399  ?   ?    13.921   6.2181 0.000000 6.218139 
1 1 1   19   12  -14 o   14.010   6.0103   7.7202   12.298   11.064   24.503   6.5943   14.219   16.245   7.5706   14.110   6.2478 2.134460 9.815810 
1 1 1   19   12  -13 o   9.5651   4.6692 -14.3188   11.931 -31.5313   23.204  -8.1332   13.910   11.826   5.9031   11.270   5.3853 0.5559931 7.990492 
1 1 1   19   12  -12 f   12.847   5.5807   4.7738   10.867 -14.0090   16.274   19.889   14.599   11.347   5.5196   17.841   6.9578 -6.494672 8.881269 
1 1 1   19   12  -11 o   10.676   4.9832  -3.9587   10.683 -17.5974   16.305   6.3017   14.142   10.961   5.3732   14.051   6.2259 -3.090578 8.223942 
1 1 1   19   12  -10 o   24.963   5.6910   33.688   11.322   28.601   16.958   37.780   15.208   20.262   7.5967   24.410   7.1714 -4.147697 10.44697 
1 1 1   19   12   -9 o   16.706   6.1543   15.779   11.037   23.478   16.336   9.3124   14.972   18.788   7.3503   14.918   6.5145 3.869372 9.821686 
1 1 1   19   12   -8 o   14.187   5.8676   8.9460   11.054   3.8104   16.593   13.044   14.823   14.079   6.4417   15.849   6.6911 -1.769901 9.287924 
1 1 1   19   12   -7 o   9.5560   4.6095 -10.4915   10.751 -13.3389   16.076  -8.1878   14.460   11.379   5.5241   11.490   5.4904 -0.1108732 7.788418 
1 1 1   19   12   -6 o   14.341   5.8721   9.4443   10.927  -9.1785   16.322   24.571   14.710   11.988   5.7563   19.485   7.1169 -7.496843 9.153386 
1 1 1   19   12   -5 o   12.197   5.4356   2.1792   10.938   14.246   16.397  -7.4935   14.681   16.280   6.9611   11.676   5.5663 4.603440 8.912930 
1 1 1   19   12   -4 o   11.682   5.3904  -1.7309   11.964  -2.9592   16.429  -0.3441   17.456   12.916   6.0768   13.589   6.3517 -0.6727781 8.790462 
1 1 1   19   12   -3 o   13.355   5.8985   4.7554   12.596   7.7732   17.951   1.8277   17.680   15.080   6.8211   13.991   6.4898 1.088773 9.415137 
1 1 1   19   12   -2 o   9.7305   4.6677  -9.2093   10.676   2.9245   13.882 -26.7689   16.700   13.279   6.0035   10.242   5.0956 3.037055 7.874444 
1 1 1   19   12   -1 o   18.735   6.2006   20.353   11.021   11.123   14.232   34.179   17.419   15.307   6.5133   22.053   7.7817 -6.746219 10.14780 
1 1 1   19   12    0 o   14.904   6.1869   10.525   12.353   7.9918   14.211   18.358   24.990   14.508   6.3407   17.441   7.9514 -2.933121 10.17000 
1 1 1   19   12    1 o   15.329   6.4907   11.297   14.016   11.297   14.016   0.0000   0.0000   15.329   6.4907  ?   ?  0.000000 6.490705 
1 1 1   19   12    2 o   16.143   6.6682   14.130   14.252   14.130   14.252   0.0000   0.0000   16.143   6.6682  ?   ?  0.000000 6.668230 
1 1 1   19   12    3 o   9.8106   4.7529 -12.0500   11.742  -1.4034   13.601 -43.2154   23.270   12.327   5.7090   11.133   5.6060 1.194242 8.001256 
1 1 1   19   12    4 o   9.8054   4.7028  -9.1924   10.825 -10.3433   13.784  -7.3402   17.486   10.932   5.2595   12.590   6.0218 -1.657732 7.995249 
1 1 1   19   12    5 o   12.299   5.4724   2.4376   11.042   3.5527   14.222   0.7457   17.519   13.494   6.0907   13.773   6.4129 -0.2791300 8.844263 
1 1 1   19   12    6 o   34.845   4.9460   60.966   13.654   17.267   18.963  108.023   19.678   17.069   7.3937   45.683   5.3877 -28.61394 9.148462 
1 1 1   19   12    7 o   25.359   5.7450   34.841   11.599   24.983   14.768   50.716   18.741   19.612   7.1357   27.296   7.9445 -7.684540 10.67863 
1 1 1   19   12    8 o   10.505   4.9504  -5.5785   10.980 -14.8295   14.084   8.7619   17.535   10.452   5.0957   15.182   6.8153 -4.729681 8.509645 
1 1 1   19   12    9 o   10.822   5.0470  -3.7836   10.918 -14.3740   14.117   11.983   17.224   10.518   5.1221   15.799   6.9407 -5.280457 8.626068 
1 1 1   19   12   10 o   12.422   5.5107   2.8900   11.113 -10.0759   14.344   22.357   17.575   11.167   5.3707   18.308   7.4660 -7.141009 9.197062 
1 1 1   19   12   11 o   14.782   5.9933   10.691   11.248   20.123   14.637  -2.9133   17.578   17.925   6.9734   13.196   6.2320 4.729339 9.352332 
1 1 1   19   12   12 f   14.493   5.9425   9.8699   11.210  -5.9338   14.387   34.284   17.882   11.784   5.5867   21.805   7.8635 -10.02130 9.646023 
1 1 1   19   12   13 o   19.488   6.3501   22.546   11.577   10.958   14.878   40.328   18.431   15.272   6.5820   23.603   8.0211 -8.331562 10.37591 
1 1 1   19   12   14 o   13.229   5.7042   5.8533   11.185  -9.7877   14.511   28.749   17.556   11.249   5.4082   20.096   7.6848 -8.846868 9.397042 
1 1 1   19   12   15 o   15.597   6.1347   13.051   11.431   9.6451   14.767   18.143   18.056   14.919   6.4929   17.162   7.3205 -2.242979 9.785082 
1 1 1   19   12   16 o   10.803   5.1523  -7.7819   12.606 -12.3951   18.095  -3.4319   17.572   12.090   5.8671   13.086   6.1954 -0.9967022 8.532644 
1 1 1   19   12   17 o   15.743   6.7094   12.820   15.144   16.547   29.067   11.431   17.743   17.161   8.0766   15.664   6.9551 1.496898 10.65858 
1 1 1   19   12   18 o   14.304   6.5916   4.1122   17.804   0.0000   0.0000   4.1122   17.804  ?   ?    14.304   6.5916 0.000000 6.591586 
1 1 1   19   12   19 o   14.752   6.4132   9.2892   14.373   6.8922   24.120   10.609   17.898   15.618   7.3528   15.498   6.9268 0.1199760 10.10170 
1 1 1   19   12   20 o   19.224   7.1313   24.365   14.866   7.4111   25.400   33.198   18.333   15.796   7.4696   21.176   7.9071 -5.379375 10.87734 
1 1 1   19   12   21 o   12.528   5.8358  -1.4191   14.530 -24.9914   24.769   10.950   17.942   12.618   6.2654   15.537   6.9405 -2.919369 9.350163 
1 1 1   19   12   22 o   14.812   6.4422   9.6132   14.518   8.8759   25.054   9.9858   17.813   15.901   7.4884   15.317   6.8732 0.5837793 10.16452 
1 1 1   19   12   23 o   11.254   5.4075  -9.2961   14.464  -4.1479   24.975 -11.8941   17.742   14.418   6.9722   11.992   5.8172 2.426741 9.080275 
1 1 1   19   12   24 o   12.328   5.7828  -2.6949   14.686   40.744   25.760 -23.6106   17.875   20.956   8.8326   10.840   5.3721 10.11643 10.33804 
1 1 1   19   12   25 o   12.237   5.7293  -2.4751   14.301 -23.4277   23.870   9.2564   17.861   12.486   6.1913   15.135   6.8292 -2.649555 9.217883 
1 1 1   19   12   26 o   9.8431   4.9499 -35.8919   17.824   0.0000   0.0000 -35.8919   17.824  ?   ?    9.8431   4.9499 0.000000 4.949882 
1 1 1   19   12   27 o   14.929   6.7960   8.1445   18.166   0.0000   0.0000   8.1445   18.166  ?   ?    14.929   6.7960 0.000000 6.795973 
1 1 1   19   12   28 o   18.363   7.5752   24.145   18.361   0.0000   0.0000   24.145   18.361  ?   ?    18.363   7.5752 0.000000 7.575226 
1 1 1   19   12   29 f   10.734   5.3174 -22.6598   17.441   0.0000   0.0000 -22.6598   17.441  ?   ?    10.734   5.3174 0.000000 5.317407 
1 1 1   19   12   30 o   16.058   7.0858   14.367   18.137   0.0000   0.0000   14.367   18.137  ?   ?    16.058   7.0858 0.000000 7.085842 
1 1 1   19   12   31 o   17.973   8.1527   25.546   25.862   0.0000   0.0000   25.546   25.862  ?   ?    17.973   8.1527 0.000000 8.152739 
1 1 1   19   12   32 o   13.146   6.4651 -14.7523   24.207   0.0000   0.0000 -14.7523   24.207  ?   ?    13.146   6.4651 0.000000 6.465075 
1 1 1   19   12   33 o   15.583   7.4071   7.9829   25.614   0.0000   0.0000   7.9829   25.614  ?   ?    15.583   7.4071 0.000000 7.407140 
1 1 1   19   12   34 o   19.050   8.4734   33.193   26.450   0.0000   0.0000   33.193   26.450  ?   ?    19.050   8.4734 0.000000 8.473407 
1 1 1   19   12   35 o   13.866   6.7587  -7.0510   24.738   0.0000   0.0000  -7.0510   24.738  ?   ?    13.866   6.7587 0.000000 6.758715 
1 1 1   19   12   39 o   14.830   7.0950   4.1389   24.303   0.0000   0.0000   4.1389   24.303  ?   ?    14.830   7.0950 0.000000 7.095030 
1 1 1   19   12   40 o   10.464   5.1977 -23.1818   17.112   0.0000   0.0000 -23.1818   17.112  ?   ?    10.464   5.1977 0.000000 5.197708 
1 1 1   19   12   41 o   15.622   6.9027   13.797   17.268   0.0000   0.0000   13.797   17.268  ?   ?    15.622   6.9027 0.000000 6.902747 
1 1 1   19   12   42 f   10.816   5.3147 -16.5179   16.248   0.0000   0.0000 -16.5179   16.248  ?   ?    10.816   5.3147 0.000000 5.314675 
1 1 1   19   12   43 o   16.902   7.1995   19.448   17.422   0.0000   0.0000   19.448   17.422  ?   ?    16.902   7.1995 0.000000 7.199545 
1 1 1   19   12   44 o   12.041   5.9770 -21.9188   22.477   0.0000   0.0000 -21.9188   22.477  ?   ?    12.041   5.9770 0.000000 5.976959 
1 1 1   19   12   45 o   15.346   7.2567   8.9005   23.976   0.0000   0.0000   8.9005   23.976  ?   ?    15.346   7.2567 0.000000 7.256749 
1 1 1   19   13  -32 o   14.983   7.1068   7.1796   23.329   0.0000   0.0000   7.1796   23.329  ?   ?    14.983   7.1068 0.000000 7.106760 
1 1 1   19   13  -31 o   15.139   7.1560   8.6650   23.273   0.0000   0.0000   8.6650   23.273  ?   ?    15.139   7.1560 0.000000 7.156020 
1 1 1   19   13  -30 f   19.782   8.4522   37.964   24.142   0.0000   0.0000   37.964   24.142  ?   ?    19.782   8.4522 0.000000 8.452177 
1 1 1   19   13  -29 o   13.012   6.1734  -1.0943   17.624   0.0000   0.0000  -1.0943   17.624  ?   ?    13.012   6.1734 0.000000 6.173371 
1 1 1   19   13  -28 o   13.385   6.0573   5.2940   14.173   23.681   23.897  -4.6829   17.603   17.247   7.8289   12.525   6.0044 4.722479 9.866311 
1 1 1   19   13  -27 o   19.890   7.0979   27.834   14.528   36.093   23.954   23.029   18.272   19.447   8.3661   17.559   7.4218 1.888220 11.18368 
1 1 1   19   13  -26 o   12.654   5.8378   1.8020   14.022  -7.8351   23.247   7.3133   17.580   13.318   6.5048   14.315   6.5795 -0.9963627 9.252171 
1 1 1   19   13  -25 o   15.083   6.4780   12.531   14.317  -3.7580   23.233   22.505   18.180   13.708   6.6514   17.434   7.3875 -3.725747 9.940661 
1 1 1   19   13  -24 o   17.714   6.9096   21.563   14.400   5.3259   23.858   30.868   18.061   14.757   7.0517   19.656   7.7173 -4.899444 10.45388 
1 1 1   19   13  -23 o   12.884   5.9000   3.0303   13.961 -17.9194   23.348   14.690   17.418   12.478   6.1759   15.722   6.9404 -3.244495 9.290398 
1 1 1   19   13  -22 o   15.759   6.6279   14.950   14.456   7.3268   24.077   19.246   18.076   15.049   7.1615   16.730   7.2327 -1.680066 10.17832 
1 1 1   19   13  -21 f   19.637   7.2113   27.593   15.135   0.0000   0.0000   27.593   15.135  ?   ?    19.637   7.2113 0.000000 7.211324 
1 1 1   19   13  -20 o   21.426   7.9336   36.701   18.383   0.0000   0.0000   36.701   18.383  ?   ?    21.426   7.9336 0.000000 7.933619 
1 1 1   19   13  -19 o   28.098   7.8008   55.647   18.499   0.0000   0.0000   55.647   18.499  ?   ?    28.098   7.8008 0.000000 7.800791 
1 1 1   19   13  -18 o   12.863   5.8971   2.6208   13.997   27.246   23.742 -10.4966   17.328   17.988   8.0129   11.799   5.7296 6.189509 9.850628 
1 1 1   19   13  -17 o   14.101   6.2483   8.1671   14.246   2.7686   23.357   11.365   17.976   14.525   6.9509   15.187   6.8518 -0.6612597 9.760267 
1 1 1   19   13  -16 o   20.881   7.1780   30.333   14.769   21.355   24.421   35.510   18.545   17.036   7.8022   21.074   7.9351 -4.037964 11.12837 
1 1 1   19   13  -15 o   10.610   5.1493 -11.4497   13.941 -13.3910   22.939 -10.3130   17.554   12.860   6.3182   11.904   5.7774 0.9561558 8.561420 
1 1 1   19   13  -14 o   16.813   6.8410   18.289   14.716   34.512   25.118   9.8094   18.160   19.192   8.4079   14.956   6.8028 4.236631 10.81531 
1 1 1   19   13  -13 o   12.260   5.7454  -1.5320   14.437 -12.9880   23.941   5.0139   18.097   13.110   6.4437   14.141   6.5618 -1.031493 9.196675 
1 1 1   19   13  -12 o   12.116   5.7071  -2.6654   14.567   10.681   24.721  -9.7646   18.030   15.664   7.3957   12.118   5.8752 3.546230 9.445298 
1 1 1   19   13  -11 o   25.982   6.9706   43.032   15.068   13.273   24.603   60.895   19.061   15.998   7.4983   29.811   7.7670 -13.81294 10.79587 
1 1 1   19   13  -10 o   10.987   5.3107 -10.1752   14.454  -7.1220   23.880 -11.9404   18.157   13.655   6.6523   11.921   5.8062 1.733571 8.829823 
1 1 1   19   13   -9 o   11.213   5.3770  -7.7704   14.141 -10.4234   23.499  -6.2642   17.706   13.286   6.5000   12.474   5.9909 0.8124533 8.839737 
1 1 1   19   13   -8 o   16.980   6.8532   18.622   14.633   18.333   24.411   18.784   18.281   16.713   7.7076   16.824   7.2736 -0.1113472 10.59775 
1 1 1   19   13   -7 o   13.760   6.1860   6.0911   14.505   15.502   17.390 -15.4292   26.297   16.103   7.0266   13.374   6.6075 2.729609 9.645312 
1 1 1   19   13   -6 o   14.822   6.4313   10.764   14.398   11.343   17.216   9.4174   26.262   15.219   6.7983   15.672   7.4636 -0.4527359 10.09570 
1 1 1   19   13   -5 o   12.193   5.7067  -1.6383   14.165  -7.3971   16.877   12.088   26.056   12.117   5.8273   15.968   7.5552 -3.850848 9.541408 
1 1 1   19   13   -4 f   16.069   6.3410   15.270   12.248   1.4739   16.693   31.355   18.025   13.353   6.2317   20.154   7.7662 -6.800334 9.957312 
1 1 1   19   13   -3 o   13.146   5.9666   3.7749   13.875   13.836   16.734 -18.3651   24.823   15.722   6.8758   12.888   6.3769 2.834100 9.377728 
1 1 1   19   13   -2 o   12.679   5.7048   3.3624   12.366   7.0023   16.628  -1.1414   18.496   14.310   6.5093   13.346   6.3295 0.9638329 9.079309 
1 1 1   19   13   -1 o   8.6497   4.3086 -22.0465   12.094 -19.3482   16.535 -25.1504   17.734   10.674   5.2673   10.542   5.2458 0.1320143 7.433872 
1 1 1   19   13    0 o   13.770   5.9836   7.6547   12.500 -11.1476   16.990   29.846   18.457   11.695   5.6779   19.603   7.7688 -7.907972 9.622525 
1 1 1   19   13    1 o   14.386   6.0776   10.002   12.243   4.7424   16.473   16.493   18.299   13.870   6.3729   16.346   7.1683 -2.476044 9.591568 
1 1 1   19   13    2 o   12.030   5.5287   0.3278   12.408   1.5033   16.923  -1.0389   18.247   13.409   6.2632   13.308   6.3043 0.1009064 8.886650 
1 1 1   19   13    3 o   9.9496   4.8304 -11.7333   12.297   22.283   16.786 -51.1225   18.064   17.817   7.2848   8.9305   4.5444 8.886251 8.585985 
1 1 1   19   13    4 f   13.924   6.0208   8.2229   12.531  -4.7936   16.942   23.946   18.620   12.481   5.9581   18.019   7.5467 -5.538550 9.615174 
1 1 1   19   13    5 o   12.726   5.8585   1.5137   14.016   12.719   16.807 -24.0753   25.397   15.477   6.8254   12.580   6.2628 2.896596 9.263317 
1 1 1   19   13    6 o   13.527   5.9317   6.7277   12.527   29.601   17.324 -18.3383   18.135   19.823   7.6202   11.272   5.5534 8.551395 9.429127 
1 1 1   19   13    7 o   17.570   6.5843   19.612   12.736   31.882   17.379   5.3796   18.718   20.515   7.6907   14.336   6.6595 6.178509 10.17329 
1 1 1   19   13    8 o   12.949   5.9135   2.8287   13.898   25.265   16.921 -43.6759   24.362   18.618   7.4190   11.134   5.6224 7.484400 9.308734 
1 1 1   19   13    9 o   12.248   5.7030  -0.7685   13.855  -6.7832   16.661   12.712   24.943   12.129   5.8219   15.966   7.5043 -3.836734 9.497841 
1 1 1   19   13   10 o   13.769   6.3855   3.6171   17.102   11.366   23.971  -4.4164   24.407   15.726   7.3803   13.999   6.7985 1.726521 10.03440 
1 1 1   19   13   11 o   13.067   5.9869   2.8847   14.399   16.266   24.084  -4.5601   17.964   16.383   7.5909   12.744   6.0979 3.638949 9.736789 
1 1 1   19   13   12 o   15.168   6.5522   12.148   14.811   15.100   25.250   10.600   18.288   16.248   7.6091   15.136   6.8618 1.112263 10.24612 
1 1 1   19   13   13 o   13.991   6.2548   7.2434   14.605   0.2346   24.265   11.225   18.288   14.417   6.9470   15.239   6.8898 -0.8216200 9.784163 
1 1 1   19   13   14 o   17.107   6.9033   19.313   14.845   11.124   24.363   24.148   18.722   15.665   7.3795   17.962   7.5478 -2.296225 10.55590 
1 1 1   19   13   15 o   10.284   5.0506 -16.2589   14.612 -32.9080   25.170  -7.7952   17.946   11.901   5.9708   12.304   5.9400 -0.4023733 8.422288 
1 1 1   19   13   16 o   17.046   6.9322   19.298   15.102   13.718   25.850   22.189   18.607   16.030   7.5665   17.473   7.4416 -1.442938 10.61270 
1 1 1   19   13   17 o   16.409   6.7527   17.008   14.543  -4.0952   24.466   28.540   18.085   13.960   6.7856   19.159   7.6581 -5.198792 10.23186 
1 1 1   19   13   18 o   12.225   5.7415  -1.7165   14.553  -5.4744   23.730   0.5486   18.424   13.703   6.6658   13.472   6.3679 0.2307978 9.218575 
1 1 1   19   13   19 o   10.483   5.1101 -12.9239   14.152  -5.2212   23.467 -17.3263   17.741   13.674   6.6465   11.188   5.5085 2.485814 8.632489 
1 1 1   19   13   20 o   9.3942   4.6806 -23.7159   14.307 -25.0651   23.204 -22.8885   18.172   11.947   5.9538   10.804   5.3648 1.143233 8.014277 
1 1 1   19   13   21 f   14.545   6.4277   9.8889   14.977   45.230   25.214  -9.3799   18.618   21.080   8.8019   12.239   5.9421 8.841299 10.61991 
1 1 1   19   13   22 o   24.323   8.1332   46.551   18.951   0.0000   0.0000   46.551   18.951  ?   ?    24.323   8.1332 0.000000 8.133238 
1 1 1   19   13   23 o   15.038   6.8311   10.953   18.233   0.0000   0.0000   10.953   18.233  ?   ?    15.038   6.8311 0.000000 6.831069 
1 1 1   19   13   24 o   13.341   6.5521 -10.0537   24.595   0.0000   0.0000 -10.0537   24.595  ?   ?    13.341   6.5521 0.000000 6.552135 
1 1 1   19   13   25 o   17.059   7.3232   20.940   18.280   17.127   25.388   25.046   26.343   16.280   7.6261   17.320   7.9944 -1.039440 11.04842 
1 1 1   19   13   26 o   11.380   5.5833 -14.9094   17.716 -41.2270   24.593   13.483   25.544   11.214   5.6614   15.838   7.4897 -4.623802 9.388713 
1 1 1   19   13   27 o   13.052   6.1859  -0.7926   17.607   0.1621   25.126  -1.7136   24.679   14.364   6.9571   14.124   6.8538 0.2394581 9.766073 
1 1 1   19   13   28 o   12.792   6.0868  -2.3129   17.389 -11.1126   25.087   5.8250   24.125   13.342   6.5654   14.851   7.0953 -1.508965 9.666832 
1 1 1   19   13   29 o   14.571   6.9844   3.6371   23.800   0.0000   0.0000   3.6371   23.800  ?   ?    14.571   6.9844 0.000000 6.984384 
1 1 1   19   13   30 f   17.476   7.9239   25.285   24.398   0.0000   0.0000   25.285   24.398  ?   ?    17.476   7.9239 0.000000 7.923934 
1 1 1   19   13   31 o   11.599   5.8175 -31.9187   23.815   0.0000   0.0000 -31.9187   23.815  ?   ?    11.599   5.8175 0.000000 5.817532 
1 1 1   19   13   32 o   14.567   7.0502   1.1179   25.678   0.0000   0.0000   1.1179   25.678  ?   ?    14.567   7.0502 0.000000 7.050166 
1 1 1   20    0 -100 o   12.817   8.6312   6.4285   25.877   6.4285   25.877   6.4285   25.877   12.817   8.6312   12.817   8.6312 0.000000 0.000000 
1 1 1   20    0  -99 o   8.9438   6.4754 -33.1167   25.124 -33.1167   25.124 -33.1167   25.124   8.9438   6.4754   8.9438   6.4754 0.000000 0.000000 
1 1 1   20    0  -98 o   13.837   9.1330   12.965   26.567   12.965   26.567   12.965   26.567   13.837   9.1330   13.837   9.1330 0.000000 0.000000 
1 1 1   20    0  -97 o   11.938   8.1656   0.2996   25.068   0.2996   25.068   0.2996   25.068   11.938   8.1656   11.938   8.1656 0.000000 0.000000 
1 1 1   20    0  -96 o   11.980   8.2544  -1.8336   26.721  -1.8336   26.721  -1.8336   26.721   11.980   8.2544   11.980   8.2544 0.000000 0.000000 
1 1 1   20    0  -95 o   10.206   7.2763 -21.0439   26.785 -21.0439   26.785 -21.0439   26.785   10.206   7.2763   10.206   7.2763 0.000000 0.000000 
1 1 1   20    0  -94 o   15.475   9.9204   20.974   28.295   20.974   28.295   20.974   28.295   15.475   9.9204   15.475   9.9204 0.000000 0.000000 
1 1 1   20    0  -92 o   14.066   9.2661   12.123   27.143   12.123   27.143   12.123   27.143   14.066   9.2661   14.066   9.2661 0.000000 0.000000 
1 1 1   20    0  -91 o   17.218   10.414   28.452   26.867   28.452   26.867   28.452   26.867   17.218   10.414   17.218   10.414 0.000000 0.000000 
1 1 1   20    0  -90 f   10.913   7.6316 -10.8347   25.149 -10.8347   25.149 -10.8347   25.149   10.913   7.6316   10.913   7.6316 0.000000 0.000000 
1 1 1   20    0  -89 o   11.296   7.4931   2.5041   18.249   2.5041   18.249   2.5041   18.249   11.296   7.4931   11.296   7.4931 0.000000 0.000000 
1 1 1   20    0  -88 o   10.782   7.2832  -1.3014   18.697  -1.3014   18.697  -1.3014   18.697   10.782   7.2832   10.782   7.2832 0.000000 0.000000 
1 1 1   20    0  -87 o   11.737   7.6968   4.3186   18.406   4.3186   18.406   4.3186   18.406   11.737   7.6968   11.737   7.6968 0.000000 0.000000 
1 1 1   20    0  -86 o   15.690   8.8975   19.652   17.590   19.652   17.590   19.652   17.590   15.690   8.8975   15.690   8.8975 0.000000 0.000000 
1 1 1   20    0  -85 o   16.119   9.1874   20.983   18.886   20.983   18.886   20.983   18.886   16.119   9.1874   16.119   9.1874 0.000000 0.000000 
1 1 1   20    0  -84 o   37.514   7.4211   71.827   20.173   71.827   20.173   71.827   20.173   37.514   7.4211   37.514   7.4211 0.000000 0.000000 
1 1 1   20    0  -83 o   10.103   6.9184  -5.7929   18.113  -5.7929   18.113  -5.7929   18.113   10.103   6.9184   10.103   6.9184 0.000000 0.000000 
1 1 1   20    0  -82 o   38.262   7.1370   72.791   19.989   72.791   19.989   72.791   19.989   38.262   7.1370   38.262   7.1370 0.000000 0.000000 
1 1 1   20    0  -81 f   11.688   7.6143   3.4776   17.587   3.4776   17.587   3.4776   17.587   11.688   7.6143   11.688   7.6143 0.000000 0.000000 
1 1 1   20    0  -80 o   9.2310   6.4139 -10.5450   17.002 -10.5450   17.002 -10.5450   17.002   9.2310   6.4139   9.2310   6.4139 0.000000 0.000000 
1 1 1   20    0  -79 o   13.296   8.2018   10.033   17.410   10.033   17.410   10.033   17.410   13.296   8.2018   13.296   8.2018 0.000000 0.000000 
1 1 1   20    0  -78 o   63.840   3.0660  171.024   15.871  171.024   15.871  171.024   15.871   63.840   3.0660   63.840   3.0660 0.000000 0.000000 
1 1 1   20    0  -77 o   22.854   7.6128   29.588   12.629   29.588   12.629   29.588   12.629   22.854   7.6128   22.854   7.6128 0.000000 0.000000 
1 1 1   20    0  -76 o   11.707   7.3055   5.9390   14.214   5.9390   14.214   5.9390   14.214   11.707   7.3055   11.707   7.3055 0.000000 0.000000 
1 1 1   20    0  -75 o   27.547   6.6696   37.993   12.980   37.993   12.980   37.993   12.980   27.547   6.6696   27.547   6.6696 0.000000 0.000000 
1 1 1   20    0  -74 f   7.5305   5.4085 -23.9432   15.946 -23.9432   15.946 -23.9432   15.946   7.5305   5.4085   7.5305   5.4085 0.000000 0.000000 
1 1 1   20    0  -73 o   44.362   5.4548   87.873   18.927   87.873   18.927   87.873   18.927   44.362   5.4548   44.362   5.4548 0.000000 0.000000 
1 1 1   20    0  -72 o   49.821   4.8240  107.943   19.141  107.943   19.141  107.943   19.141   49.821   4.8240   49.821   4.8240 0.000000 0.000000 
1 1 1   20    0  -71 o   23.465   7.5811   30.182   12.809   30.182   12.809   30.182   12.809   23.465   7.5811   23.465   7.5811 0.000000 0.000000 
1 1 1   20    0  -70 o   8.4243   5.7092  -4.7679   11.677  -4.7679   11.677  -4.7679   11.677   8.4243   5.7092   8.4243   5.7092 0.000000 0.000000 
1 1 1   20    0  -69 o   15.228   7.7844   15.259   12.204   15.259   12.204   15.259   12.204   15.228   7.7844   15.228   7.7844 0.000000 0.000000 
1 1 1   20    0  -68 o   16.691   7.9327   18.051   12.293   18.051   12.293   18.051   12.293   16.691   7.9327   16.691   7.9327 0.000000 0.000000 
1 1 1   20    0  -67 o   16.478   7.9848   17.678   12.525   17.678   12.525   17.678   12.525   16.478   7.9848   16.478   7.9848 0.000000 0.000000 
1 1 1   20    0  -66 o   61.834   3.1348  159.192   15.707  159.192   15.707  159.192   15.707   61.834   3.1348   61.834   3.1348 0.000000 0.000000 
1 1 1   20    0  -65 o   32.595   5.3226   48.054   13.011   48.054   13.011   48.054   13.011   32.595   5.3226   32.595   5.3226 0.000000 0.000000 
1 1 1   20    0  -64 o   40.740   4.0074   70.970   12.992   70.970   12.992   70.970   12.992   40.740   4.0074   40.740   4.0074 0.000000 0.000000 
1 1 1   20    0  -63 o   9.3262   6.1331  -1.1571   11.812  -1.1571   11.812  -1.1571   11.812   9.3262   6.1331   9.3262   6.1331 0.000000 0.000000 
1 1 1   20    0  -62 o   31.118   6.8531   46.500   15.209   46.500   15.209   46.500   15.209   31.118   6.8531   31.118   6.8531 0.000000 0.000000 
1 1 1   20    0  -61 o   16.275   8.4268   17.249   14.419   17.249   14.419   17.249   14.419   16.275   8.4268   16.275   8.4268 0.000000 0.000000 
1 1 1   20    0  -59 o   18.382   8.6536   21.592   14.597   21.592   14.597   21.592   14.597   18.382   8.6536   18.382   8.6536 0.000000 0.000000 
1 1 1   20    0  -58 o   47.347   4.2981   95.303   16.258   95.303   16.258   95.303   16.258   47.347   4.2981   47.347   4.2981 0.000000 0.000000 
1 1 1   20    0  -57 o   11.219   7.1434   2.4977   14.369   2.4977   14.369   2.4977   14.369   11.219   7.1434   11.219   7.1434 0.000000 0.000000 
1 1 1   20    0  -56 o   11.731   7.3044   4.6175   14.131   4.6175   14.131   4.6175   14.131   11.731   7.3044   11.731   7.3044 0.000000 0.000000 
1 1 1   20    0  -55 o   44.415   4.6611   84.560   16.410   84.560   16.410   84.560   16.410   44.415   4.6611   44.415   4.6611 0.000000 0.000000 
1 1 1   20    0  -54 o   8.3593   5.7903 -10.4802   13.582 -10.4802   13.582 -10.4802   13.582   8.3593   5.7903   8.3593   5.7903 0.000000 0.000000 
1 1 1   20    0  -53 f   32.523   5.5211   47.588   13.371   47.588   13.371   47.588   13.371   32.523   5.5211   32.523   5.5211 0.000000 0.000000 
1 1 1   20    0  -52 o   49.894   3.5265  103.960   14.175  103.960   14.175  103.960   14.175   49.894   3.5265   49.894   3.5265 0.000000 0.000000 
1 1 1   20    0  -51 o   6.9850   4.9491 -14.6495   11.720 -14.6495   11.720 -14.6495   11.720   6.9850   4.9491   6.9850   4.9491 0.000000 0.000000 
1 1 1   20    0  -50 o   46.642   3.7201   91.216   13.930   91.216   13.930   91.216   13.930   46.642   3.7201   46.642   3.7201 0.000000 0.000000 
1 1 1   20    0  -49 o   22.851   7.4520   27.751   12.290   27.751   12.290   27.751   12.290   22.851   7.4520   22.851   7.4520 0.000000 0.000000 
1 1 1   20    0  -48 o   12.003   6.7601   8.1855   10.063   8.1855   10.063   8.1855   10.063   12.003   6.7601   12.003   6.7601 0.000000 0.000000 
1 1 1   20    0  -47 o   40.586   3.3934   69.009   11.039   69.009   11.039   69.009   11.039   40.586   3.3934   40.586   3.3934 0.000000 0.000000 
1 1 1   20    0  -46 o   15.030   7.2321   13.919   10.252   13.919   10.252   13.919   10.252   15.030   7.2321   15.030   7.2321 0.000000 0.000000 
1 1 1   20    0  -45 o   44.127   3.2949   81.167   11.696   81.167   11.696   81.167   11.696   44.127   3.2949   44.127   3.2949 0.000000 0.000000 
1 1 1   20    0  -44 o   10.407   6.3120   4.3594   9.9278   4.3594   9.9278   4.3594   9.9278   10.407   6.3120   10.407   6.3120 0.000000 0.000000 
1 1 1   20    0  -43 o   76.128   2.3282  237.544   14.417  237.544   14.417  237.544   14.417   76.128   2.3282   76.128   2.3282 0.000000 0.000000 
1 1 1   20    0  -42 o   85.928   2.4919  302.643   17.421  302.643   17.421  302.643   17.421   85.928   2.4919   85.928   2.4919 0.000000 0.000000 
1 1 1   20    0  -41 o   23.253   6.5647   27.033   10.773   27.033   10.773   27.033   10.773   23.253   6.5647   23.253   6.5647 0.000000 0.000000 
1 1 1   20    0  -40 o  119.487   2.4711  584.289   24.045  584.289   24.045  584.289   24.045  119.487   2.4711  119.487   2.4711 0.000000 0.000000 
1 1 1   20    0  -39 o   9.3067   6.1568  -2.6374   12.185  -2.6374   12.185  -2.6374   12.185   9.3067   6.1568   9.3067   6.1568 0.000000 0.000000 
1 1 1   20    0  -38 o   61.113   3.2118  154.146   15.898  154.146   15.898  154.146   15.898   61.113   3.2118   61.113   3.2118 0.000000 0.000000 
1 1 1   20    0  -37 o   31.927   5.7291   45.808   13.483   45.808   13.483   45.808   13.483   31.927   5.7291   31.927   5.7291 0.000000 0.000000 
1 1 1   20    0  -36 o   16.544   7.6278   16.576   11.303   16.576   11.303   16.576   11.303   16.544   7.6278   16.544   7.6278 0.000000 0.000000 
1 1 1   20    0  -35 o   99.141   2.6680  402.577   21.526  402.577   21.526  402.577   21.526   99.141   2.6680   99.141   2.6680 0.000000 0.000000 
1 1 1   20    0  -34 o   67.189   2.7357  185.423   14.927  185.423   14.927  185.423   14.927   67.189   2.7357   67.189   2.7357 0.000000 0.000000 
1 1 1   20    0  -33 o   92.425   2.4031  349.604   18.077  349.604   18.077  349.604   18.077   92.425   2.4031   92.425   2.4031 0.000000 0.000000 
1 1 1   20    0  -32 o  150.414   2.2491  924.380   27.563  924.380   27.563  924.380   27.563  150.414   2.2491  150.414   2.2491 0.000000 0.000000 
1 1 1   20    0  -31 o   17.210   8.4976   18.187   14.286   18.187   14.286   18.187   14.286   17.210   8.4976   17.210   8.4976 0.000000 0.000000 
1 1 1   20    0  -30 o   74.437   3.1854  227.824   19.247  227.824   19.247  227.824   19.247   74.437   3.1854   74.437   3.1854 0.000000 0.000000 
1 1 1   20    0  -29 o  124.156   2.2295  629.877   22.547  629.877   22.547  629.877   22.547  124.156   2.2295  124.156   2.2295 0.000000 0.000000 
1 1 1   20    0  -28 o   30.677   5.4683   42.112   12.380   42.112   12.380   42.112   12.380   30.677   5.4683   30.677   5.4683 0.000000 0.000000 
1 1 1   20    0  -27 o   16.448   7.7858   16.425   11.831   16.425   11.831   16.425   11.831   16.448   7.7858   16.448   7.7858 0.000000 0.000000 
1 1 1   20    0  -26 o   8.7909   5.8825  -4.0929   11.674  -4.0929   11.674  -4.0929   11.674   8.7909   5.8825   8.7909   5.8825 0.000000 0.000000 
1 1 1   20    0  -25 o   27.489   6.1085   35.240   11.963   35.240   11.963   35.240   11.963   27.489   6.1085   27.489   6.1085 0.000000 0.000000 
1 1 1   20    0  -24 o   55.842   2.9997  128.513   13.564  128.513   13.564  128.513   13.564   55.842   2.9997   55.842   2.9997 0.000000 0.000000 
1 1 1   20    0  -23 f   77.593   2.4685  246.542   15.577  246.542   15.577  246.542   15.577   77.593   2.4685   77.593   2.4685 0.000000 0.000000 
1 1 1   20    0  -22 o   57.548   2.8945  136.308   13.499  136.308   13.499  136.308   13.499   57.548   2.8945   57.548   2.8945 0.000000 0.000000 
1 1 1   20    0  -21 o  135.760   2.4969  753.199   27.611  753.199   27.611  753.199   27.611  135.760   2.4969  135.760   2.4969 0.000000 0.000000 
1 1 1   20    0  -20 o   52.629   4.6419  116.118   19.542  116.118   19.542  116.118   19.542   52.629   4.6419   52.629   4.6419 0.000000 0.000000 
1 1 1   20    0  -19 o  122.424   3.1237  613.584   31.127  613.584   31.127  613.584   31.127  122.424   3.1237  122.424   3.1237 0.000000 0.000000 
1 1 1   20    0  -18 o   87.251   3.4115  312.611   24.179  312.611   24.179  312.611   24.179   87.251   3.4115   87.251   3.4115 0.000000 0.000000 
1 1 1   20    0  -17 o   28.497   8.6157   41.473   17.453   41.473   17.453   41.473   17.453   28.497   8.6157   28.497   8.6157 0.000000 0.000000 
1 1 1   20    0  -16 o   30.354   5.4420   41.205   12.178   41.205   12.178   41.205   12.178   30.354   5.4420   30.354   5.4420 0.000000 0.000000 
1 1 1   20    0  -15 o  119.087   2.9431  580.285   28.530  580.285   28.530  580.285   28.530  119.087   2.9431  119.087   2.9431 0.000000 0.000000 
1 1 1   20    0  -14 o  132.584   2.4582  718.232   26.547  718.232   26.547  718.232   26.547  132.584   2.4582  132.584   2.4582 0.000000 0.000000 
1 1 1   20    0  -13 o   62.915   3.0840  162.852   15.729  162.852   15.729  162.852   15.729   62.915   3.0840   62.915   3.0840 0.000000 0.000000 
1 1 1   20    0  -12 o   33.631   5.3078   49.671   13.468   49.671   13.468   49.671   13.468   33.631   5.3078   33.631   5.3078 0.000000 0.000000 
1 1 1   20    0  -11 o   14.245   7.7878   11.770   12.901   11.770   12.901   11.770   12.901   14.245   7.7878   14.245   7.7878 0.000000 0.000000 
1 1 1   20    0  -10 o  146.581   2.4741  877.699   29.542  877.699   29.542  877.699   29.542  146.581   2.4741  146.581   2.4741 0.000000 0.000000 
1 1 1   20    0   -9 o   29.416   6.3652   40.084   13.384   40.084   13.384   40.084   13.384   29.416   6.3652   29.416   6.3652 0.000000 0.000000 
1 1 1   20    0   -8 o  100.373   2.5183  411.983   20.575  411.983   20.575  411.983   20.575  100.373   2.5183  100.373   2.5183 0.000000 0.000000 
1 1 1   20    0   -7 f   95.839   2.5639  375.723   19.997  375.723   19.997  375.723   19.997   95.839   2.5639   95.839   2.5639 0.000000 0.000000 
1 1 1   20    0   -6 o   12.715   7.4352   7.9472   12.861   7.9472   12.861   7.9472   12.861   12.715   7.4352   12.715   7.4352 0.000000 0.000000 
1 1 1   20    0   -5 o   21.796   8.0461   26.157   13.239   26.157   13.239   26.157   13.239   21.796   8.0461   21.796   8.0461 0.000000 0.000000 
1 1 1   20    0   -4 o   19.503   8.2125   22.151   13.149   22.151   13.149   22.151   13.149   19.503   8.2125   19.503   8.2125 0.000000 0.000000 
1 1 1   20    0   -3 o  130.311   2.4741  693.789   26.259  693.789   26.259  693.789   26.259  130.311   2.4741  130.311   2.4741 0.000000 0.000000 
1 1 1   20    0   -2 o  130.941   2.4830  700.524   26.481  700.524   26.481  700.524   26.481  130.941   2.4830  130.941   2.4830 0.000000 0.000000 
1 1 1   20    0   -1 o   62.255   3.2049  159.572   16.165  159.572   16.165  159.572   16.165   62.255   3.2049   62.255   3.2049 0.000000 0.000000 
1 1 1   20    0    0 o   85.070   2.7119  296.335   18.762  296.335   18.762  296.335   18.762   85.070   2.7119   85.070   2.7119 0.000000 0.000000 
1 1 1   20    0    1 o   7.5975   5.3412 -14.2027   12.813 -14.2027   12.813 -14.2027   12.813   7.5975   5.3412   7.5975   5.3412 0.000000 0.000000 
1 1 1   20    0    2 o   89.001   2.6723  324.227   19.348  324.227   19.348  324.227   19.348   89.001   2.6723   89.001   2.6723 0.000000 0.000000 
1 1 1   20    0    3 o   77.927   2.8942  248.984   18.327  248.984   18.327  248.984   18.327   77.927   2.8942   77.927   2.8942 0.000000 0.000000 
1 1 1   20    0    4 o  147.518   3.0210  889.866   36.293  889.866   36.293  889.866   36.293  147.518   3.0210  147.518   3.0210 0.000000 0.000000 
1 1 1   20    0    5 o   58.790   3.9798  143.288   18.869  143.288   18.869  143.288   18.869   58.790   3.9798   58.790   3.9798 0.000000 0.000000 
1 1 1   20    0    6 o   9.8920   6.6409  -5.8656   15.100  -5.8656   15.100  -5.8656   15.100   9.8920   6.6409   9.8920   6.6409 0.000000 0.000000 
1 1 1   20    0    7 f  111.208   2.5214  505.556   22.831  505.556   22.831  505.556   22.831  111.208   2.5214  111.208   2.5214 0.000000 0.000000 
1 1 1   20    0    8 o   12.886   7.5106   8.2779   13.054   8.2779   13.054   8.2779   13.054   12.886   7.5106   12.886   7.5106 0.000000 0.000000 
1 1 1   20    0    9 o   24.417   7.6616   30.758   13.384   30.758   13.384   30.758   13.384   24.417   7.6616   24.417   7.6616 0.000000 0.000000 
1 1 1   20    0   10 o   56.941   3.3925  133.896   15.617  133.896   15.617  133.896   15.617   56.941   3.3925   56.941   3.3925 0.000000 0.000000 
1 1 1   20    0   11 o   32.394   5.6631   46.758   13.587   46.758   13.587   46.758   13.587   32.394   5.6631   32.394   5.6631 0.000000 0.000000 
1 1 1   20    0   12 o   36.619   4.9767   57.891   14.081   57.891   14.081   57.891   14.081   36.619   4.9767   36.619   4.9767 0.000000 0.000000 
1 1 1   20    0   13 o   15.136   8.0378   13.672   13.372   13.672   13.372   13.672   13.372   15.136   8.0378   15.136   8.0378 0.000000 0.000000 
1 1 1   20    0   14 o   71.394   2.9949  209.285   17.359  209.285   17.359  209.285   17.359   71.394   2.9949   71.394   2.9949 0.000000 0.000000 
1 1 1   20    0   15 o   54.167   3.5469  121.474   15.505  121.474   15.505  121.474   15.505   54.167   3.5469   54.167   3.5469 0.000000 0.000000 
1 1 1   20    0   16 o   25.220   7.8284   32.717   14.096   32.717   14.096   32.717   14.096   25.220   7.8284   25.220   7.8284 0.000000 0.000000 
1 1 1   20    0   17 o   66.308   3.1521  180.853   16.949  180.853   16.949  180.853   16.949   66.308   3.1521   66.308   3.1521 0.000000 0.000000 
1 1 1   20    0   18 o   22.981   8.2237   28.748   14.068   28.748   14.068   28.748   14.068   22.981   8.2237   22.981   8.2237 0.000000 0.000000 
1 1 1   20    0   19 o  106.772   2.6099  466.296   22.685  466.296   22.685  466.296   22.685  106.772   2.6099  106.772   2.6099 0.000000 0.000000 
1 1 1   20    0   20 o  153.370   2.5501  961.145   31.861  961.145   31.861  961.145   31.861  153.370   2.5501  153.370   2.5501 0.000000 0.000000 
1 1 1   20    0   21 o   64.506   3.2523  171.360   17.001  171.360   17.001  171.360   17.001   64.506   3.2523   64.506   3.2523 0.000000 0.000000 
1 1 1   20    0   22 o  101.537   2.6094  421.810   21.565  421.810   21.565  421.810   21.565  101.537   2.6094  101.537   2.6094 0.000000 0.000000 
1 1 1   20    0   23 f   43.221   5.7955   80.786   19.389   80.786   19.389   80.786   19.389   43.221   5.7955   43.221   5.7955 0.000000 0.000000 
1 1 1   20    0   24 o   34.542   7.6804   55.870   18.898   55.870   18.898   55.870   18.898   34.542   7.6804   34.542   7.6804 0.000000 0.000000 
1 1 1   20    0   25 o   87.359   3.5806  313.752   25.400  313.752   25.400  313.752   25.400   87.359   3.5806   87.359   3.5806 0.000000 0.000000 
1 1 1   20    0   26 o   14.088   8.5482   7.9500   18.223   7.9500   18.223   7.9500   18.223   14.088   8.5482   14.088   8.5482 0.000000 0.000000 
1 1 1   20    0   27 o   10.245   6.7164  -1.8962   14.001  -1.8962   14.001  -1.8962   14.001   10.245   6.7164   10.245   6.7164 0.000000 0.000000 
1 1 1   20    0   28 o   73.941   3.0339  224.588   18.216  224.588   18.216  224.588   18.216   73.941   3.0339   73.941   3.0339 0.000000 0.000000 
1 1 1   20    0   29 o   56.773   3.6206  133.510   16.597  133.510   16.597  133.510   16.597   56.773   3.6206   56.773   3.6206 0.000000 0.000000 
1 1 1   20    0   30 o   8.2159   5.7647 -15.5230   14.709 -15.5230   14.709 -15.5230   14.709   8.2159   5.7647   8.2159   5.7647 0.000000 0.000000 
1 1 1   20    0   31 o   70.020   3.8524  202.634   21.835  202.634   21.835  202.634   21.835   70.020   3.8524   70.020   3.8524 0.000000 0.000000 
1 1 1   20    0   32 o   23.192   10.415   32.674   21.033   32.674   21.033   32.674   21.033   23.192   10.415   23.192   10.415 0.000000 0.000000 
1 1 1   20    0   33 o   18.411   9.5133   20.904   18.351   20.904   18.351   20.904   18.351   18.411   9.5133   18.411   9.5133 0.000000 0.000000 
1 1 1   20    0   34 o   7.9427   5.6643 -23.4161   16.279 -23.4161   16.279 -23.4161   16.279   7.9427   5.6643   7.9427   5.6643 0.000000 0.000000 
1 1 1   20    0   35 o  102.630   3.2789  432.392   27.367  432.392   27.367  432.392   27.367  102.630   3.2789  102.630   3.2789 0.000000 0.000000 
1 1 1   20    0   36 o   35.311   6.8290   56.922   17.540   56.922   17.540   56.922   17.540   35.311   6.8290   35.311   6.8290 0.000000 0.000000 
1 1 1   20    0   37 o   14.650   8.4246   11.591   16.085   11.591   16.085   11.591   16.085   14.650   8.4246   14.650   8.4246 0.000000 0.000000 
1 1 1   20    0   38 o   36.629   5.0463   58.252   14.255   58.252   14.255   58.252   14.255   36.629   5.0463   36.629   5.0463 0.000000 0.000000 
1 1 1   20    0   39 o   10.165   6.5234   0.6997   12.275   0.6997   12.275   0.6997   12.275   10.165   6.5234   10.165   6.5234 0.000000 0.000000 
1 1 1   20    0   40 o   44.642   4.0260   83.778   14.363   83.778   14.363   83.778   14.363   44.642   4.0260   44.642   4.0260 0.000000 0.000000 
1 1 1   20    0   41 o   85.637   2.7679  300.944   19.276  300.944   19.276  300.944   19.276   85.637   2.7679   85.637   2.7679 0.000000 0.000000 
1 1 1   20    0   42 o   87.192   3.2642  312.823   23.127  312.823   23.127  312.823   23.127   87.192   3.2642   87.192   3.2642 0.000000 0.000000 
1 1 1   20    0   43 o   63.694   3.6674  168.153   18.896  168.153   18.896  168.153   18.896   63.694   3.6674   63.694   3.6674 0.000000 0.000000 
1 1 1   20    0   44 o   15.054   8.1352   13.716   13.915   13.716   13.915   13.716   13.915   15.054   8.1352   15.054   8.1352 0.000000 0.000000 
1 1 1   20    0   45 o   15.627   8.2509   15.053   14.024   15.053   14.024   15.053   14.024   15.627   8.2509   15.627   8.2509 0.000000 0.000000 
1 1 1   20    0   46 o   12.859   7.6970   7.6563   14.372   7.6563   14.372   7.6563   14.372   12.859   7.6970   12.859   7.6970 0.000000 0.000000 
1 1 1   20    0   47 o   20.662   7.7658   24.047   12.222   24.047   12.222   24.047   12.222   20.662   7.7658   20.662   7.7658 0.000000 0.000000 
1 1 1   20    0   48 o   14.579   7.7169   13.091   12.293   13.091   12.293   13.091   12.293   14.579   7.7169   14.579   7.7169 0.000000 0.000000 
1 1 1   20    0   49 o   29.530   5.9179   40.217   12.636   40.217   12.636   40.217   12.636   29.530   5.9179   29.530   5.9179 0.000000 0.000000 
1 1 1   20    0   50 o   41.792   4.1120   74.068   13.675   74.068   13.675   74.068   13.675   41.792   4.1120   41.792   4.1120 0.000000 0.000000 
1 1 1   20    0   51 o   12.687   7.3116   8.8326   12.154   8.8326   12.154   8.8326   12.154   12.687   7.3116   12.687   7.3116 0.000000 0.000000 
1 1 1   20    0   52 o   55.849   3.3290  129.587   15.031  129.587   15.031  129.587   15.031   55.849   3.3290   55.849   3.3290 0.000000 0.000000 
1 1 1   20    0   53 f   41.748   4.1451   74.093   13.763   74.093   13.763   74.093   13.763   41.748   4.1451   41.748   4.1451 0.000000 0.000000 
1 1 1   20    0   54 o   11.259   6.9090   4.9043   12.206   4.9043   12.206   4.9043   12.206   11.259   6.9090   11.259   6.9090 0.000000 0.000000 
1 1 1   20    0   55 o   22.310   7.9440   27.736   13.166   27.736   13.166   27.736   13.166   22.310   7.9440   22.310   7.9440 0.000000 0.000000 
1 1 1   20    0   56 o   9.9908   6.4826   0.0784   12.570   0.0784   12.570   0.0784   12.570   9.9908   6.4826   9.9908   6.4826 0.000000 0.000000 
1 1 1   20    0   57 o   8.4061   5.7519  -7.2026   12.467  -7.2026   12.467  -7.2026   12.467   8.4061   5.7519   8.4061   5.7519 0.000000 0.000000 
1 1 1   20    0   58 o   94.765   2.6524  369.564   20.453  369.564   20.453  369.564   20.453   94.765   2.6524   94.765   2.6524 0.000000 0.000000 
1 1 1   20    0   59 o   80.238   3.6263  267.735   23.607  267.735   23.607  267.735   23.607   80.238   3.6263   80.238   3.6263 0.000000 0.000000 
1 1 1   20    0   60 o   36.614   6.4052   61.507   17.368   61.507   17.368   61.507   17.368   36.614   6.4052   36.614   6.4052 0.000000 0.000000 
1 1 1   20    0   61 o   18.524   9.0705   22.493   16.223   22.493   16.223   22.493   16.223   18.524   9.0705   18.524   9.0705 0.000000 0.000000 
1 1 1   20    0   62 o   25.522   7.2331   33.478   13.031   33.478   13.031   33.478   13.031   25.522   7.2331   25.522   7.2331 0.000000 0.000000 
1 1 1   20    0   63 o   18.608   7.8305   21.071   11.956   21.071   11.956   21.071   11.956   18.608   7.8305   18.608   7.8305 0.000000 0.000000 
1 1 1   20    0   64 o   13.696   7.5415   11.767   12.191   11.767   12.191   11.767   12.191   13.696   7.5415   13.696   7.5415 0.000000 0.000000 
1 1 1   20    0   65 o   28.165   6.3078   38.146   12.645   38.146   12.645   38.146   12.645   28.165   6.3078   28.165   6.3078 0.000000 0.000000 
1 1 1   20    0   66 o   37.636   4.3986   61.540   13.013   61.540   13.013   61.540   13.013   37.636   4.3986   37.636   4.3986 0.000000 0.000000 
1 1 1   20    0   67 o   37.970   4.4970   62.801   13.406   62.801   13.406   62.801   13.406   37.970   4.4970   37.970   4.4970 0.000000 0.000000 
1 1 1   20    0   68 o   19.931   8.0866   24.074   12.864   24.074   12.864   24.074   12.864   19.931   8.0866   19.931   8.0866 0.000000 0.000000 
1 1 1   20    0   69 o   7.9182   5.4860  -8.9429   12.210  -8.9429   12.210  -8.9429   12.210   7.9182   5.4860   7.9182   5.4860 0.000000 0.000000 
1 1 1   20    0   70 o   19.346   8.1415   23.223   12.924   23.223   12.924   23.223   12.924   19.346   8.1415   19.346   8.1415 0.000000 0.000000 
1 1 1   20    0   71 o   36.789   4.7449   59.768   13.579   59.768   13.579   59.768   13.579   36.789   4.7449   36.789   4.7449 0.000000 0.000000 
1 1 1   20    0   72 o   13.344   7.5528   11.222   12.642   11.222   12.642   11.222   12.642   13.344   7.5528   13.344   7.5528 0.000000 0.000000 
1 1 1   20    0   73 o   10.468   6.6613   2.8848   12.475   2.8848   12.475   2.8848   12.475   10.468   6.6613   10.468   6.6613 0.000000 0.000000 
1 1 1   20    0   74 f   27.246   6.8006   37.405   13.067   37.405   13.067   37.405   13.067   27.246   6.8006   27.246   6.8006 0.000000 0.000000 
1 1 1   20    0   75 o   12.721   7.6773   8.9860   14.537   8.9860   14.537   8.9860   14.537   12.721   7.6773   12.721   7.6773 0.000000 0.000000 
1 1 1   20    0   76 o   65.749   3.6503  182.851   19.425  182.851   19.425  182.851   19.425   65.749   3.6503   65.749   3.6503 0.000000 0.000000 
1 1 1   20    0   77 o   35.893   5.7977   59.908   15.636   59.908   15.636   59.908   15.636   35.893   5.7977   35.893   5.7977 0.000000 0.000000 
1 1 1   20    0   78 o   29.827   7.2748   45.626   15.322   45.626   15.322   45.626   15.322   29.827   7.2748   29.827   7.2748 0.000000 0.000000 
1 1 1   20    0   79 o   35.782   5.9827   60.367   15.985   60.367   15.985   60.367   15.985   35.782   5.9827   35.782   5.9827 0.000000 0.000000 
1 1 1   20    0   80 o   40.940   5.0584   75.674   16.189   75.674   16.189   75.674   16.189   40.940   5.0584   40.940   5.0584 0.000000 0.000000 
1 1 1   20    0   81 f   8.8453   6.0599  -6.0490   13.934  -6.0490   13.934  -6.0490   13.934   8.8453   6.0599   8.8453   6.0599 0.000000 0.000000 
1 1 1   20    0   82 o   9.6883   6.4640  -1.2049   13.917  -1.2049   13.917  -1.2049   13.917   9.6883   6.4640   9.6883   6.4640 0.000000 0.000000 
1 1 1   20    0   83 o   10.620   6.6909   4.8426   12.231   4.8426   12.231   4.8426   12.231   10.620   6.6909   10.620   6.6909 0.000000 0.000000 
1 1 1   20    0   84 o   22.476   8.6037   32.429   14.876   32.429   14.876   32.429   14.876   22.476   8.6037   22.476   8.6037 0.000000 0.000000 
1 1 1   20    0   85 o   11.281   6.8842   7.3854   11.967   7.3854   11.967   7.3854   11.967   11.281   6.8842   11.281   6.8842 0.000000 0.000000 
1 1 1   20    0   86 o   9.6444   6.2876   1.7527   12.024   1.7527   12.024   1.7527   12.024   9.6444   6.2876   9.6444   6.2876 0.000000 0.000000 
1 1 1   20    0   87 o   8.6845   5.8289  -1.7993   11.620  -1.7993   11.620  -1.7993   11.620   8.6845   5.8289   8.6845   5.8289 0.000000 0.000000 
1 1 1   20    0   88 o   12.574   7.2131   11.171   11.749   11.171   11.749   11.171   11.749   12.574   7.2131   12.574   7.2131 0.000000 0.000000 
1 1 1   20    0   89 o   5.9840   4.3394 -20.7494   11.520 -20.7494   11.520 -20.7494   11.520   5.9840   4.3394   5.9840   4.3394 0.000000 0.000000 
1 1 1   20    0   90 f   11.954   8.1447  -0.6196   24.423  -0.6196   24.423  -0.6196   24.423   11.954   8.1447   11.954   8.1447 0.000000 0.000000 
1 1 1   20    0   91 o   14.564   9.4065   15.353   26.059   15.353   26.059   15.353   26.059   14.564   9.4065   14.564   9.4065 0.000000 0.000000 
1 1 1   20    0   92 o   13.594   8.9802   9.9531   25.772   9.9531   25.772   9.9531   25.772   13.594   8.9802   13.594   8.9802 0.000000 0.000000 
1 1 1   20    0   93 o   13.622   8.8880   11.417   24.092   11.417   24.092   11.417   24.092   13.622   8.8880   13.622   8.8880 0.000000 0.000000 
1 1 1   20    0   94 o   10.998   7.5957  -5.0806   22.950  -5.0806   22.950  -5.0806   22.950   10.998   7.5957   10.998   7.5957 0.000000 0.000000 
1 1 1   20    0   95 o   9.6679   6.8695 -18.2354   23.149 -18.2354   23.149 -18.2354   23.149   9.6679   6.8695   9.6679   6.8695 0.000000 0.000000 
1 1 1   20    0   96 o   11.745   7.9956   0.5201   23.434   0.5201   23.434   0.5201   23.434   11.745   7.9956   11.745   7.9956 0.000000 0.000000 
1 1 1   20    0   97 o   11.088   7.6400  -3.5518   22.885  -3.5518   22.885  -3.5518   22.885   11.088   7.6400   11.088   7.6400 0.000000 0.000000 
1 1 1   20    0   98 o   24.052   11.153   50.147   24.183   50.147   24.183   50.147   24.183   24.052   11.153   24.052   11.153 0.000000 0.000000 
1 1 1   20    0   99 o   20.672   10.977   41.758   24.942   41.758   24.942   41.758   24.942   20.672   10.977   20.672   10.977 0.000000 0.000000 
1 1 1   20    0  100 o   23.116   11.226   48.497   24.774   48.497   24.774   48.497   24.774   23.116   11.226   23.116   11.226 0.000000 0.000000 
1 1 1   20    1  -98 o   12.777   6.3894 -35.5311   27.738 -35.5311   27.738   0.0000   0.0000   12.777   6.3894  ?   ?  0.000000 6.389396 
1 1 1   20    1  -97 o   14.086   6.8807 -12.5458   26.031 -12.5458   26.031   0.0000   0.0000   14.086   6.8807  ?   ?  0.000000 6.880677 
1 1 1   20    1  -96 o   19.436   8.5959   30.160   26.837   30.160   26.837   0.0000   0.0000   19.436   8.5959  ?   ?  0.000000 8.595929 
1 1 1   20    1  -95 o   17.431   8.0344   16.658   26.473   16.658   26.473   0.0000   0.0000   17.431   8.0344  ?   ?  0.000000 8.034415 
1 1 1   20    1  -94 o   14.472   7.0573 -11.3113   27.062 -11.3113   27.062   0.0000   0.0000   14.472   7.0573  ?   ?  0.000000 7.057332 
1 1 1   20    1  -93 o   13.900   6.6141  -4.7677   20.528  -2.0357   28.671  -7.6412   29.405   15.662   7.5481   15.254   7.4203 0.4081984 10.58466 
1 1 1   20    1  -92 o   13.219   6.3171  -7.6483   19.149 -29.5617   26.830   15.106   27.340   13.092   6.5041   17.531   8.1102 -4.438725 10.39612 
1 1 1   20    1  -91 o   16.285   7.7060   4.6281   27.120   0.0000   0.0000   4.6281   27.120  ?   ?    16.285   7.7060 0.000000 7.705961 
1 1 1   20    1  -90 o   22.600   8.1765   35.639   19.354   43.762   28.137   28.344   26.663   22.506   9.3395   19.761   8.6598 2.744982 12.73653 
1 1 1   20    1  -88 o   9.4310   4.7827 -52.1211   18.833 -34.6293   27.026 -68.6338   26.258   12.957   6.4520   10.891   5.5357 2.066034 8.501267 
1 1 1   20    1  -87 o   21.434   7.8697   30.066   18.023   45.121   25.204   14.312   25.783   23.911   9.1915   17.736   8.0824 6.175173 12.23959 
1 1 1   20    1  -86 o   12.166   5.7433  -7.0689   14.901 -12.7158   18.380   3.7596   25.453   12.598   6.0642   16.339   7.6478 -3.741122 9.760301 
1 1 1   20    1  -85 o   25.083   6.6189   34.983   13.727   23.931   19.231   46.466   19.602   19.707   7.8902   26.811   8.2038 -7.103928 11.38232 
1 1 1   20    1  -84 o   12.651   5.7691  -1.1813   13.165   7.2654   18.864  -9.2022   18.382   15.922   7.1141   13.137   6.2530 2.785577 9.471544 
1 1 1   20    1  -83 o   12.014   5.5602  -3.8742   12.868  -8.8338   17.942   1.3798   18.467   13.077   6.2110   14.807   6.7825 -1.729990 9.196696 
1 1 1   20    1  -82 o   17.033   6.5885   14.542   13.009   24.311   18.459   4.9025   18.336   20.131   7.8313   15.484   6.9587 4.646178 10.47631 
1 1 1   20    1  -81 o   20.838   6.7924   24.166   13.245   22.580   18.238   25.937   19.267   19.750   7.7547   20.660   8.0110 -0.9100857 11.14953 
1 1 1   20    1  -80 o   18.869   6.7069   18.948   12.959   27.517   18.111   9.9566   18.551   21.454   7.8868   16.764   7.2869 4.689537 10.73779 
1 1 1   20    1  -79 o   25.369   6.3385   33.596   13.069   35.292   18.350   31.850   18.619   24.261   7.9997   23.008   8.0512 1.253183 11.34976 
1 1 1   20    1  -78 o   33.071   5.2234   52.153   13.614   66.875   18.864   36.154   19.666   35.965   6.6805   24.492   8.2858 11.47338 10.64351 
1 1 1   20    1  -77 o   15.170   5.9013   9.3744   10.481 -11.6677   17.072   22.103   13.278   12.780   6.0670   20.506   6.8067 -7.725410 9.118105 
1 1 1   20    1  -76 o   12.750   5.2691   4.2415   8.9048   6.1347   12.352   2.1928   12.849   14.675   6.1464   13.765   6.0223 0.9105110 8.605049 
1 1 1   20    1  -75 o   14.536   5.6158   8.2020   9.4424   15.359   13.935   2.1261   12.839   18.117   6.8658   13.802   6.0298 4.314653 9.137696 
1 1 1   20    1  -74 f   12.336   5.1617   3.1328   8.6986   8.7078   12.410  -2.2521   12.196   15.645   6.3124   12.521   5.6468 3.124538 8.469517 
1 1 1   20    1  -73 o   33.842   3.9651   50.498   10.731   53.105   17.767   49.000   13.465   32.385   6.9389   32.439   5.2729 -0.5410767E-01 8.715040 
1 1 1   20    1  -72 o   26.699   4.9833   32.858   10.447   28.115   17.577   35.449   12.990   23.084   7.8331   27.058   6.0424 -3.974035 9.892825 
1 1 1   20    1  -71 f   29.532   3.7299   38.032   8.7790   39.494   11.783   36.208   13.162   29.309   5.1182   27.437   6.0479 1.871290 7.922946 
1 1 1   20    1  -70 o   22.233   4.8961   22.711   8.6328   25.246   11.736   19.723   12.743   22.840   6.1624   20.227   6.6663 2.613485 9.078263 
1 1 1   20    1  -69 o   8.8081   4.1892  -9.0819   8.2171  -1.2070   11.071 -18.7397   12.261   12.431   5.5083   9.8215   4.7808 2.609523 7.293605 
1 1 1   20    1  -68 o   10.384   4.6958  -3.2913   8.5011 -14.7248   11.299   11.626   12.906   9.8577   4.7476   17.199   6.5858 -7.341205 8.118646 
1 1 1   20    1  -67 o   23.150   4.7921   24.244   8.7450   28.654   11.971   19.196   12.806   24.613   6.0177   20.213   6.6837 4.400019 8.993529 
1 1 1   20    1  -66 o   11.903   5.0423   1.5832   8.4644  -4.5246   11.700   8.2916   12.261   12.049   5.4727   15.932   6.3262 -3.883171 8.364893 
1 1 1   20    1  -65 o   25.037   4.4901   27.825   8.8273   14.822   12.142   42.399   12.855   18.414   6.4972   30.578   5.3523 -12.16403 8.417857 
1 1 1   20    1  -64 o   19.660   5.3275   17.693   8.7486   16.382   12.091   19.133   12.674   19.100   6.4966   20.331   6.6454 -1.230230 9.293382 
1 1 1   20    1  -63 o   20.628   5.1674   19.387   8.6696   21.644   11.934   16.864   12.616   21.489   6.3629   19.395   6.6353 2.094143 9.193105 
1 1 1   20    1  -62 o   28.428   3.8608   34.890   8.7157   40.586   11.883   28.256   12.823   30.167   5.0077   24.485   6.3661 5.681761 8.099683 
1 1 1   20    1  -61 o   38.456   2.8983   62.014   9.0185   59.612   12.575   64.558   12.941   37.123   4.2310   38.679   4.1704 -1.555584 5.940808 
1 1 1   20    1  -60 o   10.258   4.6314  -3.4151   8.2291  -8.6608   11.366   2.3631   11.929   11.073   5.1591   14.066   5.9734 -2.993140 7.892914 
1 1 1   20    1  -59 o   43.799   2.6064   79.839   9.2633   83.940   12.829   75.371   13.389   44.521   3.5648   41.989   3.9586 2.531395 5.327155 
1 1 1   20    1  -58 o   20.748   5.0434   19.354   8.4454   19.737   11.690   18.937   12.214   20.775   6.3314   20.430   6.5104 0.3445721 9.081416 
1 1 1   20    1  -57 o   19.120   5.8565   16.379   9.9862   6.8649   13.378   28.350   15.007   16.133   6.5378   24.521   7.1011 -8.388250 9.652378 
1 1 1   20    1  -56 o   41.391   3.3125   72.035   11.083   89.855   14.994   50.571   16.456   45.926   4.0466   33.300   6.2928 12.62635 7.481599 
1 1 1   20    1  -55 o   50.922   2.8420  107.914   11.750  110.129   15.952  105.287   17.373   51.002   3.8657   49.625   4.3384 1.377850 5.810800 
1 1 1   20    1  -54 o   47.177   2.5334   92.224   9.7070   84.102   13.213  101.748   14.308   44.646   3.6627   49.163   3.5952 -4.516121 5.132333 
1 1 1   20    1  -53 o   17.915   5.3926   14.100   8.5174   1.6110   11.725   28.056   12.394   13.901   5.9132   24.812   6.1571 -10.91149 8.536770 
1 1 1   20    1  -52 o   23.663   4.5003   24.450   8.3633   10.995   14.000   31.915   10.428   17.859   6.8542   26.965   4.9258 -9.106062 8.440601 
1 1 1   20    1  -51 o   56.243   2.1571  130.277   9.8711  115.635   16.163  138.986   12.466   52.406   3.8097   57.946   2.6461 -5.539997 4.638530 
1 1 1   20    1  -50 o   12.944   5.1285   4.3125   8.0414   3.0534   13.746   4.9676   9.9149   15.346   6.4592   14.160   5.6668 1.185920 8.592681 
1 1 1   20    1  -49 o   18.122   5.3407   14.355   8.4236   19.645   14.981   11.910   10.186   21.361   7.2318   17.190   5.9589 4.170395 9.370583 
1 1 1   20    1  -48 o   44.440   2.6842   81.769   9.6783   89.659   17.589   78.343   11.591   45.798   4.7820   43.321   3.3073 2.476692 5.814235 
1 1 1   20    1  -47 o   36.688   3.8032   56.705   11.209   64.920   16.397   49.497   15.358   38.711   5.3381   33.526   5.8315 5.185741 7.905857 
1 1 1   20    1  -46 o   70.196   2.3960  202.859   13.690  208.139   19.829  198.052   18.923   70.728   3.4498   69.020   3.3737 1.708145 4.825209 
1 1 1   20    1  -45 o   37.008   3.4411   57.272   10.262   56.997   14.126   57.579   14.933   36.466   4.8741   36.552   5.1548 -0.8571625E-01 7.094259 
1 1 1   20    1  -44 o   11.823   4.9755   1.1293   8.1538  -2.5098   10.358   7.0586   13.221   12.094   5.3449   16.477   6.5606 -4.383181 8.462234 
1 1 1   20    1  -43 o   30.789   3.2016   39.586   7.9180   53.986   11.231   25.356   11.165   35.819   3.9100   23.939   5.7861 11.88036 6.983347 
1 1 1   20    1  -42 o   38.232   2.8667   60.551   8.8689   40.843   13.034   77.544   12.103   30.661   5.4129   43.142   3.4708 -12.48050 6.430019 
1 1 1   20    1  -41 o   10.717   4.7100  -1.7483   7.9387   18.687   11.868 -18.2976   10.680   20.793   6.3873   9.1799   4.4670 11.61307 7.794310 
1 1 1   20    1  -40 o   50.029   2.3554  102.924   9.5787   96.914   16.547  105.953   11.747   48.057   4.2685   50.657   2.8563 -2.600632 5.135998 
1 1 1   20    1  -39 o  111.652   1.5106  509.453   13.748  479.741   19.467  539.017   19.419  108.184   2.2075  114.710   2.0767 -6.526314 3.030840 
1 1 1   20    1  -38 o   20.842   4.5208   18.780   7.4592   29.692   10.951   9.3345   10.188   26.137   5.3209   16.228   5.9235 9.908726 7.962414 
1 1 1   20    1  -37 o  123.408   1.5028  622.238   15.117  631.359   21.745  613.707   21.031  124.150   2.1487  122.414   2.1076 1.736267 3.009816 
1 1 1   20    1  -36 o  121.364   1.5120  601.759   14.958  626.731   21.689  579.108   20.657  123.706   2.1509  118.918   2.1310 4.787544 3.027796 
1 1 1   20    1  -35 o   36.709   2.7380   55.637   8.1338   50.882   11.718   60.057   11.299   34.781   4.2194   37.953   3.6990 -3.171898 5.611238 
1 1 1   20    1  -34 o   53.228   2.2170  116.224   9.5983  113.150   15.171  118.275   12.394   52.246   3.5839   53.585   2.8478 -1.338867 4.577568 
1 1 1   20    1  -33 o   78.263   1.7890  250.394   11.413  264.266   17.447  240.017   15.090   80.211   2.6721   76.491   2.4233 3.719597 3.607276 
1 1 1   20    1  -32 o   63.022   2.0684  162.678   10.611  151.576   14.044  177.448   16.199   60.696   2.8465   65.641   3.0357 -4.945290 4.161477 
1 1 1   20    1  -31 f  105.968   1.6893  458.821   14.593  423.493   22.211  485.652   19.356  101.579   2.6848  108.932   2.1799 -7.353355 3.458292 
1 1 1   20    1  -30 o   68.131   1.8606  189.887   10.324  175.121   14.701  204.253   14.500   65.278   2.7691   70.555   2.5253 -5.277084 3.747662 
1 1 1   20    1  -29 o   33.774   3.3780   47.385   9.1751   57.832   12.402   34.756   13.636   37.180   4.1637   28.257   6.0993 8.922634 7.384948 
1 1 1   20    1  -28 o   12.192   5.0146   2.0931   8.0146   4.0064   11.680   0.3905   11.018   14.962   6.0919   13.453   5.7278 1.508892 8.361765 
1 1 1   20    1  -27 o   21.455   5.6594   19.925   10.039  -0.2276   19.095   27.622   11.801   17.344   7.4655   25.208   5.8553 -7.864176 9.487799 
1 1 1   20    1  -26 o  142.191   1.6860  825.851   19.542  798.231   29.995  846.221   25.759  139.572   2.6365  143.823   2.1972 -4.251816 3.431997 
1 1 1   20    1  -25 o  100.732   1.7749  414.546   14.574  418.209   22.693  411.975   19.014  100.970   2.7597  100.334   2.3248 0.6355515 3.608426 
1 1 1   20    1  -24 o   45.548   2.8880   85.410   10.667   74.236   17.010   92.653   13.695   41.996   5.0714   47.326   3.5766 -5.329967 6.205756 
1 1 1   20    1  -23 o   47.649   3.1143   93.571   12.030  103.316   17.615   85.053   16.469   49.821   4.3821   45.132   4.5381 4.689289 6.308495 
1 1 1   20    1  -22 f   87.834   1.9220  315.249   13.761  315.007   18.298  315.565   20.879   87.675   2.5631   87.680   2.9253 -0.5683899E-02 3.889346 
1 1 1   20    1  -21 o  169.901   1.8825  1179.38   26.071  1168.67   36.467  1190.58   37.288  168.926   2.6483  170.492   2.6830 -1.565445 3.769881 
1 1 1   20    1  -20 o   54.565   2.9981  122.443   13.284  129.045   16.932  111.874   21.424   55.885   3.7383   51.690   5.1531 4.195408 6.366276 
1 1 1   20    1  -19 o   41.971   2.9897   72.578   10.162   86.378   15.406   61.950   13.520   45.587   4.1927   38.504   4.3855 7.082554 6.067208 
1 1 1   20    1  -18 o   43.948   2.8119   79.442   10.020   96.436   15.320   66.736   13.247   48.247   3.9294   40.042   4.1171 8.205376 5.691290 
1 1 1   20    1  -17 o   14.867   5.7033   6.3163   9.6906   5.7587   16.227   6.6254   12.082   17.666   7.1852   16.107   6.3155 1.559059 9.566211 
1 1 1   20    1  -16 o   36.077   3.5538   53.970   10.315   54.374   14.650   53.573   14.527   35.882   5.1568   35.612   5.1539 0.2696495 7.290805 
1 1 1   20    1  -15 o  124.474   1.9536  632.968   19.822  641.486   31.030  627.095   25.764  125.100   3.0429  123.792   2.5532 1.307304 3.972144 
1 1 1   20    1  -14 f   87.084   2.1267  309.939   15.097  331.032   23.678  295.491   19.597   89.779   3.2408   84.893   2.8359 4.885750 4.306386 
1 1 1   20    1  -13 o   17.327   6.0241   11.294   10.414   17.671   16.243   6.8431   13.570   21.533   7.5211   16.859   6.6678 4.673872 10.05113 
1 1 1   20    1  -12 o   37.476   3.3588   58.075   10.152   61.560   17.458   56.294   12.479   38.078   5.8079   36.733   4.2456 1.344948 7.194266 
1 1 1   20    1  -11 o   83.009   1.9874  281.485   13.448  304.591   22.974  269.441   16.586   86.116   3.2788   81.119   2.5114 4.997101 4.130058 
1 1 1   20    1  -10 o   98.172   1.7508  393.512   14.010  403.640   21.425  385.945   18.519   99.279   2.6499   97.156   2.3383 2.122665 3.534045 
1 1 1   20    1   -9 o  200.463   1.9202  1641.33   31.377  1610.01   44.183  1673.20   44.568  198.325   2.7330  202.189   2.7041 -3.863937 3.844692 
1 1 1   20    1   -8 o   95.642   1.8691  373.570   14.572  403.125   21.276  347.456   20.000   99.221   2.6329   92.105   2.6666 7.116104 3.747383 
1 1 1   20    1   -7 o   96.947   1.8533  383.819   14.646  410.123   21.253  360.031   20.211  100.085   2.6073   93.763   2.6470 6.322060 3.715471 
1 1 1   20    1   -6 o   74.584   2.0386  227.425   12.382  239.931   17.976  216.133   17.081   76.491   2.8881   72.593   2.8924 3.898781 4.087482 
1 1 1   20    1   -5 o   14.033   5.5267   4.7312   9.2881   8.1109   13.618   1.7918   12.700   17.318   6.7295   14.871   6.2307 2.446892 9.170981 
1 1 1   20    1   -4 o   13.819   5.4870   4.2821   9.2234   3.4796   13.458   4.9929   12.665   15.763   6.4923   15.849   6.3833 -0.8674240E-01 9.104754 
1 1 1   20    1   -3 o   44.861   2.8895   82.745   10.510   86.275   15.093   79.422   14.644   45.615   4.1030   43.741   4.1570 1.874153 5.840825 
1 1 1   20    1   -2 o  106.235   1.9707  460.983   17.066  470.207   22.536  448.582   26.131  107.210   2.5787  104.591   3.0682 2.619041 4.007981 
1 1 1   20    1   -1 o   65.709   2.6467  176.949   14.147  200.128   20.975  157.603   19.163   69.711   3.7045   61.818   3.8215 7.892990 5.322331 
1 1 1   20    1    0 o   14.482   5.9089   3.4091   11.016   2.8470   15.990   3.9169   15.198   16.797   7.0111   16.723   6.8947 0.7371140E-01 9.833214 
1 1 1   20    1    1 o   51.076   2.8432  107.130   11.791   74.543   18.264  130.415   15.439   42.086   5.4518   56.288   3.3804 -14.20178 6.414759 
1 1 1   20    1    2 o  112.348   1.9698  515.560   18.040  506.214   28.556  521.767   23.272  111.093   3.1565  112.943   2.5278 -1.850555 4.043921 
1 1 1   20    1    3 o   60.088   2.3580  147.839   11.527  142.988   16.789  152.165   15.855   58.925   3.5112   60.844   3.2081 -1.918472 4.756103 
1 1 1   20    1    4 o  103.608   1.8416  438.351   15.553  445.255   22.374  431.894   21.636  104.285   2.6341  102.715   2.5862 1.569183 3.691432 
1 1 1   20    1    5 o   40.281   3.1982   66.924   10.415   68.365   14.996   65.582   14.476   40.458   4.6304   39.629   4.5647 0.8288040 6.502030 
1 1 1   20    1    6 o   54.748   2.7345  122.982   12.165  131.111   16.424  113.103   18.106   56.400   3.5911   52.237   4.2900 4.163258 5.594644 
1 1 1   20    1    7 o  101.952   1.8466  424.467   15.346  435.293   22.278  414.691   21.170  103.104   2.6529  100.646   2.5825 2.458725 3.702326 
1 1 1   20    1    8 o   93.315   1.8870  355.630   14.353  353.983   20.661  357.167   19.955   92.956   2.7297   93.392   2.6238 -0.4354324 3.786230 
1 1 1   20    1    9 o   26.326   4.7994   29.482   9.9200   42.048   14.611   18.735   13.512   31.312   5.9416   21.359   6.8519 9.953373 9.069253 
1 1 1   20    1   10 o   66.508   2.1775  180.973   11.789  176.095   16.930  185.566   16.427   65.463   3.1821   67.233   3.0050 -1.770454 4.376758 
1 1 1   20    1   11 o   11.321   5.0307  -3.2843   9.3002   8.1152   13.816 -12.7293   12.576   17.393   6.7726   11.400   5.3487 5.992624 8.630053 
1 1 1   20    1   12 o   29.133   4.2797   35.686   9.8605   42.384   14.558   30.008   13.403   31.443   5.8964   26.312   6.3273 5.131254 8.648812 
1 1 1   20    1   13 o   25.118   4.9238   26.958   9.7208   11.462   14.089   41.038   13.430   18.654   6.9382   31.010   5.5150 -12.35566 8.863055 
1 1 1   20    1   14 f   37.617   3.4254   58.555   10.388   55.691   15.128   61.110   14.290   36.303   5.2657   38.193   4.6883 -1.889744 7.050392 
1 1 1   20    1   15 o   76.575   2.1037  239.818   13.119  248.595   19.083  231.954   18.064   77.824   3.0139   75.181   2.9535 2.643265 4.219755 
1 1 1   20    1   16 o  172.591   1.8559  1216.68   26.110  1243.62   37.656  1191.72   36.236  174.297   2.6504  170.634   2.6052 3.663406 3.716393 
1 1 1   20    1   17 o   92.270   2.1546  348.020   16.206  371.608   27.528  335.508   20.048   95.039   3.5596   90.476   2.7214 4.562645 4.480723 
1 1 1   20    1   18 o  112.433   2.0413  516.614   18.709  516.855   30.765  516.474   23.567  112.150   3.3691  112.329   2.5738 -0.1786194 4.239756 
1 1 1   20    1   19 o   41.454   4.2630   71.597   14.200   78.724   20.919   65.506   19.338   43.019   6.1395   39.134   6.2740 3.884434 8.778170 
1 1 1   20    1   20 o   44.796   4.1476   83.412   14.973  109.959   22.024   60.598   20.417   51.187   5.3577   37.408   6.9515 13.77819 8.776616 
1 1 1   20    1   21 o   88.331   2.2886  319.361   16.464  317.746   21.353  321.730   25.857   87.977   2.9818   88.384   3.5964 -0.4066544 4.671751 
1 1 1   20    1   22 f   75.398   2.2204  232.702   13.632  249.269   19.935  218.151   18.683   77.872   3.1470   72.839   3.1541 5.032280 4.455569 
1 1 1   20    1   23 o   81.467   2.1058  271.543   13.972  282.242   20.391  262.073   19.184   82.890   3.0230   79.885   2.9511 3.005646 4.224583 
1 1 1   20    1   24 o   59.611   2.5508  145.785   12.366  151.717   17.912  140.383   17.092   60.610   3.6423   58.300   3.6144 2.310181 5.131333 
1 1 1   20    1   25 o   61.002   2.4739  152.613   12.276  169.266   18.034  138.231   16.759   64.063   3.4662   57.853   3.5711 6.210419 4.976709 
1 1 1   20    1   26 o  115.781   2.0450  548.130   19.300  525.334   31.435  561.924   24.452  112.972   3.4174  117.122   2.5612 -4.149902 4.270662 
1 1 1   20    1   27 o   61.369   2.3892  154.423   11.929  169.600   17.912  142.326   15.991   64.118   3.4397   58.739   3.3537 5.378696 4.803991 
1 1 1   20    1   28 o   36.995   3.9641   57.111   11.768   54.067   15.199   61.668   18.594   35.629   5.4026   37.852   6.2437 -2.222809 8.256633 
1 1 1   20    1   29 o   16.321   6.0724   8.8017   10.793   5.0805   13.859   14.539   17.208   16.344   6.6429   20.589   7.6659 -4.245121 10.14369 
1 1 1   20    1   30 o   15.286   5.6390   7.8585   9.2720   18.944   13.784  -1.3030   12.531   21.362   6.9266   13.830   6.0005 7.532094 9.164251 
1 1 1   20    1   31 f   61.099   2.3316  153.093   11.591  152.373   16.977  153.721   15.864   60.734   3.4433   61.059   3.1985 -0.3245926 4.699605 
1 1 1   20    1   32 o   41.416   3.2021   70.967   10.726   68.013   14.619   74.412   15.787   40.236   4.5363   42.069   4.6828 -1.832367 6.519715 
1 1 1   20    1   33 o   10.696   4.8333  -4.5865   8.9872  -0.2016   12.918  -8.7001   12.512   14.317   6.1511   12.069   5.5486 2.247398 8.283899 
1 1 1   20    1   34 o   32.630   3.9146   44.641   10.205   51.456   16.558   40.466   12.958   34.449   6.1207   30.669   5.3794 3.779417 8.148620 
1 1 1   20    1   35 o   48.439   2.6222   96.570   10.315   90.936   14.764  101.943   14.418   46.720   3.9126   49.565   3.5930 -2.845570 5.312067 
1 1 1   20    1   36 o   61.876   2.4236  157.239   12.201  148.700   16.014  169.051   18.836   59.977   3.2881   63.865   3.6332 -3.887661 4.900173 
1 1 1   20    1   37 o   15.696   5.8322   8.2845   9.9505  -3.1730   13.309   22.807   14.984   13.731   6.0638   22.997   7.1958 -9.266397 9.410094 
1 1 1   20    1   38 o  108.279   1.9828  479.978   17.501  480.146   22.973  479.747   27.015  108.124   2.6066  107.876   3.0753 0.2481155 4.031308 
1 1 1   20    1   39 o   52.340   3.3211  113.534   14.096  110.878   18.333  117.374   22.047   51.396   4.4188   52.601   5.2102 -1.204536 6.831699 
1 1 1   20    1   40 o   43.007   3.7709   77.242   13.086   81.233   17.257   71.843   20.072   43.753   4.9242   40.623   6.2626 3.129498 7.966680 
1 1 1   20    1   41 o   28.300   4.7503   34.406   10.571   37.598   16.085   31.980   14.024   28.966   6.9096   26.797   6.4897 2.168957 9.479348 
1 1 1   20    1   42 o   44.947   2.9748   83.658   10.838   59.032   17.345   99.430   13.881   36.785   5.9906   48.874   3.5076 -12.08957 6.941890 
1 1 1   20    1   43 o   59.357   2.2672  144.827   10.950  128.552   16.102  158.827   14.934   55.564   3.5741   61.981   2.9645 -6.417614 4.643565 
1 1 1   20    1   44 o   55.399   2.5293  126.495   11.392  125.565   18.619  127.052   14.402   54.660   4.2113   55.335   3.2066 -0.6745682 5.293105 
1 1 1   20    1   45 o   39.638   3.2006   65.421   10.253   32.671   16.645   85.446   13.016   26.785   7.3856   45.228   3.5591 -18.44335 8.198411 
1 1 1   20    1   46 o   35.330   3.5021   52.322   9.9531   47.530   16.705   54.960   12.393   32.597   6.5147   35.969   4.3127 -3.371803 7.812871 
1 1 1   20    1   47 o   16.379   5.6182   10.752   9.0463   3.7579   14.514   15.194   11.568   15.964   6.6728   19.029   6.3543 -3.064370 9.214309 
1 1 1   20    1   48 o   23.124   5.1146   23.579   9.3848   36.054   15.061   15.661   11.999   28.181   6.6623   19.283   6.4720 8.897415 9.288279 
1 1 1   20    1   49 o   91.677   1.9993  344.991   14.941  345.976   23.689  344.340   19.253   91.257   3.1895   91.336   2.5885 -0.7932281E-01 4.107687 
1 1 1   20    1   50 o   57.172   2.2704  134.706   10.560  116.662   15.035  152.269   14.834   52.788   3.5142   60.541   3.0154 -7.752384 4.630522 
1 1 1   20    1   51 o   23.793   4.6495   24.775   8.6944   24.230   12.832   25.237   11.822   23.083   6.5291   23.609   6.0995 -0.5258369 8.934935 
1 1 1   20    1   52 o   45.971   2.6366   87.615   9.8386   81.644   14.175   93.166   13.667   43.887   4.0064   47.077   3.5886 -3.189911 5.378532 
1 1 1   20    1   53 o   55.101   2.3456  125.384   10.511  117.199   15.118  133.045   14.625   52.832   3.5306   56.453   3.1911 -3.620636 4.759022 
1 1 1   20    1   54 o   26.543   4.3172   30.534   9.0200   20.740   12.828   40.111   12.685   21.418   6.6515   30.073   5.3719 -8.655001 8.549815 
1 1 1   20    1   55 o   36.518   4.3273   57.308   12.631   38.044   18.028   75.884   17.703   28.240   7.6455   41.564   5.3489 -13.32432 9.330811 
1 1 1   20    1   56 o   50.317   3.3007  106.232   13.463  105.344   19.597  107.025   18.528   49.246   4.9488   49.839   4.6128 -0.5934448 6.765306 
1 1 1   20    1   57 o   55.783   3.0816  130.119   13.958  135.706   20.950  125.660   18.717   56.103   4.6221   54.191   4.2717 1.912334 6.293720 
1 1 1   20    1   58 o   55.005   2.4237  125.371   10.841  108.090   15.550  141.713   15.121   50.455   3.8089   58.137   3.2031 -7.682037 4.976754 
1 1 1   20    1   59 o   66.878   2.1583  184.695   11.750  186.375   17.054  183.177   16.213   66.697   3.1456   66.196   3.0126 0.5014801 4.355532 
1 1 1   20    1   60 o   68.358   2.1266  192.959   11.835  189.783   17.126  195.862   16.374   67.284   3.1312   68.467   2.9408 -1.182709 4.295612 
1 1 1   20    1   61 o   36.826   3.2992   57.366   9.7990   54.336   14.330   60.027   13.430   34.929   5.1906   37.098   4.5351 -2.169811 6.892706 
1 1 1   20    1   62 o   15.377   5.5785   9.3035   9.0166   9.2522   13.018   9.3508   12.500   16.626   6.5446   16.495   6.4366 0.1314602 9.179438 
1 1 1   20    1   63 o   31.206   3.7544   41.851   9.3587   34.839   13.756   47.894   12.769   27.217   6.3216   32.843   4.9211 -5.626003 8.011264 
1 1 1   20    1   64 o   28.068   4.1536   34.384   9.2166   39.814   13.516   29.665   12.600   29.374   5.8505   25.106   6.1955 4.268253 8.521236 
1 1 1   20    1   65 o   13.644   5.3839   5.6164   8.8295   2.3146   12.992   8.4507   12.037   14.424   6.1824   15.949   6.2884 -1.525409 8.818550 
1 1 1   20    1   66 o   18.929   5.4604   16.479   8.8893   15.857   13.236   16.990   11.998   18.950   6.7736   19.271   6.4717 -0.3212299 9.368254 
1 1 1   20    1   67 o   21.362   5.1985   21.015   8.9654   9.5951   13.211   30.763   12.206   16.626   6.5778   25.545   5.9698 -8.919712 8.882893 
1 1 1   20    1   68 o   31.203   3.6879   42.057   9.1992   27.448   13.654   54.201   12.449   23.697   6.7457   35.046   4.4585 -11.34835 8.085941 
1 1 1   20    1   69 o   39.982   3.0263   67.690   9.7898   50.114   14.304   83.178   13.427   32.964   5.5182   43.892   3.7900 -10.92840 6.694330 
1 1 1   20    1   70 o   33.914   3.5221   49.572   9.5952   48.861   14.156   50.175   13.050   32.438   5.5533   33.278   4.9624 -0.8394966 7.447443 
1 1 1   20    1   71 f   40.366   3.5145   70.181   11.449   70.873   16.724   69.570   15.707   39.233   5.3703   39.125   5.0420 0.1078949 7.366258 
1 1 1   20    1   72 o   26.762   5.0515   33.109   10.616   35.160   15.575   31.329   14.508   26.164   7.1161   24.816   6.9153 1.348196 9.922687 
1 1 1   20    1   73 o   31.466   4.4247   44.510   11.036   53.194   16.427   37.366   14.899   32.947   6.3469   27.153   6.7582 5.793173 9.271249 
1 1 1   20    1   74 f   55.476   2.8008  130.398   12.624  111.048   18.393  147.632   17.358   49.614   4.6004   58.251   3.6744 -8.637676 5.887708 
1 1 1   20    1   75 o   46.440   3.1556   92.639   11.875   92.891   17.731   92.434   15.990   44.920   4.9229   45.342   4.3807 -0.4220657 6.589804 
1 1 1   20    1   76 o   15.959   5.9604   11.224   10.419   33.366   15.458  -7.2073   14.103   24.866   7.2088   12.301   5.7362 12.56510 9.212596 
1 1 1   20    1   77 o   25.531   5.3751   31.509   10.832   32.061   16.361   31.079   14.454   23.961   7.5225   24.067   6.9688 -0.1069527 10.25437 
1 1 1   20    1   78 o   45.982   3.1747   91.482   11.827  103.797   18.284   82.624   15.508   47.292   4.8098   42.426   4.5554 4.865917 6.624595 
1 1 1   20    1   79 o   31.193   4.3661   44.752   10.798   63.577   16.601   30.945   14.217   35.712   5.9092   23.773   6.9197 11.93923 9.099471 
1 1 1   20    1   80 o   23.249   5.5798   27.161   10.440   22.000   16.073   30.928   13.730   19.824   7.4033   23.772   6.7637 -3.947939 10.02780 
1 1 1   20    1   81 o   10.963   4.9175  -0.9990   9.1078   2.9266   12.722  -5.1263   13.045   13.545   5.9572   11.924   5.5458 1.620864 8.139031 
1 1 1   20    1   82 o   24.203   5.0601   28.691   9.6614   18.698   13.506   39.163   13.826   18.544   6.8118   27.100   6.3676 -8.555662 9.324549 
1 1 1   20    1   83 o   31.917   3.9387   46.489   10.030   42.206   13.622   51.562   14.824   28.429   6.0631   31.615   5.9711 -3.186193 8.509702 
1 1 1   20    1   84 o   22.770   6.1697   27.858   11.734   23.959   15.993   32.404   17.269   20.068   7.4054   22.763   7.7635 -2.694918 10.72904 
1 1 1   20    1   85 o   27.418   5.3903   37.744   11.618   48.444   15.647   24.596   17.344   29.750   6.6225   20.045   7.6448 9.704826 10.11434 
1 1 1   20    1   86 o   13.174   6.0219  -0.4581   14.453  -0.4581   14.453   0.0000   0.0000   13.174   6.0219  ?   ?  0.000000 6.021858 
1 1 1   20    1   87 o   12.467   5.6597  -0.3264   12.495   1.2669   14.438  -5.0781   24.934   13.467   6.1021   15.098   7.2133 -1.630887 9.448148 
1 1 1   20    1   88 o   22.274   6.8301   29.044   13.578   29.758   15.934   27.151   25.944   21.767   7.4566   19.766   8.6043 2.001560 11.38574 
1 1 1   20    1   89 o   17.459   7.3942   16.457   18.196   13.854   25.911   18.990   25.560   17.527   8.0308   18.292   8.2186 -0.7648735 11.49082 
1 1 1   20    1   90 o   24.479   8.1367   40.858   18.973   21.084   26.284   62.371   27.416   18.553   8.3351   27.152   9.7434 -8.599480 12.82219 
1 1 1   20    1   91 o   14.953   6.7662   5.5892   17.680   31.918   24.635 -22.3768   25.389   20.477   8.6344   13.346   6.5746 7.130294 10.85258 
1 1 1   20    1   92 o   18.771   7.5580   22.422   17.751   18.922   23.949   26.689   26.442   17.950   8.0182   19.261   8.5248 -1.311798 11.70320 
1 1 1   20    1   93 o   9.9126   4.9541 -31.2474   16.572 -18.9517   22.736 -45.1827   24.205   12.925   6.3381   11.406   5.7401 1.519362 8.551013 
1 1 1   20    1   94 o   11.761   5.7060 -13.8794   17.081 -29.0839   23.719   2.4987   24.618   12.298   6.1106   15.495   7.3348 -3.196857 9.546671 
1 1 1   20    1   95 o   23.538   7.8935   38.319   17.849   2.3744   23.917   83.502   26.816   15.310   7.2422   32.778   9.4924 -17.46765 11.93965 
1 1 1   20    1   96 o   9.1892   4.6283 -36.7124   15.911 -31.7470   22.715 -41.4956   22.295   11.781   5.8740   11.011   5.5370 0.7695580 8.072353 
1 1 1   20    1   97 o   13.485   6.2501   0.2483   16.349  -3.2332   23.591   3.4655   22.678   14.563   6.9733   15.229   7.1571 -0.6664448 9.992539 
1 1 1   20    2  -95 o   15.070   7.2666  -3.0854   26.661  -3.0854   26.661   0.0000   0.0000   15.070   7.2666  ?   ?  0.000000 7.266631 
1 1 1   20    2  -94 o   15.860   7.5300   5.1536   26.316   5.1536   26.316   0.0000   0.0000   15.860   7.5300  ?   ?  0.000000 7.529981 
1 1 1   20    2  -93 o   11.580   5.8370 -46.3069   25.579 -46.3069   25.579   0.0000   0.0000   11.580   5.8370  ?   ?  0.000000 5.836967 
1 1 1   20    2  -92 o   17.005   7.9536   13.518   27.445   13.518   27.445   0.0000   0.0000   17.005   7.9536  ?   ?  0.000000 7.953570 
1 1 1   20    2  -91 f   17.830   8.1423   19.331   26.344   19.331   26.344   0.0000   0.0000   17.830   8.1423  ?   ?  0.000000 8.142291 
1 1 1   20    2  -90 o   14.906   7.1623  -4.0332   25.374  -4.0332   25.374   0.0000   0.0000   14.906   7.1623  ?   ?  0.000000 7.162295 
1 1 1   20    2  -89 o   18.415   8.3719   21.938   27.457   21.938   27.457   0.0000   0.0000   18.415   8.3719  ?   ?  0.000000 8.371887 
1 1 1   20    2  -87 o   17.305   7.9651   13.429   25.886   13.429   25.886   0.0000   0.0000   17.305   7.9651  ?   ?  0.000000 7.965070 
1 1 1   20    2  -86 o   27.488   9.8045   64.114   27.717   64.114   27.717   0.0000   0.0000   27.488   9.8045  ?   ?  0.000000 9.804504 
1 1 1   20    2  -85 o   21.320   8.9696   35.977   26.489   35.977   26.489   0.0000   0.0000   21.320   8.9696  ?   ?  0.000000 8.969589 
1 1 1   20    2  -84 o   18.963   7.7462   22.250   18.959   42.711   27.065   2.5384   26.565   22.750   9.2696   16.181   7.6479 6.568645 12.01732 
1 1 1   20    2  -83 o   12.332   5.9224 -11.6632   17.295 -21.5249   24.085  -1.1646   24.851   13.290   6.5180   15.553   7.3646 -2.263357 9.834709 
1 1 1   20    2  -82 o   15.601   6.6693   9.5795   15.044   8.7039   18.611   11.230   25.555   16.032   7.1206   17.396   7.9725 -1.364527 10.68945 
1 1 1   20    2  -81 o   24.207   7.1982   34.553   15.246   42.556   19.023   20.180   25.493   25.667   8.1186   18.910   8.3698 6.757481 11.66041 
1 1 1   20    2  -80 o   11.289   5.3426  -8.1718   13.043 -22.5286   17.931   7.9601   19.007   11.423   5.6070   16.069   7.1631 -4.645930 9.096606 
1 1 1   20    2  -79 o   15.252   6.3379   9.2552   12.983   24.852   17.869  -8.1821   18.894   20.227   7.7484   13.468   6.3902 6.758584 10.04355 
1 1 1   20    2  -78 o   17.663   6.6277   16.300   12.913   30.808   17.422  -1.3865   19.237   22.360   7.7905   14.620   6.7774 7.740292 10.32598 
1 1 1   20    2  -77 o   26.530   6.1370   36.683   13.008   26.743   17.479   49.022   19.474   21.129   7.7512   28.398   8.0469 -7.269716 11.17289 
1 1 1   20    2  -76 o   13.241   5.6435   4.1384   10.716   5.8531   17.272   3.0653   13.664   15.639   6.9072   13.991   6.1629 1.648142 9.256945 
1 1 1   20    2  -75 o   13.128   5.7200   2.4786   11.488 -38.8599   22.726   16.666   13.314   11.938   5.9402   18.141   6.7452 -6.202987 8.988026 
1 1 1   20    2  -74 o   22.714   5.6725   25.683   10.471   33.400   17.473   21.359   13.079   24.050   7.7986   20.117   6.7570 3.932320 10.31874 
1 1 1   20    2  -73 o   12.023   5.3308  -0.1760   10.385  -9.6848   17.030   5.4545   13.104   13.053   6.1553   14.659   6.2441 -1.605623 8.767905 
1 1 1   20    2  -72 o   16.120   5.9965   11.573   10.524 -15.5821   17.112   28.095   13.348   12.318   5.9091   23.186   6.6918 -10.86867 8.927321 
1 1 1   20    2  -71 o   19.580   5.4110   18.551   8.9237   13.676   12.321   23.929   12.941   17.294   6.4773   21.528   6.6799 -4.234253 9.304600 
1 1 1   20    2  -70 o   25.729   4.5114   30.211   9.1167   37.315   12.671   22.586   13.127   27.769   5.7857   21.036   6.7543 6.733101 8.893545 
1 1 1   20    2  -69 o   10.176   4.6531  -3.9737   8.6419  -3.7532   12.042  -4.2077   12.409   12.152   5.5323   12.235   5.5877 -0.8310318E-01 7.863132 
1 1 1   20    2  -68 o   35.278   3.3971   53.660   9.6483   60.955   13.740   46.562   13.552   36.754   4.6929   31.533   5.4705 5.221657 7.207622 
1 1 1   20    2  -67 o   17.424   5.6092   14.075   9.0495   6.1718   13.015   21.472   12.591   15.239   6.3402   20.887   6.6048 -5.648355 9.155419 
1 1 1   20    2  -66 o   11.916   5.0218   2.1393   8.3257 -12.8496   11.007   22.180   12.728   9.9292   4.7569   21.269   6.6286 -11.33963 8.158779 
1 1 1   20    2  -65 o   26.327   4.2359   30.744   8.7820   27.711   11.802   34.508   13.145   24.049   6.0318   26.831   6.1430 -2.782631 8.609300 
1 1 1   20    2  -64 o   28.918   3.9996   36.581   9.1760   43.748   12.493   28.185   13.522   31.046   5.1145   24.008   6.6707 7.037947 8.405717 
1 1 1   20    2  -63 o   45.117   2.5713   85.117   9.4173   82.483   12.689   88.347   14.051   43.899   3.5770   45.277   3.8434 -1.378380 5.250372 
1 1 1   20    2  -62 o   46.312   2.5444   89.555   9.5687   88.434   12.981   90.888   14.160   45.527   3.5253   45.987   3.8116 -0.4596558 5.191897 
1 1 1   20    2  -61 o   12.059   5.0442   2.2629   8.3030  -4.6935   11.059   11.251   12.570   11.656   5.3044   17.083   6.5099 -5.427261 8.397348 
1 1 1   20    2  -60 o   23.655   4.6360   25.018   8.6194   27.040   11.698   22.617   12.748   24.013   5.9953   21.828   6.6033 2.184456 8.918929 
1 1 1   20    2  -59 o   14.684   5.4100   8.2140   8.5295   9.3875   11.569   6.8164   12.626   16.167   6.2239   15.638   6.3462 0.5286942 8.888858 
1 1 1   20    2  -58 o   20.750   5.1475   19.611   8.6645   26.268   11.623   11.284   12.999   23.715   6.0070   17.301   6.6132 6.414461 8.934149 
1 1 1   20    2  -57 o   18.862   5.3387   16.174   8.5766   34.932   11.748  -5.2297   12.550   27.757   5.3867   12.425   5.6531 15.33222 7.808591 
1 1 1   20    2  -56 o   35.465   2.9021   52.802   8.3164   54.124   12.173   51.646   11.389   35.305   4.3196   34.571   4.1225 0.7343788 5.971084 
1 1 1   20    2  -55 o   58.233   2.0072  139.888   9.5137  130.024   13.727  149.005   13.197   55.711   3.0342   59.809   2.7141 -4.098129 4.070922 
1 1 1   20    2  -54 o   26.146   4.2068   29.783   8.6617   24.633   11.917   35.551   12.611   23.026   6.2085   27.934   5.7309 -4.907478 8.449167 
1 1 1   20    2  -53 o   47.529   2.4875   93.769   9.6038   97.056   13.208   90.081   13.989   47.986   3.3986   46.051   3.7594 1.934460 5.067875 
1 1 1   20    2  -52 o   11.065   5.0020  -4.0397   9.6340   2.5802   13.080 -11.8886   14.243   14.725   6.2541   12.148   5.6973 2.576858 8.460063 
1 1 1   20    2  -51 o   17.468   5.9165   12.959   10.027   7.3035   13.765   19.355   14.637   16.432   6.6414   20.892   7.1470 -4.460005 9.756422 
1 1 1   20    2  -50 o   25.096   4.7287   27.739   9.3186   35.927   14.482   21.954   12.173   27.885   6.4931   21.897   6.4114 5.987886 9.125003 
1 1 1   20    2  -49 o   28.543   3.7780   34.787   8.5746   40.293   14.386   31.754   10.679   29.776   6.1313   26.779   5.0779 2.996922 7.960973 
1 1 1   20    2  -48 o   46.671   2.3459   90.042   8.8959   88.477   13.622   91.205   11.747   45.797   3.6798   46.729   3.1015 -0.9318352 4.812499 
1 1 1   20    2  -47 o   22.642   4.5944   22.514   8.1895   15.933   12.175   27.951   11.067   19.285   6.5194   24.951   5.5815 -5.666130 8.582275 
1 1 1   20    2  -46 o   14.307   5.1486   7.6705   7.6612   8.5805   11.883   7.0232   10.022   16.292   6.2984   14.969   5.7849 1.323219 8.551889 
1 1 1   20    2  -45 o   52.802   2.1840  114.877   9.3798  100.716   14.295  125.585   12.430   48.972   3.6062   55.030   2.7801 -6.058125 4.553356 
1 1 1   20    2  -44 o   68.600   2.1241  193.608   11.864  132.110   22.997  215.909   13.849   55.365   5.1550   72.372   2.3506 -17.00702 5.665604 
1 1 1   20    2  -43 o   16.631   5.3587   11.688   8.2581  -6.7843   14.462   20.625   10.059   13.367   6.0766   21.491   5.6635 -8.123864 8.306638 
1 1 1   20    2  -42 o   9.2676   4.3656  -8.7874   8.5254 -34.8287   17.259  -0.3827   9.8052   10.938   5.3945   12.311   5.3246 -1.372738 7.579714 
1 1 1   20    2  -41 o   45.969   2.4905   87.267   9.2974   56.889   14.990  106.262   11.853   36.223   5.2276   50.631   2.8839 -14.40796 5.970294 
1 1 1   20    2  -40 o   61.817   1.9285  156.828   9.7057  155.936   14.254  157.600   13.252   61.390   2.8563   61.785   2.6374 -0.3952408 3.887697 
1 1 1   20    2  -39 o   49.132   2.1987   99.317   8.7834   92.043   12.803  105.785   12.072   46.997   3.3642   50.525   2.9440 -3.527920 4.470465 
1 1 1   20    2  -38 o   22.791   4.2690   22.399   7.6394   34.961   11.402   12.165   10.291   28.348   5.1226   17.418   5.9916 10.92945 7.882955 
1 1 1   20    2  -37 o   16.141   5.1194   10.921   7.5596   5.5528   11.035   15.669   10.377   15.006   5.9873   19.115   5.9896 -4.108910 8.468885 
1 1 1   20    2  -36 o   28.201   3.4951   33.444   7.8627   38.705   11.724   29.143   10.600   29.943   4.9780   25.830   5.2144 4.112911 7.209025 
1 1 1   20    2  -35 o   54.188   2.1502  120.613   9.4787  114.423   14.782  124.936   12.353   52.447   3.4772   55.014   2.7634 -2.566990 4.441515 
1 1 1   20    2  -34 o   39.046   2.9204   63.169   9.2277   81.178   17.000   55.647   10.987   43.718   4.8521   36.434   3.7531 7.283978 6.134169 
1 1 1   20    2  -33 o   61.738   2.2924  156.591   11.517  122.513   18.814  177.015   14.565   54.039   4.3066   65.539   2.7322 -11.50058 5.100178 
1 1 1   20    2  -32 o   35.682   3.1924   52.938   9.1874   63.253   14.311   45.706   11.983   38.638   4.6362   32.771   4.6133 5.867390 6.540426 
1 1 1   20    2  -31 o   18.236   5.3511   14.291   8.4720   17.240   12.652   11.895   11.407   20.294   6.6401   17.713   6.2927 2.581131 9.148187 
1 1 1   20    2  -30 o   41.946   2.6000   72.539   8.8464   67.174   12.107   78.684   12.957   40.109   3.7465   43.449   3.6935 -3.340199 5.260979 
1 1 1   20    2  -29 o   79.337   1.9466  257.626   12.589  244.856   15.538  282.026   21.478   77.207   2.4720   82.655   3.1938 -5.448082 4.038728 
1 1 1   20    2  -28 o   26.774   4.2689   30.485   9.0041   40.848   11.350   12.891   14.789   30.982   4.6365   19.172   7.1128 11.81038 8.490554 
1 1 1   20    2  -27 o   42.466   2.6480   74.324   9.1207   68.265   12.219   81.947   13.705   40.463   3.7473   44.342   3.8293 -3.879017 5.357796 
1 1 1   20    2  -26 o   36.447   3.4575   55.277   10.149   47.131   13.054   67.726   16.138   33.251   4.9684   39.948   5.0698 -6.696449 7.098487 
1 1 1   20    2  -25 o   26.310   4.4296   29.501   9.1629   42.412   12.841   16.110   13.078   31.459   5.1884   19.982   6.7570 11.47646 8.519186 
1 1 1   20    2  -24 o   47.305   2.9003   92.284   11.130  108.761   17.482   81.054   14.433   51.048   4.2394   44.066   4.0638 6.982559 5.872542 
1 1 1   20    2  -23 o   96.983   1.8268  384.565   14.442  392.823   20.590  376.566   20.263   97.831   2.5841   95.781   2.5977 2.050674 3.664126 
1 1 1   20    2  -22 o   57.972   2.1391  137.740   10.091  140.556   15.763  135.785   13.135   58.334   3.3287   57.442   2.8139 0.8923454 4.358694 
1 1 1   20    2  -21 o   24.556   4.4956   25.770   8.6673   44.299   13.534   12.888   11.285   32.158   5.3512   18.201   6.2737 13.95715 8.245884 
1 1 1   20    2  -20 o  132.873   1.6441  721.300   17.807  740.810   27.591  707.373   23.312  134.442   2.5177  131.466   2.1754 2.975983 3.327299 
1 1 1   20    2  -19 o  144.500   1.6616  853.077   19.572  844.170   29.801  859.831   25.953  143.511   2.5475  144.941   2.1966 -1.429733 3.363757 
1 1 1   20    2  -18 o   55.825   2.4903  127.943   11.304  140.589   16.301  116.229   15.688   58.337   3.4433   52.977   3.6553 5.360023 5.021700 
1 1 1   20    2  -17 o   67.138   2.1595  184.628   11.803  180.989   20.393  186.461   14.473   66.131   3.7991   67.389   2.6399 -1.258118 4.626236 
1 1 1   20    2  -16 o   40.784   2.8520   68.580   9.4218   59.685   14.700   74.782   12.274   37.592   4.9149   42.463   3.5794 -4.870529 6.080158 
1 1 1   20    2  -15 o   35.156   3.3195   51.268   9.4003   59.167   14.990   46.149   12.068   37.397   5.0459   33.063   4.6023 4.333389 6.829510 
1 1 1   20    2  -14 o   87.312   1.8112  311.532   12.891  334.534   20.262  295.890   16.709   90.279   2.7565   84.970   2.4148 5.308746 3.664667 
1 1 1   20    2  -13 o   28.165   4.1659   33.454   9.2762   37.816   14.484   30.420   12.079   29.488   6.2215   26.485   5.7593 3.003141 8.478000 
1 1 1   20    2  -12 o   54.207   2.4103  120.545   10.624  126.188   16.218  116.303   14.061   55.242   3.6215   53.098   3.2644 2.144135 4.875590 
1 1 1   20    2  -11 o   83.799   2.0411  287.144   13.943  274.541   19.709  299.771   19.727   81.740   2.9629   85.447   2.8362 -3.706589 4.101536 
1 1 1   20    2  -10 o   63.675   2.3770  166.202   12.316  164.673   17.702  167.637   17.146   63.181   3.4502   63.780   3.3092 -0.5981178 4.780710 
1 1 1   20    2   -9 o   29.346   4.8854   36.644   11.276   33.169   14.945   41.236   17.180   27.525   6.7204   30.657   7.0256 -3.132040 9.722307 
1 1 1   20    2   -8 o   23.880   5.9250   24.779   11.478   33.029   15.573   14.967   16.984   27.447   6.9535   20.706   7.6330 6.741287 10.32538 
1 1 1   20    2   -7 o  147.914   1.8674  894.057   22.515  907.089   32.521  882.061   31.202  148.780   2.6815  146.735   2.6087 2.045654 3.741059 
1 1 1   20    2   -6 o  114.221   2.2214  533.708   20.683  547.838   29.901  520.744   28.640  115.457   3.1801  112.580   3.1239 2.876961 4.457765 
1 1 1   20    2   -5 o   22.718   5.7346   22.372   10.619   35.005   18.522   16.187   12.960   28.220   7.7944   20.096   6.7260 8.124741 10.29523 
1 1 1   20    2   -4 o   42.116   3.6266   73.525   12.329  100.019   27.059   66.583   13.851   48.188   7.1013   39.918   4.3256 8.269730 8.315036 
1 1 1   20    2   -3 o  128.190   2.2113  672.179   23.107  682.913   46.410  668.641   26.644  128.436   4.4396  127.774   2.5581 0.6613083 5.123879 
1 1 1   20    2   -2 o   88.301   2.5117  319.527   18.060   0.0000   0.0000  319.527   18.060  ?   ?    88.301   2.5117 0.000000 2.511653 
1 1 1   20    2   -1 f   57.201   2.4268  134.173   11.290  138.068   17.788  131.545   14.609   57.776   3.7980   56.513   3.1843 1.262836 4.956249 
1 1 1   20    2    0 o   13.122   5.5395   0.9090   10.159  -2.9398   15.070   4.1148   13.753   14.832   6.5048   16.036   6.5795 -1.204001 9.252164 
1 1 1   20    2    1 f   42.451   3.2657   74.453   11.214   76.854   16.855   72.547   15.020   42.777   4.9236   41.650   4.4952 1.126793 6.666962 
1 1 1   20    2    2 o  125.355   2.0078  642.369   20.516  680.775   33.484  619.284   25.960  128.757   3.1903  122.961   2.5900 5.796036 4.109311 
1 1 1   20    2    3 o  106.001   1.9384  459.230   16.749  456.838   24.388  461.366   23.043  105.519   2.8379  106.083   2.6669 -0.5631866 3.894372 
1 1 1   20    2    4 o  119.781   1.8824  586.302   18.380  593.975   26.877  579.561   25.191  120.385   2.7389  118.949   2.5981 1.436607 3.775111 
1 1 1   20    2    5 o   15.044   5.8813   5.9032   10.452   5.4748   15.803   6.2363   13.936   17.355   7.0786   16.770   6.7159 0.5848236 9.757588 
1 1 1   20    2    6 o   9.2667   4.4750 -15.9196   10.202  -1.4422   15.477 -27.0427   13.566   15.390   6.6729   9.9199   4.8707 5.469887 8.261450 
1 1 1   20    2    7 o   17.310   6.0074   11.403   10.354   22.177   15.645   3.0054   13.812   23.022   7.3719   15.731   6.5371 7.290994 9.852813 
1 1 1   20    2    8 o  141.390   1.8536  816.911   21.363  856.559   31.479  783.060   29.087  144.577   2.6711  138.260   2.5809 6.317230 3.714246 
1 1 1   20    2    9 o  151.325   1.8541  935.777   22.870  943.536   33.099  928.688   31.637  151.735   2.6761  150.566   2.5777 1.168930 3.715629 
1 1 1   20    2   10 o   84.951   2.0427  295.084   14.145  292.577   20.812  297.237   19.285   84.373   3.0309   85.098   2.7838 -0.7253494 4.115349 
1 1 1   20    2   11 o   14.304   5.8862   2.9954   11.050   0.3402   20.381   4.1008   13.150   18.021   7.7343   15.728   6.4412 2.293274 10.06521 
1 1 1   20    2   12 o   43.541   3.3809   78.423   11.906  109.552   21.322   64.319   14.351   51.057   5.1954   39.148   4.5840 11.90879 6.928545 
1 1 1   20    2   13 o   65.083   2.5327  173.785   13.411  164.185   23.376  178.494   16.373   62.781   4.5997   65.862   3.0581 -3.081429 5.523494 
1 1 1   20    2   14 o  105.033   2.3621  451.663   20.223  431.038   29.419  470.142   27.846  102.262   3.5345  106.913   3.1988 -4.650101 4.767112 
1 1 1   20    2   15 o   66.492   2.5497  181.421   13.794  185.663   18.290  175.824   21.007   67.102   3.3544   65.143   3.9750 1.959579 5.201229 
1 1 1   20    2   16 o   50.408   3.0195  104.714   12.350   96.525   16.467  115.245   18.673   48.128   4.2406   52.579   4.3970 -4.450729 6.108697 
1 1 1   20    2   17 o   27.954   5.0810   33.488   11.152   47.738   15.229   17.013   16.375   33.306   5.8212   21.189   7.5384 12.11673 9.524358 
1 1 1   20    2   18 o   65.500   2.2291  175.805   11.884  175.213   17.767  176.285   15.988   65.168   3.3559   65.446   3.0049 -0.2778320 4.504614 
1 1 1   20    2   19 o   68.409   2.1966  191.736   12.233  198.996   18.419  186.005   16.364   69.479   3.2613   67.228   2.9936 2.250626 4.426900 
1 1 1   20    2   20 o   30.429   4.0904   38.951   9.8894   33.855   14.978   42.889   13.167   27.743   6.6996   31.654   5.2895 -3.911133 8.536018 
1 1 1   20    2   21 o   43.698   2.9397   78.778   10.410   85.175   15.715   73.777   13.896   45.139   4.3239   42.036   4.1079 3.103046 5.964148 
1 1 1   20    2   22 o   12.701   5.3211   1.3939   9.2613 -10.5825   14.219   10.218   12.205   12.711   5.8693   17.391   6.4598 -4.680570 8.728012 
1 1 1   20    2   23 o   68.774   2.1615  193.816   12.103  178.611   18.031  206.284   16.328   65.761   3.3749   70.818   2.8341 -5.056992 4.407038 
1 1 1   20    2   24 o   31.487   3.8621   41.576   9.7054   13.556   14.755   62.945   12.885   19.452   7.1240   38.769   4.1414 -19.31620 8.240320 
1 1 1   20    2   25 o   66.203   2.1990  179.688   11.851  159.406   17.444  197.071   16.149   62.076   3.4610   69.194   2.8694 -7.117962 4.495769 
1 1 1   20    2   26 o   61.394   2.2635  154.639   11.309  155.126   16.887  154.243   15.227   61.241   3.3961   61.149   3.0646 0.9219742E-01 4.574362 
1 1 1   20    2   27 o   65.138   2.4320  174.244   12.890  163.923   22.210  179.487   15.829   62.647   4.3768   65.995   2.9499 -3.348774 5.278058 
1 1 1   20    2   28 o   64.155   2.2036  168.832   11.507  172.768   17.058  165.545   15.588   64.660   3.2468   63.348   3.0274 1.312351 4.439260 
1 1 1   20    2   29 o   28.207   4.1909   33.735   9.3436   25.701   13.790   40.554   12.704   24.134   6.7481   30.677   5.2702 -6.543795 8.562263 
1 1 1   20    2   30 o   50.068   2.5273  103.180   10.281  100.503   15.206  105.434   13.954   49.103   3.8293   50.413   3.4159 -1.309624 5.131423 
1 1 1   20    2   31 o   57.683   2.6195  136.989   12.285  123.113   15.877  157.689   19.392   54.431   3.5985   61.537   3.8858 -7.106045 5.296095 
1 1 1   20    2   32 o   39.008   3.0664   63.100   9.6720   63.419   14.358   62.835   13.087   38.686   4.6458   38.632   4.2247 0.5453110E-01 6.279401 
1 1 1   20    2   33 o   36.411   3.4260   55.294   10.049   63.225   14.300   47.555   14.125   38.613   4.6358   33.171   5.4100 5.441822 7.124492 
1 1 1   20    2   34 o   54.478   2.5640  122.263   11.354  112.562   15.451  133.652   16.741   51.974   3.6707   56.664   3.6437 -4.689842 5.172042 
1 1 1   20    2   35 o   32.443   4.1491   44.555   10.722   39.697   16.456   48.139   14.133   29.716   6.9228   33.346   5.3827 -3.630686 8.769150 
1 1 1   20    2   36 o   85.132   2.6128  298.485   18.110  296.113   23.213  302.176   28.949   84.499   3.3770   84.968   4.1926 -0.4688797 5.383455 
1 1 1   20    2   37 o   37.331   3.7371   58.491   11.219   52.978   16.645   63.081   15.188   34.692   6.1092   38.374   4.9722 -3.681999 7.876835 
1 1 1   20    2   38 o   49.040   2.5666   99.249   10.224   92.032   15.450  104.872   13.637   46.770   4.0937   50.198   3.3520 -3.428356 5.290987 
1 1 1   20    2   39 o   31.419   4.1296   41.941   10.321   28.093   14.044   58.202   15.218   24.952   6.7450   36.698   5.2354 -11.74636 8.538393 
1 1 1   20    2   40 o   57.859   2.5664  138.145   12.074  141.194   16.474  134.607   17.748   58.193   3.4888   56.670   3.8652 1.523067 5.206842 
1 1 1   20    2   41 o   27.146   4.6984   31.929   10.020   50.367   14.088   13.053   14.255   34.039   5.2456   18.803   6.9818 15.23639 8.732810 
1 1 1   20    2   42 o   58.657   2.7971  142.452   13.335  156.792   20.062  131.100   17.850   61.033   4.0555   55.834   3.9473 5.198246 5.659361 
1 1 1   20    2   43 o   34.071   3.7977   49.093   10.368   49.226   14.442   48.952   14.895   33.492   5.4791   33.308   5.6900 0.1840935 7.899190 
1 1 1   20    2   44 o   25.996   4.3334   29.191   8.8595   37.634   14.029   23.591   11.426   28.909   6.1431   22.872   6.0400 6.036592 8.615040 
1 1 1   20    2   45 o   19.168   5.4313   16.291   8.8718   10.911   13.713   20.164   11.634   17.770   6.7927   21.199   6.2840 -3.428963 9.253634 
1 1 1   20    2   46 o   58.098   2.3097  139.262   10.917  144.838   16.570  134.986   14.511   58.807   3.4721   56.905   3.1405 1.902325 4.681733 
1 1 1   20    2   47 o   55.332   2.3457  126.435   10.556  122.603   16.116  129.313   13.969   53.972   3.6853   55.695   3.0890 -1.722977 4.808712 
1 1 1   20    2   48 o   66.693   2.1097  183.198   11.455  196.735   17.445  172.938   15.188   68.694   3.1237   64.500   2.8961 4.194771 4.259670 
1 1 1   20    2   49 o   41.303   2.8568   71.107   9.5591   89.185   14.419   56.933   12.768   45.864   3.8937   36.374   4.3952 9.490379 5.871849 
1 1 1   20    2   50 o   19.218   5.7095   16.528   9.5956   15.469   17.703   16.968   11.419   20.150   7.7139   19.563   6.3011 0.5860958 9.960307 
1 1 1   20    2   51 o   49.623   3.3507  103.474   13.474   83.952   19.601  120.964   18.552   43.473   5.6659   53.158   4.3187 -9.684666 7.124119 
1 1 1   20    2   52 o   21.740   6.3877   21.770   12.066   36.415   17.858   9.4687   16.366   27.457   7.6798   17.922   7.2426 9.535137 10.55624 
1 1 1   20    2   53 o   46.080   3.1675   89.144   11.825   92.711   15.763   84.553   17.885   46.491   4.2049   43.881   5.0945 2.610146 6.605708 
1 1 1   20    2   54 o   13.689   5.3972   5.4499   8.8669   9.4395   13.528   2.4451   11.740   16.943   6.6708   14.017   5.9381 2.925191 8.930891 
1 1 1   20    2   55 o   26.196   4.4232   30.128   9.1092   16.630   13.824   40.486   12.110   19.564   6.9299   30.132   5.1129 -10.56770 8.611901 
1 1 1   20    2   56 o   27.093   4.3335   32.145   9.2480   38.759   14.194   27.266   12.191   28.866   6.2160   24.157   6.1698 4.709297 8.758175 
1 1 1   20    2   57 o   42.448   2.9453   75.614   10.128   79.326   15.370   72.764   13.465   42.701   4.4826   41.107   4.0718 1.593712 6.055860 
1 1 1   20    2   58 o   41.416   3.2338   72.469   10.831   59.369   18.105   79.771   13.516   35.650   6.4683   43.135   3.8856 -7.485340 7.545676 
1 1 1   20    2   59 o   15.249   5.7608   8.5301   9.7923   15.314   17.372   5.3708   11.855   19.612   7.6062   14.872   6.1060 4.739856 9.753836 
1 1 1   20    2   60 o   35.727   3.6204   54.622   10.398   48.275   17.417   58.137   12.962   31.671   6.9387   36.440   4.4562 -4.769890 8.246394 
1 1 1   20    2   61 o   31.195   4.1567   42.460   10.307   50.831   17.713   38.175   12.673   32.479   6.9034   28.815   5.5975 3.664129 8.887560 
1 1 1   20    2   62 o   32.221   3.9321   45.037   10.114   26.062   17.115   55.220   12.537   22.988   7.7297   35.444   4.4363 -12.45655 8.912268 
1 1 1   20    2   63 o   37.049   3.4994   58.759   10.443   76.691   17.780   49.314   12.903   41.078   5.4437   33.154   4.9239 7.924149 7.340161 
1 1 1   20    2   64 o   20.030   5.7038   18.834   9.7601   23.395   16.907   16.555   11.953   21.877   7.6709   18.953   6.4591 2.924154 10.02808 
1 1 1   20    2   65 o   17.023   5.5459   13.151   8.8305   17.566   13.641   9.9672   11.586   19.440   6.8840   16.164   6.2270 3.275764 9.282479 
1 1 1   20    2   66 o   31.838   3.6745   43.980   9.3615   35.121   14.204   50.785   12.448   26.713   6.5693   33.653   4.6627 -6.939856 8.055853 
1 1 1   20    2   67 o   24.904   5.4356   29.174   10.724   24.113   17.038   32.495   13.801   21.796   7.6957   25.581   6.5809 -3.785315 10.12587 
1 1 1   20    2   68 o   17.586   6.0377   14.330   10.448   14.507   16.951   14.222   13.268   18.608   7.4221   17.902   6.7181 0.7065067 10.01098 
1 1 1   20    2   69 o   28.653   4.8649   37.735   10.957   31.452   17.260   41.976   14.181   24.162   7.7435   29.330   6.1291 -5.168100 9.875587 
1 1 1   20    2   70 o   44.629   3.3849   86.027   12.222   75.567   18.541   94.065   16.253   39.649   5.9177   45.809   4.4070 -6.159447 7.378457 
1 1 1   20    2   71 o   30.939   4.6239   43.822   11.304   24.851   17.199   58.250   14.999   21.481   7.7161   35.069   5.4217 -13.58812 9.430479 
1 1 1   20    2   72 o   21.768   6.0114   23.797   11.018   8.3807   16.685   35.717   14.672   16.494   7.0364   26.103   6.8211 -9.609352 9.799879 
1 1 1   20    2   73 o   47.907   3.1630   99.008   12.283   81.075   18.289  113.744   16.578   41.021   5.6168   50.480   4.0632 -9.459198 6.932410 
1 1 1   20    2   74 o   23.840   5.7153   28.295   10.963   12.577   16.517   40.670   14.656   17.341   7.1723   27.970   6.5449 -10.62850 9.709663 
1 1 1   20    2   75 o   12.271   5.3833   1.1637   10.329   10.135   15.549  -5.9222   13.819   16.388   6.8822   12.247   5.7001 4.141487 8.936205 
1 1 1   20    2   76 o   12.204   5.3320   1.5878   10.041   4.1764   15.260  -0.3888   13.335   14.743   6.5027   13.080   5.9014 1.662575 8.781340 
1 1 1   20    2   77 o   17.684   5.9876   16.044   10.270   10.767   15.845   19.866   13.486   16.369   6.9149   19.094   6.8358 -2.724173 9.723328 
1 1 1   20    2   78 o   24.063   6.9425   32.745   14.369   0.0000   0.0000   32.745   14.369  ?   ?    24.063   6.9425 0.000000 6.942455 
1 1 1   20    2   79 o   11.520   5.0649   1.0089   9.1886   9.0180   12.965  -7.0747   13.025   15.177   6.3224   11.495   5.4090 3.682604 8.320460 
1 1 1   20    2   80 o   11.492   5.1793  -0.8385   10.240  -8.8104   12.968   12.362   16.687   11.151   5.2917   16.663   7.0700 -5.511816 8.831037 
1 1 1   20    2   81 o   17.118   6.3562   15.332   11.815   14.113   16.081   16.762   17.416   16.995   7.0573   17.800   7.3638 -0.8051224 10.19956 
1 1 1   20    2   82 o   12.601   5.6036   1.5450   11.562   7.8875   16.011  -5.3674   16.714   15.378   6.7256   13.073   6.1438 2.305873 9.109335 
1 1 1   20    2   83 o   19.492   8.1717   24.423   21.866   24.423   21.866   0.0000   0.0000   19.492   8.1717  ?   ?  0.000000 8.171722 
1 1 1   20    2   84 o   10.963   5.4797 -36.1415   20.306 -36.1415   20.306   0.0000   0.0000   10.963   5.4797  ?   ?  0.000000 5.479748 
1 1 1   20    2   85 o   12.442   6.1011 -20.8483   21.071 -20.8483   21.071   0.0000   0.0000   12.442   6.1011  ?   ?  0.000000 6.101072 
1 1 1   20    2   86 o   11.057   5.5221 -34.7429   20.419 -34.7429   20.419   0.0000   0.0000   11.057   5.5221  ?   ?  0.000000 5.522106 
1 1 1   20    2   87 o   14.813   6.9643  -0.1919   21.510  -0.1919   21.510   0.0000   0.0000   14.813   6.9643  ?   ?  0.000000 6.964345 
1 1 1   20    2   89 o   12.652   6.2798 -28.5427   24.791 -28.5427   24.791   0.0000   0.0000   12.652   6.2798  ?   ?  0.000000 6.279794 
1 1 1   20    2   90 o   15.474   6.8723   9.2206   17.331 -30.8750   22.690   65.370   26.851   11.908   5.9268   27.623   9.6685 -15.71472 11.34049 
1 1 1   20    2   91 f   13.462   6.2937  -1.3494   17.150  -8.1188   22.725   7.6069   26.139   13.897   6.7031   16.248   7.6509 -2.350765 10.17188 
1 1 1   20    2   92 o   11.372   5.5422 -15.4384   16.618  -9.5793   22.374 -22.6470   24.817   13.617   6.5882   12.982   6.4149 0.6348839 9.195405 
1 1 1   20    2   93 o   20.362   7.7130   28.989   17.581   24.033   24.036   34.692   25.782   18.441   8.1463   20.271   8.6994 -1.829971 11.91812 
1 1 1   20    2   94 o   13.145   6.1914  -2.9650   17.139 -21.8875   23.026   20.542   25.664   12.595   6.2152   17.853   8.1076 -5.258657 10.21576 
1 1 1   20    2   95 o   12.576   6.0004  -7.1062   17.136 -13.0545   23.724  -0.6172   24.779   13.567   6.6141   15.044   7.1883 -1.477516 9.768237 
1 1 1   20    3  -92 o   16.009   7.6132   5.7479   27.125   5.7479   27.125   0.0000   0.0000   16.009   7.6132  ?   ?  0.000000 7.613172 
1 1 1   20    3  -91 o   17.671   8.1965   19.579   28.199   19.579   28.199   0.0000   0.0000   17.671   8.1965  ?   ?  0.000000 8.196537 
1 1 1   20    3  -90 o   17.892   8.1202   21.343   25.695   21.343   25.695   0.0000   0.0000   17.892   8.1202  ?   ?  0.000000 8.120170 
1 1 1   20    3  -89 o   19.008   8.4277   28.165   25.958   28.165   25.958   0.0000   0.0000   19.008   8.4277  ?   ?  0.000000 8.427716 
1 1 1   20    3  -88 o   18.231   8.2406   22.752   26.145   22.752   26.145   0.0000   0.0000   18.231   8.2406  ?   ?  0.000000 8.240644 
1 1 1   20    3  -87 o   13.332   6.5696 -20.4025   25.412 -20.4025   25.412   0.0000   0.0000   13.332   6.5696  ?   ?  0.000000 6.569606 
1 1 1   20    3  -86 o   18.709   8.4755   24.731   27.837   24.731   27.837   0.0000   0.0000   18.709   8.4755  ?   ?  0.000000 8.475514 
1 1 1   20    3  -85 o   18.632   8.4516   23.699   27.790   23.699   27.790   0.0000   0.0000   18.632   8.4516  ?   ?  0.000000 8.451638 
1 1 1   20    3  -84 o   14.483   7.0255  -9.9695   25.876  -9.9695   25.876   0.0000   0.0000   14.483   7.0255  ?   ?  0.000000 7.025483 
1 1 1   20    3  -83 o   13.670   6.6616 -14.8844   23.987 -14.8844   23.987   0.0000   0.0000   13.670   6.6616  ?   ?  0.000000 6.661572 
1 1 1   20    3  -82 f   26.681   9.5102   58.496   26.073   58.496   26.073   0.0000   0.0000   26.681   9.5102  ?   ?  0.000000 9.510212 
1 1 1   20    3  -81 o   19.767   8.4615   27.554   24.276   27.554   24.276   0.0000   0.0000   19.767   8.4615  ?   ?  0.000000 8.461487 
1 1 1   20    3  -80 o   25.518   9.4131   52.896   25.836   52.896   25.836   0.0000   0.0000   25.518   9.4131  ?   ?  0.000000 9.413133 
1 1 1   20    3  -79 o   15.186   7.1535  -0.9463   22.887  -0.9463   22.887   0.0000   0.0000   15.186   7.1535  ?   ?  0.000000 7.153450 
1 1 1   20    3  -78 o   14.683   6.9894  -5.7159   22.971  -5.7159   22.971   0.0000   0.0000   14.683   6.9894  ?   ?  0.000000 6.989394 
1 1 1   20    3  -77 o   16.641   7.1554   12.172   17.506   12.172   17.506   0.0000   0.0000   16.641   7.1554  ?   ?  0.000000 7.155409 
1 1 1   20    3  -76 o   27.809   7.9255   48.075   18.836   48.075   18.836   0.0000   0.0000   27.809   7.9255  ?   ?  0.000000 7.925495 
1 1 1   20    3  -75 o   13.871   5.9323   5.5436   11.913  -4.4244   17.373   14.392   16.368   13.521   6.3256   17.179   7.1256 -3.657439 9.528232 
1 1 1   20    3  -74 o   10.090   4.8473 -11.5879   11.608 -15.2492   22.323 -10.2310   13.590   13.651   6.5988   11.244   5.3591 2.406401 8.500778 
1 1 1   20    3  -73 o   15.208   6.0347   9.9611   11.150  -9.8554   17.697   23.005   14.358   12.946   6.1545   20.163   7.0692 -7.217614 9.372907 
1 1 1   20    3  -72 o   23.106   6.0218   27.722   11.455   29.249   18.514   26.775   14.581   21.915   7.9873   21.743   7.1290 0.1720295 10.70608 
1 1 1   20    3  -71 o   24.992   5.7139   31.339   11.386   35.583   18.660   28.821   14.372   24.231   8.0698   22.790   7.0339 1.440668 10.70505 
1 1 1   20    3  -70 o   13.886   5.4661   7.3020   9.0814   10.961   12.055   2.5011   13.809   15.995   6.2973   14.038   6.1889 1.957581 8.829455 
1 1 1   20    3  -69 o   26.142   4.6099   31.755   9.4645   36.676   12.819   25.858   14.033   27.067   5.9707   21.898   6.9783 5.169201 9.184022 
1 1 1   20    3  -68 f   20.875   5.4681   21.340   9.4137   23.913   12.725   18.229   13.991   21.398   6.6211   18.990   6.9399 2.408138 9.591777 
1 1 1   20    3  -67 o   29.678   4.0367   39.437   9.5128   38.205   12.753   40.981   14.283   27.954   5.7874   28.535   6.3082 -0.5807209 8.560822 
1 1 1   20    3  -66 o   18.721   5.5608   16.965   9.1031   15.610   12.325   18.592   13.502   18.080   6.5273   19.312   6.8479 -1.232306 9.460382 
1 1 1   20    3  -65 o   25.391   4.7760   29.767   9.5224   43.026   13.202   15.390   13.748   30.043   5.5969   18.227   6.8387 11.81599 8.837027 
1 1 1   20    3  -64 o   38.099   3.3196   62.482   10.207   77.384   14.219   46.641   14.660   41.760   4.2356   31.080   6.0038 10.68034 7.347487 
1 1 1   20    3  -63 o   23.846   5.0775   26.486   9.5666   35.021   13.562   18.033   13.497   26.665   6.3338   19.367   6.8484 7.298073 9.328359 
1 1 1   20    3  -62 o   23.154   5.7161   25.625   10.723   48.316   13.512 -12.9739   17.623   32.323   5.3126   13.171   6.2262 19.15209 8.184672 
1 1 1   20    3  -61 o   28.659   4.4015   36.653   9.9543   37.406   11.764   34.756   18.679   28.453   5.2660   25.584   8.0384 2.869019 9.609689 
1 1 1   20    3  -60 o   35.863   3.5559   55.374   10.258   66.288   12.520   33.083   17.894   39.004   3.9943   25.212   7.8598 13.79213 8.816453 
1 1 1   20    3  -59 o   23.678   4.8162   25.473   8.9789   12.429   12.072   41.626   13.433   17.267   6.4224   29.882   5.7232 -12.61459 8.602472 
1 1 1   20    3  -58 f   33.421   3.1123   47.431   8.3814   50.447   12.531   44.989   11.275   33.659   4.6948   31.890   4.4590 1.769108 6.474874 
1 1 1   20    3  -57 o   33.832   3.1213   48.554   8.5107   57.774   12.726   41.094   11.447   36.270   4.3938   30.312   4.7921 5.958378 6.501472 
1 1 1   20    3  -56 o   32.332   3.2035   44.420   8.3319   33.289   12.286   53.898   11.337   26.728   5.8055   35.254   4.0167 -8.526134 7.059604 
1 1 1   20    3  -55 o   33.852   3.1423   48.539   8.5719   43.800   12.738   52.462   11.589   31.159   5.1982   34.721   4.1784 -3.562243 6.669301 
1 1 1   20    3  -54 f   35.492   2.9336   53.039   8.4116   43.989   12.394   60.766   11.453   31.352   5.0190   37.622   3.7861 -6.270027 6.286879 
1 1 1   20    3  -53 o   14.998   5.2634   9.2133   7.9609   13.801   12.029   5.6382   10.619   18.010   6.4551   14.447   5.8356 3.563137 8.701878 
1 1 1   20    3  -52 f   27.723   3.7097   33.103   8.1730   38.616   12.561   29.056   10.763   29.134   5.4905   25.229   5.3967 3.905121 7.698767 
1 1 1   20    3  -51 o   17.179   5.1175   13.215   7.7007   10.475   11.912   15.183   10.093   16.720   6.3453   18.390   5.9242 -1.670204 8.680914 
1 1 1   20    3  -50 o   13.904   5.2384   6.8096   8.0845   19.802   11.747  -4.8819   11.143   20.686   6.3547   11.729   5.3326 8.957432 8.295753 
1 1 1   20    3  -49 o   33.731   2.9703   47.832   8.0838   42.932   12.085   51.800   10.875   31.132   4.9259   34.739   3.9080 -3.606993 6.287847 
1 1 1   20    3  -48 o   10.081   4.4912  -2.1634   7.4614  -4.9921   11.489  -0.0999   9.8125   11.932   5.4210   12.235   5.3092 -0.3033342 7.587766 
1 1 1   20    3  -47 o   20.612   5.3011   19.251   8.9567   1.7739   14.014   31.319   11.646   14.888   6.4018   26.248   5.6129 -11.36012 8.513973 
1 1 1   20    3  -46 f   17.229   5.7966   12.697   9.6249   17.100   17.768   10.868   11.450   20.535   7.7594   16.865   6.2583 3.669926 9.968721 
1 1 1   20    3  -45 o   64.285   2.4445  171.125   12.786  125.354   22.126  194.073   15.667   53.565   5.1299   68.289   2.8205 -14.72408 5.854160 
1 1 1   20    3  -44 o   45.509   2.7525   86.219   10.163   69.351   15.278   99.608   13.612   39.944   4.7875   48.642   3.4554 -8.697624 5.904286 
1 1 1   20    3  -43 o   38.997   2.8191   63.421   8.9012   50.888   14.547   70.922   11.254   33.860   5.4557   41.048   3.3937 -7.188400 6.425157 
1 1 1   20    3  -42 o   43.591   2.4390   78.705   8.6319   67.279   12.957   87.823   11.574   39.725   4.0583   45.828   3.1168 -6.103439 5.117105 
1 1 1   20    3  -41 o   26.652   3.7933   30.386   8.0087   21.748   12.097   37.127   10.686   21.858   6.3889   29.198   4.6451 -7.340641 7.899052 
1 1 1   20    3  -40 o   18.308   5.1309   14.857   7.9627   7.9478   12.198   19.987   10.511   16.151   6.3418   21.049   5.8937 -4.898104 8.657579 
1 1 1   20    3  -39 o   48.125   2.2786   95.608   8.9135   88.063   13.583  101.314   11.813   45.718   3.6758   49.335   2.9508 -3.616959 4.713696 
1 1 1   20    3  -38 o   27.910   3.6930   33.126   8.1961   21.672   12.484   41.802   10.866   21.898   6.5140   31.160   4.4001 -9.262302 7.860872 
1 1 1   20    3  -37 o   99.919   1.6291  409.005   13.269  379.558   19.362  435.083   18.220   95.902   2.4788  102.850   2.1733 -6.948273 3.296602 
1 1 1   20    3  -36 o   83.410   1.7956  285.271   12.208  278.214   19.742  289.642   15.535   81.900   2.9620   83.865   2.2745 -1.965363 3.734573 
1 1 1   20    3  -35 o   20.161   4.5819   17.834   7.3583   13.766   10.462   21.817   10.352   18.102   6.0427   22.083   5.7090 -3.980646 8.313092 
1 1 1   20    3  -34 o   67.034   1.8383  184.371   10.035  186.036   14.922  182.996   13.559   67.067   2.7353   66.595   2.5023 0.4718475 3.707168 
1 1 1   20    3  -33 o   42.709   2.4252   75.324   8.4085   75.885   12.516   74.862   11.352   42.525   3.6458   42.340   3.3155 0.1843872 4.927923 
1 1 1   20    3  -32 o   44.745   2.2785   82.507   8.2830   80.150   11.962   84.678   11.480   43.813   3.3755   45.111   3.1417 -1.298065 4.611320 
1 1 1   20    3  -31 o   41.629   2.5616   71.637   8.6503   64.357   13.461   76.759   11.290   38.944   4.3124   42.918   3.2514 -3.973663 5.400827 
1 1 1   20    3  -30 o   25.967   4.3791   29.004   8.9400   26.395   12.383   31.844   12.920   24.273   6.2281   26.712   6.0718 -2.438919 8.698030 
1 1 1   20    3  -29 o   42.123   2.8987   73.572   9.8923   78.498   14.132   68.839   13.851   43.171   4.0637   40.333   4.2782 2.838085 5.900543 
1 1 1   20    3  -28 o   44.989   2.7650   83.733   10.091   78.709   14.269   88.760   14.273   43.230   4.0981   46.016   3.8402 -2.785789 5.616148 
1 1 1   20    3  -27 o   40.153   3.1956   67.084   10.373   69.153   13.802   64.399   15.725   40.462   4.2480   38.732   5.1048 1.729599 6.641100 
1 1 1   20    3  -26 o   69.613   2.2950  199.187   13.005  221.556   16.602  163.666   20.921   73.278   2.7845   62.495   4.1300 10.78333 4.981003 
1 1 1   20    3  -25 o   84.844   1.7558  294.636   12.143  311.108   18.701  282.627   15.968   86.912   2.6427   82.921   2.3647 3.990707 3.546206 
1 1 1   20    3  -24 o   15.939   5.2936   10.310   8.0308   4.8065   12.263   14.443   10.627   15.355   6.2459   18.604   6.0852 -3.248625 8.720168 
1 1 1   20    3  -23 o   42.534   2.5946   74.655   8.9531   78.014   13.631   72.106   11.873   43.152   3.9179   41.579   3.5366 1.573017 5.278021 
1 1 1   20    3  -22 o   39.344   2.7801   64.019   8.8584   88.153   13.817   47.176   11.543   45.960   3.7199   33.362   4.3478 12.59856 5.721966 
1 1 1   20    3  -21 o   9.7393   4.5114  -6.8217   8.4986  -0.0420   14.661 -10.2524   10.429   15.159   6.5334   10.370   4.8673 4.788395 8.147130 
1 1 1   20    3  -20 o   60.979   2.0471  152.499   10.161  149.106   15.578  155.012   13.405   60.029   3.1951   61.343   2.6874 -1.314011 4.175002 
1 1 1   20    3  -19 o   74.556   1.8615  227.496   11.313  244.470   17.567  215.469   14.787   77.035   2.8022   72.393   2.5097 4.642593 3.761750 
1 1 1   20    3  -18 o   63.483   2.0182  165.208   10.431  171.495   15.991  160.554   13.761   64.443   3.0529   62.436   2.7102 2.007214 4.082302 
1 1 1   20    3  -17 o   38.735   3.4900   62.495   10.901   69.396   16.275   56.878   14.682   40.384   5.0543   36.500   5.0714 3.883801 7.159948 
1 1 1   20    3  -16 o   47.451   2.9823   93.054   11.477  125.517   17.382   67.959   15.282   54.885   3.9107   40.056   4.7743 14.82922 6.171490 
1 1 1   20    3  -15 o   39.720   3.1813   65.434   10.214   72.569   14.019   57.361   14.912   41.589   4.1925   36.654   5.1315 4.935192 6.626384 
1 1 1   20    3  -14 o   20.487   5.5747   18.279   9.5559   7.3146   13.226   30.253   13.821   16.683   6.5875   26.141   6.5109 -9.458176 9.262093 
1 1 1   20    3  -13 o   48.223   2.5450   95.709   9.9688   89.018   14.797  101.270   13.490   46.178   3.9695   49.431   3.3680 -3.253769 5.205742 
1 1 1   20    3  -12 o   51.318   2.4284  108.252   10.130  105.500   14.954  110.586   13.770   50.387   3.6661   51.689   3.2850 -1.302429 4.922546 
1 1 1   20    3  -11 o   43.934   2.7240   79.589   9.7074   82.013   14.435   77.587   13.116   44.300   4.0418   43.149   3.7668 1.150627 5.524982 
1 1 1   20    3  -10 o   59.586   2.2284  145.667   10.805  142.574   16.030  148.243   14.626   58.703   3.3640   59.952   3.0025 -1.249138 4.509061 
1 1 1   20    3   -9 o   54.163   3.2307  121.286   14.199   0.0000   0.0000  121.286   14.199  ?   ?    54.163   3.2307 0.000000 3.230667 
1 1 1   20    3   -8 o   88.548   2.5586  321.991   18.448   0.0000   0.0000  321.991   18.448  ?   ?    88.548   2.5586 0.000000 2.558584 
1 1 1   20    3   -7 o   57.699   2.3398  136.669   10.982  104.130   19.819  151.087   13.192   49.696   4.9586   60.605   2.6770 -10.90901 5.635103 
1 1 1   20    3   -6 o   26.414   5.0248   30.065   10.424   41.830   17.785   23.909   12.865   30.657   7.2341   23.362   6.5127 7.295240 9.733867 
1 1 1   20    3   -5 f   39.364   3.1445   64.178   10.006   65.422   14.910   63.158   13.497   39.355   4.7432   38.768   4.3457 0.5864334 6.432935 
1 1 1   20    3   -4 o   25.561   4.7300   28.041   9.4926   19.186   14.001   35.574   12.914   21.425   6.9834   28.604   5.7385 -7.178881 9.038692 
1 1 1   20    3   -3 o   41.639   2.9930   71.657   10.091   82.287   15.005   62.881   13.635   44.354   4.2003   38.670   4.4040 5.684540 6.085835 
1 1 1   20    3   -2 o   21.205   4.9885   19.509   8.4775   15.979   13.654   21.724   10.814   20.058   6.9016   22.303   5.8697 -2.244505 9.060088 
1 1 1   20    3   -1 o   17.177   5.4128   12.277   8.4633   23.241   13.795   5.6605   10.717   23.120   6.8400   15.015   5.9295 8.104910 9.052366 
1 1 1   20    3    0 o   96.917   1.7350  383.979   13.707  395.316   21.485  376.198   17.800   98.095   2.6894   95.826   2.2788 2.269409 3.525014 
1 1 1   20    3    1 o  110.869   1.6821  502.399   15.202  513.659   24.116  494.976   19.582  111.872   2.6445  109.940   2.1850 1.932312 3.430449 
1 1 1   20    3    2 o  142.566   1.7903  831.052   20.806  839.294   30.518  823.894   28.439  143.011   2.6179  141.749   2.4613 1.262070 3.593215 
1 1 1   20    3    3 o  104.821   1.9370  449.502   16.551  422.890   26.518  466.482   21.183  101.288   3.2158  106.666   2.4362 -5.377769 4.034469 
1 1 1   20    3    4 o   16.506   5.8294   10.210   9.7764   5.0216   25.110   11.137   10.614   20.637   8.7104   17.198   6.0739 3.438984 10.61902 
1 1 1   20    3    5 f   11.658   5.1409  -2.4262   9.5329   27.359   24.244  -7.8735   10.368   25.951   9.1785   10.857   5.0127 15.09460 10.45807 
1 1 1   20    3    6 o  112.714   2.1424  520.214   19.684  541.662   41.846  514.119   22.306  114.024   4.5110  111.973   2.4438 2.050720 5.130483 
1 1 1   20    3    7 o   53.054   2.7138  115.880   11.697  132.433   28.180  112.434   12.857   55.558   6.3354   52.191   3.0353 3.366970 7.025008 
1 1 1   20    3    8 o   79.790   2.0921  260.833   13.595  233.138   21.536  279.183   17.530   75.070   3.5292   82.433   2.6121 -7.363121 4.390709 
1 1 1   20    3    9 o   54.870   2.4015  123.679   10.715  112.590   16.225  132.257   14.270   52.021   3.8537   56.598   3.1049 -4.576710 4.948871 
1 1 1   20    3   10 o   38.682   3.6593   62.371   11.401   72.131   15.059   49.262   17.452   41.391   4.5374   33.477   6.6298 7.913574 8.033828 
1 1 1   20    3   11 o   57.627   2.6401  136.634   12.369  136.075   16.225  137.409   19.113   57.309   3.4896   57.410   4.1113 -0.1014709 5.392649 
1 1 1   20    3   12 o   87.464   2.1496  313.340   15.326  302.395   19.924  329.203   23.985   85.714   2.8555   89.292   3.3010 -3.577644 4.364698 
1 1 1   20    3   13 o   46.769   2.6904   90.143   10.213  103.784   15.627   79.972   13.494   49.913   3.8712   43.791   3.8185 6.121826 5.437537 
1 1 1   20    3   14 o   51.329   2.5168  108.389   10.498  107.343   16.001  109.180   13.911   50.752   3.8975   51.335   3.3426 -0.5830307 5.134565 
1 1 1   20    3   15 o   72.265   2.0417  214.008   12.015  216.350   18.153  212.183   16.028   72.408   3.0826   71.798   2.7436 0.6099701 4.126695 
1 1 1   20    3   16 o   26.679   4.3943   30.374   9.2242   15.790   14.723   39.798   11.835   20.176   7.1510   30.473   4.9331 -10.29677 8.687441 
1 1 1   20    3   17 o   62.307   2.2108  159.324   11.211  152.926   17.272  163.982   14.737   60.726   3.5041   63.064   2.8742 -2.338474 4.532105 
1 1 1   20    3   18 o   53.387   2.4589  117.236   10.672  123.692   16.590  112.679   13.939   54.514   3.7564   52.147   3.2960 2.367870 4.997393 
1 1 1   20    3   19 o  102.354   1.8200  428.686   15.185  423.159   22.528  433.287   20.556  101.406   2.7278  102.735   2.4547 -1.329079 3.669640 
1 1 1   20    3   20 o   44.483   2.7848   81.724   10.047   71.449   15.479   89.204   13.207   41.070   4.7088   46.304   3.5255 -5.234703 5.882380 
1 1 1   20    3   21 o   72.330   2.0408  214.504   12.021  218.519   18.149  211.366   16.044   72.733   3.0681   71.624   2.7532 1.109238 4.122293 
1 1 1   20    3   22 o   57.067   2.3669  133.906   10.987  134.487   16.651  133.458   14.621   56.863   3.6110   56.774   3.1719 0.8865356E-01 4.806277 
1 1 1   20    3   23 o   58.799   2.2845  142.084   10.929  142.185   16.768  142.010   14.409   58.486   3.5337   58.602   3.0267 -0.1156120 4.652732 
1 1 1   20    3   24 o   30.848   3.7089   40.034   9.1395   37.180   14.532   41.902   11.755   28.925   6.3387   31.269   4.7622 -2.343498 7.928250 
1 1 1   20    3   25 o   34.071   3.4364   48.542   9.4136   50.824   14.759   46.977   12.222   34.241   5.4720   33.168   4.6479 1.073002 7.179562 
1 1 1   20    3   26 o   36.791   3.2241   56.385   9.5714   54.998   15.066   57.324   12.394   35.678   5.3447   36.826   4.2039 -1.148193 6.799894 
1 1 1   20    3   27 o   78.787   2.1475  254.872   13.779  246.834   19.028  263.733   19.980   77.254   3.0275   79.840   3.0758 -2.585861 4.315780 
1 1 1   20    3   28 o   37.654   3.8876   59.662   11.761   53.445   19.843   63.029   14.602   34.322   7.3163   38.420   4.7646 -4.097618 8.730944 
1 1 1   20    3   29 o   14.755   5.6005   6.9881   9.2807   2.6923   13.546   10.788   12.741   15.262   6.4174   17.578   6.5859 -2.315084 9.195436 
1 1 1   20    3   30 o   34.521   3.9833   50.375   11.003   49.195   17.139   51.202   14.352   33.155   6.5740   34.356   5.2947 -1.200768 8.441009 
1 1 1   20    3   31 o   12.487   5.2343   1.6359   8.9695   7.6928   15.890  -1.1964   10.866   17.646   7.1347   12.733   5.5553 4.913045 9.042382 
1 1 1   20    3   32 o   13.432   5.4182   3.9659   9.1409   6.6712   15.390   2.4912   11.362   17.142   6.9879   14.090   5.8978 3.051849 9.144103 
1 1 1   20    3   33 o   22.106   5.9008   21.835   10.831   24.324   13.761   17.781   17.561   23.232   6.8206   21.209   7.7711 2.023029 10.33976 
1 1 1   20    3   34 o   19.106   5.9615   15.875   10.292   21.834   13.433   7.4051   16.014   22.111   6.7960   17.540   7.1364 4.571533 9.854689 
1 1 1   20    3   35 o   24.636   4.6490   26.457   8.9940   38.456   13.989   18.002   11.743   29.292   6.0588   20.251   6.3750 9.041410 8.794876 
1 1 1   20    3   36 o   18.232   5.4356   14.557   8.6852   21.146   13.603   10.023   11.285   21.774   6.8624   16.681   6.2085 5.093302 9.254072 
1 1 1   20    3   37 o   48.775   2.5383   98.425   10.057  101.297   15.536   96.352   13.195   48.986   3.9234   47.977   3.3960 1.009178 5.189043 
1 1 1   20    3   38 o   11.067   4.8962  -2.0672   8.7134 -13.8740   13.357   6.6789   11.496   11.421   5.4055   15.461   6.1300 -4.039428 8.172868 
1 1 1   20    3   39 o   37.818   3.1375   59.849   9.5851   52.383   14.949   65.062   12.491   34.445   5.5098   39.145   3.9692 -4.700718 6.790611 
1 1 1   20    3   40 o   33.606   3.6988   47.874   9.9651   58.165   17.630   43.043   12.080   35.927   6.2467   31.405   4.8769 4.522669 7.925011 
1 1 1   20    3   41 o   62.248   2.4030  160.127   12.170  165.812   20.427  156.999   15.153   62.579   4.0259   61.384   3.0379 1.194759 5.043436 
1 1 1   20    3   42 o   30.381   4.4566   39.987   10.709   39.584   14.918   40.416   15.383   29.376   6.4103   29.627   6.5444 -0.2510967 9.160804 
1 1 1   20    3   43 o   33.714   3.9124   48.515   10.553   60.498   14.808   36.151   15.042   37.199   5.0110   27.885   6.7011 9.313152 8.367476 
1 1 1   20    3   44 o   70.022   2.3056  202.561   13.142  194.524   17.592  212.710   19.770   68.209   3.1726   71.191   3.4167 -2.981514 4.662563 
1 1 1   20    3   45 o   41.968   3.6571   74.631   12.386   79.656   20.097   71.553   15.729   42.067   6.0331   40.509   4.8602 1.558372 7.747260 
1 1 1   20    3   46 f   18.360   6.8891   13.067   13.951   2.8495   17.872   29.006   22.322   16.730   7.2122   24.743   8.8016 -8.012745 11.37912 
1 1 1   20    3   47 o   16.375   6.2243   9.6620   11.473   14.304   17.237   5.9698   15.374   19.519   7.5749   16.554   6.8895 2.964624 10.23930 
1 1 1   20    3   48 o   44.971   3.5485   85.668   12.903   97.059   18.679   75.271   17.845   47.083   4.9403   41.099   5.4617 5.984127 7.364530 
1 1 1   20    3   49 o   25.944   4.4639   29.610   9.0999   32.031   13.951   27.817   12.005   26.058   6.5705   24.477   6.0517 1.580536 8.932724 
1 1 1   20    3   50 o   22.458   5.0395   22.781   8.9983   48.819   13.867   3.8430   11.826   32.985   5.3397   14.432   6.0271 18.55371 8.052280 
1 1 1   20    3   51 o   12.966   5.2600   4.0016   8.6704  -9.3592   13.202   14.136   11.498   11.949   5.5649   18.100   6.3274 -6.150293 8.426351 
1 1 1   20    3   52 f   21.759   5.2431   21.616   9.1891   22.337   14.274   21.106   12.008   21.751   7.0484   21.227   6.4060 0.5241699 9.524521 
1 1 1   20    3   53 o   27.118   4.3913   32.377   9.3754   41.986   14.387   25.285   12.361   30.048   6.0827   23.114   6.3608 6.933390 8.801105 
1 1 1   20    3   54 f   31.072   3.9080   41.752   9.6797   45.095   14.932   39.330   12.713   31.122   6.1039   29.347   5.5166 1.775000 8.227441 
1 1 1   20    3   55 o   53.694   2.5065  120.092   10.940  115.616   16.388  123.691   14.695   51.895   3.9025   54.041   3.3523 -2.145508 5.144670 
1 1 1   20    3   56 o   25.202   4.7383   28.505   9.3767   25.093   14.484   30.968   12.303   22.724   7.0693   25.661   5.9911 -2.936672 9.266474 
1 1 1   20    3   57 o   21.933   5.2541   22.186   9.2699   24.312   14.530   20.727   12.038   22.340   7.0989   20.883   6.4362 1.457279 9.582243 
1 1 1   20    3   58 f   46.268   3.1780   90.717   11.913   74.727   15.883  111.286   18.013   40.948   4.8525   50.394   4.4302 -9.445606 6.570630 
1 1 1   20    3   59 o   13.001   5.3794   3.6135   9.2965  -1.1585   14.503   6.9415   12.112   14.089   6.2701   15.314   6.2153 -1.224889 8.828595 
1 1 1   20    3   60 o   19.721   5.5110   18.254   9.2002   8.1961   13.728   26.455   12.396   16.196   6.6008   23.328   6.3499 -7.131903 9.159245 
1 1 1   20    3   61 o   10.470   4.7712  -3.9587   8.9842   3.6580   13.946  -9.3619   11.746   14.929   6.4024   10.965   5.1525 3.963612 8.218182 
1 1 1   20    3   62 o   28.277   4.8880   36.505   10.859   61.882   17.430   20.405   13.883   35.963   6.1677   20.405   6.9610 15.55719 9.300325 
1 1 1   20    3   63 o   15.089   5.9314   8.2267   10.680   1.0756   17.254   12.669   13.599   15.393   6.8453   17.412   6.7360 -2.019735 9.603762 
1 1 1   20    3   64 o   15.367   6.0482   8.7526   11.118   15.560   17.333   3.9945   14.491   18.880   7.5135   15.038   6.4886 3.842208 9.927439 
1 1 1   20    3   65 o   53.860   2.9724  123.488   12.999  109.531   19.596  134.457   17.372   48.884   4.9875   55.404   3.8709 -6.519211 6.313430 
1 1 1   20    3   66 o   9.9539   4.7283  -9.9105   10.404 -36.8824   16.135   9.2847   13.611   9.7438   4.8726   16.088   6.5666 -6.343957 8.176937 
1 1 1   20    3   67 o   19.775   6.1456   19.626   10.949   11.731   16.921   25.313   14.362   17.420   7.2370   21.829   7.0696 -4.409075 10.11699 
1 1 1   20    3   68 f   11.154   5.0933  -3.5316   10.308   9.7740   16.074 -12.8246   13.434   16.643   6.9938   11.038   5.2793 5.604650 8.762657 
1 1 1   20    3   69 o   26.137   5.3617   33.052   11.040   39.505   16.854   28.202   14.611   26.656   7.4625   22.750   7.1039 3.906233 10.30312 
1 1 1   20    3   70 o   25.546   5.4595   31.959   11.024   13.936   16.091   47.901   15.134   17.594   7.1553   30.663   6.2666 -13.06961 9.511464 
1 1 1   20    3   71 o   42.214   3.5130   78.510   11.979   55.847   17.730   97.544   16.248   32.263   6.9472   46.167   4.3695 -13.90474 8.207084 
1 1 1   20    3   72 o   33.506   4.2387   51.523   11.318   52.494   16.865   50.728   15.267   31.233   6.8163   31.389   6.1869 -0.1561756 9.205402 
1 1 1   20    3   73 o   12.581   5.4599   2.6349   10.381   1.0134   15.562   3.9348   13.933   14.039   6.3507   14.175   6.2343 -0.1357718 8.899339 
1 1 1   20    3   74 o   12.843   5.5293   3.5494   10.479   4.5845   15.651   2.7083   14.108   14.736   6.5384   13.877   6.1795 0.8588877 8.996506 
1 1 1   20    3   75 o   11.065   5.1895  -6.3289   11.816   0.5948   23.396  -8.7000   13.691   15.747   7.3582   11.497   5.4505 4.250241 9.156991 
1 1 1   20    3   76 o   15.030   6.8789   2.5186   18.940   0.0000   0.0000   2.5186   18.940  ?   ?    15.030   6.8789 0.000000 6.878856 
1 1 1   20    3   77 o   9.2945   4.6315 -27.6963   14.028 -51.7010   25.033 -16.7085   16.937   11.496   5.7920   11.647   5.6577 -0.1508951 8.096681 
1 1 1   20    3   78 o   15.101   6.5638   7.6461   15.051   5.7865   25.666   8.6208   18.581   16.619   7.7463   15.983   7.1060 0.6363354 10.51190 
1 1 1   20    3   79 o   11.296   5.4418 -12.6514   14.869  -7.9168   26.302 -14.8750   18.025   15.052   7.2477   12.173   5.8952 2.879086 9.342500 
1 1 1   20    3   80 o   13.376   6.6139 -26.8874   26.543 -26.8874   26.543   0.0000   0.0000   13.376   6.6139  ?   ?  0.000000 6.613896 
1 1 1   20    3   81 o   13.099   6.4633 -24.6865   24.869 -24.6865   24.869   0.0000   0.0000   13.099   6.4633  ?   ?  0.000000 6.463275 
1 1 1   20    3   82 f   13.212   6.1709  -2.7998   16.426  -2.7998   16.426   0.0000   0.0000   13.212   6.1709  ?   ?  0.000000 6.170912 
1 1 1   20    3   83 o   13.092   6.1333  -3.3206   16.431  -3.3206   16.431   0.0000   0.0000   13.092   6.1333  ?   ?  0.000000 6.133320 
1 1 1   20    3   84 o   13.058   6.1268  -3.4356   16.500  -3.4356   16.500   0.0000   0.0000   13.058   6.1268  ?   ?  0.000000 6.126766 
1 1 1   20    3   85 o   18.643   7.4295   22.088   16.971   22.088   16.971   0.0000   0.0000   18.643   7.4295  ?   ?  0.000000 7.429470 
1 1 1   20    3   86 o   14.724   6.6220   6.2137   16.641   6.2137   16.641   0.0000   0.0000   14.724   6.6220  ?   ?  0.000000 6.622039 
1 1 1   20    3   87 o   20.333   8.7939   34.722   26.743   34.722   26.743   0.0000   0.0000   20.333   8.7939  ?   ?  0.000000 8.793942 
1 1 1   20    3   88 o   18.705   8.3330   25.634   25.684   25.634   25.684   0.0000   0.0000   18.705   8.3330  ?   ?  0.000000 8.333022 
1 1 1   20    3   89 o   13.377   6.5369 -14.0618   23.568 -14.0618   23.568   0.0000   0.0000   13.377   6.5369  ?   ?  0.000000 6.536915 
1 1 1   20    3   90 o   21.896   8.9157   42.227   25.018   42.227   25.018   0.0000   0.0000   21.896   8.9157  ?   ?  0.000000 8.915739 
1 1 1   20    3   91 o   14.380   6.9360  -5.2445   24.331  -5.2445   24.331   0.0000   0.0000   14.380   6.9360  ?   ?  0.000000 6.936033 
1 1 1   20    4  -87 o   13.864   6.7737 -11.8557   25.276 -11.8557   25.276   0.0000   0.0000   13.864   6.7737  ?   ?  0.000000 6.773728 
1 1 1   20    4  -86 o   13.568   6.6004 -10.7649   23.278 -10.7649   23.278   0.0000   0.0000   13.568   6.6004  ?   ?  0.000000 6.600433 
1 1 1   20    4  -85 o   17.119   7.8685   16.477   25.142   16.477   25.142   0.0000   0.0000   17.119   7.8685  ?   ?  0.000000 7.868543 
1 1 1   20    4  -84 o   15.194   7.2609   0.5994   25.301   0.5994   25.301   0.0000   0.0000   15.194   7.2609  ?   ?  0.000000 7.260888 
1 1 1   20    4  -82 f   17.030   7.8241   14.352   24.819   14.352   24.819   0.0000   0.0000   17.030   7.8241  ?   ?  0.000000 7.824066 
1 1 1   20    4  -81 o   16.778   7.7283   12.407   24.438   12.407   24.438   0.0000   0.0000   16.778   7.7283  ?   ?  0.000000 7.728266 
1 1 1   20    4  -80 o   20.224   8.7199   32.588   26.137   32.588   26.137   0.0000   0.0000   20.224   8.7199  ?   ?  0.000000 8.719922 
1 1 1   20    4  -79 f   19.204   8.3286   25.909   24.121   25.909   24.121   0.0000   0.0000   19.204   8.3286  ?   ?  0.000000 8.328552 
1 1 1   20    4  -78 o   14.967   7.1208  -2.2249   23.779  -2.2249   23.779   0.0000   0.0000   14.967   7.1208  ?   ?  0.000000 7.120775 
1 1 1   20    4  -77 o   10.436   5.2791 -52.3088   22.056 -52.3088   22.056   0.0000   0.0000   10.436   5.2791  ?   ?  0.000000 5.279144 
1 1 1   20    4  -76 f   14.850   7.0592  -3.1488   23.272  -3.1488   23.272   0.0000   0.0000   14.850   7.0592  ?   ?  0.000000 7.059190 
1 1 1   20    4  -75 o   14.172   6.8094  -8.9565   22.932  -8.9565   22.932   0.0000   0.0000   14.172   6.8094  ?   ?  0.000000 6.809363 
1 1 1   20    4  -74 o   19.391   8.3333   24.315   23.720   24.315   23.720   0.0000   0.0000   19.391   8.3333  ?   ?  0.000000 8.333343 
1 1 1   20    4  -73 o   17.575   7.0274   16.703   15.234   35.053   21.983  -0.2512   21.131   22.182   8.5690   14.984   6.9987 7.198103 11.06386 
1 1 1   20    4  -72 o   19.877   7.3189   23.688   15.607   32.859   22.478   15.150   21.687   21.608   8.5701   17.687   7.7784 3.921526 11.57371 
1 1 1   20    4  -71 o   18.843   7.5070   20.586   17.321   20.586   17.321   0.0000   0.0000   18.843   7.5070  ?   ?  0.000000 7.507024 
1 1 1   20    4  -70 o   10.947   5.2728 -13.1067   13.945  -5.7793   16.145 -34.6411   27.677   12.903   6.0559   13.333   6.6210 -0.4305582 8.972804 
1 1 1   20    4  -69 o   13.692   6.1521   1.5962   14.325   0.6766   16.749   4.1019   27.647   14.245   6.5002   16.989   7.9580 -2.744048 10.27527 
1 1 1   20    4  -68 o   34.585   5.7617   60.150   15.672   63.558   18.239   50.534   30.636   34.395   6.7465   24.916   9.9645 9.479084 12.03353 
1 1 1   20    4  -67 o   13.034   5.4165   4.9937   9.4831   8.1651   11.746  -0.9421   16.070   14.803   6.0779   13.903   6.3528 0.9008732 8.791992 
1 1 1   20    4  -66 o   29.209   4.4977   39.623   10.366   32.865   12.712   53.031   17.907   25.145   6.2333   31.088   7.2068 -5.943676 9.528491 
1 1 1   20    4  -65 o   10.697   4.8883  -3.3298   9.5170  -8.8789   11.842   6.7902   15.992   10.809   5.1078   15.696   6.7945 -4.887426 8.500261 
1 1 1   20    4  -64 o   21.568   5.4000   22.818   9.4713   25.794   12.982   19.432   13.849   22.060   6.6613   19.320   6.9260 2.739635 9.609517 
1 1 1   20    4  -63 o   12.210   5.2337   2.2449   9.3101   0.7212   12.499   4.1441   13.954   13.201   5.8509   14.591   6.3312 -1.389502 8.620701 
1 1 1   20    4  -62 o   30.003   3.6552   39.710   8.7550   42.898   13.721   37.520   11.370   29.530   5.9068   28.162   5.1424 1.367476 7.831646 
1 1 1   20    4  -61 o   10.615   4.7061  -0.9232   8.0933   1.4514   12.571  -2.6042   10.577   13.513   5.9332   11.573   5.2353 1.940174 7.912726 
1 1 1   20    4  -60 o   15.855   5.3721   11.492   8.2669   10.013   12.785   12.555   10.837   16.146   6.4438   16.696   6.1069 -0.5501289 8.877878 
1 1 1   20    4  -59 o   41.261   2.7853   72.164   9.3131   72.405   14.362   71.988   12.234   40.163   4.4620   40.597   3.7389 -0.4340897 5.821379 
1 1 1   20    4  -58 o   30.643   3.6230   40.948   8.8747   48.340   13.785   35.716   11.598   32.098   5.4642   27.574   5.3529 4.523952 7.649255 
1 1 1   20    4  -57 o   13.000   5.2275   4.9327   8.4798   2.3598   13.122   6.7776   11.111   14.174   6.1450   14.724   5.9614 -0.5501518 8.561494 
1 1 1   20    4  -56 o   22.156   4.8744   22.640   8.5638   32.719   13.440   15.751   11.112   25.787   6.4191   18.350   6.2280 7.437302 8.943881 
1 1 1   20    4  -55 o   10.253   4.5902  -2.1338   7.8945   6.4336   11.699  -9.2956   10.697   14.904   6.0863   10.368   4.8860 4.535562 7.804819 
1 1 1   20    4  -54 o   30.047   3.3946   38.818   8.1689   32.015   12.137   44.451   11.045   25.970   5.8719   31.650   4.3998 -5.680584 7.337359 
1 1 1   20    4  -53 o   21.414   4.6948   20.844   7.9685   13.810   12.175   26.116   10.540   17.818   6.4796   23.605   5.5682 -5.787348 8.543445 
1 1 1   20    4  -52 o   29.438   3.7633   37.593   8.8244   28.332   12.477   46.860   12.482   24.283   6.2628   32.292   4.8950 -8.009243 7.948827 
1 1 1   20    4  -51 o   45.963   2.4182   88.065   9.0284   75.220   13.610   98.161   12.066   41.629   4.0623   48.201   3.0870 -6.572533 5.102193 
1 1 1   20    4  -50 o   15.801   5.4091   10.712   8.3845   17.123   14.698   7.6200   10.208   19.588   7.1200   14.948   5.8214 4.639701 9.196893 
1 1 1   20    4  -49 o   18.251   5.3910   15.228   8.5749   13.353   14.807   16.173   10.518   18.341   7.0464   18.791   6.0471 -0.4499626 9.285393 
1 1 1   20    4  -48 o   36.335   3.1405   55.864   9.2106   47.538   15.636   60.288   11.398   31.846   6.2466   37.454   3.7852 -5.607698 7.303987 
1 1 1   20    4  -47 o   22.492   4.4984   22.565   7.9592   28.345   12.220   18.306   10.489   24.533   6.1287   19.875   5.9848 4.658360 8.566190 
1 1 1   20    4  -46 o   17.787   5.1457   14.317   7.8835   16.380   12.118   12.804   10.381   19.092   6.5036   17.264   6.0136 1.828100 8.857791 
1 1 1   20    4  -45 o   16.503   5.1614   12.071   7.7099   14.737   11.871   10.127   10.139   18.381   6.4291   16.042   5.9005 2.339617 8.726318 
1 1 1   20    4  -44 o   14.003   5.1525   7.3430   7.7329   20.010   11.872  -1.9904   10.191   20.739   6.3917   11.872   5.2713 8.867567 8.284979 
1 1 1   20    4  -43 o   38.423   2.6837   61.695   8.3526   49.562   12.556   71.326   11.187   33.551   4.7214   41.043   3.3735 -7.491600 5.802762 
1 1 1   20    4  -42 o   15.841   5.1806   10.817   7.7021   19.965   11.830   4.0869   10.147   20.774   6.3765   13.744   5.6467 7.029454 8.517307 
1 1 1   20    4  -41 o   47.832   2.4622   95.029   9.5679   96.593   13.482   93.443   13.581   47.782   3.4854   46.947   3.5757 0.8341103 4.993318 
1 1 1   20    4  -40 o   48.201   2.4862   96.498   9.7357   79.366   13.373  115.816   14.201   43.135   3.8435   52.435   3.3398 -9.299423 5.091873 
1 1 1   20    4  -39 o   35.475   3.1847   53.032   9.1116   36.577   12.591   71.125   13.203   28.403   5.6371   40.750   4.0272 -12.34687 6.927853 
1 1 1   20    4  -38 o   30.735   3.5798   40.230   8.8009   26.910   14.588   47.852   11.035   23.881   7.0257   33.321   4.1528 -9.439856 8.161212 
1 1 1   20    4  -37 o   30.005   3.6399   38.390   8.7209   20.207   14.294   49.172   11.007   21.144   7.0633   33.834   4.0728 -12.68961 8.153370 
1 1 1   20    4  -36 o   65.573   2.1410  177.368   11.429  118.747   19.891  206.259   13.964   52.419   4.7051   70.597   2.4302 -18.17813 5.295605 
1 1 1   20    4  -35 o   23.379   4.3562   23.920   7.9965   24.841   12.448   23.272   10.434   23.201   6.3826   22.636   5.6682 0.5649433 8.536139 
1 1 1   20    4  -34 f   75.126   2.0792  232.486   12.721  241.818   18.844  224.673   17.243   76.166   3.0412   73.495   2.8837 2.671204 4.191019 
1 1 1   20    4  -33 o   43.745   3.1516   80.109   11.163  127.440   19.768   57.952   13.526   54.543   4.4858   36.589   4.6391 17.95443 6.453187 
1 1 1   20    4  -32 o   44.935   2.8702   84.104   10.458   66.598   15.563   98.519   14.122   39.104   4.9963   48.356   3.6087 -9.252472 6.163274 
1 1 1   20    4  -31 o   43.342   2.9988   78.395   10.529   79.672   15.779   77.370   14.138   43.050   4.5661   42.621   4.1206 0.4285088 6.150464 
1 1 1   20    4  -30 o   41.299   2.9957   71.181   10.016   67.421   15.368   73.959   13.207   39.438   4.8847   41.759   3.9260 -2.320702 6.266870 
1 1 1   20    4  -29 o   59.622   1.9732  146.201   9.5768  140.897   14.351  150.459   12.858   58.172   3.0370   60.279   2.6232 -2.106663 4.013083 
1 1 1   20    4  -28 o   28.249   3.5688   33.840   8.0347   49.108   12.432   22.890   10.529   33.712   4.6476   22.545   5.7208 11.16654 7.370730 
1 1 1   20    4  -27 o   38.919   2.6467   62.866   8.3468   56.477   12.540   67.947   11.184   36.336   4.3182   40.225   3.4440 -3.889282 5.523369 
1 1 1   20    4  -26 f   26.839   4.1367   30.954   8.7598   36.108   12.296   25.642   12.482   28.538   5.4850   23.754   6.3317 4.783878 8.377100 
1 1 1   20    4  -25 o   58.597   2.1621  141.363   10.310  152.069   14.376  130.028   14.792   60.531   2.9223   55.835   3.2643 4.695179 4.381265 
1 1 1   20    4  -24 o   47.197   2.6395   92.232   10.114   91.177   14.447   93.247   14.165   46.522   3.8438   47.098   3.7198 -0.5765533 5.348975 
1 1 1   20    4  -23 o   89.530   2.6757  331.204   19.505  331.204   19.505   0.0000   0.0000   89.530   2.6757  ?   ?  0.000000 2.675715 
1 1 1   20    4  -22 o   53.953   2.4256  120.107   10.640  128.110   15.089  112.191   15.007   55.421   3.3558   51.769   3.5783 3.651970 4.905623 
1 1 1   20    4  -21 o   34.480   3.1140   49.647   8.6580   56.512   13.784   45.174   11.127   36.251   4.7812   32.520   4.3029 3.730782 6.432287 
1 1 1   20    4  -20 o   63.069   1.9298  163.294   9.9094  164.584   14.893  162.269   13.274   63.032   2.9064   62.686   2.6034 0.3457184 3.901952 
1 1 1   20    4  -19 o   20.823   4.7244   19.009   7.8347   33.013   11.878   8.2235   10.424   27.341   5.5198   15.705   5.9413 11.63632 8.109673 
1 1 1   20    4  -18 o   48.755   2.4428   98.068   9.6772  100.750   16.234   96.589   12.053   48.888   4.1118   48.213   3.0829 0.6745644 5.139210 
1 1 1   20    4  -17 o   30.961   3.3771   40.231   8.3850   40.777   14.033   39.928   10.457   30.348   5.8850   30.570   4.3163 -0.2221050 7.298214 
1 1 1   20    4  -16 o   14.786   5.3400   8.0164   8.2501   0.6420   14.896   11.280   9.9088   15.329   6.5959   16.882   5.8757 -1.552868 8.833422 
1 1 1   20    4  -15 o   10.405   4.6169  -2.3232   7.8052  -5.6395   12.692  -0.3065   9.8980   12.698   5.7407   12.422   5.3612 0.2763433 7.854787 
1 1 1   20    4  -14 o   25.375   4.1123   27.558   8.2151   44.428   13.432   17.476   10.384   31.942   5.3477   19.977   5.9403 11.96442 7.992826 
1 1 1   20    4  -13 f   56.492   2.3121  131.347   10.625  134.584   19.916  130.059   12.561   56.496   4.3583   56.099   2.7553 0.3963394 5.156195 
1 1 1   20    4  -12 o   38.962   3.0097   63.075   9.4847   92.367   18.412   52.495   11.066   46.526   4.9297   35.281   3.9135 11.24512 6.294238 
1 1 1   20    4  -11 o   17.624   5.4454   13.282   8.6107   17.820   16.159   11.482   10.176   21.049   7.4884   17.074   5.9536 3.974529 9.566700 
1 1 1   20    4  -10 f   24.123   4.4077   25.099   8.3480   32.864   13.651   20.461   10.551   27.111   6.2978   21.502   5.8606 5.608971 8.602809 
1 1 1   20    4   -9 o   48.065   2.4147   95.198   9.4302  108.645   15.209   86.800   12.020   50.998   3.6834   45.685   3.2488 5.313438 4.911422 
1 1 1   20    4   -8 o   34.068   3.1419   48.371   8.6269   47.417   13.898   48.970   11.003   33.062   5.3388   34.038   4.0447 -0.9754715 6.697915 
1 1 1   20    4   -7 f   62.940   2.0320  162.589   10.412  181.298   16.629  150.525   13.353   66.170   3.0915   60.390   2.7196 5.779686 4.117464 
1 1 1   20    4   -6 o   41.247   2.6978   70.357   9.0210   88.876   14.888   59.613   11.340   46.006   4.0101   37.693   3.7399 8.312191 5.483380 
1 1 1   20    4   -5 o   42.496   2.6594   74.632   9.1660   66.803   14.674   79.642   11.738   39.638   4.6284   43.742   3.3167 -4.103397 5.694049 
1 1 1   20    4   -4 o   26.462   4.4442   30.068   9.2467   32.748   17.531   29.035   10.884   26.838   7.6449   25.731   5.3631 1.107063 9.338492 
1 1 1   20    4   -3 o   14.463   5.5224   6.4874   9.0576   28.118   17.575  -1.3348   10.569   25.068   7.7855   12.554   5.4780 12.51395 9.519598 
1 1 1   20    4   -2 o   48.049   2.6894   95.350   10.492   86.936   20.105   98.499   12.299   44.891   5.6167   48.731   3.1125 -3.840126 6.421472 
1 1 1   20    4   -1 f   97.173   2.0534  387.154   16.265  425.838   28.154  367.776   19.926  101.329   3.4134   94.510   2.5889 6.818306 4.284137 
1 1 1   20    4    0 o   37.172   3.6529   57.897   10.926   80.485   19.443   47.471   13.209   43.153   5.6638   33.204   5.0382 9.949711 7.580348 
1 1 1   20    4    1 f   23.781   4.9845   24.679   9.3528   22.554   14.060   26.366   12.526   22.632   6.9522   24.314   6.2773 -1.681953 9.366842 
1 1 1   20    4    2 o   54.201   2.4571  120.999   10.827  139.899   16.489  106.671   14.356   57.984   3.5049   50.606   3.5018 7.378353 4.954479 
1 1 1   20    4    3 o   41.482   2.9203   71.322   9.8117   54.632   14.794   84.429   13.110   35.583   5.2585   44.963   3.6071 -9.379917 6.376765 
1 1 1   20    4    4 o   27.103   4.1974   31.352   8.9738   35.150   13.762   28.542   11.836   28.119   6.1735   25.382   5.8420 2.736696 8.499443 
1 1 1   20    4    5 o   24.618   5.3681   26.630   10.468   26.877   13.835   26.301   16.011   24.487   6.7258   24.278   7.4115 0.2090473 10.00829 
1 1 1   20    4    6 o   35.768   3.8375   53.814   11.014   67.765   14.746   36.212   16.564   39.928   4.6156   28.252   7.1789 11.67603 8.534691 
1 1 1   20    4    7 f   35.327   3.8604   52.533   10.936   53.389   14.460   51.390   16.715   35.179   5.1989   34.107   6.2420 1.072105 8.123501 
1 1 1   20    4    8 o   37.190   3.2236   57.631   9.6760   50.068   14.690   63.426   12.860   33.934   5.4988   38.766   4.1332 -4.831978 6.878926 
1 1 1   20    4    9 o   16.033   5.5677   10.061   8.8948   16.707   13.711   5.2314   11.688   20.145   6.9163   15.192   6.1273 4.953179 9.240084 
1 1 1   20    4   10 f   56.009   2.4218  129.206   11.031  128.659   16.760  129.623   14.651   55.498   3.7263   55.875   3.2306 -0.3763275 4.931739 
1 1 1   20    4   11 o   51.107   2.5518  107.753   10.597  104.299   16.176  110.349   14.025   49.838   4.0158   51.495   3.3596 -1.657452 5.235836 
1 1 1   20    4   12 o  103.851   1.8404  441.828   15.580  458.581   23.346  428.377   20.920  105.451   2.7183  102.033   2.5153 3.418045 3.703467 
1 1 1   20    4   13 f   87.383   1.9224  312.977   13.693  312.759   20.596  313.150   18.332   86.992   2.9086   87.174   2.5826 -0.1818237 3.889708 
1 1 1   20    4   14 o   42.061   2.9108   73.384   9.9183   64.318   15.118   80.236   13.142   38.741   4.8964   43.756   3.7198 -5.014412 6.149114 
1 1 1   20    4   15 o   10.504   4.7698  -4.7158   8.8797  -7.7312   15.319  -3.1900   10.897   13.691   6.2355   12.224   5.4379 1.466723 8.273541 
1 1 1   20    4   16 o   42.167   3.0179   73.874   10.305   86.395   17.823   67.587   12.629   44.938   4.9474   40.060   3.9175 4.877277 6.310577 
1 1 1   20    4   17 o   51.152   2.6415  108.120   10.977  147.855   19.081   88.466   13.420   59.359   3.9663   45.976   3.6098 13.38325 5.363004 
1 1 1   20    4   18 o   27.397   4.3719   32.253   9.4358   43.283   16.031   26.406   11.672   31.016   6.5467   24.302   5.9424 6.714024 8.841458 
1 1 1   20    4   19 o   39.078   3.1226   63.632   9.8641   79.216   17.014   55.741   12.106   42.971   4.9474   36.241   4.1742 6.729725 6.473097 
1 1 1   20    4   20 o   8.0955   3.9637 -16.5100   8.7906 -14.6107   15.521 -17.4069   10.666   12.551   5.9056   9.2569   4.4952 3.294392 7.421797 
1 1 1   20    4   21 o   27.903   4.4944   33.577   9.8754   47.019   14.574   22.167   13.428   32.668   5.6791   22.269   6.7853 10.39915 8.848299 
1 1 1   20    4   22 o   15.562   5.6896   8.8439   9.4055   10.162   14.191   7.8115   12.561   17.743   6.8764   16.356   6.4315 1.386791 9.415364 
1 1 1   20    4   23 o   25.450   4.9028   28.362   9.8021   18.763   14.471   36.501   13.325   20.929   7.1073   28.580   5.9145 -7.650988 9.246357 
1 1 1   20    4   24 o   14.960   5.4075   8.3227   8.4624   8.3410   13.595   8.3112   10.813   16.898   6.6766   15.840   6.0373 1.057938 9.001451 
1 1 1   20    4   25 o   12.280   5.2197   0.8963   9.1239   8.5242   17.028  -2.1753   10.806   18.155   7.3692   12.376   5.4647 5.779515 9.174344 
1 1 1   20    4   26 f   12.981   5.3948   2.4863   9.4076   4.9442   17.331   1.4595   11.202   17.298   7.2650   13.623   5.7868 3.674811 9.288006 
1 1 1   20    4   27 o   23.608   5.1372   24.722   9.6046   42.347   17.877   17.569   11.388   30.126   7.3467   19.957   6.2773 10.16858 9.663234 
1 1 1   20    4   28 o   74.339   2.0562  227.327   12.448  234.809   19.286  221.984   16.298   75.089   3.1578   73.201   2.7361 1.887924 4.178326 
1 1 1   20    4   29 o   27.226   5.3831   32.951   11.523   53.112   19.578   22.266   14.253   33.764   7.3246   22.194   7.0283 11.57035 10.15122 
1 1 1   20    4   30 o   49.106   2.6139   99.967   10.425  111.983   16.164   91.407   13.643   51.474   3.8809   46.589   3.6207 4.884895 5.307649 
1 1 1   20    4   31 o   55.450   2.4379  127.153   10.992  141.614   16.964  116.686   14.432   58.037   3.6036   52.764   3.3732 5.273037 4.935990 
1 1 1   20    4   32 o   32.971   3.5841   46.040   9.4779   50.824   14.770   42.690   12.358   33.837   5.5468   31.180   5.0336 2.657045 7.490324 
1 1 1   20    4   33 o   21.388   5.3386   20.564   9.2779   29.923   14.456   14.008   12.099   25.344   6.8398   18.401   6.4861 6.942955 9.426147 
1 1 1   20    4   34 f   26.471   4.7762   30.827   9.9269   18.575   14.333   42.121   13.762   20.595   7.0716   30.619   5.7241 -10.02411 9.097954 
1 1 1   20    4   35 o   22.631   5.1004   22.922   9.1830   30.911   14.546   17.628   11.841   25.699   6.8283   19.886   6.4176 5.813017 9.370708 
1 1 1   20    4   36 o   83.699   1.9615  288.175   13.383  293.092   20.041  284.219   17.979   83.885   2.9353   82.759   2.6686 1.126717 3.967037 
1 1 1   20    4   37 o   52.616   2.8815  115.474   12.311  121.871   16.605  107.665   18.347   53.598   3.8257   49.954   4.5557 3.644005 5.948970 
1 1 1   20    4   38 o   33.039   3.6010   46.437   9.5414   46.731   15.142   46.243   12.288   32.019   6.0225   32.468   4.7863 -0.4492378 7.692816 
1 1 1   20    4   39 o   49.257   2.8667  101.320   11.461  108.793   20.938   98.124   13.694   49.699   5.2475   48.184   3.5107 1.514790 6.313553 
1 1 1   20    4   40 o   17.584   5.8893   13.411   9.9362   23.797   18.374   9.1189   11.812   22.692   7.9935   16.258   6.2812 6.433868 10.16606 
1 1 1   20    4   41 o   12.178   5.5962  -6.9776   12.709   19.770   25.629 -15.6995   14.635   22.495   9.0732   11.695   5.5705 10.79982 10.64672 
1 1 1   20    4   42 o   45.028   3.5124   85.949   12.790  107.508   19.670   70.157   16.835   49.501   4.9408   39.667   5.3421 9.833488 7.276611 
1 1 1   20    4   43 o   25.139   5.2966   28.681   10.511   17.340   14.511   41.201   15.245   19.867   7.0932   29.597   6.4976 -9.729906 9.619365 
1 1 1   20    4   44 o   10.982   4.9237  -2.8462   9.1187 -14.0812   14.152   5.1288   11.924   11.649   5.5281   14.848   6.1128 -3.199206 8.241782 
1 1 1   20    4   45 o   22.703   5.1813   23.471   9.3764   20.191   13.984   26.150   12.638   20.855   6.9868   23.492   6.4186 -2.637079 9.487572 
1 1 1   20    4   46 o   14.738   5.8150   6.7999   10.299  -9.8245   13.981   26.528   15.230   12.245   5.7108   23.396   7.2445 -11.15049 9.224715 
1 1 1   20    4   47 o   30.599   4.3814   41.087   10.617   39.857   14.575   42.478   15.496   29.078   6.3293   29.914   6.5380 -0.8361797 9.099751 
1 1 1   20    4   48 o   54.699   2.8058  125.294   12.469  129.838   17.082  120.113   18.241   55.059   3.8300   52.627   4.2893 2.432083 5.750385 
1 1 1   20    4   49 o   24.913   5.3755   28.515   10.596   20.353   14.323   38.379   15.747   20.820   7.0709   28.088   6.9228 -7.268499 9.895606 
1 1 1   20    4   50 o   11.295   4.9949  -1.3960   9.0591   21.353   14.172 -17.1147   11.780   21.166   7.0321   9.8095   4.7543 11.35672 8.488470 
1 1 1   20    4   51 o   35.958   3.6988   55.672   10.687   47.252   15.190   63.925   15.039   31.709   6.0982   37.763   5.0089 -6.053633 7.891595 
1 1 1   20    4   52 o   14.920   5.6245   8.4103   9.3234   21.517   14.373  -1.1119   12.251   21.131   7.0832   13.081   5.7953 8.050003 9.151861 
1 1 1   20    4   53 o   18.099   5.6553   15.128   9.2582   12.947   14.211   16.736   12.203   17.902   6.8964   19.024   6.5253 -1.121792 9.494196 
1 1 1   20    4   54 o   27.638   4.4389   34.090   9.6617   37.159   15.196   32.007   12.518   27.391   6.8296   25.862   6.0467 1.529308 9.121737 
1 1 1   20    4   55 o   12.247   5.2217   1.7621   9.1799  -5.6076   14.575   6.6080   11.819   13.109   6.0126   15.004   6.1210 -1.895303 8.580091 
1 1 1   20    4   56 o   15.672   5.6189   10.495   9.1151   20.601   14.132   3.2940   11.928   20.495   7.0222   13.983   5.9567 6.512255 9.208330 
1 1 1   20    4   57 o   16.607   6.0838   11.960   10.762   33.397   17.473  -1.1424   13.661   25.044   7.7604   13.550   6.0541 11.49420 9.842547 
1 1 1   20    4   58 o   24.955   5.7932   30.042   11.557   25.277   18.618   33.029   14.741   21.969   8.0092   25.392   6.9301 -3.422356 10.59116 
1 1 1   20    4   59 o   20.976   6.0519   21.686   10.919   38.996   17.209   10.023   14.126   27.019   7.5323   16.557   6.7151 10.46132 10.09100 
1 1 1   20    4   60 o   20.663   6.1410   21.265   11.099   12.671   17.308   27.268   14.465   17.901   7.3667   22.795   7.0605 -4.893639 10.20384 
1 1 1   20    4   61 o   18.791   6.2979   17.458   11.363  -3.1387   17.635   32.079   14.858   14.461   6.6257   24.609   7.0472 -10.14787 9.672807 
1 1 1   20    4   62 o   16.851   6.1584   13.181   11.017   29.880   17.234   1.6387   14.328   23.093   7.7564   14.175   6.2745 8.917807 9.976475 
1 1 1   20    4   63 o   27.333   5.3422   35.921   11.476   37.268   17.158   34.831   15.436   25.762   7.6300   25.339   7.1588 0.4228268 10.46257 
1 1 1   20    4   64 o   25.261   5.7063   31.616   11.472   18.968   17.061   42.051   15.498   19.235   7.5158   28.199   6.8181 -8.964216 10.14755 
1 1 1   20    4   65 o   19.639   6.2149   19.904   11.147   5.9411   16.470   31.705   15.142   15.622   6.8270   23.904   7.1888 -8.281522 9.913994 
1 1 1   20    4   66 o   24.917   5.7193   31.182   11.370   13.823   16.919   45.480   15.355   17.534   7.2561   29.395   6.5732 -11.86175 9.790697 
1 1 1   20    4   67 o   12.206   5.4363   0.2246   10.925   16.483   16.289 -13.0671   14.729   18.068   7.2523   11.416   5.4778 6.652817 9.088586 
1 1 1   20    4   68 o   14.221   5.8352   7.3664   10.818  -6.1083   16.010   18.687   14.675   12.910   6.0501   18.576   7.0444 -5.666212 9.285854 
1 1 1   20    4   69 o   10.828   5.0362  -5.0155   10.758  -7.0142   15.770  -3.2759   14.713   12.614   5.9406   12.860   5.9495 -0.2460098 8.407561 
1 1 1   20    4   70 o   16.571   6.1270   13.882   10.957   20.685   16.219   8.1704   14.861   18.994   7.3541   15.322   6.5906 3.672038 9.875121 
1 1 1   20    4   71 o   17.277   6.9813   15.376   15.205   26.700   23.014   6.6036   20.256   20.187   8.4175   15.992   7.2387 4.194712 11.10190 
1 1 1   20    4   72 o   14.691   6.4927   5.5236   15.287 -10.9464   22.697   19.197   20.681   14.048   6.7564   18.460   7.8530 -4.411340 10.35941 
1 1 1   20    4   73 o   12.251   5.7528  -5.7857   14.601   10.886   22.382 -18.1367   19.265   16.933   7.6421   12.258   5.9725 4.675031 9.699039 
1 1 1   20    4   74 o   16.554   6.6014   13.935   13.407   16.916   17.607   9.8200   20.683   17.663   7.3635   16.455   7.3933 1.207178 10.43468 
1 1 1   20    4   75 o   15.057   6.3650   9.1609   13.441   16.285   17.750  -0.4164   20.580   17.426   7.3376   14.717   6.8848 2.709539 10.06181 
1 1 1   20    4   76 f   20.625   6.9203   25.463   13.719   36.441   17.957   10.073   21.262   23.372   7.9176   16.410   7.4233 6.961296 10.85327 
1 1 1   20    4   77 o   22.134   7.9196   33.246   18.098   33.246   18.098   0.0000   0.0000   22.134   7.9196  ?   ?  0.000000 7.919611 
1 1 1   20    4   78 o   20.047   7.7832   26.838   18.205   26.838   18.205   0.0000   0.0000   20.047   7.7832  ?   ?  0.000000 7.783246 
1 1 1   20    4   79 f   13.781   6.4282  -0.9928   17.729  -0.9928   17.729   0.0000   0.0000   13.781   6.4282  ?   ?  0.000000 6.428217 
1 1 1   20    4   80 o   15.920   7.0111   10.994   17.675   10.994   17.675   0.0000   0.0000   15.920   7.0111  ?   ?  0.000000 7.011130 
1 1 1   20    4   81 o   17.677   7.9827   18.288   24.462   18.288   24.462   0.0000   0.0000   17.677   7.9827  ?   ?  0.000000 7.982668 
1 1 1   20    4   82 f   13.191   6.2372  -4.1154   17.708  -4.1154   17.708   0.0000   0.0000   13.191   6.2372  ?   ?  0.000000 6.237217 
1 1 1   20    4   83 o   17.353   7.2728   18.004   17.310   18.004   17.310   0.0000   0.0000   17.353   7.2728  ?   ?  0.000000 7.272763 
1 1 1   20    4   84 o   12.286   5.8892  -8.5405   16.926  -8.5405   16.926   0.0000   0.0000   12.286   5.8892  ?   ?  0.000000 5.889190 
1 1 1   20    4   85 o   14.643   6.6601   6.0333   17.403   6.0333   17.403   0.0000   0.0000   14.643   6.6601  ?   ?  0.000000 6.660123 
1 1 1   20    4   86 o   12.870   6.0750  -3.4238   16.661  -3.4238   16.661   0.0000   0.0000   12.870   6.0750  ?   ?  0.000000 6.075036 
1 1 1   20    4   87 o   11.718   5.8546 -32.6801   23.057 -32.6801   23.057   0.0000   0.0000   11.718   5.8546  ?   ?  0.000000 5.854561 
1 1 1   20    4   88 o   17.481   7.9772   18.939   25.227   18.939   25.227   0.0000   0.0000   17.481   7.9772  ?   ?  0.000000 7.977182 
1 1 1   20    5  -79 o   16.802   7.7206   14.250   24.183   14.250   24.183   0.0000   0.0000   16.802   7.7206  ?   ?  0.000000 7.720553 
1 1 1   20    5  -78 o   14.607   7.0019  -3.0793   23.921  -3.0793   23.921   0.0000   0.0000   14.607   7.0019  ?   ?  0.000000 7.001925 
1 1 1   20    5  -77 o   18.994   8.1699   26.107   22.836   26.107   22.836   0.0000   0.0000   18.994   8.1699  ?   ?  0.000000 8.169882 
1 1 1   20    5  -76 o   17.162   7.7896   15.528   23.653   15.528   23.653   0.0000   0.0000   17.162   7.7896  ?   ?  0.000000 7.789578 
1 1 1   20    5  -75 o   17.234   7.7310   15.862   22.517   15.862   22.517   0.0000   0.0000   17.234   7.7310  ?   ?  0.000000 7.731024 
1 1 1   20    5  -74 o   20.834   8.5301   33.392   23.055   33.392   23.055   0.0000   0.0000   20.834   8.5301  ?   ?  0.000000 8.530055 
1 1 1   20    5  -73 o   17.292   7.6963   15.659   21.856   15.659   21.856   0.0000   0.0000   17.292   7.6963  ?   ?  0.000000 7.696349 
1 1 1   20    5  -72 o   13.351   6.1561  -0.2507   15.563   1.3124   22.551  -1.6722   21.505   15.178   7.1343   14.584   6.8892 0.5942469 9.917578 
1 1 1   20    5  -71 o   11.179   5.3990 -12.9287   14.862 -17.9312   21.045  -7.9517   20.992   12.666   6.1870   13.733   6.5764 -1.066414 9.029259 
1 1 1   20    5  -70 f   21.512   7.3375   28.880   15.426   27.916   21.572   29.888   22.066   20.107   8.2439   20.527   8.3677 -0.4204330 11.74649 
1 1 1   20    5  -69 o   28.310   7.0129   46.340   16.099   15.792   22.509   78.330   23.035   17.667   7.8398   35.352   8.1588 -17.68553 11.31500 
1 1 1   20    5  -68 o   15.749   6.7141   10.365   15.173   7.1356   21.229   13.738   21.694   16.086   7.3319   17.296   7.6848 -1.210051 10.62129 
1 1 1   20    5  -67 o   14.724   6.4869   6.0022   15.145   0.1989   21.263   11.979   21.578   15.069   7.0326   17.018   7.6060 -1.949285 10.35900 
1 1 1   20    5  -66 o   11.246   5.4173 -12.9614   14.732 -43.7340   21.240   15.570   20.452   10.816   5.4343   17.661   7.6642 -6.845304 9.395288 
1 1 1   20    5  -65 o   14.138   6.1621   5.1537   13.341  -1.2574   17.226   14.764   21.090   13.943   6.4460   17.642   7.7172 -3.698822 10.05516 
1 1 1   20    5  -64 o   17.712   5.4127   15.972   8.5364   29.944   12.523   3.8447   11.667   23.435   6.3837   13.314   5.7832 10.12103 8.613769 
1 1 1   20    5  -63 o   8.6927   4.1302  -7.4447   7.9477 -17.0909   11.900   0.3219   10.678   9.4662   4.6300   12.036   5.3667 -2.569430 7.087901 
1 1 1   20    5  -62 o   30.432   3.6269   41.449   8.8203   35.658   13.176   46.152   11.873   25.969   6.2914   31.121   4.8374 -5.152565 7.936092 
1 1 1   20    5  -61 o   23.134   4.6920   25.463   8.5450   23.929   12.567   26.783   11.653   21.006   6.5926   22.592   6.1597 -1.585760 9.022432 
1 1 1   20    5  -60 o   38.258   3.0198   63.289   9.3410   50.381   13.393   75.515   13.035   32.318   5.2650   41.004   3.9485 -8.685802 6.581086 
1 1 1   20    5  -59 o   28.223   3.9758   35.967   8.8935   26.649   12.742   44.819   12.419   22.394   6.5601   30.610   5.1606 -8.215662 8.346643 
1 1 1   20    5  -58 o   25.564   4.4664   30.230   8.9687   41.912   12.965   19.512   12.420   29.237   5.6447   19.391   6.5843 9.845732 8.672709 
1 1 1   20    5  -57 o   35.530   3.3628   55.048   9.6235   64.305   14.435   47.642   12.911   37.161   4.8835   31.691   5.1765 5.469744 7.116543 
1 1 1   20    5  -56 o   17.186   5.6028   14.226   9.0121   24.076   13.447   6.1938   12.143   21.370   6.8333   14.595   6.1023 6.774737 9.161432 
1 1 1   20    5  -55 o   12.263   5.1492   3.0998   8.7035  -8.7030   12.987   12.723   11.727   11.534   5.4191   16.806   6.3139 -5.272452 8.320584 
1 1 1   20    5  -54 o   29.859   3.7164   39.278   8.8503   55.667   14.567   29.689   11.143   34.340   5.3805   24.725   5.6522 9.614943 7.803652 
1 1 1   20    5  -53 o   11.814   4.9766   2.4270   8.1706  -9.8734   13.103   10.252   10.451   11.460   5.4025   15.701   5.9469 -4.241313 8.034509 
1 1 1   20    5  -52 o   31.587   3.8288   43.880   9.6574   15.963   17.558   55.989   11.564   18.986   7.5600   35.569   4.0610 -16.58282 8.581719 
1 1 1   20    5  -51 o   8.7306   4.2064 -11.6816   8.8902  -6.4038   16.745 -13.7532   10.491   13.760   6.3594   9.4169   4.5451 4.343512 7.816653 
1 1 1   20    5  -50 o   13.236   5.2621   5.4975   8.4931  -7.5308   14.372   12.489   10.528   12.583   5.8416   16.793   6.0365 -4.210695 8.400196 
1 1 1   20    5  -49 o   31.952   3.2694   43.826   8.3953   37.492   12.604   48.878   11.256   28.154   5.6880   33.206   4.2561 -5.051188 7.104047 
1 1 1   20    5  -48 o   32.276   3.1989   44.563   8.3057   48.491   12.479   41.438   11.129   32.762   4.8163   30.349   4.6462 2.412271 6.692026 
1 1 1   20    5  -47 o   19.891   4.9700   18.285   8.0348   22.679   12.306   15.020   10.608   21.569   6.4796   18.064   6.0854 3.505133 8.889200 
1 1 1   20    5  -46 o   24.840   4.1627   27.341   8.1309   20.951   12.305   32.294   10.833   20.840   6.5209   26.499   5.2010 -5.658657 8.340979 
1 1 1   20    5  -45 o   16.284   5.2533   11.874   7.9348   8.9994   12.149   14.013   10.478   16.019   6.3171   17.654   6.0468 -1.635744 8.744734 
1 1 1   20    5  -44 o   10.466   4.6340  -1.4220   7.8203  -5.4717   12.021   1.5497   10.297   11.961   5.4764   12.836   5.5031 -0.8752422 7.763693 
1 1 1   20    5  -43 o   28.822   3.6369   35.869   8.3547   32.625   12.778   38.292   11.042   26.231   6.0926   29.221   4.8025 -2.989511 7.757866 
1 1 1   20    5  -42 o   8.1224   3.9225 -11.3373   7.8393 -16.3994   12.327  -7.9000   10.158   10.227   4.9338   10.390   4.8529 -0.1632242 6.920517 
1 1 1   20    5  -41 o   35.201   3.0076   52.342   8.5475   39.267   12.999   62.301   11.345   29.165   5.6722   38.096   3.6998 -8.931028 6.772152 
1 1 1   20    5  -40 o   18.144   5.1254   15.002   7.9130   17.816   12.240   12.981   10.372   19.656   6.5354   17.293   6.0119 2.362928 8.880013 
1 1 1   20    5  -39 o   20.810   4.9484   19.693   8.2707   3.4573   13.023   30.668   10.707   14.742   6.2500   25.950   5.2424 -11.20809 8.157532 
1 1 1   20    5  -38 o   15.818   5.7114   10.127   9.4370   9.3822   14.364   10.693   12.518   17.000   6.8147   16.899   6.4823 0.1014900 9.405344 
1 1 1   20    5  -37 f   11.633   5.0863  -0.5826   9.1526  -0.8356   13.585  -0.3724   12.386   13.902   6.1335   13.444   5.8966 0.4578085 8.508214 
1 1 1   20    5  -36 o   49.612   2.7362  102.880   11.023  100.606   16.329  104.783   14.940   48.263   4.1920   49.550   3.7262 -1.287613 5.608717 
1 1 1   20    5  -35 o   31.743   5.0933   45.065   12.734   47.691   15.015   38.340   24.030   32.187   5.9416   27.121   9.1592 5.065399 10.91759 
1 1 1   20    5  -34 o   30.729   4.4881   41.438   10.911   48.903   15.160   33.417   15.714   32.643   5.9153   26.250   7.1514 6.393234 9.280788 
1 1 1   20    5  -33 o   53.291   2.7961  118.643   12.104  110.995   16.441  127.694   17.885   50.900   3.9945   54.577   4.0491 -3.677532 5.687817 
1 1 1   20    5  -32 o   14.389   5.5836   6.7184   9.3653   9.7773   14.643   4.6011   12.183   17.333   6.9033   14.827   6.1485 2.506516 9.244452 
1 1 1   20    5  -31 o   32.124   3.4458   43.879   8.8821   62.249   15.565   35.008   10.816   37.406   5.2490   28.058   4.9077 9.348160 7.185904 
1 1 1   20    5  -30 o   23.756   4.9518   25.296   9.2776   24.914   17.810   25.439   10.869   23.008   7.8833   23.530   5.7225 -0.5220013 9.741274 
1 1 1   20    5  -29 o   62.077   2.2369  159.350   11.301  163.490   21.308  157.731   13.330   61.734   4.2604   61.576   2.6619 0.1575508 5.023613 
1 1 1   20    5  -28 o   20.440   5.3618   18.961   9.0431   6.8394   17.753   23.207   10.509   17.597   7.3693   22.503   5.7181 -4.905937 9.327582 
1 1 1   20    5  -27 o   34.084   3.3888   49.175   9.2906   42.827   18.035   51.468   10.839   29.831   7.4418   34.672   3.9029 -4.840939 8.403197 
1 1 1   20    5  -26 o   21.697   4.8894   21.057   8.4398   20.479   14.640   21.344   10.329   21.259   7.1489   21.608   5.7598 -0.3489361 9.180525 
1 1 1   20    5  -25 o   52.711   2.1706  114.747   9.3063  119.750   14.312  111.082   12.250   53.394   3.3045   51.585   2.9251 1.809052 4.413179 
1 1 1   20    5  -24 o   44.006   2.6817   80.588   9.5738   91.551   13.462   69.370   13.618   46.553   3.5749   40.204   4.2182 6.348640 5.529282 
1 1 1   20    5  -23 o   49.349   2.2584  100.668   9.0609   94.163   13.688  105.742   12.089   47.225   3.5824   50.331   2.9596 -3.105602 4.646831 
1 1 1   20    5  -22 o   19.755   4.8596   17.412   7.7706   26.529   12.005   10.839   10.194   24.033   6.1144   16.547   5.9410 7.485767 8.525320 
1 1 1   20    5  -21 o   25.159   4.0791   27.391   8.0795   26.933   12.437   27.725   10.627   24.185   6.2605   24.835   5.4037 -0.6498089 8.269998 
1 1 1   20    5  -20 o   55.280   2.1008  125.982   9.4495  120.448   14.181  130.402   12.673   53.623   3.2596   56.004   2.7848 -2.380970 4.287217 
1 1 1   20    5  -19 o   45.250   2.7128   85.125   9.9603  103.343   13.932   66.076   14.246   49.575   3.4694   39.137   4.5501 10.43832 5.721911 
1 1 1   20    5  -18 o   33.515   3.4650   47.461   9.3300   54.444   17.887   44.851   10.936   34.471   6.6059   32.283   4.2594 2.188148 7.860001 
1 1 1   20    5  -17 o   37.600   3.3497   59.474   10.159   73.818   25.119   56.669   11.108   39.299   8.1104   36.539   3.7843 2.759705 8.949788 
1 1 1   20    5  -16 o   38.901   3.0666   63.309   9.6456   55.666   18.819   66.033   11.233   34.736   6.8895   39.576   3.5187 -4.839787 7.736107 
1 1 1   20    5  -15 o   39.608   3.0270   65.562   9.6991   48.373   18.395   72.181   11.415   32.179   7.1939   41.436   3.4096 -9.257259 7.961018 
1 1 1   20    5  -14 o   21.783   4.6438   20.921   7.9937   30.174   12.758   14.941   10.257   25.714   6.1664   18.526   5.9723 7.187605 8.584435 
1 1 1   20    5  -13 o   36.199   3.0986   54.864   9.0554   47.701   16.061   58.202   10.964   32.435   6.3020   37.098   3.6739 -4.662930 7.294689 
1 1 1   20    5  -12 o   35.486   3.1573   52.778   9.0374   55.526   16.142   51.523   10.907   35.318   5.8084   34.804   3.9122 0.5139694 7.003088 
1 1 1   20    5  -11 o   22.968   4.6748   23.198   8.4543   9.4944   15.396   29.114   10.116   17.798   7.0817   25.680   5.0125 -7.882107 8.676209 
1 1 1   20    5  -10 o   32.887   3.3751   45.552   8.9195   21.999   15.531   57.145   10.896   22.180   7.3613   36.765   3.6853 -14.58474 8.232311 
1 1 1   20    5   -9 o   36.160   3.2665   54.865   9.5245   60.674   18.685   52.825   11.071   36.620   6.4974   35.257   3.9183 1.363041 7.587385 
1 1 1   20    5   -8 o   30.263   3.5371   38.752   8.5613   30.733   14.106   43.428   10.772   25.843   6.6558   31.811   4.2614 -5.967306 7.903071 
1 1 1   20    5   -7 o   66.588   2.0972  182.499   11.369  199.614   20.307  174.686   13.721   68.985   3.6239   64.976   2.5958 4.008675 4.457656 
1 1 1   20    5   -6 f   29.613   3.6342   37.190   8.5889   26.840   14.157   43.219   10.805   24.158   6.8662   31.729   4.2871 -7.571238 8.094667 
1 1 1   20    5   -5 o   48.758   2.4156   98.258   9.5711   98.559   15.591   98.076   12.125   48.259   3.9992   48.503   3.0826 -0.2440796 5.049368 
1 1 1   20    5   -4 o   44.546   2.5854   82.220   9.3478   77.313   15.337   85.121   11.791   42.498   4.4953   45.125   3.2268 -2.627911 5.533551 
1 1 1   20    5   -3 o   56.997   2.1902  133.862   10.157  150.950   16.748  123.921   12.774   60.065   3.4349   54.620   2.8793 5.445698 4.482096 
1 1 1   20    5   -2 o   74.289   1.9113  226.710   11.564  220.624   18.332  230.732   14.904   72.823   3.0953   74.758   2.4490 -1.935547 3.946983 
1 1 1   20    5   -1 o   75.824   1.8921  235.991   11.695  268.472   19.175  216.752   14.758   80.429   2.9296   72.435   2.5031 7.993683 3.853343 
1 1 1   20    5    0 o   10.621   4.8705  -5.9147   9.5568 -25.8202   13.505   14.054   13.526   9.8662   4.8474   18.846   6.8331 -8.980230 8.377907 
1 1 1   20    5    1 o   69.095   2.2212  196.678   12.494  188.445   17.752  204.759   17.588   67.224   3.2493   70.157   3.0829 -2.933815 4.479077 
1 1 1   20    5    2 o   51.969   2.6398  111.871   11.146  129.083   16.178   96.320   15.378   55.462   3.5978   47.715   3.9903 7.747044 5.372797 
1 1 1   20    5    3 o   17.720   5.4914   13.652   8.7490   13.283   13.746   13.903   11.343   18.611   6.8659   18.286   6.2905 0.3245106 9.311831 
1 1 1   20    5    4 o   49.517   2.4063  101.319   9.6836  104.787   15.610   99.150   12.347   49.828   3.8736   48.756   3.1230 1.071663 4.975718 
1 1 1   20    5    5 o   60.538   2.2877  151.144   11.269  147.764   16.517  154.087   15.413   59.426   3.4242   60.821   3.1193 -1.395050 4.631954 
1 1 1   20    5    6 f   62.125   2.2532  159.111   11.392  164.210   16.885  154.850   15.433   62.702   3.3154   60.971   3.1156 1.731483 4.549531 
1 1 1   20    5    7 o   36.099   3.3568   54.754   9.7645   65.672   14.637   45.999   13.107   39.039   4.6937   32.411   5.1319 6.628597 6.954652 
1 1 1   20    5    8 o   14.915   5.5774   7.7670   9.1280   5.4182   13.970   9.5169   12.058   16.065   6.6155   16.695   6.3725 -0.6293488 9.185526 
1 1 1   20    5    9 o   35.953   3.0854   54.077   8.9550   58.762   14.798   51.370   11.249   36.725   5.0789   34.714   4.0513 2.010773 6.496747 
1 1 1   20    5   10 o   85.793   1.8237  302.047   12.754  320.738   20.630  290.485   16.226   87.915   2.8826   83.904   2.3748 4.011276 3.734859 
1 1 1   20    5   11 o   66.367   2.0531  181.262   11.094  212.801   18.159  162.483   14.012   71.472   3.1245   62.591   2.7531 8.881546 4.164383 
1 1 1   20    5   12 o   28.686   3.8663   35.143   8.8108   34.465   14.612   35.531   11.045   27.354   6.6243   28.459   4.9401 -1.104820 8.263535 
1 1 1   20    5   13 o   17.643   5.6079   13.488   9.0670   31.014   14.173   1.3473   11.797   25.914   6.6705   13.854   5.9135 12.06005 8.914312 
1 1 1   20    5   14 o   51.796   2.5404  111.109   10.693  106.322   16.049  114.932   14.340   50.100   3.9620   52.367   3.3775 -2.266846 5.206240 
1 1 1   20    5   15 o   43.388   2.8894   78.437   10.161   89.325   15.730   70.642   13.310   45.748   4.2674   40.731   4.0630 5.016453 5.892258 
1 1 1   20    5   16 o   49.022   2.6011   99.659   10.357  105.021   15.805   95.624   13.710   49.791   3.9259   47.663   3.5544 2.128807 5.295884 
1 1 1   20    5   17 o   20.480   5.0684   18.732   8.4149   17.009   13.976   19.711   10.539   19.974   6.9764   20.879   5.9211 -0.9050407 9.150386 
1 1 1   20    5   18 o   54.666   2.2739  123.410   10.111  135.945   17.271  116.873   12.471   56.756   3.7542   52.981   2.8988 3.775558 4.743083 
1 1 1   20    5   19 o   70.702   2.1166  205.970   12.184  200.740   18.654  209.862   16.091   69.255   3.3140   71.088   2.7823 -1.833000 4.327076 
1 1 1   20    5   20 o   33.016   3.6381   46.266   9.6289   55.460   18.556   42.878   11.264   34.645   6.8135   31.433   4.5266 3.212080 8.180053 
1 1 1   20    5   21 o   27.152   4.3475   32.032   9.2978   19.520   18.006   36.582   10.857   21.471   7.8687   28.883   4.7786 -7.411144 9.206055 
1 1 1   20    5   22 o   42.114   2.9457   74.096   10.048   73.559   19.378   74.294   11.752   40.441   6.0651   41.975   3.4654 -1.534515 6.985336 
1 1 1   20    5   23 o   59.837   2.1623  147.744   10.530  152.321   17.375  145.088   13.237   60.134   3.5605   59.070   2.7568 1.064342 4.502971 
1 1 1   20    5   24 o   37.033   3.0881   57.559   9.2374   51.676   15.179   61.019   11.641   33.944   5.6868   37.854   3.8252 -3.909615 6.853604 
1 1 1   20    5   25 o   31.795   3.9023   43.309   9.9018   54.258   15.236   35.303   13.029   34.851   5.5488   27.808   5.9289 7.043369 8.120359 
1 1 1   20    5   26 o   23.994   4.6467   25.457   8.7599   24.570   14.943   25.921   10.812   22.910   7.1886   23.845   5.6499 -0.9345493 9.143211 
1 1 1   20    5   27 o   27.805   3.9218   33.311   8.6424   20.810   14.806   39.772   10.644   21.379   7.1894   30.205   4.4567 -8.826332 8.458677 
1 1 1   20    5   28 o   20.456   5.1453   18.900   8.5703   19.793   14.555   18.426   10.603   20.936   7.1278   20.100   6.0091 0.8359547 9.322824 
1 1 1   20    5   29 o   13.867   5.4415   5.7772   8.9753  -0.4796   18.164   7.7983   10.324   16.056   7.0877   15.232   5.8754 0.8234758 9.206285 
1 1 1   20    5   30 o   10.834   4.7782  -1.4649   8.2378 -12.1059   13.832   4.3841   10.255   11.843   5.5730   13.918   5.6927 -2.075767 7.966483 
1 1 1   20    5   31 o   39.329   3.2686   65.305   10.384   71.239   17.374   62.008   12.952   39.906   5.4862   37.861   4.2712 2.045013 6.952794 
1 1 1   20    5   32 o   26.783   5.1949   32.302   10.932   33.023   24.420   32.121   12.226   25.715   9.1994   26.407   5.8353 -0.6915569 10.89406 
1 1 1   20    5   33 o   24.745   5.6181   28.114   11.072   15.218   25.593   31.083   12.281   21.365   8.8901   25.895   5.9442 -4.530539 10.69424 
1 1 1   20    5   34 o   52.514   3.0105  115.722   12.833   95.261   27.381  121.482   14.527   44.134   7.9013   53.633   3.3394 -9.499424 8.577967 
1 1 1   20    5   35 o   70.169   2.5912  204.946   14.796  173.198   22.273  230.020   19.794   63.312   4.3420   73.873   3.2954 -10.56136 5.450945 
1 1 1   20    5   36 o   57.693   3.1019  139.976   14.534  135.125   20.638  144.749   20.471   55.679   4.5879   57.804   4.3771 -2.125057 6.340899 
1 1 1   20    5   37 f   30.556   5.0791   41.889   12.207   37.229   17.694   46.121   16.862   27.341   7.6434   31.014   6.8527 -3.672523 10.26550 
1 1 1   20    5   38 o   16.250   6.0782   10.229   10.843  -2.2869   14.654   25.370   16.118   14.048   6.2740   22.873   7.4953 -8.824427 9.774598 
1 1 1   20    5   39 o   17.715   5.6915   14.117   9.3202   16.611   14.622   12.410   12.096   19.475   7.0982   17.422   6.4383 2.052898 9.583083 
1 1 1   20    5   40 o   35.131   4.5024   54.266   12.598   66.757   18.730   43.947   17.024   37.804   6.2995   30.020   7.0737 7.784132 9.472143 
1 1 1   20    5   41 o   11.790   5.1068   0.2360   9.0460   5.0726   14.355  -2.9499   11.650   15.679   6.6002   12.382   5.5571 3.297602 8.628047 
1 1 1   20    5   42 o   9.1253   4.3628 -11.0116   9.1562 -13.3260   14.335  -9.4166   11.900   11.779   5.5822   11.135   5.2175 0.6442852 7.640850 
1 1 1   20    5   43 o   46.068   2.8705   89.264   10.726   87.244   16.762   90.664   13.957   44.418   4.7007   45.928   3.7610 -1.510540 6.020123 
1 1 1   20    5   44 o   25.289   4.8359   28.945   9.6058   37.945   14.882   22.518   12.576   27.956   6.6314   21.607   6.5632 6.349243 9.330119 
1 1 1   20    5   45 o   24.883   5.3939   28.734   10.624   37.801   19.219   24.743   12.750   26.856   8.1040   22.552   6.5497 4.304379 10.41987 
1 1 1   20    5   46 o   66.847   2.2772  185.838   12.391  182.019   18.568  188.905   16.636   65.274   3.5025   66.863   3.0605 -1.588448 4.651278 
1 1 1   20    5   47 o   36.084   3.5439   56.077   10.290   60.271   15.549   52.809   13.725   36.189   5.4391   34.073   5.0979 2.115551 7.454664 
1 1 1   20    5   48 o   45.697   2.9613   88.411   10.971   76.958   16.723   97.066   14.538   41.164   5.0921   47.332   3.7998 -6.167656 6.353589 
1 1 1   20    5   49 o   16.369   6.0555   11.312   10.705   6.0592   15.022   16.733   15.260   15.878   6.7211   19.149   7.2008 -3.271320 9.850126 
1 1 1   20    5   50 o   18.795   6.0931   16.868   10.666   20.560   14.894   12.981   15.282   20.414   7.1964   17.872   7.0734 2.542459 10.09063 
1 1 1   20    5   51 o   18.456   6.5032   16.089   12.162   12.625   15.348   21.934   19.937   17.705   7.0622   21.015   8.1491 -3.310671 10.78340 
1 1 1   20    5   52 o   34.045   5.2371   53.898   14.069   55.898   18.862   51.391   21.121   32.922   7.2272   30.400   8.2944 2.521500 11.00139 
1 1 1   20    5   53 o   18.912   6.3092   17.491   11.405   30.266   18.497   9.6543   14.487   23.416   8.0335   16.490   6.7579 6.926027 10.49790 
1 1 1   20    5   54 o   25.762   5.6437   32.144   11.523   41.866   18.429   25.904   14.766   27.499   7.8400   22.132   7.1685 5.366837 10.62322 
1 1 1   20    5   55 o   15.550   6.0863   9.6783   11.204  -1.6202   17.760   17.148   14.440   14.744   6.7146   18.736   7.0132 -3.992071 9.709300 
1 1 1   20    5   56 o   22.579   5.9929   25.632   11.212   20.490   17.956   28.918   14.354   19.907   7.7296   23.243   7.0016 -3.336359 10.42920 
1 1 1   20    5   57 o   15.193   6.0554   8.9367   11.275   2.5678   17.536   13.425   14.721   15.332   6.8541   17.373   6.9208 -2.040957 9.740492 
1 1 1   20    5   58 o   7.1916   3.6435 -34.5876   10.757 -43.4339   16.270 -27.7179   14.338   9.2203   4.6485   9.6310   4.7796 -0.4107485 6.667344 
1 1 1   20    5   59 o   21.702   6.2329   24.491   11.606   3.6574   16.955   42.860   15.921   15.247   6.7829   28.195   6.9681 -12.94755 9.724308 
1 1 1   20    5   60 o   13.566   5.7627   4.5903   11.108   0.7695   16.743   7.5947   14.846   14.540   6.5812   15.523   6.6303 -0.9836559 9.342022 
1 1 1   20    5   61 o   17.281   6.3018   14.996   11.527  -1.3197   17.110   28.557   15.599   14.176   6.5066   22.230   7.3774 -8.054615 9.836735 
1 1 1   20    5   62 o   35.858   4.3769   59.576   12.529   72.895   18.718   48.764   16.864   37.409   6.3660   29.614   7.0816 7.795095 9.522313 
1 1 1   20    5   63 o   11.477   5.2673  -3.0479   11.209 -28.7771   16.360   19.713   15.388   10.266   5.0965   18.820   7.1951 -8.554129 8.817204 
1 1 1   20    5   64 o   19.605   6.3589   20.999   11.617   26.787   17.247   16.192   15.716   20.860   7.6917   17.629   7.1068 3.230995 10.47228 
1 1 1   20    5   65 o   20.429   6.3817   23.028   11.790   55.211   17.753  -2.3659   15.770   31.157   7.1430   13.307   6.1575 17.84928 9.430671 
1 1 1   20    5   66 o   21.888   7.5918   29.922   16.535   42.091   24.104   19.104   22.726   23.655   9.0144   18.509   8.0550 5.145937 12.08896 
1 1 1   20    5   67 o   21.659   7.5281   29.280   16.263   27.756   24.118   30.550   22.023   20.170   8.5261   20.991   8.4301 -0.8215714 11.99006 
1 1 1   20    5   68 o   18.646   7.2932   20.406   16.080   46.214   24.247   0.1456   21.484   24.511   9.1048   15.066   7.0437 9.444683 11.51138 
1 1 1   20    5   69 o   18.148   7.2015   18.961   15.879   12.313   23.544   24.508   21.507   17.162   7.7824   19.427   8.1216 -2.264952 11.24843 
1 1 1   20    5   70 f   22.228   7.4363   31.120   15.842   29.138   23.280   32.829   21.621   20.227   8.4526   21.332   8.4227 -1.104416 11.93263 
1 1 1   20    5   71 o   22.413   6.9471   30.115   14.002   52.898   18.241  -2.5668   21.847   29.305   7.5796   14.595   6.9091 14.71003 10.25601 
1 1 1   20    5   72 o   12.851   5.8441   0.6143   13.392  -7.0945   17.790   10.698   20.346   12.933   6.1549   16.292   7.3253 -3.358613 9.567735 
1 1 1   20    5   73 o   15.864   7.0164   10.264   17.884   10.264   17.884   0.0000   0.0000   15.864   7.0164  ?   ?  0.000000 7.016433 
1 1 1   20    5   74 o   15.358   6.8974   7.9043   17.981   7.9043   17.981   0.0000   0.0000   15.358   6.8974  ?   ?  0.000000 6.897438 
1 1 1   20    5   75 o   11.806   5.7368 -14.6510   17.446 -14.6510   17.446   0.0000   0.0000   11.806   5.7368  ?   ?  0.000000 5.736778 
1 1 1   20    5   76 o   14.273   6.5914   2.4287   17.942   2.4287   17.942   0.0000   0.0000   14.273   6.5914  ?   ?  0.000000 6.591417 
1 1 1   20    5   77 o   15.332   6.8997   8.4614   18.097   8.4614   18.097   0.0000   0.0000   15.332   6.8997  ?   ?  0.000000 6.899738 
1 1 1   20    5   78 o   11.061   5.4518 -21.3627   17.543 -21.3627   17.543   0.0000   0.0000   11.061   5.4518  ?   ?  0.000000 5.451831 
1 1 1   20    5   79 o   13.806   6.4288   0.7131   17.613   0.7131   17.613   0.0000   0.0000   13.806   6.4288  ?   ?  0.000000 6.428824 
1 1 1   20    5   80 o   19.797   7.7248   27.873   18.004   27.873   18.004   0.0000   0.0000   19.797   7.7248  ?   ?  0.000000 7.724799 
1 1 1   20    5   81 o   11.907   5.7629 -11.5165   17.155 -11.5165   17.155   0.0000   0.0000   11.907   5.7629  ?   ?  0.000000 5.762896 
1 1 1   20    5   82 o   17.755   7.9583   21.580   23.808   21.580   23.808   0.0000   0.0000   17.755   7.9583  ?   ?  0.000000 7.958295 
1 1 1   20    5   83 o   16.441   7.1592   15.108   17.972   15.108   17.972   0.0000   0.0000   16.441   7.1592  ?   ?  0.000000 7.159160 
1 1 1   20    5   84 o   24.383   9.2575   53.807   25.363   53.807   25.363   0.0000   0.0000   24.383   9.2575  ?   ?  0.000000 9.257490 
1 1 1   20    6  -71 o   21.571   8.6283   37.830   22.974   37.830   22.974   0.0000   0.0000   21.571   8.6283  ?   ?  0.000000 8.628323 
1 1 1   20    6  -70 o   17.417   7.1055   17.986   15.927   16.144   22.318   19.897   22.735   17.180   7.7024   17.862   7.9050 -0.6819649 11.03708 
1 1 1   20    6  -69 o   13.979   6.4020   2.5310   16.441  -3.1325   23.228   8.2166   23.274   14.597   6.9707   16.068   7.4507 -1.470299 10.20312 
1 1 1   20    6  -68 o   13.032   6.0803  -2.2457   15.879 -28.5009   22.016   26.225   22.926   11.915   5.9149   19.236   8.2281 -7.320357 10.13353 
1 1 1   20    6  -67 o   15.904   6.7878   11.937   15.540   21.719   21.390   1.0022   22.615   18.403   7.9111   15.073   7.1034 3.329449 10.63222 
1 1 1   20    6  -66 o   13.366   6.1145   0.8877   14.940  -6.4620   20.086   9.9905   22.353   13.622   6.4987   16.379   7.4875 -2.756978 9.914447 
1 1 1   20    6  -65 o   22.339   7.3929   31.599   15.667   23.835   21.065   41.211   23.438   19.039   8.0038   22.920   8.8496 -3.880527 11.93217 
1 1 1   20    6  -64 o   10.383   4.8748  -5.7875   10.477   6.1319   20.208 -10.1695   12.252   15.589   7.1236   10.476   5.0187 5.113251 8.713912 
1 1 1   20    6  -63 o   11.951   5.3351   0.8290   10.585 -17.2552   19.837   8.0280   12.516   12.447   6.0636   14.542   6.1443 -2.095020 8.632446 
1 1 1   20    6  -62 o   17.642   6.1816   16.885   10.978   12.529   20.363   18.670   13.034   16.878   7.4750   18.188   6.6900 -1.309547 10.03154 
1 1 1   20    6  -61 o   15.828   5.7056   12.634   9.4132   17.101   13.947   8.8969   12.757   17.626   6.8210   14.904   6.2446 2.721876 9.247694 
1 1 1   20    6  -60 o   20.733   5.6724   22.580   9.8625   7.2387   14.502   35.780   13.452   14.866   6.4526   25.438   6.4726 -10.57140 9.139531 
1 1 1   20    6  -59 o   20.045   5.5538   20.862   9.3875   17.875   14.334   23.105   12.422   17.994   6.9277   20.246   6.5765 -2.251829 9.552107 
1 1 1   20    6  -58 o   28.341   4.1241   37.233   9.2484   42.648   13.153   31.938   13.007   28.766   5.8096   24.070   6.4845 4.695854 8.706303 
1 1 1   20    6  -57 o   13.950   5.4030   8.2737   8.7568   5.5775   12.289   11.055   12.482   14.003   6.0076   15.711   6.3336 -1.708225 8.729567 
1 1 1   20    6  -56 o   14.928   5.5022   10.344   8.8242  -0.4512   12.417   21.360   12.543   12.588   5.6855   19.706   6.6170 -7.118660 8.724087 
1 1 1   20    6  -55 o   20.681   5.6936   21.935   9.9011   22.917   15.892   21.312   12.658   20.010   7.3824   19.760   6.6475 0.2494373 9.934195 
1 1 1   20    6  -54 o   16.669   5.8661   13.688   9.8936   18.465   16.281   10.891   12.458   18.691   7.3304   15.877   6.3527 2.813349 9.700074 
1 1 1   20    6  -53 o   18.441   5.8520   17.249   9.8769   21.192   16.241   14.935   12.442   19.670   7.4216   17.395   6.5102 2.274921 9.872274 
1 1 1   20    6  -52 o   29.158   4.0872   38.586   9.4479   40.581   13.578   36.713   13.155   28.279   6.0715   26.775   6.1562 1.504042 8.646459 
1 1 1   20    6  -51 o   10.011   4.6276  -4.6544   8.8735  -1.1973   12.934  -7.7288   12.197   12.861   5.8064   11.207   5.2611 1.654452 7.835413 
1 1 1   20    6  -50 o   43.282   2.9194   80.309   10.240   61.004   14.620   98.894   14.345   35.916   5.1403   47.313   3.7503 -11.39706 6.363013 
1 1 1   20    6  -49 o   22.332   5.2719   24.132   9.4418   23.485   14.040   24.667   12.757   20.991   7.0001   21.697   6.6142 -0.7067757 9.630631 
1 1 1   20    6  -48 o   41.952   3.1041   75.729   10.540   61.596   15.745   87.205   14.188   35.824   5.5730   44.313   3.9698 -8.488621 6.842328 
1 1 1   20    6  -47 o   26.961   4.5324   33.329   9.6077   29.248   14.512   36.514   12.820   23.473   7.0328   27.213   5.9458 -3.740334 9.209406 
1 1 1   20    6  -46 o   28.245   4.8429   36.939   10.749   20.128   14.204   59.474   16.445   19.911   7.0269   34.981   5.9822 -15.06935 9.228372 
1 1 1   20    6  -45 o   30.434   4.5329   42.054   10.902   38.602   14.535   46.493   16.485   27.652   6.5499   30.155   6.8615 -2.502356 9.485832 
1 1 1   20    6  -44 o   13.880   5.5234   6.4179   9.3669   4.0218   11.840   10.426   15.314   14.028   5.9538   16.965   6.9496 -2.937047 9.151216 
1 1 1   20    6  -43 o   27.668   4.5880   34.782   9.9853   40.602   12.785   25.681   15.988   29.277   5.5607   22.178   7.4709 7.098948 9.313231 
1 1 1   20    6  -42 o   15.482   5.6797   10.080   9.3850  -8.0141   13.391   27.545   13.157   12.006   5.5958   23.414   6.6072 -11.40819 8.658384 
1 1 1   20    6  -41 o   30.968   4.0651   42.360   10.014   47.677   14.751   37.815   13.639   31.597   5.9451   27.904   6.1612 3.693630 8.561761 
1 1 1   20    6  -40 o   9.8203   4.6230  -8.3018   9.5333   8.7710   14.007 -23.0370   13.012   16.334   6.6634   9.6505   4.7448 6.683157 8.180122 
1 1 1   20    6  -39 o   28.637   4.4503   36.695   10.051   51.105   15.013   24.988   13.531   32.957   5.8001   22.396   6.8089 10.56112 8.944351 
1 1 1   20    6  -38 o   13.457   5.3157   5.7378   8.6156   22.932   14.404  -3.8406   10.751   21.528   7.0871   11.566   5.2505 9.961746 8.820136 
1 1 1   20    6  -37 o   11.864   5.1068   0.9197   8.9344   12.204   13.834  -7.1544   11.702   17.513   6.7889   11.393   5.2830 6.120239 8.602234 
1 1 1   20    6  -36 o   29.205   3.8241   37.156   8.8851   35.352   15.227   38.087   10.941   26.671   6.9389   29.073   4.7827 -2.402506 8.427457 
1 1 1   20    6  -35 o   42.385   2.8152   75.631   9.6714  100.491   16.523   62.676   11.928   47.936   4.2734   38.009   3.9054 9.927513 5.789135 
1 1 1   20    6  -34 o   15.346   5.4529   9.8199   8.5656   2.4139   14.273   13.988   10.708   14.855   6.4246   17.693   6.1108 -2.838271 8.866632 
1 1 1   20    6  -33 o   23.184   4.7844   24.356   8.7417   16.322   14.966   28.517   10.770   19.270   7.1540   24.789   5.4762 -5.518429 9.009398 
1 1 1   20    6  -32 o   11.219   4.8589   0.1436   8.1865   1.1281   13.893  -0.3801   10.133   14.418   6.2861   12.198   5.3422 2.220246 8.249472 
1 1 1   20    6  -31 o   14.914   5.3843   8.9409   8.3870   28.652   14.573  -0.8219   10.256   24.163   6.9977   12.153   5.3469 12.01008 8.806608 
1 1 1   20    6  -30 o   51.257   2.4208  109.390   10.086  109.532   16.765  109.310   12.626   50.300   4.1252   50.922   3.0559 -0.6221657 5.133780 
1 1 1   20    6  -29 o   71.715   2.1334  212.917   12.457  218.508   19.511  209.068   16.186   71.851   3.3404   70.659   2.8158 1.192421 4.368900 
1 1 1   20    6  -28 o   17.281   5.6407   13.333   9.1328   5.5751   14.755   18.152   11.628   15.981   6.7071   19.771   6.3577 -3.789904 9.241536 
1 1 1   20    6  -27 o   22.912   5.1276   23.959   9.3373   26.532   15.526   22.500   11.687   23.299   7.3298   21.809   6.2516 1.489538 9.633674 
1 1 1   20    6  -26 o   16.867   5.4645   12.627   8.5800   21.115   15.106   8.5848   10.425   21.201   7.2604   15.448   5.9181 5.752211 9.366822 
1 1 1   20    6  -25 o   21.979   4.9105   21.887   8.5758   23.768   15.364   21.035   10.336   22.249   7.3193   21.246   5.8045 1.003061 9.341521 
1 1 1   20    6  -24 o   8.8018   4.1777  -8.8899   8.0891   8.0600   14.706 -16.2435   9.6862   16.715   6.8244   8.6487   4.2186 8.066228 8.023046 
1 1 1   20    6  -23 o   28.868   4.6796   36.969   10.635   41.321   21.280   35.520   12.279   28.278   8.5264   27.819   5.6087 0.4591064 10.20572 
1 1 1   20    6  -22 o   10.752   4.8559  -3.5071   9.0565   3.4331   20.120  -5.2705   10.142   17.382   7.5717   11.004   5.0353 6.377887 9.093106 
1 1 1   20    6  -21 o   18.365   5.8594   15.230   9.8909   30.109   30.374   13.466   10.461   25.067   9.9558   17.594   6.0413 7.473377 11.64542 
1 1 1   20    6  -20 o   38.348   3.1877   62.126   9.8745   60.774   19.975   62.564   11.360   35.599   7.1321   38.259   3.6881 -2.659382 8.029268 
1 1 1   20    6  -19 o   48.801   2.6166   99.281   10.371  110.349   20.569   95.508   12.009   49.942   5.1252   47.644   3.1092 2.298450 5.994538 
1 1 1   20    6  -18 o   32.318   3.4473   44.478   8.9416   56.586   15.463   38.395   10.960   35.408   5.5387   29.457   4.7240 5.951475 7.279660 
1 1 1   20    6  -17 o   14.243   5.2585   7.5599   8.0656   26.248   14.065  -1.5970   9.8453   23.455   6.8980   11.787   5.2099 11.66875 8.644381 
1 1 1   20    6  -16 o   26.464   4.7078   31.074   9.7833   29.064   14.550   32.732   13.217   24.631   6.9474   26.458   6.2320 -1.826628 9.332897 
1 1 1   20    6  -15 o   43.246   2.5133   77.828   8.8215   82.238   13.941   74.883   11.392   43.814   3.9456   42.083   3.3486 1.731110 5.175045 
1 1 1   20    6  -14 o   75.740   2.0213  236.638   12.468  225.316   18.774  245.571   16.677   73.281   3.1503   76.818   2.6673 -3.537926 4.127760 
1 1 1   20    6  -13 o   35.484   2.9874   52.929   8.5607   56.758   13.391   50.282   11.133   35.999   4.6735   34.136   4.0817 1.862446 6.205047 
1 1 1   20    6  -12 o   13.166   5.1557   5.1782   8.0435  -3.7173   13.907   9.6496   9.8600   13.484   6.0600   15.820   5.8187 -2.336036 8.401237 
1 1 1   20    6  -11 o   36.468   3.2955   56.222   9.6909   92.468   19.903   44.958   11.095   45.562   5.4680   32.150   4.3448 13.41192 6.983973 
1 1 1   20    6  -10 f   34.711   3.3749   51.053   9.4288   28.526   18.248   59.259   11.013   24.297   7.9757   37.294   3.6701 -12.99722 8.779604 
1 1 1   20    6   -9 o   24.523   4.2416   26.321   8.1720   36.964   13.136   19.602   10.438   28.405   5.8677   20.659   5.9035 7.745689 8.323535 
1 1 1   20    6   -8 f   51.344   2.2594  109.118   9.4329  117.105   14.792  103.645   12.246   52.658   3.4654   49.731   3.0353 2.926495 4.606749 
1 1 1   20    6   -7 o   31.291   3.3530   41.526   8.4191   39.704   13.073   42.817   11.005   29.601   5.6236   31.342   4.4309 -1.741331 7.159483 
1 1 1   20    6   -6 o   68.170   2.1315  191.873   11.830  187.247   16.130  197.257   17.402   66.942   2.9634   68.621   3.1192 -1.678787 4.302443 
1 1 1   20    6   -5 o   43.028   2.8990   77.464   10.109   73.261   13.823   82.295   14.820   41.278   4.1651   43.747   4.2078 -2.468819 5.920611 
1 1 1   20    6   -4 o   17.025   5.6656   12.506   9.1982   29.754   12.821  -5.7892   13.204   25.282   6.2555   12.708   5.7885 12.57362 8.522805 
1 1 1   20    6   -3 o   38.550   3.7904   63.392   11.757   40.851   19.051   77.256   14.941   28.841   7.8810   42.279   4.3997 -13.43773 9.025910 
1 1 1   20    6   -2 o   39.268   2.8831   64.544   9.1643   65.562   14.850   63.917   11.647   38.705   4.8101   38.736   3.7348 -0.3136826E-01 6.089810 
1 1 1   20    6   -1 o   11.064   4.8356  -0.8217   8.2648   1.9686   13.753  -2.3989   10.340   14.813   6.3553   11.904   5.2961 2.908900 8.272774 
1 1 1   20    6    0 o   12.607   5.2423   2.6044   8.8898 -11.4302   13.683   12.855   11.694   11.894   5.5802   17.696   6.3619 -5.802181 8.462371 
1 1 1   20    6    1 o   22.929   4.7092   23.387   8.5069   20.918   13.853   24.881   10.779   21.326   6.9461   23.297   5.7188 -1.971279 8.997394 
1 1 1   20    6    2 o   38.775   2.9880   63.062   9.3717   81.049   15.646   52.999   11.703   43.258   4.5031   35.052   4.1782 8.206383 6.142878 
1 1 1   20    6    3 o   15.164   5.4090   9.1091   8.4359   9.8149   13.926   8.6999   10.603   17.193   6.7685   15.697   5.9795 1.495664 9.031424 
1 1 1   20    6    4 o   30.641   4.0329   40.494   9.8286   17.637   14.651   59.199   13.254   20.109   7.1329   36.910   4.4979 -16.80088 8.432589 
1 1 1   20    6    5 o   19.944   5.5415   18.097   9.3313   20.407   14.346   16.404   12.285   21.141   7.0765   19.281   6.5486 1.859871 9.641615 
1 1 1   20    6    6 o   53.895   2.4877  120.576   10.900  135.738   16.375  108.515   14.605   56.660   3.5635   50.640   3.5608 6.020237 5.037623 
1 1 1   20    6    7 o   17.445   5.6483   13.360   9.1675   4.7883   13.977   19.831   12.145   15.665   6.5480   20.769   6.4754 -5.104276 9.209024 
1 1 1   20    6    8 f   23.898   4.6542   25.340   8.7406   28.959   14.539   23.291   10.938   24.676   6.9394   22.467   5.8984 2.208841 9.107499 
1 1 1   20    6    9 o   23.380   4.6995   24.318   8.6452   32.314   14.311   19.723   10.848   26.143   6.6888   20.706   6.0496 5.437498 9.018757 
1 1 1   20    6   10 f   47.318   2.5509   93.122   9.8026   85.022   15.764   98.229   12.517   44.327   4.4217   48.330   3.1951 -4.003231 5.455243 
1 1 1   20    6   11 o   16.197   5.6930   10.799   9.3162   14.837   14.198   7.7461   12.346   18.957   6.9806   15.937   6.3415 3.019586 9.430998 
1 1 1   20    6   12 o   43.768   2.9135   80.228   10.335   56.733   15.518   98.960   13.856   35.524   5.5394   48.331   3.5416 -12.80724 6.574776 
1 1 1   20    6   13 o   9.8949   4.6017  -6.9220   8.9774   9.7383   14.152 -18.1394   11.613   17.185   6.8052   9.6319   4.6803 7.553069 8.259344 
1 1 1   20    6   14 o   40.921   3.4032   70.892   11.249   72.791   19.733   69.978   13.692   39.790   6.2931   40.251   4.2366 -0.4609222 7.586277 
1 1 1   20    6   15 o   22.152   5.1944   22.279   9.2161   26.081   18.188   20.965   10.690   23.358   7.9675   21.286   5.9376 2.072136 9.936608 
1 1 1   20    6   16 o   25.231   4.7425   28.339   9.3961   34.962   18.336   25.981   10.942   26.563   7.8927   23.738   5.7222 2.825146 9.748773 
1 1 1   20    6   17 o   28.488   3.8796   35.045   8.7753   36.208   14.346   34.349   11.093   27.720   6.4677   27.661   5.1078 0.5874634E-01 8.241390 
1 1 1   20    6   18 o   50.332   2.4388  105.266   9.9763  134.298   16.628   88.939   12.470   56.223   3.6480   45.858   3.3592 10.36448 4.959033 
1 1 1   20    6   19 o   14.337   5.3345   7.5806   8.3300   6.4540   13.775   8.2302   10.459   15.981   6.5736   15.381   5.9188 0.5996647 8.845615 
1 1 1   20    6   20 o   29.347   3.7594   37.084   8.7871   44.472   14.728   33.001   10.949   30.999   6.0459   27.048   5.1542 3.950628 7.944760 
1 1 1   20    6   21 o   26.300   4.1918   30.286   8.6852   41.604   14.347   23.740   10.912   29.914   6.0909   22.575   5.8742 7.339146 8.461974 
1 1 1   20    6   22 o   20.292   5.5387   18.967   9.4157   34.594   14.649   7.9662   12.291   26.874   6.7084   15.897   6.3269 10.97690 9.221250 
1 1 1   20    6   23 o   36.564   3.1355   56.503   9.2553   61.284   15.505   53.857   11.536   36.941   5.3006   35.259   4.0895 1.682312 6.694785 
1 1 1   20    6   24 o   28.881   4.2424   36.513   9.6902   19.610   19.149   42.333   11.235   21.153   8.0409   30.964   4.5900 -9.810478 9.258774 
1 1 1   20    6   25 o   27.000   4.4599   32.229   9.4734   40.859   19.047   29.392   10.920   28.431   7.9239   25.299   5.4557 3.131279 9.620421 
1 1 1   20    6   26 o   35.770   3.4632   54.570   9.9718   54.977   19.605   54.428   11.582   33.488   7.3813   35.423   4.0858 -1.934906 8.436678 
1 1 1   20    6   27 o   28.462   4.2840   35.577   9.6314   26.917   19.068   38.544   11.160   23.390   8.1502   29.377   4.8278 -5.986689 9.472765 
1 1 1   20    6   28 o   21.217   5.0895   20.585   8.6890   31.431   14.569   14.597   10.825   25.425   6.8686   18.091   6.1471 7.334103 9.217589 
1 1 1   20    6   29 o   14.015   5.3639   6.8261   8.5579   6.1431   14.437   7.1961   10.626   16.010   6.6707   14.957   5.9050 1.053097 8.908822 
1 1 1   20    6   30 o   48.988   3.7349  102.837   14.802  129.486   21.875   80.327   20.104   53.970   5.0301   41.618   6.1075 12.35186 7.912211 
1 1 1   20    6   31 o   20.630   5.8073   19.944   10.177   17.546   14.764   22.114   14.047   19.738   7.1414   21.462   6.9949 -1.723967 9.996399 
1 1 1   20    6   32 o   53.122   2.7625  118.319   11.921  158.812   17.918   86.160   15.968   60.972   3.6215   44.297   4.4839 16.67546 5.763769 
1 1 1   20    6   33 o   27.435   4.3192   33.292   9.3402   47.373   16.161   26.231   11.445   31.436   6.5210   23.523   5.9622 7.913258 8.835735 
1 1 1   20    6   34 o   65.833   2.5165  180.878   13.479  169.711   24.070  185.981   16.270   61.884   4.8092   66.422   3.0128 -4.537624 5.675015 
1 1 1   20    6   35 o   17.313   5.5588   13.641   8.8917   19.832   15.056   10.325   11.018   20.469   7.2337   16.186   6.1116 4.283564 9.469872 
1 1 1   20    6   36 o   18.117   5.8135   15.168   9.7262   28.629   15.605   6.6179   12.437   23.824   7.3254   15.296   6.2642 8.528445 9.638538 
1 1 1   20    6   37 o   43.041   2.8698   78.164   10.011   78.811   16.600   77.794   12.550   41.859   4.9613   42.493   3.6589 -0.6339836 6.164593 
1 1 1   20    6   38 o   27.493   4.3401   33.668   9.4042   51.008   16.297   25.010   11.515   32.549   6.3702   22.765   6.0874 9.783997 8.811143 
1 1 1   20    6   39 o   10.847   4.8682  -2.3970   8.9397   3.5055   14.881  -5.7298   11.182   15.220   6.5712   11.364   5.2320 3.856379 8.399708 
1 1 1   20    6   40 o   22.092   6.2249   23.860   11.687   0.0000   0.0000   23.860   11.687  ?   ?    22.092   6.2249 0.000000 6.224914 
1 1 1   20    6   41 o   35.868   3.3194   55.274   9.5952   54.841   15.675   55.534   12.135   33.999   5.8677   35.360   4.2981 -1.360573 7.273466 
1 1 1   20    6   42 o   35.696   3.3521   54.871   9.6395   56.831   16.072   53.770   12.047   34.516   5.9256   34.717   4.3523 -0.2015457 7.352189 
1 1 1   20    6   43 o   19.995   5.9038   19.434   10.286   5.3128   14.855   32.438   14.255   15.498   6.6262   25.239   6.7840 -9.740406 9.483103 
1 1 1   20    6   44 o   29.652   4.2430   39.377   9.9636   42.971   15.208   36.675   13.188   29.315   6.5314   27.372   6.0699 1.942839 8.916476 
1 1 1   20    6   45 o   37.090   3.4945   59.752   10.441   60.778   16.103   59.008   13.713   35.680   5.7308   35.915   4.8046 -0.2352943 7.478334 
1 1 1   20    6   46 o   27.057   5.0541   34.301   10.737   52.182   15.530   17.927   14.861   32.660   6.0563   19.129   7.1237 13.53102 9.350196 
1 1 1   20    6   47 o   14.359   5.9215   6.2285   11.214   22.650   18.229  -3.7699   14.224   20.708   7.8516   13.026   5.9614 7.682121 9.858274 
1 1 1   20    6   48 o   36.102   4.2315   58.693   12.217   62.546   19.471   56.192   15.689   34.473   7.1632   33.903   5.8906 0.5694656 9.274170 
1 1 1   20    6   49 o   21.053   6.2347   22.692   11.457   16.110   17.855   27.299   14.938   18.594   7.5464   22.390   7.2065 -3.796471 10.43464 
1 1 1   20    6   50 o   18.092   6.2860   16.317   11.339   5.3046   17.430   24.396   14.929   15.830   6.9672   21.166   7.2185 -5.336536 10.03232 
1 1 1   20    6   51 o   32.048   5.3285   49.385   13.431   92.597   25.486   32.767   15.804   40.607   7.9842   24.189   7.3594 16.41749 10.85858 
1 1 1   20    6   52 o   26.150   6.3953   35.655   13.517   55.617   24.499   26.919   16.207   29.049   9.2163   21.753   7.5176 7.296135 11.89348 
1 1 1   20    6   53 o   18.068   7.1728   16.156   15.760   20.394   23.818   12.856   21.019   19.688   8.4032   17.877   7.7637 1.810570 11.44068 
1 1 1   20    6   54 o   21.124   7.4803   25.780   16.107   41.997   24.075   12.639   21.672   24.682   9.0898   17.796   7.8026 6.886673 11.97940 
1 1 1   20    6   55 o   34.826   6.2727   62.870   17.152   69.091   25.829   57.962   22.941   31.870   9.3411   29.793   8.8223 2.076984 12.84875 
1 1 1   20    6   56 o   28.139   6.2234   41.633   13.896   37.398   25.116   43.501   16.681   22.833   9.0580   27.477   7.3176 -4.644396 11.64450 
1 1 1   20    6   57 o   20.496   6.8039   23.803   13.267   40.079   24.995   17.417   15.655   23.288   9.0975   18.013   7.1496 5.274599 11.57076 
1 1 1   20    6   58 o   15.421   6.3986   9.9225   13.205   15.578   23.735   7.3876   15.891   18.029   8.0226   15.306   6.6970 2.723055 10.45044 
1 1 1   20    6   59 o   30.318   5.9230   47.809   14.113  -6.4338   23.744   77.441   17.549   14.810   7.0655   39.049   5.6796 -24.23937 9.065261 
1 1 1   20    6   60 o   24.798   8.9659   45.721   23.266   0.0000   0.0000   45.721   23.266  ?   ?    24.798   8.9659 0.000000 8.965920 
1 1 1   20    6   61 o   12.928   6.0543  -4.4022   15.982   0.7997   23.815  -8.6648   21.558   15.596   7.3311   13.939   6.6723 1.657253 9.912837 
1 1 1   20    6   62 o   21.254   7.5483   28.597   16.411   42.432   25.085   18.245   21.699   23.185   9.0973   18.102   7.8745 5.083111 12.03199 
1 1 1   20    6   63 o   19.948   7.3922   24.735   15.965   20.400   24.599   27.891   20.986   18.533   8.2114   20.218   8.1902 -1.684786 11.59766 
1 1 1   20    6   64 o   9.6562   4.8139 -28.6145   15.227 -32.4963   23.289 -25.7163   20.123   12.088   6.0145   11.693   5.7775 0.3954811 8.339918 
1 1 1   20    6   65 o   16.744   6.9968   14.621   15.952 -34.3690   23.585   55.927   21.656   11.997   5.9825   28.186   8.6227 -16.18848 10.49483 
1 1 1   20    6   66 o   14.631   6.5052   6.2979   15.573   13.747   24.719   1.3960   20.053   17.180   7.8614   14.692   6.8476 2.488668 10.42551 
1 1 1   20    6   67 o   13.052   6.0436  -1.1088   15.233  -5.7013   23.805   2.0754   19.822   14.493   6.9571   14.704   6.8379 -0.2103453 9.754882 
1 1 1   20    6   68 o   22.600   6.8399   30.697   13.676   28.852   18.429   32.959   20.404   20.434   7.8584   21.195   8.2369 -0.7610474 11.38419 
1 1 1   20    6   69 o   16.499   6.6870   14.783   13.997  -1.1337   19.314   32.390   20.313   14.053   6.6045   20.968   8.1984 -6.914773 10.52777 
1 1 1   20    6   70 o   12.061   5.8745 -15.2987   18.596 -15.2987   18.596   0.0000   0.0000   12.061   5.8745  ?   ?  0.000000 5.874530 
1 1 1   20    6   71 o   11.619   5.6928 -18.1190   18.229 -18.1190   18.229   0.0000   0.0000   11.619   5.6928  ?   ?  0.000000 5.692790 
1 1 1   20    6   72 o   22.108   8.0608   35.737   18.859   35.737   18.859   0.0000   0.0000   22.108   8.0608  ?   ?  0.000000 8.060782 
1 1 1   20    6   73 o   14.553   6.6981   4.4443   18.304   4.4443   18.304   0.0000   0.0000   14.553   6.6981  ?   ?  0.000000 6.698123 
1 1 1   20    6   74 o   16.079   7.1187   12.835   18.454   12.835   18.454   0.0000   0.0000   16.079   7.1187  ?   ?  0.000000 7.118673 
1 1 1   20    6   75 o   14.670   6.7544   5.3517   18.639   5.3517   18.639   0.0000   0.0000   14.670   6.7544  ?   ?  0.000000 6.754406 
1 1 1   20    6   76 o   13.530   6.3841  -1.3963   18.369  -1.3963   18.369   0.0000   0.0000   13.530   6.3841  ?   ?  0.000000 6.384135 
1 1 1   20    6   77 o   21.022   7.9954   33.629   18.939   33.629   18.939   0.0000   0.0000   21.022   7.9954  ?   ?  0.000000 7.995434 
1 1 1   20    6   78 o   20.536   7.9458   31.923   18.924   31.923   18.924   0.0000   0.0000   20.536   7.9458  ?   ?  0.000000 7.945759 
1 1 1   20    6   79 o   11.281   5.5571 -19.8356   18.126 -19.8356   18.126   0.0000   0.0000   11.281   5.5571  ?   ?  0.000000 5.557053 
1 1 1   20    7  -68 o   20.487   8.5676   35.569   23.944   0.0000   0.0000   35.569   23.944  ?   ?    20.487   8.5676 0.000000 8.567564 
1 1 1   20    7  -67 o   13.340   6.4940 -11.7663   22.633   0.0000   0.0000 -11.7663   22.633  ?   ?    13.340   6.4940 0.000000 6.494009 
1 1 1   20    7  -66 o   13.776   6.6616  -8.1115   22.800   0.0000   0.0000  -8.1115   22.800  ?   ?    13.776   6.6616 0.000000 6.661578 
1 1 1   20    7  -65 o   12.894   6.3357 -18.3622   23.085   0.0000   0.0000 -18.3622   23.085  ?   ?    12.894   6.3357 0.000000 6.335663 
1 1 1   20    7  -64 o   20.123   8.5210   32.478   24.158   0.0000   0.0000   32.478   24.158  ?   ?    20.123   8.5210 0.000000 8.520995 
1 1 1   20    7  -63 o   19.837   8.4970   30.908   24.509   0.0000   0.0000   30.908   24.509  ?   ?    19.837   8.4970 0.000000 8.497005 
1 1 1   20    7  -62 o   12.411   6.1340 -24.2161   22.741   0.0000   0.0000 -24.2161   22.741  ?   ?    12.411   6.1340 0.000000 6.134026 
1 1 1   20    7  -61 o   10.790   5.1836 -10.4745   13.277   0.0000   0.0000 -10.4745   13.277  ?   ?    10.790   5.1836 0.000000 5.183552 
1 1 1   20    7  -60 o   17.931   6.9163   19.112   14.305   0.0000   0.0000   19.112   14.305  ?   ?    17.931   6.9163 0.000000 6.916278 
1 1 1   20    7  -59 o   17.086   6.7910   16.351   14.143   0.0000   0.0000   16.351   14.143  ?   ?    17.086   6.7910 0.000000 6.790965 
1 1 1   20    7  -58 o   11.502   5.5853 -14.9693   16.469   0.0000   0.0000 -14.9693   16.469  ?   ?    11.502   5.5853 0.000000 5.585277 
1 1 1   20    7  -57 o   8.7073   4.3403 -24.8178   12.361 -37.4648   18.452 -14.5205   16.650   10.183   5.1093   11.648   5.6470 -1.464859 7.615355 
1 1 1   20    7  -56 o   13.184   5.9343   1.8450   13.393 -18.3504   19.216   20.923   18.677   12.112   5.9153   18.536   7.6427 -6.423585 9.664438 
1 1 1   20    7  -55 o   15.126   6.0091   10.680   11.068   6.4406   13.657   18.793   18.894   14.371   6.2494   18.061   7.5856 -3.690529 9.828363 
1 1 1   20    7  -54 o   19.206   6.3572   20.676   11.585   27.924   14.310   6.8887   19.735   21.555   7.0622   15.729   7.1298 5.825943 10.03532 
1 1 1   20    7  -53 o   40.552   3.2375   72.778   10.613   44.998   15.501   97.292   14.561   28.167   6.8239   46.107   3.9112 -17.94019 7.865349 
1 1 1   20    7  -52 o   9.9846   4.6573  -4.9844   9.3060  -1.4261   14.039  -7.7734   12.429   12.822   5.8885   11.016   5.2139 1.806073 7.865042 
1 1 1   20    7  -51 f   17.373   5.5651   15.610   8.9155   24.755   12.686   6.6868   12.532   20.880   6.6330   14.279   6.0951 6.600928 9.008101 
1 1 1   20    7  -50 o   10.067   4.6400  -3.5778   8.8279  -9.0297   12.583   1.7071   12.389   10.920   5.1910   12.976   5.7837 -2.055923 7.771597 
1 1 1   20    7  -49 f   27.336   4.3993   35.133   9.4701   28.535   13.819   40.976   13.004   22.326   6.8985   28.196   5.8497 -5.869661 9.044756 
1 1 1   20    7  -48 o   15.920   5.6177   12.443   9.0780   5.9045   12.988   18.690   12.694   14.341   6.1648   18.565   6.6337 -4.224388 9.055945 
1 1 1   20    7  -47 o   13.644   5.4308   7.1528   9.0572  -5.7456   13.171   18.724   12.475   11.858   5.5345   18.675   6.5859 -6.816495 8.602567 
1 1 1   20    7  -46 o   23.469   4.9666   26.663   9.2049   16.813   13.231   35.903   12.814   18.002   6.7182   26.329   6.0916 -8.327215 9.068749 
1 1 1   20    7  -45 o   28.551   5.3723   39.892   12.045   49.510   16.998   30.193   17.070   30.095   7.0527   22.589   7.7183 7.506382 10.45525 
1 1 1   20    7  -44 f   10.431   4.9653 -10.1164   11.595 -15.4696   16.382  -4.7433   16.413   11.844   5.7075   13.433   6.2385 -1.588448 8.455395 
1 1 1   20    7  -43 o   22.424   6.3288   26.349   12.070   64.539   17.399  -9.0806   16.759   35.709   6.2024   12.912   6.0940 22.79683 8.695236 
1 1 1   20    7  -42 o   21.843   5.7155   23.943   10.292   12.968   17.392   29.858   12.768   17.521   7.3125   23.882   6.4206 -6.360741 9.731262 
1 1 1   20    7  -41 o   27.487   4.8136   35.463   10.392   31.372   17.419   37.724   12.949   23.324   7.7975   27.437   5.9608 -4.112844 9.814938 
1 1 1   20    7  -40 o   19.622   6.1398   19.565   10.909   15.626   17.289   22.170   14.061   18.347   7.4333   20.418   7.0042 -2.071238 10.21337 
1 1 1   20    7  -39 o   12.615   5.3733   2.9053   9.7036   11.444   16.698  -1.4486   11.924   17.197   7.1703   12.443   5.6001 4.754084 9.098048 
1 1 1   20    7  -38 o   25.463   4.8791   30.389   9.7584   30.239   15.266   30.492   12.690   23.623   7.2419   24.458   6.3199 -0.8350639 9.611717 
1 1 1   20    7  -37 o   13.904   5.4997   6.8671   9.2335   7.0773   14.511   6.7242   11.969   15.636   6.6118   14.764   6.1058 0.8722343 8.999815 
1 1 1   20    7  -36 o   44.191   2.9386   83.325   10.525   69.867   16.061   93.453   13.934   38.649   5.2323   46.191   3.7325 -7.541615 6.427157 
1 1 1   20    7  -35 o   13.684   5.4785   6.1294   9.2704   13.630   14.544   0.9970   12.031   17.689   6.9311   13.216   5.8037 4.472184 9.040042 
1 1 1   20    7  -34 o   7.4895   3.7220 -19.7127   8.8146 -42.3731   14.220  -5.5722   11.233   8.4618   4.2757   11.304   5.2185 -2.841884 6.746483 
1 1 1   20    7  -33 o   13.292   5.3788   5.2376   9.0407   17.516   14.392  -2.7654   11.619   19.090   7.0284   12.144   5.4910 6.946202 8.919094 
1 1 1   20    7  -32 o   29.985   4.0922   39.961   9.7415   40.513   15.298   39.584   12.634   28.321   6.7270   28.880   5.5687 -0.5582886 8.732858 
1 1 1   20    7  -31 o   20.093   5.4401   19.257   9.1271   17.686   14.328   20.331   11.840   19.245   7.0246   20.302   6.4028 -1.056089 9.504827 
1 1 1   20    7  -30 o   21.869   5.2788   22.576   9.3023   28.028   14.679   18.918   12.025   23.354   7.0900   19.696   6.4750 3.658463 9.601810 
1 1 1   20    7  -29 o   11.164   4.8912  -0.2782   8.5007  -8.2142   14.441   3.9302   10.516   12.496   5.8198   13.541   5.6713 -1.044960 8.126180 
1 1 1   20    7  -28 o   12.801   5.3134   3.5874   9.1104 -12.9808   19.174   8.4187   10.354   13.778   6.5075   15.101   5.8678 -1.322881 8.762391 
1 1 1   20    7  -27 o   14.009   5.5353   6.4760   9.3442 -25.5455   19.145   16.490   10.706   12.257   5.9680   18.678   6.1079 -6.420801 8.539487 
1 1 1   20    7  -26 o   35.093   3.5590   53.182   10.040   60.277   21.341   51.166   11.378   34.030   7.8529   34.058   4.1863 -0.2770996E-01 8.899110 
1 1 1   20    7  -25 o   19.181   5.6490   17.350   9.4270   7.8951   21.095   19.710   10.538   18.106   7.8206   20.296   5.9713 -2.189671 9.839597 
1 1 1   20    7  -24 o   34.186   3.3764   50.137   9.2860   66.619   16.448   42.426   11.251   38.050   5.4590   30.761   4.6302 7.289288 7.158235 
1 1 1   20    7  -23 o   34.317   4.3023   51.987   11.771   83.359   16.877   22.273   16.426   43.106   4.8895   21.328   7.5538 21.77776 8.998193 
1 1 1   20    7  -22 o   30.970   3.9915   41.980   9.8424   61.831   16.259   30.498   12.366   36.548   5.6388   25.217   6.0858 11.33043 8.296526 
1 1 1   20    7  -21 o   25.291   5.4267   29.766   10.853   34.915   15.769   25.133   14.959   26.357   7.1568   22.473   7.2095 3.884636 10.15859 
1 1 1   20    7  -20 o   17.611   5.4877   14.239   8.7238   10.159   15.779   16.035   10.470   17.406   7.0831   18.586   6.0375 -1.179846 9.307082 
1 1 1   20    7  -19 o   15.661   5.4473   10.512   8.5158   12.313   15.602   9.7484   10.163   18.015   7.1418   15.719   5.8836 2.296473 9.253188 
1 1 1   20    7  -18 o   8.5814   4.1104 -10.2555   8.2110 -15.3848   15.468  -8.2429   9.6889   11.985   5.7136   9.9930   4.6906 1.992057 7.392315 
1 1 1   20    7  -17 o   18.930   5.3546   16.599   8.6306   27.228   15.886   12.149   10.280   23.341   7.4235   16.806   5.9735 6.534670 9.528415 
1 1 1   20    7  -16 o   17.901   5.5843   14.696   9.0312   53.744   18.542   2.5501   10.341   33.079   7.0895   13.172   5.5761 19.90699 9.019681 
1 1 1   20    7  -15 o   20.621   5.1817   19.632   8.6984 -10.0189   15.601   33.009   10.478   12.905   6.0230   27.003   4.9425 -14.09829 7.791324 
1 1 1   20    7  -14 o   25.362   4.4670   28.675   8.8976   12.193   15.866   36.236   10.746   18.120   7.1959   28.398   4.8141 -10.27781 8.657799 
1 1 1   20    7  -13 o   14.106   5.3664   7.1243   8.5331   15.871   15.525   3.3381   10.214   19.233   7.2564   13.385   5.5965 5.848516 9.163818 
1 1 1   20    7  -12 o   40.425   3.0606   69.084   10.010   75.822   14.007   62.050   14.311   41.740   4.1728   37.339   4.8139 4.401249 6.370648 
1 1 1   20    7  -11 o   40.199   3.1440   68.439   10.221   78.920   14.309   57.522   14.604   42.596   4.1746   35.721   5.1651 6.874763 6.641198 
1 1 1   20    7  -10 o   12.267   5.2421   1.3454   9.2890   6.9270   13.107  -4.2868   13.166   15.736   6.4359   12.842   5.8221 2.893832 8.678562 
1 1 1   20    7   -9 o   34.953   3.7485   52.646   10.514   56.967   15.619   49.066   14.217   35.260   5.6228   32.742   5.5232 2.517982 7.881736 
1 1 1   20    7   -8 o   11.151   4.9580  -1.8698   9.0472   13.754   18.216  -6.9855   10.424   19.159   7.6764   10.749   4.9851 8.409384 9.153032 
1 1 1   20    7   -7 o   21.361   5.1334   20.943   8.8271   16.010   14.857   23.634   10.974   19.217   7.1291   22.394   5.9220 -3.176933 9.267949 
1 1 1   20    7   -6 o   40.831   3.0222   70.360   9.9876   70.196   18.650   70.426   11.826   38.880   6.0840   40.556   3.6152 -1.676292 7.077028 
1 1 1   20    7   -5 o   31.399   4.1601   43.083   10.386   39.969   17.995   44.639   12.718   28.158   7.6450   31.442   5.1395 -3.283510 9.211990 
1 1 1   20    7   -4 o   35.262   3.8325   53.669   10.839   44.899   15.691   61.673   14.991   30.706   6.4731   37.083   5.0937 -6.376230 8.236905 
1 1 1   20    7   -3 o   13.555   5.3958   5.3624   8.9418   8.9147   13.536   2.6119   11.911   16.527   6.6187   13.976   5.9531 2.550785 8.902020 
1 1 1   20    7   -2 o   34.543   3.4501   50.981   9.5847   37.513   13.874   63.276   13.256   28.165   6.2105   38.027   4.3551 -9.861864 7.585278 
1 1 1   20    7   -1 o   18.704   5.2796   16.058   8.3993   31.947   13.719   6.5321   10.623   25.775   6.5247   14.703   5.8718 11.07280 8.777796 
1 1 1   20    7    0 o   11.090   4.8109  -0.0446   8.0531   7.1995   13.074  -4.4733   10.223   15.833   6.4458   11.201   5.0985 4.632166 8.218472 
1 1 1   20    7    1 o   22.996   4.6559   23.776   8.4279   27.817   13.450   21.164   10.814   23.991   6.6483   21.203   5.9925 2.788157 8.950392 
1 1 1   20    7    2 o   15.489   5.4637   9.9849   8.5863   9.7299   14.911   10.111   10.502   17.194   6.9256   16.053   5.9866 1.140820 9.154428 
1 1 1   20    7    3 o   28.876   3.9148   36.245   8.9775   25.748   15.136   41.942   11.151   22.939   7.2398   30.761   4.5871 -7.821999 8.570688 
1 1 1   20    7    4 o   20.505   5.1859   19.333   8.6723   34.720   15.191   11.894   10.563   26.650   6.9292   16.821   6.0464 9.829788 9.196319 
1 1 1   20    7    5 o   11.211   4.9073  -0.6144   8.5398   5.3711   14.941  -3.5184   10.407   15.959   6.7266   11.540   5.2094 4.419075 8.507958 
1 1 1   20    7    6 o   39.236   2.9286   64.859   9.2990   81.856   15.871   55.975   11.475   43.141   4.5833   35.938   3.9839 7.203453 6.072680 
1 1 1   20    7    7 o   27.685   3.9911   33.451   8.7472   45.146   14.796   27.167   10.845   31.053   6.0629   24.164   5.6135 6.889334 8.262588 
1 1 1   20    7    8 o   33.516   3.6153   48.258   9.7211   46.171   19.252   48.971   11.262   30.191   7.7757   33.463   4.2226 -3.272263 8.848259 
1 1 1   20    7    9 o   29.612   4.0701   38.299   9.5650   37.145   18.980   38.692   11.074   26.877   8.0408   29.409   4.7837 -2.532644 9.356138 
1 1 1   20    7   10 o   44.322   2.8913   82.643   10.389  113.709   20.842   72.372   11.984   50.425   5.1426   41.105   3.6133 9.319633 6.285092 
1 1 1   20    7   11 o   12.304   5.2240   1.7465   9.1202   15.313   18.207  -2.7983   10.538   19.570   7.7284   11.784   5.2871 7.786133 9.363869 
1 1 1   20    7   12 o   10.989   4.8308  -0.9182   8.3561 -16.4077   14.099   7.4692   10.375   11.186   5.3654   14.933   5.8531 -3.746898 7.940138 
1 1 1   20    7   13 o   26.564   4.2513   31.148   8.8952   31.125   14.965   31.161   11.062   25.112   7.0325   26.001   5.3959 -0.8893604 8.864141 
1 1 1   20    7   14 o   39.272   2.9852   65.133   9.4848   82.492   16.152   55.997   11.718   43.201   4.6605   35.857   4.0816 7.344013 6.195117 
1 1 1   20    7   15 o   35.921   3.2083   54.859   9.2953   38.418   15.737   63.669   11.520   27.954   6.9387   38.452   3.7217 -10.49777 7.873777 
1 1 1   20    7   16 o   13.502   5.5957   3.9260   10.082   8.7497   19.380   2.1361   11.805   18.075   7.6419   13.739   5.8913 4.335854 9.649190 
1 1 1   20    7   17 o   31.552   4.2758   43.818   10.714   68.132   20.539   34.728   12.559   37.425   6.9896   27.188   5.8408 10.23629 9.108754 
1 1 1   20    7   18 o   19.346   5.9494   17.549   10.293   13.146   19.851   19.168   12.037   19.208   7.8953   20.099   6.4692 -0.8910446 10.20714 
1 1 1   20    7   19 o   16.188   5.9197   10.840   10.182   2.8029   18.838   14.158   12.103   16.552   7.2654   17.950   6.4696 -1.398455 9.728441 
1 1 1   20    7   20 o   21.528   5.0953   21.399   8.8017   8.2076   14.990   28.340   10.873   16.626   6.8502   24.612   5.5523 -7.986639 8.817816 
1 1 1   20    7   21 o   10.634   4.7600  -2.2623   8.4866 -15.5284   14.524   4.6150   10.458   11.474   5.4881   13.860   5.7173 -2.386536 7.925037 
1 1 1   20    7   22 o   46.413   2.6351   90.362   9.9285   87.355   16.828   91.968   12.297   44.274   4.7364   46.476   3.2666 -2.201843 5.753652 
1 1 1   20    7   23 o   51.214   2.4769  109.635   10.310  114.862   17.317  106.765   12.832   51.273   4.1797   50.152   3.1547 1.120617 5.236590 
1 1 1   20    7   24 o   23.962   4.8354   26.217   9.1189   17.117   15.397   31.135   11.318   19.425   7.2476   25.764   5.5527 -6.339216 9.130162 
1 1 1   20    7   25 o   10.799   4.9494  -4.8472   9.8523  -9.2891   14.719  -1.2417   13.261   12.514   5.8438   13.439   5.9874 -0.9251385 8.366553 
1 1 1   20    7   26 o   9.3921   4.4843 -10.8463   9.6047 -14.4915   14.207  -7.7775   13.035   11.415   5.4511   11.941   5.5505 -0.5263567 7.779597 
1 1 1   20    7   27 o   20.924   5.8278   21.011   10.307   20.234   14.928   21.718   14.249   20.387   7.2029   20.948   7.0528 -0.5611534 10.08086 
1 1 1   20    7   28 o   35.137   3.3825   53.122   9.5685   58.003   15.771   50.278   12.037   35.151   5.6990   33.503   4.5231 1.647934 7.275753 
1 1 1   20    7   29 o   30.361   3.9063   40.513   9.4440   46.334   15.456   37.044   11.930   30.806   6.3656   28.129   5.3993 2.677464 8.347061 
1 1 1   20    7   30 o   48.866   2.5816  100.384   10.247   96.991   16.372  102.569   13.139   46.757   4.3452   48.920   3.3144 -2.162827 5.465008 
1 1 1   20    7   31 o   29.297   4.3880   38.558   10.157   48.707   19.352   34.699   11.933   30.192   7.8062   27.007   5.6043 3.185291 9.609607 
1 1 1   20    7   32 o   26.360   4.6037   31.671   9.5323   12.632   15.611   42.990   12.037   17.712   7.1030   30.522   5.0118 -12.80962 8.693144 
1 1 1   20    7   33 o   42.040   2.9385   75.234   10.007   69.834   16.419   78.426   12.622   38.688   5.3493   42.420   3.6867 -3.731709 6.496644 
1 1 1   20    7   34 o   33.056   3.6511   47.797   9.6742   44.508   15.705   49.808   12.281   29.683   6.6555   33.056   4.6890 -3.372839 8.141401 
1 1 1   20    7   35 o   22.797   5.1232   24.593   9.2880   32.558   15.283   19.928   11.696   24.813   7.1603   19.964   6.3717 4.848694 9.584847 
1 1 1   20    7   36 o   14.168   5.4804   7.6226   9.0007   18.306   14.885   1.4655   11.301   19.246   7.1367   12.991   5.6666 6.254166 9.112782 
1 1 1   20    7   37 o   40.980   3.2460   72.513   10.755   74.178   16.315   71.234   14.302   39.853   5.1419   39.619   4.5085 0.2341270 6.838572 
1 1 1   20    7   38 o   27.250   4.6950   34.389   10.052   34.936   15.316   33.975   13.324   25.548   7.1000   25.818   6.3706 -0.2704430 9.539115 
1 1 1   20    7   39 o   18.701   6.0154   17.439   10.409   33.835   17.982   9.1763   12.765   24.284   7.9142   15.683   6.3749 8.601559 10.16235 
1 1 1   20    7   40 o   36.990   3.8320   60.782   11.387   44.233   15.608   79.614   16.650   29.113   6.7141   41.183   5.0665 -12.07048 8.411163 
1 1 1   20    7   41 o   39.833   3.5559   69.735   11.425   74.189   19.723   67.486   14.015   38.022   6.6031   38.299   4.5800 -0.2774773 8.036000 
1 1 1   20    7   42 o   10.701   4.9574  -5.1632   10.268 -10.8648   17.961  -2.3955   12.514   13.131   6.2305   12.410   5.6457 0.7217474 8.407924 
1 1 1   20    7   43 o   18.883   5.9503   18.130   10.228   30.315   17.542   11.854   12.589   22.739   7.8225   16.356   6.4366 6.383163 10.13025 
1 1 1   20    7   44 f   13.265   5.5370   4.9595   9.9732   14.412   17.343   0.2889   12.191   17.750   7.3462   12.823   5.7250 4.927117 9.313511 
1 1 1   20    7   45 o   14.425   5.7251   8.2363   10.037   0.0945   17.447   12.264   12.272   14.569   6.6428   16.349   6.3781 -1.779787 9.209040 
1 1 1   20    7   46 o   18.485   6.3773   17.939   11.661   10.995   17.230   23.808   15.841   16.719   7.1419   20.399   7.3949 -3.679716 10.28062 
1 1 1   20    7   47 o   13.424   5.6274   5.3766   10.368   18.745   17.464  -1.9000   12.884   18.645   7.5004   12.491   5.7004 6.154314 9.420796 
1 1 1   20    7   48 o   21.338   5.9133   23.886   10.641   21.202   18.359   25.244   13.058   19.226   7.7054   21.239   6.7272 -2.012945 10.22880 
1 1 1   20    7   49 f   21.235   5.8758   23.738   10.515   23.020   18.013   24.109   12.950   19.628   7.7068   20.682   6.7145 -1.054430 10.22151 
1 1 1   20    7   50 o   21.935   5.7752   25.221   10.466   23.011   17.961   26.357   12.878   19.514   7.6855   21.593   6.6574 -2.078770 10.16799 
1 1 1   20    7   51 f   11.815   5.3911  -1.7035   11.519   8.4071   17.393  -9.6025   15.374   15.756   6.9464   11.967   5.7025 3.789235 8.987250 
1 1 1   20    7   52 o   22.531   5.6690   26.523   10.401   29.011   17.595   25.187   12.896   21.247   7.7797   20.953   6.6912 0.2934856 10.26135 
1 1 1   20    7   53 o   14.685   6.0207   9.0394   11.506   22.905   25.942   5.6442   12.837   19.097   8.4484   14.007   6.0752 5.090379 10.40592 
1 1 1   20    7   54 o   32.898   4.6713   52.097   12.175   63.733   26.458   48.971   13.713   28.339   9.6105   30.827   5.6661 -2.487137 11.15644 
1 1 1   20    7   55 o   12.817   5.7774   1.0543   12.746 -14.6398   26.091   5.9740   14.608   14.284   6.9576   14.484   6.3766 -0.2007046 9.437609 
1 1 1   20    7   56 o   15.658   6.7731   10.040   15.870 -33.5539   24.806   40.243   20.648   12.430   6.1885   23.686   8.4609 -11.25606 10.48251 
1 1 1   20    7   57 o   16.648   7.0746   13.892   16.753   4.4746   25.906   20.660   21.963   16.169   7.6147   18.384   7.9602 -2.214413 11.01579 
1 1 1   20    7   58 o   13.917   6.3713   1.7846   16.265 -34.7752   24.931   28.877   21.461   12.306   6.1388   20.140   8.2361 -7.834495 10.27223 
1 1 1   20    7   59 o   18.562   6.7130   20.327   13.044   22.831   26.237   19.504   15.034   18.600   8.3443   18.066   7.0562 0.5338211 10.92781 
1 1 1   20    7   60 o   16.817   6.5923   15.686   13.162   5.6206   26.372   19.025   15.189   16.154   7.6303   17.850   7.0558 -1.695942 10.39259 
1 1 1   20    7   61 o   8.1881   4.1302 -33.4550   12.934 -26.6766   25.279 -35.8585   15.053   12.865   6.3778   8.9339   4.5000 3.930909 7.805540 
1 1 1   20    7   62 o   17.873   8.1573   19.334   26.393   19.334   26.393   0.0000   0.0000   17.873   8.1573  ?   ?  0.000000 8.157265 
1 1 1   20    7   63 o   10.132   4.9330 -14.4319   13.075 -36.7334   26.185  -7.0247   15.091   12.338   6.1754   11.956   5.6836 0.3824625 8.392826 
1 1 1   20    7   64 o   13.341   5.9599   3.7714   13.234   22.059   26.958  -2.0351   15.190   18.136   8.2647   12.761   5.9518 5.375182 10.18474 
1 1 1   20    7   65 o   8.5868   4.2705 -21.8927   11.687  -2.8760   19.195 -33.0974   14.734   13.653   6.4670   8.9654   4.5074 4.687281 7.882827 
1 1 1   20    7   66 o   15.060   6.4967   10.099   14.522   14.715   19.841   4.7725   21.313   16.578   7.3582   15.084   7.0400 1.493590 10.18355 
1 1 1   20    7   67 o   14.816   6.5849   8.2610   15.942   20.297   25.945   0.9611   20.206   17.658   8.0701   14.324   6.7393 3.333483 10.51403 
1 1 1   20    7   68 o   12.344   5.9200  -8.0766   17.151 -13.6034   25.836  -3.7223   22.932   13.789   6.7605   14.213   6.8242 -0.4239378 9.605937 
1 1 1   20    7   69 o   24.539   9.6274   60.046   28.090   60.046   28.090   0.0000   0.0000   24.539   9.6274  ?   ?  0.000000 9.627387 
1 1 1   20    7   70 o   21.163   8.9223   42.257   26.298   42.257   26.298   0.0000   0.0000   21.163   8.9223  ?   ?  0.000000 8.922280 
1 1 1   20    7   71 o   15.350   7.3310   4.4042   25.703   4.4042   25.703   0.0000   0.0000   15.350   7.3310  ?   ?  0.000000 7.330996 
1 1 1   20    7   72 o   15.634   7.4179   7.2778   25.457   7.2778   25.457   0.0000   0.0000   15.634   7.4179  ?   ?  0.000000 7.417906 
1 1 1   20    7   73 o   12.606   6.2662 -24.9365   25.037 -24.9365   25.037   0.0000   0.0000   12.606   6.2662  ?   ?  0.000000 6.266212 
1 1 1   20    7   74 o   13.321   6.5871 -18.9686   26.328 -18.9686   26.328   0.0000   0.0000   13.321   6.5871  ?   ?  0.000000 6.587116 
1 1 1   20    8  -65 o   14.601   6.9905   0.7981   23.686   0.0000   0.0000   0.7981   23.686  ?   ?    14.601   6.9905 0.000000 6.990509 
1 1 1   20    8  -64 o   13.617   6.6515 -10.4596   24.331   0.0000   0.0000 -10.4596   24.331  ?   ?    13.617   6.6515 0.000000 6.651482 
1 1 1   20    8  -63 o   21.508   8.8795   43.147   25.254   0.0000   0.0000   43.147   25.254  ?   ?    21.508   8.8795 0.000000 8.879533 
1 1 1   20    8  -62 o   12.851   6.3570 -21.0618   24.600   0.0000   0.0000 -21.0618   24.600  ?   ?    12.851   6.3570 0.000000 6.356977 
1 1 1   20    8  -61 o   21.462   8.8360   41.575   24.915   0.0000   0.0000   41.575   24.915  ?   ?    21.462   8.8360 0.000000 8.835958 
1 1 1   20    8  -60 o   22.548   9.0937   47.158   25.743   0.0000   0.0000   47.158   25.743  ?   ?    22.548   9.0937 0.000000 9.093669 
1 1 1   20    8  -59 o   19.316   8.4095   30.295   24.788   0.0000   0.0000   30.295   24.788  ?   ?    19.316   8.4095 0.000000 8.409491 
1 1 1   20    8  -58 o   19.063   7.2476   23.944   15.558   0.0000   0.0000   23.944   15.558  ?   ?    19.063   7.2476 0.000000 7.247551 
1 1 1   20    8  -57 o   14.631   6.5015   7.4777   15.533   0.0000   0.0000   7.4777   15.533  ?   ?    14.631   6.5015 0.000000 6.501541 
1 1 1   20    8  -56 o   15.285   6.6713   10.140   15.684   0.0000   0.0000   10.140   15.684  ?   ?    15.285   6.6713 0.000000 6.671272 
1 1 1   20    8  -55 o   21.615   7.4414   30.982   15.875   0.0000   0.0000   30.982   15.875  ?   ?    21.615   7.4414 0.000000 7.441394 
1 1 1   20    8  -54 o   13.197   5.8140   4.3087   12.165   5.5764   20.588   3.6288   15.078   15.234   7.0445   13.811   6.2491 1.422940 9.416777 
1 1 1   20    8  -53 f   20.344   6.5519   24.568   12.346  -2.5728   20.112   40.980   15.640   13.992   6.6254   25.761   7.1803 -11.76852 9.769986 
1 1 1   20    8  -52 o   10.841   5.1137  -6.1079   11.768   1.1946   19.697 -10.1612   14.674   14.474   6.7596   11.385   5.4644 3.089356 8.692012 
1 1 1   20    8  -51 f   10.009   4.8274 -11.3356   11.782  -8.2138   19.585 -13.1064   14.750   13.218   6.3358   11.040   5.3434 2.177422 8.288213 
1 1 1   20    8  -50 o   22.855   6.5542   30.267   12.843   29.797   20.849   30.554   16.304   20.355   8.1927   21.606   7.5359 -1.250191 11.13152 
1 1 1   20    8  -49 o   12.421   5.8440  -5.0184   15.194  -1.0359   19.513 -11.1519   24.216   14.239   6.6749   14.075   6.8203 0.1639261 9.543035 
1 1 1   20    8  -48 o   9.6258   4.7919 -27.0753   14.865 -28.7985   19.086 -24.4186   23.698   11.065   5.4954   12.789   6.3101 -1.724023 8.367640 
1 1 1   20    8  -47 o   19.083   7.2838   22.360   15.753   26.193   20.870   17.282   24.017   19.674   8.0921   17.849   7.9972 1.825642 11.37702 
1 1 1   20    8  -46 o   13.261   5.6956   5.0492   11.068 -18.1775   19.589   15.943   13.415   12.242   5.9775   17.102   6.6696 -4.859705 8.956257 
1 1 1   20    8  -45 o   13.861   5.8248   6.8998   11.150  -1.9535   20.499   10.619   13.287   14.455   6.7968   15.427   6.4114 -0.9724016 9.343566 
1 1 1   20    8  -44 o   14.245   5.8747   8.1020   11.038   13.203   19.959   5.8544   13.249   16.935   7.4544   14.137   6.1514 2.797329 9.664770 
1 1 1   20    8  -43 o   15.398   6.2321   10.866   12.139   14.405   20.522   8.9618   15.055   17.287   7.5859   15.356   6.6194 1.931920 10.06790 
1 1 1   20    8  -42 o   23.664   5.5543   28.919   10.529   30.382   16.946   27.999   13.437   21.839   7.6781   21.978   6.8045 -0.1389275 10.25934 
1 1 1   20    8  -41 o   12.214   5.3543   2.1408   10.200  -3.8280   16.692   5.6978   12.886   13.293   6.2129   14.090   6.0992 -0.7969027 8.706278 
1 1 1   20    8  -40 o   14.981   5.8309   10.234   10.237   18.699   16.647   5.0874   12.982   18.291   7.3351   14.005   6.0916 4.285701 9.534737 
1 1 1   20    8  -39 o   32.161   4.2850   48.169   10.954   67.553   18.332   37.404   13.662   35.426   6.5906   26.252   6.4349 9.173981 9.211092 
1 1 1   20    8  -38 o   14.832   5.8037   9.6624   10.186   13.153   17.073   7.7335   12.692   16.990   7.1774   14.747   6.2068 2.243034 9.488946 
1 1 1   20    8  -37 o   9.4735   4.5528 -10.9776   10.262  -0.2025   16.852 -17.3272   12.937   14.157   6.4829   9.9634   4.8632 4.193971 8.104300 
1 1 1   20    8  -36 o   15.745   5.9407   11.645   10.406   15.955   17.361   9.2273   13.001   17.899   7.3731   15.364   6.3598 2.534277 9.736979 
1 1 1   20    8  -35 o   11.499   5.1863  -1.3537   10.288  -4.6326   17.540   0.3661   12.703   13.727   6.4001   12.964   5.8119 0.7628975 8.645179 
1 1 1   20    8  -34 o   20.819   5.8306   22.264   10.286   18.490   17.388   24.296   12.758   18.752   7.5044   21.144   6.6434 -2.392551 10.02253 
1 1 1   20    8  -33 o   28.301   4.8181   37.946   10.717   70.441   18.466   21.440   13.161   37.011   6.3491   19.907   6.7777 17.10415 9.286984 
1 1 1   20    8  -32 o   18.098   6.0102   16.621   10.352   8.8889   17.815   20.562   12.720   16.496   7.1559   19.643   6.6636 -3.147495 9.778044 
1 1 1   20    8  -31 o   35.604   3.8549   56.740   11.010   42.648   19.169   63.676   13.449   26.678   8.1028   37.124   4.5386 -10.44519 9.287280 
1 1 1   20    8  -30 f   9.4528   4.5135  -9.8603   9.7325 -10.9265   17.924  -9.4145   11.590   13.087   6.2135   10.577   5.0147 2.509315 7.984669 
1 1 1   20    8  -29 o   8.5304   4.1306 -11.9983   8.8403 -20.2210   13.451  -5.7455   11.729   9.9940   4.8953   11.349   5.2716 -1.354547 7.194046 
1 1 1   20    8  -28 o   25.706   4.7004   30.929   9.4863   36.244   14.792   27.217   12.363   26.022   6.8727   22.849   6.3897 3.173773 9.384200 
1 1 1   20    8  -27 o   19.024   5.6318   17.956   9.3497   26.462   14.426   11.794   12.277   22.060   7.0802   16.394   6.3843 5.665697 9.533488 
1 1 1   20    8  -26 o   19.509   5.6095   18.837   9.3958   16.373   14.798   20.501   12.162   18.329   7.0436   19.915   6.5097 -1.585863 9.591115 
1 1 1   20    8  -25 o   27.708   4.4940   35.282   9.8027   27.559   15.320   40.636   12.756   22.454   7.3040   28.912   5.6150 -6.457563 9.212852 
1 1 1   20    8  -24 o   28.896   4.1960   37.747   9.5948   23.787   15.131   47.136   12.409   21.070   7.2644   31.767   4.9536 -10.69663 8.792623 
1 1 1   20    8  -23 o   17.020   5.6993   13.834   9.3056   5.9912   14.553   19.258   12.103   15.324   6.5554   19.488   6.4993 -4.163994 9.231138 
1 1 1   20    8  -22 o   16.038   5.7046   11.727   9.3766  -6.8698   14.969   23.736   12.029   12.758   5.9361   21.553   6.3899 -8.794868 8.721687 
1 1 1   20    8  -21 o   16.448   5.7250   12.543   9.4071   14.695   15.353   11.249   11.903   18.061   7.1078   16.309   6.3041 1.751165 9.500684 
1 1 1   20    8  -20 o   35.030   3.9917   54.488   11.195   59.522   15.966   49.620   15.701   35.171   5.7690   31.576   6.3208 3.594519 8.557642 
1 1 1   20    8  -19 o   29.064   4.2606   38.053   9.7944   47.685   15.861   32.115   12.452   30.788   6.5230   25.440   6.0865 5.347422 8.921574 
1 1 1   20    8  -18 o   24.785   4.8990   28.631   9.5468   35.202   15.411   24.539   12.161   25.875   7.0953   22.022   6.3970 3.852879 9.553265 
1 1 1   20    8  -17 o   21.567   7.3614   24.421   15.527   24.421   15.527   0.0000   0.0000   21.567   7.3614  ?   ?  0.000000 7.361361 
1 1 1   20    8  -16 o   32.028   7.5096   54.303   19.264   54.303   19.264   0.0000   0.0000   32.028   7.5096  ?   ?  0.000000 7.509633 
1 1 1   20    8  -15 o   34.051   6.1442   56.483   16.427   56.483   16.427   0.0000   0.0000   34.051   6.1442  ?   ?  0.000000 6.144240 
1 1 1   20    8  -14 o   38.664   3.7235   65.316   11.590   65.983   16.381   64.648   16.401   37.432   5.5352   36.974   5.6183 0.4576454 7.886973 
1 1 1   20    8  -13 o   18.776   5.8247   17.000   9.8404   25.597   15.230   10.839   12.893   22.151   7.2873   16.533   6.5115 5.617531 9.772588 
1 1 1   20    8  -12 o   22.553   5.1133   23.917   9.1830   15.501   15.608   28.372   11.356   18.583   7.2090   24.171   5.8315 -5.587254 9.272393 
1 1 1   20    8  -11 o   23.887   4.8474   26.404   9.1155   21.084   15.334   29.312   11.336   20.483   7.2940   24.643   5.7490 -4.159983 9.287278 
1 1 1   20    8  -10 o   17.559   5.5153   14.523   8.7939   31.839   15.037   5.5219   10.841   24.786   7.0869   14.143   5.8262 10.64352 9.174310 
1 1 1   20    8   -9 o   13.260   5.5728   3.6174   10.209   12.475   15.580  -3.0465   13.514   17.692   7.0956   13.021   5.9013 4.670630 9.228890 
1 1 1   20    8   -8 o   29.337   4.0254   38.123   9.3730   59.256   16.480   28.018   11.396   35.193   5.9569   24.036   5.8681 11.15701 8.361776 
1 1 1   20    8   -7 o   14.977   5.6258   9.0082   9.3093  -4.5639   15.071   17.381   11.838   13.409   6.1367   18.993   6.4284 -5.583696 8.887241 
1 1 1   20    8   -6 o   14.808   5.4330   9.0525   8.5877 -13.4790   15.051   19.928   10.457   11.899   5.6622   20.254   5.9454 -8.355517 8.210234 
1 1 1   20    8   -5 o   10.568   4.7061  -1.5417   8.1835   2.7735   13.054  -4.3352   10.504   14.226   6.1484   11.232   5.1339 2.993778 8.009955 
1 1 1   20    8   -4 o   9.2843   4.3684  -7.4381   8.4926  -5.0286   15.203  -8.5311   10.239   13.390   6.1412   10.186   4.7940 3.203419 7.790789 
1 1 1   20    8   -3 o   31.793   3.4200   43.702   8.7239   31.548   13.519   52.375   11.420   25.121   6.5393   34.387   4.1585 -9.265415 7.749518 
1 1 1   20    8   -2 o   49.895   2.5082  104.472   10.169  144.638   17.709   84.715   12.420   57.703   3.7859   44.337   3.4640 13.36595 5.131482 
1 1 1   20    8   -1 o   12.980   5.1662   5.2194   8.1953   2.7769   13.002   6.8294   10.556   14.217   6.1402   14.530   5.8360 -0.3125973 8.471237 
1 1 1   20    8    0 o   17.981   5.5167   15.245   8.8564   18.085   15.723   13.924   10.719   19.551   7.3181   17.427   6.1080 2.124550 9.532127 
1 1 1   20    8    1 o   18.472   5.4174   16.135   8.6852   26.925   15.137   10.840   10.604   22.836   7.2443   16.091   6.0126 6.745268 9.414397 
1 1 1   20    8    2 o   19.735   5.6012   18.631   9.4276   39.302   19.438   12.272   10.781   26.770   8.1652   16.720   6.0947 10.04996 10.18900 
1 1 1   20    8    3 o   35.881   3.3480   55.428   9.6793   54.617   16.834   55.828   11.830   33.420   6.4127   35.508   4.1664 -2.088638 7.647366 
1 1 1   20    8    4 o   46.795   2.9559   92.967   11.217   36.758   22.438  111.697   12.952   25.379   8.8412   51.194   3.1186 -25.81408 9.375134 
1 1 1   20    8    5 o   37.441   3.2652   60.179   9.8658   39.937   17.024   70.416   12.106   27.624   7.4083   40.216   3.7356 -12.59148 8.296893 
1 1 1   20    8    6 o   40.758   3.0885   70.887   10.185   65.393   19.224   73.030   12.008   36.301   6.7450   41.029   3.6278 -4.728363 7.658703 
1 1 1   20    8    7 o   34.006   3.8242   50.661   10.417   58.512   25.374   49.070   11.424   31.518   9.2640   33.146   4.3317 -1.628363 10.22672 
1 1 1   20    8    8 o   10.918   4.9610  -3.4950   9.6263  -8.7449   23.214  -2.4047   10.579   15.645   7.3167   11.728   5.2768 3.917127 9.020969 
1 1 1   20    8    9 o   31.289   4.1783   43.562   10.391   73.601   25.240   37.432   11.402   36.403   8.6369   28.398   5.1134 8.004421 10.03707 
1 1 1   20    8   10 o   25.097   4.8388   29.052   9.5405   26.231   17.822   30.185   11.295   22.270   7.8701   25.086   5.6589 -2.815409 9.693384 
1 1 1   20    8   11 o   11.156   4.9579  -1.2441   9.0363   8.4545   17.190  -4.9475   10.622   16.951   7.1833   11.138   5.1176 5.812840 8.819805 
1 1 1   20    8   12 o   23.906   4.8782   26.500   9.1836   26.853   15.338   26.303   11.466   22.658   7.3033   23.139   6.0218 -0.4810696 9.465750 
1 1 1   20    8   13 o   42.563   2.8499   76.893   9.8309   69.471   16.254   81.174   12.345   38.650   5.2983   43.287   3.5292 -4.637257 6.366086 
1 1 1   20    8   14 o   34.488   3.6684   51.962   10.155   54.683   15.860   50.071   13.220   33.640   6.0042   32.877   5.0978 0.7638016 7.876401 
1 1 1   20    8   15 o   26.388   4.4914   31.674   9.3154   31.264   15.559   31.903   11.630   24.308   7.2821   25.711   5.6990 -1.402407 9.247008 
1 1 1   20    8   16 o   11.016   4.8982  -1.1979   8.8308 -19.5302   14.834   8.8645   10.990   10.907   5.2976   15.303   6.0164 -4.395881 8.016322 
1 1 1   20    8   17 o   9.3818   4.4218  -7.6589   8.7680   5.0984   14.961 -14.3326   10.821   15.375   6.6130   9.4862   4.5877 5.888738 8.048533 
1 1 1   20    8   18 o   19.177   5.9299   18.013   10.209   9.7715   14.701   25.689   14.187   16.538   6.7957   22.180   7.0106 -5.641319 9.763721 
1 1 1   20    8   19 o   27.111   4.9023   34.164   10.435   27.563   15.055   40.267   14.476   22.779   7.2246   28.301   6.4228 -5.522324 9.666796 
1 1 1   20    8   20 o   26.833   4.9201   33.554   10.365   15.278   15.167   49.567   14.197   18.255   7.0996   32.169   5.6185 -13.91462 9.053834 
1 1 1   20    8   21 o   11.509   5.0288   0.4134   8.9342 -11.5231   14.529   7.6712   11.329   11.818   5.6061   14.894   6.0234 -3.076102 8.228574 
1 1 1   20    8   22 o   27.179   4.5774   33.953   9.7811   33.990   15.177   33.927   12.792   25.263   7.0848   26.044   6.1285 -0.7805653 9.367620 
1 1 1   20    8   23 o   16.531   5.8026   12.763   9.6761   15.202   15.037   11.039   12.641   18.099   7.0604   16.328   6.4424 1.770288 9.557896 
1 1 1   20    8   24 o   13.913   5.5539   6.7644   9.4995 -18.3224   14.554   25.385   12.539   10.830   5.2573   22.129   6.5143 -11.29903 8.371152 
1 1 1   20    8   25 o   13.260   5.4684   4.9833   9.5641   7.8834   14.743   2.8761   12.567   15.817   6.6752   13.790   5.9959 2.026814 8.972698 
1 1 1   20    8   26 o   16.206   5.6044   12.358   9.0083   23.371   14.773   5.8388   11.366   20.838   7.1783   14.181   5.9146 6.656984 9.301087 
1 1 1   20    8   27 o   18.979   5.5345   17.788   9.0872   34.821   14.704   7.2622   11.559   25.497   6.9057   14.674   6.0275 10.82260 9.166235 
1 1 1   20    8   28 o   8.7951   4.2506 -12.0523   9.2509 -25.4931   14.305  -2.3899   12.128   9.8379   4.8629   12.263   5.5708 -2.425195 7.394704 
1 1 1   20    8   29 o   34.855   3.6321   53.733   10.168   68.322   15.453   42.593   13.504   37.968   5.1235   29.241   5.8696 8.727161 7.791206 
1 1 1   20    8   30 f   12.698   5.3192   4.0162   9.2535   10.327   13.755  -1.2016   12.507   16.100   6.5899   12.653   5.7114 3.447437 8.720469 
1 1 1   20    8   31 o   19.032   5.7051   18.249   9.5478   12.120   14.307   23.171   12.820   16.710   6.7650   20.783   6.6749 -4.072752 9.503671 
1 1 1   20    8   32 o   19.282   6.0196   19.122   10.492   15.693   18.332   20.793   12.795   18.196   7.5437   19.732   6.6832 -1.535973 10.07834 
1 1 1   20    8   33 o   11.506   5.0758   0.3530   9.3020   4.1658   14.086  -2.5959   12.387   14.411   6.3052   12.229   5.5840 2.182236 8.422389 
1 1 1   20    8   34 o   10.238   4.7318  -4.4258   9.2735   3.8666   14.238 -10.5350   12.221   14.354   6.3081   10.649   5.0773 3.704800 8.097624 
1 1 1   20    8   35 o   13.756   5.6341   6.5169   10.063  -9.8039   16.935   15.424   12.511   12.739   6.0460   17.457   6.5291 -4.717211 8.898518 
1 1 1   20    8   36 o   15.478   5.8438   11.104   10.073   23.155   17.232   4.8480   12.415   19.971   7.6192   13.948   6.0120 6.022738 9.705489 
1 1 1   20    8   37 o   8.3588   4.1134 -16.9064   9.8526 -14.4588   16.633 -18.2296   12.229   11.920   5.7456   9.4984   4.6557 2.421437 7.395125 
1 1 1   20    8   38 o   12.019   5.3135   1.0462   10.244   9.1838   17.097  -3.5113   12.795   16.055   6.9870   12.063   5.5693 3.991943 8.935031 
1 1 1   20    8   39 o   12.928   5.5928   3.5630   10.823 -16.4513   22.005   9.9495   12.430   13.364   6.4817   15.316   6.2663 -1.952707 9.015497 
1 1 1   20    8   40 o   10.442   4.8461  -4.4609   9.8794  -5.1789   16.907  -4.0887   12.174   13.197   6.1950   11.621   5.3888 1.575529 8.210761 
1 1 1   20    8   41 o   10.562   4.8810  -3.7745   9.8639 -10.9375   16.588   0.1436   12.269   12.214   5.8483   12.523   5.6543 -0.3091497 8.134757 
1 1 1   20    8   42 o   9.8835   4.6928  -8.0036   10.226   4.9439   17.068 -15.2534   12.772   14.922   6.7094   10.049   4.8888 4.873260 8.301621 
1 1 1   20    8   43 o   13.241   5.5648   5.6672   10.179   12.408   16.761   1.7278   12.813   16.459   7.0379   13.034   5.8406 3.424990 9.145732 
1 1 1   20    8   44 o   15.224   5.8642   11.168   10.274   12.763   17.167   10.278   12.824   16.541   7.0986   15.282   6.3202 1.258097 9.504514 
1 1 1   20    8   45 o   12.242   5.4836   0.9178   11.284 -32.1993   25.582   8.9177   12.573   12.740   6.3331   14.799   6.1999 -2.058228 8.862645 
1 1 1   20    8   46 o   14.587   5.9609   9.1404   11.232   0.9961   25.897   11.027   12.465   15.809   7.4952   15.408   6.2860 0.4010763 9.782174 
1 1 1   20    8   47 o   18.432   6.4336   19.245   11.884   1.1027   27.045   23.587   13.230   15.955   7.5918   19.965   6.7956 -4.009884 10.18896 
1 1 1   20    8   48 o   15.702   6.1513   12.359   11.454   56.428   27.262   2.9131   12.622   25.556   9.6213   13.145   5.8498 12.41081 11.26007 
1 1 1   20    8   49 o   14.361   6.1892   7.2790   13.155  -6.2296   25.856   11.997   15.281   14.893   7.1748   15.956   6.7677 -1.063783 9.863068 
1 1 1   20    8   50 o   10.695   5.1461 -11.1590   13.203  -7.0692   26.883 -12.4591   15.157   14.935   7.2249   11.303   5.4575 3.631676 9.054447 
1 1 1   20    8   51 f   11.803   5.5261  -4.3591   13.303 -16.3148   25.801  -0.0302   15.525   13.841   6.7795   13.311   6.1417 0.5293818 9.147766 
1 1 1   20    8   52 o   15.519   6.4256   11.722   13.277   5.1070   27.024   13.827   15.244   16.109   7.6431   16.293   6.8264 -0.1842060 10.24776 
1 1 1   20    8   53 f   15.747   6.5013   12.527   13.539   26.150   27.442   8.1440   15.565   18.849   8.4883   14.893   6.5684 3.955381 10.73287 
1 1 1   20    8   54 o   12.246   5.6587  -1.5541   13.252 -14.5828   26.426   2.8232   15.317   14.007   6.8611   13.710   6.2408 0.2969179 9.274811 
1 1 1   20    8   55 o   9.7019   4.7715 -18.3087   13.192 -41.4484   25.745 -10.0693   15.362   11.925   5.9903   11.601   5.5738 0.3242693 8.182328 
1 1 1   20    8   56 o   13.239   5.9164   3.6376   13.052 -29.8255   25.287   15.792   15.240   12.533   6.2409   16.693   6.8954 -4.160295 9.300280 
1 1 1   20    8   57 o   18.425   6.8538   21.028   13.749   0.0433   26.770   28.547   16.024   15.315   7.3585   20.578   7.4406 -5.262372 10.46470 
1 1 1   20    8   58 o   18.603   7.2745   22.726   15.993   0.0000   0.0000   22.726   15.993  ?   ?    18.603   7.2745 0.000000 7.274464 
1 1 1   20    8   59 o   16.130   7.3371   12.127   21.128   0.0000   0.0000   12.127   21.128  ?   ?    16.130   7.3371 0.000000 7.337139 
1 1 1   20    8   60 o   11.515   5.7264 -27.3863   20.997   0.0000   0.0000 -27.3863   20.997  ?   ?    11.515   5.7264 0.000000 5.726412 
1 1 1   20    8   61 o   16.749   7.5445   16.037   21.693   0.0000   0.0000   16.037   21.693  ?   ?    16.749   7.5445 0.000000 7.544517 
1 1 1   20    8   62 o   11.203   5.4211 -11.5397   15.165   0.0000   0.0000 -11.5397   15.165  ?   ?    11.203   5.4211 0.000000 5.421098 
1 1 1   20    8   63 o   12.447   6.0948 -15.1056   20.790   0.0000   0.0000 -15.1056   20.790  ?   ?    12.447   6.0948 0.000000 6.094753 
1 1 1   20    8   64 o   12.250   5.9837 -13.9647   19.683   0.0000   0.0000 -13.9647   19.683  ?   ?    12.250   5.9837 0.000000 5.983673 
1 1 1   20    8   65 o   16.659   7.5127   16.945   21.585   0.0000   0.0000   16.945   21.585  ?   ?    16.659   7.5127 0.000000 7.512715 
1 1 1   20    8   66 o   16.825   7.5662   17.914   21.718   0.0000   0.0000   17.914   21.718  ?   ?    16.825   7.5662 0.000000 7.566225 
1 1 1   20    9  -59 o   13.093   6.4129 -12.3007   23.075   0.0000   0.0000 -12.3007   23.075  ?   ?    13.093   6.4129 0.000000 6.412887 
1 1 1   20    9  -58 o   13.091   6.4111 -12.1894   23.045   0.0000   0.0000 -12.1894   23.045  ?   ?    13.091   6.4111 0.000000 6.411142 
1 1 1   20    9  -57 o   14.169   6.8599  -3.7703   24.358   0.0000   0.0000  -3.7703   24.358  ?   ?    14.169   6.8599 0.000000 6.859873 
1 1 1   20    9  -56 o   19.413   8.4633   33.653   25.181   0.0000   0.0000   33.653   25.181  ?   ?    19.413   8.4633 0.000000 8.463266 
1 1 1   20    9  -55 o   11.221   5.6537 -41.7037   23.864   0.0000   0.0000 -41.7037   23.864  ?   ?    11.221   5.6537 0.000000 5.653688 
1 1 1   20    9  -54 o   19.221   7.3997   25.811   16.353   0.0000   0.0000   25.811   16.353  ?   ?    19.221   7.3997 0.000000 7.399717 
1 1 1   20    9  -53 o   12.453   6.1729 -23.2005   23.652   0.0000   0.0000 -23.2005   23.652  ?   ?    12.453   6.1729 0.000000 6.172856 
1 1 1   20    9  -52 o   31.054   9.6440   81.993   26.968   0.0000   0.0000   81.993   26.968  ?   ?    31.054   9.6440 0.000000 9.643973 
1 1 1   20    9  -51 o   10.991   5.3853 -16.8715   16.313 -24.7882   22.312  -7.7791   23.911   12.042   5.9738   13.897   6.7444 -1.855243 9.009630 
1 1 1   20    9  -50 o   12.381   5.6601   0.5657   12.776  -2.9910   21.582   2.4844   15.852   14.012   6.6989   13.598   6.2491 0.4145870 9.161148 
1 1 1   20    9  -49 o   13.292   5.9297   4.2051   13.053   6.9564   21.413   2.5781   16.467   15.350   7.1276   13.788   6.3485 1.561689 9.544951 
1 1 1   20    9  -48 o   13.796   6.0410   6.2966   12.953   12.993   21.452   2.4545   16.250   16.340   7.4174   13.741   6.3195 2.599131 9.744425 
1 1 1   20    9  -47 o   11.137   5.2794  -6.5226   12.840   0.4255   20.185 -11.2452   16.641   14.279   6.7237   11.825   5.7117 2.454114 8.822185 
1 1 1   20    9  -46 o   25.008   6.5719   36.673   13.569   25.845   22.108   43.218   17.188   18.854   8.0729   25.518   7.6558 -6.663794 11.12574 
1 1 1   20    9  -45 o   12.334   5.6312   0.1936   12.593 -11.8195   20.143   7.9009   16.134   12.812   6.2112   14.855   6.6122 -2.043366 9.071917 
1 1 1   20    9  -44 o   10.966   5.2106  -7.3040   12.655   41.944   21.299 -34.1767   15.733   23.153   8.5456   9.2960   4.6715 13.85696 9.739107 
1 1 1   20    9  -43 o   14.213   6.0992   7.7315   12.672   10.723   21.710   6.1855   15.607   16.167   7.3861   14.441   6.4602 1.726067 9.812633 
1 1 1   20    9  -42 o   12.125   5.5641  -0.8699   12.501 -12.0927   21.026   5.2662   15.547   13.073   6.3398   14.266   6.4098 -1.192733 9.015433 
1 1 1   20    9  -41 o   14.898   6.2084   10.014   12.508  -4.7684   21.072   18.056   15.542   13.955   6.6571   17.483   7.0605 -3.527854 9.704009 
1 1 1   20    9  -40 o   10.750   5.0358  -4.9822   11.072   27.851   21.198 -17.3006   12.984   19.715   8.1369   9.7673   4.7895 9.947704 9.441813 
1 1 1   20    9  -39 f   10.485   4.9557  -6.6809   11.156 -27.4875   20.354   2.2533   13.338   11.520   5.7132   13.140   5.9176 -1.620234 8.225458 
1 1 1   20    9  -38 o   13.121   5.6874   4.6614   11.236 -11.6282   21.328   10.919   13.219   13.323   6.4426   15.366   6.3912 -2.042753 9.074927 
1 1 1   20    9  -37 o   10.999   5.2489  -9.0059   13.122   0.0000   0.0000  -9.0059   13.122  ?   ?    10.999   5.2489 0.000000 5.248924 
1 1 1   20    9  -36 o   10.223   4.9639 -14.1066   13.001   0.0000   0.0000 -14.1066   13.001  ?   ?    10.223   4.9639 0.000000 4.963929 
1 1 1   20    9  -35 o   26.264   6.5901   39.171   14.084   0.0000   0.0000   39.171   14.084  ?   ?    26.264   6.5901 0.000000 6.590059 
1 1 1   20    9  -34 o   20.423   6.2710   23.493   11.441   9.4282   21.612   28.970   13.486   16.302   7.4175   22.132   6.8107 -5.830212 10.06999 
1 1 1   20    9  -33 o   13.665   5.8096   6.2213   11.306   19.280   21.662   1.3324   13.254   18.138   7.8792   13.011   5.8756 5.126882 9.828763 
1 1 1   20    9  -32 o   11.507   5.2595  -1.7165   11.025   18.683   21.043  -9.4353   12.944   18.046   7.8028   10.909   5.2079 7.136822 9.381172 
1 1 1   20    9  -31 o   36.542   3.8409   61.164   11.270   53.848   18.315   65.622   14.298   29.813   7.5342   36.656   4.9083 -6.842985 8.992000 
1 1 1   20    9  -30 o   19.881   6.0420   21.590   10.656   12.528   17.369   27.060   13.495   16.521   7.1158   21.465   6.8436 -4.943598 9.872639 
1 1 1   20    9  -29 o   18.489   6.4257   19.060   11.848   0.1656   16.956   37.090   16.563   13.974   6.4369   24.390   7.5553 -10.41657 9.925543 
1 1 1   20    9  -28 f   19.107   6.3466   20.299   11.543   20.855   17.609   19.879   15.286   18.727   7.5321   18.520   7.1479 0.2069931 10.38386 
1 1 1   20    9  -27 o   12.422   5.5171   1.4938   11.171  -4.1218   16.804   5.9408   14.954   13.275   6.2138   14.673   6.4559 -1.398167 8.960509 
1 1 1   20    9  -26 o   29.971   5.0979   44.197   12.009   37.197   18.122   49.678   16.035   24.011   7.9512   29.934   6.7351 -5.922705 10.42037 
1 1 1   20    9  -25 o   24.747   5.4519   31.067   10.700   23.182   14.352   40.935   16.056   19.941   7.0611   26.446   7.2385 -6.505255 10.11214 
1 1 1   20    9  -24 o   13.340   5.4558   6.3367   9.4184   10.102   13.917   3.1545   12.793   15.625   6.5328   13.492   5.9524 2.132986 8.837890 
1 1 1   20    9  -23 o   17.282   5.7796   15.392   9.5701   0.5099   13.714   29.518   13.361   13.222   5.9732   22.921   6.7184 -9.699148 8.989758 
1 1 1   20    9  -22 o   11.290   5.1738  -2.8638   10.762 -12.7395   13.692   13.098   17.407   10.908   5.2466   17.020   7.2212 -6.111629 8.925887 
1 1 1   20    9  -21 o   20.884   6.1056   23.232   11.047   35.017   14.332   5.9818   17.340   25.029   6.8341   15.456   6.8687 9.572276 9.689385 
1 1 1   20    9  -20 o   10.728   4.9988  -5.4278   10.675  -5.2978   13.669  -5.6311   17.092   12.131   5.6538   13.337   6.2504 -1.205845 8.428105 
1 1 1   20    9  -19 o   12.887   5.3533   4.9555   9.2572  -3.2734   13.297   12.695   12.895   12.381   5.7021   16.444   6.5010 -4.063050 8.647360 
1 1 1   20    9  -18 o   13.834   5.6592   6.7454   10.137   3.4501   13.776   10.636   14.969   14.039   6.1858   16.179   6.7707 -2.140611 9.170924 
1 1 1   20    9  -17 o   20.081   5.8721   20.892   10.217   22.991   16.225   19.512   13.153   20.052   7.4479   19.007   6.7568 1.044744 10.05617 
1 1 1   20    9  -16 o   16.158   5.7363   12.680   9.4773  -7.5389   13.937   30.071   12.926   11.917   5.6037   23.631   6.5053 -11.71367 8.586097 
1 1 1   20    9  -15 o   28.072   4.4601   36.741   9.8650   27.550   14.273   45.149   13.650   22.130   7.0361   29.953   5.8003 -7.823324 9.118681 
1 1 1   20    9  -14 o   22.044   5.4000   24.211   9.6251   13.230   14.147   33.675   13.133   16.895   6.7665   25.227   6.3826 -8.332090 9.301783 
1 1 1   20    9  -13 o   13.843   5.5565   7.0815   9.5623   10.592   14.033   4.0386   13.065   16.094   6.6291   14.031   6.1070 2.062113 9.013361 
1 1 1   20    9  -12 o   18.898   5.7691   18.184   9.7010   5.8736   14.294   28.696   13.209   14.885   6.4336   23.006   6.6620 -8.120543 9.261403 
1 1 1   20    9  -11 o   33.935   3.7083   51.380   10.091   49.528   15.043   52.896   13.607   31.133   6.1459   33.134   5.2096 -2.000757 8.056782 
1 1 1   20    9  -10 o   31.338   4.4087   45.366   10.951   61.436   14.987   26.960   16.040   35.639   5.3218   21.654   7.4790 13.98417 9.179148 
1 1 1   20    9   -9 o   13.736   5.6752   6.0113   10.326 -13.9033   14.267   27.926   14.966   11.142   5.3581   22.251   7.2176 -11.10910 8.989104 
1 1 1   20    9   -8 o   16.482   5.9553   13.086   10.263   15.471   14.485   10.682   14.542   17.742   6.9272   16.283   6.7317 1.458437 9.659317 
1 1 1   20    9   -7 o   9.8873   4.6142  -5.7896   9.1530   9.4533   14.316 -16.3272   11.903   15.897   6.6348   9.6582   4.7034 6.239280 8.132750 
1 1 1   20    9   -6 o   31.884   4.0029   45.947   10.175   37.112   15.454   52.707   13.518   25.906   7.1058   33.161   5.1696 -7.254814 8.787323 
1 1 1   20    9   -5 o   22.163   6.0075   25.278   11.122   33.133   14.963   15.578   16.628   24.438   7.0947   18.008   7.2921 6.430019 10.17390 
1 1 1   20    9   -4 o   19.050   5.9847   18.566   10.354   8.9947   18.317   23.061   12.552   16.646   7.2381   20.767   6.5978 -4.121468 9.793900 
1 1 1   20    9   -3 o   19.788   5.9984   20.115   10.512  -2.2717   18.423   30.922   12.801   14.528   6.6986   24.261   6.3866 -9.732910 9.255227 
1 1 1   20    9   -2 o   12.683   5.4600   2.7767   10.217  -0.5440   17.977   4.3608   12.417   14.694   6.7162   13.975   6.0179 0.7183752 9.017903 
1 1 1   20    9   -1 o   32.483   4.3035   48.319   11.115   25.560   19.093   59.985   13.670   20.978   8.0161   35.769   4.8102 -14.79057 9.348521 
1 1 1   20    9    0 o   18.078   5.7467   16.387   9.5212   12.952   14.804   18.810   12.434   17.037   6.8871   18.972   6.5832 -1.935705 9.527317 
1 1 1   20    9    1 o   10.539   4.8267  -3.4946   9.3457   11.309   14.606 -13.7574   12.161   16.517   6.7790   10.166   4.9034 6.351392 8.366480 
1 1 1   20    9    2 o   17.049   5.5477   14.286   8.8376   13.070   12.195   15.630   12.825   16.709   6.4010   17.716   6.6138 -1.007320 9.204090 
1 1 1   20    9    3 o   24.007   4.5258   26.960   8.5320   41.093   12.849   15.814   11.411   28.795   5.6760   17.733   6.2945 11.06166 8.475710 
1 1 1   20    9    4 o   22.847   4.6800   24.691   8.4226   34.309   12.510   16.715   11.392   25.926   6.0331   18.114   6.3003 7.811850 8.723016 
1 1 1   20    9    5 o   27.207   4.3190   34.106   9.2589   28.609   15.056   37.449   11.742   22.555   7.2326   27.685   5.3970 -5.130306 9.024247 
1 1 1   20    9    6 o   20.156   5.3758   20.152   8.9946  -1.3242   14.356   34.031   11.540   13.323   6.0557   26.206   5.5739 -12.88294 8.230467 
1 1 1   20    9    7 o   28.185   4.1743   36.320   9.3009   25.614   14.700   43.467   12.011   21.417   7.1630   30.151   5.0664 -8.733719 8.773707 
1 1 1   20    9    8 o   11.024   4.9102  -0.6677   8.9135   2.0945   14.314  -2.4170   11.392   14.028   6.2370   11.835   5.3852 2.193000 8.240203 
1 1 1   20    9    9 o   31.139   3.8027   43.483   9.4523   25.220   14.761   56.177   12.306   21.224   7.1785   34.906   4.4243 -13.68197 8.432368 
1 1 1   20    9   10 o   12.791   5.2879   4.7440   8.9723   3.0787   12.268   6.6587   13.155   13.538   5.9046   14.796   6.2776 -1.258202 8.618200 
1 1 1   20    9   11 o   27.825   4.3603   35.807   9.5651   26.324   15.019   42.278   12.407   21.576   7.2407   29.429   5.3697 -7.852673 9.014460 
1 1 1   20    9   12 o   25.760   5.1492   32.193   10.434   26.135   14.747   38.267   14.766   21.532   7.1740   26.579   6.7912 -5.046209 9.878581 
1 1 1   20    9   13 o   17.089   5.9132   14.570   10.029   12.508   14.191   16.626   14.175   16.696   6.7454   18.030   6.9025 -1.333792 9.651135 
1 1 1   20    9   14 o   14.234   5.6622   7.9267   9.8400   5.7755   13.869   10.107   13.963   14.710   6.3474   15.921   6.5905 -1.210567 9.150114 
1 1 1   20    9   15 o   27.501   4.2605   34.913   9.2423   38.477   14.547   32.501   11.968   26.682   6.6991   25.171   5.9309 1.510365 8.947278 
1 1 1   20    9   16 o   18.183   5.5406   16.674   8.9530   24.781   13.910   10.941   11.698   21.051   6.9660   15.727   6.1998 5.324381 9.325365 
1 1 1   20    9   17 o   13.794   5.3795   7.6699   8.7274  -3.4136   13.430   15.771   11.482   12.440   5.7300   17.552   6.3047 -5.111352 8.519510 
1 1 1   20    9   18 o   18.503   5.5377   17.356   9.0012   17.204   14.018   17.462   11.742   18.107   6.8805   18.232   6.3926 -0.1245728 9.391882 
1 1 1   20    9   19 o   8.6031   4.1799 -12.7514   9.2553  -7.5363   13.357 -17.5674   12.836   11.625   5.4723   9.9029   4.8360 1.721684 7.302989 
1 1 1   20    9   20 o   16.376   5.7701   13.319   9.5746   18.884   13.956   8.3701   13.160   18.624   6.9095   15.107   6.3368 3.516965 9.375311 
1 1 1   20    9   21 o   15.084   5.8894   10.112   10.470  -4.0156   14.062   27.684   15.683   12.498   5.7941   21.594   7.3976 -9.095898 9.396597 
1 1 1   20    9   22 o   9.0227   4.3341 -10.1275   9.2748 -21.7289   13.341   0.7254   12.903   9.6197   4.7440   13.005   5.8416 -3.385195 7.525264 
1 1 1   20    9   23 o   15.456   5.7138   11.468   9.5281   21.784   13.833   2.1553   13.143   19.579   6.9323   13.395   5.9645 6.184661 9.145090 
1 1 1   20    9   24 o   10.726   4.8714  -1.9493   9.2686   4.7081   13.462  -7.9486   12.780   14.083   6.1628   11.207   5.2991 2.875731 8.127756 
1 1 1   20    9   25 o   10.074   4.7110  -5.5351   9.6203  -1.1565   14.278  -9.1755   13.019   13.025   5.9654   11.095   5.2757 1.930080 7.963581 
1 1 1   20    9   26 o   10.698   4.9443  -3.8047   10.122   11.122   16.483 -12.8406   12.825   16.230   6.9604   10.431   5.0323 5.798968 8.589028 
1 1 1   20    9   27 o   8.7821   4.2933 -14.8307   10.196 -22.5569   16.368  -9.9309   13.034   10.766   5.2986   10.945   5.2252 -0.1792440 7.441590 
1 1 1   20    9   28 f   12.555   5.5767   1.7485   11.415   15.521   16.814 -10.0298   15.548   17.273   7.1980   11.929   5.6984 5.343562 9.180621 
1 1 1   20    9   29 o   33.029   5.2424   54.377   13.644   84.644   24.521   40.805   16.420   36.398   8.4304   25.928   7.4032 10.47014 11.21958 
1 1 1   20    9   30 o   10.544   5.0409  -9.8531   12.222  -1.8910   20.653 -14.1441   15.162   14.544   6.8337   11.198   5.4190 3.346863 8.721524 
1 1 1   20    9   31 o   15.130   6.1074   10.449   11.623 -18.9427   21.628   22.384   13.782   12.798   6.2558   19.461   6.9166 -6.662602 9.326005 
1 1 1   20    9   32 o   18.352   6.3281   18.827   11.482   8.0239   21.926   22.908   13.478   16.187   7.4057   19.682   6.8525 -3.494816 10.08959 
1 1 1   20    9   33 o   13.303   5.9301   2.9446   13.027   0.0000   0.0000   2.9446   13.027  ?   ?    13.303   5.9301 0.000000 5.930099 
1 1 1   20    9   34 o   15.229   6.0949   10.997   11.470   3.2683   22.437   13.731   13.346   15.490   7.2274   16.327   6.5606 -0.8369617 9.760952 
1 1 1   20    9   35 o   13.971   5.7622   7.8203   10.620  -5.8639   17.434   15.894   13.392   13.026   6.1681   17.020   6.6562 -3.994291 9.074722 
1 1 1   20    9   36 o   12.280   5.3963   2.5463   10.419 -26.8604   16.713   21.241   13.326   10.375   5.1506   18.945   6.7936 -8.570730 8.525378 
1 1 1   20    9   37 o   11.153   5.2050  -4.4463   11.645  -7.5867   25.790  -3.6420   13.052   14.734   7.1151   11.883   5.5336 2.851342 9.013638 
1 1 1   20    9   38 o   16.302   6.5250   13.960   13.147   0.0000   0.0000   13.960   13.147  ?   ?    16.302   6.5250 0.000000 6.525010 
1 1 1   20    9   39 f   16.306   6.3078   14.209   11.924   1.2208   27.732   17.155   13.208   15.865   7.5870   17.349   6.6576 -1.484151 10.09384 
1 1 1   20    9   40 o   16.743   6.3820   15.483   12.083   3.5529   27.987   18.216   13.396   16.092   7.6752   17.674   6.7238 -1.582544 10.20380 
1 1 1   20    9   41 o   19.924   6.5226   23.421   12.208 -18.3311   28.186   33.062   13.544   14.089   6.9378   23.622   6.7167 -9.533608 9.656476 
1 1 1   20    9   42 o   14.879   6.1541   10.221   12.161   6.0194   27.568   11.236   13.551   16.204   7.6970   15.366   6.4369 0.8372717 10.03387 
1 1 1   20    9   43 o   10.061   4.9248 -16.5546   13.539 -18.1270   27.076 -16.0303   15.633   13.821   6.8048   10.959   5.3486 2.861969 8.655231 
1 1 1   20    9   44 o   14.498   6.6187   4.8237   17.392   18.537   27.038  -4.8551   22.715   17.608   8.1173   14.183   6.8050 3.424720 10.59238 
1 1 1   20    9   45 o   16.328   6.6653   14.655   14.025  -2.8498   27.234   20.973   16.361   15.130   7.3078   18.138   7.2724 -3.007190 10.30975 
1 1 1   20    9   46 o   16.377   6.6382   14.911   13.796  -0.8483   26.410   20.825   16.178   15.186   7.2997   18.079   7.2375 -2.892871 10.27940 
1 1 1   20    9   47 o   18.788   7.0502   22.549   14.612   15.031   29.588   24.975   16.805   17.146   8.0940   19.195   7.4708 -2.049084 11.01479 
1 1 1   20    9   48 o   14.071   6.4239   4.1008   16.382   0.0000   0.0000   4.1008   16.382  ?   ?    14.071   6.4239 0.000000 6.423869 
1 1 1   20    9   49 o   17.234   7.1565   18.293   16.536   0.0000   0.0000   18.293   16.536  ?   ?    17.234   7.1565 0.000000 7.156512 
1 1 1   20    9   50 o   31.143   7.0412   58.787   17.454   0.0000   0.0000   58.787   17.454  ?   ?    31.143   7.0412 0.000000 7.041157 
1 1 1   20    9   51 o   20.103   7.5092   28.306   16.538   0.0000   0.0000   28.306   16.538  ?   ?    20.103   7.5092 0.000000 7.509197 
1 1 1   20    9   52 o   13.067   6.1110  -0.8158   16.195   0.0000   0.0000  -0.8158   16.195  ?   ?    13.067   6.1110 0.000000 6.111002 
1 1 1   20    9   53 o   15.791   6.8410   13.146   16.237   0.0000   0.0000   13.146   16.237  ?   ?    15.791   6.8410 0.000000 6.840957 
1 1 1   20    9   54 o   16.041   6.9126   14.299   16.406   0.0000   0.0000   14.299   16.406  ?   ?    16.041   6.9126 0.000000 6.912574 
1 1 1   20    9   55 o   12.069   5.7506  -5.8531   15.628   0.0000   0.0000  -5.8531   15.628  ?   ?    12.069   5.7506 0.000000 5.750553 
1 1 1   20    9   56 o   15.051   6.6555   10.434   16.083   0.0000   0.0000   10.434   16.083  ?   ?    15.051   6.6555 0.000000 6.655479 
1 1 1   20    9   57 o   14.631   6.5277   8.7998   15.822   0.0000   0.0000   8.7998   15.822  ?   ?    14.631   6.5277 0.000000 6.527746 
1 1 1   20    9   58 o   10.888   5.3258 -14.9809   15.756   0.0000   0.0000 -14.9809   15.756  ?   ?    10.888   5.3258 0.000000 5.325796 
1 1 1   20    9   59 o   18.305   7.9863   26.764   22.458   0.0000   0.0000   26.764   22.458  ?   ?    18.305   7.9863 0.000000 7.986262 
1 1 1   20    9   60 o   17.413   7.9628   22.440   25.311   0.0000   0.0000   22.440   25.311  ?   ?    17.413   7.9628 0.000000 7.962821 
1 1 1   20   10  -51 o   16.409   7.7254   15.853   26.635   0.0000   0.0000   15.853   26.635  ?   ?    16.409   7.7254 0.000000 7.725374 
1 1 1   20   10  -50 o   11.574   5.6072 -10.3698   16.343   0.0000   0.0000 -10.3698   16.343  ?   ?    11.574   5.6072 0.000000 5.607154 
1 1 1   20   10  -49 o   12.563   5.9654  -3.3070   16.528   0.0000   0.0000  -3.3070   16.528  ?   ?    12.563   5.9654 0.000000 5.965448 
1 1 1   20   10  -48 o   15.167   6.7662   11.106   16.995   0.0000   0.0000   11.106   16.995  ?   ?    15.167   6.7662 0.000000 6.766202 
1 1 1   20   10  -47 o   14.311   6.2039   9.0732   13.373   24.152   22.692   1.0491   16.553   17.778   7.8814   13.288   6.2027 4.490130 10.02947 
1 1 1   20   10  -46 o   13.521   6.0144   5.8051   13.327   5.2082   22.048   6.1488   16.729   14.850   7.0029   14.229   6.4943 0.6207523 9.550760 
1 1 1   20   10  -45 o   16.344   6.5761   15.926   13.427   28.913   22.411   8.6522   16.771   18.836   8.0976   14.747   6.6390 4.088578 10.47125 
1 1 1   20   10  -44 f   15.243   6.6564   11.417   15.633   10.611   22.087   12.226   22.131   15.693   7.2706   15.938   7.3463 -0.2450209 10.33579 
1 1 1   20   10  -43 o   12.554   5.9132  -2.6478   15.633  -4.4375   22.227  -0.8961   21.990   13.815   6.6547   14.178   6.7736 -0.3631468 9.495627 
1 1 1   20   10  -42 o   20.176   8.3470   34.374   22.379   0.0000   0.0000   34.374   22.379  ?   ?    20.176   8.3470 0.000000 8.347010 
1 1 1   20   10  -41 o   10.305   5.1991 -42.1875   20.561   0.0000   0.0000 -42.1875   20.561  ?   ?    10.305   5.1991 0.000000 5.199145 
1 1 1   20   10  -40 o   14.354   6.8542  -0.6535   22.457   0.0000   0.0000  -0.6535   22.457  ?   ?    14.354   6.8542 0.000000 6.854248 
1 1 1   20   10  -39 o   18.433   7.2800   22.876   16.157   29.252   23.145   16.815   22.565   19.103   8.2209   16.853   7.6331 2.250120 11.21817 
1 1 1   20   10  -38 o   25.735   6.7500   40.001   14.333   48.432   22.775   34.472   18.443   23.922   8.8356   21.505   7.9494 2.417097 11.88530 
1 1 1   20   10  -37 o   14.041   6.1807   6.8687   13.721   5.1847   21.911   7.9550   17.598   15.109   7.0797   14.938   6.7557 0.1713915 9.785774 
1 1 1   20   10  -36 o   25.125   6.8459   38.527   14.400   29.083   22.756   44.834   18.596   19.256   8.2161   25.047   8.0387 -5.791430 11.49456 
1 1 1   20   10  -35 o   11.233   5.3463  -7.1743   13.429   1.5389   21.469 -12.7744   17.212   14.603   6.8937   11.789   5.7213 2.814041 8.958594 
1 1 1   20   10  -34 o   10.938   5.2342  -8.7125   13.248 -21.2743   21.857  -1.4185   16.655   12.284   6.0605   13.185   6.1765 -0.9018841 8.653250 
1 1 1   20   10  -33 o   12.512   5.6105   2.2747   11.847   27.447   22.242  -7.6940   13.997   19.088   8.1330   11.386   5.4301 7.701594 9.779164 
1 1 1   20   10  -32 o   18.125   6.4240   19.484   11.881   18.264   22.417   19.961   14.011   17.322   7.7464   17.973   6.8670 -0.6501312 10.35191 
1 1 1   20   10  -31 o   14.582   6.0532   9.7469   11.825   23.437   22.393   4.4535   13.924   18.311   7.9821   13.617   6.0962 4.693927 10.04377 
1 1 1   20   10  -30 o   15.008   6.0980   11.061   11.674   31.924   22.362   3.2443   13.688   20.165   8.3432   13.309   5.9940 6.855907 10.27312 
1 1 1   20   10  -29 o   26.604   5.7521   38.072   12.110   60.820   23.175   29.527   14.204   28.010   8.9723   21.637   7.0325 6.372246 11.39992 
1 1 1   20   10  -28 o   13.648   6.1204   4.1375   14.101   9.8681   21.094  -0.4926   18.960   15.939   7.2814   13.976   6.5607 1.962582 9.801110 
1 1 1   20   10  -27 o   19.673   7.0504   24.448   14.350   32.434   22.282   18.789   18.758   20.451   8.3810   17.560   7.4750 2.891138 11.23013 
1 1 1   20   10  -26 o   14.518   6.3366   7.6688   14.152   7.8547   21.556   7.5280   18.761   15.740   7.2530   15.289   6.9387 0.4504824 10.03754 
1 1 1   20   10  -25 o   14.156   5.9571   8.0872   11.688   24.208   21.875   1.6463   13.827   18.751   8.0294   13.096   5.9486 5.654968 9.992855 
1 1 1   20   10  -24 f   13.562   5.8474   5.9452   11.752 -12.1592   22.038   13.140   13.893   13.354   6.4792   15.998   6.5935 -2.644461 9.244130 
1 1 1   20   10  -23 o   16.830   6.3259   15.701   11.775   22.207   22.016   13.095   13.935   18.412   7.9710   16.011   6.6016 2.401230 10.34980 
1 1 1   20   10  -22 o   21.213   6.5132   26.286   12.342   15.072   22.194   31.306   14.850   17.108   7.6747   22.343   7.1847 -5.234892 10.51292 
1 1 1   20   10  -21 o   31.486   5.0784   49.702   12.591   57.582   24.730   46.944   14.629   26.648   9.2819   29.067   6.3521 -2.419224 11.24734 
1 1 1   20   10  -20 o   37.713   4.2581   67.294   12.862   37.390   23.571   79.973   15.348   21.691   8.7179   40.494   4.7393 -18.80240 9.922845 
1 1 1   20   10  -19 o   18.675   6.1453   19.603   10.831   25.930   16.744   15.052   14.201   19.911   7.5306   16.677   6.7440 3.234518 10.10897 
1 1 1   20   10  -18 o   11.565   5.1426   1.0458   9.7359   4.8865   13.538  -3.0687   14.012   13.821   6.1092   12.321   5.7364 1.500076 8.380253 
1 1 1   20   10  -17 o   9.9054   4.7674 -10.7684   11.348 -16.7188   16.097  -4.8894   16.001   11.143   5.4360   12.684   5.9767 -1.540548 8.079043 
1 1 1   20   10  -16 f   9.3278   4.4680  -9.0552   9.7017 -23.7153   13.858   5.0350   13.586   9.4888   4.7073   13.882   6.1288 -4.393029 7.727942 
1 1 1   20   10  -15 o   16.671   5.8703   14.876   9.9087   22.135   14.159   7.9090   13.871   19.107   6.9818   14.665   6.3380 4.442209 9.429508 
1 1 1   20   10  -14 o   12.176   5.2833   3.1404   9.7166  -0.3091   13.778   6.5538   13.705   12.786   5.8576   14.296   6.2381 -1.510123 8.557139 
1 1 1   20   10  -13 o   14.098   5.6326   8.7298   9.7796   7.4249   14.047   9.9571   13.623   14.595   6.3426   15.184   6.4127 -0.5884237 9.019472 
1 1 1   20   10  -12 o   12.759   5.3977   5.0030   9.6784   14.353   13.941  -3.6969   13.447   16.521   6.6815   12.036   5.6091 4.484289 8.723806 
1 1 1   20   10  -11 o   12.230   5.2940   3.2775   9.7088   12.381   13.911  -5.3675   13.556   15.936   6.5858   11.788   5.5380 4.147754 8.604796 
1 1 1   20   10  -10 o   9.8487   4.6942  -8.4322   10.431   21.000   17.265 -25.3493   13.090   18.505   7.4528   8.9980   4.4822 9.506955 8.696830 
1 1 1   20   10   -9 o   10.320   4.8563  -6.0841   10.499 -29.4304   16.857   8.7150   13.421   10.217   5.0891   14.840   6.3202 -4.622970 8.114386 
1 1 1   20   10   -8 o   24.765   5.5669   31.982   10.964   28.018   17.351   34.617   14.146   20.639   7.6951   24.279   6.8510 -3.640169 10.30295 
1 1 1   20   10   -7 o   26.645   4.9000   35.075   10.251   13.781   14.190   58.311   14.823   16.413   6.7028   33.652   5.6006 -17.23840 8.734681 
1 1 1   20   10   -6 o   26.825   4.8277   35.352   10.168   36.903   14.380   33.800   14.380   25.167   6.8344   23.836   6.9653 1.331762 9.758269 
1 1 1   20   10   -5 o   14.014   5.6100   8.4231   9.7206   13.172   13.782   3.7228   13.712   16.207   6.6106   13.683   6.0927 2.524151 8.990028 
1 1 1   20   10   -4 o   15.293   5.7936   11.561   9.9205   19.126   13.867   3.6306   14.198   18.173   6.8576   13.801   6.1687 4.372548 9.223836 
1 1 1   20   10   -3 o   10.019   4.7553  -7.7177   10.481 -16.9956   13.693   5.4097   16.288   10.191   4.9806   14.695   6.5849 -4.504212 8.256396 
1 1 1   20   10   -2 f   10.757   5.0984  -7.6375   11.966   2.2914   13.779 -38.0846   24.130   13.390   6.0239   11.928   5.9640 1.462176 8.476825 
1 1 1   20   10   -1 o   10.949   5.0541  -3.1735   10.529   12.422   14.031 -23.2750   15.930   16.021   6.6169   10.440   5.1551 5.581402 8.387971 
1 1 1   20   10    0 o   14.450   5.6676   9.5261   9.7329   5.8598   13.943   13.010   13.592   14.257   6.2546   16.153   6.5738 -1.896530 9.073859 
1 1 1   20   10    1 o   10.007   4.7554  -7.9798   10.546 -24.3939   16.847   2.5970   13.524   10.685   5.2807   13.382   5.9981 -2.697437 7.991383 
1 1 1   20   10    2 f   22.949   5.4781   27.364   10.105   13.417   14.288   41.323   14.294   16.337   6.7049   27.150   6.5375 -10.81329 9.364507 
1 1 1   20   10    3 o   12.625   5.5101   3.2861   10.699   2.6938   17.530   3.6377   13.506   14.459   6.6177   13.611   6.0545 0.8482208 8.969454 
1 1 1   20   10    4 o   24.396   5.2037   30.159   10.032   25.996   14.389   34.097   13.995   20.645   7.0854   24.166   6.8127 -3.520948 9.829366 
1 1 1   20   10    5 o   13.749   5.6026   7.6052   9.8876   11.672   14.140   3.7135   13.832   15.806   6.5949   13.715   6.1121 2.091398 8.991705 
1 1 1   20   10    6 o   16.460   6.4560   14.210   12.629   13.665   14.405   16.021   26.257   16.402   6.7321   17.772   8.1208 -1.369667 10.54839 
1 1 1   20   10    7 o   16.782   6.7979   14.951   14.456   14.951   14.456   0.0000   0.0000   16.782   6.7979  ?   ?  0.000000 6.797873 
1 1 1   20   10    9 o   20.685   6.0622   23.638   10.879   24.503   14.345   22.466   16.690   20.033   7.0625   18.985   7.4290 1.048552 10.25031 
1 1 1   20   10   10 o   14.357   5.8566   8.8254   10.819   17.090   14.319  -2.1685   16.515   17.416   6.8612   13.324   6.2114 4.092068 9.255168 
1 1 1   20   10   11 o   11.299   5.0200   0.7499   9.2556   7.0254   11.350 -11.7099   15.992   13.886   5.8582   11.748   5.6556 2.137528 8.142753 
1 1 1   20   10   12 o   10.952   5.0211  -2.2316   10.150   4.6615   13.056 -12.7613   16.136   13.680   6.0251   11.658   5.6294 2.021405 8.245718 
1 1 1   20   10   13 o   19.547   6.0508   21.206   10.626   20.102   13.794   22.818   16.664   18.440   6.8639   19.035   7.4307 -0.5949402 10.11573 
1 1 1   20   10   14 o   11.848   5.2854   1.0530   10.369   1.1894   13.424   0.8513   16.327   12.980   5.8825   13.757   6.3296 -0.7763433 8.640988 
1 1 1   20   10   15 o   14.430   5.8146   9.2943   10.515   12.661   13.609   4.3070   16.563   15.948   6.5444   14.447   6.5417 1.501895 9.253284 
1 1 1   20   10   16 f   13.555   5.6892   6.6724   10.616  -1.6839   13.872   18.486   16.494   12.538   5.7923   17.743   7.2338 -5.204956 9.267073 
1 1 1   20   10   17 o   20.213   5.9992   22.620   10.598   13.771   13.633   36.136   16.849   16.272   6.5978   23.477   7.6614 -7.205397 10.11081 
1 1 1   20   10   18 o   10.186   4.8032  -6.2768   10.368  -5.5866   13.465  -7.2820   16.248   11.679   5.4969   12.401   5.8962 -0.7221212 8.061082 
1 1 1   20   10   19 o   8.7642   4.2922 -14.9144   10.329 -26.3245   13.284   2.5324   16.426   8.9707   4.4760   14.046   6.4201 -5.075609 7.826405 
1 1 1   20   10   20 o   11.632   5.2368   0.2192   10.436  -1.5043   13.511   2.7680   16.430   12.422   5.7308   14.079   6.4297 -1.656495 8.612936 
1 1 1   20   10   21 o   9.3177   4.5053 -11.3996   10.422  -0.6409   13.606 -26.6744   16.212   12.615   5.7945   10.160   5.0488 2.455099 7.685463 
1 1 1   20   10   22 o   10.646   4.9625  -4.2779   10.537 -11.9390   13.680   6.8983   16.522   10.765   5.1944   14.880   6.6525 -4.114699 8.440274 
1 1 1   20   10   23 o   13.300   5.7949   4.8979   11.792   14.386   16.518  -4.9622   16.839   16.553   7.0292   12.873   6.0855 3.680200 9.297425 
1 1 1   20   10   24 f   19.995   6.4405   23.362   11.929   19.688   16.712   27.179   17.034   17.924   7.2912   20.123   7.5990 -2.199377 10.53115 
1 1 1   20   10   25 o   11.011   5.1851  -5.6931   12.009 -32.1429   16.977   20.800   16.991   9.9594   4.9830   18.189   7.3690 -8.229144 8.895650 
1 1 1   20   10   26 o   25.804   6.0455   36.650   12.492   33.118   17.571   40.261   17.764   21.850   7.8050   24.294   7.8622 -2.443611 11.07846 
1 1 1   20   10   27 o   11.413   5.2019  -0.8554   10.688   5.3166   17.182  -4.7504   13.650   14.586   6.6279   11.800   5.5478 2.786021 8.643377 
1 1 1   20   10   28 o   12.696   5.7049   2.1496   12.320  -1.1314   28.688   2.8916   13.642   15.528   7.5000   13.255   5.9757 2.273111 9.589551 
1 1 1   20   10   29 o   25.006   6.3694   35.831   13.017  -2.8004   28.271   46.224   14.664   15.282   7.3968   28.462   6.4678 -13.17945 9.825710 
1 1 1   20   10   30 o   26.892   6.1267   40.258   13.130   28.579   28.716   43.345   14.763   18.943   8.5922   27.137   6.7117 -8.193785 10.90289 
1 1 1   20   10   31 o   13.045   5.8030   3.7108   12.409  -7.4260   27.861   6.4666   13.859   14.745   7.1839   14.065   6.2006 0.6801424 9.489772 
1 1 1   20   10   32 o   14.706   6.4761   8.2926   15.079 -18.3223   27.796   19.392   17.950   13.828   6.8247   17.547   7.3832 -3.719377 10.05420 
1 1 1   20   10   33 o   10.508   5.1263 -15.0922   14.314  -7.9136   28.807 -17.4457   16.495   14.808   7.2344   11.051   5.4147 3.757409 9.036379 
1 1 1   20   10   34 o   17.426   6.9922   18.663   15.137 -16.9720   29.442   31.467   17.648   14.183   7.0042   20.979   7.7724 -6.796860 10.46274 
1 1 1   20   10   35 o   11.533   5.5158  -8.2024   14.667 -21.9791   28.871  -3.4103   17.028   13.706   6.7985   12.961   6.1248 0.7450943 9.150576 
1 1 1   20   10   36 o   15.220   6.5814   10.820   14.973  -8.2232   28.805   17.870   17.527   14.704   7.1943   17.082   7.2467 -2.377748 10.21140 
1 1 1   20   10   37 o   16.295   7.0532   14.670   17.231   0.0000   0.0000   14.670   17.231  ?   ?    16.295   7.0532 0.000000 7.053154 
1 1 1   20   10   38 o   19.553   7.1513   25.362   14.861   55.003   29.917   15.653   17.123   22.767   9.5525   16.490   7.0834 6.277058 11.89226 
1 1 1   20   10   39 o   12.691   5.8885  -0.4471   14.571   1.7095   28.246  -1.2291   17.008   15.419   7.4461   13.207   6.2041 2.212353 9.692036 
1 1 1   20   10   40 o   14.937   6.8482   7.4246   18.881   8.4467   30.477   6.7880   24.052   16.209   7.8041   15.476   7.3032 0.7327957 10.68831 
1 1 1   20   10   41 o   12.696   6.0318  -4.2850   16.942   0.0000   0.0000  -4.2850   16.942  ?   ?    12.696   6.0318 0.000000 6.031805 
1 1 1   20   10   42 o   39.195   6.1492   85.951   19.001   0.0000   0.0000   85.951   19.001  ?   ?    39.195   6.1492 0.000000 6.149230 
1 1 1   20   10   43 o   10.672   5.2711 -20.6925   16.692   0.0000   0.0000 -20.6925   16.692  ?   ?    10.672   5.2711 0.000000 5.271079 
1 1 1   20   10   44 f   15.561   6.8759   12.257   17.135   0.0000   0.0000   12.257   17.135  ?   ?    15.561   6.8759 0.000000 6.875915 
1 1 1   20   10   45 o   10.257   5.0851 -22.5387   16.075   0.0000   0.0000 -22.5387   16.075  ?   ?    10.257   5.0851 0.000000 5.085059 
1 1 1   20   10   46 o   10.519   5.1888 -19.3750   15.998   0.0000   0.0000 -19.3750   15.998  ?   ?    10.519   5.1888 0.000000 5.188763 
1 1 1   20   10   47 o   12.379   5.8780  -4.0181   16.043   0.0000   0.0000  -4.0181   16.043  ?   ?    12.379   5.8780 0.000000 5.877982 
1 1 1   20   10   48 o   16.439   7.0133   16.875   16.577   0.0000   0.0000   16.875   16.577  ?   ?    16.439   7.0133 0.000000 7.013317 
1 1 1   20   10   49 o   14.603   6.5746   8.7913   16.452   0.0000   0.0000   8.7913   16.452  ?   ?    14.603   6.5746 0.000000 6.574591 
1 1 1   20   10   50 o   15.745   6.8172   14.208   16.106   0.0000   0.0000   14.208   16.106  ?   ?    15.745   6.8172 0.000000 6.817182 
1 1 1   20   10   51 o   20.935   7.5828   32.418   16.651   0.0000   0.0000   32.418   16.651  ?   ?    20.935   7.5828 0.000000 7.582782 
1 1 1   20   10   52 o   11.867   5.9188 -26.9668   23.131   0.0000   0.0000 -26.9668   23.131  ?   ?    11.867   5.9188 0.000000 5.918848 
1 1 1   20   10   53 o   13.662   6.6078  -4.7350   22.457   0.0000   0.0000  -4.7350   22.457  ?   ?    13.662   6.6078 0.000000 6.607779 
1 1 1   20   11  -43 o   18.129   7.9918   27.409   23.017   0.0000   0.0000   27.409   23.017  ?   ?    18.129   7.9918 0.000000 7.991791 
1 1 1   20   11  -42 o   16.143   7.3957   15.803   21.967   0.0000   0.0000   15.803   21.967  ?   ?    16.143   7.3957 0.000000 7.395743 
1 1 1   20   11  -41 o   15.228   6.5454   12.717   14.638   9.3434   24.617   14.562   18.206   15.399   7.3027   15.804   7.0297 -0.4051924 10.13642 
1 1 1   20   11  -40 o   18.178   6.9176   22.483   14.182   31.350   23.238   17.219   17.903   18.799   8.1637   16.356   7.1333 2.443426 10.84114 
1 1 1   20   11  -39 o   10.451   5.0802 -11.8848   13.714 -26.6828   21.795  -2.1860   17.645   11.507   5.7400   12.922   6.1440 -1.415823 8.408139 
1 1 1   20   11  -38 o   14.332   6.2147   9.6595   13.426   40.536   22.680  -6.9979   16.658   20.896   8.4961   12.031   5.7868 8.864261 10.27961 
1 1 1   20   11  -37 o   11.031   5.2715  -6.8046   13.335   25.059   22.959 -23.0275   16.382   17.691   7.8802   10.233   5.0834 7.458708 9.377542 
1 1 1   20   11  -36 o   10.523   5.1044 -11.3114   13.650   3.7651   22.957 -19.5570   16.978   14.627   6.9696   10.765   5.3168 3.862309 8.766067 
1 1 1   20   11  -35 o   9.9712   4.8866 -15.2057   13.455 -44.8844   22.628   1.0274   16.735   10.612   5.3661   13.256   6.2037 -2.643689 8.202451 
1 1 1   20   11  -34 o   18.567   7.5302   25.709   17.764   28.184   23.507   22.414   27.124   18.332   8.0790   17.241   8.0115 1.091112 11.37779 
1 1 1   20   11  -33 o   11.343   5.5603 -15.5949   17.452  -1.8118   22.594 -35.9812   27.479   14.009   6.7384   12.254   6.1602 1.754928 9.129855 
1 1 1   20   11  -32 o   12.518   5.9779  -4.9554   17.089  -3.8857   22.628  -6.3753   26.071   13.816   6.6702   14.120   6.8946 -0.3031778 9.593095 
1 1 1   20   11  -31 f   20.713   7.1057   29.015   14.471   55.865   23.876   13.425   18.193   24.825   9.0669   15.776   7.0216 9.048964 11.46780 
1 1 1   20   11  -30 o   15.065   7.1131   6.1145   22.875   6.1145   22.875   0.0000   0.0000   15.065   7.1131  ?   ?  0.000000 7.113085 
1 1 1   20   11  -29 o   10.907   5.2453  -9.0709   13.672 -25.8042   21.956   1.5275   17.474   11.740   5.8411   13.596   6.3549 -1.855473 8.631490 
1 1 1   20   11  -28 o   10.074   4.9368 -15.7246   13.727 -11.9338   22.040 -18.1269   17.545   12.950   6.3270   11.169   5.4950 1.781097 8.380082 
1 1 1   20   11  -27 o   12.069   5.6482  -2.2501   13.874 -22.4431   22.672   9.8370   17.541   12.194   6.0444   15.080   6.7892 -2.886035 9.089972 
1 1 1   20   11  -26 o   12.447   5.6468   1.9408   12.410   24.787   22.883  -7.5786   14.771   18.025   7.9562   11.529   5.5200 6.495754 9.683572 
1 1 1   20   11  -25 o   11.822   5.4721  -1.1901   12.470   27.786   23.282 -12.8469   14.767   18.582   8.1188   10.838   5.2688 7.744601 9.678631 
1 1 1   20   11  -24 o   27.724   6.0340   43.221   13.248   67.745   25.385   34.040   15.531   27.642   9.4130   22.346   7.3593 5.295710 11.94838 
1 1 1   20   11  -23 o   17.502   6.5860   18.893   12.771  -5.1882   23.582   28.886   15.191   13.997   6.7700   20.573   7.2664 -6.576172 9.931444 
1 1 1   20   11  -22 f   15.433   6.3213   12.782   12.668   1.8274   23.286   17.386   15.097   14.744   7.0236   16.833   6.8986 -2.089188 9.844885 
1 1 1   20   11  -21 o   9.0037   4.4551 -19.3335   12.118 -33.0380   22.247 -13.5519   14.450   11.378   5.6945   10.667   5.1918 0.7110996 7.706007 
1 1 1   20   11  -20 o   14.874   6.2096   10.919   12.546   25.561   23.441   5.0412   14.853   18.308   8.0679   13.798   6.2265 4.509615 10.19120 
1 1 1   20   11  -19 o   15.759   6.3531   13.702   12.559   14.835   23.038   13.223   14.980   16.527   7.5726   15.734   6.6882 0.7930574 10.10329 
1 1 1   20   11  -18 o   17.694   6.5559   19.120   12.556   33.862   23.922   13.514   14.752   19.914   8.4579   15.809   6.6746 4.105146 10.77434 
1 1 1   20   11  -17 o   12.800   5.7234   3.3386   12.233   26.006   23.187  -5.4045   14.401   18.472   8.0856   11.807   5.5953 6.664514 9.832870 
1 1 1   20   11  -16 o   35.881   5.6632   68.838   16.015   0.0000   0.0000   68.838   16.015  ?   ?    35.881   5.6632 0.000000 5.663176 
1 1 1   20   11  -15 f   26.044   7.8839   47.112   18.168   0.0000   0.0000   47.112   18.168  ?   ?    26.044   7.8839 0.000000 7.883937 
1 1 1   20   11  -14 o   18.283   7.1242   21.835   15.296   0.0000   0.0000   21.835   15.296  ?   ?    18.283   7.1242 0.000000 7.124204 
1 1 1   20   11  -13 o   15.491   6.3099   12.692   12.536   6.1334   23.034   15.452   14.943   15.375   7.2216   16.406   6.8070 -1.031161 9.923988 
1 1 1   20   11  -12 f   10.194   4.8448  -7.0204   10.950  -7.4202   16.928  -6.7326   14.359   12.339   5.9082   11.617   5.5287 0.7225733 8.091518 
1 1 1   20   11  -11 o   9.0524   4.4284 -14.2963   10.901 -25.5162   16.512  -5.6267   14.514   10.234   5.0874   11.842   5.6135 -1.607870 7.575848 
1 1 1   20   11  -10 o   7.7360   3.8829 -25.1571   10.707 -10.2348   16.435 -36.1602   14.112   11.828   5.7039   8.4423   4.2652 3.385679 7.122180 
1 1 1   20   11   -9 o   12.909   5.6143   4.9432   11.025   7.0299   16.784   3.3596   14.621   14.645   6.6128   13.477   6.1201 1.167539 9.010232 
1 1 1   20   11   -8 o   10.266   4.8574  -6.1908   10.774 -16.2267   16.066   2.0115   14.525   10.997   5.3791   13.187   6.0310 -2.189356 8.081299 
1 1 1   20   11   -7 o   17.884   6.2367   18.759   11.167  -9.1000   16.512   42.242   15.159   12.003   5.7701   26.199   6.9751 -14.19585 9.052427 
1 1 1   20   11   -6 f   15.771   6.0773   13.570   11.038   10.592   16.717   15.872   14.697   15.370   6.7915   16.550   6.7972 -1.180310 9.608662 
1 1 1   20   11   -5 o   13.877   5.8058   8.1726   11.003  -0.3183   16.778   14.579   14.574   13.352   6.2365   16.180   6.7187 -2.828156 9.167073 
1 1 1   20   11   -4 o   12.675   5.6686   2.9067   12.006   21.046   16.954 -15.3419   17.005   17.924   7.3239   11.418   5.5737 6.506174 9.203597 
1 1 1   20   11   -3 o   24.826   6.8857   37.853   14.421   35.079   24.763   39.277   17.740   20.207   8.5945   23.518   7.8691 -3.311903 11.65287 
1 1 1   20   11   -2 o   12.431   5.4901   3.2892   10.911   0.4069   14.195   7.4507   17.057   12.794   5.8922   14.785   6.6721 -1.990734 8.901417 
1 1 1   20   11   -1 o   13.105   5.8131   4.2465   12.362   3.5354   14.386   6.2547   24.175   13.467   6.0977   15.566   7.3385 -2.098907 9.541207 
1 1 1   20   11    0 o   21.102   6.6609   27.308   12.811   32.050   14.945   14.166   24.882   22.130   7.2151   16.675   7.7223 5.455772 10.56839 
1 1 1   20   11    1 o   11.370   5.3290  -4.0304   12.427  -3.0078   14.339  -7.1154   24.906   12.224   5.7277   14.197   6.8884 -1.973477 8.958620 
1 1 1   20   11    2 o   14.747   6.4412   9.0355   14.646   9.0355   14.646   0.0000   0.0000   14.747   6.4412  ?   ?  0.000000 6.441250 
1 1 1   20   11    3 o   18.900   6.5959   21.884   12.491   26.392   14.667   9.9798   23.834   20.050   7.1343   16.017   7.4651 4.033632 10.32600 
1 1 1   20   11    4 o   9.8736   4.7955 -12.7139   12.153 -21.2387   14.213   10.472   23.439   9.7597   4.8284   16.047   7.4535 -6.287341 8.880747 
1 1 1   20   11    5 o   18.769   6.6051   21.606   12.543   15.372   14.701   38.285   24.047   16.409   6.7746   21.022   8.6705 -4.613314 11.00329 
1 1 1   20   11    6 f   20.168   6.6807   25.154   12.793   26.250   14.948   22.152   24.732   19.908   7.1881   17.856   8.0482 2.051785 10.79089 
1 1 1   20   11    7 o   11.938   5.5254  -1.5508   12.711   2.3062   18.990  -4.6817   17.110   14.237   6.6450   12.777   6.0677 1.460361 8.998550 
1 1 1   20   11    8 o   11.457   5.2453  -0.8481   11.025   9.6885   14.582 -14.9080   16.844   14.885   6.4653   11.408   5.5644 3.476293 8.530119 
1 1 1   20   11    9 o   12.272   5.4962   2.1572   11.332  -4.5312   14.676   12.031   17.832   12.072   5.6993   15.780   6.9914 -3.707603 9.020072 
1 1 1   20   11   10 o   10.836   5.0680  -4.0299   11.139   6.2469   14.798 -17.4661   16.920   14.121   6.3056   11.154   5.4690 2.966773 8.346947 
1 1 1   20   11   11 o   9.8555   4.7304  -9.1728   10.999   1.7724   14.578 -23.6362   16.758   13.147   6.0239   10.491   5.1997 2.656118 7.957664 
1 1 1   20   11   12 f   13.251   5.7090   6.0161   11.186   0.2874   14.585   14.200   17.433   12.866   5.9422   16.201   7.0528 -3.335347 9.222366 
1 1 1   20   11   13 o   20.484   6.3384   24.926   11.661   20.352   15.254   31.358   18.089   17.836   7.0644   20.677   7.8255 -2.841406 10.54252 
1 1 1   20   11   14 o   11.729   5.3509  -0.1082   11.342  -6.0548   14.893   8.1028   17.501   11.890   5.6508   14.935   6.7473 -3.044253 8.800982 
1 1 1   20   11   15 f   21.646   6.2686   27.487   11.695   16.283   15.262   43.422   18.201   16.617   6.8855   24.661   7.9564 -8.044287 10.52210 
1 1 1   20   11   16 o   16.136   6.4684   14.737   12.941   11.666   18.606   17.615   18.011   15.721   7.0418   16.942   7.2710 -1.220887 10.12200 
1 1 1   20   11   17 o   12.344   5.6453   0.6265   12.724   14.000   18.368 -11.7131   17.643   16.152   7.1289   11.983   5.8103 4.169128 9.196820 
1 1 1   20   11   18 o   20.834   7.3540   29.672   15.558 -17.1116   28.638   49.261   18.531   13.898   6.8717   26.526   7.9472 -12.62767 10.50611 
1 1 1   20   11   19 o   13.573   6.1993   3.3935   15.279   35.511   28.718  -9.2874   18.045   19.521   8.7458   12.370   5.9679 7.151395 10.58800 
1 1 1   20   11   20 o   15.928   6.7685   13.944   15.334   33.888   29.382   6.4777   17.977   19.183   8.6970   14.640   6.7009 4.542641 10.97906 
1 1 1   20   11   21 o   13.106   6.0669   0.9032   15.332   6.8159   29.635  -1.2579   17.916   15.972   7.6914   13.381   6.3109 2.591283 9.949096 
1 1 1   20   11   22 f   8.2688   4.1955 -41.4715   14.621 -29.7084   28.340 -45.7381   17.068   12.955   6.4752   8.9435   4.5373 4.011267 7.906643 
1 1 1   20   11   23 o   16.576   6.9423   16.580   15.758   14.849   29.805   17.252   18.564   16.737   7.9654   16.742   7.2832 -0.4655838E-02 10.79317 
1 1 1   20   11   24 o   17.999   7.1531   21.668   15.689   21.698   30.190   21.656   18.364   17.458   8.2212   17.728   7.4640 -0.2702312 11.10400 
1 1 1   20   11   25 o   15.094   6.9073   8.7418   19.087  -0.7978   29.331   15.749   25.138   15.153   7.3800   16.604   7.7143 -1.450813 10.67595 
1 1 1   20   11   26 o   12.476   5.8691  -2.4350   15.317  -2.8969   28.548  -2.2482   18.151   14.864   7.2484   13.221   6.2700 1.643140 9.584018 
1 1 1   20   11   27 o   13.313   6.1166   2.6724   15.173   19.885   29.338  -3.6125   17.728   17.160   8.0879   12.922   6.1481 4.237178 10.15942 
1 1 1   20   11   28 o   11.596   5.5520  -7.4022   14.945  -6.6649   27.923  -7.6982   17.693   14.432   7.0658   12.369   5.9530 2.062689 9.239251 
1 1 1   20   11   29 o   16.694   6.9297   17.426   15.496  -8.3567   28.531   28.215   18.456   14.361   7.0538   19.287   7.7271 -4.925569 10.46251 
1 1 1   20   11   30 o   16.254   7.2683   15.442   19.733 -29.9992   29.600   51.791   26.474   13.046   6.5350   22.633   9.1879 -9.587285 11.27489 
1 1 1   20   11   31 f   10.453   5.2303 -30.4946   18.709   8.3004   29.475 -56.6728   24.212   15.865   7.6477   10.474   5.3232 5.390961 9.317956 
1 1 1   20   11   32 o   20.471   7.9396   33.205   18.928   30.035   29.167   35.511   24.879   18.252   8.4201   19.608   8.4812 -1.356314 11.95109 
1 1 1   20   11   33 o   15.544   7.0187   12.299   18.907   13.773   28.453   11.133   25.300   16.279   7.7574   15.815   7.4712 0.4644480 10.77015 
1 1 1   20   11   34 o   10.826   5.3772 -23.7481   18.302 -37.2566   28.000 -13.6727   24.182   12.267   6.1735   13.122   6.4548 -0.8549652 8.931760 
1 1 1   20   11   35 o   16.483   7.6538   17.024   24.688   0.0000   0.0000   17.024   24.688  ?   ?    16.483   7.6538 0.000000 7.653831 
1 1 1   20   11   36 o   12.855   6.3436 -15.9730   23.983   0.0000   0.0000 -15.9730   23.983  ?   ?    12.855   6.3436 0.000000 6.343610 
1 1 1   20   11   37 o   12.804   6.3315 -17.1596   24.333   0.0000   0.0000 -17.1596   24.333  ?   ?    12.804   6.3315 0.000000 6.331518 
1 1 1   20   11   38 o   14.293   6.9271  -1.1738   25.008   0.0000   0.0000  -1.1738   25.008  ?   ?    14.293   6.9271 0.000000 6.927070 
1 1 1   20   11   42 o   13.901   6.7925  -6.1190   25.431   0.0000   0.0000  -6.1190   25.431  ?   ?    13.901   6.7925 0.000000 6.792497 
1 1 1   20   11   43 o   13.169   6.4722 -12.3836   24.144   0.0000   0.0000 -12.3836   24.144  ?   ?    13.169   6.4722 0.000000 6.472236 
1 1 1   20   12  -29 o   24.216   9.1909   58.343   24.993   0.0000   0.0000   58.343   24.993  ?   ?    24.216   9.1909 0.000000 9.190884 
1 1 1   20   12  -28 o   14.407   6.9140   2.4593   23.477   0.0000   0.0000   2.4593   23.477  ?   ?    14.407   6.9140 0.000000 6.913956 
1 1 1   20   12  -27 o   12.443   6.1524 -17.1635   22.960   0.0000   0.0000 -17.1635   22.960  ?   ?    12.443   6.1524 0.000000 6.152428 
1 1 1   20   12  -26 o   11.344   5.4565  -7.6932   14.811 -35.8612   25.998   5.8431   18.022   11.811   5.9446   14.117   6.5497 -2.306005 8.845117 
1 1 1   20   12  -25 o   14.549   6.3568   10.442   14.274   26.433   24.342   2.0626   17.621   17.633   7.9628   13.460   6.3204 4.173170 10.16626 
1 1 1   20   12  -24 o   12.797   5.9049   2.1718   14.356   17.326   24.287  -5.9674   17.799   16.279   7.5700   12.399   5.9683 3.880039 9.639812 
1 1 1   20   12  -23 f   16.877   6.8202   18.992   14.513   29.363   24.123   13.109   18.168   18.140   8.0790   15.409   6.9257 2.731398 10.64123 
1 1 1   20   12  -22 o   13.621   6.3407   3.7012   17.109   0.0000   0.0000   3.7012   17.109  ?   ?    13.621   6.3407 0.000000 6.340664 
1 1 1   20   12  -21 o   16.682   7.2090   19.279   17.943   0.0000   0.0000   19.279   17.943  ?   ?    16.682   7.2090 0.000000 7.209023 
1 1 1   20   12  -20 o   15.077   6.8100   11.522   17.815   0.0000   0.0000   11.522   17.815  ?   ?    15.077   6.8100 0.000000 6.810033 
1 1 1   20   12  -19 o   10.711   5.0923  -5.6826   12.119 -19.8366   22.191   0.3331   14.467   12.067   5.9811   12.494   5.8209 -0.4273090 8.346018 
1 1 1   20   12  -18 o   9.7242   4.7916 -17.1222   13.516 -17.0304   22.132 -17.1768   17.069   12.293   6.0714   10.965   5.3997 1.327767 8.125206 
1 1 1   20   12  -17 o   21.609   7.0980   32.101   14.452   45.166   23.726   24.394   18.222   21.522   8.7121   17.927   7.4838 3.594744 11.48511 
1 1 1   20   12  -16 o   9.1338   4.5532 -23.4249   13.612 -31.6812   22.261 -18.4942   17.203   11.252   5.6409   10.893   5.3748 0.3593359 7.791494 
1 1 1   20   12  -15 o   12.431   5.7731   0.3843   14.055   31.934   24.042 -15.9976   17.324   18.724   8.2138   11.182   5.4932 7.542320 9.881365 
1 1 1   20   12  -14 o   10.540   5.1202 -11.6071   13.878 -39.0613   22.900   4.3303   17.447   10.964   5.5260   13.846   6.4310 -2.882301 8.479112 
1 1 1   20   12  -13 o   10.536   5.1163 -11.4877   13.817 -16.1787   22.690  -8.7230   17.419   12.527   6.1794   12.019   5.8148 0.5072966 8.485083 
1 1 1   20   12  -12 o   9.1342   4.5514 -23.2218   13.540 -22.6629   22.331 -23.5468   17.027   11.933   5.9294   10.392   5.1660 1.541188 7.864167 
1 1 1   20   12  -11 o   14.327   6.2918   9.2439   14.143   18.335   23.672   4.1966   17.638   16.553   7.6180   13.877   6.4524 2.675783 9.983378 
1 1 1   20   12  -10 o   10.437   5.0812 -12.4954   13.869 -24.0900   23.236  -6.0778   17.287   12.042   5.9943   12.326   5.9199 -0.2838535 8.424767 
1 1 1   20   12   -9 o   15.748   6.6017   14.669   14.269   4.5108   23.982   20.236   17.754   14.793   7.0694   17.063   7.2680 -2.269645 10.13909 
1 1 1   20   12   -8 o   11.405   5.5724 -13.5227   17.104 -17.3825   23.345  -9.0493   25.132   12.592   6.2219   13.617   6.6743 -1.025372 9.124606 
1 1 1   20   12   -7 o   20.383   7.7987   32.685   18.088   14.950   24.496   53.949   26.822   16.134   7.5359   22.538   9.2110 -6.403988 11.90089 
1 1 1   20   12   -6 o   14.787   6.7317   9.1743   17.831 -14.8342   23.888   39.381   26.795   12.918   6.3664   19.721   8.6604 -6.802360 10.74872 
1 1 1   20   12   -5 o   11.314   5.2998  -2.8785   12.264 -10.5555   17.139   5.1760   17.556   11.759   5.7074   14.058   6.5022 -2.299360 8.651727 
1 1 1   20   12   -4 o   24.556   6.3203   36.031   12.725   47.578   17.876   24.167   18.119   25.640   7.8321   18.030   7.4896 7.609814 10.83675 
1 1 1   20   12   -3 o   13.064   5.7819   5.3754   12.163   0.6208   16.848   10.552   17.579   13.196   6.1912   15.028   6.7785 -1.832669 9.180322 
1 1 1   20   12   -2 o   16.303   6.6231   16.413   13.768   26.836   16.831  -4.6639   23.936   19.017   7.4548   13.856   6.7296 5.160908 10.04299 
1 1 1   20   12   -1 o   15.407   6.2517   13.480   12.251   18.875   16.928   7.5471   17.752   16.827   7.1295   14.503   6.6458 2.324538 9.746586 
1 1 1   20   12    0 o   15.850   6.3195   14.811   12.284   8.2955   17.200   21.595   17.550   14.566   6.6237   17.459   7.3204 -2.893303 9.872276 
1 1 1   20   12    1 o   23.089   6.5646   33.114   12.938   32.443   18.110   33.814   18.491   20.339   7.7982   20.621   7.8863 -0.2823639 11.09080 
1 1 1   20   12    2 o   10.961   5.1938  -5.1917   12.403   1.6604   17.192 -12.6271   17.909   13.432   6.2865   11.749   5.7322 1.682343 8.507542 
1 1 1   20   12    3 o   19.524   6.7260   24.952   12.970   21.334   17.864   28.985   18.862   17.361   7.3383   19.149   7.7618 -1.787567 10.68162 
1 1 1   20   12    4 o   9.5964   4.6906 -13.7425   12.157 -26.5728   16.847   0.1972   17.560   10.097   5.0383   13.280   6.2587 -3.183069 8.034683 
1 1 1   20   12    5 o   14.109   6.0684   9.0861   12.597  -6.8921   17.313   27.063   18.364   12.250   5.8940   18.733   7.6345 -6.482899 9.644930 
1 1 1   20   12    6 o   9.9622   4.8953 -16.3126   13.791  -5.2737   16.681 -40.1465   24.511   12.292   5.8800   11.323   5.7084 0.9685926 8.195152 
1 1 1   20   12    7 o   12.400   5.6429   2.1773   12.514   2.4454   17.562   1.9008   17.836   13.610   6.3646   13.578   6.3703 0.3211117E-01 9.004911 
1 1 1   20   12    8 o   12.326   5.6038   2.1284   12.304   0.7086   17.233   3.6049   17.574   13.272   6.2379   13.789   6.4214 -0.5172653 8.952358 
1 1 1   20   12    9 o   17.412   6.9172   20.382   14.666   46.328   25.650   7.7789   17.877   21.291   8.8828   14.525   6.6609 6.765800 11.10277 
1 1 1   20   12   10 o   14.490   6.6363   7.7656   17.669   10.771   24.997   4.7646   24.980   15.604   7.3879   14.918   7.1521 0.6855316 10.28267 
1 1 1   20   12   11 o   14.777   6.7067   9.4866   17.528   15.305   25.142   3.9835   24.451   16.164   7.5771   14.770   7.0798 1.393221 10.36992 
1 1 1   20   12   12 o   17.423   7.2944   21.687   17.387   29.879   24.660   13.588   24.518   18.328   8.1650   15.909   7.4656 2.418658 11.06353 
1 1 1   20   12   13 o   14.835   6.4663   11.170   14.693   38.348   24.909  -3.3328   18.196   19.813   8.5275   12.883   6.1568 6.929917 10.51776 
1 1 1   20   12   14 o   15.929   6.7006   15.465   14.779   29.404   25.860   8.7040   18.011   18.099   8.1869   14.666   6.7107 3.432586 10.58582 
1 1 1   20   12   15 o   16.723   6.8289   18.310   14.728   14.599   25.500   20.168   18.041   16.040   7.5542   16.968   7.2795 -0.9278393 10.49078 
1 1 1   20   12   16 o   14.525   6.4248   9.8215   14.998  -4.5162   25.230   17.658   18.652   13.970   6.8128   16.384   7.2093 -2.414294 9.919121 
1 1 1   20   12   17 o   11.493   5.4902  -5.9503   14.438   21.196   24.863 -19.7625   17.735   16.872   7.7803   10.929   5.4047 5.942976 9.473290 
1 1 1   20   12   18 o   18.470   7.0982   24.225   15.029   1.0435   25.076   37.220   18.775   14.451   6.9874   21.319   7.9933 -6.868832 10.61683 
1 1 1   20   12   19 o   16.541   6.8003   17.896   14.729   35.779   25.802   9.2519   17.939   19.022   8.4200   14.690   6.7125 4.332146 10.76821 
1 1 1   20   12   20 o   11.144   5.3724  -8.5292   14.556 -23.9908   24.621  -0.2217   18.047   12.265   6.1155   13.202   6.2585 -0.9372101 8.750304 
1 1 1   20   12   21 o   16.013   7.0683   16.196   18.061   0.0000   0.0000   16.196   18.061  ?   ?    16.013   7.0683 0.000000 7.068259 
1 1 1   20   12   22 o   13.212   6.1117   3.0640   15.521 -31.1329   29.885   15.695   18.163   12.781   6.4249   15.915   7.0534 -3.133878 9.540913 
1 1 1   20   12   23 f   16.735   7.3969   19.890   19.844   19.297   30.331   20.334   26.239   16.558   7.9229   16.678   7.7930 -0.1200962 11.11319 
1 1 1   20   12   24 o   12.713   6.1409  -6.1129   19.244 -18.3644   29.056   3.4608   25.685   13.413   6.6809   14.735   7.1118 -1.321771 9.757651 
1 1 1   20   12   25 o   12.979   6.2522  -4.5109   19.626 -42.8257   29.067   27.591   26.606   12.043   6.0884   17.644   8.1040 -5.601172 10.13629 
1 1 1   20   12   26 o   16.440   7.3311   18.362   19.930  -0.0502   30.111   32.716   26.587   14.838   7.2795   18.400   8.3143 -3.562301 11.05075 
1 1 1   20   12   27 o   18.562   7.7550   28.141   19.590   26.522   29.822   29.369   25.983   17.342   8.1680   17.956   8.1557 -0.6139050 11.54257 
1 1 1   20   12   28 o   16.783   7.3882   19.943   19.609 -33.9591   30.071   59.822   25.866   12.681   6.3837   24.060   9.2948 -11.37937 11.27581 
1 1 1   20   12   29 o   14.583   7.0868   0.4138   26.640   0.0000   0.0000   0.4138   26.640  ?   ?    14.583   7.0868 0.000000 7.086756 
1 1 1   21    0  -91 o   15.995   10.038   24.931   27.232   24.931   27.232   24.931   27.232   15.995   10.038   15.995   10.038 0.000000 0.000000 
1 1 1   21    0  -90 o   10.240   7.3018 -20.6539   27.014 -20.6539   27.014 -20.6539   27.014   10.240   7.3018   10.240   7.3018 0.000000 0.000000 
1 1 1   21    0  -89 f   20.847   11.421   44.606   27.805   44.606   27.805   44.606   27.805   20.847   11.421   20.847   11.421 0.000000 0.000000 
1 1 1   21    0  -88 o   27.843   12.152   66.096   28.654   66.096   28.654   66.096   28.654   27.843   12.152   27.843   12.152 0.000000 0.000000 
1 1 1   21    0  -87 o   23.439   12.002   53.769   29.040   53.769   29.040   53.769   29.040   23.439   12.002   23.439   12.002 0.000000 0.000000 
1 1 1   21    0  -86 o   19.648   11.113   38.914   27.344   38.914   27.344   38.914   27.344   19.648   11.113   19.648   11.113 0.000000 0.000000 
1 1 1   21    0  -85 o   8.5691   6.2385 -41.2535   25.151 -41.2535   25.151 -41.2535   25.151   8.5691   6.2385   8.5691   6.2385 0.000000 0.000000 
1 1 1   21    0  -84 o   13.801   9.0486   11.195   25.421   11.195   25.421   11.195   25.421   13.801   9.0486   13.801   9.0486 0.000000 0.000000 
1 1 1   21    0  -83 o   16.065   9.8981   22.641   25.288   22.641   25.288   22.641   25.288   16.065   9.8981   16.065   9.8981 0.000000 0.000000 
1 1 1   21    0  -82 f   14.694   9.3595   15.762   24.695   15.762   24.695   15.762   24.695   14.694   9.3595   14.694   9.3595 0.000000 0.000000 
1 1 1   21    0  -81 f   31.626   9.3073   59.664   20.851   59.664   20.851   59.664   20.851   31.626   9.3073   31.626   9.3073 0.000000 0.000000 
1 1 1   21    0  -80 o   11.445   7.6045   2.2278   18.922   2.2278   18.922   2.2278   18.922   11.445   7.6045   11.445   7.6045 0.000000 0.000000 
1 1 1   21    0  -79 o   15.945   9.1381   20.615   18.830   20.615   18.830   20.615   18.830   15.945   9.1381   15.945   9.1381 0.000000 0.000000 
1 1 1   21    0  -78 o   13.164   8.6329   7.2751   23.160   7.2751   23.160   7.2751   23.160   13.164   8.6329   13.164   8.6329 0.000000 0.000000 
1 1 1   21    0  -77 o   9.2300   6.4410 -11.1012   17.655 -11.1012   17.655 -11.1012   17.655   9.2300   6.4410   9.2300   6.4410 0.000000 0.000000 
1 1 1   21    0  -76 o   22.200   9.9268   35.898   19.105   35.898   19.105   35.898   19.105   22.200   9.9268   22.200   9.9268 0.000000 0.000000 
1 1 1   21    0  -75 o   10.888   6.9383   4.3548   13.591   4.3548   13.591   4.3548   13.591   10.888   6.9383   10.888   6.9383 0.000000 0.000000 
1 1 1   21    0  -74 o   36.182   5.5197   60.879   15.157   60.879   15.157   60.879   15.157   36.182   5.5197   36.182   5.5197 0.000000 0.000000 
1 1 1   21    0  -73 o   46.194   4.1099   92.802   15.181   92.802   15.181   92.802   15.181   46.194   4.1099   46.194   4.1099 0.000000 0.000000 
1 1 1   21    0  -72 o   7.0480   5.0249 -16.1948   12.778 -16.1948   12.778 -16.1948   12.778   7.0480   5.0249   7.0480   5.0249 0.000000 0.000000 
1 1 1   21    0  -71 o   15.286   7.9801   16.358   13.006   16.358   13.006   16.358   13.006   15.286   7.9801   15.286   7.9801 0.000000 0.000000 
1 1 1   21    0  -70 o   18.950   8.1094   23.150   12.788   23.150   12.788   23.150   12.788   18.950   8.1094   18.950   8.1094 0.000000 0.000000 
1 1 1   21    0  -69 o   12.137   7.3063   8.1857   13.099   8.1857   13.099   8.1857   13.099   12.137   7.3063   12.137   7.3063 0.000000 0.000000 
1 1 1   21    0  -68 o   12.485   7.4357   9.0063   13.287   9.0063   13.287   9.0063   13.287   12.485   7.4357   12.485   7.4357 0.000000 0.000000 
1 1 1   21    0  -67 o   21.125   8.2470   27.185   13.557   27.185   13.557   27.185   13.557   21.125   8.2470   21.125   8.2470 0.000000 0.000000 
1 1 1   21    0  -66 o   13.489   7.6353   11.662   12.921   11.662   12.921   11.662   12.921   13.489   7.6353   13.489   7.6353 0.000000 0.000000 
1 1 1   21    0  -65 o   12.613   7.4035   9.3064   12.833   9.3064   12.833   9.3064   12.833   12.613   7.4035   12.613   7.4035 0.000000 0.000000 
1 1 1   21    0  -64 o   41.845   4.3389   75.866   14.403   75.866   14.403   75.866   14.403   41.845   4.3389   41.845   4.3389 0.000000 0.000000 
1 1 1   21    0  -63 o   21.392   8.2357   27.323   13.597   27.323   13.597   27.323   13.597   21.392   8.2357   21.392   8.2357 0.000000 0.000000 
1 1 1   21    0  -62 o   10.440   6.6781   2.2432   12.734   2.2432   12.734   2.2432   12.734   10.440   6.6781   10.440   6.6781 0.000000 0.000000 
1 1 1   21    0  -61 o   12.042   7.2468   7.3884   12.877   7.3884   12.877   7.3884   12.877   12.042   7.2468   12.042   7.2468 0.000000 0.000000 
1 1 1   21    0  -60 o   29.196   6.6408   41.451   13.775   41.451   13.775   41.451   13.775   29.196   6.6408   29.196   6.6408 0.000000 0.000000 
1 1 1   21    0  -59 o   38.637   4.6652   65.281   14.124   65.281   14.124   65.281   14.124   38.637   4.6652   38.637   4.6652 0.000000 0.000000 
1 1 1   21    0  -58 o   43.823   4.1116   82.171   14.373   82.171   14.373   82.171   14.373   43.823   4.1116   43.823   4.1116 0.000000 0.000000 
1 1 1   21    0  -57 o   51.033   3.6418  109.711   14.969  109.711   14.969  109.711   14.969   51.033   3.6418   51.033   3.6418 0.000000 0.000000 
1 1 1   21    0  -56 o   52.792   3.5559  117.066   15.140  117.066   15.140  117.066   15.140   52.792   3.5559   52.792   3.5559 0.000000 0.000000 
1 1 1   21    0  -55 o   11.274   6.9355   5.2120   12.371   5.2120   12.371   5.2120   12.371   11.274   6.9355   11.274   6.9355 0.000000 0.000000 
1 1 1   21    0  -54 o   18.846   8.0974   21.907   12.743   21.907   12.743   21.907   12.743   18.846   8.0974   18.846   8.0974 0.000000 0.000000 
1 1 1   21    0  -53 o   46.909   3.8960   93.168   14.653   93.168   14.653   93.168   14.653   46.909   3.8960   46.909   3.8960 0.000000 0.000000 
1 1 1   21    0  -52 o   18.970   8.8231   23.118   15.141   23.118   15.141   23.118   15.141   18.970   8.8231   18.970   8.8231 0.000000 0.000000 
1 1 1   21    0  -51 o   19.866   8.8300   24.818   15.117   24.818   15.117   24.818   15.117   19.866   8.8300   19.866   8.8300 0.000000 0.000000 
1 1 1   21    0  -50 o   8.5882   5.9847 -12.7941   15.094 -12.7941   15.094 -12.7941   15.094   8.5882   5.9847   8.5882   5.9847 0.000000 0.000000 
1 1 1   21    0  -49 o   24.350   7.4017   31.083   12.822   31.083   12.822   31.083   12.822   24.350   7.4017   24.350   7.4017 0.000000 0.000000 
1 1 1   21    0  -48 o   11.654   7.0720   6.0200   12.476   6.0200   12.476   6.0200   12.476   11.654   7.0720   11.654   7.0720 0.000000 0.000000 
1 1 1   21    0  -47 o   28.100   6.5405   38.007   13.027   38.007   13.027   38.007   13.027   28.100   6.5405   28.100   6.5405 0.000000 0.000000 
1 1 1   21    0  -46 o   15.977   7.9133   16.230   12.405   16.230   12.405   16.230   12.405   15.977   7.9133   15.977   7.9133 0.000000 0.000000 
1 1 1   21    0  -45 o   12.285   6.9094   8.8056   10.493   8.8056   10.493   8.8056   10.493   12.285   6.9094   12.285   6.9094 0.000000 0.000000 
1 1 1   21    0  -44 o   38.526   3.7415   62.922   11.479   62.922   11.479   62.922   11.479   38.526   3.7415   38.526   3.7415 0.000000 0.000000 
1 1 1   21    0  -43 o   13.942   7.1754   12.153   10.413   12.153   10.413   12.153   10.413   13.942   7.1754   13.942   7.1754 0.000000 0.000000 
1 1 1   21    0  -42 o   50.856   3.3005  107.684   13.548  107.684   13.548  107.684   13.548   50.856   3.3005   50.856   3.3005 0.000000 0.000000 
1 1 1   21    0  -41 o   38.659   3.7330   63.251   11.495   63.251   11.495   63.251   11.495   38.659   3.7330   38.659   3.7330 0.000000 0.000000 
1 1 1   21    0  -40 o   47.794   3.1534   95.016   12.161   95.016   12.161   95.016   12.161   47.794   3.1534   47.794   3.1534 0.000000 0.000000 
1 1 1   21    0  -39 o   8.6708   5.7079  -1.5776   10.271  -1.5776   10.271  -1.5776   10.271   8.6708   5.7079   8.6708   5.7079 0.000000 0.000000 
1 1 1   21    0  -38 o   14.913   7.4520   13.869   11.046   13.869   11.046   13.869   11.046   14.913   7.4520   14.913   7.4520 0.000000 0.000000 
1 1 1   21    0  -37 o   52.850   3.3096  116.030   14.128  116.030   14.128  116.030   14.128   52.850   3.3096   52.850   3.3096 0.000000 0.000000 
1 1 1   21    0  -36 o  121.986   2.4359  609.651   24.200  609.651   24.200  609.651   24.200  121.986   2.4359  121.986   2.4359 0.000000 0.000000 
1 1 1   21    0  -35 o   82.364   2.6006  278.529   17.420  278.529   17.420  278.529   17.420   82.364   2.6006   82.364   2.6006 0.000000 0.000000 
1 1 1   21    0  -34 o   60.970   3.0146  153.472   14.899  153.472   14.899  153.472   14.899   60.970   3.0146   60.970   3.0146 0.000000 0.000000 
1 1 1   21    0  -33 o   9.8526   6.3197   0.8056   11.503   0.8056   11.503   0.8056   11.503   9.8526   6.3197   9.8526   6.3197 0.000000 0.000000 
1 1 1   21    0  -32 o   39.091   4.2398   65.069   13.108   65.069   13.108   65.069   13.108   39.091   4.2398   39.091   4.2398 0.000000 0.000000 
1 1 1   21    0  -31 o   51.233   4.2379  110.224   17.410  110.224   17.410  110.224   17.410   51.233   4.2379   51.233   4.2379 0.000000 0.000000 
1 1 1   21    0  -30 o   10.623   6.6468   2.9654   11.849   2.9654   11.849   2.9654   11.849   10.623   6.6468   10.623   6.6468 0.000000 0.000000 
1 1 1   21    0  -29 o   22.632   7.7508   27.640   12.844   27.640   12.844   27.640   12.844   22.632   7.7508   22.632   7.7508 0.000000 0.000000 
1 1 1   21    0  -28 o   19.869   8.0361   22.894   12.716   22.894   12.716   22.894   12.716   19.869   8.0361   19.869   8.0361 0.000000 0.000000 
1 1 1   21    0  -27 o   12.902   7.4676   8.7937   12.763   8.7937   12.763   8.7937   12.763   12.902   7.4676   12.902   7.4676 0.000000 0.000000 
1 1 1   21    0  -26 o   52.770   4.5463  117.116   19.208  117.116   19.208  117.116   19.208   52.770   4.5463   52.770   4.5463 0.000000 0.000000 
1 1 1   21    0  -25 o   10.467   6.4907   3.3381   11.043   3.3381   11.043   3.3381   11.043   10.467   6.4907   10.467   6.4907 0.000000 0.000000 
1 1 1   21    0  -24 o   66.545   2.7063  181.991   14.625  181.991   14.625  181.991   14.625   66.545   2.7063   66.545   2.7063 0.000000 0.000000 
1 1 1   21    0  -23 o   64.858   2.7237  172.930   14.342  172.930   14.342  172.930   14.342   64.858   2.7237   64.858   2.7237 0.000000 0.000000 
1 1 1   21    0  -22 o   20.733   7.3629   23.426   11.328   23.426   11.328   23.426   11.328   20.733   7.3629   20.733   7.3629 0.000000 0.000000 
1 1 1   21    0  -21 o   12.580   7.0989   8.8300   11.125   8.8300   11.125   8.8300   11.125   12.580   7.0989   12.580   7.0989 0.000000 0.000000 
1 1 1   21    0  -20 o   22.553   8.0998   27.920   13.619   27.920   13.619   27.920   13.619   22.553   8.0998   22.553   8.0998 0.000000 0.000000 
1 1 1   21    0  -19 o   26.948   6.1714   34.213   11.808   34.213   11.808   34.213   11.808   26.948   6.1714   26.948   6.1714 0.000000 0.000000 
1 1 1   21    0  -18 o   61.132   2.8778  153.843   14.268  153.843   14.268  153.843   14.268   61.132   2.8778   61.132   2.8778 0.000000 0.000000 
1 1 1   21    0  -17 o   15.359   7.7297   14.478   11.927   14.478   11.927   14.478   11.927   15.359   7.7297   15.359   7.7297 0.000000 0.000000 
1 1 1   21    0  -16 o   26.119   6.5922   32.948   12.137   32.948   12.137   32.948   12.137   26.119   6.5922   26.119   6.5922 0.000000 0.000000 
1 1 1   21    0  -15 o   74.385   2.9424  227.341   17.778  227.341   17.778  227.341   17.778   74.385   2.9424   74.385   2.9424 0.000000 0.000000 
1 1 1   21    0  -14 o   7.3057   5.2057 -19.3751   13.643 -19.3751   13.643 -19.3751   13.643   7.3057   5.2057   7.3057   5.2057 0.000000 0.000000 
1 1 1   21    0  -13 o   61.877   3.9981  158.941   19.970  158.941   19.970  158.941   19.970   61.877   3.9981   61.877   3.9981 0.000000 0.000000 
1 1 1   21    0  -12 o   88.182   2.7789  318.803   19.930  318.803   19.930  318.803   19.930   88.182   2.7789   88.182   2.7789 0.000000 0.000000 
1 1 1   21    0  -11 f   98.944   2.6940  400.986   21.692  400.986   21.692  400.986   21.692   98.944   2.6940   98.944   2.6940 0.000000 0.000000 
1 1 1   21    0  -10 o   25.770   9.0582   36.182   17.252   36.182   17.252   36.182   17.252   25.770   9.0582   25.770   9.0582 0.000000 0.000000 
1 1 1   21    0   -9 o  109.173   3.1526  488.767   28.002  488.767   28.002  488.767   28.002  109.173   3.1526  109.173   3.1526 0.000000 0.000000 
1 1 1   21    0   -8 f   67.938   3.8425  190.921   21.122  190.921   21.122  190.921   21.122   67.938   3.8425   67.938   3.8425 0.000000 0.000000 
1 1 1   21    0   -7 o   25.545   9.0333   35.621   17.095   35.621   17.095   35.621   17.095   25.545   9.0333   25.545   9.0333 0.000000 0.000000 
1 1 1   21    0   -6 o   47.637   5.1061   96.459   19.253   96.459   19.253   96.459   19.253   47.637   5.1061   47.637   5.1061 0.000000 0.000000 
1 1 1   21    0   -5 o   79.280   3.5425  258.851   22.789  258.851   22.789  258.851   22.789   79.280   3.5425   79.280   3.5425 0.000000 0.000000 
1 1 1   21    0   -4 o   43.369   5.4470   80.961   18.434   80.961   18.434   80.961   18.434   43.369   5.4470   43.369   5.4470 0.000000 0.000000 
1 1 1   21    0   -3 o   41.870   5.7908   76.206   18.687   76.206   18.687   76.206   18.687   41.870   5.7908   41.870   5.7908 0.000000 0.000000 
1 1 1   21    0   -2 o   50.724   3.9843  107.370   16.234  107.370   16.234  107.370   16.234   50.724   3.9843   50.724   3.9843 0.000000 0.000000 
1 1 1   21    0   -1 o   93.199   2.7817  355.937   21.091  355.937   21.091  355.937   21.091   93.199   2.7817   93.199   2.7817 0.000000 0.000000 
1 1 1   21    0    0 o  132.136   2.6099  714.167   28.087  714.167   28.087  714.167   28.087  132.136   2.6099  132.136   2.6099 0.000000 0.000000 
1 1 1   21    0    1 o  197.872   2.7599  1601.03   44.496  1601.03   44.496  1601.03   44.496  197.872   2.7599  197.872   2.7599 0.000000 0.000000 
1 1 1   21    0    2 o   26.251   8.1439   35.622   15.262   35.622   15.262   35.622   15.262   26.251   8.1439   26.251   8.1439 0.000000 0.000000 
1 1 1   21    0    3 o   27.476   7.8651   37.938   15.267   37.938   15.267   37.938   15.267   27.476   7.8651   27.476   7.8651 0.000000 0.000000 
1 1 1   21    0    4 o   34.964   6.0734   54.655   15.746   54.655   15.746   54.655   15.746   34.964   6.0734   34.964   6.0734 0.000000 0.000000 
1 1 1   21    0    5 o   65.071   3.3850  174.677   17.843  174.677   17.843  174.677   17.843   65.071   3.3850   65.071   3.3850 0.000000 0.000000 
1 1 1   21    0    6 o   39.807   5.1044   68.257   15.818   68.257   15.818   68.257   15.818   39.807   5.1044   39.807   5.1044 0.000000 0.000000 
1 1 1   21    0    7 o   21.714   8.7274   27.160   15.026   27.160   15.026   27.160   15.026   21.714   8.7274   21.714   8.7274 0.000000 0.000000 
1 1 1   21    0    8 f   17.890   8.7806   19.712   15.216   19.712   15.216   19.712   15.216   17.890   8.7806   17.890   8.7806 0.000000 0.000000 
1 1 1   21    0    9 o   33.999   6.2814   52.216   15.659   52.216   15.659   52.216   15.659   33.999   6.2814   33.999   6.2814 0.000000 0.000000 
1 1 1   21    0   10 o   24.483   8.2936   32.076   14.814   32.076   14.814   32.076   14.814   24.483   8.2936   24.483   8.2936 0.000000 0.000000 
1 1 1   21    0   11 f   7.3934   5.2649 -19.4700   13.873 -19.4700   13.873 -19.4700   13.873   7.3934   5.2649   7.3934   5.2649 0.000000 0.000000 
1 1 1   21    0   12 o   26.625   7.8449   35.994   14.798   35.994   14.798   35.994   14.798   26.625   7.8449   26.625   7.8449 0.000000 0.000000 
1 1 1   21    0   13 o   80.251   2.9515  264.430   19.249  264.430   19.249  264.430   19.249   80.251   2.9515   80.251   2.9515 0.000000 0.000000 
1 1 1   21    0   14 o   17.156   9.3017   17.697   18.250   17.697   18.250   17.697   18.250   17.156   9.3017   17.156   9.3017 0.000000 0.000000 
1 1 1   21    0   15 o   67.413   4.1294  188.532   22.495  188.532   22.495  188.532   22.495   67.413   4.1294   67.413   4.1294 0.000000 0.000000 
1 1 1   21    0   16 o  111.541   3.2975  510.621   29.922  510.621   29.922  510.621   29.922  111.541   3.2975  111.541   3.2975 0.000000 0.000000 
1 1 1   21    0   17 o  133.318   2.5937  727.221   28.163  727.221   28.163  727.221   28.163  133.318   2.5937  133.318   2.5937 0.000000 0.000000 
1 1 1   21    0   18 o   14.076   7.9408   11.141   13.914   11.141   13.914   11.141   13.914   14.076   7.9408   14.076   7.9408 0.000000 0.000000 
1 1 1   21    0   19 o   68.053   3.1222  190.713   17.237  190.713   17.237  190.713   17.237   68.053   3.1222   68.053   3.1222 0.000000 0.000000 
1 1 1   21    0   20 o   18.268   8.4205   20.323   13.774   20.323   13.774   20.323   13.774   18.268   8.4205   18.268   8.4205 0.000000 0.000000 
1 1 1   21    0   21 o   51.209   3.8650  109.376   15.917  109.376   15.917  109.376   15.917   51.209   3.8650   51.209   3.8650 0.000000 0.000000 
1 1 1   21    0   22 o   11.993   7.3199   5.4869   13.534   5.4869   13.534   5.4869   13.534   11.993   7.3199   11.993   7.3199 0.000000 0.000000 
1 1 1   21    0   23 o  124.067   2.5810  630.079   26.077  630.079   26.077  630.079   26.077  124.067   2.5810  124.067   2.5810 0.000000 0.000000 
1 1 1   21    0   24 o   92.041   2.7286  347.379   20.431  347.379   20.431  347.379   20.431   92.041   2.7286   92.041   2.7286 0.000000 0.000000 
1 1 1   21    0   25 o   44.182   4.2500   82.403   14.960   82.403   14.960   82.403   14.960   44.182   4.2500   44.182   4.2500 0.000000 0.000000 
1 1 1   21    0   26 o  114.513   2.5728  537.005   23.989  537.005   23.989  537.005   23.989  114.513   2.5728  114.513   2.5728 0.000000 0.000000 
1 1 1   21    0   27 o   9.0008   6.0550  -4.9929   12.672  -4.9929   12.672  -4.9929   12.672   9.0008   6.0550   9.0008   6.0550 0.000000 0.000000 
1 1 1   21    0   28 o   47.477   3.8191   94.320   14.554   94.320   14.554   94.320   14.554   47.477   3.8191   47.477   3.8191 0.000000 0.000000 
1 1 1   21    0   29 o   32.219   7.7904   50.066   17.735   50.066   17.735   50.066   17.735   32.219   7.7904   32.219   7.7904 0.000000 0.000000 
1 1 1   21    0   30 o   17.944   8.1465   19.610   12.874   19.610   12.874   19.610   12.874   17.944   8.1465   17.944   8.1465 0.000000 0.000000 
1 1 1   21    0   31 o   59.606   3.2340  146.933   15.607  146.933   15.607  146.933   15.607   59.606   3.2340   59.606   3.2340 0.000000 0.000000 
1 1 1   21    0   32 o   53.201   3.5442  117.722   15.211  117.722   15.211  117.722   15.211   53.201   3.5442   53.201   3.5442 0.000000 0.000000 
1 1 1   21    0   33 o  101.708   2.6002  424.162   21.525  424.162   21.525  424.162   21.525  101.708   2.6002  101.708   2.6002 0.000000 0.000000 
1 1 1   21    0   34 o   54.028   3.4769  121.330   15.165  121.330   15.165  121.330   15.165   54.028   3.4769   54.028   3.4769 0.000000 0.000000 
1 1 1   21    0   35 o   94.149   3.1231  364.754   23.909  364.754   23.909  364.754   23.909   94.149   3.1231   94.149   3.1231 0.000000 0.000000 
1 1 1   21    0   36 o   14.848   8.0954   13.377   13.900   13.377   13.900   13.377   13.900   14.848   8.0954   14.848   8.0954 0.000000 0.000000 
1 1 1   21    0   37 o   69.576   3.5053  200.473   19.764  200.473   19.764  200.473   19.764   69.576   3.5053   69.576   3.5053 0.000000 0.000000 
1 1 1   21    0   38 o   36.246   4.7570   57.049   13.384   57.049   13.384   57.049   13.384   36.246   4.7570   36.246   4.7570 0.000000 0.000000 
1 1 1   21    0   39 o   12.490   7.6649   6.0789   15.023   6.0789   15.023   6.0789   15.023   12.490   7.6649   12.490   7.6649 0.000000 0.000000 
1 1 1   21    0   40 o   7.8040   5.4161  -9.8787   12.032  -9.8787   12.032  -9.8787   12.032   7.8040   5.4161   7.8040   5.4161 0.000000 0.000000 
1 1 1   21    0   41 o   53.671   3.5320  120.078   15.296  120.078   15.296  120.078   15.296   53.671   3.5320   53.671   3.5320 0.000000 0.000000 
1 1 1   21    0   42 o   12.978   7.4161   9.5366   12.350   9.5366   12.350   9.5366   12.350   12.978   7.4161   12.978   7.4161 0.000000 0.000000 
1 1 1   21    0   43 o   9.1911   6.0969  -2.5727   12.082  -2.5727   12.082  -2.5727   12.082   9.1911   6.0969   9.1911   6.0969 0.000000 0.000000 
1 1 1   21    0   44 o   12.887   7.3169   9.5736   11.915   9.5736   11.915   9.5736   11.915   12.887   7.3169   12.887   7.3169 0.000000 0.000000 
1 1 1   21    0   45 o   9.5280   6.2389  -0.9672   12.026  -0.9672   12.026  -0.9672   12.026   9.5280   6.2389   9.5280   6.2389 0.000000 0.000000 
1 1 1   21    0   46 o   31.136   7.3343   47.065   16.169   47.065   16.169   47.065   16.169   31.136   7.3343   31.136   7.3343 0.000000 0.000000 
1 1 1   21    0   47 o   56.111   4.0543  132.413   18.317  132.413   18.317  132.413   18.317   56.111   4.0543   56.111   4.0543 0.000000 0.000000 
1 1 1   21    0   48 o   26.032   8.3418   36.508   15.606   36.508   15.606   36.508   15.606   26.032   8.3418   26.032   8.3418 0.000000 0.000000 
1 1 1   21    0   49 o   48.112   4.4449   98.666   17.071   98.666   17.071   98.666   17.071   48.112   4.4449   48.112   4.4449 0.000000 0.000000 
1 1 1   21    0   50 o   35.691   6.0696   57.996   16.126   57.996   16.126   57.996   16.126   35.691   6.0696   35.691   6.0696 0.000000 0.000000 
1 1 1   21    0   51 o   20.699   9.4299   27.489   17.254   27.489   17.254   27.489   17.254   20.699   9.4299   20.699   9.4299 0.000000 0.000000 
1 1 1   21    0   52 o   7.7643   5.5453 -22.1833   15.827 -22.1833   15.827 -22.1833   15.827   7.7643   5.5453   7.7643   5.5453 0.000000 0.000000 
1 1 1   21    0   53 o   43.120   5.5015   82.016   18.478   82.016   18.478   82.016   18.478   43.120   5.5015   43.120   5.5015 0.000000 0.000000 
1 1 1   21    0   54 o   12.350   7.3423   7.9767   12.912   7.9767   12.912   7.9767   12.912   12.350   7.3423   12.350   7.3423 0.000000 0.000000 
1 1 1   21    0   55 o   53.167   3.6750  118.878   15.749  118.878   15.749  118.878   15.749   53.167   3.6750   53.167   3.6750 0.000000 0.000000 
1 1 1   21    0   56 o   55.849   3.4911  130.708   15.749  130.708   15.749  130.708   15.749   55.849   3.4911   55.849   3.4911 0.000000 0.000000 
1 1 1   21    0   57 o   33.448   5.5795   50.926   13.942   50.926   13.942   50.926   13.942   33.448   5.5795   33.448   5.5795 0.000000 0.000000 
1 1 1   21    0   58 o   69.849   3.0715  202.716   17.411  202.716   17.411  202.716   17.411   69.849   3.0715   69.849   3.0715 0.000000 0.000000 
1 1 1   21    0   59 o   67.927   3.1298  191.972   17.245  191.972   17.245  191.972   17.245   67.927   3.1298   67.927   3.1298 0.000000 0.000000 
1 1 1   21    0   60 o   53.103   3.5848  118.704   15.352  118.704   15.352  118.704   15.352   53.103   3.5848   53.103   3.5848 0.000000 0.000000 
1 1 1   21    0   61 o   39.645   4.6572   68.694   14.506   68.694   14.506   68.694   14.506   39.645   4.6572   39.645   4.6572 0.000000 0.000000 
1 1 1   21    0   62 o   12.286   7.3464   8.0397   13.068   8.0397   13.068   8.0397   13.068   12.286   7.3464   12.286   7.3464 0.000000 0.000000 
1 1 1   21    0   63 o   28.117   6.8497   39.328   13.601   39.328   13.601   39.328   13.601   28.117   6.8497   28.117   6.8497 0.000000 0.000000 
1 1 1   21    0   64 o   11.038   6.8923   4.5654   12.670   4.5654   12.670   4.5654   12.670   11.038   6.8923   11.038   6.8923 0.000000 0.000000 
1 1 1   21    0   65 o   16.901   8.0892   18.935   12.806   18.935   12.806   18.935   12.806   16.901   8.0892   16.901   8.0892 0.000000 0.000000 
1 1 1   21    0   66 o   15.202   7.8709   15.587   12.579   15.587   12.579   15.587   12.579   15.202   7.8709   15.202   7.8709 0.000000 0.000000 
1 1 1   21    0   67 o   38.522   5.4724   67.261   16.184   67.261   16.184   67.261   16.184   38.522   5.4724   38.522   5.4724 0.000000 0.000000 
1 1 1   21    0   68 o   8.2457   5.7557 -11.3008   14.123 -11.3008   14.123 -11.3008   14.123   8.2457   5.7557   8.2457   5.7557 0.000000 0.000000 
1 1 1   21    0   69 o   8.3803   5.8283 -10.2325   14.127 -10.2325   14.127 -10.2325   14.127   8.3803   5.8283   8.3803   5.8283 0.000000 0.000000 
1 1 1   21    0   70 o   12.906   7.7178   9.9537   14.424   9.9537   14.424   9.9537   14.424   12.906   7.7178   12.906   7.7178 0.000000 0.000000 
1 1 1   21    0   71 o   18.110   8.6688   22.868   14.708   22.868   14.708   22.868   14.708   18.110   8.6688   18.110   8.6688 0.000000 0.000000 
1 1 1   21    0   72 o   38.419   5.7689   68.561   16.866   68.561   16.866   68.561   16.866   38.419   5.7689   38.419   5.7689 0.000000 0.000000 
1 1 1   21    0   73 o   18.044   8.9007   23.550   15.667   23.550   15.667   23.550   15.667   18.044   8.9007   18.044   8.9007 0.000000 0.000000 
1 1 1   21    0   74 o   29.091   7.7839   45.439   15.948   45.439   15.948   45.439   15.948   29.091   7.7839   29.091   7.7839 0.000000 0.000000 
1 1 1   21    0   75 o   39.244   5.6761   71.775   17.053   71.775   17.053   71.775   17.053   39.244   5.6761   39.244   5.6761 0.000000 0.000000 
1 1 1   21    0   76 o   38.935   5.7653   71.242   17.121   71.242   17.121   71.242   17.121   38.935   5.7653   38.935   5.7653 0.000000 0.000000 
1 1 1   21    0   77 o   11.452   7.3400   5.2552   15.478   5.2552   15.478   5.2552   15.478   11.452   7.3400   11.452   7.3400 0.000000 0.000000 
1 1 1   21    0   78 o   14.923   8.4376   17.034   15.757   17.034   15.757   17.034   15.757   14.923   8.4376   14.923   8.4376 0.000000 0.000000 
1 1 1   21    0   79 o   13.876   8.0229   14.213   14.707   14.213   14.707   14.213   14.707   13.876   8.0229   13.876   8.0229 0.000000 0.000000 
1 1 1   21    0   80 o   24.480   8.4921   36.959   15.289   36.959   15.289   36.959   15.289   24.480   8.4921   24.480   8.4921 0.000000 0.000000 
1 1 1   21    0   81 f   34.412   8.7823   66.767   21.295   66.767   21.295   66.767   21.295   34.412   8.7823   34.412   8.7823 0.000000 0.000000 
1 1 1   21    0   82 f   16.712   9.2470   23.246   18.428   23.246   18.428   23.246   18.428   16.712   9.2470   16.712   9.2470 0.000000 0.000000 
1 1 1   21    0   83 o   10.779   7.2297   0.2442   17.819   0.2442   17.819   0.2442   17.819   10.779   7.2297   10.779   7.2297 0.000000 0.000000 
1 1 1   21    0   84 o   13.959   8.5128   14.739   18.271   14.739   18.271   14.739   18.271   13.959   8.5128   13.959   8.5128 0.000000 0.000000 
1 1 1   21    0   85 o   28.036   8.1325   45.434   16.127   45.434   16.127   45.434   16.127   28.036   8.1325   28.036   8.1325 0.000000 0.000000 
1 1 1   21    0   86 o   14.427   9.3517   15.072   26.069   15.072   26.069   15.072   26.069   14.427   9.3517   14.427   9.3517 0.000000 0.000000 
1 1 1   21    0   87 o   18.133   10.690   33.183   26.956   33.183   26.956   33.183   26.956   18.133   10.690   18.133   10.690 0.000000 0.000000 
1 1 1   21    0   88 o   14.248   9.3430   14.205   27.120   14.205   27.120   14.205   27.120   14.248   9.3430   14.248   9.3430 0.000000 0.000000 
1 1 1   21    0   89 f   24.082   11.644   53.049   26.614   53.049   26.614   53.049   26.614   24.082   11.644   24.082   11.644 0.000000 0.000000 
1 1 1   21    0   90 o   13.455   8.8888   10.750   25.253   10.750   25.253   10.750   25.253   13.455   8.8888   13.455   8.8888 0.000000 0.000000 
1 1 1   21    0   91 o   10.349   7.3018 -13.5093   24.629 -13.5093   24.629 -13.5093   24.629   10.349   7.3018   10.349   7.3018 0.000000 0.000000 
1 1 1   21    0   92 o   11.561   7.9631  -2.0177   24.817  -2.0177   24.817  -2.0177   24.817   11.561   7.9631   11.561   7.9631 0.000000 0.000000 
1 1 1   21    0   93 o   11.160   7.7674  -5.8345   25.210  -5.8345   25.210  -5.8345   25.210   11.160   7.7674   11.160   7.7674 0.000000 0.000000 
1 1 1   21    0   94 o   15.327   9.5859   21.952   24.616   21.952   24.616   21.952   24.616   15.327   9.5859   15.327   9.5859 0.000000 0.000000 
1 1 1   21    0   95 f   18.438   10.436   34.119   24.136   34.119   24.136   34.119   24.136   18.438   10.436   18.438   10.436 0.000000 0.000000 
1 1 1   21    1  -87 o   15.209   7.3279  -3.3648   26.984  -3.3648   26.984   0.0000   0.0000   15.209   7.3279  ?   ?  0.000000 7.327874 
1 1 1   21    1  -86 o   14.358   6.9671  -9.9190   25.494  -9.9190   25.494   0.0000   0.0000   14.358   6.9671  ?   ?  0.000000 6.967097 
1 1 1   21    1  -85 o   17.406   8.0059   14.845   26.090   14.845   26.090   0.0000   0.0000   17.406   8.0059  ?   ?  0.000000 8.005902 
1 1 1   21    1  -84 o   12.858   6.3948 -31.4032   26.208 -31.4032   26.208   0.0000   0.0000   12.858   6.3948  ?   ?  0.000000 6.394788 
1 1 1   21    1  -83 f   18.309   8.2912   19.614   26.610   19.614   26.610   0.0000   0.0000   18.309   8.2912  ?   ?  0.000000 8.291245 
1 1 1   21    1  -82 o   16.290   7.6484   5.1273   25.793   5.1273   25.793   0.0000   0.0000   16.290   7.6484  ?   ?  0.000000 7.648440 
1 1 1   21    1  -81 o   17.662   7.4042   17.221   17.950 -15.4926   25.041   51.795   25.743   13.986   6.8133   25.272   9.3827 -11.28594 11.59550 
1 1 1   21    1  -80 o   22.673   8.0452   34.358   18.640   73.982   27.105  -1.1914   25.674   31.176   9.6663   15.671   7.4394 15.50537 12.19759 
1 1 1   21    1  -79 o   13.262   6.2342  -5.0948   17.226 -15.0654   24.646   4.4268   24.085   14.068   6.8319   16.208   7.5375 -2.139972 10.17297 
1 1 1   21    1  -78 o   19.124   7.5855   21.704   17.611   34.792   24.620   7.9898   25.203   21.823   8.8598   16.940   7.8194 4.882301 11.81688 
1 1 1   21    1  -77 o   14.609   6.4284   5.4216   14.830   20.012   25.175  -2.3319   18.352   18.899   8.3434   14.093   6.5626 4.806231 10.61509 
1 1 1   21    1  -76 o   15.976   6.4660   11.621   13.067   32.256   18.090 -10.8895   18.895   22.530   7.9320   13.093   6.2619 9.436098 10.10586 
1 1 1   21    1  -75 o   28.588   5.9685   42.237   13.459   38.059   18.943   46.495   19.125   24.407   8.1307   27.367   8.0426 -2.960398 11.43640 
1 1 1   21    1  -74 o   17.655   6.6599   16.097   13.077   28.828   18.117   2.2516   18.893   21.666   7.9005   15.198   6.9230 6.468407 10.50451 
1 1 1   21    1  -73 o   15.116   5.9164   9.7982   10.587 -22.7763   17.618   28.212   13.246   11.436   5.6019   22.718   6.6976 -11.28196 8.731487 
1 1 1   21    1  -72 o   13.999   5.5567   7.4438   9.4568   5.6569   13.051   9.4189   13.721   14.519   6.2093   15.762   6.5299 -1.243476 9.010790 
1 1 1   21    1  -71 o   13.501   5.4983   5.9138   9.5168   1.9362   13.347   10.028   13.573   13.745   6.0712   16.012   6.5492 -2.267349 8.930391 
1 1 1   21    1  -70 o   41.421   3.2200   74.322   10.787   82.511   15.260   66.144   15.249   42.538   4.4677   37.442   5.1313 5.095863 6.803659 
1 1 1   21    1  -69 o   15.062   5.7177   9.5158   9.6742   13.147   13.316   5.4568   14.079   17.129   6.6549   15.000   6.4328 2.129086 9.255711 
1 1 1   21    1  -68 o   12.469   5.3146   2.5880   9.5041   30.932   13.542 -24.9244   13.342   24.440   6.6305   9.4914   4.6925 14.94815 8.122996 
1 1 1   21    1  -67 o   18.175   5.6801   15.944   9.3392   20.556   13.337   11.506   13.082   20.113   6.8232   16.691   6.5635 3.421467 9.467635 
1 1 1   21    1  -66 o   17.978   5.7606   15.447   9.5524   2.7244   13.485   28.262   13.534   14.294   6.2129   23.491   6.7254 -9.197194 9.155930 
1 1 1   21    1  -65 o   29.681   4.1158   39.163   9.6904   25.157   13.666   53.326   13.743   22.225   6.8589   33.996   5.1178 -11.77065 8.557858 
1 1 1   21    1  -64 o   18.113   5.7491   15.484   9.5322   3.2619   13.490   27.672   13.471   14.553   6.2697   23.447   6.7090 -8.893768 9.182571 
1 1 1   21    1  -63 f   17.962   5.7872   15.073   9.6316   14.166   13.859   15.921   13.395   18.074   6.8476   18.647   6.7942 -0.5726280 9.646323 
1 1 1   21    1  -62 o   27.071   4.5586   32.944   9.7022   52.879   13.870   13.844   13.576   34.030   5.1621   17.982   6.7854 16.04730 8.525764 
1 1 1   21    1  -61 o   13.292   5.3855   4.7442   9.0754   21.251   12.994 -10.9745   12.680   20.941   6.7197   11.228   5.2997 9.713239 8.558067 
1 1 1   21    1  -60 o   14.035   5.5041   6.4390   9.1784   23.644   13.136  -9.9711   12.829   22.047   6.7100   11.511   5.4014 10.53599 8.613898 
1 1 1   21    1  -59 o   16.092   5.7134   10.928   9.4019   9.3720   13.432   12.423   13.164   16.587   6.6099   17.560   6.6689 -0.9729595 9.389678 
1 1 1   21    1  -58 o   41.525   3.1150   72.924   10.467   80.136   14.554   65.195   15.066   42.916   4.2145   38.221   4.9519 4.694866 6.502582 
1 1 1   21    1  -57 o   49.043   2.7507  100.720   10.952   98.783   15.114  102.862   15.894   47.928   3.9023   48.830   4.0288 -0.9020119 5.608866 
1 1 1   21    1  -56 f   30.635   3.9830   40.713   9.7110   39.540   13.606   41.931   13.865   29.182   5.9222   30.110   5.8599 -0.9276276 8.331344 
1 1 1   21    1  -55 o   10.620   4.9207  -6.8913   10.120  -6.1847   12.787  -8.0758   16.556   12.314   5.6421   13.790   6.3554 -1.476035 8.498488 
1 1 1   21    1  -54 o   15.159   5.8801   7.7778   10.383   10.277   13.108   3.5687   17.012   16.963   6.5992   16.375   7.0476 0.5877800 9.654989 
1 1 1   21    1  -53 o   14.773   5.7988   6.9230   10.196   4.8082   13.029   10.263   16.375   15.203   6.3361   17.932   7.2454 -2.728720 9.625071 
1 1 1   21    1  -52 o   52.593   2.4646  114.935   10.537  112.109   14.990  117.695   14.815   51.389   3.6011   52.736   3.4655 -1.346878 4.997753 
1 1 1   21    1  -51 o   14.911   5.3408   8.7821   8.2331   12.211   12.843   6.3904   10.727   17.665   6.6137   14.825   5.9072 2.839824 8.867661 
1 1 1   21    1  -50 o   32.019   3.6943   43.826   9.4657   21.575   17.137   53.594   11.355   21.801   7.7162   35.305   4.0170 -13.50356 8.699206 
1 1 1   21    1  -49 o   14.362   5.4421   7.1382   8.7544  -6.5820   16.471   12.540   10.335   14.156   6.4545   17.265   6.0013 -3.108538 8.813375 
1 1 1   21    1  -48 o   28.166   4.4475   34.648   9.8727   40.623   16.927   31.567   12.154   29.204   7.1654   26.279   5.8266 2.924644 9.235439 
1 1 1   21    1  -47 o   57.897   2.7386  139.443   12.888  141.132   27.625  138.973   14.571   56.047   6.1473   57.629   3.1133 -1.581997 6.890773 
1 1 1   21    1  -46 o   30.243   4.0929   39.374   9.8314   65.052   16.445   25.092   12.264   38.338   5.4126   23.315   6.3034 15.02299 8.308372 
1 1 1   21    1  -45 o   10.282   4.8010  -8.3668   9.9302   4.9046   15.106 -18.4667   13.178   16.274   6.8053   10.568   5.0991 5.706016 8.503716 
1 1 1   21    1  -44 o   35.818   2.7504   53.469   7.9688   61.132   11.530   46.461   11.026   37.958   3.7763   32.883   4.2100 5.075588 5.655540 
1 1 1   21    1  -43 o   16.655   5.0525   12.088   7.4564   24.754   10.798   0.5433   10.309   23.394   5.7126   12.806   5.4985 10.58793 7.928904 
1 1 1   21    1  -42 o   27.380   3.5529   31.846   7.7427   35.977   11.107   27.941   10.799   28.635   4.9368   24.979   5.4566 3.655811 7.358467 
1 1 1   21    1  -41 o   42.168   2.3926   73.553   8.1902   80.485   11.727   66.953   11.443   43.831   3.3067   39.868   3.5585 3.963047 4.857741 
1 1 1   21    1  -40 o   38.683   2.6098   62.084   8.1812   55.611   11.840   67.999   11.318   36.133   4.0918   40.222   3.4863 -4.088451 5.375575 
1 1 1   21    1  -39 o   36.538   2.7593   55.513   8.1575   52.474   11.733   58.356   11.349   35.069   4.1872   37.146   3.8017 -2.076553 5.655552 
1 1 1   21    1  -38 o   36.401   2.7526   55.066   8.1069   45.652   11.648   63.909   11.290   32.584   4.5059   38.978   3.5938 -6.393654 5.763546 
1 1 1   21    1  -37 o   74.996   1.7207  230.463   10.519  221.067   15.090  239.344   14.670   73.181   2.5335   76.211   2.3644 -3.029984 3.465352 
1 1 1   21    1  -36 o  102.911   1.6749  433.767   14.051  402.466   21.846  455.851   18.349   98.699   2.7179  105.336   2.1370 -6.637581 3.457441 
1 1 1   21    1  -35 o   43.698   2.5781   78.964   9.1423   82.044   14.804   77.064   11.624   44.043   4.1732   42.956   3.3460 1.086994 5.348966 
1 1 1   21    1  -34 o   18.357   5.2399   14.734   8.2271   10.976   13.277   17.077   10.482   17.778   6.7097   19.758   5.9899 -1.979841 8.994404 
1 1 1   21    1  -33 o   44.177   2.5538   80.625   9.1572   75.629   14.548   83.903   11.785   42.269   4.2813   44.887   3.2426 -2.618565 5.370688 
1 1 1   21    1  -32 o   17.161   5.2808   12.592   8.1078   10.621   10.833   15.102   12.225   16.882   6.1160   19.153   6.5321 -2.270416 8.948413 
1 1 1   21    1  -31 o   35.138   3.0654   51.401   8.6924   53.106   11.600   49.217   13.126   35.439   4.0906   33.836   4.9019 1.602982 6.384490 
1 1 1   21    1  -30 f   17.647   5.6626   13.108   9.2276   8.0480   13.465   17.588   12.671   16.896   6.6544   20.331   6.6445 -3.435167 9.403681 
1 1 1   21    1  -29 o   17.540   5.3205   13.182   8.2685   18.864   11.076   6.0290   12.427   20.752   6.1262   15.809   6.3382 4.943014 8.814950 
1 1 1   21    1  -28 o   9.8840   4.5103  -4.8906   8.0645   5.4435   10.767 -18.0982   12.172   14.860   5.9190   10.153   4.8992 4.706682 7.683585 
1 1 1   21    1  -27 o   51.351   2.1756  108.347   9.0862  118.196   13.040   99.051   12.668   53.447   3.0051   48.862   3.1981 4.584187 4.388444 
1 1 1   21    1  -26 o   23.837   4.1393   24.311   7.7514   27.841   11.251   21.122   10.694   25.160   5.6273   21.895   5.8717 3.264980 8.132868 
1 1 1   21    1  -25 o   15.176   5.5258   8.1968   8.8582   0.1038   12.336   16.812   12.728   13.998   6.0127   20.088   6.6640 -6.090203 8.975565 
1 1 1   21    1  -24 o   60.330   2.0680  149.301   10.155  180.948   15.815  127.099   13.247   66.215   2.9374   55.471   2.9400 10.74338 4.155974 
1 1 1   21    1  -23 o   45.394   2.9862   85.246   10.988  136.459   18.185   55.791   13.791   57.205   3.9235   36.212   4.7893 20.99291 6.191198 
1 1 1   21    1  -22 o   53.096   2.3860  115.907   10.301  119.861   14.799  112.191   14.346   53.761   3.3943   52.003   3.4029 1.757488 4.806359 
1 1 1   21    1  -21 o  117.759   1.7546  567.214   16.843  581.823   24.077  553.216   23.569  119.054   2.4810  116.087   2.4907 2.966942 3.515560 
1 1 1   21    1  -20 o  126.922   1.9040  659.272   19.698  673.607   31.261  649.832   25.369  127.906   2.9983  125.832   2.4733 2.073799 3.886718 
1 1 1   21    1  -19 o   63.473   2.1737  165.259   11.230  167.408   16.093  163.220   15.677   63.673   3.1101   62.880   3.0679 0.7923584 4.368579 
1 1 1   21    1  -18 o   26.390   4.3343   29.675   9.0004   25.785   12.993   33.265   12.480   24.180   6.4664   27.605   5.7338 -3.424789 8.642418 
1 1 1   21    1  -17 o   80.996   1.9091  268.431   12.605  275.918   18.031  261.275   17.628   81.914   2.7040   79.705   2.7171 2.208900 3.833363 
1 1 1   21    1  -16 o  103.123   1.7802  434.881   14.964  457.260   21.692  414.558   20.671  105.566   2.5208  100.484   2.5256 5.082344 3.568334 
1 1 1   21    1  -15 o   20.450   5.2835   18.189   8.8699   20.351   13.008   16.310   12.126   21.766   6.6873   19.852   6.5008 1.913651 9.326389 
1 1 1   21    1  -14 o   71.932   2.0015  211.912   11.724  222.137   17.029  202.697   16.166   73.467   2.8490   70.178   2.8318 3.288979 4.016928 
1 1 1   21    1  -13 o   64.117   2.1247  168.500   11.089  183.914   16.176  154.832   15.232   66.812   2.9776   61.272   3.0594 5.539494 4.269178 
1 1 1   21    1  -12 o   48.499   2.8108   96.935   11.065  109.415   14.639   80.304   16.899   51.382   3.5163   43.637   4.8316 7.744705 5.975688 
1 1 1   21    1  -11 o   97.454   2.6191  389.967   20.787  389.967   20.787   0.0000   0.0000   97.454   2.6191  ?   ?  0.000000 2.619118 
1 1 1   21    1  -10 o   62.782   2.6809  162.060   13.688  144.356   19.610  178.882   19.116   58.896   4.1105   65.748   3.5803 -6.851444 5.451090 
1 1 1   21    1   -9 o  103.512   2.2113  438.757   18.658  414.169   26.372  463.399   26.401  100.253   3.2313  106.110   3.0554 -5.857536 4.447171 
1 1 1   21    1   -8 o   33.913   3.5879   47.958   9.7683   61.322   16.883   41.234   11.976   37.843   5.6457   31.107   4.8839 6.735815 7.464949 
1 1 1   21    1   -7 o   65.237   2.3513  174.588   12.483  165.502   19.863  180.520   16.048   63.162   3.8766   66.209   2.9812 -3.046482 4.890398 
1 1 1   21    1   -6 o   49.094   2.6156   99.138   10.429   99.557   15.288   98.774   14.264   48.935   3.8638   48.802   3.6112 0.1335716 5.288697 
1 1 1   21    1   -5 o   17.467   5.8875   12.121   9.9290   16.450   13.399   6.8486   14.787   20.220   6.8392   17.250   6.9146 2.969984 9.725598 
1 1 1   21    1   -4 o   65.390   2.3681  175.410   12.602  172.686   16.539  179.180   19.458   64.720   3.1444   65.802   3.6419 -1.082085 4.811484 
1 1 1   21    1   -3 o   51.565   2.7843  109.460   11.660  121.959   15.638   93.811   17.498   54.273   3.5543   47.306   4.5955 6.966953 5.809588 
1 1 1   21    1   -2 o  110.211   2.1672  497.204   19.470  504.954   27.796  489.739   27.280  110.780   3.0811  109.101   3.0705 1.679474 4.349896 
1 1 1   21    1   -1 o   90.510   2.0592  335.197   15.193  325.497   23.927  341.749   19.666   88.858   3.3092   91.237   2.6470 -2.379288 4.237627 
1 1 1   21    1    0 o  116.740   1.9328  557.362   18.392  556.317   29.289  558.042   23.633  116.279   3.0928  116.680   2.4848 -0.4011383 3.967335 
1 1 1   21    1    1 o   20.150   5.7975   17.472   10.033  -3.5230   15.863   31.472   12.953   15.044   6.6330   26.834   6.0649 -11.78957 8.987716 
1 1 1   21    1    2 o   15.897   5.6443   9.3057   9.1759  -1.5362   13.468   18.699   12.536   14.267   6.2050   21.026   6.5822 -6.759421 9.045837 
1 1 1   21    1    3 o   26.326   4.5177   29.546   9.3458   22.173   13.422   36.484   13.021   22.661   6.7575   29.017   5.7084 -6.356623 8.845886 
1 1 1   21    1    4 o   38.639   3.1115   61.782   9.7172   69.584   14.223   54.953   13.307   40.743   4.3499   36.084   4.6305 4.658840 6.353171 
1 1 1   21    1    5 o   26.037   4.5470   28.935   9.2997   28.822   13.496   29.038   12.833   25.611   6.4648   25.740   6.1919 -0.1287804 8.951762 
1 1 1   21    1    6 o   21.979   5.1506   20.960   9.0659   26.401   13.323   16.267   12.372   24.530   6.5426   19.922   6.5687 4.607353 9.271149 
1 1 1   21    1    7 o   63.344   2.1977  164.480   11.331  153.203   16.237  175.184   15.820   60.915   3.2821   65.220   2.9835 -4.305622 4.435460 
1 1 1   21    1    8 o   46.582   3.0236   89.576   11.419  101.679   19.322   83.080   14.155   49.166   4.8859   44.657   3.9287 4.509014 6.269459 
1 1 1   21    1    9 o   35.994   3.7265   54.056   10.776   61.532   18.097   49.949   13.413   37.763   6.0859   34.281   4.9425 3.481457 7.840067 
1 1 1   21    1   10 o   48.831   3.3968   98.730   13.436  109.822   19.636   88.964   18.426   51.142   4.7650   45.914   5.0041 5.227474 6.909828 
1 1 1   21    1   11 o   49.248   3.3563  100.390   13.393  103.554   19.452   97.537   18.467   49.610   4.8730   48.167   4.7659 1.442783 6.816144 
1 1 1   21    1   12 o   46.884   3.0710   90.805   11.672   81.852   14.844  105.307   18.892   44.249   4.1643   50.084   4.6816 -5.835171 6.265722 
1 1 1   21    1   13 o   49.842   2.5864  102.200   10.472   94.163   14.998  109.845   14.628   47.549   3.9039   51.481   3.5067 -3.931839 5.247653 
1 1 1   21    1   14 o   54.954   2.4030  124.042   10.738  117.725   15.557  129.791   14.841   53.275   3.6035   56.035   3.2633 -2.760433 4.861540 
1 1 1   21    1   15 o   84.303   1.9230  290.779   13.215  288.330   19.133  293.013   18.273   83.720   2.8076   84.438   2.6581 -0.7182159 3.866284 
1 1 1   21    1   16 o   28.038   4.3205   33.382   9.5577   50.397   14.141   19.070   12.969   34.319   5.2189   21.193   6.7032 13.12605 8.495270 
1 1 1   21    1   17 o   69.940   2.1065  200.499   11.996  190.356   17.454  209.577   16.514   67.906   3.1619   71.344   2.8453 -3.437378 4.253579 
1 1 1   21    1   18 o  134.549   1.9416  740.897   21.295  777.952   35.013  719.145   26.827  137.424   3.1256  132.386   2.4859 5.038589 3.993661 
1 1 1   21    1   19 o   52.958   2.4851  115.342   10.698  114.693   15.538  115.926   14.750   52.537   3.6509   52.876   3.4409 -0.3389740 5.016876 
1 1 1   21    1   20 o   21.721   5.2116   20.585   9.1094   14.802   13.333   25.647   12.475   19.451   6.8127   24.107   6.2848 -4.655743 9.268882 
1 1 1   21    1   21 o   33.652   3.5047   47.298   9.4733   50.289   13.859   44.675   12.979   34.268   5.1181   32.265   5.1044 2.002960 7.228363 
1 1 1   21    1   22 o   50.878   2.5101  106.543   10.378  117.334   15.479   97.732   13.988   53.133   3.5950   48.480   3.5645 4.653748 5.062594 
1 1 1   21    1   23 o   27.793   4.1862   32.817   9.1899   21.236   13.525   42.749   12.525   22.125   6.8229   31.549   5.0399 -9.424337 8.482442 
1 1 1   21    1   24 o   38.345   3.0899   61.012   9.5761   47.931   14.046   72.373   13.090   33.334   5.3500   41.575   3.9084 -8.240623 6.625583 
1 1 1   21    1   25 o   43.881   2.8462   79.611   10.126   80.274   14.667   79.006   13.997   43.716   4.1662   43.417   4.0000 0.2993507 5.775554 
1 1 1   21    1   26 o   24.627   4.7668   26.247   9.2231   35.098   13.634   18.780   12.523   28.172   6.1132   20.897   6.5841 7.274820 8.984566 
1 1 1   21    1   27 o   15.359   5.5562   8.5613   8.9364   0.0385   13.160   15.854   12.174   14.395   6.1970   19.542   6.5182 -5.146418 8.993890 
1 1 1   21    1   28 o   68.521   2.3616  193.056   13.171  206.767   17.355  174.437   20.224   70.720   3.0176   64.653   3.8550 6.067665 4.895571 
1 1 1   21    1   29 o   35.345   3.3856   52.194   9.6355   48.004   14.095   55.869   13.202   33.272   5.3806   36.231   4.5717 -2.958694 7.060561 
1 1 1   21    1   30 f   49.668   3.1427  102.383   12.659  117.362   20.221   92.730   16.233   52.602   4.7677   46.891   4.2944 5.710098 6.416656 
1 1 1   21    1   31 o   28.261   4.7910   34.499   10.643   6.4811   15.328   60.585   14.790   17.127   6.9768   37.586   4.9473 -20.45906 8.552886 
1 1 1   21    1   32 o   58.822   3.1606  143.581   15.099  153.380   18.794  125.744   25.356   60.553   3.8272   53.867   5.8695 6.686066 7.007002 
1 1 1   21    1   33 o   32.710   3.8125   45.169   9.9751   47.372   15.965   43.758   12.776   32.643   6.2269   31.766   5.1070 0.8775520 8.053358 
1 1 1   21    1   34 o   45.264   2.7290   84.815   10.022  100.279   14.836   71.835   13.593   48.909   3.7499   41.234   4.0982 7.675518 5.554900 
1 1 1   21    1   35 o   51.805   2.6635  110.975   11.210  110.707   15.190  111.296   16.610   51.422   3.6477   51.425   3.9938 -0.3040314E-02 5.408889 
1 1 1   21    1   36 o   25.934   4.9724   29.443   10.129   28.418   13.368   30.825   15.523   25.034   6.4956   25.924   7.1260 -0.8902473 9.642174 
1 1 1   21    1   37 o   25.653   4.7740   28.716   9.6154   25.939   15.364   30.504   12.328   23.880   7.2543   26.071   5.9347 -2.191078 9.372592 
1 1 1   21    1   38 o   31.372   3.7534   41.702   9.4083   45.857   13.876   38.167   12.800   32.281   5.4684   29.356   5.5522 2.924435 7.792906 
1 1 1   21    1   39 o   53.385   2.6386  117.996   11.447   96.878   18.343  131.464   14.649   47.495   4.8040   56.148   3.2141 -8.653137 5.780005 
1 1 1   21    1   40 o   15.491   5.5437   9.2079   8.8687   6.4174   13.111   11.561   12.041   16.035   6.4817   17.486   6.4304 -1.450596 9.130282 
1 1 1   21    1   41 o   25.446   4.6150   28.284   9.2200   28.085   13.642   28.452   12.510   24.711   6.6339   24.994   6.1762 -0.2831726 9.063910 
1 1 1   21    1   42 o   34.060   3.4286   48.906   9.3899   52.104   13.853   46.189   12.771   34.522   5.0743   32.510   4.9774 2.012108 7.107985 
1 1 1   21    1   43 o   10.823   4.8127  -2.3864   8.5267  -9.6586   12.387   4.1632   11.755   11.573   5.3900   14.676   6.0585 -3.103044 8.109140 
1 1 1   21    1   44 o   33.778   3.4807   48.221   9.4467   37.487   13.742   57.840   13.008   28.719   6.0607   36.638   4.4464 -7.919399 7.516798 
1 1 1   21    1   45 o   32.518   3.5744   44.846   9.3184   43.908   13.587   45.678   12.804   31.371   5.5143   32.231   5.0384 -0.8601627 7.469512 
1 1 1   21    1   46 o   50.515   2.5352  105.848   10.406  102.604   15.349  108.607   14.155   49.173   3.8603   50.803   3.4384 -1.630615 5.169577 
1 1 1   21    1   47 o   57.619   2.9899  138.644   13.995  125.578   20.402  150.255   19.233   53.893   4.6910   59.440   3.9926 -5.547642 6.160002 
1 1 1   21    1   48 o   13.589   6.0242  -2.0766   13.258 -11.9305   16.369   16.713   22.604   13.198   6.1630   21.374   8.5554 -8.176570 10.54408 
1 1 1   21    1   49 o   23.038   6.7933   24.930   13.626   25.866   16.794   23.127   23.310   23.376   7.6502   23.075   8.8471 0.3014278 11.69603 
1 1 1   21    1   50 o   24.269   5.2841   26.653   10.156   28.398   13.538   24.406   15.360   24.538   6.6179   22.747   7.3065 1.790775 9.858035 
1 1 1   21    1   51 o   49.081   2.8287  100.679   11.269  111.519   14.922   86.291   17.192   51.283   3.5924   44.385   4.8296 6.898136 6.019169 
1 1 1   21    1   52 o   19.552   5.8036   17.496   9.9180   13.712   13.096   22.585   15.187   18.257   6.7075   21.936   7.2794 -3.679052 9.898502 
1 1 1   21    1   53 o   25.784   4.5995   29.481   9.3125   17.745   13.656   39.683   12.732   19.879   6.8990   29.559   5.4861 -9.679886 8.814427 
1 1 1   21    1   54 o   10.976   4.9025  -2.4447   8.9503 -17.1309   13.329   9.6148   12.078   10.737   5.1673   16.419   6.3493 -5.682185 8.186205 
1 1 1   21    1   55 o   21.210   5.3375   20.651   9.2194   33.962   14.034   10.546   12.228   26.716   6.5059   16.783   6.4146 9.932617 9.136375 
1 1 1   21    1   56 f   33.736   3.6738   48.840   9.9398   41.077   14.775   55.258   13.434   29.513   6.3315   35.321   4.7892 -5.808624 7.938784 
1 1 1   21    1   57 o   43.401   2.9451   79.257   10.358   77.877   15.315   80.420   14.061   42.141   4.5293   43.132   4.0466 -0.9906540 6.073618 
1 1 1   21    1   58 o   38.021   3.9507   62.540   12.066   63.934   18.405   61.489   15.978   36.868   6.3536   36.745   5.5038 0.1233978 8.405929 
1 1 1   21    1   59 o   19.335   5.9288   17.448   10.231   18.902   16.738   16.581   12.927   20.396   7.5668   19.103   6.7067 1.292551 10.11126 
1 1 1   21    1   60 o   23.726   5.3552   26.104   10.111   38.452   16.754   19.031   12.680   27.660   7.3183   20.056   6.6514 7.604479 9.889309 
1 1 1   21    1   61 o   20.032   5.7806   18.967   9.9608   13.415   16.156   22.371   12.651   18.425   7.2790   21.449   6.5959 -3.023884 9.822912 
1 1 1   21    1   62 o   9.3082   4.4511 -11.1353   9.5411 -18.0287   15.809  -7.1856   11.966   11.717   5.6360   11.511   5.3393 0.2062235 7.763534 
1 1 1   21    1   63 f   18.655   6.3722   16.349   11.635   28.533   21.485   11.295   13.839   23.215   8.5804   17.095   6.7421 6.119701 10.91235 
1 1 1   21    1   64 o   17.741   6.0443   14.632   10.467   21.993   15.757   8.8179   14.003   20.950   7.4004   16.290   6.6562 4.660168 9.953436 
1 1 1   21    1   65 o   32.247   4.3650   46.574   11.179   64.270   17.106   33.379   14.771   36.691   5.9208   25.520   6.9252 11.17061 9.111195 
1 1 1   21    1   66 o   10.898   5.0156  -4.9902   10.261 -21.5315   15.484   7.9634   13.702   10.982   5.3517   15.805   6.5343 -4.822520 8.446168 
1 1 1   21    1   67 o   22.566   5.8689   25.100   10.896   17.391   16.551   30.996   14.475   19.111   7.4209   24.331   6.9519 -5.219810 10.16849 
1 1 1   21    1   68 o   42.123   3.4993   77.293   11.907   80.750   18.042   74.625   15.848   41.216   5.5078   40.148   4.9471 1.067791 7.403306 
1 1 1   21    1   69 o   31.467   4.4842   45.278   11.177   44.476   16.708   45.928   15.037   28.861   7.1415   30.169   6.3172 -1.308485 9.534533 
1 1 1   21    1   70 o   20.431   6.1623   21.333   11.114   47.133   16.874   1.5641   14.771   29.704   7.0713   14.229   6.3304 15.47461 9.490860 
1 1 1   21    1   71 o   22.782   5.9308   26.330   11.120   11.012   16.584   38.841   14.988   16.899   7.1026   26.996   6.8120 -10.09773 9.841270 
1 1 1   21    1   72 o   31.217   4.6690   45.548   11.516   48.548   17.282   43.151   15.446   29.701   7.2115   28.418   6.7655 1.282528 9.888205 
1 1 1   21    1   73 o   13.310   6.1561  -3.6297   15.737  -3.6297   15.737   0.0000   0.0000   13.310   6.1561  ?   ?  0.000000 6.156054 
1 1 1   21    1   74 o   25.965   5.4544   33.627   11.176   43.784   16.755   25.485   15.002   27.662   7.3186   21.017   7.2339 6.644903 10.29035 
1 1 1   21    1   75 o   36.624   4.0226   61.239   11.812   61.616   17.820   60.944   15.775   33.782   6.7078   34.700   5.7803 -0.9184990 8.854738 
1 1 1   21    1   76 o   21.934   6.0296   25.583   11.114   30.387   16.463   21.562   15.064   22.286   7.5806   19.365   7.1797 2.920824 10.44095 
1 1 1   21    1   77 o   13.797   6.1251   3.2160   13.755  -5.2074   20.589   10.006   18.485   14.273   6.7421   16.362   7.1890 -2.088165 9.855804 
1 1 1   21    1   78 o   10.725   5.1656 -12.6444   13.384 -18.1350   20.261  -8.3940   17.827   12.618   6.1428   13.012   6.1835 -0.3944836 8.716079 
1 1 1   21    1   79 o   24.423   6.8938   34.371   14.321   40.046   21.204   29.611   19.420   23.849   8.5675   21.147   8.0834 2.702219 11.77889 
1 1 1   21    1   80 o   17.066   6.6974   15.465   13.597   29.001   20.828   5.4125   17.950   20.648   8.2300   15.175   6.8466 5.473453 10.70559 
1 1 1   21    1   81 o   18.558   6.8609   19.949   13.738   8.4573   20.886   28.713   18.240   16.159   7.3286   20.841   7.8647 -4.682161 10.74993 
1 1 1   21    1   82 o   14.047   6.1430   5.5841   13.356   34.060   20.654 -14.8806   17.510   21.822   8.3376   11.927   5.7842 9.895161 10.14750 
1 1 1   21    1   83 f   19.476   8.1004   25.546   21.233   25.546   21.233   0.0000   0.0000   19.476   8.1004  ?   ?  0.000000 8.100352 
1 1 1   21    1   84 o   15.539   7.1232   6.1566   20.417   6.1566   20.417   0.0000   0.0000   15.539   7.1232  ?   ?  0.000000 7.123189 
1 1 1   21    1   87 o   56.952   6.9780  187.532   31.719  187.532   31.719   0.0000   0.0000   56.952   6.9780  ?   ?  0.000000 6.978047 
1 1 1   21    1   88 o   15.218   6.8652   7.7560   18.041   2.0049   25.701   13.342   25.329   15.528   7.3918   16.914   7.8186 -1.386825 10.75960 
1 1 1   21    1   89 o   13.591   6.4218  -2.7631   18.709 -10.7060   26.411   5.2369   26.506   14.299   6.9728   15.923   7.5591 -1.624172 10.28395 
1 1 1   21    1   90 o   16.864   7.3127   16.244   18.589   9.8351   25.976   22.971   26.614   16.333   7.6710   18.155   8.2493 -1.821640 11.26473 
1 1 1   21    1   91 o   11.414   5.6014 -18.6197   17.870  -3.8591   25.746 -32.3412   24.823   14.772   7.1274   12.227   6.1037 2.544643 9.383736 
1 1 1   21    1   92 o   13.758   6.4335  -0.0858   17.940 -24.0529   25.304   24.135   25.438   12.932   6.4057   18.370   8.2305 -5.437917 10.42950 
1 1 1   21    2  -82 o   13.899   6.8015 -15.3577   25.773 -15.3577   25.773   0.0000   0.0000   13.899   6.8015  ?   ?  0.000000 6.801509 
1 1 1   21    2  -81 f   16.831   7.8354   10.746   26.137   10.746   26.137   0.0000   0.0000   16.831   7.8354  ?   ?  0.000000 7.835423 
1 1 1   21    2  -80 f   13.577   6.6641 -19.1715   25.330 -19.1715   25.330   0.0000   0.0000   13.577   6.6641  ?   ?  0.000000 6.664082 
1 1 1   21    2  -79 o   13.629   6.6694 -17.6442   24.780 -17.6442   24.780   0.0000   0.0000   13.629   6.6694  ?   ?  0.000000 6.669378 
1 1 1   21    2  -78 o   14.264   6.8443  -7.5067   22.984  -7.5067   22.984   0.0000   0.0000   14.264   6.8443  ?   ?  0.000000 6.844326 
1 1 1   21    2  -77 o   20.108   8.5555   28.925   24.553   28.925   24.553   0.0000   0.0000   20.108   8.5555  ?   ?  0.000000 8.555502 
1 1 1   21    2  -76 o   18.337   8.2055   18.616   25.197   18.616   25.197   0.0000   0.0000   18.337   8.2055  ?   ?  0.000000 8.205503 
1 1 1   21    2  -75 o   17.688   7.9271   14.678   23.614   14.678   23.614   0.0000   0.0000   17.688   7.9271  ?   ?  0.000000 7.927051 
1 1 1   21    2  -74 o   15.302   7.2083  -1.4528   23.244  -1.4528   23.244   0.0000   0.0000   15.302   7.2083  ?   ?  0.000000 7.208301 
1 1 1   21    2  -73 o   17.394   7.3309   15.133   17.745   15.133   17.745   0.0000   0.0000   17.394   7.3309  ?   ?  0.000000 7.330914 
1 1 1   21    2  -72 o   14.493   6.1013   7.3988   12.269   17.239   17.643  -1.8154   17.072   17.998   7.4252   13.835   6.4035 4.162700 9.805069 
1 1 1   21    2  -71 o   22.368   6.1306   26.710   11.508   28.895   18.126   25.234   14.896   21.475   7.8908   20.772   7.2056 0.7031021 10.68571 
1 1 1   21    2  -70 o   22.126   6.0311   25.775   11.173   12.358   18.232   33.846   14.140   17.054   7.3171   24.668   6.8091 -7.613609 9.995234 
1 1 1   21    2  -69 o   16.328   5.7915   13.052   9.6586   6.9198   13.236   20.036   14.126   14.799   6.2886   19.160   6.9778 -4.360686 9.393394 
1 1 1   21    2  -68 o   25.121   5.0266   30.401   9.9333   45.886   13.818   13.843   14.289   30.269   5.8116   17.163   6.8246 13.10642 8.963815 
1 1 1   21    2  -67 o   14.151   5.5976   7.6574   9.5659   4.3009   13.243   11.319   13.832   14.265   6.1789   16.415   6.6494 -2.150001 9.077060 
1 1 1   21    2  -66 o   11.189   5.0158  -1.3637   9.4600   4.4516   13.117  -7.6671   13.656   14.323   6.1766   11.923   5.5875 2.400331 8.328868 
1 1 1   21    2  -65 o   16.993   5.7817   13.905   9.5769   11.979   13.191   16.051   13.926   16.661   6.5787   18.155   6.8674 -1.493454 9.510060 
1 1 1   21    2  -64 o   9.7914   4.5932  -6.9836   9.2665  -3.0685   12.980 -11.0527   13.233   12.586   5.7353   11.233   5.3350 1.353301 7.832942 
1 1 1   21    2  -63 o   14.103   5.5628   7.1897   9.4226   16.004   13.525  -1.1237   13.135   18.273   6.7976   13.123   5.8944 5.149594 8.997334 
1 1 1   21    2  -62 o   17.911   6.2398   15.334   11.176   25.874   14.163  -2.0599   18.195   22.250   7.0009   14.905   6.7912 7.345372 9.753610 
1 1 1   21    2  -61 o   21.363   6.1381   22.611   11.254   28.234   14.300   13.462   18.239   23.340   6.9786   18.381   7.5632 4.958391 10.29091 
1 1 1   21    2  -60 o   13.694   5.7299   4.2759   10.719   8.0095   13.666  -1.6930   17.279   15.889   6.5430   14.807   6.6955 1.081830 9.361660 
1 1 1   21    2  -59 o   18.534   6.2013   16.299   11.017   4.1083   13.913   36.793   18.040   14.933   6.3993   26.212   7.8384 -11.27862 10.11889 
1 1 1   21    2  -58 o   49.066   2.7500  101.444   10.955   83.413   15.480  119.530   15.504   43.349   4.4437   52.644   3.6353 -9.294651 5.741253 
1 1 1   21    2  -57 o   28.017   4.1421   34.718   9.1749   29.329   12.475   41.067   13.540   24.575   6.2225   29.466   5.8438 -4.891172 8.536377 
1 1 1   21    2  -56 o   21.766   4.7298   21.602   8.1515   25.612   12.194   18.361   10.961   22.971   6.3163   19.664   6.1547 3.306458 8.819023 
1 1 1   21    2  -55 o   23.609   4.4452   24.978   8.2410   21.650   12.316   27.677   11.089   21.191   6.5064   24.251   5.7055 -3.059639 8.653695 
1 1 1   21    2  -54 o   27.686   3.8319   33.370   8.4163   29.553   12.773   36.299   11.189   24.794   6.3061   28.284   5.0378 -3.490208 8.071290 
1 1 1   21    2  -53 o   22.362   4.7275   22.618   8.3475   13.644   12.649   29.543   11.111   17.924   6.5907   25.224   5.5542 -7.299803 8.618977 
1 1 1   21    2  -52 o   39.642   2.7863   65.993   8.9463   60.002   13.610   70.550   11.871   36.856   4.6324   40.590   3.6261 -3.734058 5.882783 
1 1 1   21    2  -51 o   23.609   4.8208   25.137   8.9636   44.416   14.974   14.371   11.190   30.776   6.1838   18.046   6.2460 12.73002 8.789309 
1 1 1   21    2  -50 o   42.209   2.8214   74.735   9.6517   49.534   15.511   90.659   12.330   32.669   6.0470   46.278   3.2899 -13.60850 6.884040 
1 1 1   21    2  -49 f   18.889   5.2978   16.297   8.4859  -2.3876   13.888   27.431   10.720   13.684   6.1099   24.412   5.5173 -10.72786 8.232326 
1 1 1   21    2  -48 o   18.322   5.1834   15.243   8.0870   3.9032   12.359   23.733   10.694   14.631   6.1394   22.599   5.7822 -7.968075 8.433583 
1 1 1   21    2  -47 o   60.625   2.1283  151.989   10.502  145.746   14.601  158.680   15.116   58.920   3.0504   61.500   3.0245 -2.580036 4.295629 
1 1 1   21    2  -46 o   9.8571   4.4968  -4.2356   8.0084  -0.3249   13.075  -6.5833   10.131   13.836   6.0636   10.718   4.9509 3.117560 7.828110 
1 1 1   21    2  -45 o   42.643   2.6471   75.852   9.1559   59.564   14.361   87.007   11.884   36.737   4.9191   45.434   3.2300 -8.697063 5.884787 
1 1 1   21    2  -44 f   45.272   2.5017   85.216   9.1963  102.963   14.804   74.065   11.735   49.211   3.7180   41.811   3.4745 7.400105 5.088815 
1 1 1   21    2  -43 o   25.278   4.2970   27.970   8.5377   19.978   13.559   33.220   10.990   20.896   6.8760   27.237   5.1383 -6.341280 8.583783 
1 1 1   21    2  -42 o   38.598   3.0811   62.589   9.6135   63.661   14.126   61.663   13.121   38.237   4.6260   37.767   4.3408 0.4699287 6.343643 
1 1 1   21    2  -41 o   14.617   5.6794   6.7940   9.6992   26.391   16.037  -4.5079   12.179   23.624   7.4519   12.456   5.6279 11.16788 9.338329 
1 1 1   21    2  -40 o   41.354   2.9000   71.479   9.7137   68.677   13.815   74.218   13.660   39.941   4.3116   41.650   4.0757 -1.709831 5.933029 
1 1 1   21    2  -39 o   25.882   4.0924   29.000   8.3471   18.267   12.934   36.662   10.927   20.249   6.7178   28.875   4.8117 -8.626297 8.263208 
1 1 1   21    2  -38 o   17.629   4.9979   13.791   7.5104   18.065   10.845   9.8531   10.411   20.026   6.0973   16.191   5.9748 3.835106 8.536645 
1 1 1   21    2  -37 o   11.714   4.9038   1.6730   7.8568   1.6239   12.204   1.7077   10.267   14.096   6.0156   13.124   5.5561 0.9718351 8.188886 
1 1 1   21    2  -36 o   23.623   4.1738   24.238   7.7432   16.044   11.222   31.683   10.697   19.146   6.2530   26.743   5.0931 -7.597475 8.064708 
1 1 1   21    2  -35 o   17.972   5.3743   14.248   8.4806   22.729   11.170   2.7079   13.030   22.358   6.0033   14.826   6.2671 7.531423 8.678494 
1 1 1   21    2  -34 o   28.267   3.8550   34.146   8.6513   32.252   11.355   36.768   13.357   26.911   5.3647   28.539   5.9352 -1.628090 8.000412 
1 1 1   21    2  -33 o   91.471   1.8647  343.476   13.903  350.852   19.638  336.062   19.687   92.092   2.6186   90.095   2.6837 1.997093 3.749592 
1 1 1   21    2  -32 o   41.827   2.9410   72.890   9.9635   98.378   14.262   48.589   13.925   48.358   3.6448   33.247   5.3174 15.11113 6.446670 
1 1 1   21    2  -31 o   26.716   3.7206   30.406   7.8830   19.512   11.428   40.294   10.888   20.872   6.2382   30.549   4.5076 -9.676468 7.696292 
1 1 1   21    2  -30 o   35.243   2.8673   51.747   8.1662   54.708   12.026   49.214   11.124   35.816   4.1988   33.983   4.0985 1.832767 5.867467 
1 1 1   21    2  -29 o   28.122   3.7970   33.644   8.4817   25.816   13.731   38.474   10.785   23.799   6.7616   29.841   4.5799 -6.042356 8.166650 
1 1 1   21    2  -28 o   40.830   2.5700   69.028   8.5103   57.290   12.246   79.991   11.835   36.701   4.1670   43.736   3.3451 -7.034988 5.343577 
1 1 1   21    2  -27 o   36.139   2.8224   54.300   8.2486   66.638   11.917   42.950   11.429   39.787   3.7173   31.590   4.5711 8.196846 5.891792 
1 1 1   21    2  -26 o   36.601   3.0445   55.841   9.0011   61.159   12.119   49.298   13.442   38.032   3.9676   33.721   5.0450 4.310658 6.418244 
1 1 1   21    2  -25 o   11.547   4.9329   0.3327   8.2205  -2.2930   10.838   3.8900   12.615   12.399   5.4740   15.124   6.2629 -2.725273 8.317976 
1 1 1   21    2  -24 o   13.508   5.3191   4.8654   8.6022   10.937   12.221  -1.0975   12.111   17.416   6.4649   13.454   5.8673 3.962111 8.730427 
1 1 1   21    2  -23 o   17.545   5.2593   13.310   8.1141   14.066   12.386   12.741   10.740   18.723   6.5655   17.755   6.1203 0.9675217 8.975732 
1 1 1   21    2  -22 o   17.668   5.2321   13.520   8.0684  -4.2919   12.291   27.010   10.696   12.772   5.7219   24.724   5.4538 -11.95177 7.904689 
1 1 1   21    2  -21 o   23.250   4.5272   23.447   8.2713   23.332   12.772   23.530   10.855   22.850   6.5308   23.000   5.7936 -0.1495419 8.730259 
1 1 1   21    2  -20 o   14.925   5.5872   7.4984   9.1653  -1.4230   19.241   10.117   10.424   16.794   7.3579   16.536   5.9982 0.2576256 9.492997 
1 1 1   21    2  -19 o   15.101   5.4267   8.4301   8.5077   9.9893   12.224   6.9653   11.848   17.108   6.4422   15.854   6.2427 1.253550 8.970689 
1 1 1   21    2  -18 f   48.235   2.5777   96.023   10.098   81.231   14.384  110.401   14.181   43.936   4.0622   51.501   3.3969 -7.564568 5.295313 
1 1 1   21    2  -17 o   56.053   2.3214  129.278   10.584  122.895   15.160  135.347   14.782   54.342   3.4401   57.120   3.1875 -2.778305 4.689825 
1 1 1   21    2  -16 o   27.750   4.0805   32.765   8.9550   28.054   12.913   37.130   12.430   25.056   6.3229   29.157   5.4295 -4.100536 8.334215 
1 1 1   21    2  -15 o   21.991   4.7481   21.068   8.2619   20.889   12.885   21.193   10.767   21.822   6.6463   21.891   5.9006 -0.6901741E-01 8.887663 
1 1 1   21    2  -14 o   40.446   2.7775   67.697   9.1017   65.551   14.283   69.165   11.810   39.305   4.5415   40.679   3.5987 -1.373909 5.794454 
1 1 1   21    2  -13 o   41.032   2.9005   69.747   9.6387   87.443   17.045   61.429   11.686   45.425   4.6698   38.268   3.7963 7.156841 6.018232 
1 1 1   21    2  -12 o   26.439   4.3609   29.931   9.0712   18.654   15.988   35.285   11.016   21.395   7.4625   28.596   4.9021 -7.200861 8.928600 
1 1 1   21    2  -11 o   53.758   2.4215  118.945   10.584  134.413   19.267  112.260   12.666   56.615   4.2050   52.086   2.9958 4.528671 5.163033 
1 1 1   21    2  -10 o   51.549   2.3212  109.293   9.7286  130.113   15.347   95.307   12.579   55.982   3.3789   47.920   3.2392 8.061764 4.680771 
1 1 1   21    2   -9 o   69.992   1.9282  200.791   10.991  220.048   17.257  187.649   14.256   73.019   2.9051   67.507   2.5955 5.511749 3.895640 
1 1 1   21    2   -8 f   14.511   5.3450   7.2585   8.3253   12.998   13.129   3.3988   10.767   18.622   6.7349   14.162   5.8173 4.459451 8.899372 
1 1 1   21    2   -7 o   69.382   1.9428  197.307   10.977  226.664   17.465  178.137   14.113   74.120   2.8962   65.765   2.6380 8.354538 3.917554 
1 1 1   21    2   -6 o   16.258   5.4355   10.665   8.4642  -0.1222   13.159   18.278   11.054   14.370   6.1916   20.517   6.1361 -6.146989 8.717098 
1 1 1   21    2   -5 o   73.255   1.9126  219.882   11.411  239.119   17.923  206.769   14.798   76.138   2.8931   70.885   2.5652 5.253357 3.866540 
1 1 1   21    2   -4 o   51.761   2.3269  110.163   9.7928  110.203   15.276  110.134   12.760   51.439   3.6672   51.593   3.0475 -0.1545525 4.768178 
1 1 1   21    2   -3 o   10.710   4.7666  -2.8308   8.3840   9.8769   13.162 -11.5082   10.876   17.487   6.6619   10.426   4.9172 7.061200 8.280043 
1 1 1   21    2   -2 o   77.878   1.8656  248.277   11.843  266.447   18.560  235.795   15.382   80.399   2.8364   75.725   2.4954 4.674309 3.777839 
1 1 1   21    2   -1 o   95.498   1.8616  373.321   14.492  382.884   21.001  364.627   20.023   96.455   2.6736   94.146   2.6117 2.308487 3.737505 
1 1 1   21    2    0 o  121.817   1.9506  607.709   19.369  593.362   25.300  628.027   30.107  120.155   2.5831  123.440   2.9921 -3.284561 3.952884 
1 1 1   21    2    1 o  109.145   3.0901  491.740   27.464   0.0000   0.0000  491.740   27.464  ?   ?   109.145   3.0901 0.000000 3.090064 
1 1 1   21    2    2 o   63.669   2.7059  167.035   14.012  154.041   20.935  177.579   18.858   60.648   4.2618   65.398   3.5508 -4.750271 5.547182 
1 1 1   21    2    3 o   26.104   5.4465   29.791   11.214   7.0112   17.077   47.062   14.870   18.061   7.3616   32.877   5.7582 -14.81623 9.346091 
1 1 1   21    2    4 o   35.093   3.6715   51.575   10.347   54.217   17.939   50.258   12.667   35.059   6.5167   34.366   4.6403 0.6930847 7.999999 
1 1 1   21    2    5 o   13.377   5.5860   2.0285   10.157  -0.3285   13.417   5.1926   15.545   14.452   6.2395   16.943   6.9779 -2.491151 9.360693 
1 1 1   21    2    6 o  113.468   2.2084  528.028   20.426  556.657   29.200  500.594   28.583  116.121   3.0876  110.067   3.1892 6.053848 4.438915 
1 1 1   21    2    7 o   88.028   2.3537  318.302   16.874  333.507   23.925  303.253   23.802   89.783   3.2746   85.550   3.4201 4.232643 4.734925 
1 1 1   21    2    8 f   29.332   5.0042   37.113   11.536   31.834   16.120   42.654   16.516   26.597   7.2417   30.915   6.7440 -4.317883 9.895628 
1 1 1   21    2    9 o   60.968   2.4302  152.909   12.053  160.966   19.674  148.068   15.250   62.110   3.9056   59.809   3.1391 2.300930 5.010765 
1 1 1   21    2   10 o   45.666   2.9233   86.295   10.825   80.184   17.363   90.180   13.844   43.384   5.0013   46.484   3.6837 -3.100372 6.211518 
1 1 1   21    2   11 o   20.513   5.6773   18.450   9.8152   36.262   16.395   8.5015   12.254   28.352   7.1083   16.623   6.4040 11.72869 9.567551 
1 1 1   21    2   12 o   31.933   3.7087   42.870   9.4746   33.790   13.878   50.797   12.967   27.553   6.3146   34.491   4.7370 -6.938353 7.893860 
1 1 1   21    2   13 o   55.485   2.4218  126.721   10.927  127.926   16.017  125.673   14.945   55.433   3.5635   55.009   3.3488 0.4248352 4.890055 
1 1 1   21    2   14 o   70.957   2.1116  206.661   12.200  214.615   18.007  199.912   16.587   72.029   3.0739   69.560   2.9319 2.469025 4.247967 
1 1 1   21    2   15 o   73.765   2.0755  223.295   12.468  234.578   18.439  213.792   16.922   75.326   3.0091   71.946   2.8913 3.380630 4.173042 
1 1 1   21    2   16 o  108.612   1.8288  483.103   16.191  478.763   23.402  487.088   22.425  107.836   2.6622  108.823   2.5280 -0.9872894 3.671300 
1 1 1   21    2   17 o   62.177   2.2465  158.929   11.367  132.922   16.532  182.251   15.655   56.465   3.6107   66.404   2.8992 -9.938400 4.630583 
1 1 1   21    2   18 f   16.142   5.6295   10.161   9.0982   21.821   13.752   1.0836   12.133   22.264   6.8822   14.112   6.0097 8.151641 9.136756 
1 1 1   21    2   19 o   14.528   5.4635   6.9549   8.7856   28.907   13.351  -9.8094   11.668   25.375   6.4438   11.223   5.2284 14.15156 8.298167 
1 1 1   21    2   20 o   12.223   5.1434   1.2971   8.7122 -17.2316   13.143   15.821   11.636   10.847   5.1970   19.357   6.3698 -8.509199 8.220881 
1 1 1   21    2   21 o   53.206   2.4163  116.660   10.452  113.463   15.637  119.242   14.053   52.084   3.7072   53.562   3.2338 -1.477646 4.919424 
1 1 1   21    2   22 o   45.883   2.6892   87.074   10.014   81.196   14.847   91.978   13.563   43.839   4.2064   46.904   3.5742 -3.065716 5.519825 
1 1 1   21    2   23 o   20.235   5.3258   18.081   8.9028   20.345   13.559   16.367   11.803   21.549   6.8588   19.593   6.4136 1.955816 9.390286 
1 1 1   21    2   24 o   40.621   3.4325   69.021   11.260   69.878   17.435   68.407   14.747   40.110   5.4752   40.038   4.6022 0.7256699E-01 7.152534 
1 1 1   21    2   25 o   42.842   3.0543   76.356   10.596   86.939   15.208   66.370   14.772   45.352   4.1601   39.379   4.6943 5.972439 6.272428 
1 1 1   21    2   26 o   38.628   3.6228   62.704   11.274   57.601   17.286   66.482   14.873   36.042   6.1012   39.382   4.7273 -3.339741 7.718261 
1 1 1   21    2   27 o   39.816   3.2834   66.274   10.562   63.993   17.829   67.507   13.110   38.078   5.9376   39.918   4.0867 -1.839462 7.208043 
1 1 1   21    2   28 o   37.353   3.3145   58.434   9.9874   58.483   17.038   58.409   12.327   36.335   5.9590   37.067   4.1510 -0.7317924 7.262250 
1 1 1   21    2   29 o   11.289   4.9468  -1.3552   8.6990  -4.0376   13.267   0.6679   11.522   13.306   5.9541   13.572   5.8199 -0.2663345 8.325997 
1 1 1   21    2   30 o   19.968   5.3618   17.742   8.9105   12.104   13.606   21.975   11.791   18.170   6.8063   22.066   6.2644 -3.895756 9.250320 
1 1 1   21    2   31 o   44.014   3.1117   80.844   11.092   98.941   19.624   72.348   13.446   47.821   5.1135   41.291   4.0468 6.530132 6.521088 
1 1 1   21    2   32 o   54.498   2.6893  123.105   11.910  130.017   16.120  114.795   17.674   55.661   3.5716   51.997   4.2058 3.663750 5.517751 
1 1 1   21    2   33 o   34.583   3.4283   50.383   9.5376   32.461   14.074   65.604   12.970   26.578   6.5412   39.245   4.1155 -12.66693 7.728179 
1 1 1   21    2   34 o   25.979   4.4599   29.373   9.1048   26.947   13.552   31.368   12.292   24.178   6.6630   26.338   5.8752 -2.159708 8.883284 
1 1 1   21    2   35 o   11.913   5.2890  -2.4734   10.257 -19.7048   13.470   21.308   15.824   10.583   5.1184   21.883   7.4321 -11.30006 9.024090 
1 1 1   21    2   36 o   35.868   3.4576   54.279   9.9841   55.025   14.160   53.541   14.079   35.466   5.0398   34.954   5.0908 0.5126572 7.163523 
1 1 1   21    2   37 o   11.749   5.0419   0.3521   8.6592  -1.7202   13.260   1.8928   11.434   13.744   6.0620   13.790   5.8518 -0.4586601E-01 8.425660 
1 1 1   21    2   38 o   16.294   5.7312   10.723   9.4426  -8.8158   16.709   19.890   11.445   13.949   6.4125   20.916   6.2408 -6.967200 8.948048 
1 1 1   21    2   39 o   23.214   4.9907   24.053   9.1629   35.255   13.933   15.516   12.163   27.640   6.3217   18.982   6.5144 8.658974 9.077479 
1 1 1   21    2   40 o   21.296   5.6036   20.630   9.8572   18.903   16.481   21.592   12.300   20.927   7.5488   21.653   6.4717 -0.7251244 9.943176 
1 1 1   21    2   41 o   20.459   5.8299   19.086   10.193   13.685   18.751   21.351   12.144   19.729   7.8267   21.516   6.4304 -1.786924 10.12955 
1 1 1   21    2   42 o   16.557   5.9041   11.111   10.050   9.4949   17.737   11.875   12.197   18.277   7.4823   17.434   6.4609 0.8433132 9.885815 
1 1 1   21    2   43 o   27.793   5.7096   35.217   12.502   18.883   18.838   48.073   16.714   21.172   7.9920   32.073   6.6127 -10.90125 10.37304 
1 1 1   21    2   44 f   48.543   3.3996   99.524   13.367   88.350   19.782  108.912   18.133   44.437   5.5841   50.161   4.4819 -5.723213 7.160262 
1 1 1   21    2   45 o   22.742   5.6195   23.778   10.357   40.941   13.955   2.7353   15.452   29.833   5.9473   15.655   6.7268 14.17792 8.978871 
1 1 1   21    2   46 o   31.546   3.7540   42.725   9.4640   60.084   14.285   29.145   12.635   36.899   4.8679   24.920   6.2355 11.97920 7.910664 
1 1 1   21    2   47 o   17.271   5.5964   13.209   8.9988   19.227   13.581   8.4985   12.015   20.457   6.8856   16.011   6.2918 4.446650 9.327315 
1 1 1   21    2   48 o   18.580   5.5252   15.728   8.9828   3.6494   13.804   24.599   11.830   15.163   6.4318   22.862   6.1951 -7.699794 8.930081 
1 1 1   21    2   49 f   39.594   3.0828   66.121   9.8714   62.422   14.997   68.948   13.113   37.444   5.0415   39.942   4.0848 -2.498062 6.488635 
1 1 1   21    2   50 o   28.663   4.1265   35.864   9.3639   29.650   14.003   40.891   12.594   24.797   6.7487   30.018   5.3427 -5.220547 8.607497 
1 1 1   21    2   51 o   28.678   4.7682   36.703   10.755   31.594   14.744   42.515   15.724   25.473   6.9218   29.802   6.6424 -4.329348 9.593343 
1 1 1   21    2   52 o   28.147   4.8644   35.570   10.757   19.925   14.283   56.074   16.351   20.616   7.0599   34.755   5.9878 -14.13823 9.257215 
1 1 1   21    2   53 o   28.287   4.8548   35.979   10.791   40.929   14.622   30.059   15.991   29.342   6.3016   24.534   7.3899 4.807623 9.711868 
1 1 1   21    2   54 o   16.265   6.0202   10.719   10.583   16.004   14.537   4.7575   15.438   19.075   7.0564   15.899   6.7751 3.176076 9.782357 
1 1 1   21    2   55 o   22.450   5.2894   23.390   9.5194   5.0493   14.223   38.272   12.812   15.506   6.5508   28.640   5.6885 -13.13381 8.675953 
1 1 1   21    2   56 o   43.027   2.9481   78.256   10.277   80.347   15.550   76.635   13.695   42.581   4.5504   41.919   4.0587 0.6627998 6.097480 
1 1 1   21    2   57 o   27.959   4.3305   34.815   9.5505   44.665   14.981   28.071   12.396   30.475   6.2409   24.009   6.2677 6.465481 8.844913 
1 1 1   21    2   58 o   24.141   5.0044   26.917   9.5242   27.210   14.714   26.705   12.495   23.139   7.1130   23.285   6.3902 -0.1465683 9.561877 
1 1 1   21    2   59 o   30.230   4.7682   41.537   11.361   8.1824   17.276   66.950   15.080   17.016   7.2056   38.369   4.9357 -21.35278 8.733974 
1 1 1   21    2   60 o   13.212   5.5958   3.1650   10.423  -0.1197   16.073   5.5485   13.692   14.683   6.5631   15.189   6.4226 -0.5065517 9.182837 
1 1 1   21    2   61 o   10.817   5.0002  -5.6399   10.360 -11.2937   15.859  -1.4307   13.683   12.538   5.9206   13.400   6.0175 -0.8621407 8.441847 
1 1 1   21    2   62 o   9.5749   4.5925 -11.8682   10.327   11.980   16.108 -28.5094   13.456   17.470   7.1387   9.2164   4.5833 8.253433 8.483403 
1 1 1   21    2   63 o   13.955   5.8083   5.2934   10.928 -22.2066   16.673   26.005   14.469   11.364   5.5411   22.142   7.0893 -10.77826 8.997914 
1 1 1   21    2   64 o   22.189   7.2162   26.577   14.954   0.0000   0.0000   26.577   14.954  ?   ?    22.189   7.2162 0.000000 7.216232 
1 1 1   21    2   65 o   18.605   6.2212   17.376   11.088   9.1896   16.843   23.638   14.731   16.621   7.0793   20.955   7.1699 -4.334398 10.07588 
1 1 1   21    2   66 o   29.126   5.0689   40.286   11.598   37.932   17.305   42.206   15.626   25.804   7.6677   28.179   6.8667 -2.375422 10.29300 
1 1 1   21    2   67 o   18.126   6.1772   16.614   10.932   20.138   16.175   13.650   14.833   19.433   7.3895   17.292   6.9275 2.141396 10.12892 
1 1 1   21    2   68 o   23.426   5.8362   27.950   11.103   15.809   16.623   37.730   14.919   18.001   7.2903   26.309   6.8800 -8.307837 10.02412 
1 1 1   21    2   69 o   22.272   6.0003   25.841   11.137   37.385   16.697   16.588   14.948   25.261   7.5379   17.977   7.0318 7.284142 10.30853 
1 1 1   21    2   70 o   12.034   5.3673   0.2149   10.688   3.2595   16.056  -2.2073   14.321   14.616   6.5446   12.964   5.9513 1.652000 8.845873 
1 1 1   21    2   71 o   11.928   5.3322   0.0931   10.612   4.6266   16.243  -3.2829   14.017   14.874   6.6266   12.592   5.8190 2.282207 8.818848 
1 1 1   21    2   72 o   20.762   6.6095   24.153   12.591   26.369   16.132   20.698   20.141   20.868   7.4758   18.941   7.8845 1.926836 10.86524 
1 1 1   21    2   73 o   16.575   7.3138   10.611   19.322   0.0000   0.0000   10.611   19.322  ?   ?    16.575   7.3138 0.000000 7.313786 
1 1 1   21    2   74 o   21.787   8.2529   32.076   20.129   0.0000   0.0000   32.076   20.129  ?   ?    21.787   8.2529 0.000000 8.252934 
1 1 1   21    2   75 o   19.478   7.9024   23.755   19.570   0.0000   0.0000   23.755   19.570  ?   ?    19.478   7.9024 0.000000 7.902376 
1 1 1   21    2   76 o   15.373   6.9720   5.5700   18.900   0.0000   0.0000   5.5700   18.900  ?   ?    15.373   6.9720 0.000000 6.972044 
1 1 1   21    2   77 o   14.031   6.5745  -2.2513   18.895   0.0000   0.0000  -2.2513   18.895  ?   ?    14.031   6.5745 0.000000 6.574548 
1 1 1   21    2   78 o   12.571   5.8095  -2.0118   13.974 -17.5062   21.883   8.6575   18.158   12.951   6.3222   15.687   6.9965 -2.736492 9.429785 
1 1 1   21    2   79 o   12.660   5.8139  -0.9344   13.685   7.2675   21.607  -6.4283   17.684   15.935   7.3132   13.025   6.1805 2.910176 9.575083 
1 1 1   21    2   80 f   24.707   7.9128   40.765   18.025   40.765   18.025   0.0000   0.0000   24.707   7.9128  ?   ?  0.000000 7.912765 
1 1 1   21    2   81 f   12.063   5.8047 -11.0763   16.806 -11.0763   16.806   0.0000   0.0000   12.063   5.8047  ?   ?  0.000000 5.804694 
1 1 1   21    2   82 o   15.090   6.7516   7.5422   17.054   7.5422   17.054   0.0000   0.0000   15.090   6.7516  ?   ?  0.000000 6.751648 
1 1 1   21    2   83 o   16.322   7.0420   13.445   17.065   13.445   17.065   0.0000   0.0000   16.322   7.0420  ?   ?  0.000000 7.041955 
1 1 1   21    2   84 o   14.402   7.0262 -11.1416   26.904 -11.1416   26.904   0.0000   0.0000   14.402   7.0262  ?   ?  0.000000 7.026150 
1 1 1   21    2   85 o   12.379   6.1853 -33.8981   25.759 -33.8981   25.759   0.0000   0.0000   12.379   6.1853  ?   ?  0.000000 6.185333 
1 1 1   21    2   86 o   18.184   8.2673   23.185   26.778   23.185   26.778   0.0000   0.0000   18.184   8.2673  ?   ?  0.000000 8.267280 
1 1 1   21    2   87 o   13.199   6.5194 -20.5780   25.542 -20.5780   25.542   0.0000   0.0000   13.199   6.5194  ?   ?  0.000000 6.519406 
1 1 1   21    2   88 o   13.965   6.8095 -10.7392   25.182 -10.7392   25.182   0.0000   0.0000   13.965   6.8095  ?   ?  0.000000 6.809518 
1 1 1   21    2   89 o   15.808   7.4912   5.9721   25.807   5.9721   25.807   0.0000   0.0000   15.808   7.4912  ?   ?  0.000000 7.491223 
1 1 1   21    3  -77 o   14.378   6.9431  -7.8533   24.556  -7.8533   24.556   0.0000   0.0000   14.378   6.9431  ?   ?  0.000000 6.943102 
1 1 1   21    3  -76 o   14.844   7.1496  -5.7395   25.639  -5.7395   25.639   0.0000   0.0000   14.844   7.1496  ?   ?  0.000000 7.149570 
1 1 1   21    3  -75 o   15.625   7.3388   3.2146   23.783   3.2146   23.783   0.0000   0.0000   15.625   7.3388  ?   ?  0.000000 7.338759 
1 1 1   21    3  -74 o   14.018   6.7750 -10.3897   23.507 -10.3897   23.507   0.0000   0.0000   14.018   6.7750  ?   ?  0.000000 6.774982 
1 1 1   21    3  -73 f   18.390   8.0509   20.471   22.996   20.471   22.996   0.0000   0.0000   18.390   8.0509  ?   ?  0.000000 8.050913 
1 1 1   21    3  -72 o   24.401   9.1730   47.320   24.761   47.320   24.761   0.0000   0.0000   24.401   9.1730  ?   ?  0.000000 9.173012 
1 1 1   21    3  -71 o   27.564   7.3131   45.268   16.700   95.162   25.300   6.7449   22.231   39.158   8.1901   16.149   7.4141 23.00815 11.04744 
1 1 1   21    3  -70 o   14.924   6.5666   6.6129   15.472   13.085   22.604   0.9088   21.221   17.303   7.7552   15.148   7.0547 2.155746 10.48391 
1 1 1   21    3  -69 o   20.888   8.4516   30.077   22.316   30.077   22.316   0.0000   0.0000   20.888   8.4516  ?   ?  0.000000 8.451636 
1 1 1   21    3  -68 o   25.988   8.9927   48.974   23.195   48.974   23.195   0.0000   0.0000   25.988   8.9927  ?   ?  0.000000 8.992749 
1 1 1   21    3  -67 o   11.601   5.5229  -9.7134   14.353  -7.2296   16.598 -17.0796   28.583   12.818   6.0541   14.867   7.2507 -2.049597 9.445909 
1 1 1   21    3  -66 o   22.189   5.7785   25.616   10.553   21.125   13.293   33.271   17.356   19.414   6.8022   23.120   7.7839 -3.706598 10.33730 
1 1 1   21    3  -65 o   29.390   4.7346   41.095   10.958   51.004   13.862   24.591   17.889   32.032   5.5076   20.288   7.7575 11.74354 9.513809 
1 1 1   21    3  -64 o   13.400   5.6564   4.9481   10.591   4.4997   13.207   5.7557   17.725   14.140   6.1474   15.641   6.9479 -1.500559 9.277071 
1 1 1   21    3  -63 o   16.311   6.0111   12.704   10.531   7.2842   13.153   22.384   17.579   14.958   6.3083   19.953   7.6746 -4.995368 9.934482 
1 1 1   21    3  -62 o   11.217   5.0888  -2.3892   10.080   1.2064   12.675  -8.5744   16.625   13.270   5.8861   12.934   6.0938 0.3359232 8.472358 
1 1 1   21    3  -61 o   18.913   6.0317   18.135   10.482   18.644   13.191   17.262   17.265   18.977   6.7645   18.688   7.4782 0.2889519 10.08375 
1 1 1   21    3  -60 o   16.037   5.8019   11.866   9.7445   17.807   13.522   5.4466   14.055   18.737   6.8264   14.919   6.4132 3.817865 9.366395 
1 1 1   21    3  -59 o   17.408   5.5108   14.665   8.7634   16.407   13.825   13.495   11.331   18.318   6.8610   16.978   6.2387 1.339973 9.273356 
1 1 1   21    3  -58 o   13.240   5.2705   5.8905   8.5313   4.0841   13.371   7.1308   11.079   14.454   6.2346   14.591   5.9361 -0.1370497 8.608584 
1 1 1   21    3  -57 o   13.014   5.2409   5.2274   8.5371  -1.5834   13.484   9.7843   11.029   13.194   5.9453   15.589   6.0565 -2.394521 8.486931 
1 1 1   21    3  -56 o   13.390   5.2790   6.1132   8.4817  -5.1555   13.066   14.319   11.150   12.305   5.6619   17.498   6.2210 -5.192664 8.411807 
1 1 1   21    3  -55 o   14.173   5.4048   7.6968   8.6686  -2.2857   13.653   14.439   11.220   13.212   5.9651   17.619   6.2429 -4.407448 8.634583 
1 1 1   21    3  -54 o   10.742   4.8572  -2.9155   9.0904   3.0132   16.097  -5.6915   11.015   15.375   6.7334   11.208   5.1718 4.167475 8.490389 
1 1 1   21    3  -53 o   30.581   3.9527   41.171   9.6230   62.261   17.877   32.567   11.418   35.836   6.3525   26.256   5.5109 9.579372 8.409775 
1 1 1   21    3  -52 o   29.028   3.9314   37.043   9.0636   27.196   14.664   43.131   11.530   23.130   7.0991   30.886   4.7300 -7.755470 8.530498 
1 1 1   21    3  -51 o   16.319   5.3762   12.003   8.2883  -6.2118   12.520   26.215   11.059   11.987   5.5253   23.418   5.8189 -11.43067 8.024224 
1 1 1   21    3  -50 o   13.426   5.3019   5.6832   8.5685   1.1406   12.176   10.140   12.060   13.561   5.8990   16.339   6.3373 -2.777392 8.657925 
1 1 1   21    3  -49 o   28.014   3.8195   34.211   8.4952   41.625   12.955   28.618   11.252   29.995   5.5011   24.645   5.7128 5.350039 7.930830 
1 1 1   21    3  -48 o   31.408   3.3706   42.261   8.4947   50.629   12.786   35.649   11.366   33.627   4.8006   27.921   5.1846 5.706541 7.065788 
1 1 1   21    3  -47 o   51.127   2.2942  108.702   9.5369  109.864   14.330  107.778   12.778   50.748   3.4852   50.485   3.1202 0.2629166 4.677878 
1 1 1   21    3  -46 o   16.137   5.3392   11.452   8.1719   10.083   12.409   12.500   10.859   16.555   6.4263   17.119   6.1334 -0.5640373 8.883498 
1 1 1   21    3  -45 o   7.8280   3.8144 -13.1607   7.8624 -15.8960   11.861 -11.0167   10.501   10.038   4.8418   10.011   4.7539 0.2722645E-01 6.785474 
1 1 1   21    3  -44 o   27.474   3.8276   32.740   8.3397   31.867   12.619   33.417   11.112   26.018   6.0627   27.107   5.2185 -1.088217 7.999341 
1 1 1   21    3  -43 o   25.016   4.2362   27.566   8.3303   16.587   12.277   36.932   11.340   19.152   6.5457   28.642   5.0411 -9.490337 8.261890 
1 1 1   21    3  -42 o   11.743   5.0080   1.0974   8.4465   16.194   11.729 -15.1656   12.174   18.946   6.3989   10.357   4.9724 8.589155 8.103764 
1 1 1   21    3  -41 o   21.675   4.6932   21.114   8.0514   1.4143   11.924   37.623   10.916   13.701   5.8985   29.083   4.7695 -15.38233 7.585543 
1 1 1   21    3  -40 o   38.254   2.8619   61.431   8.8593   39.455   12.982   80.587   12.120   29.364   5.6283   43.573   3.4403 -14.20840 6.596498 
1 1 1   21    3  -39 o   13.326   5.1664   5.6575   8.0125   6.4420   11.951   5.0171   10.799   15.281   6.1842   14.325   5.8483 0.9557772 8.511597 
1 1 1   21    3  -38 o   43.726   2.7958   79.996   9.9128   80.716   13.576   79.174   14.508   43.414   3.8769   42.811   4.2119 0.6029243 5.724520 
1 1 1   21    3  -37 f   37.478   3.4123   59.574   10.310   46.755   12.816   83.093   17.359   32.438   5.0077   43.417   4.9960 -10.97810 7.073681 
1 1 1   21    3  -36 o   28.508   4.7566   35.960   10.664   27.469   13.913   48.052   16.604   24.046   6.7977   32.027   6.5803 -7.981453 9.460920 
1 1 1   21    3  -35 o   44.758   2.4934   83.271   9.0610   79.755   11.861   88.200   14.041   43.449   3.3755   45.482   3.8226 -2.033623 5.099618 
1 1 1   21    3  -34 o   28.117   4.0274   34.194   8.9675   35.740   15.547   33.423   10.977   27.400   6.9512   27.337   5.1142 0.6343460E-01 8.629833 
1 1 1   21    3  -33 o   32.789   3.2639   45.440   8.6079   26.921   13.380   58.517   11.244   23.943   6.6294   37.038   3.7769 -13.09532 7.629770 
1 1 1   21    3  -32 o   43.199   2.6355   77.679   9.2365   68.998   14.289   83.910   12.106   39.931   4.4662   44.623   3.3527 -4.692066 5.584581 
1 1 1   21    3  -31 o   14.638   5.1764   8.4574   7.7111   19.791   11.542  -0.6787   10.363   20.807   6.2808   12.413   5.4202 8.393397 8.296197 
1 1 1   21    3  -30 o   36.826   2.9641   56.799   8.8228   64.534   12.143   48.151   12.841   38.911   3.8802   33.119   4.9044 5.791477 6.253675 
1 1 1   21    3  -29 o   41.367   2.5317   71.067   8.4963   75.988   12.384   66.690   11.679   42.380   3.6192   39.672   3.6523 2.708729 5.141840 
1 1 1   21    3  -28 o   17.043   5.3245   12.682   8.2070   3.9153   12.836   18.745   10.674   15.038   6.2796   20.349   6.0157 -5.311852 8.696084 
1 1 1   21    3  -27 o   28.798   4.5056   36.093   10.230   43.521   17.278   32.083   12.695   30.446   7.0939   26.517   6.0121 3.928520 9.298858 
1 1 1   21    3  -26 o   12.846   5.2826   3.0739   8.8915   3.9301   12.783   2.2715   12.376   15.045   6.2735   14.370   6.0925 0.6749783 8.744973 
1 1 1   21    3  -25 o   49.635   2.5779  102.153   10.394  122.759   14.973   82.987   14.440   54.086   3.4136   44.158   4.0571 9.928352 5.302100 
1 1 1   21    3  -24 o   27.199   4.2488   31.989   9.1121   35.965   12.969   28.113   12.806   28.239   5.8273   24.744   6.3254 3.494188 8.600468 
1 1 1   21    3  -23 o   23.127   4.9511   23.724   9.0520   21.854   13.152   25.407   12.477   21.920   6.7223   23.543   6.3549 -1.622713 9.250662 
1 1 1   21    3  -22 o   27.994   4.2640   33.828   9.4230   44.514   13.020   22.074   13.655   31.805   5.2016   22.050   6.8649 9.755180 8.612964 
1 1 1   21    3  -21 o   29.901   3.6131   37.924   8.6283   32.577   13.232   41.879   11.380   26.748   6.1913   31.074   4.6343 -4.326242 7.733653 
1 1 1   21    3  -20 o   14.134   5.4075   6.4107   8.6958   7.6195   15.309   5.8349   10.566   17.217   6.9877   14.738   5.8659 2.479066 9.123468 
1 1 1   21    3  -19 o   28.405   3.7593   34.355   8.4909   43.824   13.385   27.979   10.983   31.504   5.4070   25.000   5.5359 6.503683 7.738346 
1 1 1   21    3  -18 o   34.861   3.3464   51.071   9.3929   59.851   16.494   46.858   11.427   36.808   5.6799   33.038   4.3484 3.769581 7.153334 
1 1 1   21    3  -17 o   37.146   3.1924   57.758   9.5727   17.117   16.839   77.164   11.636   20.681   7.6044   42.918   3.3526 -22.23710 8.310629 
1 1 1   21    3  -16 o   36.441   3.2532   55.641   9.5621   68.061   17.666   50.494   11.372   39.331   5.6740   34.410   4.1371 4.920933 7.022079 
1 1 1   21    3  -15 o   20.179   5.3757   18.124   9.0005  -1.6561   15.796   27.633   10.953   15.090   6.6375   24.879   5.5427 -9.788368 8.647372 
1 1 1   21    3  -14 o   24.582   4.3762   26.198   8.4475   12.600   13.325   35.335   10.923   18.288   6.7577   28.462   4.8838 -10.17430 8.337724 
1 1 1   21    3  -13 o   33.123   3.2955   46.041   8.7798   44.566   14.053   46.985   11.244   31.743   5.6376   33.154   4.2590 -1.410135 7.065474 
1 1 1   21    3  -12 f   51.560   2.3290  109.652   9.7631  128.516   15.561   97.404   12.538   55.443   3.4603   48.332   3.2005 7.111546 4.713484 
1 1 1   21    3  -11 o   74.268   1.8910  226.416   11.439  264.560   18.113  201.108   14.753   79.957   2.7832   69.769   2.5987 10.18838 3.807833 
1 1 1   21    3  -10 o   52.202   2.4856  112.553   10.546  127.305   18.739  105.713   12.759   54.864   4.2225   50.395   3.1213 4.468807 5.250882 
1 1 1   21    3   -9 o   53.432   2.2607  117.630   9.8244  124.142   15.404  113.165   12.756   54.496   3.4858   52.188   3.0112 2.307205 4.606328 
1 1 1   21    3   -8 o   19.108   5.2338   16.114   8.3908   24.470   13.617   10.999   10.654   23.260   6.7727   16.918   6.0735 6.342094 9.097075 
1 1 1   21    3   -7 o   17.015   5.3539   12.369   8.2831   0.1720   13.383   19.944   10.546   14.424   6.2295   21.146   5.8970 -6.722174 8.577961 
1 1 1   21    3   -6 o   41.606   2.9513   71.971   9.9442   56.364   18.229   78.584   11.865   35.425   6.5542   43.353   3.3843 -7.928150 7.376379 
1 1 1   21    3   -5 o   22.670   5.0158   22.647   9.0233   42.773   17.115   14.899   10.619   30.576   7.0160   18.686   6.0812 11.88999 9.284642 
1 1 1   21    3   -4 o   54.207   2.6302  121.471   11.587   93.116   19.030  138.178   14.607   46.519   5.1022   57.661   3.1194 -11.14201 5.980206 
1 1 1   21    3   -3 o   41.360   3.0031   71.162   10.056   51.978   18.344   79.405   12.024   33.851   6.8825   43.577   3.4120 -9.725914 7.681864 
1 1 1   21    3   -2 o   25.235   4.3828   27.506   8.6887   33.095   14.109   24.091   11.028   27.034   6.4857   23.204   5.8367 3.829847 8.725322 
1 1 1   21    3   -1 f   54.975   2.2578  124.462   10.096  125.133   16.092  124.026   12.966   54.680   3.6309   54.689   2.9190 -0.9571075E-02 4.658766 
1 1 1   21    3    0 o   34.003   3.3274   48.449   9.1047   44.658   14.541   50.894   11.677   31.764   5.8307   34.576   4.2312 -2.811726 7.204156 
1 1 1   21    3    1 f   28.224   4.4870   34.323   9.9779   27.723   14.031   41.076   14.192   24.700   6.7691   30.389   5.9420 -5.689192 9.007114 
1 1 1   21    3    2 o   69.798   2.2036  200.417   12.522  237.082   18.062  166.490   17.375   75.655   2.9345   63.207   3.3847 12.44796 4.479627 
1 1 1   21    3    3 o   36.538   3.5480   56.080   10.434   66.216   14.823   46.123   14.691   39.309   4.7203   32.305   5.7915 7.003738 7.471471 
1 1 1   21    3    4 o   24.562   4.5523   26.200   8.7789   21.033   13.870   29.654   11.339   21.814   6.9362   25.849   5.5476 -4.035032 8.881787 
1 1 1   21    3    5 o   52.935   2.5416  115.748   10.935  129.422   16.142  104.154   14.865   55.625   3.5791   49.838   3.6850 5.787025 5.136989 
1 1 1   21    3    6 o   57.017   2.4343  134.111   11.288  147.548   16.410  122.043   15.552   59.477   3.3989   54.017   3.5516 5.459469 4.915936 
1 1 1   21    3    7 o   85.266   2.1486  298.913   14.922  300.570   19.856  296.763   22.618   85.216   2.8625   84.467   3.2913 0.7494888 4.361959 
1 1 1   21    3    8 o   33.772   3.9388   48.349   10.640   45.968   14.254   51.345   15.989   32.300   5.6178   34.018   5.9842 -1.718731 8.207936 
1 1 1   21    3    9 o   40.883   2.8993   69.477   9.5995   81.629   15.488   61.897   12.232   43.804   4.3970   38.243   3.9822 5.561691 5.932285 
1 1 1   21    3   10 o   70.132   2.1178  202.272   12.093  230.779   18.315  180.236   16.102   74.577   3.0190   65.898   3.0056 8.679680 4.260035 
1 1 1   21    3   11 o   73.447   2.0867  221.785   12.480  222.947   18.579  220.829   16.847   73.249   3.1187   73.021   2.8358 0.2283325 4.215177 
1 1 1   21    3   12 f   46.085   2.7938   88.115   10.446   73.173   15.843   99.604   13.893   41.262   4.7999   48.763   3.5188 -7.500683 5.951596 
1 1 1   21    3   13 o   65.271   2.2036  175.405   11.707  162.107   17.402  186.400   15.824   62.293   3.4405   67.042   2.9024 -4.748802 4.501175 
1 1 1   21    3   14 o   28.175   4.1691   34.055   9.2865   28.486   14.276   38.140   12.227   24.930   6.8263   29.441   5.2891 -4.510489 8.635561 
1 1 1   21    3   15 o   40.638   3.0595   68.876   10.060   80.979   15.450   59.965   13.256   43.575   4.4101   37.432   4.4303 6.143276 6.251139 
1 1 1   21    3   16 o   14.840   5.5595   7.5912   9.0785   13.895   14.121   3.1506   11.853   18.953   6.9648   14.467   6.0373 4.486416 9.217181 
1 1 1   21    3   17 o   71.546   2.1186  210.650   12.342  212.681   18.616  209.058   16.486   71.452   3.2044   70.998   2.8544 0.4537735 4.291359 
1 1 1   21    3   18 o   53.851   2.8922  120.497   12.649  117.479   19.331  122.756   16.727   52.432   4.5685   53.973   3.8268 -1.540771 5.959546 
1 1 1   21    3   19 o   63.609   2.6036  167.436   13.471  167.294   20.483  167.544   17.883   62.934   4.0136   63.255   3.4817 -0.3210640 5.313318 
1 1 1   21    3   20 o   15.757   5.9237   8.6989   10.326   17.687   16.672   3.1050   13.152   20.788   7.5790   15.030   6.3218 5.757047 9.869431 
1 1 1   21    3   21 o   12.430   5.3782  -0.1864   10.010   2.7785   20.354  -1.1323   11.497   17.823   7.6900   13.010   5.6942 4.813512 9.568718 
1 1 1   21    3   22 o   15.070   5.8369   7.1418   10.220  -2.4815   21.248   10.038   11.656   17.084   7.5970   16.728   6.2927 0.3555984 9.864724 
1 1 1   21    3   23 o   8.4161   4.1390 -19.6153   9.9248   9.8250   20.444 -28.6933   11.352   19.415   7.9997   8.2817   4.1331 11.13317 9.004286 
1 1 1   21    3   24 o   10.146   4.7162  -7.4478   9.4137 -22.7897   16.827  -0.4589   11.357   11.958   5.7679   13.094   5.6964 -1.135600 8.106641 
1 1 1   21    3   25 o   64.927   2.1851  173.828   11.548  176.556   17.636  171.780   15.280   64.936   3.3431   64.250   2.9252 0.6860428 4.442179 
1 1 1   21    3   26 o   28.005   4.1626   33.839   9.2137   14.541   14.227   47.779   12.092   19.070   6.9936   33.190   4.5923 -14.12020 8.366556 
1 1 1   21    3   27 o   11.116   4.9062  -1.7289   8.6999   5.2887   13.967  -6.1780   11.121   15.932   6.5929   11.513   5.2698 4.419245 8.440221 
1 1 1   21    3   28 o   27.953   4.2128   33.807   9.3014   41.367   14.574   28.612   12.082   30.112   6.1458   25.005   6.0036 5.107166 8.591534 
1 1 1   21    3   29 o   13.435   5.5448   3.3792   9.8438 -12.5733   13.974   19.094   13.869   11.905   5.6020   20.697   6.9582 -8.792067 8.933043 
1 1 1   21    3   30 o   11.422   5.0136  -1.2215   8.9690 -18.2307   13.673   11.625   11.883   10.859   5.2281   17.310   6.3841 -6.450887 8.251641 
1 1 1   21    3   31 o   35.393   3.7572   53.380   10.674   53.258   19.762   53.431   12.684   33.397   7.4489   35.068   4.5439 -1.670940 8.725414 
1 1 1   21    3   32 o   43.604   2.9236   79.514   10.332   76.502   15.734   81.797   13.699   41.951   4.6808   43.815   3.8754 -1.863827 6.076874 
1 1 1   21    3   33 o   38.382   3.1695   61.998   9.8281   47.718   14.919   72.947   13.063   32.417   5.8617   41.320   3.9254 -8.903522 7.054732 
1 1 1   21    3   34 o   25.555   4.6226   28.850   9.2752   42.958   14.355   18.738   12.153   30.641   5.9618   20.280   6.4975 10.36152 8.818159 
1 1 1   21    3   35 o   17.278   5.5890   13.109   8.9775   2.2348   14.281   20.215   11.544   15.082   6.4737   20.921   6.2735 -5.838923 9.014700 
1 1 1   21    3   36 o   38.189   3.5120   61.936   10.811   73.147   19.669   57.084   12.940   39.931   6.2475   36.200   4.4808 3.730366 7.688218 
1 1 1   21    3   37 f   37.630   4.0263   60.947   12.158   78.338   20.091   50.899   15.272   41.379   6.1428   33.417   5.8179 7.962013 8.460622 
1 1 1   21    3   38 o   34.534   5.3720   53.580   14.631   74.338   27.858   45.674   17.193   37.778   9.1454   30.874   6.9943 6.903812 11.51343 
1 1 1   21    3   39 o   21.928   5.9722   22.411   10.962   19.063   14.610   26.724   16.580   20.485   7.1343   23.482   7.5954 -2.997578 10.42058 
1 1 1   21    3   40 o   50.890   3.0281  108.825   12.505  145.801   17.029   65.559   18.421   58.588   3.5829   37.637   6.2215 20.95145 7.179398 
1 1 1   21    3   41 o   47.151   2.7635   93.030   10.575  109.950   16.393   80.971   13.839   50.571   4.0095   43.388   3.9565 7.183090 5.632934 
1 1 1   21    3   42 o   31.848   3.8487   43.777   9.7890   37.236   15.350   48.259   12.708   27.787   6.8270   32.934   4.8814 -5.146971 8.392635 
1 1 1   21    3   43 o   34.599   3.7148   51.425   10.313   72.944   18.282   41.380   12.490   39.960   5.7803   30.235   5.2587 9.724829 7.814409 
1 1 1   21    3   44 o   13.546   5.4113   5.2081   9.0246   27.214   13.972 -10.5443   11.821   23.692   6.8492   10.903   5.1373 12.78885 8.561773 
1 1 1   21    3   45 o   11.446   5.0132  -0.6252   8.9247   14.192   14.150 -10.4146   11.501   18.462   6.9356   10.727   5.0586 7.734236 8.584371 
1 1 1   21    3   46 o   28.797   4.1461   36.356   9.4525   41.581   14.765   32.728   12.304   29.583   6.3153   26.419   5.8664 3.163704 8.619568 
1 1 1   21    3   47 o   11.515   5.0201  -0.1853   8.8598  -7.5164   13.912   4.8167   11.492   12.537   5.7948   14.419   5.9748 -1.882048 8.323320 
1 1 1   21    3   48 o   15.828   5.6648   10.499   9.2603   2.3072   14.441   16.220   12.068   14.886   6.4501   18.813   6.4877 -3.926883 9.148434 
1 1 1   21    3   49 o   36.467   3.3942   56.920   9.9736   65.620   15.395   50.627   13.093   38.115   5.0815   33.509   4.9414 4.606392 7.088000 
1 1 1   21    3   50 o   15.123   5.6290   9.0516   9.2769   14.800   14.183   4.7529   12.264   18.462   6.9420   14.624   6.1247 3.837982 9.257642 
1 1 1   21    3   51 o   9.3077   4.4215  -9.5261   9.0986  -2.2852   14.219 -14.5469   11.840   13.620   6.1239   10.144   4.8790 3.476004 7.829841 
1 1 1   21    3   52 o   24.447   4.9327   27.512   9.4905   10.012   14.609   40.290   12.483   16.873   6.8341   29.405   5.4073 -12.53136 8.714620 
1 1 1   21    3   53 o   14.632   5.9478   6.5036   11.112  -2.3198   14.248   20.203   17.753   13.548   6.1073   20.450   7.7496 -6.902195 9.866885 
1 1 1   21    3   54 o   19.158   6.6825   17.720   12.820   17.946   17.478   17.458   18.864   19.633   7.6251   19.658   7.8333 -0.2520943E-01 10.93173 
1 1 1   21    3   55 o   35.676   4.8546   58.164   13.752   56.413   18.376   60.393   20.733   33.296   6.9934   33.745   7.7069 -0.4487114 10.40694 
1 1 1   21    3   56 o   14.788   6.2683   5.2148   13.096   20.530   17.704 -13.2932   19.462   20.234   7.7220   13.649   6.4787 6.584971 10.07982 
1 1 1   21    3   57 o   10.059   4.7864 -10.4375   10.752 -30.5317   16.923   3.1651   13.924   10.638   5.2640   14.477   6.3027 -3.839255 8.211846 
1 1 1   21    3   58 o   43.671   3.5174   83.158   12.415  102.164   19.180   69.451   16.289   46.821   5.1081   38.308   5.3630 8.513866 7.406413 
1 1 1   21    3   59 o   20.349   6.1691   21.035   11.119   11.033   17.031   28.464   14.678   17.165   7.2052   22.952   7.1127 -5.786848 10.12452 
1 1 1   21    3   60 o   13.298   5.6599   3.7768   10.752   11.194   16.728  -1.4444   14.035   17.062   7.1500   13.302   6.0228 3.760352 9.348592 
1 1 1   21    3   61 o   11.975   5.3358  -0.4270   10.536  -4.8243   15.623   3.2412   14.269   13.220   6.1212   14.381   6.3177 -1.161253 8.796729 
1 1 1   21    3   62 o   10.947   5.0365  -4.1178   10.336  -0.7897   15.636  -6.7005   13.774   13.918   6.3236   12.090   5.6483 1.827854 8.478849 
1 1 1   21    3   63 o   15.935   6.0768   11.646   10.958  -1.7155   16.389   22.451   14.738   13.919   6.3810   20.133   7.1527 -6.213805 9.585340 
1 1 1   21    3   64 o   32.268   6.2955   54.090   15.964   0.0000   0.0000   54.090   15.964  ?   ?    32.268   6.2955 0.000000 6.295488 
1 1 1   21    3   65 o   18.642   6.2551   18.457   11.208   6.0728   16.572   28.900   15.217   15.337   6.7701   22.229   7.2826 -6.892385 9.943369 
1 1 1   21    3   66 o   16.826   6.1073   14.443   10.809   0.5908   16.285   25.352   14.451   14.071   6.4166   20.885   7.1024 -6.813680 9.571616 
1 1 1   21    3   67 o   15.204   6.0155   10.376   11.049  -1.4549   16.603   19.780   14.803   13.751   6.3470   18.722   7.0807 -4.971234 9.508991 
1 1 1   21    3   68 o   18.507   7.1067   19.402   15.057   25.292   22.385   14.535   20.347   19.855   8.2920   17.479   7.6143 2.375099 11.25766 
1 1 1   21    3   69 o   12.821   5.9396  -2.8469   14.740   2.6881   21.714  -7.5767   20.073   15.551   7.2060   13.745   6.5403 1.805124 9.731494 
1 1 1   21    3   70 o   18.006   7.0394   18.176   14.974   27.808   22.251   10.205   20.243   20.277   8.3494   16.506   7.3727 3.770916 11.13861 
1 1 1   21    3   71 o   10.907   5.2915 -15.0235   14.686 -13.9011   21.541 -15.9981   20.074   13.331   6.4533   12.689   6.1631 0.6412792 8.923498 
1 1 1   21    3   72 o   14.717   6.4707   6.5963   14.999  -1.8624   21.910   14.058   20.578   14.787   6.9758   17.130   7.5535 -2.342155 10.28187 
1 1 1   21    3   73 f   16.390   6.8088   13.434   14.976   17.943   21.680   9.3181   20.713   17.866   7.8196   16.190   7.3249 1.676182 10.71454 
1 1 1   21    3   74 o   16.619   6.8835   14.395   15.244   44.930   23.200  -8.8041   20.222   23.970   8.9057   13.405   6.4288 10.56474 10.98363 
1 1 1   21    3   75 o   12.994   6.0306  -1.7939   15.300   1.5946   22.931  -4.5125   20.540   15.275   7.1844   13.996   6.6471 1.278843 9.787721 
1 1 1   21    3   76 o   13.979   6.7361  -8.6686   22.822  -8.6686   22.822   0.0000   0.0000   13.979   6.7361  ?   ?  0.000000 6.736104 
1 1 1   21    3   77 o   16.361   7.5091   10.218   22.782   10.218   22.782   0.0000   0.0000   16.361   7.5091  ?   ?  0.000000 7.509070 
1 1 1   21    3   78 o   21.107   8.6228   35.668   23.494   35.668   23.494   0.0000   0.0000   21.107   8.6228  ?   ?  0.000000 8.622801 
1 1 1   21    3   79 o   12.982   6.1400  -4.4808   17.180  -4.4808   17.180   0.0000   0.0000   12.982   6.1400  ?   ?  0.000000 6.139962 
1 1 1   21    3   80 o   16.254   7.0869   13.327   17.660   13.327   17.660   0.0000   0.0000   16.254   7.0869  ?   ?  0.000000 7.086884 
1 1 1   21    3   81 o   10.480   5.1994 -25.1077   16.927 -25.1077   16.927   0.0000   0.0000   10.480   5.1994  ?   ?  0.000000 5.199433 
1 1 1   21    3   82 o   15.154   6.7816   8.8683   17.213   8.8683   17.213   0.0000   0.0000   15.154   6.7816  ?   ?  0.000000 6.781553 
1 1 1   21    3   83 o   13.769   6.3839   1.7186   17.079   1.7186   17.079   0.0000   0.0000   13.769   6.3839  ?   ?  0.000000 6.383851 
1 1 1   21    3   84 o   18.454   8.3463   26.173   26.864   26.173   26.864   0.0000   0.0000   18.454   8.3463  ?   ?  0.000000 8.346276 
1 1 1   21    3   85 o   19.054   8.4585   29.685   26.227   29.685   26.227   0.0000   0.0000   19.054   8.4585  ?   ?  0.000000 8.458475 
1 1 1   21    4  -69 o   17.895   7.2072   18.950   16.146   54.439   23.058 -15.1883   22.615   26.776   8.9716   13.297   6.4769 13.47910 11.06527 
1 1 1   21    4  -68 o   11.842   5.6540  -9.1726   15.270  -0.8524   20.732 -19.0386   22.576   14.574   6.8472   12.965   6.3488 1.608703 9.337653 
1 1 1   21    4  -67 o   18.981   7.2902   21.956   15.847   30.916   21.765   11.849   23.117   20.788   8.3695   16.930   7.6908 3.858454 11.36649 
1 1 1   21    4  -66 o   15.379   6.6843   8.8200   15.607  -1.3430   22.036   19.049   22.107   14.905   7.0205   18.234   7.9399 -3.328408 10.59858 
1 1 1   21    4  -65 o   16.613   6.9289   13.521   15.599   26.413   21.739  -0.1620   22.397   19.902   8.2296   15.185   7.1289 4.717214 10.88796 
1 1 1   21    4  -64 o   15.373   6.6817   8.4790   15.595   14.848   22.024   2.0749   22.084   17.551   7.7734   15.476   7.2039 2.075495 10.59823 
1 1 1   21    4  -63 o   15.133   5.6667   10.982   9.4295   1.7201   14.758   17.371   12.258   13.704   6.1933   17.836   6.4993 -4.132205 8.977614 
1 1 1   21    4  -62 o   31.263   3.8961   44.704   9.7141   29.414   13.567   60.791   13.916   22.673   6.8015   35.399   4.9584 -12.72597 8.417011 
1 1 1   21    4  -61 o   39.447   3.0690   68.032   9.7908   56.858   14.338   77.794   13.402   33.826   5.3799   41.207   4.0418 -7.381039 6.728985 
1 1 1   21    4  -60 o   13.950   5.4300   8.1681   8.8784  -5.2244   12.887   20.268   12.249   11.775   5.4885   19.225   6.5389 -7.450083 8.537013 
1 1 1   21    4  -59 o   17.329   5.6238   15.214   9.0852   9.0886   13.333   20.522   12.413   15.365   6.4070   19.405   6.5826 -4.040195 9.185924 
1 1 1   21    4  -58 o   16.250   5.6215   12.933   9.0635   1.7950   13.522   22.018   12.213   13.589   6.0507   20.184   6.5180 -6.594219 8.893568 
1 1 1   21    4  -57 f   24.548   4.7434   28.599   9.1482   20.122   13.502   35.792   12.438   19.348   6.8490   26.555   5.8994 -7.207373 9.039495 
1 1 1   21    4  -56 o   16.239   5.9087   12.483   10.126  -0.4316   17.679   18.788   12.353   14.629   6.6767   18.970   6.5628 -4.340790 9.362077 
1 1 1   21    4  -55 o   14.878   5.7993   9.0708   10.138   9.9006   17.218   8.6305   12.543   16.732   7.1431   15.326   6.2852 1.405611 9.514647 
1 1 1   21    4  -54 o   14.645   5.7757   8.3534   10.156  -0.0914   17.194   12.878   12.586   14.662   6.6497   16.817   6.4871 -2.154270 9.289898 
1 1 1   21    4  -53 o   24.472   4.8952   28.270   9.4238   22.391   14.016   33.120   12.731   20.542   6.9945   25.545   6.1814 -5.003120 9.334448 
1 1 1   21    4  -52 o   16.431   5.7631   12.623   9.5435 -12.0489   13.801   35.234   13.212   11.346   5.4054   26.393   6.2399 -15.04754 8.255591 
1 1 1   21    4  -51 o   34.614   3.9762   53.284   11.015   17.737   18.133   74.076   13.868   19.257   7.6779   40.637   4.2492 -21.37928 8.775286 
1 1 1   21    4  -50 o   13.679   5.4923   6.0891   9.3458   8.1575   13.746   4.3111   12.745   15.788   6.5377   14.368   6.1402 1.419600 8.969007 
1 1 1   21    4  -49 o   37.534   3.0966   60.380   9.3901   59.371   14.932   61.041   12.077   35.630   5.3025   37.107   4.0589 -1.477325 6.677684 
1 1 1   21    4  -48 o   12.971   5.2257   4.9923   8.4913   16.306   13.545  -2.3331   10.899   18.593   6.8229   11.886   5.3514 6.706701 8.671203 
1 1 1   21    4  -47 o   19.592   5.2959   18.210   8.6581   19.596   13.855   17.322   11.090   19.931   6.9471   18.942   6.2178 0.9893036 9.323286 
1 1 1   21    4  -46 o   11.183   4.8257   0.6947   8.0170  -1.2066   11.870   2.2894   10.871   12.707   5.6628   13.178   5.6521 -0.4705687 8.000785 
1 1 1   21    4  -45 o   14.736   5.3261   9.0135   8.2094   0.6398   12.097   16.162   11.177   13.310   5.8329   18.514   6.2466 -5.203781 8.546472 
1 1 1   21    4  -44 o   9.9330   4.5242  -3.6471   8.0653  -4.5361   12.024  -2.9200   10.874   12.067   5.5069   11.828   5.3334 0.2394438 7.666224 
1 1 1   21    4  -43 o   13.014   5.1553   5.2017   8.1246   14.113   12.152  -2.0017   10.925   17.840   6.4756   12.106   5.4112 5.733849 8.438861 
1 1 1   21    4  -42 o   32.791   3.4118   46.176   8.9866   35.767   13.152   55.291   12.308   27.374   6.0550   35.373   4.3606 -7.999023 7.461731 
1 1 1   21    4  -41 o   21.442   5.3402   21.442   9.2982   24.666   12.539   17.502   13.859   22.514   6.4823   19.464   6.9341 3.050095 9.492188 
1 1 1   21    4  -40 o   20.992   5.3508   20.527   9.1820   14.054   12.354   28.514   13.724   17.954   6.5275   24.095   6.7299 -6.141293 9.375490 
1 1 1   21    4  -39 o   31.270   4.0511   42.731   10.084   25.351   13.940   61.808   14.605   22.735   6.9107   37.126   4.9490 -14.39099 8.500014 
1 1 1   21    4  -38 o   23.211   4.6384   24.263   8.4690   35.044   12.595   15.365   11.442   27.362   5.8257   18.432   6.3186 8.929979 8.594361 
1 1 1   21    4  -37 o   68.598   2.1096  194.856   11.782  130.217   18.475  239.166   15.297   54.805   4.1668   75.780   2.4797 -20.97491 4.848786 
1 1 1   21    4  -36 o   26.374   4.4166   30.827   9.1596   18.850   12.681   43.893   13.245   20.090   6.6512   31.002   5.4394 -10.91239 8.592155 
1 1 1   21    4  -35 o   11.531   4.9989   0.0938   8.6822 -16.0306   12.283   16.193   12.274   10.270   4.9472   18.952   6.5424 -8.681820 8.202269 
1 1 1   21    4  -34 o   18.694   5.4441   16.028   8.7980   13.408   12.501   18.598   12.384   17.881   6.5560   20.008   6.5706 -2.127102 9.281890 
1 1 1   21    4  -33 o   12.152   5.2079   1.0093   9.2156  -6.3973   12.145   11.060   14.148   11.902   5.4700   17.455   6.8372 -5.552828 8.756027 
1 1 1   21    4  -32 o   16.492   5.5146   11.853   8.7124   7.5475   14.633   14.218   10.844   16.531   6.7851   17.955   6.1513 -1.423594 9.158389 
1 1 1   21    4  -31 o   17.054   5.7063   12.761   9.3287   21.520   14.467   6.5256   12.205   21.364   7.1052   15.365   6.2382 5.998357 9.455050 
1 1 1   21    4  -30 o   11.138   4.8663  -0.6108   8.3634  -0.0863   11.663  -1.1660   12.000   13.166   5.7494   13.055   5.7620 0.1105623 8.139765 
1 1 1   21    4  -29 f   43.393   2.7705   78.809   9.7486   89.780   13.794   67.862   13.779   45.857   3.7222   39.499   4.3516 6.357773 5.726329 
1 1 1   21    4  -28 o   35.576   2.9984   53.300   8.6143   51.408   12.880   54.831   11.587   34.128   4.7593   35.621   4.0630 -1.493382 6.257739 
1 1 1   21    4  -27 o   12.631   5.1733   3.3937   8.4836  -1.5957   13.954   6.3194   10.685   13.940   6.1799   14.748   5.8893 -0.8086777 8.536716 
1 1 1   21    4  -26 o   48.629   2.7217   98.717   10.746   51.245   20.123  117.655   12.709   32.257   7.7500   52.993   2.9539 -20.73594 8.293862 
1 1 1   21    4  -25 o   63.834   2.0748  168.267   10.782  183.653   17.517  158.883   13.680   66.067   3.2627   61.735   2.7251 4.331642 4.251090 
1 1 1   21    4  -24 f   16.407   5.5277   11.510   8.7525  -7.0323   15.648   19.952   10.559   13.643   6.2474   20.800   5.9357 -7.156330 8.617585 
1 1 1   21    4  -23 o   31.661   3.7129   42.909   9.4006   57.445   17.061   36.571   11.265   35.394   6.1357   28.649   5.0059 6.745676 7.918640 
1 1 1   21    4  -22 o   24.883   4.7054   27.479   9.1946   32.857   16.626   25.110   11.036   26.037   7.4543   23.342   5.8203 2.695721 9.457381 
1 1 1   21    4  -21 o   64.036   2.4126  169.959   12.571  169.271   20.581  170.368   15.876   62.979   4.0302   63.790   3.0621 -0.8112373 5.061543 
1 1 1   21    4  -20 o   35.429   3.6618   53.465   10.423   67.508   23.944   50.182   11.578   37.074   8.1459   34.056   4.2637 3.018021 9.194253 
1 1 1   21    4  -19 o   32.994   3.5621   46.307   9.4285   50.641   17.191   44.443   11.276   32.976   6.6254   31.950   4.4501 1.025700 7.981199 
1 1 1   21    4  -18 o   23.729   5.1180   25.299   9.6084   39.499   13.981   12.591   13.227   29.349   6.0453   17.982   6.7159 11.36696 9.036000 
1 1 1   21    4  -17 o   48.346   2.4762   96.988   9.7258  104.335   15.733   92.444   12.373   49.494   3.9318   46.893   3.2573 2.601509 5.105785 
1 1 1   21    4  -16 o   18.224   5.2910   14.861   8.3217   11.490   13.405   16.974   10.615   17.658   6.7241   19.426   6.0533 -1.767368 9.047425 
1 1 1   21    4  -15 o   61.466   2.1137  155.869   10.575  153.475   17.044  157.367   13.484   60.373   3.4780   61.529   2.6949 -1.156353 4.399893 
1 1 1   21    4  -14 o   14.301   5.6537   5.8878   9.7527   12.008   23.915   4.6669   10.681   20.635   8.5907   14.275   5.8206 6.360788 10.37690 
1 1 1   21    4  -13 o   22.169   5.1660   22.093   9.1618   9.5932   17.364   26.915   10.785   18.283   7.4341   24.371   5.5533 -6.087296 9.279239 
1 1 1   21    4  -12 o   8.9182   4.2565 -10.6259   8.6373   4.3725   16.207 -16.5755   10.208   16.519   6.9864   9.0076   4.3795 7.511466 8.245622 
1 1 1   21    4  -11 o   43.148   2.8681   77.692   10.031   83.084   18.683   75.508   11.889   43.403   5.3968   42.304   3.4785 1.098698 6.420691 
1 1 1   21    4  -10 o   19.041   5.2235   16.253   8.3504   20.873   13.356   13.289   10.699   21.403   6.8066   17.754   6.1093 3.648996 9.146185 
1 1 1   21    4   -9 o   15.239   5.3591   9.2500   8.2561   7.2748   13.267   10.498   10.547   16.245   6.5365   16.498   6.0262 -0.2530766 8.890499 
1 1 1   21    4   -8 o   7.7666   3.8015 -14.8792   8.0670 -13.1479   13.067 -15.9454   10.255   11.313   5.3521   9.1393   4.4309 2.174120 6.948199 
1 1 1   21    4   -7 o   31.871   3.4545   43.004   8.8315   35.254   14.134   47.967   11.312   27.640   6.3995   33.375   4.2544 -5.734758 7.684621 
1 1 1   21    4   -6 o   25.155   4.3355   27.573   8.5688   27.561   13.458   27.581   11.112   24.362   6.6100   24.679   5.6465 -0.3167000 8.693419 
1 1 1   21    4   -5 o   16.503   5.4230   11.599   8.4354   16.122   13.441   8.6603   10.835   19.485   6.8391   15.853   6.0432 3.631478 9.126505 
1 1 1   21    4   -4 o   10.387   4.7975  -6.5940   9.5081  -1.8285   13.531 -11.2428   13.364   13.847   6.1146   11.815   5.5339 2.031662 8.246968 
1 1 1   21    4   -3 o   79.927   2.0862  263.155   13.580  275.210   19.439  251.660   18.981   81.320   2.9373   77.723   3.0016 3.597153 4.199640 
1 1 1   21    4   -2 o   46.265   2.9141   89.269   10.934  111.726   15.706   68.153   15.230   51.398   3.7752   39.608   4.8161 11.78957 6.119397 
1 1 1   21    4   -1 o   64.056   2.1056  169.111   10.979  183.260   17.505  159.935   14.097   66.181   3.2549   62.030   2.7952 4.151882 4.290363 
1 1 1   21    4    0 o   45.062   2.6589   84.380   9.7233   82.126   15.519   85.836   12.475   43.731   4.4140   45.174   3.4132 -1.442635 5.579662 
1 1 1   21    4    1 o   20.770   5.1842   19.354   8.7490   21.180   13.818   18.132   11.303   21.597   6.9291   20.096   6.2441 1.501221 9.327456 
1 1 1   21    4    2 o   40.937   2.8420   69.882   9.4245   70.528   14.902   69.451   12.167   40.404   4.6069   40.484   3.7287 -0.8031082E-01 5.926784 
1 1 1   21    4    3 o   14.163   5.3830   6.7015   8.5812   19.898   14.110  -1.0441   10.810   21.090   7.0171   12.604   5.5190 8.485775 8.927391 
1 1 1   21    4    4 o   78.200   1.9031  251.327   12.131  264.734   19.218  242.446   15.642   79.739   2.9618   76.533   2.5107 3.206528 3.882731 
1 1 1   21    4    5 o   33.823   3.5456   48.456   9.6304   55.187   14.674   43.364   12.763   35.381   5.2469   31.323   5.1798 4.058033 7.372935 
1 1 1   21    4    6 o   24.375   4.5494   26.082   8.7069   46.238   14.020   13.428   11.109   32.190   5.5430   17.917   6.2222 14.27319 8.333079 
1 1 1   21    4    7 o   22.135   4.9626   21.856   8.7325   21.932   13.854   21.807   11.248   21.895   6.9287   21.842   6.0898 0.5262184E-01 9.224580 
1 1 1   21    4    8 o   39.841   2.9347   66.333   9.4639   64.915   14.861   67.301   12.275   38.619   4.8256   39.792   3.8316 -1.172215 6.161841 
1 1 1   21    4    9 o   56.215   2.2788  130.584   10.421  144.804   16.748  121.601   13.312   58.658   3.5188   53.957   3.0388 4.701317 4.649308 
1 1 1   21    4   10 o   74.513   2.5085  229.920   15.215  228.324   21.900  231.409   21.152   73.601   3.6618   74.199   3.5072 -0.5975647 5.070420 
1 1 1   21    4   11 o   23.424   5.5818   24.886   10.506   32.231   14.671   17.155   15.051   26.224   6.8053   20.122   7.2195 6.101551 9.921321 
1 1 1   21    4   12 o   28.188   4.7193   34.883   10.461   25.337   14.467   45.341   15.143   23.294   7.0318   31.546   6.1095 -8.252417 9.315144 
1 1 1   21    4   13 o   66.672   2.4470  184.045   13.276  203.221   18.253  162.504   19.345   69.669   3.2228   61.929   3.8512 7.739513 5.021772 
1 1 1   21    4   14 o   76.051   2.1083  238.484   13.057  310.342   23.605  206.801   15.674   86.004   3.3735   70.538   2.7311 15.46667 4.340466 
1 1 1   21    4   15 o   50.571   2.4862  106.078   10.217  127.652   16.631   92.998   12.949   54.905   3.7382   46.984   3.4042 7.921677 5.056008 
1 1 1   21    4   16 o   37.464   3.2976   59.177   9.9678   59.970   18.325   58.845   11.879   36.122   6.4608   37.074   3.9935 -0.9523239 7.595370 
1 1 1   21    4   17 o   19.006   5.5229   16.282   9.0635   29.055   17.137   11.322   10.679   24.633   7.6937   16.832   6.0760 7.800228 9.803565 
1 1 1   21    4   18 o   19.564   5.4946   17.336   9.1214   22.893   17.516   15.269   10.684   22.373   7.8104   18.597   6.1029 3.775946 9.911975 
1 1 1   21    4   19 o   42.187   2.9599   74.531   10.114   82.637   18.915   71.286   11.969   43.091   5.5108   40.984   3.6198 2.106682 6.593325 
1 1 1   21    4   20 o   17.169   5.4210   12.979   8.4853   7.9530   14.039   15.871   10.651   16.637   6.7135   18.857   6.0866 -2.219790 9.061895 
1 1 1   21    4   21 o   32.846   3.5695   45.942   9.4037   40.774   14.621   49.588   12.281   29.681   6.2414   33.689   4.5913 -4.007698 7.748259 
1 1 1   21    4   22 o   35.038   3.4244   52.065   9.6557   46.962   14.630   56.004   12.853   32.140   5.7973   35.868   4.4944 -3.727104 7.335417 
1 1 1   21    4   23 o   16.940   5.5818   12.476   8.9342   11.566   13.778   13.137   11.736   17.693   6.7972   17.780   6.3755 -0.8641624E-01 9.319318 
1 1 1   21    4   24 f   10.060   4.6320  -5.5890   8.7665   6.2100   13.581 -14.0162   11.478   15.887   6.5304   10.169   4.8679 5.718148 8.145096 
1 1 1   21    4   25 o   13.973   5.6331   5.0952   9.8738   3.3324   13.872   6.9056   14.057   15.167   6.4411   16.256   6.6588 -1.089631 9.264296 
1 1 1   21    4   26 o   48.908   2.6701   99.762   10.604  124.272   16.509   82.544   13.837   54.011   3.7734   43.902   3.9073 10.10955 5.431886 
1 1 1   21    4   27 o   9.9822   4.6237  -6.3148   8.9256   5.6222   14.075 -14.3448   11.544   15.855   6.5947   10.139   4.8611 5.716522 8.192720 
1 1 1   21    4   28 o   29.689   4.0556   38.255   9.5586   34.112   15.127   41.010   12.333   26.616   6.9117   30.204   5.1965 -3.588131 8.647249 
1 1 1   21    4   29 f   27.054   4.9432   32.802   10.500   49.874   19.146   25.460   12.556   31.886   7.4936   23.184   6.4231 8.702095 9.869665 
1 1 1   21    4   30 o   54.160   2.7497  122.598   12.100  116.401   21.535  125.457   14.627   51.144   5.2395   54.489   3.3087 -3.344872 6.196762 
1 1 1   21    4   31 o   47.352   3.0157   94.305   11.580   93.588   20.838   94.625   13.928   45.393   5.7610   47.094   3.6569 -1.700443 6.823662 
1 1 1   21    4   32 o   24.870   5.6570   28.635   11.209   25.604   24.326   29.452   12.629   23.373   9.0180   24.957   6.2282 -1.583878 10.95969 
1 1 1   21    4   33 o   39.535   4.0279   67.552   12.799   61.353   18.228   73.580   17.977   36.159   6.4195   40.244   5.6341 -4.084526 8.541257 
1 1 1   21    4   34 o   46.365   3.4946   91.503   13.110  101.569   18.549   81.455   18.532   47.984   4.8070   42.454   5.4829 5.529594 7.291752 
1 1 1   21    4   35 o   73.005   2.6781  222.580   15.910  239.110   23.015  207.449   22.020   74.782   3.7878   69.546   3.8998 5.235931 5.436591 
1 1 1   21    4   36 o   17.537   5.8640   13.726   9.8516   22.464   16.447   8.8373   12.303   21.688   7.5686   16.112   6.3560 5.575987 9.883451 
1 1 1   21    4   37 o   14.253   5.6823   6.1156   9.9310   6.5545   16.908   5.8844   12.271   16.899   7.1409   15.099   6.2071 1.799295 9.461514 
1 1 1   21    4   38 o   13.040   5.5920   1.6016   10.638   5.1382   16.894  -0.7223   13.694   16.518   7.0643   13.877   6.1387 2.640649 9.358890 
1 1 1   21    4   39 o   15.979   5.6606   10.809   9.2244   1.5953   14.625   16.896   11.887   14.802   6.4515   19.109   6.4419 -4.306412 9.117081 
1 1 1   21    4   40 o   15.442   5.6977   9.5465   9.4670  -0.6171   14.949   16.352   12.232   14.396   6.3887   18.874   6.5306 -4.477516 9.135882 
1 1 1   21    4   41 o   20.306   6.2255   19.678   11.281   18.414   15.090   21.278   16.985   19.924   7.2183   21.077   7.6550 -1.153652 10.52151 
1 1 1   21    4   42 o   14.593   5.5909   7.7843   9.3045   22.190   14.499  -2.3021   12.132   21.278   7.1139   12.681   5.6828 8.596863 9.105081 
1 1 1   21    4   43 o   11.552   5.0862  -0.7038   9.2962   3.7543   14.568  -3.7659   12.074   15.196   6.5308   12.289   5.5728 2.907688 8.585302 
1 1 1   21    4   44 o   27.569   4.6569   34.361   10.093   38.750   15.541   31.159   13.274   27.804   6.8917   25.161   6.4442 2.643234 9.435181 
1 1 1   21    4   45 o   14.057   5.5960   6.3854   9.6178   0.4325   14.696   10.845   12.720   14.364   6.3564   16.642   6.4932 -2.277777 9.086565 
1 1 1   21    4   46 o   34.350   3.9991   51.928   10.989   34.289   18.806   61.072   13.541   25.121   8.0859   36.859   4.6071 -11.73778 9.306314 
1 1 1   21    4   47 o   30.703   4.1065   41.845   10.020   49.735   15.522   36.208   13.120   32.000   6.1741   27.270   6.0594 4.730145 8.650805 
1 1 1   21    4   48 o   20.028   6.0128   19.644   10.600   24.053   15.428   15.702   14.587   21.542   7.3382   18.494   7.0210 3.048117 10.15597 
1 1 1   21    4   49 o   20.803   6.2227   21.568   11.368   17.046   17.943   24.601   14.693   19.248   7.6497   21.727   7.1580 -2.478495 10.47639 
1 1 1   21    4   50 o   40.754   3.8241   73.064   12.556   67.538   20.112   76.593   16.072   36.209   7.0676   40.779   4.9354 -4.570480 8.620275 
1 1 1   21    4   51 o   13.851   5.8338   4.6317   11.224  -2.1711   17.800   9.1229   14.462   14.666   6.6955   16.193   6.7057 -1.527469 9.476094 
1 1 1   21    4   52 o   32.383   4.7250   48.424   12.105   52.540   19.024   45.623   15.692   30.999   7.5903   29.784   6.6336 1.215284 10.08058 
1 1 1   21    4   53 o   13.818   5.8421   4.6877   11.326   11.811   17.534  -0.4124   14.836   17.414   7.3102   13.850   6.2390 3.563494 9.610635 
1 1 1   21    4   54 o   13.526   5.7623   4.0576   11.163   14.984   16.776  -4.6245   14.954   18.052   7.3191   13.025   6.0162 5.026297 9.474353 
1 1 1   21    4   55 o   14.995   6.0241   8.6317   11.250   19.751   17.311   0.5022   14.802   19.389   7.5721   13.934   6.2578 5.455464 9.823328 
1 1 1   21    4   56 o   10.543   5.0752 -13.6725   12.878  -7.7877   16.271 -23.5405   21.071   12.913   6.0666   12.688   6.1960 0.2249346 8.671483 
1 1 1   21    4   57 f   13.922   6.0739   3.6231   12.991   6.7540   16.504  -1.4758   21.062   15.677   6.8429   15.310   7.0953 0.3672447 9.857391 
1 1 1   21    4   58 o   40.025   4.5086   74.450   14.454   72.817   18.350   77.119   23.463   37.683   6.1884   36.078   8.1687 1.604031 10.24817 
1 1 1   21    4   59 o   11.518   5.3939  -6.3775   12.685  -7.2928   16.075  -4.8670   20.651   12.735   5.9976   14.516   6.8243 -1.781007 9.085284 
1 1 1   21    4   60 o   20.153   6.2849   21.998   11.440   7.6305   17.038   33.794   15.438   15.703   6.9006   24.003   7.2677 -8.300175 10.02182 
1 1 1   21    4   61 o   23.038   6.0450   28.243   11.492   19.274   17.061   35.692   15.549   18.525   7.4267   24.607   7.2570 -6.082500 10.38358 
1 1 1   21    4   62 o   28.523   5.3619   40.742   12.009   36.448   17.804   44.327   16.267   23.911   7.8795   27.683   7.1565 -3.772314 10.64438 
1 1 1   21    4   63 o   20.281   7.4901   25.318   16.366   34.038   24.168   17.932   22.243   21.586   8.7728   18.217   7.9478 3.368942 11.83762 
1 1 1   21    4   64 o   16.182   6.8399   11.785   15.520   3.9408   22.624   18.758   21.330   15.842   7.3460   18.276   7.8787 -2.434047 10.77212 
1 1 1   21    4   65 o   12.532   5.9067  -6.1242   15.648   12.025   23.047 -21.6490   21.315   17.103   7.7334   12.497   6.1299 4.605820 9.868133 
1 1 1   21    4   66 o   16.212   6.8710   12.122   15.732   15.404   23.129   9.2970   21.462   17.614   7.8732   16.396   7.4334 1.217617 10.82787 
1 1 1   21    4   67 o   18.180   7.1186   19.328   15.333   18.247   21.713   20.404   21.656   17.967   7.8454   18.400   7.9356 -0.4336662 11.15900 
1 1 1   21    4   68 o   19.233   7.3004   22.959   15.770   23.081   22.312   22.838   22.292   18.848   8.0909   18.799   8.0787 0.4967690E-01 11.43365 
1 1 1   21    4   69 o   14.453   6.4604   5.4209   15.574   4.4753   22.327   6.3171   21.736   15.560   7.2434   15.741   7.2641 -0.1800623 10.25835 
1 1 1   21    4   70 o   12.769   5.9671  -3.1059   15.391   12.321   22.634 -16.3746   20.991   16.748   7.6090   12.730   6.2096 4.018085 9.821181 
1 1 1   21    4   71 o   17.020   7.0149   16.171   15.726   34.025   23.082   0.7025   21.484   20.953   8.5516   14.810   6.9620 6.142549 11.02725 
1 1 1   21    4   72 o   15.844   6.7899   11.895   15.665   2.9351   22.799   19.908   21.561   15.287   7.1818   17.934   7.8248 -2.647119 10.62100 
1 1 1   21    4   73 o   18.440   8.1101   23.037   23.578   23.037   23.578   0.0000   0.0000   18.440   8.1101  ?   ?  0.000000 8.110081 
1 1 1   21    4   74 o   11.228   5.6261 -36.9190   22.024 -36.9190   22.024   0.0000   0.0000   11.228   5.6261  ?   ?  0.000000 5.626115 
1 1 1   21    4   75 o   13.925   6.4872   0.7738   17.963   0.7738   17.963   0.0000   0.0000   13.925   6.4872  ?   ?  0.000000 6.487151 
1 1 1   21    4   76 o   12.660   6.0626  -7.6590   17.841  -7.6590   17.841   0.0000   0.0000   12.660   6.0626  ?   ?  0.000000 6.062613 
1 1 1   21    4   77 o   22.872   7.9982   37.990   18.373   37.990   18.373   0.0000   0.0000   22.872   7.9982  ?   ?  0.000000 7.998159 
1 1 1   21    4   78 o   14.530   6.6086   6.0151   17.134   6.0151   17.134   0.0000   0.0000   14.530   6.6086  ?   ?  0.000000 6.608584 
1 1 1   21    4   79 o   12.404   5.9391  -7.1624   17.101  -7.1624   17.101   0.0000   0.0000   12.404   5.9391  ?   ?  0.000000 5.939066 
1 1 1   21    4   80 f   16.850   7.2395   17.108   17.894   17.108   17.894   0.0000   0.0000   16.850   7.2395  ?   ?  0.000000 7.239522 
1 1 1   21    4   81 f   12.618   6.0317  -6.3998   17.488  -6.3998   17.488   0.0000   0.0000   12.618   6.0317  ?   ?  0.000000 6.031704 
1 1 1   21    4   82 o   16.971   7.8034   16.325   24.763   16.325   24.763   0.0000   0.0000   16.971   7.8034  ?   ?  0.000000 7.803388 
1 1 1   21    5  -68 o   12.381   6.1381 -26.0177   23.412   0.0000   0.0000 -26.0177   23.412  ?   ?    12.381   6.1381 0.000000 6.138119 
1 1 1   21    5  -67 o   15.429   7.3169   2.3893   24.710   0.0000   0.0000   2.3893   24.710  ?   ?    15.429   7.3169 0.000000 7.316890 
1 1 1   21    5  -66 o   21.572   8.8462   38.875   24.844   0.0000   0.0000   38.875   24.844  ?   ?    21.572   8.8462 0.000000 8.846182 
1 1 1   21    5  -65 o   13.744   6.6628 -11.1516   23.170   0.0000   0.0000 -11.1516   23.170  ?   ?    13.744   6.6628 0.000000 6.662803 
1 1 1   21    5  -64 o   16.478   7.5098   11.205   22.268   0.0000   0.0000   11.205   22.268  ?   ?    16.478   7.5098 0.000000 7.509840 
1 1 1   21    5  -63 o   13.400   5.8708   4.6023   12.247   0.0000   0.0000   4.6023   12.247  ?   ?    13.400   5.8708 0.000000 5.870820 
1 1 1   21    5  -62 o   12.668   5.7123   1.1451   12.474   0.0000   0.0000   1.1451   12.474  ?   ?    12.668   5.7123 0.000000 5.712305 
1 1 1   21    5  -61 o   15.618   6.4503   11.406   13.333   0.0000   0.0000   11.406   13.333  ?   ?    15.618   6.4503 0.000000 6.450310 
1 1 1   21    5  -60 o   9.4765   4.5816 -11.9689   10.772 -22.1787   19.073  -7.1873   13.053   11.699   5.7503   11.326   5.3555 0.3723536 7.857950 
1 1 1   21    5  -59 f   10.900   5.0798  -4.6860   11.031 -12.0598   19.299  -1.1081   13.443   12.872   6.2005   12.616   5.7820 0.2554598 8.478096 
1 1 1   21    5  -58 f   13.002   5.6817   3.5380   11.406 -22.0160   20.612   14.819   13.695   12.245   6.0106   16.836   6.6855 -4.591193 8.990173 
1 1 1   21    5  -57 o   26.583   5.5800   36.308   11.705   32.869   21.049   37.848   14.084   21.685   8.3829   25.975   6.6300 -4.289736 10.68784 
1 1 1   21    5  -56 o   10.098   4.7903  -8.0160   10.607 -38.6042   22.017   1.2283   12.104   11.398   5.6986   12.716   5.6888 -1.317849 8.052125 
1 1 1   21    5  -55 o   19.979   5.5448   20.684   9.3483   19.894   13.597   21.393   12.874   18.769   6.8442   19.448   6.7010 -0.6790485 9.578424 
1 1 1   21    5  -54 o   16.481   5.6610   13.756   9.1856   17.472   13.388   10.452   12.626   17.957   6.7464   15.503   6.3258 2.454594 9.248187 
1 1 1   21    5  -53 o   24.302   5.0525   28.977   9.6819   19.450   13.926   37.891   13.470   18.747   6.9117   26.658   6.2993 -7.911081 9.351602 
1 1 1   21    5  -52 o   20.291   5.5738   21.033   9.5009   5.1498   13.755   35.524   13.139   14.404   6.2677   25.875   6.2911 -11.47057 8.880428 
1 1 1   21    5  -51 o   12.827   5.3557   4.6181   9.3344 -10.5030   13.712   17.676   12.743   11.328   5.3946   18.307   6.6330 -6.978736 8.549809 
1 1 1   21    5  -50 o   37.999   3.2776   63.180   10.053   51.549   14.265   74.657   14.170   32.283   5.6251   40.284   4.3860 -8.001301 7.132886 
1 1 1   21    5  -49 o   29.047   4.3011   38.785   9.8767   29.519   13.872   48.311   14.065   23.237   6.8550   31.189   5.7440 -7.951824 8.943413 
1 1 1   21    5  -48 o   10.412   4.7662  -3.4784   9.0986 -17.1792   13.265   8.6943   12.504   10.264   4.9906   15.305   6.2757 -5.041044 8.018195 
1 1 1   21    5  -47 o   15.852   5.7127   11.655   9.4359   25.303   13.935   0.0979   12.823   21.591   6.9615   13.110   5.8610 8.481212 9.100176 
1 1 1   21    5  -46 o   20.782   5.9755   21.907   10.662   21.801   14.385   22.037   15.882   20.214   7.0766   20.227   7.3938 -0.1272202E-01 10.23459 
1 1 1   21    5  -45 o   21.350   6.5625   23.812   12.525   30.606   14.051  -2.4677   27.637   23.973   6.8493   17.031   7.9709 6.942249 10.50944 
1 1 1   21    5  -44 o   18.940   6.5921   18.071   12.473   13.727   14.008   34.691   27.398   17.444   6.8118   23.444   9.4071 -5.999964 11.61442 
1 1 1   21    5  -43 o   31.464   5.4401   47.226   13.448   54.807   15.277   21.124   28.346   33.638   5.7796   20.897   9.0457 12.74159 10.73446 
1 1 1   21    5  -42 o   37.579   3.7461   62.056   11.322   59.488   15.117   65.338   17.088   35.482   5.3963   36.733   5.9071 -1.251232 8.000925 
1 1 1   21    5  -41 o   13.891   5.4501   6.8844   9.0027   5.7447   12.654   8.0523   12.811   14.774   6.2067   15.523   6.3573 -0.7487068 8.884740 
1 1 1   21    5  -40 o   10.342   4.6984  -3.2210   8.6293  -1.7806   12.133  -4.6952   12.275   12.610   5.6644   12.033   5.5186 0.5772190 7.908204 
1 1 1   21    5  -39 o   17.303   5.5734   14.081   8.9333   17.839   12.694   10.393   12.574   19.140   6.6511   16.308   6.4280 2.831793 9.249711 
1 1 1   21    5  -38 o   18.034   5.5470   15.409   8.9469   0.9901   12.500   30.553   12.811   13.511   5.9250   24.816   6.3176 -11.30436 8.661266 
1 1 1   21    5  -37 o   25.934   4.2179   30.095   8.6104   21.950   12.636   37.154   11.764   20.998   6.6135   28.195   5.3136 -7.196508 8.483671 
1 1 1   21    5  -36 o   26.066   4.6597   30.897   9.5374   25.208   14.295   35.460   12.804   22.285   7.0363   27.141   5.9515 -4.856045 9.215776 
1 1 1   21    5  -35 o   23.540   4.8586   25.483   9.0139   42.114   14.978   16.039   11.287   29.326   6.4421   18.479   6.2768 10.84715 8.994365 
1 1 1   21    5  -34 o   7.7885   3.8305 -16.1444   8.5021 -34.3905   13.792  -4.9595   10.798   8.9380   4.4748   11.312   5.1835 -2.373978 6.847823 
1 1 1   21    5  -33 o   11.682   5.0228   0.9645   8.6259  -8.7834   14.276   6.5698   10.825   12.388   5.7751   14.636   5.8990 -2.247638 8.255300 
1 1 1   21    5  -32 o   13.960   5.4183   6.7231   8.8205  -2.0437   14.795   11.558   10.987   13.958   6.2636   16.615   6.1367 -2.657334 8.768800 
1 1 1   21    5  -31 o   25.648   4.5095   29.511   9.0840   36.339   15.393   25.862   11.252   27.011   6.9509   23.277   5.9181 3.734011 9.129016 
1 1 1   21    5  -30 o   37.588   3.1431   60.059   9.5424   52.981   15.851   64.083   11.950   33.544   6.0181   38.440   3.8664 -4.895180 7.153061 
1 1 1   21    5  -29 o   57.550   2.2533  137.680   10.550  156.159   17.742  127.570   13.122   60.381   3.6213   55.018   2.9366 5.362411 4.662322 
1 1 1   21    5  -28 o   53.799   2.3446  120.501   10.257  145.093   17.550  107.742   12.641   58.137   3.7228   50.475   3.0871 7.661587 4.836268 
1 1 1   21    5  -27 o   42.243   2.8274   75.082   9.6798   76.709   16.371   74.207   12.003   41.420   4.9463   41.612   3.5731 -0.1923180 6.101941 
1 1 1   21    5  -26 o   15.828   5.9189   9.8283   10.280   6.7019   20.011   10.949   11.982   17.812   7.6543   16.730   6.3605 1.081770 9.952111 
1 1 1   21    5  -25 o   32.119   4.3003   45.327   10.976   60.485   20.794   39.473   12.923   34.844   7.5405   29.213   5.6312 5.630983 9.411156 
1 1 1   21    5  -24 o   35.575   4.7569   56.244   13.449   41.288   21.223   66.280   17.385   27.983   8.5311   37.940   5.8058 -9.956806 10.31929 
1 1 1   21    5  -23 o   8.5377   4.1415 -13.7713   8.9900  -6.3830   14.530 -18.3535   11.443   13.091   6.0040   9.4366   4.5990 3.654459 7.563007 
1 1 1   21    5  -22 o   21.553   5.1485   21.310   8.9208   14.543   14.977   25.031   11.106   18.750   7.1150   23.073   5.8866 -4.323072 9.234495 
1 1 1   21    5  -21 o   34.617   3.3719   51.080   9.3944   69.093   16.190   41.937   11.535   39.230   5.1901   30.674   4.7680 8.556208 7.047786 
1 1 1   21    5  -20 o   28.450   4.7663   36.151   10.663   40.927   19.126   33.997   12.844   28.351   7.9544   26.922   6.0057 1.429113 9.966976 
1 1 1   21    5  -19 o   39.738   2.9329   66.471   9.4333   70.942   15.927   64.055   11.708   39.906   5.0059   38.613   3.7677 1.293488 6.265358 
1 1 1   21    5  -18 o   11.519   4.9137   1.0248   8.1352  -1.3055   12.559   2.7095   10.678   13.266   5.8731   13.455   5.6798 -0.1889114 8.170265 
1 1 1   21    5  -17 o   13.232   5.2423   5.1117   8.4021   10.164   14.371   2.4880   10.356   17.225   6.8460   13.232   5.5899 3.993849 8.838217 
1 1 1   21    5  -16 o   22.084   5.1286   22.270   9.0550   52.503   17.027   10.349   10.692   33.344   6.4983   16.246   6.0439 17.09812 8.874534 
1 1 1   21    5  -15 o   15.874   5.9241   9.7167   10.288  -6.3531   16.064   20.892   13.396   13.859   6.3400   21.056   6.8286 -7.196581 9.318027 
1 1 1   21    5  -14 o   27.720   4.2355   33.681   9.2671   36.402   17.228   32.573   10.993   27.071   7.5326   26.789   5.2217 0.2817993 9.165505 
1 1 1   21    5  -13 o   23.003   4.7740   23.797   8.6583   21.110   14.689   25.227   10.718   21.213   7.1609   23.315   5.6904 -2.102711 9.146550 
1 1 1   21    5  -12 o   27.661   4.0592   33.341   8.8804   11.976   14.475   46.236   11.245   17.879   6.9406   32.510   4.3527 -14.63096 8.192567 
1 1 1   21    5  -11 o   39.286   2.8923   64.834   9.1973   55.891   14.816   70.442   11.731   35.245   5.3226   40.646   3.5772 -5.401226 6.412955 
1 1 1   21    5  -10 o   26.871   4.5326   31.954   9.5754   60.837   18.579   21.507   11.174   35.968   6.5793   21.434   6.1027 14.53336 8.973808 
1 1 1   21    5   -9 o   13.899   5.5747   5.3269   9.6174  -9.9993   13.721   20.129   13.484   12.084   5.6426   20.789   6.8577 -8.705178 8.880735 
1 1 1   21    5   -8 o   29.672   4.2476   38.461   9.9811   47.673   14.659   30.498   13.628   32.252   5.7884   25.297   6.5561 6.955282 8.745696 
1 1 1   21    5   -7 o   70.219   2.2218  204.136   12.701  230.241   18.667  181.633   17.331   74.040   3.0998   65.651   3.2487 8.388733 4.490314 
1 1 1   21    5   -6 o   46.621   2.6052   90.649   9.8611   91.847   15.945   89.908   12.549   46.049   4.2975   46.083   3.3637 -0.3437805E-01 5.457371 
1 1 1   21    5   -5 o   22.838   4.8034   23.437   8.6582   21.269   14.299   24.691   10.879   21.314   7.0631   23.060   5.7953 -1.745909 9.136336 
1 1 1   21    5   -4 o   43.614   2.7046   79.499   9.5681  106.793   15.745   63.518   12.048   49.939   3.8986   38.447   3.8981 11.49191 5.513075 
1 1 1   21    5   -3 o   36.519   3.0859   56.252   9.1004   60.708   15.011   53.662   11.443   36.913   5.1271   35.237   4.0579 1.676651 6.538605 
1 1 1   21    5   -2 o   26.144   4.3273   30.042   8.8997   23.930   14.318   33.889   11.361   22.413   7.0372   27.355   5.2863 -4.941568 8.801538 
1 1 1   21    5   -1 o   24.158   4.6627   26.022   8.8495   22.987   14.348   27.885   11.243   22.025   7.0603   24.565   5.7215 -2.539654 9.087543 
1 1 1   21    5    0 o   11.936   5.0861   1.1541   8.6992   0.1218   14.003   1.8028   11.101   14.357   6.2842   13.438   5.7362 0.9195719 8.508541 
1 1 1   21    5    1 o   28.400   3.9867   34.981   8.9753   40.777   14.767   31.585   11.303   29.490   6.3322   26.309   5.4497 3.180586 8.354390 
1 1 1   21    5    2 o   43.589   3.1819   80.144   11.228   60.998   15.568  100.894   16.208   36.881   5.3332   48.384   4.1495 -11.50305 6.757330 
1 1 1   21    5    3 o   15.850   5.6345   10.280   9.1465  -7.4796   14.005   23.488   12.078   12.710   5.8531   22.333   6.3402 -9.623373 8.628800 
1 1 1   21    5    4 o   57.768   2.4243  138.621   11.390  124.244   16.968  150.413   15.368   53.891   3.8887   59.788   3.1645 -5.897091 5.013568 
1 1 1   21    5    5 o   36.243   3.3960   55.807   9.9159   67.660   15.199   47.024   13.084   39.148   4.8678   32.420   5.1205 6.727753 7.065120 
1 1 1   21    5    6 o   19.543   5.3704   17.475   8.8181   10.430   14.466   21.640   11.124   17.412   6.8849   21.522   6.0759 -4.110491 9.182560 
1 1 1   21    5    7 o   50.478   2.4465  105.953   10.037   98.321   16.256  110.654   12.759   47.697   4.2247   51.302   3.0650 -3.605270 5.219446 
1 1 1   21    5    8 o   68.413   2.1587  193.626   12.023  216.224   21.776  183.716   14.421   71.242   3.7632   66.377   2.6707 4.865150 4.614550 
1 1 1   21    5    9 o   17.638   5.4316   14.009   8.5755   10.189   14.273   16.167   10.727   17.262   6.8348   18.872   6.1099 -1.610048 9.167584 
1 1 1   21    5   10 o   9.8996   4.5389  -4.7958   8.2957  -3.7628   13.694  -5.3946   10.427   13.295   5.9910   11.148   5.1029 2.147024 7.869729 
1 1 1   21    5   11 o   10.918   4.8826  -2.5246   8.9071 -13.9194   16.744   1.9726   10.519   12.928   6.0984   13.176   5.6028 -0.2481680 8.281432 
1 1 1   21    5   12 o   38.515   3.2521   62.824   10.115   44.521   18.915   70.154   11.970   29.880   7.7132   40.514   3.6641 -10.63442 8.539318 
1 1 1   21    5   13 o   22.368   5.3181   22.951   9.5538   10.437   17.996   27.862   11.274   18.349   7.5272   24.497   5.7457 -6.147564 9.469482 
1 1 1   21    5   14 o   12.374   5.1407   2.7229   8.5376   3.4267   14.444   2.3449   10.585   15.329   6.5433   13.313   5.6389 2.016328 8.637838 
1 1 1   21    5   15 o   37.854   3.0530   60.463   9.3405   57.535   15.555   62.114   11.681   35.595   5.5411   38.012   3.8217 -2.416542 6.731265 
1 1 1   21    5   16 o   12.983   5.3545   3.4981   9.1705   0.5918   14.078   5.6404   12.087   14.446   6.3125   15.015   6.1651 -0.5690298 8.823603 
1 1 1   21    5   17 o   26.191   4.6832   30.618   9.6315   46.516   14.790   18.911   12.692   31.682   5.9451   20.173   6.6531 11.50926 8.922284 
1 1 1   21    5   18 o   19.796   5.6405   18.141   9.5420   27.554   14.627   11.166   12.590   23.785   7.0448   17.063   6.5119 6.722324 9.593407 
1 1 1   21    5   19 o   22.588   5.2622   23.423   9.5083   35.059   14.922   15.468   12.337   26.907   6.8012   18.674   6.5523 8.233206 9.443995 
1 1 1   21    5   20 o   22.048   5.0061   22.145   8.7910   12.737   14.667   27.420   10.982   18.107   6.9982   24.291   5.6529 -6.183292 8.996082 
1 1 1   21    5   21 o   33.799   3.4134   48.765   9.2756   60.043   15.339   42.263   11.646   36.456   5.3181   30.779   4.7983 5.676954 7.162835 
1 1 1   21    5   22 o   29.370   4.6817   38.412   10.833   52.015   19.718   32.531   12.964   32.262   7.6203   26.207   6.1712 6.054173 9.805755 
1 1 1   21    5   23 o   22.416   5.3772   23.234   9.6992   17.075   19.169   25.354   11.245   20.272   7.9530   23.193   5.9267 -2.920679 9.918449 
1 1 1   21    5   24 o   16.010   5.7052   10.709   9.3830 -15.9441   18.545   19.880   10.878   13.351   6.3336   20.542   6.0731 -7.191184 8.774796 
1 1 1   21    5   25 o   20.468   5.3363   19.403   8.9931   33.598   15.075   11.561   11.205   26.141   6.9541   16.794   6.1984 9.346800 9.315536 
1 1 1   21    5   26 o   38.303   3.0649   62.098   9.4896   49.816   15.627   69.273   11.944   32.555   6.1132   40.143   3.6915 -7.587967 7.141289 
1 1 1   21    5   27 o   19.297   5.8751   17.400   10.070   42.394   14.826  -4.0040   13.720   29.830   6.2952   13.138   5.9512 16.69165 8.662922 
1 1 1   21    5   28 o   10.683   4.9089  -5.3444   9.7780  -4.8861   14.107  -5.7683   13.566   13.124   5.9799   12.685   5.8118 0.4389305 8.338784 
1 1 1   21    5   29 o   29.683   4.5518   39.285   10.663   47.766   15.512   31.686   14.682   31.702   6.2248   25.283   6.9225 6.418839 9.309639 
1 1 1   21    5   30 o   21.027   5.8782   21.015   10.465   61.539   15.539 -12.6231   14.157   36.697   5.3522   11.732   5.5562 24.96486 7.714722 
1 1 1   21    5   31 o   42.948   2.8527   77.787   9.9304   85.681   16.355   73.178   12.498   43.921   4.6381   41.142   3.7684 2.778824 5.976031 
1 1 1   21    5   32 o   38.161   3.2251   62.102   9.9385   59.590   16.313   63.584   12.533   35.715   5.8022   38.113   4.0985 -2.397709 7.103720 
1 1 1   21    5   33 o   21.912   5.5102   22.664   9.8309   19.245   19.649   23.806   11.354   20.567   8.0569   22.195   6.0919 -1.627604 10.10076 
1 1 1   21    5   34 o   9.2493   4.3989  -9.6632   9.0589   8.5858   14.473 -21.4168   11.615   16.447   6.7489   9.0728   4.4651 7.373771 8.092272 
1 1 1   21    5   35 o   14.244   5.5765   7.0342   9.4078   26.526   14.612  -6.7677   12.295   22.850   7.0992   11.729   5.4307 11.12046 8.938188 
1 1 1   21    5   36 o   18.311   5.7303   15.853   9.5017   6.6528   14.571   22.661   12.533   15.852   6.6598   21.371   6.5638 -5.519294 9.350737 
1 1 1   21    5   37 o   10.358   4.8240  -6.7554   9.9226 -34.7211   17.861   5.7276   11.933   10.774   5.3446   14.654   6.0818 -3.880405 8.096519 
1 1 1   21    5   38 o   16.784   6.0866   12.525   10.733   6.7220   15.407   17.996   14.959   16.046   6.8003   19.391   7.1609 -3.345278 9.875350 
1 1 1   21    5   39 o   20.920   5.6440   21.161   9.8449   18.077   15.015   23.487   13.039   19.360   7.1698   21.523   6.7094 -2.162096 9.819428 
1 1 1   21    5   40 o   13.587   5.4897   5.6684   9.4004   13.137   14.598   0.3768   12.287   17.600   6.9295   13.203   5.8289 4.396037 9.055049 
1 1 1   21    5   41 o   13.271   5.6011   3.6670   10.382 -16.5949   14.991   22.346   14.393   11.344   5.4646   20.813   7.0879 -9.469581 8.949857 
1 1 1   21    5   42 o   14.803   5.8325   8.1960   10.348   14.965   15.344   2.5484   14.015   18.170   7.1193   14.357   6.2853 3.813493 9.496814 
1 1 1   21    5   43 o   21.926   5.9599   24.006   10.929   13.001   15.431   35.083   15.482   17.514   7.0485   25.619   7.1451 -8.105398 10.03662 
1 1 1   21    5   44 o   29.751   6.4058   44.885   15.075   51.734   19.518   34.760   23.733   30.479   7.8186   23.748   8.9691 6.730423 11.89853 
1 1 1   21    5   45 o   11.372   5.2334  -4.5253   11.171 -26.6365   17.362   11.093   14.592   11.114   5.4676   16.658   6.7992 -5.543561 8.724874 
1 1 1   21    5   46 o   21.038   6.3436   22.940   11.779   14.773   18.440   28.570   15.309   18.228   7.5622   22.729   7.2936 -4.501755 10.50635 
1 1 1   21    5   47 o   20.502   6.4246   21.977   11.939 -14.5785   18.053   50.394   15.917   12.683   6.0802   31.299   6.4534 -18.61623 8.866508 
1 1 1   21    5   48 o   49.246   3.3883  105.956   13.519   60.095   19.672  146.989   18.608   32.948   7.4945   57.283   4.0104 -24.33569 8.500072 
1 1 1   21    5   49 o   14.597   6.0218   7.3791   11.603  -5.6872   17.294   18.075   15.647   13.589   6.3420   18.669   7.2246 -5.079669 9.613310 
1 1 1   21    5   50 o   51.191   3.3236  114.582   13.794   96.319   20.269  130.334   18.825   44.065   5.7823   53.328   4.3688 -9.263359 7.247194 
1 1 1   21    5   51 o   12.690   5.7758  -1.5617   13.115  -1.9079   25.043  -1.4308   15.395   16.022   7.5271   13.557   6.2035 2.465584 9.754020 
1 1 1   21    5   52 o   21.219   6.8252   25.245   13.400  -5.2745   26.093   36.178   15.617   15.724   7.4747   25.049   7.2411 -9.325086 10.40692 
1 1 1   21    5   53 o   10.813   5.1652 -10.5895   12.777 -19.3953   23.617  -6.9457   15.192   13.574   6.6135   12.409   5.8398 1.165231 8.822793 
1 1 1   21    5   54 o   17.598   6.7328   16.463   13.481 -12.5686   23.657   30.424   16.405   14.196   6.8451   22.259   7.5673 -8.063087 10.20390 
1 1 1   21    5   55 o   15.963   6.5445   11.624   13.594   46.273   24.669  -3.4841   16.290   24.693   9.1816   13.262   6.1779 11.43113 11.06655 
1 1 1   21    5   56 o   30.649   6.0307   49.325   14.530   60.844   26.575   44.414   17.353   27.848   9.6262   27.024   7.5747 0.8235760 12.24908 
1 1 1   21    5   57 o   10.624   5.2424 -23.8128   16.376   0.0000   0.0000 -23.8128   16.376  ?   ?    10.624   5.2424 0.000000 5.242435 
1 1 1   21    5   59 f   15.371   7.2398   0.1228   23.434   0.1228   23.434   0.0000   0.0000   15.371   7.2398  ?   ?  0.000000 7.239797 
1 1 1   21    5   60 o   11.072   5.5594 -42.3312   22.055 -42.3312   22.055   0.0000   0.0000   11.072   5.5594  ?   ?  0.000000 5.559416 
1 1 1   21    5   61 o   20.845   8.6942   33.063   24.561   33.063   24.561   0.0000   0.0000   20.845   8.6942  ?   ?  0.000000 8.694220 
1 1 1   21    5   62 o   18.499   7.4062   21.025   16.943   27.307   24.493   15.261   23.462   19.560   8.4376   17.388   7.8380 2.172064 11.51640 
1 1 1   21    5   63 o   13.074   6.0900  -2.1232   15.827 -14.1073   22.815   8.9936   21.974   13.429   6.5332   16.155   7.3996 -2.726051 9.870996 
1 1 1   21    5   64 o   12.172   5.8141  -8.5555   16.185 -28.4142   23.577   9.1406   22.257   12.348   6.1281   16.151   7.4160 -3.802928 9.620263 
1 1 1   21    5   65 o   10.662   5.2394 -19.7516   15.797 -34.2401   23.629  -8.0418   21.242   11.925   5.9533   13.639   6.5535 -1.713500 8.853800 
1 1 1   21    5   66 o   14.515   6.5382   5.5709   16.292   13.170   24.600  -0.3652   21.743   16.893   7.7713   14.646   6.9211 2.246726 10.40648 
1 1 1   21    5   67 o   15.342   6.7633   9.5554   16.487   28.509   25.108  -4.8108   21.859   19.341   8.4412   14.077   6.7330 5.264494 10.79757 
1 1 1   21    5   68 o   12.751   5.9896  -3.2883   15.848   4.3112   23.393  -9.7348   21.545   15.427   7.2559   13.410   6.4823 2.017082 9.729796 
1 1 1   21    5   69 o   16.782   7.0439   16.113   16.275   3.8688   24.398   25.930   21.847   15.448   7.3095   18.904   8.0577 -3.456472 10.87907 
1 1 1   21    5   70 f   10.875   5.4826 -44.5041   22.629 -44.5041   22.629   0.0000   0.0000   10.875   5.4826  ?   ?  0.000000 5.482627 
1 1 1   21    5   71 o   13.751   6.6807  -9.7890   23.629  -9.7890   23.629   0.0000   0.0000   13.751   6.6807  ?   ?  0.000000 6.680655 
1 1 1   21    5   72 o   13.195   6.4593 -14.4306   23.309 -14.4306   23.309   0.0000   0.0000   13.195   6.4593  ?   ?  0.000000 6.459293 
1 1 1   21    5   73 o   13.206   6.2686  -3.4576   18.220  -3.4576   18.220   0.0000   0.0000   13.206   6.2686  ?   ?  0.000000 6.268600 
1 1 1   21    5   74 o   16.351   7.1881   15.044   18.503   15.044   18.503   0.0000   0.0000   16.351   7.1881  ?   ?  0.000000 7.188067 
1 1 1   21    5   75 o   18.846   7.6917   25.808   18.673   25.808   18.673   0.0000   0.0000   18.846   7.6917  ?   ?  0.000000 7.691707 
1 1 1   21    5   76 o   14.365   6.6258   4.7564   18.050   4.7564   18.050   0.0000   0.0000   14.365   6.6258  ?   ?  0.000000 6.625765 
1 1 1   21    5   77 o   19.370   7.7479   27.515   18.525   27.515   18.525   0.0000   0.0000   19.370   7.7479  ?   ?  0.000000 7.747924 
1 1 1   21    6  -66 o   16.745   7.7128   15.295   24.338   0.0000   0.0000   15.295   24.338  ?   ?    16.745   7.7128 0.000000 7.712810 
1 1 1   21    6  -65 o   15.165   7.1759   3.6807   23.521   0.0000   0.0000   3.6807   23.521  ?   ?    15.165   7.1759 0.000000 7.175941 
1 1 1   21    6  -64 o   14.244   6.8456  -4.0440   23.201   0.0000   0.0000  -4.0440   23.201  ?   ?    14.244   6.8456 0.000000 6.845569 
1 1 1   21    6  -63 o   16.739   7.7267   14.065   24.612   0.0000   0.0000   14.065   24.612  ?   ?    16.739   7.7267 0.000000 7.726737 
1 1 1   21    6  -62 o   14.270   6.8784  -5.6451   23.834   0.0000   0.0000  -5.6451   23.834  ?   ?    14.270   6.8784 0.000000 6.878361 
1 1 1   21    6  -61 o   21.562   8.7832   39.322   24.292   0.0000   0.0000   39.322   24.292  ?   ?    21.562   8.7832 0.000000 8.783214 
1 1 1   21    6  -60 o   18.186   7.0159   20.412   14.722   0.0000   0.0000   20.412   14.722  ?   ?    18.186   7.0159 0.000000 7.015895 
1 1 1   21    6  -59 o   14.330   6.2931   6.8478   14.148   0.0000   0.0000   6.8478   14.148  ?   ?    14.330   6.2931 0.000000 6.293080 
1 1 1   21    6  -58 o   17.063   6.8445   16.639   14.500   0.0000   0.0000   16.639   14.500  ?   ?    17.063   6.8445 0.000000 6.844537 
1 1 1   21    6  -57 o   18.001   6.4556   18.713   12.033   56.642   21.505   1.4250   14.519   28.125   8.5903   13.284   6.0580 14.84139 10.51150 
1 1 1   21    6  -56 o   22.065   7.0372   29.958   14.268   41.064   21.619   21.386   18.992   23.200   8.6011   18.381   7.6541 4.819635 11.51365 
1 1 1   21    6  -55 o   25.001   6.8724   36.907   14.438   37.035   21.422   36.800   19.543   22.227   8.4914   22.717   8.2167 -0.4901237 11.81602 
1 1 1   21    6  -54 o   18.609   6.9100   20.538   13.963   48.652   21.264  -0.7763   18.515   25.952   8.6135   14.071   6.5654 11.88057 10.83038 
1 1 1   21    6  -53 o   14.751   6.3647   7.8809   13.944   14.615   20.325   1.8942   19.165   17.134   7.5329   14.684   6.7921 2.450118 10.14290 
1 1 1   21    6  -52 o   19.618   6.5083   22.033   12.140   36.413   20.859   14.668   14.929   22.480   8.4260   16.776   6.8658 5.704464 10.86909 
1 1 1   21    6  -51 o   26.841   5.8780   38.085   12.504   22.139   22.026   45.667   15.188   18.826   8.0593   28.523   6.6547 -9.696760 10.45169 
1 1 1   21    6  -50 o   15.656   6.0841   12.038   11.132   25.989   20.999   6.5854   13.128   19.791   8.1261   14.303   6.1737 5.487443 10.20525 
1 1 1   21    6  -49 o   20.541   6.2041   23.265   11.260   14.835   21.183   26.585   13.294   17.443   7.6789   21.383   6.7895 -3.940187 10.25004 
1 1 1   21    6  -48 o   16.345   6.6649   12.944   14.005  -2.4328   23.243   21.709   17.548   15.127   7.1508   19.021   7.5632 -3.894221 10.40846 
1 1 1   21    6  -47 f   26.647   6.0273   37.547   12.785   30.586   18.155   44.395   18.006   21.733   7.9111   26.721   7.7902 -4.988285 11.10286 
1 1 1   21    6  -46 o   25.731   6.0843   35.095   12.560   17.452   17.512   53.784   18.023   18.005   7.4097   30.457   7.3453 -12.45216 10.43349 
1 1 1   21    6  -45 o   17.349   5.9830   15.625   10.264   11.167   17.052   18.157   12.852   16.473   7.0723   18.278   6.6558 -1.804955 9.711697 
1 1 1   21    6  -44 o   20.859   5.9085   22.830   10.501   22.254   16.840   23.196   13.433   19.585   7.5169   20.298   6.8480 -0.7136402 10.16854 
1 1 1   21    6  -43 o   30.630   4.5334   44.011   10.978   27.569   18.036   53.685   13.835   21.261   7.8610   33.121   5.3034 -11.85960 9.482664 
1 1 1   21    6  -42 o   13.339   5.5991   5.0673   10.286 -12.4213   16.794   15.566   13.012   12.324   5.8966   17.533   6.6367 -5.208611 8.877819 
1 1 1   21    6  -41 o   12.188   5.2182   2.7189   9.2365   7.1324   13.528  -1.1350   12.642   14.996   6.3643   12.640   5.7201 2.356244 8.557150 
1 1 1   21    6  -40 o   19.374   6.2171   19.557   11.123   17.736   17.219   20.862   14.572   18.618   7.4621   19.594   7.0940 -0.9757996 10.29603 
1 1 1   21    6  -39 o   25.823   5.2277   32.335   10.626   40.301   18.000   28.074   13.165   26.233   7.8262   22.856   6.6605 3.376919 10.27676 
1 1 1   21    6  -38 o   8.9683   4.3512 -13.5202   9.9348 -24.7012   17.029  -7.7506   12.232   11.095   5.4495   11.201   5.2617 -0.1061306 7.575128 
1 1 1   21    6  -37 o   12.667   5.4648   2.4752   10.276 -18.8706   17.580   13.554   12.665   11.981   5.8069   17.032   6.5235 -5.051590 8.733626 
1 1 1   21    6  -36 o   11.782   5.2428  -0.4995   10.136  -8.7019   17.503   3.6394   12.433   13.328   6.2712   13.884   6.0004 -0.5553064 8.679436 
1 1 1   21    6  -35 o   22.271   5.3936   24.215   9.6864   33.266   14.810   17.450   12.805   24.847   7.0096   18.605   6.6609 6.242098 9.669669 
1 1 1   21    6  -34 o   21.459   5.5268   22.609   9.7260   8.1086   14.696   33.910   12.974   15.869   6.6789   25.853   6.2302 -9.983834 9.133653 
1 1 1   21    6  -33 o   42.226   3.1126   76.722   10.638   62.174   15.820   88.730   14.373   36.007   5.5696   44.692   3.9872 -8.684799 6.849702 
1 1 1   21    6  -32 f   24.242   5.0808   27.840   9.7184   18.686   14.807   34.767   12.881   19.293   7.1245   26.387   6.1091 -7.094852 9.385094 
1 1 1   21    6  -31 o   10.963   5.0403  -4.6445   10.326  -6.7475   19.229  -3.7923   12.240   14.425   6.7172   12.145   5.5478 2.279328 8.711967 
1 1 1   21    6  -30 o   9.4647   4.5258 -10.8268   9.8618 -24.8499   17.818  -4.6340   11.841   11.597   5.6709   11.790   5.4119 -0.1922836 7.838859 
1 1 1   21    6  -29 o   23.065   5.6612   25.842   10.563   40.377   18.750   19.082   12.786   26.955   7.9741   19.562   6.6800 7.392933 10.40239 
1 1 1   21    6  -28 o   28.881   4.8336   38.405   10.978   16.791   19.646   48.217   13.237   19.414   7.9024   32.124   5.2350 -12.71007 9.479097 
1 1 1   21    6  -27 o   45.166   2.9178   86.737   10.685   81.980   16.137   90.451   14.259   42.513   4.7370   45.413   3.8892 -2.899799 6.128971 
1 1 1   21    6  -26 o   21.444   5.6087   22.168   9.9138  -1.4905   15.413   38.865   12.948   14.119   6.3595   28.450   5.7805 -14.33145 8.594039 
1 1 1   21    6  -25 o   23.049   5.2848   25.108   9.7171   37.708   15.149   16.301   12.666   27.240   6.8348   18.567   6.6273 8.672449 9.520239 
1 1 1   21    6  -24 o   17.596   5.7264   14.524   9.4161  -0.5005   14.598   25.229   12.322   14.053   6.2701   22.509   6.4085 -8.456039 8.965664 
1 1 1   21    6  -23 o   35.839   3.5908   55.711   10.349   32.143   19.822   64.543   12.134   24.235   8.3163   38.372   3.9350 -14.13784 9.200221 
1 1 1   21    6  -22 o   22.915   4.9904   24.374   9.0569   29.458   15.304   21.633   11.236   23.888   7.2367   21.041   6.1592 2.846228 9.502914 
1 1 1   21    6  -21 o   10.652   4.7769  -2.2202   8.5890   5.9961   14.758  -6.4287   10.562   15.751   6.6645   10.830   5.0210 4.921040 8.344213 
1 1 1   21    6  -20 o   29.477   4.5886   39.137   10.667   31.788   18.627   42.723   13.011   24.391   8.0607   30.245   5.4793 -5.853367 9.746693 
1 1 1   21    6  -19 o   16.080   5.9732   10.722   10.436   13.316   15.115   8.3596   14.427   18.032   7.0657   16.353   6.7272 1.678488 9.756016 
1 1 1   21    6  -18 o   9.4266   4.4154  -6.9920   8.5092  -8.8955   12.712  -5.4468   11.453   11.565   5.4104   11.572   5.3159 -0.7268906E-02 7.584978 
1 1 1   21    6  -17 f   14.864   5.5111   8.7980   8.8759   2.1198   12.999   14.632   12.149   14.147   6.1247   18.034   6.4844 -3.887339 8.919580 
1 1 1   21    6  -16 o   11.294   4.8872   0.4139   8.2694  -6.1017   12.992   4.8512   10.722   12.263   5.6436   14.008   5.7847 -1.745868 8.081640 
1 1 1   21    6  -15 o   18.924   5.2889   16.708   8.4732   3.6950   13.226   25.767   11.035   14.684   6.2646   23.239   5.8346 -8.554718 8.560806 
1 1 1   21    6  -14 o   10.859   4.9028  -3.0902   9.2238  -6.8985   12.602   1.3040   13.537   11.918   5.5110   14.194   6.1963 -2.275856 8.292439 
1 1 1   21    6  -13 o   10.264   4.7350  -5.5018   9.2238  -9.3819   12.871  -1.4055   13.225   11.595   5.4308   13.408   5.9761 -1.813712 8.075088 
1 1 1   21    6  -12 o   14.995   5.6294   8.7181   9.3186   8.4319   13.131   9.0083   13.226   16.078   6.4911   16.292   6.5365 -0.2139912 9.211942 
1 1 1   21    6  -11 f   28.471   3.8554   35.400   8.7179   42.619   13.477   30.206   11.432   30.209   5.6816   25.326   5.6779 4.883123 8.032385 
1 1 1   21    6  -10 o   36.071   3.1777   55.406   9.2479  102.350   15.960   31.676   11.347   48.487   4.0757   26.052   5.5154 22.43503 6.857862 
1 1 1   21    6   -9 o   44.671   2.7500   83.906   9.9651   89.314   16.326   80.694   12.580   44.963   4.5156   43.340   3.5932 1.623692 5.770753 
1 1 1   21    6   -8 o   15.759   5.5092   10.657   8.7167   6.7747   14.757   12.738   10.803   16.138   6.7357   17.116   6.1192 -0.9775620 9.100231 
1 1 1   21    6   -7 o   22.973   5.7316   24.949   10.697   35.165   19.183   20.338   12.887   25.862   8.1490   20.570   6.6996 5.292370 10.54943 
1 1 1   21    6   -6 o   36.050   3.6902   56.103   10.691  108.659   18.599   30.168   13.065   49.525   4.6620   24.939   6.3965 24.58597 7.915144 
1 1 1   21    6   -5 o   10.101   4.7136  -7.2501   9.5486 -12.2062   16.185  -4.6043   11.826   12.778   6.0181   12.020   5.4760 0.7587643 8.136626 
1 1 1   21    6   -4 o   19.775   5.8270   18.425   10.028   8.7204   16.897   23.702   12.460   17.328   7.2180   22.102   6.4904 -4.774639 9.706939 
1 1 1   21    6   -3 o   44.142   2.8711   82.112   10.275  102.006   18.946   73.823   12.230   47.765   4.9370   41.423   3.6595 6.342262 6.145422 
1 1 1   21    6   -2 o   20.627   5.4515   19.893   9.3031   17.954   17.556   20.650   10.970   20.101   7.6852   20.817   6.0837 -0.7158661 9.801750 
1 1 1   21    6   -1 o   11.050   4.9424  -2.2673   9.1297  -2.9004   14.576  -1.8586   11.712   13.737   6.1864   12.608   5.6212 1.129551 8.358768 
1 1 1   21    6    0 o   25.569   4.4668   29.219   8.9712   44.755   15.023   20.609   11.184   30.666   6.2228   20.781   6.1616 9.885216 8.757147 
1 1 1   21    6    1 o   24.364   4.6190   26.740   8.8378   35.436   14.958   22.076   10.954   26.820   6.8259   21.519   6.0134 5.300179 9.096932 
1 1 1   21    6    2 o   17.165   5.5073   13.382   8.7288   15.648   14.735   12.156   10.834   18.930   7.0847   16.893   6.1169 2.037205 9.359967 
1 1 1   21    6    3 o   16.206   5.4947   11.548   8.6488   26.202   14.787   3.9272   10.663   22.963   7.1428   13.739   5.7293 9.223684 9.156668 
1 1 1   21    6    4 o   17.487   5.5362   13.987   8.8443   30.175   14.858   5.1043   11.007   24.603   7.0478   14.272   5.8741 10.33033 9.174785 
1 1 1   21    6    5 o   9.6076   4.4711  -6.3086   8.4974  -7.6091   14.781  -5.6665   10.385   12.899   5.9661   10.968   5.0470 1.931108 7.814502 
1 1 1   21    6    6 o   27.268   4.4838   33.191   9.6201   59.894   19.261   24.316   11.104   34.933   7.0082   22.582   5.9501 12.35075 9.193362 
1 1 1   21    6    7 o   27.753   4.4121   34.278   9.6478   59.215   19.528   26.226   11.097   34.591   7.1615   23.518   5.8202 11.07332 9.228280 
1 1 1   21    6    8 o   60.021   2.4041  150.197   11.739  165.444   22.599  144.563   13.737   61.269   4.5576   58.595   2.8850 2.673317 5.393939 
1 1 1   21    6    9 o   45.910   2.6850   88.483   10.004  107.304   16.520   77.583   12.572   49.628   4.1208   42.445   3.6697 7.183170 5.517912 
1 1 1   21    6   10 o   37.461   3.1415   59.673   9.5047   51.450   15.261   64.884   12.148   33.139   5.8641   38.645   3.9102 -5.506271 7.048226 
1 1 1   21    6   11 f   19.987   5.3976   18.698   8.9989   22.115   14.808   16.697   11.331   21.257   7.1899   18.902   6.2883 2.355421 9.551819 
1 1 1   21    6   12 o   40.004   2.9938   67.776   9.6916   90.775   16.165   54.870   12.109   45.369   4.4273   35.270   4.3006 10.09816 6.172276 
1 1 1   21    6   13 o   29.444   4.0250   38.066   9.4076   28.761   15.722   43.256   11.742   23.799   7.3589   30.972   4.8065 -7.172379 8.789555 
1 1 1   21    6   14 o   32.631   3.8441   46.371   10.029   70.061   20.099   38.517   11.573   37.974   6.7400   29.033   5.0747 8.941383 8.436853 
1 1 1   21    6   15 o   19.706   5.6821   18.358   9.6276   3.0499   19.134   23.548   11.141   16.589   7.3005   22.127   6.0185 -5.538584 9.461482 
1 1 1   21    6   16 o   19.588   5.7010   18.159   9.6507 -12.0247   19.112   28.488   11.181   13.970   6.5670   24.518   5.7023 -10.54790 8.697259 
1 1 1   21    6   17 f   43.457   2.8393   79.725   10.003   81.613   16.280   78.580   12.678   42.687   4.7596   42.648   3.6830 0.3917313E-01 6.018116 
1 1 1   21    6   18 o   39.048   3.3172   65.285   10.459   70.093   16.237   61.876   13.674   39.160   5.2163   37.203   4.6072 1.956455 6.959593 
1 1 1   21    6   19 o   21.775   5.1428   22.117   8.9819   32.453   14.954   16.284   11.234   25.311   7.0084   18.609   6.2625 6.701677 9.398711 
1 1 1   21    6   20 o   34.136   3.4221   50.202   9.3940   48.551   15.557   51.149   11.785   31.714   6.2401   33.908   4.3650 -2.193882 7.615262 
1 1 1   21    6   21 o   38.391   3.4692   63.523   10.739   93.136   16.847   43.250   13.939   45.664   4.5880   30.120   5.8884 15.54456 7.464795 
1 1 1   21    6   22 o   21.784   6.1757   23.250   11.467   26.330   15.038   18.970   17.727   22.657   7.2244   20.077   7.7108 2.579479 10.56634 
1 1 1   21    6   23 o   13.430   5.7743   2.3513   11.399  -6.4064   14.723   15.454   18.009   12.934   5.9724   19.051   7.6328 -6.117270 9.691698 
1 1 1   21    6   24 o   12.519   5.5564  -0.8023   11.312   7.4955   14.719 -12.7763   17.681   16.075   6.7194   13.151   6.2225 2.924098 9.158073 
1 1 1   21    6   25 o   21.950   5.1799   22.705   9.1177   14.813   14.915   27.414   11.521   18.302   7.0613   23.698   5.9684 -5.395895 9.245785 
1 1 1   21    6   26 o   30.118   3.8366   39.931   9.2056   59.468   15.514   29.315   11.436   35.558   5.5324   24.603   5.7980 10.95412 8.014043 
1 1 1   21    6   27 o   17.801   5.6087   15.062   9.0875   25.953   14.658   8.2630   11.582   22.337   7.1336   15.290   6.1228 7.046451 9.400932 
1 1 1   21    6   28 o   40.380   3.0292   69.662   9.8982   76.245   16.148   65.700   12.528   40.757   4.9625   38.526   4.0497 2.231121 6.405171 
1 1 1   21    6   29 o   20.041   5.4362   19.350   9.1038   8.5040   14.818   25.926   11.538   16.224   6.7589   22.838   6.0876 -6.613474 9.096252 
1 1 1   21    6   30 o   11.443   5.0016   0.2935   8.8428 -10.5574   14.775   6.3491   11.038   12.112   5.7181   14.388   5.8978 -2.276345 8.214602 
1 1 1   21    6   31 o   34.190   3.5301   51.047   9.6969   66.595   16.137   42.259   12.132   37.522   5.4339   30.002   5.1458 7.519936 7.483719 
1 1 1   21    6   32 f   39.137   3.1727   66.020   10.035   80.142   16.588   57.869   12.603   41.570   4.9953   35.738   4.4202 5.832066 6.670187 
1 1 1   21    6   33 o   14.481   5.5397   8.4227   9.1251  -9.2085   15.314   18.128   11.362   12.484   5.8716   19.014   6.2960 -6.530331 8.609012 
1 1 1   21    6   34 o   29.483   4.8809   40.615   11.320   43.401   19.978   39.298   13.739   27.186   8.2750   27.929   6.1969 -0.7429523 10.33813 
1 1 1   21    6   35 o   11.166   5.0542  -2.4159   9.8740 -14.0556   14.771   6.9864   13.276   11.461   5.4959   15.121   6.3551 -3.659883 8.401940 
1 1 1   21    6   36 o   30.134   4.5677   41.940   10.869   28.604   17.991   49.604   13.639   22.289   7.9046   32.106   5.4032 -9.816208 9.574760 
1 1 1   21    6   37 o   29.767   4.2982   40.491   10.128   52.669   15.522   31.464   13.364   32.380   6.1047   24.428   6.5694 7.951944 8.967992 
1 1 1   21    6   38 o   41.473   3.2151   74.732   10.784   78.330   16.106   71.808   14.519   40.831   4.9394   39.414   4.6059 1.416901 6.753654 
1 1 1   21    6   39 o   15.162   5.9061   9.7095   10.510   24.980   17.788   1.5195   13.027   20.880   7.7902   13.468   5.9709 7.412186 9.815276 
1 1 1   21    6   40 o   9.4511   4.5343 -10.9076   10.081 -23.5649   16.882  -3.8932   12.568   11.104   5.4484   12.051   5.5478 -0.9467859 7.775870 
1 1 1   21    6   41 o   20.992   5.8994   22.711   10.511   30.131   17.662   18.642   13.080   22.426   7.8421   18.762   6.7303 3.663918 10.33418 
1 1 1   21    6   42 o   18.538   6.0079   17.793   10.371   42.923   17.194   3.4215   13.002   27.247   7.5036   13.810   6.0497 13.43744 9.638587 
1 1 1   21    6   43 o   30.759   4.5184   44.342   10.992   26.847   18.014   54.720   13.874   21.035   7.8412   33.492   5.2545 -12.45739 9.438951 
1 1 1   21    6   44 o   16.054   5.9854   12.526   10.497   1.1752   17.656   18.732   13.055   14.615   6.6709   18.565   6.7155 -3.949779 9.465706 
1 1 1   21    6   45 o   13.581   5.6643   6.0524   10.424   12.368   17.652   2.6704   12.917   16.842   7.2124   13.446   5.9544 3.395214 9.352766 
1 1 1   21    6   46 o   17.733   6.0567   16.629   10.511   2.5802   17.501   24.555   13.146   14.699   6.6832   20.756   6.7670 -6.056163 9.510886 
1 1 1   21    6   47 f   14.863   6.0786   9.2379   11.691   8.7411   17.624   9.6283   15.623   15.875   6.9959   15.723   6.7601 0.1526775 9.728339 
1 1 1   21    6   48 o   25.181   5.3838   32.155   10.716   34.851   17.806   30.625   13.418   23.195   7.8839   23.161   6.7169 0.3352737E-01 10.35720 
1 1 1   21    6   49 o   15.404   5.9050   11.493   10.383   23.906   17.651   4.9257   12.839   19.581   7.6463   13.828   6.0356 5.753044 9.741365 
1 1 1   21    6   50 o   13.477   5.7802   5.3268   11.369   14.345   25.593   3.1098   12.689   17.646   8.0455   13.298   5.8944 4.347707 9.973722 
1 1 1   21    6   51 o   18.772   7.0265   20.788   14.495  -6.3069   25.813   33.267   17.518   15.039   7.2259   22.502   7.8136 -7.462086 10.64262 
1 1 1   21    6   52 o   21.247   7.0212   27.223   14.133 -12.7382   25.543   44.853   16.966   14.315   6.9526   27.073   7.4531 -12.75729 10.19255 
1 1 1   21    6   53 o   11.241   5.4975 -18.5423   16.761  -4.3432   24.678 -30.7024   22.837   14.969   7.1580   12.088   6.0045 2.880731 9.343003 
1 1 1   21    6   54 o   13.679   6.3441  -0.6247   16.886 -17.6748   24.664   14.420   23.168   13.591   6.6512   17.251   7.7814 -3.660368 10.23658 
1 1 1   21    6   55 o   15.184   6.7765   7.5401   17.064 -13.6379   24.660   26.996   23.636   13.912   6.7737   19.484   8.3449 -5.571902 10.74806 
1 1 1   21    6   56 o   18.155   7.4165   20.287   17.380   31.916   25.631   10.389   23.646   20.185   8.6683   16.516   7.6057 3.668667 11.53199 
1 1 1   21    6   57 o   17.756   7.3494   19.013   17.361 -15.2901   25.725   47.705   23.527   13.892   6.7973   24.275   8.9776 -10.38290 11.26063 
1 1 1   21    6   58 o   15.334   6.8033   9.0180   16.943   2.1909   25.757   14.225   22.494   15.601   7.4190   16.901   7.6412 -1.300176 10.65031 
1 1 1   21    6   59 o   9.5044   4.7658 -32.8461   15.937 -42.6809   24.567 -25.7002   20.941   11.591   5.8264   11.783   5.8349 -0.1919327 8.245747 
1 1 1   21    6   60 o   12.192   5.8535  -9.4547   16.866  -9.6733   25.755  -9.2906   22.318   14.304   6.9550   13.652   6.5991 0.6517906 9.587564 
1 1 1   21    6   61 o   17.777   8.1187   19.831   26.198   19.831   26.198   0.0000   0.0000   17.777   8.1187  ?   ?  0.000000 8.118690 
1 1 1   21    6   62 o   13.435   6.5853 -15.6595   24.474 -15.6595   24.474   0.0000   0.0000   13.435   6.5853  ?   ?  0.000000 6.585270 
1 1 1   21    6   63 o   13.508   6.6338 -16.0640   25.208 -16.0640   25.208   0.0000   0.0000   13.508   6.6338  ?   ?  0.000000 6.633829 
1 1 1   21    6   64 o   13.685   6.3123   2.0537   16.381 -19.2283   25.941   16.170   21.127   13.368   6.5968   16.851   7.5289 -3.482559 10.01008 
1 1 1   21    6   65 o   16.320   6.9259   14.868   16.020   30.180   25.847   5.3166   20.414   19.158   8.4561   14.945   6.9464 4.213538 10.94339 
1 1 1   21    6   66 o   16.108   7.5541   10.300   25.033   10.300   25.033   0.0000   0.0000   16.108   7.5541  ?   ?  0.000000 7.554141 
1 1 1   21    6   67 o   13.267   6.5068 -14.3955   23.996 -14.3955   23.996   0.0000   0.0000   13.267   6.5068  ?   ?  0.000000 6.506801 
1 1 1   21    6   68 o   21.072   8.9343   42.761   26.615   42.761   26.615   0.0000   0.0000   21.072   8.9343  ?   ?  0.000000 8.934254 
1 1 1   21    6   69 o   14.373   6.9643  -3.8934   25.237  -3.8934   25.237   0.0000   0.0000   14.373   6.9643  ?   ?  0.000000 6.964332 
1 1 1   21    6   70 o   12.014   6.0039 -30.8680   24.321 -30.8680   24.321   0.0000   0.0000   12.014   6.0039  ?   ?  0.000000 6.003877 
1 1 1   21    6   71 o   16.535   7.7154   14.776   25.574   14.776   25.574   0.0000   0.0000   16.535   7.7154  ?   ?  0.000000 7.715368 
1 1 1   21    6   72 o   16.710   7.8339   15.345   26.881   15.345   26.881   0.0000   0.0000   16.710   7.8339  ?   ?  0.000000 7.833851 
1 1 1   21    7  -63 o   13.684   6.6649  -8.1144   23.932   0.0000   0.0000  -8.1144   23.932  ?   ?    13.684   6.6649 0.000000 6.664941 
1 1 1   21    7  -62 o   14.374   6.9522  -2.9319   24.861   0.0000   0.0000  -2.9319   24.861  ?   ?    14.374   6.9522 0.000000 6.952245 
1 1 1   21    7  -61 o   22.026   8.9856   46.286   25.470   0.0000   0.0000   46.286   25.470  ?   ?    22.026   8.9856 0.000000 8.985637 
1 1 1   21    7  -60 o   16.427   7.6672   13.637   25.287   0.0000   0.0000   13.637   25.287  ?   ?    16.427   7.6672 0.000000 7.667193 
1 1 1   21    7  -59 o   16.412   7.6230   13.331   24.519   0.0000   0.0000   13.331   24.519  ?   ?    16.412   7.6230 0.000000 7.622993 
1 1 1   21    7  -58 o   12.412   6.1963 -30.4901   25.595   0.0000   0.0000 -30.4901   25.595  ?   ?    12.412   6.1963 0.000000 6.196334 
1 1 1   21    7  -57 o   15.143   6.6397   10.214   15.695   0.0000   0.0000   10.214   15.695  ?   ?    15.143   6.6397 0.000000 6.639715 
1 1 1   21    7  -56 o   21.171   7.3835   30.291   15.651   0.0000   0.0000   30.291   15.651  ?   ?    21.171   7.3835 0.000000 7.383477 
1 1 1   21    7  -55 o   11.810   5.6368  -7.5337   15.149   0.0000   0.0000  -7.5337   15.149  ?   ?    11.810   5.6368 0.000000 5.636829 
1 1 1   21    7  -54 o   16.443   6.9067   15.039   15.666   0.0000   0.0000   15.039   15.666  ?   ?    16.443   6.9067 0.000000 6.906689 
1 1 1   21    7  -53 o   24.919   6.4006   35.774   13.069   32.756   21.968   37.427   16.259   20.434   8.3418   23.798   7.5027 -3.364237 11.21942 
1 1 1   21    7  -52 o   22.195   6.5814   29.285   12.760   14.761   20.840   37.994   16.139   16.748   7.4808   24.149   7.4539 -7.400396 10.56041 
1 1 1   21    7  -51 o   12.812   6.0046  -2.8315   15.775 -13.4845   20.630   12.167   24.478   12.796   6.2225   16.631   7.6870 -3.834851 9.889872 
1 1 1   21    7  -50 o   12.079   5.7811  -8.6641   16.169 -24.2301   21.370   12.180   24.729   12.006   5.9363   16.679   7.7153 -4.673132 9.734715 
1 1 1   21    7  -49 o   12.108   5.5570  -0.9574   12.474 -33.9465   20.272   19.147   15.825   10.943   5.4707   17.770   7.1428 -6.826732 8.997131 
1 1 1   21    7  -48 o   15.014   6.2499   10.266   12.655 -11.2515   20.581   23.350   16.048   13.100   6.3332   19.093   7.3356 -5.993881 9.691275 
1 1 1   21    7  -47 o   25.532   6.4187   36.888   13.342   36.921   22.495   36.870   16.572   21.791   8.5952   23.797   7.5835 -2.005640 11.46240 
1 1 1   21    7  -46 o   17.355   6.5666   17.014   12.735   2.2442   21.183   25.374   15.936   15.019   7.0126   19.902   7.3835 -4.883026 10.18297 
1 1 1   21    7  -45 o   9.8215   4.7688 -13.5863   11.995 -32.7344   20.330  -3.3602   14.857   11.141   5.5554   12.588   5.8759 -1.446936 8.086345 
1 1 1   21    7  -44 o   13.151   5.7280   4.3104   11.512   14.253   21.494   0.3111   13.632   17.099   7.6201   12.889   5.8750 4.209876 9.621929 
1 1 1   21    7  -43 o   13.645   5.9862   4.6957   12.772   3.0311   21.529   5.5997   15.866   15.311   7.1223   14.625   6.5301 0.6858788 9.662822 
1 1 1   21    7  -42 o   11.475   5.2772  -2.4213   11.332   13.785   21.862  -8.3759   13.252   17.120   7.6532   11.198   5.3241 5.921867 9.322976 
1 1 1   21    7  -41 o   15.099   6.0665   10.520   11.410 -10.0013   21.606   18.455   13.436   13.701   6.5899   18.000   6.7592 -4.299417 9.439984 
1 1 1   21    7  -40 o   30.006   5.1661   44.896   12.180   86.721   24.035   30.444   14.129   37.282   8.1378   22.637   6.9720 14.64506 10.71597 
1 1 1   21    7  -39 f   18.180   6.3652   18.289   11.639   35.398   22.094   11.718   13.692   22.081   8.5740   15.871   6.5439 6.210100 10.78588 
1 1 1   21    7  -38 o   9.5983   4.6137 -10.6390   10.550  -6.0468   17.864 -13.0987   13.074   13.272   6.2723   10.476   5.0605 2.796299 8.059205 
1 1 1   21    7  -37 o   18.183   6.1318   17.891   10.770   4.9318   17.944   25.189   13.465   15.131   6.8343   20.801   6.8525 -5.670638 9.678041 
1 1 1   21    7  -36 o   23.969   5.6377   29.682   10.830   9.4152   17.779   41.638   13.655   16.059   7.0534   27.987   6.1533 -11.92820 9.360243 
1 1 1   21    7  -35 o   13.892   5.9168   5.8925   11.765   2.0621   28.394   6.6863   12.926   16.691   7.8939   14.435   6.1767 2.255166 10.02326 
1 1 1   21    7  -34 o   17.140   6.3553   15.223   11.804  -2.6203   26.019   19.847   13.245   15.845   7.5126   18.891   6.7732 -3.045487 10.11505 
1 1 1   21    7  -33 f   15.808   6.2654   11.455   12.006   16.806   28.453   10.295   13.243   18.779   8.5315   15.639   6.4406 3.140278 10.68958 
1 1 1   21    7  -32 o   13.239   5.6183   4.6890   10.541 -11.9944   17.148   14.823   13.365   12.434   5.9518   17.169   6.6680 -4.734632 8.937850 
1 1 1   21    7  -31 o   41.351   3.5492   75.924   11.848   88.584   19.320   68.294   14.999   42.034   5.7925   37.760   4.9953 4.273727 7.648929 
1 1 1   21    7  -30 o   17.077   6.1281   14.642   10.845  -0.5184   18.110   23.118   13.541   14.574   6.6912   20.421   6.8755 -5.847219 9.593959 
1 1 1   21    7  -29 o   23.074   5.3794   26.436   9.9307   5.8427   14.485   44.702   13.641   14.892   6.4562   29.787   5.8270 -14.89504 8.696964 
1 1 1   21    7  -28 o   16.115   5.7899   12.463   9.6841   21.258   14.145   4.7035   13.286   19.710   7.0070   14.279   6.1870 5.431149 9.347548 
1 1 1   21    7  -27 o   13.758   5.5580   6.7269   9.6341   15.023   14.352  -0.0783   12.998   17.559   6.8836   13.044   5.8608 4.514541 9.040612 
1 1 1   21    7  -26 o   12.687   5.3529   3.8121   9.4771  -3.4459   14.178   9.6739   12.742   12.831   5.9016   15.618   6.3614 -2.786777 8.677377 
1 1 1   21    7  -25 o   12.620   5.3552   3.4364   9.5760   2.4737   14.317   4.2158   12.882   14.148   6.2666   14.096   6.0999 0.5164051E-01 8.745275 
1 1 1   21    7  -24 o   14.125   5.5749   7.6688   9.4692   3.1701   14.280   11.199   12.651   14.322   6.3049   16.153   6.4219 -1.830555 8.999570 
1 1 1   21    7  -23 o   8.4026   4.1049 -14.5783   9.2733 -12.8643   14.103 -15.8838   12.308   11.270   5.3953   9.9625   4.8357 1.307738 7.245268 
1 1 1   21    7  -22 o   22.456   5.3416   24.667   9.6346   32.733   14.613   18.465   12.815   24.556   6.9747   18.917   6.6746 5.639217 9.653824 
1 1 1   21    7  -21 o   13.279   5.4541   5.3126   9.4631   8.7411   14.624   2.8430   12.412   15.913   6.6779   13.648   5.9461 2.264939 8.941525 
1 1 1   21    7  -20 o   23.260   5.7069   26.918   10.738   23.210   17.583   29.123   13.560   20.563   7.7301   23.392   6.7428 -2.828827 10.25765 
1 1 1   21    7  -19 o   17.265   6.2507   14.328   11.313   5.9881   14.953   25.492   17.301   15.331   6.6028   21.368   7.7307 -6.036883 10.16663 
1 1 1   21    7  -18 o   18.244   6.2770   16.551   11.295  -3.3812   14.582   46.448   17.858   13.159   6.0275   29.073   7.4896 -15.91347 9.613849 
1 1 1   21    7  -17 o   16.253   6.4529   10.914   12.756   10.466   14.812   12.201   25.101   16.550   6.8132   18.774   8.3076 -2.223610 10.74410 
1 1 1   21    7  -16 o   24.672   5.5309   29.657   10.848   13.411   15.185   46.591   15.502   17.512   7.0113   30.240   6.4837 -12.72786 9.549660 
1 1 1   21    7  -15 o   16.243   6.0304   11.859   10.634   3.7696   15.108   19.801   14.970   14.930   6.5313   19.624   7.1776 -4.694345 9.704438 
1 1 1   21    7  -14 o   20.284   6.0785   20.686   10.840   16.888   15.136   24.684   15.532   18.660   7.1354   21.418   7.3610 -2.758385 10.25175 
1 1 1   21    7  -13 o   16.555   5.9829   12.611   10.358   7.0580   14.911   17.792   14.401   15.724   6.6778   18.943   7.0205 -3.218430 9.689208 
1 1 1   21    7  -12 o   38.055   3.4237   62.970   10.507   60.224   14.085   66.415   15.777   36.063   4.9193   37.545   5.3025 -1.481922 7.232988 
1 1 1   21    7  -11 o   35.154   3.6396   54.201   10.279   66.231   13.940   39.864   15.218   38.152   4.5733   27.752   6.7849 10.40004 8.182285 
1 1 1   21    7  -10 o   31.336   3.7475   43.316   9.3829   26.777   13.256   59.924   13.283   22.722   6.7004   36.268   4.5961 -13.54528 8.125296 
1 1 1   21    7   -9 o   25.234   4.6832   29.432   9.2785   34.944   13.446   24.422   12.820   26.329   6.3412   21.779   6.6286 4.550486 9.173281 
1 1 1   21    7   -8 o   19.678   6.0045   19.170   10.510   13.623   13.425   27.953   16.893   17.457   6.7088   22.634   7.6792 -5.176550 10.19695 
1 1 1   21    7   -7 o   13.448   5.3829   5.8889   8.9484   1.0157   12.983   10.299   12.351   13.597   5.9977   16.103   6.3635 -2.506036 8.744505 
1 1 1   21    7   -6 o   15.252   5.4323   10.261   8.5057   2.9125   13.063   15.671   11.207   14.113   6.1248   18.040   6.2505 -3.926488 8.751131 
1 1 1   21    7   -5 o   41.221   2.9796   72.594   9.9444   65.142   14.256   79.656   13.879   37.759   4.7355   42.374   4.0679 -4.614895 6.242850 
1 1 1   21    7   -4 o   50.563   3.6949  111.623   15.124   0.0000   0.0000  111.623   15.124  ?   ?    50.563   3.6949 0.000000 3.694864 
1 1 1   21    7   -3 f   30.795   3.7938   41.840   9.3221   55.606   15.664   34.290   11.600   33.923   5.8773   26.757   5.5023 7.166155 8.051002 
1 1 1   21    7   -2 o   33.895   3.6554   50.324   9.9402   84.317   19.094   37.687   11.642   42.055   5.7179   28.275   5.2443 13.78044 7.758640 
1 1 1   21    7   -1 o   32.616   3.6355   46.595   9.5017   62.864   15.972   37.683   11.821   36.399   5.5590   28.209   5.3362 8.190178 7.705700 
1 1 1   21    7    0 o   11.325   5.0466  -1.2542   9.4266  -5.8417   19.281   0.1867   10.806   14.637   6.7852   12.436   5.4792 2.200742 8.721248 
1 1 1   21    7    1 o   15.354   5.6688   10.077   9.3736   24.057   18.833   5.4727   10.807   21.296   8.0012   14.022   5.8007 7.273655 9.882730 
1 1 1   21    7    2 o   21.599   5.6027   22.683   9.9470   25.797   19.236   21.546   11.621   21.821   8.1089   20.708   6.3129 1.112736 10.27652 
1 1 1   21    7    3 f   13.637   5.4119   6.3134   8.9685  -1.5529   14.914   10.769   11.225   13.812   6.2356   16.040   6.1419 -2.227086 8.752460 
1 1 1   21    7    4 o   45.608   2.9493   88.703   10.906   58.562   20.297  100.936   12.931   33.006   7.6877   48.399   3.2974 -15.39347 8.365029 
1 1 1   21    7    5 o   44.661   3.0246   85.274   10.946   61.161   20.491   94.902   12.948   33.834   7.6143   46.829   3.4155 -12.99523 8.345267 
1 1 1   21    7    6 o   48.441   2.8343   99.719   11.143  124.001   21.462   90.758   13.038   51.712   5.1602   45.698   3.5273 6.014759 6.250529 
1 1 1   21    7    7 o   32.972   3.9174   48.170   10.323   42.812   19.962   50.125   12.061   27.370   8.2593   33.175   4.5823 -5.804726 9.445268 
1 1 1   21    7    8 o   29.127   4.3052   38.324   9.9141   20.593   17.814   46.280   11.933   20.149   7.7319   31.725   4.7610 -11.57629 9.080179 
1 1 1   21    7    9 o   16.911   5.7825   13.456   9.5813   13.197   17.314   13.570   11.503   17.964   7.3776   17.155   6.2890 0.8088570 9.694311 
1 1 1   21    7   10 o   9.1689   4.3931 -10.7567   9.3937 -20.9700   16.761  -6.0797   11.342   11.553   5.6158   11.208   5.1985 0.3453321 7.652600 
1 1 1   21    7   11 o   22.728   5.3734   24.895   9.7970   35.946   17.618   19.948   11.788   25.397   7.7787   19.877   6.4021 5.520193 10.07450 
1 1 1   21    7   12 o   42.032   3.1115   75.922   10.585   86.400   18.907   71.139   12.775   42.581   5.5813   40.048   3.9653 2.533085 6.846484 
1 1 1   21    7   13 o   18.307   5.7134   16.361   9.4524   19.568   17.011   14.929   11.369   19.675   7.5542   17.645   6.2810 2.029518 9.824260 
1 1 1   21    7   14 o   16.022   5.8177   11.605   9.8097   8.3274   15.029   14.038   12.948   16.073   6.7589   17.439   6.6161 -1.365385 9.458110 
1 1 1   21    7   15 o   39.667   3.1092   67.754   9.9733   68.815   16.339   67.124   12.591   38.034   5.4236   38.786   4.0417 -0.7521935 6.763975 
1 1 1   21    7   16 o   25.607   5.2834   31.446   10.662   39.280   15.270   23.994   14.894   27.328   6.8648   21.155   7.2102 6.172720 9.955512 
1 1 1   21    7   17 o   19.239   6.0496   18.580   10.577   25.280   15.195   12.282   14.733   21.586   7.2833   17.070   6.8812 4.515896 10.01983 
1 1 1   21    7   18 o   8.8336   4.3127 -15.7385   10.188  -7.0795   14.722 -23.6956   14.113   12.541   5.8525   9.9671   4.9084 2.573818 7.638339 
1 1 1   21    7   19 o   16.565   5.6752   13.083   9.2301  -0.1478   14.898   21.324   11.758   13.908   6.2596   20.322   6.3768 -6.413877 8.935635 
1 1 1   21    7   20 o   42.545   2.9288   77.647   10.095   76.587   16.186   78.321   12.915   40.395   5.0240   42.020   3.8119 -1.625538 6.306419 
1 1 1   21    7   21 o   25.062   4.7498   29.507   9.3482   41.084   15.106   22.322   11.901   27.940   6.7160   20.698   6.4029 7.242125 9.279090 
1 1 1   21    7   22 o   23.889   4.9782   27.245   9.3794   34.079   15.262   23.098   11.889   24.904   7.1458   21.032   6.3800 3.871807 9.579512 
1 1 1   21    7   23 o   16.455   5.5982   13.031   8.9786   15.001   14.635   11.842   11.370   17.721   6.9501   16.188   6.1858 1.532948 9.304177 
1 1 1   21    7   24 o   11.148   4.9356  -0.2485   8.8701  -8.2071   14.457   4.5562   11.233   12.135   5.7067   13.639   5.7943 -1.503543 8.132689 
1 1 1   21    7   25 o   14.433   5.4960   8.7872   8.9555   22.652   14.454   0.1477   11.409   20.344   7.0954   12.478   5.5567 7.866829 9.012285 
1 1 1   21    7   26 o   16.075   5.7573   12.288   9.5673   10.847   14.480   13.404   12.746   16.329   6.7308   16.871   6.5228 -0.5420113 9.372891 
1 1 1   21    7   27 o   30.215   6.2756   47.087   14.951   47.087   14.951   0.0000   0.0000   30.215   6.2756  ?   ?  0.000000 6.275646 
1 1 1   21    7   28 o   21.367   5.8475   23.429   10.479   13.579   14.146   35.407   15.599   17.032   6.7845   25.018   7.2384 -7.985802 9.920905 
1 1 1   21    7   29 o   18.684   6.0375   18.062   10.478   3.9836   14.109   35.374   15.645   14.329   6.2889   24.931   7.2596 -10.60186 9.604789 
1 1 1   21    7   30 o   10.802   4.8968  -2.1098   9.3115  -2.9606   13.509  -1.3397   12.852   12.568   5.7734   12.638   5.7387 -0.7041454E-01 8.140292 
1 1 1   21    7   31 o   11.213   5.0129  -0.6110   9.3808  -7.7699   13.842   5.4702   12.757   11.801   5.5600   14.224   6.1120 -2.422897 8.262586 
1 1 1   21    7   32 o   16.058   5.7835   12.633   9.6694   2.9207   14.367   20.675   13.073   14.040   6.2450   19.359   6.7484 -5.319460 9.194581 
1 1 1   21    7   33 f   8.5014   4.1810 -16.9730   10.127  -4.7821   16.764 -23.9780   12.708   13.314   6.2237   9.0754   4.5031 4.238643 7.681967 
1 1 1   21    7   34 o   9.5373   4.6133 -12.8147   10.955  -5.4318   24.635 -14.6343   12.230   15.245   7.2517   9.9361   4.8223 5.309224 8.708699 
1 1 1   21    7   35 o   14.485   5.7711   8.8892   10.237   0.0799   17.300   13.637   12.700   14.200   6.5268   16.548   6.4790 -2.348547 9.196511 
1 1 1   21    7   36 o   41.796   3.8682   79.509   13.029   51.376   18.741  105.831   18.127   28.999   7.7712   46.988   4.8000 -17.98979 9.134065 
1 1 1   21    7   37 o   24.234   5.5263   30.177   10.674   35.485   17.968   27.282   13.269   23.360   7.9198   21.751   6.7663 1.609755 10.41660 
1 1 1   21    7   38 o   13.283   5.6487   5.2573   10.693  -7.1231   17.927   12.094   13.322   13.139   6.2312   15.969   6.5047 -2.830652 9.007697 
1 1 1   21    7   39 f   12.296   5.4026   2.2515   10.440   17.686   18.261  -5.2435   12.725   17.848   7.4742   11.561   5.4101 6.287225 9.226755 
1 1 1   21    7   40 o   19.577   6.1296   21.133   10.871   25.530   18.244   18.713   13.536   19.891   7.7719   18.128   6.7890 1.763351 10.31957 
1 1 1   21    7   41 o   23.434   5.7175   29.002   10.824   55.901   18.238   14.377   13.448   30.584   7.3972   16.599   6.6140 13.98493 9.922852 
1 1 1   21    7   42 o   25.307   5.4218   32.908   10.848   25.155   17.710   37.563   13.724   19.744   7.6735   25.842   6.5170 -6.098490 10.06751 
1 1 1   21    7   43 o   12.047   5.4544  -0.1379   11.510  -6.1271   25.338   1.4193   12.920   14.886   7.1539   12.912   5.8186 1.974131 9.221404 
1 1 1   21    7   44 o   17.306   6.3326   16.541   11.655   3.3804   25.725   19.940   13.074   15.983   7.5456   18.503   6.7166 -2.520070 10.10191 
1 1 1   21    7   45 o   12.067   5.4495   0.2593   11.403  -3.0824   26.467   1.0210   12.636   15.330   7.3528   12.690   5.7332 2.640220 9.323847 
1 1 1   21    7   46 o   15.940   6.1841   13.176   11.487   40.722   25.270   6.0018   12.896   22.169   8.9849   13.938   6.0668 8.230968 10.84131 
1 1 1   21    7   47 o   14.960   6.2696   9.8524   12.865   9.8824   25.258   9.8419   14.949   16.593   7.7174   15.286   6.5928 1.307009 10.15004 
1 1 1   21    7   48 o   12.612   5.7651   0.0619   13.250 -14.6223   24.718   5.9829   15.696   13.733   6.7073   14.500   6.4832 -0.7670441 9.328428 
1 1 1   21    7   49 o   23.022   7.8492   36.482   17.652   25.240   26.557   45.379   23.626   18.759   8.4070   23.470   8.9293 -4.710773 12.26420 
1 1 1   21    7   50 o   11.357   5.3727  -6.3241   13.169   8.3897   25.935 -11.4353   15.286   16.287   7.6542   11.403   5.4995 4.883809 9.425051 
1 1 1   21    7   51 o   14.790   6.2845   9.4708   13.218   0.2633   26.139   12.634   15.322   15.350   7.3475   15.897   6.7609 -0.5470648 9.984769 
1 1 1   21    7   52 o   14.940   6.3370   9.9937   13.399   14.880   27.095   8.4120   15.416   17.129   7.9755   14.864   6.5469 2.264853 10.31849 
1 1 1   21    7   53 o   11.960   5.5844  -3.1666   13.436  -8.3876   25.559  -1.1729   15.795   14.312   6.9520   13.047   6.0796 1.265598 9.235353 
1 1 1   21    7   54 o   13.240   5.9623   3.2064   13.539  -3.0380   26.666   5.3753   15.716   14.969   7.2302   14.210   6.4092 0.7593956 9.661989 
1 1 1   21    7   55 o   14.025   6.1281   6.9443   13.266   24.704   27.047   1.3183   15.223   18.303   8.3164   13.281   6.1111 5.022329 10.32025 
1 1 1   21    7   56 o   17.552   6.7215   18.783   13.444  -9.6892   26.270   28.885   15.648   14.195   6.9292   20.660   7.3671 -6.465038 10.11378 
1 1 1   21    7   57 o   11.822   5.5379  -3.4019   13.390   25.593   26.814 -13.0356   15.456   18.303   8.3020   11.145   5.4120 7.157320 9.910243 
1 1 1   21    7   58 o   17.937   6.7924   20.129   13.632 -17.1184   25.991   34.265   16.011   13.465   6.6367   22.410   7.4754 -8.944891 9.996355 
1 1 1   21    7   59 o   16.299   6.5430   15.300   13.261 -25.8061   25.989   29.771   15.420   12.792   6.3628   20.928   7.3267 -8.135944 9.703884 
1 1 1   21    7   60 o   11.937   5.5456  -1.6939   12.987   37.282   25.895 -14.7928   15.012   20.154   8.6847   10.724   5.2354 9.430482 10.14070 
1 1 1   21    7   61 o   15.009   6.3327   11.299   13.265   9.7227   25.166   11.905   15.609   15.868   7.4825   15.384   6.6856 0.4835911 10.03423 
1 1 1   21    7   62 o   11.917   5.7300  -8.3138   16.304   8.0248   25.733 -19.2708   21.073   15.655   7.4366   12.076   5.9566 3.579436 9.528068 
1 1 1   21    7   63 o   12.581   5.9770  -3.9901   16.637   19.947   25.962 -20.6675   21.671   17.120   7.9143   12.084   5.9753 5.036235 9.916696 
1 1 1   21    7   64 o   15.340   6.7830   11.586   16.702  -6.9305   25.859   24.838   21.877   14.119   6.8884   18.068   7.8826 -3.948526 10.46829 
1 1 1   21    7   65 o   19.274   8.5168   34.001   26.292   34.001   26.292   0.0000   0.0000   19.274   8.5168  ?   ?  0.000000 8.516797 
1 1 1   21    7   66 o   15.350   7.3313   5.2950   25.718   5.2950   25.718   0.0000   0.0000   15.350   7.3313  ?   ?  0.000000 7.331299 
1 1 1   21    8  -57 o   15.457   7.3639   7.5359   25.607   0.0000   0.0000   7.5359   25.607  ?   ?    15.457   7.3639 0.000000 7.363874 
1 1 1   21    8  -56 o   13.485   6.5912  -9.6409   23.999   0.0000   0.0000  -9.6409   23.999  ?   ?    13.485   6.5912 0.000000 6.591197 
1 1 1   21    8  -55 o   14.502   6.9531   0.9064   23.622   0.0000   0.0000   0.9064   23.622  ?   ?    14.502   6.9531 0.000000 6.953095 
1 1 1   21    8  -54 o   13.941   6.7821  -6.3967   24.580   0.0000   0.0000  -6.3967   24.580  ?   ?    13.941   6.7821 0.000000 6.782121 
1 1 1   21    8  -53 o   19.229   8.4850   33.416   26.006   0.0000   0.0000   33.416   26.006  ?   ?    19.229   8.4850 0.000000 8.485005 
1 1 1   21    8  -52 o   15.228   6.6487   11.348   15.589   0.0000   0.0000   11.348   15.589  ?   ?    15.228   6.6487 0.000000 6.648673 
1 1 1   21    8  -51 o   17.308   7.1307   19.323   16.240   0.0000   0.0000   19.323   16.240  ?   ?    17.308   7.1307 0.000000 7.130723 
1 1 1   21    8  -50 o   14.393   6.1406   9.2238   12.708  -1.4862   21.243   15.193   15.859   14.029   6.6900   16.253   6.8941 -2.224556 9.606503 
1 1 1   21    8  -49 o   10.423   5.0140  -9.7315   12.520 -10.2381   21.207  -9.4605   15.512   13.052   6.3381   11.580   5.5732 1.472261 8.439932 
1 1 1   21    8  -48 o   12.795   5.8253   1.8796   13.353  -4.6703   22.092   5.6496   16.761   13.862   6.6664   14.321   6.5223 -0.4589558 9.326379 
1 1 1   21    8  -47 o   12.026   5.5740  -1.5177   13.003  -0.7986   21.165  -1.9538   16.481   14.181   6.7387   12.989   6.1034 1.192368 9.091816 
1 1 1   21    8  -46 o   12.411   5.7172  -0.2849   13.378   22.803   22.412 -13.0654   16.675   18.031   7.9195   11.568   5.6182 6.463433 9.709921 
1 1 1   21    8  -45 o   12.667   5.7646   1.3797   13.058   11.283   21.509  -4.4010   16.433   16.030   7.3345   12.652   5.9904 3.378192 9.469877 
1 1 1   21    8  -44 o   12.698   5.7734   1.4391   13.062 -21.1952   21.671   14.354   16.369   12.245   6.0402   16.265   6.9548 -4.019447 9.211613 
1 1 1   21    8  -43 o   12.464   5.7225  -0.0674   13.246   22.863   22.887 -11.6178   16.244   18.172   7.9913   11.650   5.6309 6.521699 9.775845 
1 1 1   21    8  -42 o   14.178   6.1275   7.5943   12.966   8.7749   21.865   6.9540   16.103   15.783   7.2844   14.627   6.5514 1.156063 9.797126 
1 1 1   21    8  -41 o   12.093   5.5922  -1.6055   12.977   13.586   21.950  -9.7688   16.091   16.573   7.5150   11.859   5.6996 4.713851 9.431915 
1 1 1   21    8  -40 o   17.804   6.6894   18.969   13.163   8.7576   21.643   24.965   16.583   15.800   7.2762   19.326   7.4487 -3.526285 10.41275 
1 1 1   21    8  -39 f   13.988   6.3996   3.0730   16.374   0.0000   0.0000   3.0730   16.374  ?   ?    13.988   6.3996 0.000000 6.399584 
1 1 1   21    8  -38 o   12.028   5.7590  -8.8838   16.083   0.0000   0.0000  -8.8838   16.083  ?   ?    12.028   5.7590 0.000000 5.759032 
1 1 1   21    8  -37 o   24.818   6.8421   36.770   14.287   0.0000   0.0000   36.770   14.287  ?   ?    24.818   6.8421 0.000000 6.842149 
1 1 1   21    8  -36 o   17.492   6.3841   17.412   11.834   3.3125   22.433   22.849   13.930   15.285   7.1628   19.280   6.9419 -3.994805 9.974729 
1 1 1   21    8  -35 o   19.033   6.3778   20.909   11.653   41.363   21.724   12.646   13.807   23.207   8.6186   15.892   6.5638 7.314481 10.83341 
1 1 1   21    8  -34 o   24.107   6.0692   31.954   11.917   35.076   22.610   30.753   14.022   21.354   8.5534   22.520   6.9475 -1.165869 11.01943 
1 1 1   21    8  -33 o   12.622   5.6111   2.3570   11.583  -3.4486   21.907   4.6097   13.646   14.407   6.8486   13.790   6.1127 0.6166115 9.179769 
1 1 1   21    8  -32 o   18.638   6.3928   19.852   11.713   9.1540   22.310   23.923   13.762   16.259   7.4505   19.871   6.9240 -3.611704 10.17113 
1 1 1   21    8  -31 f   22.974   6.2158   29.413   11.920   44.457   23.010   23.894   13.936   23.878   8.8697   19.844   6.9639 4.034077 11.27688 
1 1 1   21    8  -30 o   16.210   6.2660   13.731   11.760   31.745   23.060   7.3993   13.672   20.652   8.5015   14.526   6.2851 6.126458 10.57246 
1 1 1   21    8  -29 o   19.810   6.7529   23.192   13.065   31.718   22.854   19.052   15.924   20.715   8.4883   18.004   7.1895 2.710512 11.12388 
1 1 1   21    8  -28 o   13.668   5.8584   5.9219   11.666   9.2297   17.501   3.2769   15.650   15.695   6.9415   14.098   6.3738 1.597271 9.423878 
1 1 1   21    8  -27 f   12.833   5.6449   3.1057   11.426   9.7220   16.995  -2.3513   15.434   15.749   6.9073   13.007   6.0438 2.741683 9.178100 
1 1 1   21    8  -26 o   22.441   6.3349   28.178   12.092   29.223   18.193   27.351   16.186   20.961   7.8665   20.768   7.4822 0.1934509 10.85655 
1 1 1   21    8  -25 o   24.243   7.1834   35.418   15.206   25.169   18.534   56.521   26.595   19.750   7.7982   26.191   9.5687 -6.440311 12.34389 
1 1 1   21    8  -24 o   15.577   6.3193   11.348   12.514   4.2446   17.796   18.296   17.600   14.878   6.7544   17.952   7.4121 -3.073619 10.02808 
1 1 1   21    8  -23 o   11.945   5.3615   0.2879   10.847   4.1819   13.995  -5.5701   17.166   13.954   6.1877   13.105   6.1797 0.8499298 8.745016 
1 1 1   21    8  -22 o   8.7244   4.2348 -12.1595   9.4402 -26.3831   13.952  -0.1480   12.821   9.3486   4.6521   12.626   5.7324 -3.277182 7.382575 
1 1 1   21    8  -21 o   11.628   5.1615   0.7587   9.7636   14.259   14.323 -10.9595   13.344   16.764   6.7752   10.917   5.2320 5.847435 8.560214 
1 1 1   21    8  -20 o   31.778   4.3690   47.511   11.018   35.301   18.519   54.201   13.708   23.163   8.0343   33.027   5.2687 -9.864101 9.607778 
1 1 1   21    8  -19 f   20.204   5.7330   21.482   9.8776   20.550   15.165   22.169   13.018   18.859   7.1588   19.718   6.7402 -0.8592091 9.832547 
1 1 1   21    8  -18 o   13.907   5.5689   7.7981   9.5818   10.570   14.444   5.6195   12.805   15.805   6.6349   14.096   6.0909 1.708827 9.006697 
1 1 1   21    8  -17 o   10.769   4.9035  -2.1537   9.4640   1.7109   14.490  -5.0290   12.498   13.691   6.1665   11.594   5.4046 2.096315 8.199743 
1 1 1   21    8  -16 o   30.220   4.7269   43.696   11.263   31.848   15.222   58.030   16.743   23.185   7.2525   32.916   6.4709 -9.731266 9.719661 
1 1 1   21    8  -15 o   12.229   5.2858   2.7238   9.6492  -3.7566   14.652   7.6865   12.822   12.717   5.9021   14.732   6.2216 -2.014916 8.575738 
1 1 1   21    8  -14 o   14.289   5.6475   8.5398   9.7292  -3.8019   14.499   18.648   13.122   12.669   5.8767   18.464   6.7250 -5.794995 8.930922 
1 1 1   21    8  -13 o   38.053   3.4065   64.168   10.455   54.665   15.405   72.284   14.236   32.528   6.0318   39.246   4.5332 -6.717823 7.545317 
1 1 1   21    8  -12 o   18.536   5.8312   17.893   9.8264   19.425   14.571   16.614   13.308   18.736   7.0381   17.755   6.7140 0.9804268 9.726903 
1 1 1   21    8  -11 o   16.841   5.8004   14.350   9.6455   12.501   14.338   15.878   13.037   16.513   6.7397   17.507   6.6394 -0.9944706 9.460732 
1 1 1   21    8  -10 o   19.071   5.7285   18.796   9.6190   13.972   14.326   22.755   12.980   16.978   6.8059   20.234   6.7302 -3.255037 9.571626 
1 1 1   21    8   -9 o   18.127   5.8355   16.965   9.7943   9.2575   14.695   23.126   13.138   15.696   6.6462   20.381   6.7708 -4.684390 9.487644 
1 1 1   21    8   -8 o   18.703   5.7913   18.069   9.7331  -0.3831   14.362   33.742   13.236   13.357   6.0655   25.047   6.4456 -11.68997 8.850782 
1 1 1   21    8   -7 o   16.524   6.0474   13.488   10.630   13.155   14.494   13.874   15.636   16.797   6.8057   17.146   7.0230 -0.3488655 9.779600 
1 1 1   21    8   -6 o   11.429   5.2730  -3.9827   11.442   5.7292   17.869 -10.7325   14.897   15.620   6.9552   11.780   5.6134 3.840234 8.937794 
1 1 1   21    8   -5 o   14.063   6.2589   2.6610   14.453 -11.6594   17.694   31.372   25.054   12.721   6.0771   21.639   8.8795 -8.918329 10.75993 
1 1 1   21    8   -4 o   11.683   5.2675  -1.1432   10.604   26.852   17.421 -17.6201   13.365   21.166   7.7427   10.163   4.9568 11.00283 9.193455 
1 1 1   21    8   -3 o   16.469   5.7970   13.410   9.6620   8.9101   14.186   17.304   13.196   15.549   6.5542   18.133   6.7203 -2.583311 9.387265 
1 1 1   21    8   -2 o   16.222   5.5800   12.922   8.9257   16.652   12.222   8.6580   13.066   17.889   6.4940   15.230   6.3460 2.659308 9.079843 
1 1 1   21    8   -1 o   25.074   4.6079   29.755   9.0714   36.375   12.263   21.756   13.481   26.757   5.7909   19.845   6.8563 6.912191 8.974566 
1 1 1   21    8    0 o   25.085   4.9497   30.387   9.7614   34.195   14.209   26.983   13.433   24.897   6.8072   22.038   6.8002 2.859016 9.621929 
1 1 1   21    8    1 o   17.451   5.7701   15.443   9.5445   11.096   13.708   19.534   13.297   16.093   6.5818   18.986   6.7889 -2.893501 9.455625 
1 1 1   21    8    2 o   10.859   4.9358  -2.3188   9.5376  -4.7924   13.743  -0.0206   13.247   12.295   5.7095   13.061   5.8882 -0.7659454 8.201796 
1 1 1   21    8    3 o   21.058   5.5326   22.469   9.6185   20.801   13.965   23.975   13.267   19.414   6.9555   20.783   6.7995 -1.368740 9.726871 
1 1 1   21    8    4 o   10.293   4.7545  -4.2155   9.3417  -1.5976   13.584  -6.5647   12.868   12.848   5.8594   11.592   5.4297 1.256023 7.988388 
1 1 1   21    8    5 o   13.540   5.4959   6.5149   9.4717   0.7155   13.538   12.075   13.256   13.322   5.9839   16.311   6.5439 -2.989207 8.867346 
1 1 1   21    8    6 o   14.203   5.6020   8.1994   9.5553   7.4668   13.678   8.8978   13.354   15.021   6.3883   15.347   6.4068 -0.3260593 9.047485 
1 1 1   21    8    7 o   22.003   5.4485   24.381   9.7203   19.186   13.942   29.295   13.559   18.780   6.9171   22.955   6.7787 -4.175287 9.684844 
1 1 1   21    8    8 o   14.922   5.6810   9.9984   9.5674   17.324   13.717   3.0574   13.351   18.097   6.8222   13.776   6.0792 4.320812 9.137752 
1 1 1   21    8    9 o   25.125   4.9532   30.594   9.7837   28.898   13.974   32.225   13.703   22.608   6.9284   24.150   6.7171 -1.541517 9.649965 
1 1 1   21    8   10 o   24.473   6.2224   31.804   12.439   37.180   14.212   14.198   25.720   26.069   6.6633   18.264   8.2219 7.805338 10.58293 
1 1 1   21    8   11 o   11.639   5.2778  -1.5840   10.828   4.7462   13.803 -11.7103   17.458   14.288   6.2467   12.572   6.0142 1.715916 8.671356 
1 1 1   21    8   12 o   12.617   5.5430   2.0473   10.987   0.5766   13.756   4.6378   18.257   13.295   5.9964   15.389   6.9275 -2.094651 9.162304 
1 1 1   21    8   13 o   23.705   5.2372   27.959   9.8498   0.2860   13.838   56.377   14.023   13.244   5.9901   33.907   5.2426 -20.66307 7.960304 
1 1 1   21    8   14 o   26.383   4.8305   33.586   10.006   30.449   14.375   36.535   13.936   22.980   7.0242   25.794   6.6013 -2.813692 9.639340 
1 1 1   21    8   15 o   17.233   5.7665   15.294   9.5264   17.680   13.998   13.236   13.001   18.057   6.8724   16.491   6.5251 1.566187 9.476630 
1 1 1   21    8   16 o   21.433   5.1908   23.017   8.9717   8.0777   13.848   33.824   11.778   15.059   6.4168   25.574   5.7855 -10.51508 8.639922 
1 1 1   21    8   17 o   20.428   5.6893   21.782   9.8230   10.062   14.232   32.445   13.575   15.652   6.5793   24.050   6.6845 -8.397458 9.379199 
1 1 1   21    8   18 o   33.068   3.8712   49.881   10.238   64.293   15.205   37.930   13.846   35.981   5.3465   26.307   6.4963 9.674835 8.413465 
1 1 1   21    8   19 f   12.870   5.3912   5.0458   9.5049   5.3387   13.857   4.7855   13.062   14.286   6.2522   13.928   6.0833 0.3587437 8.723335 
1 1 1   21    8   20 o   14.360   5.6239   9.0652   9.5715   4.9523   13.370   13.389   13.708   14.035   6.1418   16.473   6.6386 -2.437765 9.043938 
1 1 1   21    8   21 o   17.375   5.8093   15.881   9.6687  -2.3541   13.740   33.770   13.609   12.535   5.7813   24.456   6.6518 -11.92134 8.813038 
1 1 1   21    8   22 o   21.062   5.6401   23.293   9.8762   2.2702   14.276   42.589   13.677   13.629   6.1312   28.246   6.1176 -14.61728 8.661254 
1 1 1   21    8   23 o   12.196   5.2507   3.2381   9.4488   12.598   13.978  -4.6376   12.822   16.169   6.6334   11.713   5.4647 4.455547 8.594414 
1 1 1   21    8   24 o   20.079   5.7020   21.408   9.7674   18.799   14.331   23.670   13.347   18.133   6.9409   20.088   6.8258 -1.955555 9.734857 
1 1 1   21    8   25 o   19.721   5.7816   20.833   9.8940   23.274   14.759   18.841   13.334   19.633   7.1349   18.185   6.7525 1.447365 9.823586 
1 1 1   21    8   26 o   19.106   5.7576   19.563   9.7054   15.944   14.405   22.571   13.134   17.147   6.8410   19.632   6.7682 -2.485104 9.623336 
1 1 1   21    8   27 f   14.194   5.9306   7.7922   11.459  -0.8183   23.235   10.559   13.172   15.133   7.1524   15.363   6.3840 -0.2296400 9.587090 
1 1 1   21    8   28 o   23.247   6.1412   29.733   11.809   35.342   23.458   27.829   13.667   21.526   8.6809   21.593   6.8876 -0.6682777E-01 11.08140 
1 1 1   21    8   29 o   30.010   5.1232   45.041   12.083   66.288   24.458   38.180   13.898   29.891   9.1672   25.954   6.5655 3.937330 11.27576 
1 1 1   21    8   30 o   24.894   5.9699   33.475   11.958   65.818   23.887   22.660   13.813   30.053   9.0274   19.414   6.9218 10.63829 11.37570 
1 1 1   21    8   31 f   13.212   5.7237   4.7506   11.367   17.804   22.531   0.2938   13.165   17.772   7.8671   12.714   5.7867 5.057490 9.766163 
1 1 1   21    8   32 o   11.733   5.4814  -4.2839   12.972 -12.1585   22.100  -0.1445   16.023   13.478   6.5275   13.492   6.2303 -0.1408195E-01 9.023546 
1 1 1   21    8   33 o   14.523   6.1909   8.1708   12.898  -7.9861   21.291   17.538   16.212   13.723   6.5855   17.468   7.1526 -3.744737 9.722528 
1 1 1   21    8   34 o   12.387   5.6887  -0.9957   13.102   20.062   22.500 -11.8001   16.117   18.088   7.9400   11.734   5.6559 6.354045 9.748479 
1 1 1   21    8   35 o   13.503   6.2663  -0.5045   16.512   0.0000   0.0000  -0.5045   16.512  ?   ?    13.503   6.2663 0.000000 6.266343 
1 1 1   21    8   36 o   21.785   6.4577   27.562   12.286  -4.8994   27.153   35.920   13.777   15.098   7.2932   24.789   6.6720 -9.691064 9.884632 
1 1 1   21    8   37 o   11.461   5.3124  -2.9063   11.815 -65.7921   26.668   12.451   13.179   10.953   5.5686   15.712   6.4429 -4.758915 8.515924 
1 1 1   21    8   38 o   14.868   6.1319   10.265   12.027   8.5595   26.952   10.689   13.439   16.423   7.7443   15.190   6.3896 1.233736 10.03997 
1 1 1   21    8   39 f   9.8785   4.7631 -10.8453   11.452   11.683   26.524 -16.0066   12.696   16.720   7.8199   9.7534   4.7729 6.966357 9.161410 
1 1 1   21    8   40 o   13.585   5.8694   6.1930   11.888   9.1454   26.684   5.4618   13.279   16.372   7.7158   13.735   6.0617 2.637518 9.812102 
1 1 1   21    8   41 o   10.775   5.1967 -11.1807   13.650 -24.6586   26.475  -6.3013   15.930   13.149   6.5204   12.287   5.8409 0.8619757 8.753895 
1 1 1   21    8   42 o   15.518   6.5333   11.931   14.070   8.1732   27.167   13.308   16.447   16.248   7.6956   16.081   6.9254 0.1668148 10.35291 
1 1 1   21    8   43 o   13.969   6.1988   5.8822   14.073   24.705   27.035  -1.1144   16.483   18.368   8.3336   13.216   6.1758 5.152309 10.37249 
1 1 1   21    8   44 o   11.646   5.5060  -5.5325   13.792   8.0883   27.241 -10.2273   15.993   16.163   7.6700   11.726   5.6475 4.437032 9.524869 
1 1 1   21    8   45 o   13.160   5.9878   2.3423   14.081  -6.3597   27.005   5.5916   16.502   14.634   7.1170   14.353   6.5114 0.2811708 9.646288 
1 1 1   21    8   46 o   16.297   7.1077   14.432   17.775   11.118   27.673   16.759   23.193   16.458   7.7868   16.976   7.7086 -0.5179634 10.95707 
1 1 1   21    8   47 o   14.855   6.4150   9.8977   14.189   25.255   27.600   4.3811   16.542   18.198   8.3193   14.075   6.4368 4.122639 10.51869 
1 1 1   21    8   48 o   19.517   7.0463   24.993   14.364   12.651   27.208   29.763   16.913   16.497   7.7795   20.440   7.6019 -3.942972 10.87707 
1 1 1   21    8   49 o   13.350   6.0284   3.8461   13.950   9.4712   27.684   1.9318   16.150   16.128   7.6761   13.502   6.2420 2.626037 9.893703 
1 1 1   21    8   50 o   17.714   6.8556   19.908   14.090   4.8563   27.131   25.467   16.489   15.555   7.4565   19.101   7.4097 -3.545921 10.51201 
1 1 1   21    8   51 o   11.766   5.5444  -4.0930   13.772   5.1477   27.482  -7.1918   15.915   15.586   7.4801   11.987   5.7366 3.599291 9.426599 
1 1 1   21    8   52 o   14.672   6.3154   9.9680   13.664 -29.1658   27.173   23.214   15.809   12.719   6.3547   18.436   7.2255 -5.717176 9.622366 
1 1 1   21    8   53 o   11.136   5.2963  -6.3156   13.135 -17.1875   27.403  -3.0728   14.966   13.546   6.7020   12.263   5.7789 1.282765 8.849501 
1 1 1   21    8   54 o   12.041   5.5728  -0.6641   12.927   26.462   26.683  -8.9836   14.777   18.000   8.2102   11.311   5.4427 6.689442 9.850414 
1 1 1   21    8   55 o   9.8856   4.8422 -15.1754   13.161 -30.6656   26.417 -10.0614   15.179   12.385   6.1993   11.280   5.4500 1.104285 8.254330 
1 1 1   21    8   56 o   12.076   5.6265  -1.2907   13.518   44.008   26.923 -16.5611   15.632   20.779   8.9031   10.662   5.2335 10.11782 10.32742 
1 1 1   21    8   57 o   15.709   6.4722   14.117   13.381 -27.5559   27.349   27.231   15.342   12.756   6.3735   19.703   7.2562 -6.946669 9.657854 
1 1 1   21    8   58 o   13.879   6.4287   3.8362   17.257   31.368   27.380 -14.3086   22.228   18.579   8.4121   12.714   6.2411 5.864703 10.47451 
1 1 1   21    8   59 o   15.206   7.3303   3.5368   27.088   3.5368   27.088   0.0000   0.0000   15.206   7.3303  ?   ?  0.000000 7.330335 
1 1 1   21    9  -49 o   20.537   8.4593   38.555   22.851   0.0000   0.0000   38.555   22.851  ?   ?    20.537   8.4593 0.000000 8.459281 
1 1 1   21    9  -48 o   11.745   5.6695  -8.8910   16.339   0.0000   0.0000  -8.8910   16.339  ?   ?    11.745   5.6695 0.000000 5.669533 
1 1 1   21    9  -47 o   12.370   5.8950  -4.3595   16.435   0.0000   0.0000  -4.3595   16.435  ?   ?    12.370   5.8950 0.000000 5.895013 
1 1 1   21    9  -46 f   12.297   5.6730   0.5337   13.242   1.2589   21.921   0.1170   16.615   14.214   6.7833   13.087   6.1426 1.127409 9.151251 
1 1 1   21    9  -45 o   11.349   5.3614  -4.4065   13.025 -13.9588   21.345   1.2609   16.441   12.522   6.1403   13.259   6.1865 -0.7368317 8.716462 
1 1 1   21    9  -44 o   13.880   6.3898   4.5050   16.671   0.0000   0.0000   4.5050   16.671  ?   ?    13.880   6.3898 0.000000 6.389782 
1 1 1   21    9  -43 o   12.708   6.0274  -3.1130   16.777   0.0000   0.0000  -3.1130   16.777  ?   ?    12.708   6.0274 0.000000 6.027399 
1 1 1   21    9  -42 o   13.655   6.6027  -5.5031   22.393   0.0000   0.0000  -5.5031   22.393  ?   ?    13.655   6.6027 0.000000 6.602651 
1 1 1   21    9  -41 o   17.186   7.1279   19.249   16.376   49.785   23.136 -11.4092   23.182   23.680   8.8743   13.252   6.4776 10.42732 10.98693 
1 1 1   21    9  -40 o   12.031   5.7314  -5.7587   15.508   6.4246   21.629 -18.6466   22.246   15.038   7.0424   12.420   6.1253 2.617425 9.333557 
1 1 1   21    9  -39 o   18.240   7.3131   22.913   16.544   18.960   22.868   27.255   23.963   17.053   7.7078   18.444   8.1415 -1.391504 11.21131 
1 1 1   21    9  -38 o   9.1557   4.6025 -32.6363   15.334   6.4196   21.758 -71.1715   21.613   15.099   7.0685   9.1779   4.6957 5.920748 8.486032 
1 1 1   21    9  -37 o   12.345   5.7041  -0.3138   13.463   14.352   22.078  -8.9957   16.986   16.338   7.4582   12.074   5.8165 4.264024 9.458142 
1 1 1   21    9  -36 o   17.653   6.8275   19.654   13.968   40.956   22.961   7.1378   17.600   21.689   8.6423   14.695   6.6891 6.994481 10.92863 
1 1 1   21    9  -35 o   12.999   5.9088   2.4713   13.670  -2.1268   22.234   5.2654   17.333   14.168   6.7803   14.343   6.5705 -0.1753149 9.441592 
1 1 1   21    9  -34 o   10.971   5.2754  -9.6721   13.825 -14.6843   22.380  -6.5794   17.580   12.913   6.3229   12.607   6.0324 0.3057919 8.738933 
1 1 1   21    9  -33 o   10.143   4.9554 -15.0876   13.517   1.9044   22.801 -24.2957   16.785   14.791   7.0185   10.431   5.1759 4.359653 8.720628 
1 1 1   21    9  -32 o   11.872   5.5483  -2.9700   13.308  -9.4140   22.164   0.6632   16.642   13.415   6.5065   13.465   6.2632 -0.4974747E-01 9.031135 
1 1 1   21    9  -31 o   10.648   5.0713  -7.4822   12.124   10.759   22.297 -15.1400   14.447   15.990   7.3714   10.529   5.1392 5.461381 8.985999 
1 1 1   21    9  -30 o   20.327   7.2491   27.453   15.151   98.435   24.586 -16.0045   19.238   38.852   8.0289   12.045   5.8905 26.80686 9.957928 
1 1 1   21    9  -29 o   19.230   7.1325   24.124   14.869   29.064   23.282   20.720   19.324   19.271   8.2684   17.772   7.5767 1.498880 11.21482 
1 1 1   21    9  -28 o   20.452   7.1835   27.425   14.831   39.321   23.085   19.063   19.354   21.624   8.6492   17.415   7.5063 4.208996 11.45220 
1 1 1   21    9  -27 o   13.712   5.9402   6.5707   12.243   16.123   23.180   2.8750   14.418   16.965   7.7047   13.381   6.0768 3.584088 9.812763 
1 1 1   21    9  -26 o   11.555   5.3435  -2.0979   11.847 -16.3794   21.515   4.1170   14.193   12.658   6.1984   13.600   6.1163 -0.9420776 8.708019 
1 1 1   21    9  -25 o   15.482   6.2549   12.386   12.203   27.992   22.766   6.0962   14.454   19.219   8.2096   14.112   6.2712 5.106811 10.33079 
1 1 1   21    9  -24 o   13.395   5.8404   5.4589   11.995   15.056   23.592   2.1135   13.929   16.909   7.7153   13.138   5.9688 3.771051 9.754644 
1 1 1   21    9  -23 o   18.469   6.4544   20.180   11.963   5.8948   22.849   25.575   14.042   15.530   7.2618   20.117   6.9950 -4.586365 10.08285 
1 1 1   21    9  -22 o   20.997   6.4719   26.033   12.172   27.717   23.309   25.402   14.272   19.233   8.2631   20.014   7.0454 -0.7808914 10.85898 
1 1 1   21    9  -21 o   31.106   5.1425   49.120   12.584   77.395   25.107   39.633   14.543   32.112   9.1496   25.801   6.8147 6.310818 11.40851 
1 1 1   21    9  -20 o   12.197   5.4896   1.1792   11.459   0.9334   22.662   1.2636   13.282   14.921   7.0557   12.825   5.8274 2.096572 9.151030 
1 1 1   21    9  -19 o   13.876   5.9004   7.2120   11.667   2.6264   22.851   8.8288   13.568   15.191   7.1534   14.709   6.3116 0.4828386 9.539757 
1 1 1   21    9  -18 o   12.939   5.6698   4.0728   11.428   11.519   22.991   1.6296   13.170   16.490   7.5591   12.891   5.8358 3.598982 9.549630 
1 1 1   21    9  -17 o   10.540   4.9999  -7.2497   11.554   8.7853   22.485 -13.0029   13.468   16.046   7.3991   10.510   5.0913 5.536364 8.981555 
1 1 1   21    9  -16 o   17.586   5.8767   17.013   9.8945   0.7077   14.489   31.262   13.544   13.123   6.0101   22.852   6.7819 -9.728405 9.061748 
1 1 1   21    9  -15 o   11.187   5.0585  -0.4804   9.8614   8.6036   14.319  -8.6756   13.601   14.840   6.4265   11.197   5.3433 3.642822 8.357643 
1 1 1   21    9  -14 o   10.705   5.0598  -6.6068   11.633 -17.6228   17.781   1.6358   15.381   11.595   5.6688   13.569   6.2059 -1.973712 8.405272 
1 1 1   21    9  -13 o   25.729   5.1018   33.522   10.322   19.501   14.476   48.021   14.721   18.044   6.9581   29.426   6.3256 -11.38234 9.403635 
1 1 1   21    9  -12 o   24.005   5.8157   31.060   11.259   22.227   18.516   36.241   14.182   18.584   7.6306   24.748   6.8144 -6.164156 10.23045 
1 1 1   21    9  -11 o   11.963   5.3516   1.1206   10.709   11.503   17.568  -5.0185   13.509   16.022   7.0250   11.772   5.5297 4.250046 8.940265 
1 1 1   21    9  -10 o   10.071   4.7899  -7.8749   10.745  -3.7844   17.577 -10.3155   13.578   13.287   6.2619   10.963   5.2602 2.324443 8.178055 
1 1 1   21    9   -9 o   10.540   4.8592  -2.9219   9.6923  -5.7949   13.821  -0.1415   13.596   11.766   5.5474   12.720   5.8241 -0.9539680 8.043261 
1 1 1   21    9   -8 o   12.002   5.2688   2.3893   9.9093   3.3628   14.328   1.4967   13.720   13.670   6.1468   13.100   5.9405 0.5706358 8.548262 
1 1 1   21    9   -7 o   13.716   5.6435   7.5588   10.155   19.151   14.729  -2.9462   14.021   17.960   6.9930   12.336   5.7417 5.623838 9.048167 
1 1 1   21    9   -6 o   17.219   5.9361   16.178   10.103   20.525   14.460   12.032   14.122   18.445   6.9930   15.779   6.5877 2.665781 9.607326 
1 1 1   21    9   -5 o   28.314   4.7652   39.386   10.608   26.519   14.959   52.403   15.045   20.507   7.2134   31.058   6.1604 -10.55165 9.485991 
1 1 1   21    9   -4 o   12.466   5.3853   3.8296   10.006  -3.9142   14.139   11.598   14.161   12.210   5.7104   15.666   6.5726 -3.455532 8.706754 
1 1 1   21    9   -3 o   13.231   5.5570   6.1197   10.140   5.4710   14.670   6.7132   14.030   14.228   6.3205   14.372   6.2905 -0.1447163 8.917308 
1 1 1   21    9   -2 o   15.315   5.8474   11.791   10.155   4.8795   14.287   18.846   14.435   14.004   6.2284   17.890   6.9349 -3.885527 9.321228 
1 1 1   21    9   -1 o   13.407   5.7717   5.5103   11.417  -8.9621   14.467   29.406   18.589   11.526   5.5032   20.644   7.9042 -9.117759 9.631287 
1 1 1   21    9    0 o   26.705   5.5284   37.131   11.638   24.766   15.016   55.729   18.416   19.861   7.2000   30.049   7.5336 -10.18755 10.42086 
1 1 1   21    9    1 o   15.292   6.2902   10.981   12.612   0.3931   17.789   21.683   17.884   14.012   6.5031   18.541   7.5424 -4.529316 9.958803 
1 1 1   21    9    2 o   11.333   5.2277  -2.5994   11.237   15.716   14.724 -28.1527   17.391   16.901   6.8552   10.485   5.2138 6.415321 8.612622 
1 1 1   21    9    3 o   9.1703   4.3602  -7.3474   8.8879 -13.5003   11.452   1.9722   14.094   9.5488   4.6417   13.319   6.0326 -3.770640 7.611722 
1 1 1   21    9    4 o   18.247   6.1998   18.747   11.011   25.268   13.723   6.9562   18.452   20.364   6.9211   15.279   6.9132 5.084105 9.782316 
1 1 1   21    9    5 o   26.323   5.4310   35.847   11.267   32.901   14.090   41.072   18.762   23.407   6.9095   24.377   8.0910 -0.9697437 10.63980 
1 1 1   21    9    6 o   11.955   5.4815  -1.3030   12.099  -4.7997   13.438   13.670   27.807   11.797   5.5331   17.336   8.0744 -5.538672 9.788311 
1 1 1   21    9    7 o   15.950   5.9874   13.329   10.541   10.803   13.654   17.055   16.582   15.371   6.4516   17.311   7.1755 -1.940160 9.649438 
1 1 1   21    9    8 o   12.774   5.5043   4.4269   10.401   6.8666   13.527   0.8979   16.269   14.289   6.2166   13.703   6.3098 0.5855284 8.857742 
1 1 1   21    9    9 o   12.889   5.5244   4.8498   10.372   0.2995   13.437   11.560   16.316   12.758   5.8218   15.902   6.8733 -3.144447 9.007475 
1 1 1   21    9   10 o   10.375   4.8570  -5.0139   10.272   1.9680   13.270 -15.4516   16.226   13.055   5.8888   11.316   5.5061 1.739325 8.061991 
1 1 1   21    9   11 o   16.716   6.0515   15.206   10.603   7.3396   13.733   26.816   16.684   14.437   6.2726   20.166   7.5404 -5.728783 9.808351 
1 1 1   21    9   12 o   23.392   5.7705   29.442   10.934   40.191   14.250   14.055   17.049   26.422   6.6283   16.539   7.0857 9.883064 9.702611 
1 1 1   21    9   13 o   14.617   5.8513   9.9463   10.574  -2.3534   13.685   28.168   16.657   12.303   5.7078   20.593   7.5647 -8.289621 9.476468 
1 1 1   21    9   14 o   7.5378   3.7792 -23.8518   10.007 -25.8663   12.894 -20.8015   15.866   8.8189   4.4018   10.580   5.2089 -1.760630 6.819704 
1 1 1   21    9   15 o   16.344   6.0153   14.387   10.541   4.3161   13.553   29.803   16.768   13.636   6.0655   21.090   7.6135 -7.453328 9.734202 
1 1 1   21    9   16 o   10.252   4.8304  -5.9810   10.449   1.7274   13.603 -17.0739   16.319   13.067   5.9215   11.136   5.4412 1.931195 8.041816 
1 1 1   21    9   17 o   13.215   5.6517   5.6434   10.813  -6.2740   14.009   23.204   17.005   11.715   5.5421   18.897   7.4671 -7.181582 9.299033 
1 1 1   21    9   18 o   17.096   6.1070   16.280   10.757   25.809   14.169   3.3117   16.529   20.302   7.0284   14.119   6.4484 6.182219 9.538359 
1 1 1   21    9   19 o   12.884   5.5481   4.8586   10.554   3.1088   13.672   7.4395   16.604   13.350   6.0033   14.922   6.6704 -1.572640 8.974111 
1 1 1   21    9   20 o   11.512   5.2120  -0.1407   10.508 -11.8735   13.633   17.028   16.492   10.708   5.1717   17.126   7.1322 -6.417749 8.809892 
1 1 1   21    9   21 o   13.271   5.7958   4.9806   11.853  -4.4157   16.873   14.135   16.655   12.887   6.0922   16.379   7.0097 -3.491091 9.287161 
1 1 1   21    9   22 o   14.281   6.0087   8.5572   11.889   1.4346   16.840   15.635   16.787   13.793   6.3756   16.729   7.0944 -2.936031 9.538266 
1 1 1   21    9   23 o   20.153   6.4515   24.060   11.983   19.494   16.698   28.910   17.207   17.706   7.2556   20.437   7.6544 -2.730558 10.54674 
1 1 1   21    9   24 o   12.066   5.4841   0.3202   11.774   5.7637   16.593  -5.1994   16.708   14.490   6.5558   12.680   6.0144 1.809240 8.896680 
1 1 1   21    9   25 o   23.200   6.4749   31.593   12.709   22.246   17.975   40.937   17.971   18.308   7.5178   24.197   7.9134 -5.889231 10.91513 
1 1 1   21    9   26 o   16.262   6.7586   14.535   14.767   47.562   28.972   2.9447   17.163   21.975   9.3194   14.053   6.4744 7.921698 11.34768 
1 1 1   21    9   27 o   15.234   6.5609   10.741   14.764   18.724   28.043   7.6806   17.365   17.496   8.1354   14.934   6.7364 2.562033 10.56242 
1 1 1   21    9   28 o   22.636   7.3211   33.685   15.405 -12.6192   28.912   52.041   18.204   14.426   7.0888   28.108   7.7130 -13.68149 10.47573 
1 1 1   21    9   29 o   20.819   7.3588   29.122   15.582   87.134   30.130   7.9421   18.206   30.511   10.256   15.089   6.8430 15.42149 12.32920 
1 1 1   21    9   30 o   36.786   5.5459   71.265   16.113   46.056   29.596   81.886   19.210   21.413   9.2561   38.087   6.4154 -16.67376 11.26197 
1 1 1   21    9   31 o   19.409   7.2594   25.176   15.466 -10.5386   29.095   39.242   18.259   14.564   7.1474   23.258   7.9816 -8.693555 10.71404 
1 1 1   21    9   32 o   16.907   6.9471   17.196   15.363 -51.7737   28.758   44.738   18.173   11.925   6.0321   25.223   7.9294 -13.29792 9.963003 
1 1 1   21    9   33 o   12.239   5.7463  -3.1748   14.558 -37.6973   27.762   9.9203   17.098   12.442   6.2461   15.238   6.7931 -2.795959 9.228255 
1 1 1   21    9   34 o   13.985   6.4992   2.4272   17.859   0.0000   0.0000   2.4272   17.859  ?   ?    13.985   6.4992 0.000000 6.499162 
1 1 1   21    9   35 o   12.508   6.0303  -8.8711   18.340  -2.7710   28.444 -13.2119   23.994   15.020   7.3046   13.372   6.5476 1.648040 9.809626 
1 1 1   21    9   36 o   13.902   6.5253   1.0532   18.749   20.097   28.932 -12.7339   24.617   17.374   8.1393   13.509   6.6181 3.865513 10.49031 
1 1 1   21    9   37 o   17.398   8.1554   20.696   29.123   20.696   29.123   0.0000   0.0000   17.398   8.1554  ?   ?  0.000000 8.155421 
1 1 1   21    9   38 o   21.559   9.2569   49.236   29.220   49.236   29.220   0.0000   0.0000   21.559   9.2569  ?   ?  0.000000 9.256891 
1 1 1   21    9   39 o   13.963   6.8757 -12.8280   27.675 -12.8280   27.675   0.0000   0.0000   13.963   6.8757  ?   ?  0.000000 6.875730 
1 1 1   21    9   40 o   13.724   6.7821 -15.9067   27.765 -15.9067   27.765   0.0000   0.0000   13.724   6.7821  ?   ?  0.000000 6.782104 
1 1 1   21    9   41 o   20.321   7.9153   32.067   18.876   56.250   28.110   12.208   25.473   23.120   9.4368   16.121   7.5790 6.999317 12.10350 
1 1 1   21    9   42 o   12.201   5.9073  -9.8390   18.065 -39.9708   27.245   13.803   24.133   12.045   6.0653   16.205   7.5391 -4.160111 9.676033 
1 1 1   21    9   43 o   14.381   6.6415   5.7817   18.218  -4.0562   27.730   13.252   24.164   14.569   7.1133   16.083   7.5028 -1.513658 10.33885 
1 1 1   21    9   44 o   11.380   5.5818 -16.0147   17.676 -43.2900   26.920   4.6584   23.437   11.756   5.9334   14.894   7.0811 -3.137498 9.238351 
1 1 1   21    9   45 o   17.290   7.3551   20.762   18.140 -12.6555   27.046   48.089   24.458   13.711   6.7602   22.345   8.9142 -8.633968 11.18764 
1 1 1   21    9   46 f   16.333   7.1721   16.708   18.374   35.534   28.130   2.6980   24.266   18.974   8.5649   14.691   7.0445 4.283488 11.08976 
1 1 1   21    9   47 o   10.209   5.0948 -26.9440   17.249 -37.0536   26.299 -19.3122   22.850   11.911   5.9929   12.360   6.1160 -0.4482841 8.562730 
1 1 1   21    9   48 o   18.063   7.4469   23.947   17.729   29.448   27.165   19.867   23.399   18.160   8.2834   16.884   7.6963 1.275822 11.30698 
1 1 1   21    9   49 o   9.5104   4.7940 -36.4922   17.265 -34.3443   27.304 -37.9232   22.287   12.274   6.1661   10.923   5.4984 1.351062 8.261577 
1 1 1   21    9   50 o   12.992   6.1569  -1.7703   17.440   39.239   27.267 -30.1602   22.687   19.694   8.6891   11.528   5.7668 8.165587 10.42864 
1 1 1   21    9   51 o   11.598   5.7960 -29.3611   22.669   0.0000   0.0000 -29.3611   22.669  ?   ?    11.598   5.7960 0.000000 5.796035 
1 1 1   21   10  -41 o   13.964   6.8317  -6.5848   25.966   0.0000   0.0000  -6.5848   25.966  ?   ?    13.964   6.8317 0.000000 6.831667 
1 1 1   21   10  -40 o   16.285   7.4767   16.600   22.615   0.0000   0.0000   16.600   22.615  ?   ?    16.285   7.4767 0.000000 7.476740 
1 1 1   21   10  -39 f   13.168   6.4173  -8.1565   22.281   0.0000   0.0000  -8.1565   22.281  ?   ?    13.168   6.4173 0.000000 6.417350 
1 1 1   21   10  -38 o   11.865   5.7198  -7.8686   16.491   29.262   24.595 -38.1934   22.227   18.204   8.1291   10.845   5.4634 7.358462 9.794397 
1 1 1   21   10  -37 f   10.658   5.1460  -9.6139   13.478 -11.9346   22.298  -8.2780   16.919   12.814   6.2819   11.934   5.7630 0.8793993 8.524900 
1 1 1   21   10  -36 o   15.325   6.5001   13.271   14.098  -0.1363   22.596   21.816   18.039   14.054   6.7546   17.366   7.3589 -3.312131 9.988894 
1 1 1   21   10  -35 o   18.085   7.4880   24.738   18.030   13.830   22.905   42.503   29.232   15.840   7.3609   19.639   8.8092 -3.798643 11.47976 
1 1 1   21   10  -34 o   18.471   7.4884   25.811   17.559   6.8220   22.520   55.255   28.043   14.884   7.0367   22.224   9.2813 -7.340113 11.64723 
1 1 1   21   10  -33 o   11.744   5.6844  -9.4856   16.699 -25.6319   21.287   16.345   26.925   11.466   5.7122   16.358   7.7217 -4.892220 9.604844 
1 1 1   21   10  -32 o   12.978   5.9203   3.2177   13.882 -11.7457   22.005   13.108   17.890   12.818   6.2748   15.542   6.9373 -2.724534 9.354082 
1 1 1   21   10  -31 o   11.546   5.4636  -4.3241   13.636   4.5274   22.403  -9.5334   17.187   14.663   6.9576   11.905   5.7632 2.758682 9.034554 
1 1 1   21   10  -30 o   13.678   6.1319   6.1463   14.140 -17.7911   22.303   22.234   18.284   12.375   6.1088   17.584   7.4278 -5.208191 9.617186 
1 1 1   21   10  -29 o   28.974   6.5293   50.075   15.051   22.507   23.832   68.365   19.411   17.347   7.8518   32.307   7.5133 -14.96063 10.86740 
1 1 1   21   10  -28 f   16.178   6.7100   15.799   14.512   55.044   24.208  -6.2161   18.132   24.280   9.0821   12.602   6.0553 11.67721 10.91559 
1 1 1   21   10  -27 o   14.248   6.2681   8.4293   14.092   2.7694   22.764   11.946   17.944   14.593   6.9497   15.439   6.9154 -0.8457689 9.804115 
1 1 1   21   10  -26 o   17.360   6.8572   19.533   14.336  -1.6073   22.888   33.181   18.391   14.123   6.7904   20.668   7.8746 -6.544978 10.39802 
1 1 1   21   10  -25 o   12.935   5.9233   2.3073   14.069   4.6175   23.612   1.0359   17.518   14.951   7.1082   13.506   6.3290 1.445392 9.517475 
1 1 1   21   10  -24 o   12.476   5.6419   2.4106   12.270   10.636   22.931  -0.8892   14.525   15.673   7.3107   12.473   5.8182 3.199770 9.343348 
1 1 1   21   10  -23 o   11.549   5.3873  -2.4067   12.453  -8.2455   23.539  -0.1372   14.676   13.586   6.6157   12.654   5.8844 0.9318676 8.854019 
1 1 1   21   10  -22 o   19.880   6.7089   25.255   12.893   32.582   24.049   22.300   15.273   19.315   8.3463   18.167   7.1073 1.147877 10.96243 
1 1 1   21   10  -21 o   10.921   5.1663  -5.3819   12.177 -16.2368   23.101  -1.2056   14.329   12.795   6.2967   12.384   5.7776 0.4101486 8.545713 
1 1 1   21   10  -20 o   22.265   6.5280   30.330   12.613   30.715   23.837   30.181   14.864   19.029   8.2659   21.090   7.2026 -2.060873 10.96370 
1 1 1   21   10  -19 o   13.933   6.0254   7.8726   12.553 -32.3400   23.365   24.188   14.883   11.660   5.8355   18.919   7.1118 -7.259303 9.199500 
1 1 1   21   10  -18 o   10.828   5.2503 -11.9103   14.412   0.0000   0.0000 -11.9103   14.412  ?   ?    10.828   5.2503 0.000000 5.250289 
1 1 1   21   10  -17 o   15.067   6.5142   11.012   14.664   0.0000   0.0000   11.012   14.664  ?   ?    15.067   6.5142 0.000000 6.514228 
1 1 1   21   10  -16 o   16.259   6.8198   15.429   15.240   0.0000   0.0000   15.429   15.240  ?   ?    16.259   6.8198 0.000000 6.819764 
1 1 1   21   10  -15 o   14.501   6.1650   9.6730   12.732   15.706   24.279   7.3849   14.953   16.633   7.6766   14.283   6.3610 2.349946 9.969577 
1 1 1   21   10  -14 o   17.064   6.5956   17.721   13.029   1.0559   24.291   24.453   15.438   14.790   7.0806   18.972   7.2180 -4.181247 10.11107 
1 1 1   21   10  -13 o   11.643   5.5054  -4.9338   13.795   1.5350   24.354  -7.9897   16.739   14.862   7.1083   12.137   5.8280 2.725577 9.192031 
1 1 1   21   10  -12 o   19.219   6.7788   23.533   13.217  -6.2896   25.017   35.081   15.567   14.161   6.8784   22.819   7.3579 -8.657934 10.07234 
1 1 1   21   10  -11 o   16.371   6.5262   15.622   13.099   21.869   25.605   13.408   15.244   17.608   8.0356   15.778   6.7282 1.829827 10.48041 
1 1 1   21   10  -10 o   14.879   6.0321   11.288   11.393   12.495   17.618   10.421   14.937   15.745   6.9641   15.015   6.5325 0.7304487 9.548407 
1 1 1   21   10   -9 o   12.358   5.5314   2.5497   11.459 -15.7617   17.705   15.748   15.031   11.536   5.6433   16.406   6.8188 -4.870652 8.851185 
1 1 1   21   10   -8 o   19.865   6.3602   23.733   11.646   15.503   18.456   29.178   15.013   16.438   7.2041   20.832   7.2334 -4.393560 10.20889 
1 1 1   21   10   -7 o   14.899   6.0386   11.303   11.415 -15.4395   17.360   31.671   15.150   11.469   5.6058   21.738   7.2720 -10.26895 9.181840 
1 1 1   21   10   -6 o   11.960   5.4215   0.9095   11.412 -11.7667   17.287   10.699   15.192   11.861   5.7512   15.132   6.5857 -3.270949 8.743385 
1 1 1   21   10   -5 o   15.860   6.1669   13.991   11.442   7.1934   17.685   18.885   15.006   14.747   6.7101   17.340   6.9605 -2.592859 9.668207 
1 1 1   21   10   -4 o   17.403   6.5291   18.329   12.531   24.807   17.943   12.163   17.507   18.721   7.5771   15.699   6.9429 3.022305 10.27696 
1 1 1   21   10   -3 o   13.096   6.2031  -3.0546   17.659   28.999   24.748 -36.3026   25.205   18.885   8.3072   11.932   5.9845 6.952772 10.23836 
1 1 1   21   10   -2 o   26.098   6.9294   42.005   14.987   47.066   18.154   31.176   26.556   25.977   7.8844   19.096   8.4923 6.881372 11.58808 
1 1 1   21   10   -1 o   13.314   6.0729   2.8076   14.600   22.986   17.870 -37.7070   25.321   18.253   7.4955   11.876   5.9621 6.377019 9.577575 
1 1 1   21   10    0 o   16.716   6.2036   16.157   11.252   9.8197   14.647   25.280   17.575   14.865   6.4680   18.918   7.5535 -4.053312 9.944351 
1 1 1   21   10    1 o   12.638   5.5497   4.1201   11.002   3.4228   14.466   5.0766   16.944   13.405   6.0873   14.247   6.5150 -0.8420582 8.916309 
1 1 1   21   10    2 o   11.086   5.2379  -5.4426   12.441 -13.2752   14.484   16.603   24.299   10.735   5.2186   16.875   7.7486 -6.140522 9.342108 
1 1 1   21   10    3 o   13.119   5.8471   4.2017   12.660  -8.1092   14.632   40.860   25.250   11.478   5.4951   21.122   8.8128 -9.643319 10.38567 
1 1 1   21   10    4 o   13.384   5.7436   6.5626   11.239  -3.3423   14.902   19.627   17.114   12.292   5.7844   17.427   7.2621 -5.134993 9.284245 
1 1 1   21   10    5 o   14.107   5.9036   8.8683   11.381   6.6686   14.938   11.912   17.573   14.180   6.3336   15.649   6.9367 -1.469142 9.393171 
1 1 1   21   10    6 o   14.283   6.1406   8.6191   12.890   6.3357   15.134   14.652   24.599   14.143   6.3416   16.589   7.6811 -2.446538 9.960667 
1 1 1   21   10    7 o   10.273   5.0490 -17.8600   14.693  -5.2794   18.496 -39.3801   24.191   12.990   6.2078   11.491   5.7768 1.499275 8.479837 
1 1 1   21   10    8 o   11.240   5.2782  -4.1770   12.290   6.0134   14.258 -33.6363   24.242   13.892   6.1974   11.858   5.9363 2.033371 8.581825 
1 1 1   21   10    9 o   14.612   6.4119   8.8626   14.662  -9.1262   18.045   43.816   25.153   12.383   5.9729   21.727   8.9043 -9.343478 10.72200 
1 1 1   21   10   10 o   17.820   6.6309   19.660   12.871   20.128   18.543   19.224   17.879   17.448   7.4299   17.258   7.3202 0.1899719 10.43014 
1 1 1   21   10   11 o   10.616   5.0810  -8.3243   12.490   4.4224   18.247 -19.5622   17.133   14.330   6.6282   10.959   5.3992 3.370450 8.548938 
1 1 1   21   10   12 o   20.501   6.1196   24.554   11.003   21.683   13.996   29.202   17.805   18.339   6.8961   19.936   7.7089 -1.596153 10.34327 
1 1 1   21   10   13 o   12.811   5.5916   4.8549   11.019   10.488   14.303  -3.3686   17.282   14.935   6.4453   12.916   6.1234 2.019194 8.890339 
1 1 1   21   10   14 o   19.864   6.6483   24.713   12.662   21.553   17.744   27.992   18.075   17.800   7.4042   19.492   7.6995 -1.692022 10.68196 
1 1 1   21   10   15 o   20.867   6.6466   27.130   12.731   40.498   17.840   13.256   18.174   23.603   7.8911   15.897   7.0500 7.706429 10.58169 
1 1 1   21   10   16 o   13.078   6.0364   1.3470   15.018   1.1115   29.267   1.4311   17.497   15.358   7.4551   13.664   6.3778 1.693952 9.810982 
1 1 1   21   10   17 o   18.654   7.1844   23.617   15.420   9.0150   30.012   28.854   17.974   16.130   7.7604   19.706   7.7099 -3.576292 10.93921 
1 1 1   21   10   18 o   25.101   7.2357   41.106   15.614   34.218   29.993   43.667   18.288   18.996   8.6798   24.402   7.9830 -5.405615 11.79270 
1 1 1   21   10   19 o   15.322   6.6619   11.846   15.515   8.5219   29.507   13.116   18.240   16.002   7.6981   15.807   7.0334 0.1952295 10.42730 
1 1 1   21   10   20 o   18.505   7.1897   23.419   15.543   4.9901   29.293   30.640   18.337   15.630   7.5565   20.057   7.8046 -4.426972 10.86332 
1 1 1   21   10   21 o   16.293   6.8359   15.848   15.320   9.7647   29.114   18.177   18.016   16.058   7.7045   16.847   7.2516 -0.7885895 10.58040 
1 1 1   21   10   22 o   14.615   6.4271   9.3229   14.805   4.8300   28.476   10.987   17.331   15.513   7.4875   15.264   6.8196 0.2487679 10.12766 
1 1 1   21   10   23 o   12.542   5.8528  -0.8494   14.721   18.712   28.079  -8.2639   17.287   16.954   7.9666   12.177   5.8666 4.777301 9.893631 
1 1 1   21   10   24 o   15.498   6.6399   12.984   14.974   26.316   28.490   7.8950   17.601   17.879   8.2742   14.680   6.6851 3.199530 10.63728 
1 1 1   21   10   25 o   11.875   5.6346  -4.8063   14.693  -3.7226   27.579  -5.2358   17.363   14.590   7.1172   12.571   6.0095 2.019334 9.314966 
1 1 1   21   10   26 o   18.758   7.1614   24.300   15.231   28.181   29.511   22.891   17.782   18.027   8.3696   17.921   7.4296 0.1056366 11.19153 
1 1 1   21   10   27 o   16.120   6.7945   15.508   15.245 -17.7809   28.753   28.524   17.980   13.642   6.7697   19.391   7.6731 -5.749684 10.23260 
1 1 1   21   10   28 f   12.839   6.1475  -4.7153   18.327   24.187   28.260 -25.6939   24.077   17.499   8.1468   12.196   6.0760 5.302034 10.16307 
1 1 1   21   10   29 o   12.217   5.9200  -9.5374   18.245   24.526   28.048 -34.5247   24.022   17.504   8.1381   11.582   5.8138 5.921766 10.00138 
1 1 1   21   10   30 o   11.216   5.5162 -17.1778   17.635 -11.7919   27.346 -21.0119   23.073   13.791   6.7992   12.287   6.0917 1.503751 9.128955 
1 1 1   21   10   31 o   13.519   6.3881   0.4372   18.517   31.745   27.660 -24.9918   24.928   18.435   8.3895   12.378   6.1690 6.057245 10.41352 
1 1 1   21   10   32 o   14.201   6.6209   4.8908   18.770  -0.5677   28.505   9.0695   24.941   14.805   7.2250   15.438   7.3299 -0.6328545 10.29219 
1 1 1   21   10   33 o   10.883   5.4970 -42.7941   23.353   0.0000   0.0000 -42.7941   23.353  ?   ?    10.883   5.4970 0.000000 5.496967 
1 1 1   21   10   34 o   15.649   7.0625   13.649   19.113   7.8969   29.088   18.019   25.355   15.538   7.5162   16.499   7.6930 -0.9608011 10.75527 
1 1 1   21   10   35 o   13.629   6.4208   1.8113   18.452 -35.0665   27.457   32.186   24.918   12.192   6.1329   18.651   8.2641 -6.458969 10.29115 
1 1 1   21   10   36 o   13.960   6.5245   4.0637   18.409 -28.6995   27.956   29.147   24.461   12.655   6.3409   18.193   8.1167 -5.537669 10.29987 
1 1 1   21   10   37 f   10.243   5.1271 -29.3994   18.054 -31.0722   27.874 -28.1904   23.696   12.504   6.2746   11.840   5.9183 0.6646261 8.625367 
1 1 1   21   10   38 o   10.031   5.0216 -29.2196   17.355 -36.9848   26.958 -23.7228   22.681   11.994   6.0386   11.924   5.9334 0.6918812E-01 8.465816 
1 1 1   21   10   39 f   11.794   5.7581 -12.4780   18.165 -31.9342   28.121   1.4524   23.795   12.500   6.2765   14.395   6.9219 -1.895535 9.343822 
1 1 1   21   10   40 o   12.486   6.0322  -7.3891   18.586  -6.1227   29.077  -8.2640   24.169   14.380   7.0746   13.513   6.6070 0.8668747 9.679968 
1 1 1   21   11  -25 o   12.180   6.0368 -19.6308   22.594   0.0000   0.0000 -19.6308   22.594  ?   ?    12.180   6.0368 0.000000 6.036754 
1 1 1   21   11  -24 o   15.469   7.2443   11.750   22.885   0.0000   0.0000   11.750   22.885  ?   ?    15.469   7.2443 0.000000 7.244278 
1 1 1   21   11  -23 o   13.611   6.6307  -5.3041   23.720   0.0000   0.0000  -5.3041   23.720  ?   ?    13.611   6.6307 0.000000 6.630662 
1 1 1   21   11  -22 o   12.032   5.8622 -10.6224   18.549   0.0000   0.0000 -10.6224   18.549  ?   ?    12.032   5.8622 0.000000 5.862214 
1 1 1   21   11  -21 o   19.621   7.1324   27.471   14.750  -3.0284   23.973   46.049   18.710   13.861   6.7329   24.173   8.0812 -10.31207 10.51848 
1 1 1   21   11  -20 o   15.458   6.5971   14.038   14.678   28.344   23.933   5.4131   18.582   17.954   8.0181   14.111   6.5817 3.843335 10.37348 
1 1 1   21   11  -19 o   11.634   5.5247  -4.2877   14.184  -6.7020   22.470  -2.6885   18.287   13.264   6.4598   12.911   6.1708 0.3528471 8.933526 
1 1 1   21   11  -18 o   12.232   5.8260  -3.7387   16.009   2.8523   22.653 -10.3141   22.627   14.308   6.8466   12.949   6.3440 1.359698 9.333941 
1 1 1   21   11  -17 o   11.611   5.5156  -4.3638   14.156   0.0112   23.340  -6.9096   17.804   14.080   6.7917   12.269   5.9214 1.811297 9.010608 
1 1 1   21   11  -16 o   13.046   5.9508   3.9377   14.020  -5.8578   23.499   9.3523   17.471   13.512   6.5864   14.628   6.6610 -1.115601 9.367447 
1 1 1   21   11  -15 o   12.144   5.6755  -0.7201   13.929   1.1166   23.627  -1.6986   17.245   14.230   6.8565   12.813   6.0870 1.416831 9.168539 
1 1 1   21   11  -14 o   10.274   5.0199 -13.4054   13.880 -20.7930   22.755  -9.0277   17.517   12.092   6.0043   11.940   5.7895 0.1511669 8.340838 
1 1 1   21   11  -13 o   9.9749   4.9057 -16.2183   13.944 -31.4567   23.479  -7.9148   17.332   11.514   5.7749   12.028   5.8143 -0.5141249 8.194840 
1 1 1   21   11  -12 o   23.612   7.0140   37.173   14.482   38.879   25.229   36.335   17.686   19.648   8.5194   21.457   7.8087 -1.809137 11.55666 
1 1 1   21   11  -11 o   14.036   6.2222   8.3482   14.144   27.195   24.180  -1.4540   17.438   17.764   7.9866   12.908   6.1286 4.856692 10.06709 
1 1 1   21   11  -10 o   17.543   6.9507   21.244   14.772   8.6894   24.966   28.006   18.323   15.235   7.2619   18.792   7.6381 -3.556277 10.53921 
1 1 1   21   11   -9 o   19.802   7.7095   31.157   17.900   42.878   24.413   17.528   26.325   20.721   8.6571   16.349   7.6920 4.371983 11.58070 
1 1 1   21   11   -8 o   20.970   7.8299   35.032   17.977   27.708   24.698   43.283   26.216   17.844   8.0428   20.315   8.7460 -2.471403 11.88189 
1 1 1   21   11   -7 o   20.827   7.8219   34.564   17.994   20.409   24.453   51.282   26.574   16.751   7.7213   21.810   9.0657 -5.058493 11.90820 
1 1 1   21   11   -6 o   21.656   7.0954   32.223   14.445   10.951   24.251   43.919   17.982   15.489   7.3164   24.001   7.9194 -8.512719 10.78179 
1 1 1   21   11   -5 o   19.972   7.0514   27.744   14.304   19.452   23.897   32.373   17.856   16.633   7.6545   20.220   7.7457 -3.587923 10.88974 
1 1 1   21   11   -4 o   17.453   6.8254   20.474   14.081   22.752   24.112   19.294   17.347   17.130   7.8100   16.776   7.1663 0.3534985 10.59957 
1 1 1   21   11   -3 o   12.275   5.5801   2.2365   12.195 -19.3416   17.369   23.213   17.125   10.859   5.3661   17.790   7.3250 -6.930696 9.080267 
1 1 1   21   11   -2 o   16.333   6.6928   16.930   14.208   11.254   17.445   28.114   24.487   15.052   6.7741   17.970   8.0615 -2.917794 10.52973 
1 1 1   21   11   -1 o   14.582   6.1496   11.040   12.499  -0.2539   17.661   22.375   17.693   13.162   6.2253   17.504   7.3453 -4.341853 9.628504 
1 1 1   21   11    0 o   19.421   6.6594   24.732   12.710   19.892   17.928   29.622   18.021   16.889   7.2513   19.374   7.6770 -2.484928 10.56020 
1 1 1   21   11    1 o   20.743   6.6896   28.019   12.868   44.898   17.918   10.047   18.490   24.424   7.8956   14.923   6.8174 9.500433 10.43159 
1 1 1   21   11    2 o   14.768   6.2103   11.633   12.689   16.737   17.834   6.4002   18.057   16.188   7.0884   14.254   6.5932 1.934103 9.680697 
1 1 1   21   11    3 o   11.565   5.3931  -1.6528   12.463   17.777   17.598 -21.2038   17.653   16.418   7.1171   10.776   5.3402 5.641719 8.897797 
1 1 1   21   11    4 o   13.287   5.8637   6.3080   12.424   20.531   17.555  -7.9668   17.587   17.059   7.2453   12.128   5.8614 4.930305 9.319336 
1 1 1   21   11    5 o   26.667   6.2297   41.952   13.296   37.342   18.688   46.677   18.921   21.422   7.9864   24.378   8.1261 -2.955885 11.39370 
1 1 1   21   11    6 o   11.502   5.3833  -2.2222   12.606 -23.4629   17.383   21.339   18.307   10.489   5.2152   17.179   7.3507 -6.689754 9.012815 
1 1 1   21   11    7 o   12.320   5.9207  -5.8564   17.351 -11.5153   25.315  -0.8429   23.828   13.356   6.5768   14.108   6.8191 -0.7510319 9.473889 
1 1 1   21   11    8 o   12.956   5.9447   3.0489   14.266 -22.7697   24.657   16.041   17.491   12.379   6.1639   16.010   7.0150 -3.631079 9.338314 
1 1 1   21   11    9 o   11.985   5.6647  -2.9095   14.575   5.7043   26.302  -6.7269   17.510   15.032   7.2407   12.242   5.8995 2.790244 9.339762 
1 1 1   21   11   10 o   15.819   6.6629   15.307   14.643  -2.1460   25.827   23.575   17.777   14.217   6.9246   17.740   7.3976 -3.522311 10.13286 
1 1 1   21   11   11 o   8.3938   4.2342 -32.0711   13.603 -13.9732   23.364 -41.3518   16.731   12.782   6.2986   8.9607   4.5403 3.821276 7.764473 
1 1 1   21   11   12 o   22.069   7.9624   39.158   18.337   0.0000   0.0000   39.158   18.337  ?   ?    22.069   7.9624 0.000000 7.962391 
1 1 1   21   11   13 o   17.993   8.1369   29.618   25.525   0.0000   0.0000   29.618   25.525  ?   ?    17.993   8.1369 0.000000 8.136884 
1 1 1   21   11   14 o   13.342   6.5556  -9.8812   24.709   0.0000   0.0000  -9.8812   24.709  ?   ?    13.342   6.5556 0.000000 6.555613 
1 1 1   21   11   15 o   16.484   7.6628   19.106   24.853   0.0000   0.0000   19.106   24.853  ?   ?    16.484   7.6628 0.000000 7.662781 
1 1 1   21   11   16 o   10.527   5.2302 -22.6675   17.367   0.0000   0.0000 -22.6675   17.367  ?   ?    10.527   5.2302 0.000000 5.230249 
1 1 1   21   11   17 o   23.121   8.0415   42.734   18.558   0.0000   0.0000   42.734   18.558  ?   ?    23.121   8.0415 0.000000 8.041482 
1 1 1   21   11   18 o   22.168   7.9622   39.463   18.313   0.0000   0.0000   39.463   18.313  ?   ?    22.168   7.9622 0.000000 7.962188 
1 1 1   21   11   19 o   12.208   5.8836  -6.6507   17.423   0.0000   0.0000  -6.6507   17.423  ?   ?    12.208   5.8836 0.000000 5.883613 
1 1 1   21   11   20 o   18.537   7.5694   27.007   18.095   0.0000   0.0000   27.007   18.095  ?   ?    18.537   7.5694 0.000000 7.569397 
1 1 1   21   11   21 o   14.492   7.0144   1.5312   25.429   0.0000   0.0000   1.5312   25.429  ?   ?    14.492   7.0144 0.000000 7.014390 
1 1 1   21   11   22 o   12.682   6.1242  -5.9884   19.110 -32.6873   28.312   16.354   25.899   12.417   6.2434   16.149   7.6078 -3.732280 9.841677 
1 1 1   21   11   23 o   12.217   5.9596 -10.7403   19.337 -15.9385   29.689  -6.9103   25.484   13.644   6.7892   13.730   6.7279 -0.8537674E-01 9.558120 
1 1 1   21   11   24 o   14.982   6.9265   9.9085   19.891   17.124   31.338   5.0398   25.742   16.366   7.8881   14.902   7.1740 1.464057 10.66253 
1 1 1   21   11   25 o   11.295   5.7042 -41.8834   25.093   0.0000   0.0000 -41.8834   25.093  ?   ?    11.295   5.7042 0.000000 5.704193 
1 1 1   22    0  -77 o   12.963   8.6612   6.2223   25.143   6.2223   25.143   6.2223   25.143   12.963   8.6612   12.963   8.6612 0.000000 0.000000 
1 1 1   22    0  -76 o   14.292   9.2740   13.738   25.729   13.738   25.729   13.738   25.729   14.292   9.2740   14.292   9.2740 0.000000 0.000000 
1 1 1   22    0  -75 o   11.215   7.7766  -7.3109   24.658  -7.3109   24.658  -7.3109   24.658   11.215   7.7766   11.215   7.7766 0.000000 0.000000 
1 1 1   22    0  -74 f   14.844   9.5260   16.103   26.176   16.103   26.176   16.103   26.176   14.844   9.5260   14.844   9.5260 0.000000 0.000000 
1 1 1   22    0  -73 o   13.263   8.3719   11.092   19.249   11.092   19.249   11.092   19.249   13.263   8.3719   13.263   8.3719 0.000000 0.000000 
1 1 1   22    0  -72 o   11.046   7.3367   1.5760   17.591   1.5760   17.591   1.5760   17.591   11.046   7.3367   11.046   7.3367 0.000000 0.000000 
1 1 1   22    0  -71 o   11.917   7.2861   8.6497   13.463   8.6497   13.463   8.6497   13.463   11.917   7.2861   11.917   7.2861 0.000000 0.000000 
1 1 1   22    0  -70 o   8.7442   5.9784  -4.9791   13.408  -4.9791   13.408  -4.9791   13.408   8.7442   5.9784   8.7442   5.9784 0.000000 0.000000 
1 1 1   22    0  -69 o   11.571   7.2236   6.9002   13.912   6.9002   13.912   6.9002   13.912   11.571   7.2236   11.571   7.2236 0.000000 0.000000 
1 1 1   22    0  -68 o   15.861   8.4492   18.755   14.815   18.755   14.815   18.755   14.815   15.861   8.4492   15.861   8.4492 0.000000 0.000000 
1 1 1   22    0  -67 o   29.581   7.1437   45.277   14.932   45.277   14.932   45.277   14.932   29.581   7.1437   29.581   7.1437 0.000000 0.000000 
1 1 1   22    0  -66 f   7.3792   5.2614 -17.2471   14.018 -17.2471   14.018 -17.2471   14.018   7.3792   5.2614   7.3792   5.2614 0.000000 0.000000 
1 1 1   22    0  -65 o   12.116   7.3797   8.3049   13.693   8.3049   13.693   8.3049   13.693   12.116   7.3797   12.116   7.3797 0.000000 0.000000 
1 1 1   22    0  -64 o   8.3358   5.7792  -8.7690   13.608  -8.7690   13.608  -8.7690   13.608   8.3358   5.7792   8.3358   5.7792 0.000000 0.000000 
1 1 1   22    0  -63 o   32.410   6.1125   50.283   14.473   50.283   14.473   50.283   14.473   32.410   6.1125   32.410   6.1125 0.000000 0.000000 
1 1 1   22    0  -62 o   41.824   4.6130   77.229   15.240   77.229   15.240   77.229   15.240   41.824   4.6130   41.824   4.6130 0.000000 0.000000 
1 1 1   22    0  -61 o   19.683   8.4819   25.225   13.977   25.225   13.977   25.225   13.977   19.683   8.4819   19.683   8.4819 0.000000 0.000000 
1 1 1   22    0  -60 o   14.851   8.1232   15.150   14.044   15.150   14.044   15.150   14.044   14.851   8.1232   14.851   8.1232 0.000000 0.000000 
1 1 1   22    0  -59 o   8.0976   5.6437 -10.5248   13.438 -10.5248   13.438 -10.5248   13.438   8.0976   5.6437   8.0976   5.6437 0.000000 0.000000 
1 1 1   22    0  -58 o   11.949   7.2856   7.1967   13.378   7.1967   13.378   7.1967   13.378   11.949   7.2856   11.949   7.2856 0.000000 0.000000 
1 1 1   22    0  -57 o   9.4555   6.2896  -2.0043   13.006  -2.0043   13.006  -2.0043   13.006   9.4555   6.2896   9.4555   6.2896 0.000000 0.000000 
1 1 1   22    0  -56 o   7.3196   5.1954 -15.7598   13.115 -15.7598   13.115 -15.7598   13.115   7.3196   5.1954   7.3196   5.1954 0.000000 0.000000 
1 1 1   22    0  -55 o   11.505   7.4324   2.3848   16.282   2.3848   16.282   2.3848   16.282   11.505   7.4324   11.505   7.4324 0.000000 0.000000 
1 1 1   22    0  -54 o   47.331   5.1444   98.413   19.254   98.413   19.254   98.413   19.254   47.331   5.1444   47.331   5.1444 0.000000 0.000000 
1 1 1   22    0  -53 o   10.043   6.8017  -5.7272   16.515  -5.7272   16.515  -5.7272   16.515   10.043   6.8017   10.043   6.8017 0.000000 0.000000 
1 1 1   22    0  -52 o   16.515   8.2102   18.126   13.377   18.126   13.377   18.126   13.377   16.515   8.2102   16.515   8.2102 0.000000 0.000000 
1 1 1   22    0  -51 f   23.244   8.0553   30.553   13.766   30.553   13.766   30.553   13.766   23.244   8.0553   23.244   8.0553 0.000000 0.000000 
1 1 1   22    0  -50 o   60.276   3.3912  152.072   16.541  152.072   16.541  152.072   16.541   60.276   3.3912   60.276   3.3912 0.000000 0.000000 
1 1 1   22    0  -49 o   48.563   3.8753  100.066   15.109  100.066   15.109  100.066   15.109   48.563   3.8753   48.563   3.8753 0.000000 0.000000 
1 1 1   22    0  -48 o   7.6227   5.2571  -7.3487   10.898  -7.3487   10.898  -7.3487   10.898   7.6227   5.2571   7.6227   5.2571 0.000000 0.000000 
1 1 1   22    0  -47 o   30.764   5.0552   42.771   11.649   42.771   11.649   42.771   11.649   30.764   5.0552   30.764   5.0552 0.000000 0.000000 
1 1 1   22    0  -46 o   18.439   7.4799   20.350   11.007   20.350   11.007   20.350   11.007   18.439   7.4799   18.439   7.4799 0.000000 0.000000 
1 1 1   22    0  -45 o   7.0660   4.9347  -9.4204   10.418  -9.4204   10.418  -9.4204   10.418   7.0660   4.9347   7.0660   4.9347 0.000000 0.000000 
1 1 1   22    0  -44 o   24.954   6.5393   31.143   11.493   31.143   11.493   31.143   11.493   24.954   6.5393   24.954   6.5393 0.000000 0.000000 
1 1 1   22    0  -43 o   10.994   6.8472   4.2402   12.423   4.2402   12.423   4.2402   12.423   10.994   6.8472   10.994   6.8472 0.000000 0.000000 
1 1 1   22    0  -42 o   42.691   4.8538   79.200   16.328   79.200   16.328   79.200   16.328   42.691   4.8538   42.691   4.8538 0.000000 0.000000 
1 1 1   22    0  -41 o   70.849   2.9139  207.761   16.764  207.761   16.764  207.761   16.764   70.849   2.9139   70.849   2.9139 0.000000 0.000000 
1 1 1   22    0  -40 f   11.490   7.0375   5.5502   12.610   5.5502   12.610   5.5502   12.610   11.490   7.0375   11.490   7.0375 0.000000 0.000000 
1 1 1   22    0  -39 o   21.239   7.1971   24.654   11.153   24.654   11.153   24.654   11.153   21.239   7.1971   21.239   7.1971 0.000000 0.000000 
1 1 1   22    0  -38 o   91.648   2.7093  346.082   20.200  346.082   20.200  346.082   20.200   91.648   2.7093   91.648   2.7093 0.000000 0.000000 
1 1 1   22    0  -37 f   37.980   4.7351   62.818   14.045   62.818   14.045   62.818   14.045   37.980   4.7351   37.980   4.7351 0.000000 0.000000 
1 1 1   22    0  -36 o   69.394   3.0286  199.324   17.057  199.324   17.057  199.324   17.057   69.394   3.0286   69.394   3.0286 0.000000 0.000000 
1 1 1   22    0  -35 o   14.858   7.9623   13.966   13.226   13.966   13.226   13.966   13.226   14.858   7.9623   14.858   7.9623 0.000000 0.000000 
1 1 1   22    0  -34 o   67.624   2.6406  188.571   14.505  188.571   14.505  188.571   14.505   67.624   2.6406   67.624   2.6406 0.000000 0.000000 
1 1 1   22    0  -33 f   99.054   2.5399  403.283   20.478  403.283   20.478  403.283   20.478   99.054   2.5399   99.054   2.5399 0.000000 0.000000 
1 1 1   22    0  -32 o   65.368   2.6591  176.218   14.116  176.218   14.116  176.218   14.116   65.368   2.6591   65.368   2.6591 0.000000 0.000000 
1 1 1   22    0  -31 o   30.608   5.0139   41.900   11.502   41.900   11.502   41.900   11.502   30.608   5.0139   30.608   5.0139 0.000000 0.000000 
1 1 1   22    0  -30 o   25.674   6.2764   31.959   11.377   31.959   11.377   31.959   11.377   25.674   6.2764   25.674   6.2764 0.000000 0.000000 
1 1 1   22    0  -29 o   56.337   2.9211  131.386   13.332  131.386   13.332  131.386   13.332   56.337   2.9211   56.337   2.9211 0.000000 0.000000 
1 1 1   22    0  -28 o   35.276   4.2678   53.659   11.795   53.659   11.795   53.659   11.795   35.276   4.2678   35.276   4.2678 0.000000 0.000000 
1 1 1   22    0  -27 o   7.8153   5.4536 -11.5162   12.653 -11.5162   12.653 -11.5162   12.653   7.8153   5.4536   7.8153   5.4536 0.000000 0.000000 
1 1 1   22    0  -26 o   90.279   2.6176  334.921   19.227  334.921   19.227  334.921   19.227   90.279   2.6176   90.279   2.6176 0.000000 0.000000 
1 1 1   22    0  -25 o   34.694   4.3424   52.010   11.761   52.010   11.761   52.010   11.761   34.694   4.3424   34.694   4.3424 0.000000 0.000000 
1 1 1   22    0  -24 o   17.440   7.5453   18.305   11.056   18.305   11.056   18.305   11.056   17.440   7.5453   17.440   7.5453 0.000000 0.000000 
1 1 1   22    0  -23 o   8.7551   5.9229  -5.5078   12.456  -5.5078   12.456  -5.5078   12.456   8.7551   5.9229   8.7551   5.9229 0.000000 0.000000 
1 1 1   22    0  -22 o   21.326   7.8465   25.525   12.612   25.525   12.612   25.525   12.612   21.326   7.8465   21.326   7.8465 0.000000 0.000000 
1 1 1   22    0  -21 o   41.405   3.7171   72.247   12.302   72.247   12.302   72.247   12.302   41.405   3.7171   41.405   3.7171 0.000000 0.000000 
1 1 1   22    0  -20 o   8.0868   5.4873  -5.3326   10.854  -5.3326   10.854  -5.3326   10.854   8.0868   5.4873   8.0868   5.4873 0.000000 0.000000 
1 1 1   22    0  -19 o  104.221   2.5166  445.516   21.352  445.516   21.352  445.516   21.352  104.221   2.5166  104.221   2.5166 0.000000 0.000000 
1 1 1   22    0  -18 o   67.709   2.8924  188.983   15.897  188.983   15.897  188.983   15.897   67.709   2.8924   67.709   2.8924 0.000000 0.000000 
1 1 1   22    0  -17 o   19.815   7.3527   21.989   11.026   21.989   11.026   21.989   11.026   19.815   7.3527   19.815   7.3527 0.000000 0.000000 
1 1 1   22    0  -16 o   8.4888   5.6677  -3.2370   10.732  -3.2370   10.732  -3.2370   10.732   8.4888   5.6677   8.4888   5.6677 0.000000 0.000000 
1 1 1   22    0  -15 o  106.777   2.5562  467.546   22.220  467.546   22.220  467.546   22.220  106.777   2.5562  106.777   2.5562 0.000000 0.000000 
1 1 1   22    0  -14 f   20.256   8.0149   23.712   12.740   23.712   12.740   23.712   12.740   20.256   8.0149   20.256   8.0149 0.000000 0.000000 
1 1 1   22    0  -13 o   12.328   7.2127   7.8304   12.115   7.8304   12.115   7.8304   12.115   12.328   7.2127   12.328   7.2127 0.000000 0.000000 
1 1 1   22    0  -12 o   17.720   8.0419   19.201   12.545   19.201   12.545   19.201   12.545   17.720   8.0419   17.720   8.0419 0.000000 0.000000 
1 1 1   22    0  -11 o   19.007   7.9986   21.423   12.475   21.423   12.475   21.423   12.475   19.007   7.9986   19.007   7.9986 0.000000 0.000000 
1 1 1   22    0  -10 o   73.902   2.8669  224.754   17.211  224.754   17.211  224.754   17.211   73.902   2.8669   73.902   2.8669 0.000000 0.000000 
1 1 1   22    0   -9 o  121.871   2.4967  608.483   24.779  608.483   24.779  608.483   24.779  121.871   2.4967  121.871   2.4967 0.000000 0.000000 
1 1 1   22    0   -8 o   88.625   2.6473  322.380   19.086  322.380   19.086  322.380   19.086   88.625   2.6473   88.625   2.6473 0.000000 0.000000 
1 1 1   22    0   -7 f   18.917   8.0467   21.303   12.602   21.303   12.602   21.303   12.602   18.917   8.0467   18.917   8.0467 0.000000 0.000000 
1 1 1   22    0   -6 o   38.009   4.5050   62.004   13.442   62.004   13.442   62.004   13.442   38.009   4.5050   38.009   4.5050 0.000000 0.000000 
1 1 1   22    0   -5 o   44.500   4.0334   83.456   14.340   83.456   14.340   83.456   14.340   44.500   4.0334   44.500   4.0334 0.000000 0.000000 
1 1 1   22    0   -4 o   61.148   3.2235  154.618   15.965  154.618   15.965  154.618   15.965   61.148   3.2235   61.148   3.2235 0.000000 0.000000 
1 1 1   22    0   -3 o   33.556   5.1966   49.724   13.200   49.724   13.200   49.724   13.200   33.556   5.1966   33.556   5.1966 0.000000 0.000000 
1 1 1   22    0   -2 o   14.190   7.6820   12.157   12.429   12.157   12.429   12.157   12.429   14.190   7.6820   14.190   7.6820 0.000000 0.000000 
1 1 1   22    0   -1 o   33.555   5.3015   49.863   13.419   49.863   13.419   49.863   13.419   33.555   5.3015   33.555   5.3015 0.000000 0.000000 
1 1 1   22    0    0 o   58.509   3.2030  141.630   15.171  141.630   15.171  141.630   15.171   58.509   3.2030   58.509   3.2030 0.000000 0.000000 
1 1 1   22    0    1 o   20.981   7.8421   24.720   12.497   24.720   12.497   24.720   12.497   20.981   7.8421   20.981   7.8421 0.000000 0.000000 
1 1 1   22    0    2 o   43.022   4.9468   79.428   16.753   79.428   16.753   79.428   16.753   43.022   4.9468   43.022   4.9468 0.000000 0.000000 
1 1 1   22    0    3 o   17.651   8.6689   19.503   14.836   19.503   14.836   19.503   14.836   17.651   8.6689   17.651   8.6689 0.000000 0.000000 
1 1 1   22    0    4 o   20.848   10.873   27.913   24.125   27.913   24.125   27.913   24.125   20.848   10.873   20.848   10.873 0.000000 0.000000 
1 1 1   22    0    5 o   21.218   11.024   29.003   24.737   29.003   24.737   29.003   24.737   21.218   11.024   21.218   11.024 0.000000 0.000000 
1 1 1   22    0    6 o   74.461   5.2471  233.074   31.478  233.074   31.478  233.074   31.478   74.461   5.2471   74.461   5.2471 0.000000 0.000000 
1 1 1   22    0    7 f   13.129   7.9771   7.2483   15.918   7.2483   15.918   7.2483   15.918   13.129   7.9771   13.129   7.9771 0.000000 0.000000 
1 1 1   22    0    8 o   17.921   8.0507   19.544   12.567   19.544   12.567   19.544   12.567   17.921   8.0507   17.921   8.0507 0.000000 0.000000 
1 1 1   22    0    9 o   49.787   3.5907  103.397   14.395  103.397   14.395  103.397   14.395   49.787   3.5907   49.787   3.5907 0.000000 0.000000 
1 1 1   22    0   10 o   7.7088   5.3549 -10.0330   11.831 -10.0330   11.831 -10.0330   11.831   7.7088   5.3549   7.7088   5.3549 0.000000 0.000000 
1 1 1   22    0   11 o   37.189   4.8455   59.949   14.001   59.949   14.001   59.949   14.001   37.189   4.8455   37.189   4.8455 0.000000 0.000000 
1 1 1   22    0   12 o   9.6211   6.3420  -2.0789   12.747  -2.0789   12.747  -2.0789   12.747   9.6211   6.3420   9.6211   6.3420 0.000000 0.000000 
1 1 1   22    0   13 o   66.752   3.0621  183.869   16.582  183.869   16.582  183.869   16.582   66.752   3.0621   66.752   3.0621 0.000000 0.000000 
1 1 1   22    0   14 f   46.053   4.0343   89.322   14.866   89.322   14.866   89.322   14.866   46.053   4.0343   46.053   4.0343 0.000000 0.000000 
1 1 1   22    0   15 o   30.026   6.4803   42.288   13.914   42.288   13.914   42.288   13.914   30.026   6.4803   30.026   6.4803 0.000000 0.000000 
1 1 1   22    0   16 o   37.506   4.8437   60.985   14.130   60.985   14.130   60.985   14.130   37.506   4.8437   37.506   4.8437 0.000000 0.000000 
1 1 1   22    0   17 o   25.130   7.5879   32.666   13.553   32.666   13.553   32.666   13.553   25.130   7.5879   25.130   7.5879 0.000000 0.000000 
1 1 1   22    0   18 o  151.977   2.5721  946.619   31.843  946.619   31.843  946.619   31.843  151.977   2.5721  151.977   2.5721 0.000000 0.000000 
1 1 1   22    0   19 o   42.594   4.2544   77.057   14.408   77.057   14.408   77.057   14.408   42.594   4.2544   42.594   4.2544 0.000000 0.000000 
1 1 1   22    0   20 o   66.416   3.0929  182.213   16.661  182.213   16.661  182.213   16.661   66.416   3.0929   66.416   3.0929 0.000000 0.000000 
1 1 1   22    0   21 o  144.143   2.5345  851.701   29.759  851.701   29.759  851.701   29.759  144.143   2.5345  144.143   2.5345 0.000000 0.000000 
1 1 1   22    0   22 o   39.277   4.5315   66.271   14.007   66.271   14.007   66.271   14.007   39.277   4.5315   39.277   4.5315 0.000000 0.000000 
1 1 1   22    0   23 o   8.5622   5.8279  -6.4944   12.441  -6.4944   12.441  -6.4944   12.441   8.5622   5.8279   8.5622   5.8279 0.000000 0.000000 
1 1 1   22    0   24 o   36.611   4.8142   58.318   13.678   58.318   13.678   58.318   13.678   36.611   4.8142   36.611   4.8142 0.000000 0.000000 
1 1 1   22    0   25 o   7.3996   5.2103 -13.5568   12.343 -13.5568   12.343 -13.5568   12.343   7.3996   5.2103   7.3996   5.2103 0.000000 0.000000 
1 1 1   22    0   26 o   26.333   7.9301   36.099   14.836   36.099   14.836   36.099   14.836   26.333   7.9301   26.333   7.9301 0.000000 0.000000 
1 1 1   22    0   27 o   25.254   8.0675   33.978   14.631   33.978   14.631   33.978   14.631   25.254   8.0675   25.254   8.0675 0.000000 0.000000 
1 1 1   22    0   28 o   12.728   7.7233   7.1924   14.877   7.1924   14.877   7.1924   14.877   12.728   7.7233   12.728   7.7233 0.000000 0.000000 
1 1 1   22    0   29 o   8.5167   5.8115  -6.8472   12.536  -6.8472   12.536  -6.8472   12.536   8.5167   5.8115   8.5167   5.8115 0.000000 0.000000 
1 1 1   22    0   30 o   22.134   7.7842   27.121   12.737   27.121   12.737   27.121   12.737   22.134   7.7842   22.134   7.7842 0.000000 0.000000 
1 1 1   22    0   31 o   21.903   8.0242   27.111   13.220   27.111   13.220   27.111   13.220   21.903   8.0242   21.903   8.0242 0.000000 0.000000 
1 1 1   22    0   32 o   51.030   3.5845  109.008   14.738  109.008   14.738  109.008   14.738   51.030   3.5845   51.030   3.5845 0.000000 0.000000 
1 1 1   22    0   33 f   24.001   9.3104   33.940   17.323   33.940   17.323   33.940   17.323   24.001   9.3104   24.001   9.3104 0.000000 0.000000 
1 1 1   22    0   34 o   10.056   6.4922   0.6522   12.397   0.6522   12.397   0.6522   12.397   10.056   6.4922   10.056   6.4922 0.000000 0.000000 
1 1 1   22    0   35 o   32.029   7.2545   49.477   16.517   49.477   16.517   49.477   16.517   32.029   7.2545   32.029   7.2545 0.000000 0.000000 
1 1 1   22    0   36 o   16.360   8.0123   17.113   12.660   17.113   12.660   17.113   12.660   16.360   8.0123   16.360   8.0123 0.000000 0.000000 
1 1 1   22    0   37 f   57.396   3.3727  137.319   15.654  137.319   15.654  137.319   15.654   57.396   3.3727   57.396   3.3727 0.000000 0.000000 
1 1 1   22    0   38 o   30.898   6.7910   45.659   14.969   45.659   14.969   45.659   14.969   30.898   6.7910   30.898   6.7910 0.000000 0.000000 
1 1 1   22    0   39 o   17.856   8.1738   20.111   12.969   20.111   12.969   20.111   12.969   17.856   8.1738   17.856   8.1738 0.000000 0.000000 
1 1 1   22    0   40 f   6.5134   4.6776 -19.0967   11.917 -19.0967   11.917 -19.0967   11.917   6.5134   4.6776   6.5134   4.6776 0.000000 0.000000 
1 1 1   22    0   41 o   9.8802   6.4453  -0.2460   12.662  -0.2460   12.662  -0.2460   12.662   9.8802   6.4453   9.8802   6.4453 0.000000 0.000000 
1 1 1   22    0   42 o   8.0640   5.5660  -8.4865   12.278  -8.4865   12.278  -8.4865   12.278   8.0640   5.5660   8.0640   5.5660 0.000000 0.000000 
1 1 1   22    0   43 o   8.2996   5.8485 -16.4435   15.644 -16.4435   15.644 -16.4435   15.644   8.2996   5.8485   8.2996   5.8485 0.000000 0.000000 
1 1 1   22    0   44 o   17.757   8.9869   21.012   16.172   21.012   16.172   21.012   16.172   17.757   8.9869   17.757   8.9869 0.000000 0.000000 
1 1 1   22    0   45 o   9.6065   6.5543  -7.6399   15.934  -7.6399   15.934  -7.6399   15.934   9.6065   6.5543   9.6065   6.5543 0.000000 0.000000 
1 1 1   22    0   46 o   15.149   7.8370   14.987   12.464   14.987   12.464   14.987   12.464   15.149   7.8370   15.149   7.8370 0.000000 0.000000 
1 1 1   22    0   47 o   6.7398   4.8230 -17.9179   12.206 -17.9179   12.206 -17.9179   12.206   6.7398   4.8230   6.7398   4.8230 0.000000 0.000000 
1 1 1   22    0   48 o   7.1807   5.0667 -13.0338   11.867 -13.0338   11.867 -13.0338   11.867   7.1807   5.0667   7.1807   5.0667 0.000000 0.000000 
1 1 1   22    0   49 o   16.265   8.0218   17.368   12.725   17.368   12.725   17.368   12.725   16.265   8.0218   16.265   8.0218 0.000000 0.000000 
1 1 1   22    0   50 o   37.945   4.8386   63.424   14.302   63.424   14.302   63.424   14.302   37.945   4.8386   37.945   4.8386 0.000000 0.000000 
1 1 1   22    0   51 f   28.877   6.4349   40.329   13.234   40.329   13.234   40.329   13.234   28.877   6.4349   28.877   6.4349 0.000000 0.000000 
1 1 1   22    0   52 o   11.395   7.0234   5.5446   12.742   5.5446   12.742   5.5446   12.742   11.395   7.0234   11.395   7.0234 0.000000 0.000000 
1 1 1   22    0   53 o   8.3907   5.7416  -6.5660   12.424  -6.5660   12.424  -6.5660   12.424   8.3907   5.7416   8.3907   5.7416 0.000000 0.000000 
1 1 1   22    0   54 o   20.160   8.1796   24.898   13.161   24.898   13.161   24.898   13.161   20.160   8.1796   20.160   8.1796 0.000000 0.000000 
1 1 1   22    0   55 o   9.2352   6.1774  -2.9202   12.852  -2.9202   12.852  -2.9202   12.852   9.2352   6.1774   9.2352   6.1774 0.000000 0.000000 
1 1 1   22    0   56 o   6.2075   4.4999 -23.5453   12.331 -23.5453   12.331 -23.5453   12.331   6.2075   4.4999   6.2075   4.4999 0.000000 0.000000 
1 1 1   22    0   57 o   8.1598   5.6544  -9.0894   12.986  -9.0894   12.986  -9.0894   12.986   8.1598   5.6544   8.1598   5.6544 0.000000 0.000000 
1 1 1   22    0   58 o   10.767   6.8385   3.4368   13.074   3.4368   13.074   3.4368   13.074   10.767   6.8385   10.767   6.8385 0.000000 0.000000 
1 1 1   22    0   59 o   13.145   8.3932   6.3586   20.005   6.3586   20.005   6.3586   20.005   13.145   8.3932   13.145   8.3932 0.000000 0.000000 
1 1 1   22    0   60 o   36.009   9.0587   68.917   22.996   68.917   22.996   68.917   22.996   36.009   9.0587   36.009   9.0587 0.000000 0.000000 
1 1 1   22    0   61 o   51.875   6.2936  123.488   25.571  123.488   25.571  123.488   25.571   51.875   6.2936   51.875   6.2936 0.000000 0.000000 
1 1 1   22    0   62 o   11.132   7.5381  -4.4545   20.270  -4.4545   20.270  -4.4545   20.270   11.132   7.5381   11.132   7.5381 0.000000 0.000000 
1 1 1   22    0   63 o   10.982   7.4799  -5.7352   20.565  -5.7352   20.565  -5.7352   20.565   10.982   7.4799   10.982   7.4799 0.000000 0.000000 
1 1 1   22    0   64 o   40.494   5.5052   75.157   17.224   75.157   17.224   75.157   17.224   40.494   5.5052   40.494   5.5052 0.000000 0.000000 
1 1 1   22    0   65 o   19.116   9.0351   26.007   15.926   26.007   15.926   26.007   15.926   19.116   9.0351   19.116   9.0351 0.000000 0.000000 
1 1 1   22    0   66 f   7.7818   5.5375 -17.6067   15.244 -17.6067   15.244 -17.6067   15.244   7.7818   5.5375   7.7818   5.5375 0.000000 0.000000 
1 1 1   22    0   67 o   30.034   8.1587   49.290   17.263   49.290   17.263   49.290   17.263   30.034   8.1587   30.034   8.1587 0.000000 0.000000 
1 1 1   22    0   68 o   25.513   8.9201   39.938   16.786   39.938   16.786   39.938   16.786   25.513   8.9201   25.513   8.9201 0.000000 0.000000 
1 1 1   22    0   69 o   12.883   7.8620   10.501   15.609   10.501   15.609   10.501   15.609   12.883   7.8620   12.883   7.8620 0.000000 0.000000 
1 1 1   22    0   70 o   26.984   8.5567   42.962   16.554   42.962   16.554   42.962   16.554   26.984   8.5567   26.984   8.5567 0.000000 0.000000 
1 1 1   22    0   71 o   32.442   7.1265   54.360   16.495   54.360   16.495   54.360   16.495   32.442   7.1265   32.442   7.1265 0.000000 0.000000 
1 1 1   22    0   72 o   9.8277   6.6333  -2.1466   15.451  -2.1466   15.451  -2.1466   15.451   9.8277   6.6333   9.8277   6.6333 0.000000 0.000000 
1 1 1   22    0   73 o   18.836   9.9513   30.099   20.410   30.099   20.410   30.099   20.410   18.836   9.9513   18.836   9.9513 0.000000 0.000000 
1 1 1   22    0   74 f   9.7256   6.7847 -10.3508   19.544 -10.3508   19.544 -10.3508   19.544   9.7256   6.7847   9.7256   6.7847 0.000000 0.000000 
1 1 1   22    0   75 o   9.3149   6.5379 -12.4404   18.960 -12.4404   18.960 -12.4404   18.960   9.3149   6.5379   9.3149   6.5379 0.000000 0.000000 
1 1 1   22    0   76 o   13.852   8.6229   13.883   19.681   13.883   19.681   13.883   19.681   13.852   8.6229   13.852   8.6229 0.000000 0.000000 
1 1 1   22    0   77 o   11.939   7.8701   5.0300   19.633   5.0300   19.633   5.0300   19.633   11.939   7.8701   11.939   7.8701 0.000000 0.000000 
1 1 1   22    0   78 f   14.487   8.8921   16.792   20.228   16.792   20.228   16.792   20.228   14.487   8.8921   14.487   8.8921 0.000000 0.000000 
1 1 1   22    0   79 o   8.8374   6.2800 -17.3702   19.362 -17.3702   19.362 -17.3702   19.362   8.8374   6.2800   8.8374   6.2800 0.000000 0.000000 
1 1 1   22    0   80 o   11.487   7.6996   2.3490   20.155   2.3490   20.155   2.3490   20.155   11.487   7.6996   11.487   7.6996 0.000000 0.000000 
1 1 1   22    0   81 o   17.297   9.7932   27.518   21.265   27.518   21.265   27.518   21.265   17.297   9.7932   17.297   9.7932 0.000000 0.000000 
1 1 1   22    0   86 f   9.1541   6.5930 -27.2112   24.447 -27.2112   24.447 -27.2112   24.447   9.1541   6.5930   9.1541   6.5930 0.000000 0.000000 
1 1 1   22    0   87 o   12.101   8.2607   2.3938   25.385   2.3938   25.385   2.3938   25.385   12.101   8.2607   12.101   8.2607 0.000000 0.000000 
1 1 1   22    0   88 o   19.807   11.086   41.838   26.849   41.838   26.849   41.838   26.849   19.807   11.086   19.807   11.086 0.000000 0.000000 
1 1 1   22    0   89 o   12.855   8.6224   8.0586   25.354   8.0586   25.354   8.0586   25.354   12.855   8.6224   12.855   8.6224 0.000000 0.000000 
1 1 1   22    1  -72 o   19.351   8.3563   24.197   24.073   24.197   24.073   0.0000   0.0000   19.351   8.3563  ?   ?  0.000000 8.356318 
1 1 1   22    1  -71 o   13.232   6.4489 -17.8957   22.502 -17.8957   22.502   0.0000   0.0000   13.232   6.4489  ?   ?  0.000000 6.448867 
1 1 1   22    1  -70 o   17.593   7.9510   13.365   24.326   13.365   24.326   0.0000   0.0000   17.593   7.9510  ?   ?  0.000000 7.951009 
1 1 1   22    1  -69 o   19.734   7.4631   23.396   16.445   32.195   24.184   15.827   22.428   21.308   8.7317   17.931   7.8972 3.377121 11.77319 
1 1 1   22    1  -68 o   11.873   5.3363  -0.3206   10.785   6.5510   13.969 -10.4616   16.970   14.695   6.3555   12.494   5.9640 2.200609 8.715648 
1 1 1   22    1  -67 o   15.366   5.8042   11.090   9.9398   2.3130   13.634   21.048   14.522   13.618   6.0689   19.275   7.0661 -5.656896 9.314588 
1 1 1   22    1  -66 o   9.9632   4.6887  -6.8697   9.7914   4.9665   13.884 -18.5800   13.810   14.399   6.2809   10.236   5.0025 4.163199 8.029649 
1 1 1   22    1  -65 o   22.043   5.6763   24.726   10.261   28.832   14.435   20.532   14.588   22.591   7.0619   19.333   7.0830 3.258106 10.00196 
1 1 1   22    1  -64 o   27.839   4.8238   36.715   10.550   38.145   14.826   35.249   15.016   26.547   6.8166   25.243   7.0355 1.304649 9.796123 
1 1 1   22    1  -63 o   25.976   5.0820   32.364   10.375   17.261   14.517   48.132   14.833   18.433   7.0027   30.844   6.1158 -12.41074 9.297355 
1 1 1   22    1  -62 o   14.025   5.6797   6.7738   10.088   17.182   14.091  -4.1713   14.450   18.474   6.9253   12.894   5.9407 5.579772 9.124223 
1 1 1   22    1  -61 o   11.974   5.3947  -1.6903   11.099  -4.0912   13.992   2.3837   18.226   12.764   5.8678   15.488   6.9509 -2.723948 9.096457 
1 1 1   22    1  -60 o   20.730   6.1171   21.751   11.045   15.972   13.906   31.628   18.180   18.196   6.8669   23.518   7.9665 -5.321926 10.51757 
1 1 1   22    1  -59 o   13.992   5.8277   5.3416   11.013  -7.2661   13.757   27.842   18.378   12.155   5.6674   22.338   7.9819 -10.18264 9.789269 
1 1 1   22    1  -58 o   9.5834   4.5560  -9.5954   9.6974 -15.8430   13.590  -3.1145   13.842   10.753   5.1860   13.038   5.9338 -2.283996 7.880616 
1 1 1   22    1  -57 o   18.937   5.8077   17.384   9.8167   10.911   14.113   23.452   13.664   16.795   6.7472   21.380   6.8935 -4.585106 9.645964 
1 1 1   22    1  -56 f   21.434   6.0286   22.566   10.972   18.436   17.690   25.147   13.987   19.750   7.6712   22.145   6.9557 -2.394691 10.35515 
1 1 1   22    1  -55 o   20.415   6.0967   20.343   10.919   9.8487   17.673   26.823   13.887   17.487   7.3399   22.958   6.8801 -5.470695 10.06032 
1 1 1   22    1  -54 o   25.912   5.2537   31.315   10.717   36.055   17.026   28.205   13.791   26.215   7.5553   23.658   6.7941 2.556770 10.16081 
1 1 1   22    1  -53 o   25.937   4.8517   30.731   9.8806   30.907   14.114   30.561   13.837   24.851   6.7803   24.762   6.6957 0.8883858E-01 9.529140 
1 1 1   22    1  -52 o   48.033   2.5917   96.748   10.110   94.199   15.595   98.597   13.278   46.383   4.1691   48.002   3.4157 -1.618954 5.389653 
1 1 1   22    1  -51 o   39.341   2.9962   65.533   9.5363   77.574   14.829   57.041   12.453   41.955   4.4016   35.965   4.3349 5.989399 6.177821 
1 1 1   22    1  -50 o   34.152   3.4031   49.954   9.3479   30.801   14.276   64.331   12.368   24.991   6.8194   38.455   4.0042 -13.46478 7.908058 
1 1 1   22    1  -49 o   39.440   2.9917   65.739   9.5465   56.230   14.881   72.389   12.445   35.121   5.3681   40.983   3.7673 -5.861500 6.558125 
1 1 1   22    1  -48 o   41.601   2.8451   72.801   9.5899   77.365   14.834   69.523   12.570   42.015   4.3962   40.113   3.8932 1.902161 5.872219 
1 1 1   22    1  -47 o   10.469   4.7122  -2.9137   8.4439  -6.1711   13.314  -0.7217   10.922   12.532   5.7475   12.548   5.5191 -0.1540565E-01 7.968373 
1 1 1   22    1  -46 o   20.023   5.2806   18.451   8.7407   27.978   13.604   11.752   11.407   24.067   6.6923   16.973   6.2558 7.094032 9.160876 
1 1 1   22    1  -45 o   37.194   3.2834   58.718   9.8527   62.859   14.209   54.883   13.674   37.726   4.7239   35.114   4.9113 2.611931 6.814364 
1 1 1   22    1  -44 o   39.061   2.9529   64.210   9.3324   70.379   14.555   59.903   12.161   40.083   4.5343   37.197   4.0775 2.886059 6.098025 
1 1 1   22    1  -43 o   16.419   5.3847   11.805   8.3182   10.547   12.985   12.681   10.833   16.995   6.5803   17.292   6.1334 -0.2967625 8.995491 
1 1 1   22    1  -42 o   16.116   5.4066   11.191   8.3737   7.4940   12.898   13.885   11.010   15.957   6.4363   17.867   6.1949 -1.910175 8.933217 
1 1 1   22    1  -41 o   36.250   2.8736   55.185   8.4219   64.769   11.970   45.789   11.852   38.865   3.8279   32.239   4.6436 6.626541 6.017962 
1 1 1   22    1  -40 f   40.542   2.8080   68.827   9.2223   64.598   12.097   74.696   14.251   38.806   3.8760   41.541   4.2692 -2.734573 5.766207 
1 1 1   22    1  -39 o   31.738   3.7053   43.153   9.4058   31.437   13.151   55.422   13.458   25.895   6.2927   35.494   4.7724 -9.598511 7.897689 
1 1 1   22    1  -38 o   38.212   3.2056   61.597   9.8932   66.758   12.192   51.651   16.928   39.512   3.8336   33.309   6.4676 6.202831 7.518436 
1 1 1   22    1  -37 o   31.523   3.6750   42.479   9.2662   51.497   13.526   34.503   12.720   34.116   5.0131   27.414   5.8692 6.701735 7.718746 
1 1 1   22    1  -36 o   27.244   4.2422   32.326   9.1145   46.936   13.402   19.754   12.432   32.449   5.2457   20.751   6.5631 11.69790 8.401868 
1 1 1   22    1  -35 o   32.445   3.6694   44.900   9.5345   40.908   13.633   48.721   13.339   30.008   5.7833   33.171   5.0960 -3.163260 7.708125 
1 1 1   22    1  -34 o   78.717   1.9649  255.019   12.608  275.868   21.556  244.177   15.544   81.120   3.2666   76.763   2.4875 4.357040 4.105856 
1 1 1   22    1  -33 o   45.865   2.5764   87.405   9.5937   57.068   14.847  109.153   12.571   35.931   5.2218   51.089   3.0322 -15.15821 6.038361 
1 1 1   22    1  -32 o   53.649   2.1225  118.765   9.2639  117.738   13.164  119.773   13.039   53.069   3.0560   53.551   2.9990 -0.4827499 4.281743 
1 1 1   22    1  -31 o   16.699   5.1461   12.184   7.6959   11.058   10.869   13.316   10.898   16.827   6.1219   17.811   6.1641 -0.9837837 8.687556 
1 1 1   22    1  -30 o   27.964   3.6260   33.331   8.0709   29.792   11.442   36.835   11.386   25.680   5.6225   28.886   5.0174 -3.206173 7.535651 
1 1 1   22    1  -29 o   25.732   3.9095   28.479   7.9425   34.751   11.350   22.460   11.119   27.994   5.1639   22.194   6.0025 5.799965 7.918113 
1 1 1   22    1  -28 o   33.592   3.0347   47.288   8.2201   48.493   11.855   46.172   11.408   33.511   4.4495   32.712   4.3890 0.7991753 6.249915 
1 1 1   22    1  -27 o   30.113   3.2909   38.246   7.9466   50.256   11.548   27.444   10.952   34.224   4.2293   24.688   5.5746 9.536480 6.997368 
1 1 1   22    1  -26 o   49.670   2.6310  102.325   10.615   82.461   15.451  120.079   14.607   43.894   4.3766   53.532   3.3645 -9.638588 5.520367 
1 1 1   22    1  -25 o   11.822   4.8708   2.3390   7.5781 -11.0008   10.853   15.030   10.586   10.390   4.9040   18.623   6.0725 -8.232169 7.805392 
1 1 1   22    1  -24 o   36.376   3.1128   55.388   9.1416   53.690   11.954   57.780   14.187   35.425   4.2228   36.484   4.8936 -1.058334 6.463682 
1 1 1   22    1  -23 f   9.8591   4.5251  -5.3208   8.2750 -31.7432   12.794   13.683   10.850   8.8365   4.4065   18.071   6.1540 -9.234638 7.568923 
1 1 1   22    1  -22 o   34.599   3.2452   50.224   9.0457   44.692   12.012   57.472   13.749   32.107   4.7312   36.479   4.7352 -4.372433 6.693722 
1 1 1   22    1  -21 o   72.919   2.0519  218.677   12.184  232.919   17.503  205.288   16.971   74.939   2.8707   70.304   2.9681 4.634056 4.129179 
1 1 1   22    1  -20 o   47.622   2.4827   93.775   9.6044   83.505   12.848  106.783   14.460   44.589   3.5645   50.465   3.5375 -5.876022 5.021881 
1 1 1   22    1  -19 o   34.640   3.4341   50.451   9.5693   41.667   13.672   58.885   13.398   30.639   5.6835   37.055   4.5297 -6.415533 7.267786 
1 1 1   22    1  -18 o   29.331   3.7046   36.481   8.6600   45.161   13.404   30.262   11.346   32.095   5.3087   26.085   5.5092 6.010281 7.650701 
1 1 1   22    1  -17 o   31.047   3.7028   40.797   9.1863   51.446   15.819   35.379   11.284   34.049   5.9141   28.433   5.0537 5.616245 7.779269 
1 1 1   22    1  -16 o   55.625   2.3365  127.574   10.571  122.729   18.018  130.117   13.053   53.903   4.1321   56.016   2.8683 -2.112835 5.030049 
1 1 1   22    1  -15 o   63.550   2.1517  166.145   11.130  170.622   16.235  162.174   15.289   64.077   3.1176   62.508   3.0095 1.568905 4.333137 
1 1 1   22    1  -14 o   15.516   5.3457   9.5847   8.1928   12.181   12.657   7.7121   10.748   17.991   6.5966   15.605   6.0013 2.386225 8.918008 
1 1 1   22    1  -13 f   31.035   3.4459   40.524   8.5708   52.138   13.115   31.866   11.323   34.811   4.7452   26.881   5.3559 7.929939 7.155594 
1 1 1   22    1  -12 o   90.198   2.0633  334.007   15.170  379.308   24.474  305.741   19.332   95.614   3.1445   86.008   2.7610 9.605644 4.184608 
1 1 1   22    1  -11 f   83.793   1.9503  288.016   13.321  288.431   23.270  287.814   16.247   83.226   3.4374   83.597   2.3866 -0.3708954 4.184734 
1 1 1   22    1  -10 o   37.254   2.9515   57.736   8.8898   72.604   13.553   46.508   11.777   41.454   4.0630   32.952   4.5022 8.501942 6.064453 
1 1 1   22    1   -9 o   31.944   3.3901   42.828   8.6928   36.617   13.162   47.633   11.577   28.724   5.8212   33.410   4.3543 -4.686581 7.269523 
1 1 1   22    1   -8 o   38.157   2.9588   60.543   9.1310   50.735   13.825   68.132   12.161   34.226   5.1119   40.259   3.7487 -6.033451 6.339099 
1 1 1   22    1   -7 f   30.645   3.5889   39.582   8.7955   22.056   13.275   53.297   11.743   22.256   6.7394   35.446   4.1423 -13.18965 7.910618 
1 1 1   22    1   -6 o   43.022   2.6574   76.587   9.2737   97.659   14.352   61.481   12.151   48.290   3.6735   38.163   3.9637 10.12684 5.404236 
1 1 1   22    1   -5 o   58.141   2.3091  139.183   10.922  140.913   15.567  137.505   15.328   58.200   3.2947   57.494   3.2842 0.7065735 4.652047 
1 1 1   22    1   -4 o   20.998   5.2991   19.487   9.0688   32.960   13.428   8.1883   12.297   27.115   6.2093   16.436   6.3924 10.67916 8.911704 
1 1 1   22    1   -3 o   31.101   3.7590   40.861   9.3367   45.485   13.752   36.907   12.717   32.275   5.4189   28.943   5.5926 3.331749 7.787333 
1 1 1   22    1   -2 o   18.340   5.8959   14.302   10.001   4.3882   16.781   19.762   12.454   17.089   7.1612   21.200   6.5486 -4.111149 9.703956 
1 1 1   22    1   -1 o   52.791   2.7138  115.217   11.639  113.966   19.456  115.914   14.524   51.799   4.6575   52.740   3.3965 -0.9412994 5.764401 
1 1 1   22    1    0 o   40.727   3.8296   69.754   12.564   86.674   18.256   54.526   17.319   44.950   5.0709   35.041   6.2945 9.908913 8.083005 
1 1 1   22    1    1 o   39.537   3.9742   65.925   12.635   55.364   17.985   76.217   17.754   35.222   6.5036   42.022   5.3006 -6.799908 8.390068 
1 1 1   22    1    2 o   45.796   3.1215   87.198   11.583   95.075   14.965   75.428   18.293   47.575   3.8929   41.706   5.5159 5.869167 6.751286 
1 1 1   22    1    3 o   32.478   4.1467   44.827   10.728   40.144   13.725   52.181   17.198   30.140   5.7971   34.211   6.4023 -4.070610 8.636904 
1 1 1   22    1    4 o   11.804   5.1071  -0.5165   9.0268  -1.7834   12.953   0.6796   12.586   13.742   6.0285   14.198   6.0854 -0.4560432 8.565937 
1 1 1   22    1    5 o   54.994   2.4358  124.689   10.892  131.370   15.764  118.586   15.068   56.129   3.4623   53.309   3.4866 2.819710 4.913639 
1 1 1   22    1    6 o   86.470   1.9526  306.647   13.763  306.408   19.802  306.871   19.143   86.101   2.8251   86.207   2.7275 -0.1057281 3.926950 
1 1 1   22    1    7 f   39.471   3.4422   65.193   10.965   72.265   14.421   55.504   16.879   41.263   4.3531   35.439   6.0608 5.824741 7.462029 
1 1 1   22    1    8 o   20.497   5.7512   18.600   9.9981   14.896   13.299   23.416   15.162   19.258   6.7992   22.941   7.2469 -3.682652 9.937129 
1 1 1   22    1    9 o   50.159   2.8414  104.239   11.570  101.419   15.012  108.366   18.160   49.170   3.7742   50.561   4.4516 -1.391117 5.836211 
1 1 1   22    1   10 o   62.364   2.4469  160.351   12.415  160.206   16.295  160.551   19.167   62.074   3.2315   61.901   3.8171 0.1729393 5.001343 
1 1 1   22    1   11 f   35.164   3.6619   52.057   10.343   53.966   16.313   50.774   13.374   34.957   5.9370   34.292   4.9258 0.6648293 7.714311 
1 1 1   22    1   12 o   27.840   4.6158   33.508   10.108   54.825   16.607   20.963   12.740   35.202   6.0025   21.711   6.6080 13.49099 8.927253 
1 1 1   22    1   13 f   63.612   2.4107  166.821   12.477  144.044   19.651  182.208   16.151   58.446   4.1517   66.282   2.9971 -7.836365 5.120414 
1 1 1   22    1   14 o   78.340   2.2039  252.468   14.060  278.872   22.864  236.413   17.829   81.805   3.4365   75.551   2.9004 6.253899 4.496886 
1 1 1   22    1   15 o   18.131   5.8918   13.993   9.9699  -1.2942   15.714   24.292   12.898   15.178   6.6498   23.182   6.5421 -8.004055 9.328401 
1 1 1   22    1   16 o   57.527   2.3928  136.508   11.196  143.112   16.120  130.353   15.562   58.557   3.3917   55.860   3.4343 2.696358 4.826822 
1 1 1   22    1   17 o   34.190   3.5645   49.244   9.7886   59.153   14.086   39.989   13.613   37.063   4.7730   29.986   5.7786 7.076319 7.494934 
1 1 1   22    1   18 o   31.496   3.8017   42.069   9.5634   36.221   13.869   47.370   13.204   28.340   6.1784   32.982   5.0737 -4.641621 7.994680 
1 1 1   22    1   19 o   29.878   4.0082   38.089   9.5158   41.810   13.680   34.600   13.246   30.695   5.6763   27.728   6.0322 2.967468 8.282961 
1 1 1   22    1   20 o   14.971   5.7168   7.2970   9.7069   7.6479   13.150   6.8770   14.389   16.472   6.5479   16.705   6.7765 -0.2329197 9.423171 
1 1 1   22    1   21 o   31.586   4.1612   42.685   10.453   26.210   14.093   62.833   15.586   23.911   6.8686   37.988   5.1669 -14.07663 8.595034 
1 1 1   22    1   22 o   59.608   2.7513  147.308   13.333  163.103   19.552  133.580   18.228   62.222   3.8741   56.225   4.0033 5.996788 5.570886 
1 1 1   22    1   23 f   52.681   2.9348  115.435   12.553  123.630   18.497  108.438   17.092   53.949   4.2403   50.532   4.1870 3.416592 5.959116 
1 1 1   22    1   24 o   62.613   2.4355  161.982   12.407  182.446   19.955  149.087   15.840   65.866   3.7320   59.742   3.2652 6.124767 4.958733 
1 1 1   22    1   25 o   45.716   2.7725   86.866   10.283   75.010   15.127   97.052   14.021   41.800   4.5111   48.017   3.6086 -6.217140 5.776808 
1 1 1   22    1   26 o   19.364   5.5767   16.744   9.2790   14.834   13.687   18.368   12.623   19.105   6.8808   20.368   6.6302 -1.263067 9.555377 
1 1 1   22    1   27 o   62.810   2.2731  162.815   11.619  154.885   16.780  170.119   16.105   60.794   3.3997   63.867   3.1027 -3.072601 4.602682 
1 1 1   22    1   28 o   47.445   2.7008   93.517   10.402   94.258   15.229   92.870   14.242   47.106   4.0040   46.868   3.7594 0.2386436 5.492269 
1 1 1   22    1   29 o   12.075   5.1673   0.6124   9.0480   6.8821   13.388  -4.6583   12.275   16.199   6.5491   12.533   5.6576 3.665977 8.654463 
1 1 1   22    1   30 o   12.807   5.3254   2.5672   9.1740  -9.6203   13.481   13.078   12.520   12.173   5.6535   18.094   6.5721 -5.920967 8.669141 
1 1 1   22    1   31 o   27.657   4.4069   33.288   9.6020   35.260   14.230   31.639   13.010   27.611   6.4410   26.235   6.1854 1.375835 8.930027 
1 1 1   22    1   32 o   51.475   2.8704  110.466   11.996  108.445   15.553  113.435   18.849   50.578   3.8002   51.313   4.5535 -0.7344589 5.930905 
1 1 1   22    1   33 o   55.777   2.6640  129.303   12.077  136.954   20.392  125.170   14.989   56.439   4.4690   54.552   3.3874 1.886623 5.607747 
1 1 1   22    1   34 o   40.884   3.3821   70.534   11.171   61.377   18.655   75.653   13.948   36.506   6.5075   42.010   4.1262 -5.503895 7.705364 
1 1 1   22    1   35 o   62.681   2.5111  163.000   12.804  173.197   20.548  156.527   16.372   63.788   3.9715   61.032   3.3031 2.755665 5.165547 
1 1 1   22    1   36 o   50.634   2.8859  107.126   11.862  105.631   15.264  109.404   18.849   49.843   3.7852   50.206   4.6589 -0.3631783 6.002734 
1 1 1   22    1   37 o   41.719   2.9542   72.949   9.9812   65.869   14.810   78.842   13.511   38.778   4.7868   42.950   3.9016 -4.172359 6.175382 
1 1 1   22    1   38 o   16.608   6.3210   10.121   11.842   26.120   17.660  -2.9505   15.963   23.389   7.8517   14.597   6.5315 8.791893 10.21320 
1 1 1   22    1   39 o   22.525   6.7704   23.973   13.433   41.911   17.959   1.1903   20.239   29.289   7.4926   17.068   7.5101 12.22069 10.60849 
1 1 1   22    1   40 f   47.574   3.4536   95.887   13.302  101.656   19.932   91.255   17.862   47.890   5.1885   45.558   4.8860 2.332222 7.126983 
1 1 1   22    1   41 o   27.079   4.8865   32.772   10.389   32.407   17.161   32.983   13.053   25.627   7.6406   26.547   6.1526 -0.9197025 9.809875 
1 1 1   22    1   42 o   16.425   5.6952   11.440   9.3050   28.738   13.952  -2.4179   12.488   24.467   6.7677   13.002   5.8002 11.46509 8.913169 
1 1 1   22    1   43 o   26.551   4.6269   31.326   9.6501   34.484   14.069   28.520   13.261   26.930   6.4866   24.447   6.5307 2.482628 9.204694 
1 1 1   22    1   44 o   32.320   3.7833   44.989   9.7788   67.350   14.636   26.960   13.143   39.113   4.6836   23.740   6.5691 15.37382 8.067822 
1 1 1   22    1   45 o   11.124   4.9545  -2.1035   9.0730  -6.4194   13.518   1.4346   12.239   12.621   5.7895   13.828   5.9647 -1.206570 8.312428 
1 1 1   22    1   46 o   34.862   3.5399   52.008   9.9203   62.510   14.606   43.015   13.516   37.489   4.8966   30.598   5.6262 6.890339 7.458596 
1 1 1   22    1   47 o   13.377   5.3994   4.7578   9.0838   13.645   13.490  -2.6136   12.287   18.122   6.7796   12.783   5.7242 5.339423 8.872921 
1 1 1   22    1   48 o   48.518   2.6635   98.550   10.493  105.331   15.372   92.632   14.360   49.473   3.8418   46.386   3.8318 3.087299 5.426123 
1 1 1   22    1   49 o   17.111   5.6665   13.135   9.2038   14.177   13.406   12.206   12.658   18.223   6.7699   17.343   6.5502 0.8807793 9.420023 
1 1 1   22    1   50 o   11.449   5.0390  -0.8491   9.1181  -1.1876   13.535  -0.5677   12.338   13.650   6.0670   13.241   5.8434 0.4090281 8.423429 
1 1 1   22    1   51 o   15.963   5.6340   10.920   9.1310   14.930   13.795   7.7931   12.182   18.479   6.8669   15.583   6.2658 2.895835 9.295949 
1 1 1   22    1   52 o   15.274   5.6244   9.4641   9.2170   2.2773   13.646   15.493   12.499   14.471   6.2702   18.448   6.5835 -3.976953 9.091637 
1 1 1   22    1   53 o   13.281   5.3572   5.0300   8.9356   2.7962   13.278   6.8793   12.081   14.415   6.2152   15.159   6.1868 -0.7442951 8.769555 
1 1 1   22    1   54 o   11.781   5.1063   0.6467   9.0563   10.013   13.365  -7.3057   12.315   16.517   6.5895   11.622   5.3996 4.894834 8.519245 
1 1 1   22    1   55 o   13.685   5.7279   4.1907   10.716   24.715   15.903 -12.8795   14.503   21.898   7.4505   11.735   5.5768 10.16276 9.306527 
1 1 1   22    1   56 f   22.971   5.9576   25.824   11.249   3.1984   16.649   44.826   15.258   15.564   6.8312   30.107   6.4135 -14.54291 9.370057 
1 1 1   22    1   57 o   16.971   6.0903   13.149   10.712   17.900   16.281   9.5230   14.224   19.347   7.3999   16.399   6.7055 2.948324 9.986105 
1 1 1   22    1   58 o   32.353   4.3731   47.257   11.238   50.404   16.781   44.698   15.133   31.458   6.7463   29.873   6.4068 1.585716 9.303741 
1 1 1   22    1   59 o   45.463   3.3885   89.606   12.467   78.079   18.410   99.369   16.943   40.256   5.7755   46.861   4.4904 -6.605240 7.315786 
1 1 1   22    1   60 o   20.153   6.7562   21.067   13.076   8.3285   16.210   44.803   22.128   16.331   6.9501   27.061   8.7762 -10.72998 11.19493 
1 1 1   22    1   61 o   16.160   6.5586   10.277   13.487   19.414   16.823  -6.1541   22.561   19.427   7.4985   15.327   7.1827 4.099781 10.38358 
1 1 1   22    1   62 o   11.951   5.5665  -6.3817   13.216   4.4156   16.371 -26.5874   22.394   15.312   6.7451   12.917   6.3247 2.395185 9.246516 
1 1 1   22    1   63 o   20.588   6.8931   22.898   13.612   6.8406   16.564   56.298   23.889   15.831   6.8834   29.561   9.0587 -13.72989 11.37724 
1 1 1   22    1   64 o   30.438   5.8845   46.554   14.072   49.479   17.188   40.610   24.507   30.048   7.1262   24.384   9.1344 5.663652 11.58539 
1 1 1   22    1   65 o   25.615   5.6084   32.930   11.385   45.096   16.824   22.651   15.464   28.296   7.2591   20.027   7.2996 8.269051 10.29461 
1 1 1   22    1   66 o   26.859   7.1442   40.888   15.913   0.0000   0.0000   40.888   15.913  ?   ?    26.859   7.1442 0.000000 7.144222 
1 1 1   22    1   67 o   14.057   5.8108   7.0770   10.833  -8.8389   15.905   20.851   14.797   12.378   5.8702   19.184   7.1151 -6.806177 9.224113 
1 1 1   22    1   68 o   9.2110   4.4665 -13.0367   10.433  -3.7192   15.386 -20.9667   14.194   12.973   6.0302   10.078   4.9549 2.895669 7.804737 
1 1 1   22    1   69 o   12.085   5.6676  -5.8817   14.093   13.465   21.660 -20.0863   18.559   17.419   7.7121   11.866   5.7989 5.553113 9.649009 
1 1 1   22    1   70 o   13.999   6.2274   3.6577   14.292  -0.4272   21.053   7.1489   19.463   14.972   6.9907   15.879   7.1499 -0.9071226 9.999506 
1 1 1   22    1   71 o   16.476   7.3457   10.153   19.999   0.0000   0.0000   10.153   19.999  ?   ?    16.476   7.3457 0.000000 7.345718 
1 1 1   22    1   72 o   22.661   8.3805   35.979   20.501   0.0000   0.0000   35.979   20.501  ?   ?    22.661   8.3805 0.000000 8.380468 
1 1 1   22    1   73 o   21.097   8.1782   30.712   20.076   0.0000   0.0000   30.712   20.076  ?   ?    21.097   8.1782 0.000000 8.178183 
1 1 1   22    1   74 o   15.228   7.0009   4.2855   19.919   0.0000   0.0000   4.2855   19.919  ?   ?    15.228   7.0009 0.000000 7.000892 
1 1 1   22    1   75 o   13.815   6.5438  -4.4880   19.650   0.0000   0.0000  -4.4880   19.650  ?   ?    13.815   6.5438 0.000000 6.543756 
1 1 1   22    1   76 o   13.163   6.0338   0.1758   14.651 -20.6539   21.357   18.691   20.135   12.459   6.1160   17.863   7.6773 -5.404401 9.815666 
1 1 1   22    1   77 f   10.642   5.1655 -14.1507   14.042 -20.4659   20.261  -8.3149   19.477   12.126   5.9537   13.214   6.3299 -1.088078 8.689897 
1 1 1   22    1   78 o   9.3905   4.6804 -26.8290   14.361 -24.0839   20.757 -29.3495   19.889   11.917   5.8844   11.213   5.5756 0.7036800 8.106423 
1 1 1   22    1   79 o   17.157   7.6143   16.072   21.240   16.072   21.240   0.0000   0.0000   17.157   7.6143  ?   ?  0.000000 7.614345 
1 1 1   22    1   80 f   15.137   7.0615   3.9781   21.404   3.9781   21.404   0.0000   0.0000   15.137   7.0615  ?   ?  0.000000 7.061467 
1 1 1   22    1   81 o   16.639   7.5233   13.568   21.809   13.568   21.809   0.0000   0.0000   16.639   7.5233  ?   ?  0.000000 7.523271 
1 1 1   22    1   84 o   13.369   6.5855 -17.8248   25.467 -17.8248   25.467   0.0000   0.0000   13.369   6.5855  ?   ?  0.000000 6.585480 
1 1 1   22    1   85 o   13.587   6.6900 -16.9288   26.182 -16.9288   26.182   0.0000   0.0000   13.587   6.6900  ?   ?  0.000000 6.690001 
1 1 1   22    1   86 o   11.750   5.9032 -39.7655   25.033 -39.7655   25.033   0.0000   0.0000   11.750   5.9032  ?   ?  0.000000 5.903206 
1 1 1   22    2  -66 o   15.673   7.2998   2.5904   22.723   2.5904   22.723   0.0000   0.0000   15.673   7.2998  ?   ?  0.000000 7.299764 
1 1 1   22    2  -65 o   15.367   6.3394   10.208   12.859   18.627   15.958  -5.3807   21.714   18.179   7.2175   14.437   6.8501 3.741913 9.950694 
1 1 1   22    2  -64 o   13.478   5.9560   3.1699   12.859   4.2734   16.016   1.1684   21.571   14.625   6.5434   15.356   7.1384 -0.7304859 9.683672 
1 1 1   22    2  -63 o   20.171   6.1341   21.951   10.981   24.180   14.159   18.587   17.395   20.404   7.0276   18.334   7.4457 2.070894 10.23850 
1 1 1   22    2  -62 o   14.505   5.9061   8.3007   10.978   11.800   14.157   3.0229   17.387   16.222   6.6678   14.841   6.7132 1.381001 9.461854 
1 1 1   22    2  -61 o   11.413   5.2121  -2.5586   10.796  -2.8102   13.821  -2.1650   17.289   12.663   5.8254   13.969   6.4580 -1.305956 8.697170 
1 1 1   22    2  -60 o   30.150   4.8042   43.170   11.411   24.366   14.511   73.646   18.474   20.754   7.1156   37.885   6.1960 -17.13068 9.435123 
1 1 1   22    2  -59 o   15.302   6.0162   9.9664   10.990   1.8571   13.917   23.398   17.911   13.810   6.1442   20.250   7.7575 -6.440632 9.895922 
1 1 1   22    2  -58 o   14.264   6.0713   5.4171   12.373   1.6061   17.746   9.0217   17.259   15.029   6.7917   16.459   7.0912 -1.430268 9.818994 
1 1 1   22    2  -57 o   28.345   5.7821   39.881   12.906   23.784   18.691   54.551   17.843   20.605   7.9166   31.935   7.0440 -11.32992 10.59667 
1 1 1   22    2  -56 o   8.1179   3.9869 -15.9277   9.1074 -26.4566   17.072 -11.7393   10.768   10.983   5.4068   9.7686   4.6865 1.214676 7.155238 
1 1 1   22    2  -55 o   19.936   5.4701   19.506   9.1563   14.458   14.753   22.669   11.677   17.729   6.9706   20.999   6.3126 -3.269962 9.404205 
1 1 1   22    2  -54 f   8.2605   4.0224 -13.3428   8.7018 -23.2690   14.096  -7.2310   11.061   10.031   4.9330   10.788   5.0471 -0.7577696 7.057437 
1 1 1   22    2  -53 o   43.137   2.8103   79.171   9.8280   81.741   15.596   77.478   12.657   42.412   4.5839   42.008   3.7353 0.4041519 5.913084 
1 1 1   22    2  -52 o   13.948   5.4333   7.1383   8.8942   9.8409   14.299   5.4329   11.359   16.447   6.7240   14.209   5.9183 2.238329 8.957552 
1 1 1   22    2  -51 o   12.231   5.1601   2.6593   8.8054   10.810   14.126  -2.5199   11.261   16.772   6.7461   12.009   5.4201 4.762752 8.653742 
1 1 1   22    2  -50 o   8.3588   4.0568 -12.8765   8.6543 -29.4634   13.781  -2.0755   11.121   9.3263   4.6380   12.075   5.4235 -2.748553 7.136236 
1 1 1   22    2  -49 o   14.656   5.4619   8.6330   8.7395   9.6173   14.093   8.0178   11.141   16.513   6.7035   15.137   6.0238 1.375667 9.012380 
1 1 1   22    2  -48 o   45.149   2.6543   85.827   9.7255   82.576   15.498   87.940   12.491   43.043   4.4827   45.238   3.4125 -2.194633 5.633818 
1 1 1   22    2  -47 o   32.028   3.8441   44.842   9.8355   44.200   14.873   45.342   13.112   30.233   6.2419   31.288   5.3321 -1.055010 8.209282 
1 1 1   22    2  -46 o   11.942   5.0684   1.8324   8.5797   15.452   14.052  -6.2626   10.833   18.608   6.9276   11.055   5.1113 7.552256 8.609127 
1 1 1   22    2  -45 o   28.208   3.9956   34.953   8.9305   37.736   14.622   33.297   11.278   27.771   6.5638   26.794   5.3513 0.9774380 8.468787 
1 1 1   22    2  -44 o   23.221   4.8168   24.570   8.8182   19.554   13.840   27.998   11.441   20.254   6.9489   24.288   5.8491 -4.034344 9.082958 
1 1 1   22    2  -43 o   16.216   5.7150   11.290   9.3929   13.582   13.613   9.2073   12.977   18.003   6.7942   16.337   6.5013 1.665545 9.403632 
1 1 1   22    2  -42 o   40.927   3.1578   71.053   10.454   59.980   14.863   81.894   14.706   36.433   5.1478   43.314   4.2185 -6.880478 6.655491 
1 1 1   22    2  -41 o   11.961   5.1875   0.2990   9.3580   5.9466   13.653  -4.7052   12.852   15.610   6.4942   12.576   5.7214 3.034198 8.654977 
1 1 1   22    2  -40 o   42.193   2.6249   74.514   8.9834   59.312   12.903   88.814   12.514   36.759   4.3932   45.694   3.3838 -8.934963 5.545321 
1 1 1   22    2  -39 o   49.486   2.3208  101.797   9.3359   94.161   13.435  108.928   12.983   46.990   3.5333   50.782   3.1518 -3.792633 4.734796 
1 1 1   22    2  -38 o   42.617   2.5653   75.857   8.8702   63.229   12.686   87.937   12.407   38.151   4.1458   45.508   3.3685 -7.356918 5.341781 
1 1 1   22    2  -37 o   24.340   4.5403   26.407   8.6773   43.250   13.629   14.926   11.253   30.689   5.6566   18.306   6.2663 12.38313 8.441758 
1 1 1   22    2  -36 o   26.883   3.8259   31.331   8.1476   28.971   11.788   33.489   11.274   24.897   5.8992   27.129   5.2884 -2.231375 7.922617 
1 1 1   22    2  -35 o   8.9996   4.2109  -6.6858   7.7046  -8.2620   11.204  -5.2719   10.612   10.993   5.1220   11.279   5.1572 -0.2858067 7.268533 
1 1 1   22    2  -34 o   23.643   4.3764   24.756   8.1239   17.720   11.816   31.063   11.187   19.648   6.4162   26.055   5.4432 -6.406727 8.414036 
1 1 1   22    2  -33 o   55.142   2.1475  125.832   9.6343  129.697   13.772  122.128   13.482   55.559   3.0527   53.893   3.0819 1.665607 4.337850 
1 1 1   22    2  -32 o   14.165   5.2970   7.3029   8.2334  -4.3098   11.277   20.561   12.049   11.913   5.3958   20.978   6.4344 -9.065215 8.397413 
1 1 1   22    2  -31 o   23.929   4.5357   25.413   8.5233   33.954   11.762   15.968   12.368   27.306   5.4752   19.004   6.5672 8.301596 8.550186 
1 1 1   22    2  -30 o   20.277   5.3885   18.786   9.0575   7.0051   12.927   30.146   12.694   15.865   6.4277   25.385   6.1910 -9.520335 8.924317 
1 1 1   22    2  -29 o   13.331   5.5013   3.5535   9.6882   6.2204   12.855   0.0474   14.739   15.605   6.3770   14.711   6.4429 0.8935003 9.065177 
1 1 1   22    2  -28 o   19.591   5.4143   17.464   8.9341   2.9440   12.855   31.029   12.425   14.642   6.2086   25.885   6.0052 -11.24302 8.637663 
1 1 1   22    2  -27 o   43.852   2.8397   80.408   10.096   70.121   14.360   90.464   14.198   40.201   4.4569   46.070   3.8148 -5.869202 5.866589 
1 1 1   22    2  -26 o   23.765   4.5514   24.982   8.4960   22.883   11.604   27.407   12.473   22.206   6.1833   24.241   6.2667 -2.035658 8.803727 
1 1 1   22    2  -25 o   26.483   4.1855   30.520   8.7357   22.906   13.730   35.698   11.323   22.157   6.8814   28.292   5.0973 -6.134464 8.563630 
1 1 1   22    2  -24 f   49.704   2.2795  102.251   9.2109  101.343   13.304  103.087   12.765   49.053   3.3473   49.554   3.1769 -0.5008278 4.614833 
1 1 1   22    2  -23 o   52.162   2.5194  112.944   10.681  138.911   18.768  100.505   12.990   57.064   4.0612   48.891   3.2783 8.173477 5.219311 
1 1 1   22    2  -22 o   11.118   4.9084  -1.6600   8.7142  -2.0523   15.154  -1.4662   10.651   14.512   6.4366   12.358   5.4424 2.153952 8.429082 
1 1 1   22    2  -21 f   24.686   5.1839   27.322   10.099   3.8696   15.153   46.062   13.545   15.955   6.7519   32.156   5.3559 -16.20173 8.618203 
1 1 1   22    2  -20 o   12.051   5.2292  -0.2715   9.5188  -6.4188   15.279   3.6279   12.169   13.683   6.2303   14.627   6.1117 -0.9437017 8.727502 
1 1 1   22    2  -19 o   28.942   3.7550   35.814   8.6502   31.263   13.564   38.933   11.230   25.960   6.4410   29.788   4.7871 -3.827631 8.025168 
1 1 1   22    2  -18 o   19.962   5.1408   17.885   8.4157   30.790   13.299   9.2663   10.869   25.804   6.3632   16.090   6.0712 9.714046 8.794865 
1 1 1   22    2  -17 o   39.566   2.8615   65.344   9.1665   72.784   14.317   60.174   11.933   41.168   4.3311   37.557   3.9573 3.610394 5.866714 
1 1 1   22    2  -16 o   17.778   5.5751   13.865   8.9891   17.609   15.553   11.986   11.015   20.413   7.3371   17.274   6.1787 3.138971 9.592200 
1 1 1   22    2  -15 o   30.627   3.5740   39.829   8.7552   29.956   13.615   46.789   11.432   25.427   6.5340   32.923   4.3675 -7.496170 7.859251 
1 1 1   22    2  -14 o   31.801   3.4906   42.815   8.8998   40.528   14.160   44.308   11.443   29.896   6.0189   31.972   4.5161 -2.075714 7.524795 
1 1 1   22    2  -13 o   32.138   3.4227   43.648   8.8288   45.108   14.080   42.702   11.334   31.770   5.6436   31.362   4.5675 0.4078903 7.260353 
1 1 1   22    2  -12 o   34.269   3.2742   49.419   9.0353   50.352   14.344   48.805   11.633   33.731   5.3988   33.663   4.3405 0.6761551E-01 6.927262 
1 1 1   22    2  -11 o   10.446   4.6972  -3.2998   8.3682  -2.6358   13.096  -3.7580   10.879   13.457   5.9754   11.950   5.3661 1.507200 8.031237 
1 1 1   22    2  -10 o   23.323   4.7190   23.988   8.6632   26.713   13.336   21.999   11.395   24.054   6.6022   21.979   6.1299 2.074265 9.009154 
1 1 1   22    2   -9 o   20.163   5.5323   18.263   9.3660   42.652   16.672   7.0159   11.321   30.299   6.9047   15.454   6.0970 14.84512 9.211290 
1 1 1   22    2   -8 o   9.8025   4.5642  -7.3002   8.8736  -5.4485   16.030  -8.1183   10.655   14.309   6.4618   10.823   5.0265 3.486158 8.186639 
1 1 1   22    2   -7 f   38.148   3.2487   61.072   10.006   61.296   17.745   60.968   12.116   36.945   6.1052   37.843   3.9876 -0.8977547 7.292079 
1 1 1   22    2   -6 o   46.505   2.7758   89.912   10.475   87.764   18.954   90.857   12.569   44.819   5.2899   46.549   3.3344 -1.729885 6.253120 
1 1 1   22    2   -5 o   23.946   4.5624   25.124   8.5807   50.032   13.969   10.030   10.874   33.725   5.2524   16.466   6.1009 17.25842 8.050364 
1 1 1   22    2   -4 o   19.513   5.5920   17.015   9.3522   15.092   13.229   18.936   13.223   19.114   6.7781   20.680   6.7895 -1.566107 9.593728 
1 1 1   22    2   -3 o   27.078   4.4682   31.863   9.5189   45.727   13.550   18.355   13.375   32.173   5.3548   20.458   6.8325 11.71548 8.680869 
1 1 1   22    2   -2 o   24.213   4.9845   25.960   9.5100   40.967   13.431   10.871   13.468   30.292   5.6469   17.608   6.7313 12.68372 8.786262 
1 1 1   22    2   -1 o   22.166   5.2956   21.995   9.4370   15.819   13.244   28.366   13.450   19.411   6.7905   24.820   6.5527 -5.409164 9.436582 
1 1 1   22    2    0 o   23.204   4.6621   23.679   8.5120   8.1479   13.058   35.155   11.225   16.536   6.5405   28.248   5.0606 -11.71147 8.269664 
1 1 1   22    2    1 o   39.162   3.3143   64.387   10.481   82.568   14.744   45.818   14.901   44.035   4.1568   31.940   5.9420 12.09470 7.251663 
1 1 1   22    2    2 o   13.783   5.3279   5.8381   8.5024   5.2230   13.252   6.2685   11.085   15.677   6.4482   15.103   6.0092 0.5741396 8.814185 
1 1 1   22    2    3 o   40.502   2.8538   68.337   9.3614   75.728   14.778   63.383   12.098   42.057   4.3746   38.639   3.8943 3.417618 5.856802 
1 1 1   22    2    4 o   46.275   2.7652   89.004   10.383   86.007   15.073   91.710   14.324   44.942   4.1617   46.579   3.8057 -1.637470 5.639393 
1 1 1   22    2    5 o   74.993   2.0670  231.491   12.624  244.821   18.352  219.520   17.391   76.742   2.9392   72.661   2.9423 4.080864 4.158866 
1 1 1   22    2    6 o   59.860   2.3382  147.981   11.387  161.844   16.639  135.768   15.618   62.211   3.2928   56.926   3.3810 5.285484 4.719484 
1 1 1   22    2    7 f   11.930   5.1335   0.1619   9.0228 -13.8835   13.229   12.380   12.338   11.316   5.3626   17.828   6.5168 -6.512646 8.439570 
1 1 1   22    2    8 o   19.253   5.5352   16.554   9.1491   13.261   13.559   19.307   12.397   18.475   6.8185   20.750   6.5525 -2.274984 9.456574 
1 1 1   22    2    9 o   40.017   3.1322   67.048   10.136   89.573   15.195   48.992   13.605   45.878   4.1066   33.388   5.1655 12.48990 6.598975 
1 1 1   22    2   10 o   14.090   5.4985   5.9245   9.1223   5.7294   13.583   6.0848   12.312   15.943   6.5397   15.535   6.2804 0.4079952 9.067065 
1 1 1   22    2   11 o   70.260   2.1439  203.425   12.264  192.186   17.688  213.832   17.020   67.829   3.2081   71.704   2.9180 -3.874397 4.336686 
1 1 1   22    2   12 o   23.230   5.4394   24.284   10.117   22.049   13.564   27.087   15.190   21.984   6.8416   24.105   7.1889 -2.121124 9.924080 
1 1 1   22    2   13 o   54.995   2.6718  125.528   11.942  127.785   15.969  122.664   17.985   55.102   3.5747   53.694   4.1412 1.407764 5.470627 
1 1 1   22    2   14 o   15.585   6.0015   8.0101   10.759   2.9537   13.320   17.502   18.250   15.000   6.3382   20.910   7.8721 -5.910766 10.10653 
1 1 1   22    2   15 o   22.026   5.9753   22.119   10.998   33.449   13.808   2.4542   18.191   26.938   6.3860   16.863   7.2728 10.07501 9.678586 
1 1 1   22    2   16 o   15.478   5.7955   8.5894   9.8629   15.002   13.494   1.2341   14.452   19.059   6.8361   15.034   6.4832 4.025706 9.421448 
1 1 1   22    2   17 o   65.074   3.9838  179.590   21.031  179.590   21.031   0.0000   0.0000   65.074   3.9838  ?   ?  0.000000 3.983817 
1 1 1   22    2   18 o   28.736   4.4808   35.959   10.154   44.241   17.008   31.374   12.656   30.733   6.9524   26.173   6.0530 4.560057 9.218194 
1 1 1   22    2   19 o   38.330   3.4234   62.004   10.584   44.542   17.521   72.037   13.280   30.724   7.1331   41.081   4.0170 -10.35715 8.186466 
1 1 1   22    2   20 o   36.181   3.4076   55.301   9.9318   57.113   14.918   53.859   13.310   35.951   5.2450   35.126   4.7718 0.8245621 7.090889 
1 1 1   22    2   21 f   34.586   3.5541   50.749   9.8775   45.378   14.685   55.186   13.348   31.632   5.9127   35.574   4.7195 -3.942892 7.565247 
1 1 1   22    2   22 o   32.112   4.1250   44.433   10.549   54.019   17.686   39.141   13.142   34.169   6.5886   29.420   5.6858 4.748709 8.702818 
1 1 1   22    2   23 o   16.051   5.8183   10.092   9.8061   16.854   16.334   6.2810   12.262   20.163   7.4761   15.471   6.2629 4.691619 9.752738 
1 1 1   22    2   24 f   41.424   3.2699   72.282   10.952   99.567   18.304   57.066   13.669   47.850   4.7556   36.120   4.7579 11.72968 6.727059 
1 1 1   22    2   25 o   32.828   4.0638   46.425   10.643   51.811   17.609   43.325   13.358   33.290   6.7210   31.042   5.4795 2.248003 8.671623 
1 1 1   22    2   26 o   17.367   5.9161   12.925   10.028   6.1320   16.122   17.211   12.806   16.832   7.0340   19.676   6.6860 -2.843285 9.704649 
1 1 1   22    2   27 o   47.380   2.7654   93.697   10.634   85.766   15.477  100.789   14.637   44.582   4.3125   48.696   3.7154 -4.114071 5.692222 
1 1 1   22    2   28 o   58.598   2.3940  142.391   11.411  107.100   16.329  176.077   15.953   50.005   4.0404   64.847   3.0264 -14.84175 5.048185 
1 1 1   22    2   29 o   34.398   3.9679   50.924   10.922   60.005   14.756   39.918   16.243   36.806   5.0512   28.881   6.9783 7.925117 8.614602 
1 1 1   22    2   30 o   13.982   5.4994   5.9303   9.1857   2.2352   14.043   8.6934   12.144   14.937   6.4155   16.155   6.3324 -1.218037 9.014368 
1 1 1   22    2   31 o   59.029   2.4060  144.638   11.553  134.857   17.076  152.895   15.688   56.274   3.7437   60.275   3.2046 -4.000721 4.927977 
1 1 1   22    2   32 o   40.052   3.5008   68.214   11.315   71.293   20.023   66.769   13.714   39.100   6.5112   39.180   4.3683 -0.7983017E-01 7.840832 
1 1 1   22    2   33 o   55.116   2.7961  127.030   12.521  125.614   21.530  127.754   15.392   53.353   5.0093   54.909   3.4563 -1.556644 6.085953 
1 1 1   22    2   34 o   33.892   4.8478   50.952   13.012   41.229   19.234   59.157   17.669   28.592   7.9601   35.628   6.3151 -7.035843 10.16092 
1 1 1   22    2   35 o   48.998   3.5084  102.044   13.920   82.146   19.978  120.822   19.407   42.352   5.9506   52.607   4.5709 -10.25460 7.503536 
1 1 1   22    2   36 o   19.333   6.0676   17.222   10.645   27.076   14.048   3.9317   16.314   23.669   6.8753   16.151   6.9256 7.517578 9.758800 
1 1 1   22    2   37 o   36.376   3.3883   56.332   9.9314   42.520   14.788   67.680   13.404   30.072   6.2374   39.449   4.2345 -9.376913 7.538976 
1 1 1   22    2   38 o   13.073   5.6286   1.1888   10.860  -4.0895   14.250   8.5004   16.772   13.442   6.0792   17.420   7.2181 -3.977994 9.437031 
1 1 1   22    2   39 o   17.814   5.7943   14.332   9.6415   6.7433   14.167   20.881   13.159   16.076   6.6450   20.974   6.7652 -4.897799 9.482791 
1 1 1   22    2   40 o   11.508   5.1783  -3.0970   10.190   1.5421   14.690  -7.3985   14.146   14.867   6.4731   12.701   5.8608 2.166444 8.732175 
1 1 1   22    2   41 o   30.230   4.1317   40.024   9.9151   36.462   15.116   42.713   13.136   27.318   6.8119   30.490   5.4869 -3.172714 8.746898 
1 1 1   22    2   42 o   33.953   3.7364   49.804   10.170   61.023   15.438   41.202   13.518   36.632   5.3261   29.713   5.7895 6.918621 7.866735 
1 1 1   22    2   43 o   20.762   5.6301   20.274   9.7665   21.217   14.769   19.540   13.020   20.977   7.1789   20.254   6.7406 0.7228889 9.847496 
1 1 1   22    2   44 o   30.577   4.3482   41.401   10.532   48.332   17.783   37.656   13.072   31.142   7.1557   28.257   5.8672 2.885092 9.253543 
1 1 1   22    2   45 o   21.580   5.5237   21.947   9.7566   30.983   14.773   14.956   12.994   24.856   6.9967   18.325   6.6894 6.530931 9.679972 
1 1 1   22    2   46 o   22.803   5.3475   24.373   9.7665   20.914   14.870   26.997   12.952   20.694   7.1982   23.387   6.5400 -2.693142 9.725470 
1 1 1   22    2   47 o   10.355   4.7935  -5.9251   9.5735   5.7784   14.183 -15.7211   12.976   15.533   6.5507   10.580   5.0934 4.952774 8.297832 
1 1 1   22    2   48 o   11.506   5.0876  -0.8874   9.3960   3.6609   14.112  -4.5093   12.593   14.900   6.4158   12.323   5.6282 2.577203 8.534548 
1 1 1   22    2   49 o   14.991   5.7103   8.7931   9.6694   10.550   14.394   7.3479   13.053   16.874   6.8018   15.521   6.3935 1.352869 9.334933 
1 1 1   22    2   50 o   17.398   5.9708   14.106   10.218   21.638   14.373   6.4095   14.529   20.687   7.0820   15.667   6.6199 5.020218 9.694221 
1 1 1   22    2   51 o   8.3099   4.1253 -22.9162   10.713 -28.8371   16.598 -18.6875   14.027   10.705   5.2814   10.627   5.1593 0.7729340E-01 7.383226 
1 1 1   22    2   52 o   22.493   6.1488   25.302   11.594   27.837   17.357   23.260   15.580   22.597   7.7810   21.076   7.3656 1.520374 10.71427 
1 1 1   22    2   53 o   13.337   5.7448   2.7428   11.322   17.532   16.984  -9.0862   15.189   19.109   7.4892   12.495   5.8674 6.614455 9.513937 
1 1 1   22    2   54 f   10.831   5.0517  -6.7001   10.946   7.2388   17.053 -16.4665   14.274   16.297   7.0354   10.945   5.2873 5.352525 8.800710 
1 1 1   22    2   55 o   10.602   4.9739  -7.5218   10.870   3.1951   16.635 -15.5068   14.359   15.219   6.7473   11.085   5.3422 4.133360 8.606122 
1 1 1   22    2   56 o   11.514   5.2447  -3.0215   10.842   18.324   16.467 -19.3570   14.406   19.017   7.3971   10.582   5.1578 8.435088 9.017780 
1 1 1   22    2   57 o   23.257   6.0374   27.617   11.545   17.279   16.798   36.870   15.893   18.638   7.4033   25.806   7.2546 -7.168427 10.36525 
1 1 1   22    2   58 o   16.836   6.2416   13.609   11.384   22.271   17.439   7.1754   15.028   20.059   7.6619   15.497   6.6461 4.562246 10.14272 
1 1 1   22    2   59 o   12.331   5.4826   0.3448   11.061   10.497   16.417  -8.0960   14.969   16.548   7.0165   12.300   5.7913 4.247257 9.097888 
1 1 1   22    2   60 o   16.738   6.1851   13.807   11.163   12.825   16.670   14.605   15.030   17.066   7.1437   17.362   6.9672 -0.2955151 9.978719 
1 1 1   22    2   61 o   40.040   5.3387   78.452   16.991   0.0000   0.0000   78.452   16.991  ?   ?    40.040   5.3387 0.000000 5.338744 
1 1 1   22    2   62 o   23.356   6.8464   30.860   13.875   32.944   17.294   27.098   23.243   23.043   7.7700   20.481   8.4928 2.562557 11.51094 
1 1 1   22    2   63 o   14.024   6.1436   4.5421   13.410  -8.5982   16.875   27.057   22.089   12.709   6.0328   20.389   8.3489 -7.680250 10.30041 
1 1 1   22    2   64 o   12.359   6.0975 -26.9415   22.120 -26.9415   22.120   0.0000   0.0000   12.359   6.0975  ?   ?  0.000000 6.097523 
1 1 1   22    2   65 o   16.637   7.5715   8.8823   22.534   8.8823   22.534   0.0000   0.0000   16.637   7.5715  ?   ?  0.000000 7.571543 
1 1 1   22    2   66 o   24.005   7.3858   35.151   15.861   19.841   23.438   48.083   21.542   18.573   8.1297   26.178   8.6690 -7.604687 11.88463 
1 1 1   22    2   67 o   15.118   6.5707   7.9738   15.081 -15.1824   21.931   28.745   20.771   13.303   6.4568   20.568   8.2118 -7.264709 10.44627 
1 1 1   22    2   68 o   13.843   6.2600   2.3970   15.105   9.7858   22.682  -3.4918   20.249   16.623   7.5772   14.209   6.7038 2.413882 10.11709 
1 1 1   22    2   69 o   11.908   5.6451  -7.4677   14.683   13.014   22.368 -22.9736   19.463   17.036   7.6685   11.730   5.7742 5.306159 9.599357 
1 1 1   22    2   70 o   14.337   6.4050   5.0107   15.284   11.956   22.901  -0.5674   20.524   16.826   7.6482   14.561   6.8321 2.265953 10.25534 
1 1 1   22    2   71 o   14.511   6.4469   6.0349   15.265 -12.9219   22.373   22.547   20.880   13.458   6.5295   18.671   7.9147 -5.212304 10.26044 
1 1 1   22    2   72 o   13.007   6.0210  -1.2278   15.100   18.616   22.271 -18.1118   20.543   17.832   7.8609   12.437   6.0830 5.395074 9.939689 
1 1 1   22    2   73 o   17.593   7.0816   18.206   15.579   21.143   22.920   15.685   21.239   18.236   8.0090   17.165   7.6163 1.070757 11.05226 
1 1 1   22    2   74 o   16.070   6.8415   12.802   15.717   13.478   22.814   12.191   21.682   16.828   7.6429   16.520   7.4822 0.3086147 10.69566 
1 1 1   22    2   75 o   16.838   7.0221   15.921   16.019   35.973   23.319  -1.9966   22.043   21.139   8.6076   14.456   6.8715 6.682966 11.01399 
1 1 1   22    2   76 o   14.886   7.0137   1.7373   22.028   1.7373   22.028   0.0000   0.0000   14.886   7.0137  ?   ?  0.000000 7.013653 
1 1 1   22    2   77 o   18.859   8.1067   25.777   22.457   25.777   22.457   0.0000   0.0000   18.859   8.1067  ?   ?  0.000000 8.106722 
1 1 1   22    2   78 o   15.528   7.2611   6.3462   22.850   6.3462   22.850   0.0000   0.0000   15.528   7.2611  ?   ?  0.000000 7.261070 
1 1 1   22    2   79 o   15.004   7.0625   3.5225   22.236   3.5225   22.236   0.0000   0.0000   15.004   7.0625  ?   ?  0.000000 7.062516 
1 1 1   22    2   80 o   13.140   6.4126 -12.8923   22.459 -12.8923   22.459   0.0000   0.0000   13.140   6.4126  ?   ?  0.000000 6.412649 
1 1 1   22    2   82 o   16.577   7.7761   13.037   26.553   13.037   26.553   0.0000   0.0000   16.577   7.7761  ?   ?  0.000000 7.776114 
1 1 1   22    2   83 o   13.188   6.5528 -24.8652   27.266 -24.8652   27.266   0.0000   0.0000   13.188   6.5528  ?   ?  0.000000 6.552753 
1 1 1   22    3  -67 o   22.973   8.9730   43.511   24.311   0.0000   0.0000   43.511   24.311  ?   ?    22.973   8.9730 0.000000 8.973002 
1 1 1   22    3  -66 o   12.926   6.3213 -17.4621   22.153   0.0000   0.0000 -17.4621   22.153  ?   ?    12.926   6.3213 0.000000 6.321252 
1 1 1   22    3  -65 o   21.706   8.7023   36.741   23.425   0.0000   0.0000   36.741   23.425  ?   ?    21.706   8.7023 0.000000 8.702277 
1 1 1   22    3  -64 o   20.338   8.5178   30.442   23.720   0.0000   0.0000   30.442   23.720  ?   ?    20.338   8.5178 0.000000 8.517753 
1 1 1   22    3  -63 o   21.215   8.6735   33.870   23.794   0.0000   0.0000   33.870   23.794  ?   ?    21.215   8.6735 0.000000 8.673504 
1 1 1   22    3  -62 f   18.937   7.3981   21.740   16.529   12.844   23.469   30.496   23.284   17.211   7.7909   20.616   8.5202 -3.405775 11.54516 
1 1 1   22    3  -61 o   19.185   7.4116   22.341   16.447   35.543   23.242   9.0990   23.276   21.908   8.7063   16.655   7.6239 5.252323 11.57250 
1 1 1   22    3  -60 o   21.792   7.5471   29.855   16.338   31.293   23.228   28.447   22.985   20.954   8.5686   20.326   8.4386 0.6282787 12.02627 
1 1 1   22    3  -59 o   32.900   5.7299   55.513   14.809   0.0000   0.0000   55.513   14.809  ?   ?    32.900   5.7299 0.000000 5.729854 
1 1 1   22    3  -58 o   15.566   6.2820   10.983   12.294   0.0000   0.0000   10.983   12.294  ?   ?    15.566   6.2820 0.000000 6.281963 
1 1 1   22    3  -57 o   13.705   5.4769   7.4508   9.2484   27.508   14.154  -7.4911   12.217   21.729   7.0169   11.023   5.2028 10.70543 8.735377 
1 1 1   22    3  -56 o   22.788   5.1944   25.835   9.4336   19.959   14.217   30.458   12.609   18.900   6.9809   23.686   6.3862 -4.785009 9.461306 
1 1 1   22    3  -55 o   13.426   5.4276   6.5276   9.1948   12.666   13.969   1.8353   12.214   16.543   6.6891   13.064   5.7873 3.478615 8.845134 
1 1 1   22    3  -54 o   12.925   5.3728   4.9071   9.3344  -0.1403   13.935   9.0150   12.572   13.298   6.0132   15.238   6.2753 -1.939465 8.691257 
1 1 1   22    3  -53 o   14.995   5.6446   10.012   9.3825   11.182   13.659   8.9666   12.911   16.213   6.5929   15.380   6.3491 0.8331728 9.153045 
1 1 1   22    3  -52 o   16.194   5.7071   12.566   9.3669   14.625   13.815   10.813   12.744   17.420   6.7754   15.994   6.4164 1.425641 9.331454 
1 1 1   22    3  -51 o   30.245   4.0895   41.457   9.8240   28.676   14.534   52.209   13.330   22.796   7.0799   33.127   5.0999 -10.33057 8.725492 
1 1 1   22    3  -50 o   28.255   4.4924   36.870   10.001   27.217   14.855   44.871   13.525   22.216   7.1897   30.209   5.7012 -7.993546 9.175821 
1 1 1   22    3  -49 o   18.566   5.7567   17.122   9.6135   11.899   14.354   21.370   12.946   16.815   6.7874   20.182   6.7215 -3.366625 9.552322 
1 1 1   22    3  -48 o   18.841   5.7679   17.589   9.6881   16.167   14.676   18.687   12.898   18.290   7.0181   19.143   6.7008 -0.8525848 9.703320 
1 1 1   22    3  -47 o   36.382   3.5257   57.885   10.325   54.933   15.488   60.246   13.852   33.546   5.8781   36.103   4.8278 -2.557095 7.606529 
1 1 1   22    3  -46 o   10.825   5.0481  -6.8150   10.924 -16.3751   14.630   5.2336   16.424   11.159   5.3813   15.743   6.8495 -4.583631 8.710533 
1 1 1   22    3  -45 o   12.907   5.5988   1.7468   10.905   7.6368   14.433  -6.0871   16.645   15.843   6.6404   13.633   6.3146 2.209439 9.163450 
1 1 1   22    3  -44 o   48.322   2.9432   99.396   11.538   83.952   16.485  114.225   16.154   42.927   4.7929   50.999   3.9158 -8.071529 6.189112 
1 1 1   22    3  -43 o   12.042   5.1517   1.7768   8.9895   3.4704   14.428   0.7021   11.493   14.850   6.4409   12.952   5.6805 1.898156 8.587964 
1 1 1   22    3  -42 o   12.241   5.2051   2.1737   9.0783  -8.4078   14.748   8.6298   11.519   12.551   5.8573   15.446   6.1322 -2.894909 8.480087 
1 1 1   22    3  -41 o   47.899   2.6167   96.548   10.178   80.049   15.880  108.050   13.259   42.156   4.7012   50.255   3.2542 -8.099087 5.717560 
1 1 1   22    3  -40 o   57.777   2.3543  139.457   11.065  119.164   17.058  154.198   14.539   52.176   4.0423   60.333   2.9653 -8.157234 5.013308 
1 1 1   22    3  -39 o   69.273   2.2524  199.862   12.702  186.968   22.106  206.218   15.520   65.327   4.1730   70.023   2.7242 -4.696175 4.983492 
1 1 1   22    3  -38 o   35.436   3.3845   53.931   9.6576   48.541   15.413   57.415   12.392   31.835   6.1622   36.026   4.3049 -4.191435 7.516993 
1 1 1   22    3  -37 o   10.808   4.9146  -3.8556   9.4680   8.6069   14.079 -14.1441   12.793   16.389   6.6827   10.749   5.1438 5.639945 8.433123 
1 1 1   22    3  -36 o   22.373   5.3547   23.384   9.6352   17.514   14.058   28.584   13.232   19.447   6.9772   24.136   6.5569 -4.688612 9.574645 
1 1 1   22    3  -35 o   46.436   2.6579   90.464   10.018   96.202   13.360   83.091   15.143   47.416   3.4809   43.491   4.3290 3.924755 5.554907 
1 1 1   22    3  -34 f   52.086   2.6508  113.676   11.218  127.610   16.135  100.639   15.607   54.541   3.6502   48.160   4.0118 6.380955 5.423903 
1 1 1   22    3  -33 o   23.807   4.8772   25.787   9.1462   16.860   12.358   36.601   13.601   19.116   6.5661   27.710   6.1789 -8.593765 9.016253 
1 1 1   22    3  -32 o   37.993   2.8800   60.853   8.8526   51.013   12.689   70.184   12.357   33.830   4.7306   40.336   3.8030 -6.506504 6.069693 
1 1 1   22    3  -31 o   13.584   5.2339   6.2648   8.1858  -2.4231   11.864   14.158   11.309   12.588   5.6319   17.893   6.2736 -5.304874 8.430720 
1 1 1   22    3  -30 o   18.650   5.1932   15.971   8.1853   9.7672   12.032   21.316   11.168   16.336   6.3317   21.216   6.1204 -4.880026 8.806203 
1 1 1   22    3  -29 o   50.247   2.3318  104.980   9.5247   82.591   13.580  126.657   13.363   43.809   3.8417   54.855   2.9998 -11.04644 4.874156 
1 1 1   22    3  -28 o   16.857   5.3488   12.726   8.2516   22.060   12.007   4.3706   11.359   21.541   6.3834   14.273   5.9296 7.267487 8.712523 
1 1 1   22    3  -27 o   51.174   2.4697  109.089   10.272   95.639   13.773  125.942   15.418   47.336   3.5964   54.419   3.4941 -7.082661 5.014300 
1 1 1   22    3  -26 o   62.922   2.4788  164.789   12.689  162.523   20.495  166.197   16.159   61.380   4.1202   62.781   3.1677 -1.400951 5.197155 
1 1 1   22    3  -25 o   25.864   5.1171   30.341   10.406   9.2836   16.691   43.731   13.309   17.635   7.2432   30.975   5.4712 -13.34032 9.077312 
1 1 1   22    3  -24 o   35.446   3.7112   53.931   10.564   59.046   17.379   50.933   13.305   35.613   6.2125   33.779   4.9814 1.834064 7.963049 
1 1 1   22    3  -23 o   37.515   3.5664   60.110   10.775   88.381   27.499   54.982   11.712   41.826   8.3579   35.601   4.1112 6.225044 9.314339 
1 1 1   22    3  -22 o   11.086   4.9550  -2.4803   9.1588  -9.9082   16.517   0.8177   11.006   13.450   6.2505   13.072   5.6475 0.3784437 8.423952 
1 1 1   22    3  -21 o   46.016   2.8321   88.731   10.572  119.265   19.112   75.270   12.690   52.319   4.5259   41.934   3.7521 10.38511 5.878953 
1 1 1   22    3  -20 o   9.2760   4.4058  -9.9084   9.0267  -1.3155   16.274 -13.7266   10.848   14.987   6.6575   9.7972   4.7012 5.189659 8.150060 
1 1 1   22    3  -19 o   38.144   3.2726   61.609   10.077   66.008   17.819   59.541   12.219   37.960   5.9542   37.100   4.1091 0.8602371 7.234479 
1 1 1   22    3  -18 o   44.498   2.9125   83.063   10.507   98.383   15.460   69.914   14.322   47.864   3.9989   40.046   4.4633 7.818035 5.992679 
1 1 1   22    3  -17 o   13.544   5.7192   2.5702   10.833   23.576   17.856  -9.6644   13.627   22.394   7.8808   12.114   5.6456 10.28022 9.694259 
1 1 1   22    3  -16 o   38.296   3.3034   62.082   10.212   73.373   19.286   57.683   12.037   40.006   6.1073   36.536   4.1132 3.469429 7.363269 
1 1 1   22    3  -15 o   51.379   2.6374  110.018   11.009  104.845   20.313  112.168   13.099   48.645   5.2034   51.652   3.1258 -3.006477 6.070107 
1 1 1   22    3  -14 f   19.189   5.6647   16.790   9.4701   21.492   17.425   14.820   11.282   21.701   7.7702   18.377   6.2748 3.323748 9.987477 
1 1 1   22    3  -13 o   13.377   5.4450   4.1880   9.3273  -8.6320   16.723   9.9767   11.238   13.837   6.3806   16.350   6.1725 -2.513613 8.877590 
1 1 1   22    3  -12 o   35.723   3.2553   53.963   9.3752   39.228   14.635   64.218   12.210   28.959   6.3728   38.691   3.9255 -9.731766 7.484761 
1 1 1   22    3  -11 o   32.197   3.6032   44.261   9.2945   53.982   14.726   37.826   11.983   34.708   5.3791   29.007   5.2614 5.700666 7.524362 
1 1 1   22    3  -10 o   28.456   3.9506   34.992   8.9168   57.547   14.519   21.333   11.299   36.027   5.0852   21.441   6.1472 14.58656 7.977876 
1 1 1   22    3   -9 o   10.177   4.6375  -4.3609   8.4870   2.0323   13.667  -8.3735   10.828   14.750   6.3320   10.793   5.0309 3.956758 8.087334 
1 1 1   22    3   -8 o   34.557   3.7169   51.029   10.306   54.686   14.783   47.572   14.375   34.970   5.3564   32.419   5.6445 2.550602 7.781466 
1 1 1   22    3   -7 o   45.908   2.8860   88.179   10.745  103.182   15.465   74.177   14.941   49.172   3.8901   41.323   4.5086 7.848671 5.954844 
1 1 1   22    3   -6 o   13.195   5.4379   3.4660   9.4487  -5.1612   13.575   11.574   13.160   13.014   5.9046   17.537   6.6660 -4.522874 8.905031 
1 1 1   22    3   -5 o   47.857   2.5291   95.220   9.8312  111.874   15.522   84.063   12.704   51.306   3.7370   44.542   3.5278 6.763489 5.139139 
1 1 1   22    3   -4 o   26.277   4.2722   30.168   8.8368   26.866   14.023   32.343   11.381   23.809   6.8551   26.735   5.4084 -2.925951 8.731690 
1 1 1   22    3   -3 o   33.187   3.4284   46.755   9.1414   78.253   14.801   27.330   11.623   42.569   4.3254   24.326   5.9188 18.24229 7.330834 
1 1 1   22    3   -2 o   37.212   3.1035   58.270   9.3282   73.525   15.096   48.847   11.865   41.114   4.5820   33.489   4.4568 7.625614 6.392041 
1 1 1   22    3   -1 o   28.009   4.0258   33.950   8.9277   57.420   14.470   19.523   11.344   36.032   5.0662   20.604   6.2282 15.42798 8.028486 
1 1 1   22    3    0 o   27.811   4.0393   33.490   8.8895   38.196   14.371   30.574   11.314   28.653   6.3227   25.932   5.5217 2.721136 8.394403 
1 1 1   22    3    1 o   11.297   4.9364  -0.7622   8.6091 -14.7809   13.934   7.8939   10.949   11.469   5.4549   15.492   6.0301 -4.023097 8.131254 
1 1 1   22    3    2 o   52.841   2.5364  116.029   10.893  102.453   15.947  127.906   14.916   48.930   4.0340   55.106   3.3362 -6.176392 5.234800 
1 1 1   22    3    3 o   32.133   3.5761   44.010   9.2084   39.843   14.496   46.829   11.923   29.309   6.2577   32.712   4.5982 -3.402836 7.765517 
1 1 1   22    3    4 o   44.647   2.7387   83.187   9.9192   84.158   15.356   82.491   12.994   44.158   4.3212   44.065   3.6502 0.9340668E-01 5.656621 
1 1 1   22    3    5 o   45.174   2.7031   85.109   9.9082   92.861   15.607   79.875   12.824   46.491   4.1622   43.348   3.6636 3.142982 5.544885 
1 1 1   22    3    6 o   26.425   4.2831   30.520   8.9103   34.418   14.118   27.940   11.487   27.074   6.4828   24.633   5.8150 2.441109 8.708648 
1 1 1   22    3    7 o   10.902   4.9193  -3.6092   9.2682   5.4010   13.732 -11.1470   12.560   15.721   6.5244   11.301   5.3157 4.420954 8.415744 
1 1 1   22    3    8 o   18.069   5.8828   14.464   9.9371   21.777   13.732   6.4245   14.399   21.620   6.9045   16.266   6.7090 5.354454 9.627197 
1 1 1   22    3    9 o   16.370   5.6735   11.220   9.2340   21.658   14.119   3.4177   12.206   21.576   7.0114   14.490   6.0920 7.085971 9.288309 
1 1 1   22    3   10 o   10.672   4.8444  -4.1800   9.1512   2.4801   13.710  -9.5320   12.290   14.883   6.3644   11.433   5.3394 3.449390 8.307576 
1 1 1   22    3   11 o   15.823   5.4703   10.430   8.5821   1.9197   13.493   16.212   11.122   14.634   6.2870   19.008   6.2259 -4.373837 8.848099 
1 1 1   22    3   12 o   13.311   5.4038   4.2252   9.1576   12.265   16.805   0.8293   10.922   18.688   7.4107   13.091   5.6406 5.596972 9.313165 
1 1 1   22    3   13 o   40.706   3.1055   69.746   10.227   71.636   18.665   68.935   12.225   39.672   5.9557   40.166   3.7781 -0.4941521 7.052939 
1 1 1   22    3   14 f   12.786   5.4309   1.6950   9.8640 -20.2768   16.766   13.326   12.199   12.100   5.8160   17.916   6.4901 -5.816335 8.714806 
1 1 1   22    3   15 o   44.184   3.1779   82.265   11.369   91.729   19.553   77.430   13.975   45.339   5.3963   42.406   4.0935 2.932892 6.773305 
1 1 1   22    3   16 o   13.298   5.4338   4.0057   9.3330   3.0690   13.967   4.7613   12.545   15.109   6.4414   14.999   6.2313 0.1092405 8.962209 
1 1 1   22    3   17 o   38.655   3.5570   63.633   11.083   69.355   15.033   56.821   16.403   39.739   4.7336   35.228   5.9221 4.511559 7.581444 
1 1 1   22    3   18 o   11.309   5.1015  -3.5941   9.9605   1.7407   13.963  -9.1215   14.213   14.740   6.3647   12.509   5.8080 2.231380 8.616385 
1 1 1   22    3   19 o   30.910   4.3687   41.827   10.701   34.259   14.727   50.292   15.576   26.732   6.7564   33.016   6.0088 -6.284286 9.041793 
1 1 1   22    3   20 o   36.745   5.3406   60.668   15.528   60.668   15.528   0.0000   0.0000   36.745   5.3406  ?   ?  0.000000 5.340561 
1 1 1   22    3   21 o   34.718   3.6042   51.555   10.052   32.736   15.030   66.782   13.520   25.995   6.9564   39.188   4.3031 -13.19287 8.179766 
1 1 1   22    3   22 o   22.839   5.2339   23.842   9.5350   21.779   14.392   25.455   12.730   21.467   7.0849   23.122   6.4901 -1.654169 9.608180 
1 1 1   22    3   23 o   13.306   5.4006   4.3900   9.1447   11.488   14.271  -0.5551   11.912   17.644   6.8795   13.149   5.7743 4.494848 8.981663 
1 1 1   22    3   24 o   15.001   5.6335   8.3792   9.3337   4.1417   14.424   11.432   12.242   15.498   6.5742   17.087   6.4443 -1.589139 9.205942 
1 1 1   22    3   25 o   11.861   5.2740  -1.9774   10.239  -4.7571   14.146   1.0818   14.840   13.269   6.0232   14.881   6.4921 -1.611901 8.855909 
1 1 1   22    3   26 o   10.401   4.8383  -7.2701   9.9345   5.3188   18.456 -12.4055   11.788   17.173   7.3650   10.562   5.0217 6.611029 8.914066 
1 1 1   22    3   27 o   16.923   5.9704   12.229   10.253   17.620   19.188   10.075   12.130   20.483   7.9799   16.519   6.3696 3.963856 10.21033 
1 1 1   22    3   28 o   18.830   6.0171   16.293   10.427   5.2930   19.199   20.895   12.419   17.361   7.4794   20.991   6.5484 -3.630114 9.941031 
1 1 1   22    3   29 o   47.023   3.2958   93.783   12.553   90.074   16.789   98.485   18.904   45.248   4.6165   47.033   5.0077 -1.785473 6.810966 
1 1 1   22    3   30 o   36.467   4.0331   57.747   11.788   58.248   15.790   57.116   17.719   35.653   5.6190   34.671   6.5085 0.9822159 8.598493 
1 1 1   22    3   31 o   33.754   4.3575   50.107   11.710   59.015   15.923   39.614   17.281   35.850   5.6343   28.088   7.4331 7.762264 9.327229 
1 1 1   22    3   32 o   18.281   5.7724   15.382   9.6207   27.244   14.919   6.9376   12.587   23.458   7.1532   15.515   6.3217 7.942179 9.546274 
1 1 1   22    3   33 o   42.259   3.0791   75.607   10.534   78.994   16.153   73.101   13.894   42.126   4.7889   40.886   4.2300 1.240486 6.389569 
1 1 1   22    3   34 f   24.769   5.4160   28.514   10.630   29.289   17.856   28.089   13.229   23.916   7.8916   23.982   6.5730 -0.6610107E-01 10.27044 
1 1 1   22    3   35 o   41.848   3.7842   75.682   12.769   61.529   27.755   79.482   14.382   32.649   9.7128   42.622   4.1937 -9.973186 10.57947 
1 1 1   22    3   36 o   30.234   4.5249   40.797   10.809   36.529   18.156   43.140   13.453   26.454   7.8522   30.422   5.6324 -3.968437 9.663352 
1 1 1   22    3   37 o   16.755   6.0068   12.193   10.417  -5.9551   17.600   21.978   12.924   14.344   6.5894   21.192   6.6902 -6.847864 9.390409 
1 1 1   22    3   38 o   26.115   5.1585   31.524   10.592   43.084   18.251   25.655   13.006   28.771   7.6506   22.761   6.6163 6.009426 10.11466 
1 1 1   22    3   39 o   29.580   4.6236   39.452   10.784   44.792   18.510   36.709   13.268   29.254   7.6698   27.600   6.0635 1.653494 9.777086 
1 1 1   22    3   40 o   31.321   4.7199   44.415   11.677   55.535   18.233   36.684   15.203   33.309   6.9409   26.932   6.8960 6.376907 9.784209 
1 1 1   22    3   41 o   11.141   5.1451  -5.8487   10.930   12.903   14.633 -29.5159   16.440   17.683   6.9452   10.625   5.2448 7.057521 8.703138 
1 1 1   22    3   42 o   21.330   5.6191   21.905   9.9043   29.003   15.230   16.703   13.038   23.581   7.2343   18.749   6.7202 4.831898 9.874037 
1 1 1   22    3   43 o   25.854   4.9044   30.950   9.9577   31.821   15.076   30.276   13.262   24.701   7.1066   24.495   6.5254 0.2063026 9.647987 
1 1 1   22    3   44 o   15.912   5.9156   10.873   10.239   11.638   14.878   10.185   14.114   17.172   6.9176   16.558   6.7134 0.6132431 9.639629 
1 1 1   22    3   45 o   11.199   5.0902  -3.2670   10.142 -13.4708   14.243   7.2304   14.446   11.417   5.4537   15.735   6.6221 -4.317756 8.578792 
1 1 1   22    3   46 o   18.317   6.3059   16.415   11.400   15.547   17.763   17.022   14.864   18.626   7.5388   18.750   7.0943 -0.1235619 10.35198 
1 1 1   22    3   47 o   39.984   3.8010   70.568   12.240   61.360   18.712   77.455   16.181   34.446   6.9047   40.854   4.9605 -6.408722 8.501873 
1 1 1   22    3   48 o   15.660   6.0715   10.279   11.066   5.4711   17.079   13.758   14.528   15.846   6.9377   17.486   6.9042 -1.639770 9.787727 
1 1 1   22    3   49 o   20.557   6.2296   21.699   11.339   35.736   17.722   11.969   14.755   24.928   7.8296   16.909   6.8611 8.018667 10.41038 
1 1 1   22    3   50 o   30.950   4.8836   44.998   11.913   16.533   18.001   67.177   15.890   18.570   7.5623   37.434   5.3601 -18.86400 9.269215 
1 1 1   22    3   51 o   31.277   4.7876   45.853   11.818   38.393   17.627   51.946   15.929   25.726   7.7607   31.824   6.3631 -6.097731 10.03577 
1 1 1   22    3   52 o   28.691   5.2703   39.867   11.872   20.536   17.494   56.367   16.163   19.489   7.6118   33.292   6.1834 -13.80311 9.806802 
1 1 1   22    3   53 o   21.834   6.2482   25.129   11.684   31.382   17.713   20.313   15.545   22.866   7.8610   19.313   7.2665 3.552950 10.70495 
1 1 1   22    3   54 o   33.879   4.4863   53.454   12.085   27.075   18.181   74.339   16.177   21.182   7.8811   39.239   5.1842 -18.05640 9.433321 
1 1 1   22    3   55 o   31.579   4.8031   47.524   11.975   29.951   17.878   61.823   16.127   22.016   7.8720   34.908   5.8759 -12.89170 9.823150 
1 1 1   22    3   56 o   25.629   5.7083   33.630   11.619   22.507   17.544   42.323   15.508   19.557   7.6271   27.486   6.9257 -7.929581 10.30232 
1 1 1   22    3   57 o   15.622   6.0819   11.503   11.140  -1.1144   16.883   21.231   14.824   13.882   6.4047   19.205   7.1220 -5.323136 9.578262 
1 1 1   22    3   58 o   27.723   5.4586   38.811   11.896   19.272   18.141   53.552   15.757   18.448   7.5613   31.672   6.3249 -13.22382 9.857900 
1 1 1   22    3   59 o   17.278   6.6219   15.937   13.056   12.189   23.756   17.558   15.627   17.311   7.8371   17.849   7.1240 -0.5377388 10.59109 
1 1 1   22    3   60 o   27.259   7.4574   44.864   17.047   5.7693   24.349   82.446   23.874   16.360   7.5981   36.254   8.2628 -19.89439 11.22524 
1 1 1   22    3   61 o   12.843   5.9951  -3.7972   15.466   10.582   22.992 -15.6817   20.902   16.853   7.6616   12.963   6.2943 3.890697 9.915496 
1 1 1   22    3   62 f   11.963   5.6960  -8.8122   15.275 -15.2761   22.838  -3.5792   20.548   13.491   6.5572   14.275   6.7407 -0.7845774 9.403953 
1 1 1   22    3   63 o   16.032   7.4400   5.6962   23.280   5.6962   23.280   0.0000   0.0000   16.032   7.4400  ?   ?  0.000000 7.440045 
1 1 1   22    3   64 o   19.951   8.4529   28.656   23.794   28.656   23.794   0.0000   0.0000   19.951   8.4529  ?   ?  0.000000 8.452909 
1 1 1   22    3   65 o   10.893   5.4800 -43.6817   21.969 -43.6817   21.969   0.0000   0.0000   10.893   5.4800  ?   ?  0.000000 5.479992 
1 1 1   22    3   66 o   19.781   8.4064   28.807   23.656   28.807   23.656   0.0000   0.0000   19.781   8.4064  ?   ?  0.000000 8.406431 
1 1 1   22    3   67 o   12.349   5.8534  -6.4044   15.776  -7.1369   23.207  -5.7752   21.511   14.199   6.8297   13.990   6.6880 0.2094879 9.558966 
1 1 1   22    3   68 o   12.173   5.7868  -7.1240   15.640 -37.6357   22.449   21.650   21.801   11.361   5.6910   18.293   7.9257 -6.931746 9.757231 
1 1 1   22    3   69 o   16.507   6.9949   14.481   16.300   53.331   24.203 -17.7662   22.050   25.439   9.1515   12.788   6.2646 12.65120 11.09033 
1 1 1   22    3   70 o   18.316   7.3596   21.432   16.793   1.7069   23.891   40.694   23.610   15.206   7.2062   22.164   8.7856 -6.958360 11.36294 
1 1 1   22    3   71 o   15.673   6.8997   11.045   17.104   35.497   26.362  -6.7323   22.477   20.362   8.7682   13.920   6.7020 6.441793 11.03627 
1 1 1   22    3   72 o   11.085   5.4055 -15.3567   15.868 -41.1905   23.514   6.2449   21.502   11.329   5.6955   15.360   7.1360 -4.031433 9.130248 
1 1 1   22    3   73 o   35.700   9.0349   92.956   26.311   92.956   26.311   0.0000   0.0000   35.700   9.0349  ?   ?  0.000000 9.034943 
1 1 1   22    3   74 f   13.999   6.7159  -4.3164   22.112  -4.3164   22.112   0.0000   0.0000   13.999   6.7159  ?   ?  0.000000 6.715943 
1 1 1   22    3   75 o   15.582   7.2712   7.8552   22.719   7.8552   22.719   0.0000   0.0000   15.582   7.2712  ?   ?  0.000000 7.271166 
1 1 1   22    3   76 o   12.388   6.1172 -20.6787   22.430 -20.6787   22.430   0.0000   0.0000   12.388   6.1172  ?   ?  0.000000 6.117210 
1 1 1   22    3   77 o   14.553   6.9243   0.7203   22.490   0.7203   22.490   0.0000   0.0000   14.553   6.9243  ?   ?  0.000000 6.924308 
1 1 1   22    3   78 o   11.392   5.7042 -33.9952   22.446 -33.9952   22.446   0.0000   0.0000   11.392   5.7042  ?   ?  0.000000 5.704165 
1 1 1   22    3   79 o   17.696   7.9413   21.559   23.783   21.559   23.783   0.0000   0.0000   17.696   7.9413  ?   ?  0.000000 7.941256 
1 1 1   22    4  -65 o   16.604   7.6512   12.735   23.986   0.0000   0.0000   12.735   23.986  ?   ?    16.604   7.6512 0.000000 7.651158 
1 1 1   22    4  -64 f   12.306   6.1123 -27.8592   23.642   0.0000   0.0000 -27.8592   23.642  ?   ?    12.306   6.1123 0.000000 6.112296 
1 1 1   22    4  -63 o   21.880   8.8690   40.411   24.626   0.0000   0.0000   40.411   24.626  ?   ?    21.880   8.8690 0.000000 8.869007 
1 1 1   22    4  -62 f   11.808   5.5448  -4.7252   13.562   0.0000   0.0000  -4.7252   13.562  ?   ?    11.808   5.5448 0.000000 5.544803 
1 1 1   22    4  -61 o   26.607   6.6428   40.896   14.362   0.0000   0.0000   40.896   14.362  ?   ?    26.607   6.6428 0.000000 6.642831 
1 1 1   22    4  -60 o   17.246   6.7962   16.969   14.052   0.0000   0.0000   16.969   14.052  ?   ?    17.246   6.7962 0.000000 6.796161 
1 1 1   22    4  -59 o   17.128   6.3580   16.286   11.820   10.785   22.391   18.411   13.917   16.492   7.5219   17.788   6.8319 -1.295555 10.16142 
1 1 1   22    4  -58 o   9.6133   4.6678 -13.3376   11.493   17.998   22.136 -24.9017   13.448   17.805   7.8434   9.2009   4.5767 8.603744 9.081029 
1 1 1   22    4  -57 o   9.9028   4.7745 -11.5091   11.501  -7.5352   21.904 -13.0219   13.514   14.016   6.7135   10.618   5.1329 3.398284 8.450927 
1 1 1   22    4  -56 o   16.663   6.3714   14.721   12.068   2.2175   22.758   19.611   14.233   15.468   7.2374   18.352   6.9426 -2.884440 10.02894 
1 1 1   22    4  -55 o   20.245   6.5266   23.427   12.249   30.997   22.767   20.344   14.531   20.774   8.4877   18.627   7.0218 2.146746 11.01577 
1 1 1   22    4  -54 o   13.971   6.0087   6.0748   12.351   25.407   24.056  -0.8451   14.392   19.523   8.3911   13.003   5.9679 6.519898 10.29689 
1 1 1   22    4  -53 f   30.890   5.3140   47.830   12.898   93.226   25.485   32.198   14.955   38.465   8.3666   23.140   7.1809 15.32512 11.02570 
1 1 1   22    4  -52 o   12.960   5.6573   3.3753   11.283  -2.0011   24.346   4.8460   12.733   15.404   7.2926   13.815   6.0205 1.589303 9.456656 
1 1 1   22    4  -51 f   14.588   5.8082   9.1961   10.363  -5.5796   16.970   17.982   13.086   13.133   6.1780   18.067   6.6930 -4.933915 9.108428 
1 1 1   22    4  -50 o   15.510   5.9098   11.473   10.359  -0.6226   17.201   18.355   12.976   14.054   6.4773   18.278   6.6828 -4.224436 9.306748 
1 1 1   22    4  -49 o   19.326   6.1431   20.015   10.880   10.192   17.922   25.749   13.692   16.400   7.1450   21.218   6.9053 -4.818584 9.936507 
1 1 1   22    4  -48 o   14.391   6.1343   6.3599   12.663   19.109   17.496  -7.6644   18.350   18.671   7.5085   13.427   6.3492 5.243594 9.833124 
1 1 1   22    4  -47 o   30.510   5.5878   46.420   13.385   50.008   18.577   42.547   19.302   29.192   7.6982   26.084   8.1680 3.107122 11.22401 
1 1 1   22    4  -46 o   26.516   7.0553   39.106   15.516   36.754   18.315   45.084   29.201   24.533   7.9866   24.369   9.7342 0.1639519 12.59126 
1 1 1   22    4  -45 o   40.234   4.0187   73.077   13.004   72.778   19.127   73.333   17.733   37.458   6.4996   38.360   5.8563 -0.9016953 8.748783 
1 1 1   22    4  -44 o   22.849   5.7912   26.442   10.798   23.975   13.992   30.075   16.981   20.900   6.9884   22.693   7.6993 -1.792828 10.39789 
1 1 1   22    4  -43 o   12.370   5.3954   1.6086   10.244 -10.9312   13.626   17.909   15.536   11.329   5.3902   18.696   7.2086 -7.366535 9.000973 
1 1 1   22    4  -42 o   24.968   5.1237   29.948   10.078   21.904   14.730   37.028   13.819   20.154   7.1519   26.712   6.4252 -6.557661 9.614172 
1 1 1   22    4  -41 o   17.759   5.7961   15.554   9.6433   4.9441   14.257   24.503   13.093   14.835   6.4185   21.477   6.7274 -6.641581 9.298115 
1 1 1   22    4  -40 o   31.538   4.1435   44.890   10.395   29.846   15.334   57.681   14.139   23.301   7.2777   34.979   5.1096 -11.67771 8.892328 
1 1 1   22    4  -39 o   45.911   2.9699   90.285   11.055   89.620   16.334   90.847   15.018   44.302   4.5893   45.055   4.1351 -0.7534409 6.177476 
1 1 1   22    4  -38 o   19.184   5.8066   18.176   9.8559   30.827   14.700   7.8435   13.284   24.033   7.0477   15.476   6.4193 8.557750 9.532911 
1 1 1   22    4  -37 o   16.509   5.6781   12.712   9.2423   7.9429   12.851   17.823   13.302   15.426   6.3479   18.952   6.7886 -3.525949 9.294162 
1 1 1   22    4  -36 o   11.095   5.0151  -2.6382   9.6841 -22.5905   12.465   27.743   15.381   9.3141   4.5918   22.788   7.3106 -13.47353 8.633077 
1 1 1   22    4  -35 o   11.547   5.0575   0.1453   9.0837  -4.7166   12.734   5.1820   12.961   12.232   5.6140   14.726   6.2389 -2.494355 8.392885 
1 1 1   22    4  -34 o   39.907   3.3302   68.675   10.734   72.166   16.004   65.820   14.473   39.548   5.0815   38.004   4.7773 1.544666 6.974528 
1 1 1   22    4  -33 o   25.781   5.0070   30.921   10.143   20.472   15.115   39.481   13.681   20.218   7.2371   28.428   6.0873 -8.210850 9.456790 
1 1 1   22    4  -32 o   14.805   5.7122   8.3259   9.7602 -10.5222   14.465   24.079   13.224   12.065   5.6844   21.809   6.7501 -9.743719 8.824733 
1 1 1   22    4  -31 o   13.990   5.7331   5.4757   10.426   2.7782   18.068   6.8225   12.766   15.979   7.0607   15.269   6.3094 0.7107534 9.469032 
1 1 1   22    4  -30 o   22.923   5.2375   24.691   9.5718   10.391   17.628   30.670   11.399   17.643   7.3627   25.357   5.6584 -7.713627 9.285800 
1 1 1   22    4  -29 o   57.693   2.4969  139.454   11.715  139.203   21.351  139.562   14.012   55.717   4.7462   57.367   3.0069 -1.649475 5.618521 
1 1 1   22    4  -28 o   35.323   3.5935   54.016   10.203   64.266   18.631   49.625   12.194   36.341   6.5292   33.224   4.6280 3.116608 8.003066 
1 1 1   22    4  -27 o   14.705   5.4647   8.5785   8.7363  -3.0018   14.246   15.558   11.060   13.462   6.0844   18.282   6.2134 -4.819307 8.696325 
1 1 1   22    4  -26 o   16.708   5.5368   12.643   8.7867   27.291   14.113   3.3714   11.228   23.329   6.9226   13.740   5.8134 9.588927 9.039762 
1 1 1   22    4  -25 o   13.515   5.4698   5.0887   9.3501  -2.8660   17.008   8.5340   11.193   14.676   6.6389   15.481   6.0762 -0.8054104 8.999714 
1 1 1   22    4  -24 o   44.154   3.0142   82.562   10.784   68.590   20.133   88.183   12.770   37.487   6.8406   45.360   3.4802 -7.873642 7.674960 
1 1 1   22    4  -23 o   55.347   2.7495  128.714   12.366  169.748   29.884  120.236   13.584   60.146   6.1832   53.245   3.1437 6.901623 6.936492 
1 1 1   22    4  -22 o   12.089   5.2252   0.7380   9.4292   3.0852   17.151  -0.2788   11.288   16.011   6.9825   12.775   5.6154 3.235972 8.960365 
1 1 1   22    4  -21 o   20.515   5.5849   19.786   9.5884   23.063   13.922   16.830   13.224   21.698   6.9548   19.143   6.7781 2.554613 9.711386 
1 1 1   22    4  -20 o   10.742   4.8860  -3.9919   9.3659   9.1538   14.302 -13.8632   12.393   16.708   6.7638   10.608   5.0727 6.100228 8.454664 
1 1 1   22    4  -19 o   11.254   5.0144  -1.9326   9.3038   11.733   14.027 -12.6662   12.432   17.473   6.8184   10.829   5.1509 6.644160 8.545303 
1 1 1   22    4  -18 f   9.3306   4.3817  -7.5101   8.4721 -12.7888   13.261  -3.8700   11.012   11.268   5.3484   11.761   5.3291 -0.4934940 7.550127 
1 1 1   22    4  -17 o   40.503   3.1590   69.585   10.347   66.375   15.179   72.372   14.142   38.494   4.9522   40.629   4.3373 -2.135082 6.583025 
1 1 1   22    4  -16 o   10.786   4.8044  -1.9377   8.5341 -10.2600   13.337   3.8329   11.105   11.744   5.5095   13.940   5.8325 -2.195508 8.023263 
1 1 1   22    4  -15 o   19.197   5.3611   17.053   8.7094   11.428   13.872   20.714   11.190   17.387   6.7817   20.893   6.1550 -3.506380 9.158337 
1 1 1   22    4  -14 o   32.790   3.9555   46.720   10.359   57.553   14.790   36.288   14.514   35.661   5.2444   27.407   6.5800 8.254782 8.414273 
1 1 1   22    4  -13 o   13.065   5.5475   2.2244   10.286  -2.1708   16.085   5.2656   13.380   14.603   6.5437   15.327   6.4067 -0.7243023 9.157844 
1 1 1   22    4  -12 f   18.044   6.1093   14.640   10.691   17.059   16.702   12.960   13.916   19.836   7.5168   17.950   6.8473 1.885860 10.16796 
1 1 1   22    4  -11 o   34.863   4.0665   52.872   11.340   60.048   17.585   47.763   14.837   35.760   6.2605   32.055   5.8953 3.705540 8.599322 
1 1 1   22    4  -10 o   35.044   3.8288   53.035   10.760   98.258   25.457   43.199   11.872   45.089   7.1656   31.074   4.8451 14.01528 8.649944 
1 1 1   22    4   -9 o   22.711   5.0689   23.573   9.1459   20.290   14.563   25.711   11.753   20.762   7.1280   23.275   6.1161 -2.512686 9.392267 
1 1 1   22    4   -8 o   11.245   4.9264  -0.6695   8.6231   8.8844   14.250  -6.1895   10.831   16.732   6.7595   11.170   5.1450 5.562645 8.494808 
1 1 1   22    4   -7 o   41.790   2.8455   73.401   9.6356   66.132   15.234   78.248   12.440   38.496   4.9708   42.773   3.6013 -4.277599 6.138266 
1 1 1   22    4   -6 o   21.018   5.1777   20.302   8.8119   27.341   13.898   15.570   11.395   23.716   6.8235   18.566   6.3069 5.149754 9.291792 
1 1 1   22    4   -5 o   21.085   5.1923   20.436   8.8643   27.163   14.056   15.994   11.422   23.625   6.8816   18.760   6.3145 4.864717 9.339716 
1 1 1   22    4   -4 o   13.970   5.3721   6.6835   8.6122   15.208   13.620   1.0044   11.117   18.742   6.8475   13.139   5.6761 5.602956 8.894204 
1 1 1   22    4   -3 f   8.9437   4.2640 -10.0193   8.6179 -27.4928   13.485   2.0447   11.205   9.5118   4.7053   13.486   5.7601 -3.974340 7.437632 
1 1 1   22    4   -2 o   21.912   5.0350   21.918   8.8040   33.554   14.236   14.711   11.203   26.378   6.6293   18.174   6.2516 8.204144 9.112082 
1 1 1   22    4   -1 o   41.489   2.9277   72.455   9.8378   72.514   15.672   72.416   12.638   40.426   4.8527   41.027   3.8229 -0.6008339 6.177667 
1 1 1   22    4    0 o   40.948   3.1914   71.003   10.568   65.669   15.490   75.649   14.456   38.300   5.0871   41.644   4.3212 -3.343647 6.674663 
1 1 1   22    4    1 o   19.682   5.6501   17.969   9.5397   13.704   14.253   21.431   12.840   18.325   6.9440   21.224   6.6641 -2.898182 9.624372 
1 1 1   22    4    2 o   25.932   4.8599   30.277   9.8956   28.358   15.234   31.679   13.016   24.010   7.2084   25.820   6.2516 -1.809996 9.541669 
1 1 1   22    4    3 f   50.759   2.7056  107.817   11.154  130.967   17.075   90.584   14.732   55.268   3.8135   45.817   3.9841 9.450180 5.515047 
1 1 1   22    4    4 o   19.408   5.7132   17.461   9.6444   15.336   14.795   19.031   12.718   18.991   7.1009   20.177   6.6601 -1.185400 9.735472 
1 1 1   22    4    5 o   20.876   5.2585   20.078   8.9425   10.250   14.748   25.792   11.246   17.308   6.9165   23.419   5.8957 -6.111097 9.088293 
1 1 1   22    4    6 o   23.346   4.8945   24.706   9.0165   16.333   14.766   29.685   11.386   19.328   7.1186   25.263   5.6685 -5.935574 9.099788 
1 1 1   22    4    7 o   13.968   5.5610   5.8004   9.4989   10.753   18.110   3.9207   11.157   18.345   7.5409   14.033   5.8569 4.311615 9.548229 
1 1 1   22    4    8 o   12.050   5.2186   0.3639   9.4426   7.5326   17.662  -2.5053   11.174   17.398   7.3222   12.223   5.4674 5.175035 9.138241 
1 1 1   22    4    9 o   28.115   4.4849   35.042   9.9332   21.095   17.930   41.218   11.932   21.316   7.8454   30.253   5.0137 -8.937559 9.310598 
1 1 1   22    4   10 o   32.676   3.8946   46.265   10.170   59.316   19.325   41.267   11.960   34.967   7.0241   30.260   5.0246 4.706787 8.636230 
1 1 1   22    4   11 o   9.2237   4.3669  -8.9692   8.7312 -18.6651   13.943  -2.7151   11.198   10.797   5.2181   12.177   5.4580 -1.380201 7.551060 
1 1 1   22    4   12 f   41.641   2.9051   73.012   9.7992   75.139   15.647   71.639   12.570   41.185   4.7474   40.773   3.8266 0.4113541 6.097621 
1 1 1   22    4   13 o   29.967   3.8617   38.984   9.2143   44.611   15.212   35.723   11.581   30.678   6.2944   27.962   5.2741 2.716084 8.211912 
1 1 1   22    4   14 o   15.886   5.5220   10.774   8.7505   33.933   14.717  -1.8910   10.883   26.352   6.8045   12.200   5.4305 14.15134 8.705788 
1 1 1   22    4   15 o   24.427   4.7466   26.920   9.1104   27.532   14.720   26.541   11.599   23.619   7.0847   23.651   6.0060 -0.3211212E-01 9.287893 
1 1 1   22    4   16 o   14.222   5.4775   7.0493   8.9630   27.027   14.407  -5.5658   11.448   23.424   7.0048   11.633   5.3330 11.79113 8.803905 
1 1 1   22    4   17 o   19.145   5.4909   17.028   9.0135   7.1559   14.963   22.651   11.292   16.377   6.8048   21.797   6.1107 -5.419256 9.145813 
1 1 1   22    4   18 f   18.374   5.5212   15.608   8.9340   7.3968   14.589   20.535   11.301   16.311   6.7430   20.764   6.2027 -4.452585 9.161947 
1 1 1   22    4   19 o   23.674   5.2668   25.915   9.9014   19.545   19.293   28.192   11.537   20.824   8.0320   24.403   5.8712 -3.579395 9.949057 
1 1 1   22    4   20 o   32.766   3.9211   46.743   10.265   47.524   19.941   46.462   11.974   30.245   7.9755   32.239   4.6940 -1.994076 9.254365 
1 1 1   22    4   21 o   59.919   2.6788  150.475   13.051  131.694   22.565  159.915   15.998   54.052   5.1850   61.410   3.2070 -7.358017 6.096596 
1 1 1   22    4   22 o   28.965   4.3651   37.250   9.9865   33.846   15.068   39.915   13.336   26.060   6.9614   29.136   5.8188 -3.076340 9.073034 
1 1 1   22    4   23 o   11.932   5.1750   0.4654   9.3127  -9.6419   14.102   8.2828   12.402   12.183   5.6994   15.804   6.3333 -3.620592 8.520156 
1 1 1   22    4   24 o   14.787   5.9644   6.6660   11.075   12.637   14.557  -1.5424   17.067   17.798   6.9457   14.975   6.7231 2.823359 9.666612 
1 1 1   22    4   25 o   43.822   3.9070   83.436   13.810   80.902   15.959   90.992   27.557   42.594   4.6730   41.544   8.4261 1.050545 9.635159 
1 1 1   22    4   26 o   37.255   4.0049   60.703   11.971   61.386   15.745   59.767   18.431   36.453   5.4670   34.966   6.7105 1.487530 8.655591 
1 1 1   22    4   27 o   50.633   2.7311  107.916   11.231   87.529   16.676  124.839   15.192   44.234   4.6965   53.951   3.4730 -9.717522 5.841142 
1 1 1   22    4   28 o   52.255   2.6310  114.735   11.171  109.874   16.784  118.600   14.967   50.035   4.1526   52.520   3.5163 -2.484768 5.441331 
1 1 1   22    4   29 o   32.529   3.8637   46.336   10.045   36.933   15.265   53.516   13.340   27.031   6.9040   34.300   4.9112 -7.268702 8.472611 
1 1 1   22    4   30 o   10.776   4.9063  -3.7705   9.4733 -12.7240   14.904   2.2992   12.271   11.963   5.6758   13.798   5.9624 -1.835853 8.231915 
1 1 1   22    4   31 o   11.276   5.0405  -1.8141   9.4822   3.1517   14.799  -5.2724   12.350   14.974   6.5087   12.012   5.5187 2.962524 8.533436 
1 1 1   22    4   32 o   13.089   5.4464   3.9254   9.6050   23.414   15.109  -9.2916   12.443   21.378   7.2623   11.270   5.2980 10.10842 8.989472 
1 1 1   22    4   33 o   17.795   5.8596   15.020   9.8463   26.227   15.298   7.0942   12.865   22.393   7.2998   15.320   6.3326 7.072818 9.663774 
1 1 1   22    4   34 o   13.264   5.5753   3.7674   10.219   21.008   17.525  -5.1153   12.579   20.431   7.7093   12.099   5.5627 8.332120 9.506694 
1 1 1   22    4   35 o   37.274   3.5544   60.497   10.669   38.622   16.445   76.398   14.020   26.980   7.3012   41.407   4.2124 -14.42676 8.429191 
1 1 1   22    4   36 o   26.334   5.3084   32.946   11.001   65.794   20.314   19.315   13.086   35.521   7.2612   19.604   6.7559 15.91731 9.918077 
1 1 1   22    4   37 o   22.962   5.4950   25.562   10.148   34.181   15.653   19.314   13.328   25.244   7.2346   19.539   6.8135 5.705641 9.938022 
1 1 1   22    4   38 o   30.167   4.7048   41.984   11.192   52.996   15.951   31.305   15.708   32.634   6.2233   23.978   7.3452 8.656940 9.627120 
1 1 1   22    4   39 o   31.172   4.5515   44.582   11.224   57.161   15.943   32.220   15.805   34.111   5.9501   24.231   7.3570 9.880091 9.462030 
1 1 1   22    4   40 o   11.853   5.3005  -1.0010   10.496   8.1975   14.946  -9.9503   14.742   15.915   6.7190   12.066   5.7010 3.849499 8.811673 
1 1 1   22    4   41 o   24.013   6.0166   29.203   11.751   22.228   18.347   34.055   15.302   20.253   7.8271   24.957   7.1533 -4.704212 10.60344 
1 1 1   22    4   42 o   19.207   6.3396   18.995   11.523   21.460   17.985   17.278   15.008   19.937   7.7374   18.526   7.1000 1.411392 10.50131 
1 1 1   22    4   43 o   18.745   6.3602   18.078   11.588  -1.5042   17.501   33.368   15.464   14.415   6.6029   24.454   7.2438 -10.03903 9.801574 
1 1 1   22    4   44 o   38.016   5.1262   68.886   15.481   80.494   19.928   51.218   24.585   39.656   6.3811   27.523   9.2643 12.13383 11.24922 
1 1 1   22    4   45 o   45.859   3.5385   92.788   13.125  114.291   20.146   76.929   17.301   48.976   5.1218   39.720   5.4903 9.255749 7.508387 
1 1 1   22    4   46 o   19.872   6.4246   21.087   11.863   27.086   18.382   16.806   15.531   21.254   7.9213   18.125   7.1440 3.128775 10.66698 
1 1 1   22    4   47 o   9.9307   4.7683 -11.4778   11.199   7.2272   17.414 -24.6702   14.624   15.833   6.9665   9.9491   4.9177 5.884179 8.527346 
1 1 1   22    4   48 o   26.529   5.7583   35.930   12.094   41.823   18.479   31.515   15.996   25.995   7.9675   23.000   7.4622 2.994675 10.91628 
1 1 1   22    4   49 o   22.014   6.3060   26.308   11.895   37.609   18.223   17.917   15.702   24.397   7.9681   18.178   7.1776 6.219631 10.72416 
1 1 1   22    4   50 o   19.011   6.4618   19.902   11.962 -11.3171   18.058   44.310   15.967   12.729   6.0968   27.909   7.0248 -15.18003 9.301543 
1 1 1   22    4   51 f   12.581   5.7495  -1.2454   13.167 -42.2799   23.371   17.835   15.937   11.579   5.8013   17.989   7.1893 -6.409375 9.238016 
1 1 1   22    4   52 o   39.643   4.5895   74.706   14.557  118.889   27.701   57.848   17.111   44.578   7.9130   32.378   6.7040 12.20074 10.37104 
1 1 1   22    4   53 f   16.279   6.5380   13.121   13.247   17.468   25.088   11.441   15.598   18.183   8.1582   16.082   6.8299 2.101261 10.63971 
1 1 1   22    4   54 o   17.335   7.0995   16.163   15.976   0.0000   0.0000   16.163   15.976  ?   ?    17.335   7.0995 0.000000 7.099548 
1 1 1   22    4   55 o   24.508   9.0945   46.869   24.181   0.0000   0.0000   46.869   24.181  ?   ?    24.508   9.0945 0.000000 9.094494 
1 1 1   22    4   56 o   17.172   7.7803   13.027   23.470   0.0000   0.0000   13.027   23.470  ?   ?    17.172   7.7803 0.000000 7.780327 
1 1 1   22    4   57 o   27.793   9.3086   60.012   24.823   0.0000   0.0000   60.012   24.823  ?   ?    27.793   9.3086 0.000000 9.308556 
1 1 1   22    4   58 o   23.206   7.7470   35.538   17.195   52.436   25.022   20.416   23.670   25.344   9.2779   18.291   8.0819 7.053076 12.30437 
1 1 1   22    4   59 o   22.142   7.6740   32.540   16.894   35.306   24.409   29.996   23.405   21.122   8.7259   20.097   8.4419 1.024872 12.14108 
1 1 1   22    4   60 o   11.543   5.5880 -13.3017   16.157 -27.9696   23.774  -0.7137   22.024   12.434   6.1677   14.723   6.9599 -2.289042 9.299531 
1 1 1   22    4   61 o   16.824   7.0917   15.489   16.608   25.413   24.099   6.5110   22.920   18.953   8.2707   15.798   7.3490 3.154321 11.06405 
1 1 1   22    4   62 f   16.522   7.0141   14.425   16.439   25.099   23.517   4.2250   22.989   18.880   8.2056   15.467   7.2489 3.412679 10.94889 
1 1 1   22    4   63 o   12.849   6.0429  -3.5661   16.217 -10.4261   23.657   2.5147   22.273   13.847   6.7171   15.077   7.0878 -1.230005 9.765076 
1 1 1   22    4   64 f   14.825   6.6175   7.4503   16.280 -10.8537   23.598   24.075   22.489   13.756   6.6813   18.582   8.0503 -4.825818 10.46172 
1 1 1   22    4   65 o   14.716   7.0420  -1.9705   23.974  -1.9705   23.974   0.0000   0.0000   14.716   7.0420  ?   ?  0.000000 7.041980 
1 1 1   22    4   66 o   15.689   7.4111   5.6938   24.887   5.6938   24.887   0.0000   0.0000   15.689   7.4111  ?   ?  0.000000 7.411108 
1 1 1   22    4   67 o   13.641   6.6416 -11.0763   23.706 -11.0763   23.706   0.0000   0.0000   13.641   6.6416  ?   ?  0.000000 6.641595 
1 1 1   22    4   68 o   11.420   5.5374 -12.6425   16.032 -14.9685   23.618 -10.6549   21.833   13.235   6.4836   13.255   6.4354 -0.2024746E-01 9.135177 
1 1 1   22    4   69 o   24.512   9.2587   54.653   25.292   54.653   25.292   0.0000   0.0000   24.512   9.2587  ?   ?  0.000000 9.258667 
1 1 1   22    4   70 o   14.918   7.1007   2.1651   23.699   2.1651   23.699   0.0000   0.0000   14.918   7.1007  ?   ?  0.000000 7.100733 
1 1 1   22    4   71 o   18.318   8.1751   26.193   24.833   26.193   24.833   0.0000   0.0000   18.318   8.1751  ?   ?  0.000000 8.175055 
1 1 1   22    4   72 o   18.358   8.1833   26.671   24.807   26.671   24.807   0.0000   0.0000   18.358   8.1833  ?   ?  0.000000 8.183287 
1 1 1   22    4   73 o   14.336   6.8922  -2.1481   23.567  -2.1481   23.567   0.0000   0.0000   14.336   6.8922  ?   ?  0.000000 6.892204 
1 1 1   22    4   74 o   13.959   6.7497  -5.5439   23.401  -5.5439   23.401   0.0000   0.0000   13.959   6.7497  ?   ?  0.000000 6.749723 
1 1 1   22    5  -63 o   11.873   5.9328 -31.7703   23.710   0.0000   0.0000 -31.7703   23.710  ?   ?    11.873   5.9328 0.000000 5.932828 
1 1 1   22    5  -62 o   16.200   7.6018   10.666   25.415   0.0000   0.0000   10.666   25.415  ?   ?    16.200   7.6018 0.000000 7.601845 
1 1 1   22    5  -61 o   18.876   8.3846   28.549   25.809   0.0000   0.0000   28.549   25.809  ?   ?    18.876   8.3846 0.000000 8.384562 
1 1 1   22    5  -60 o   13.640   6.6798 -13.6920   25.012   0.0000   0.0000 -13.6920   25.012  ?   ?    13.640   6.6798 0.000000 6.679813 
1 1 1   22    5  -59 o   12.033   5.7020  -5.6920   14.952   0.0000   0.0000  -5.6920   14.952  ?   ?    12.033   5.7020 0.000000 5.701961 
1 1 1   22    5  -58 o   14.894   6.5236   8.9118   15.115   0.0000   0.0000   8.9118   15.115  ?   ?    14.894   6.5236 0.000000 6.523631 
1 1 1   22    5  -57 o   15.895   6.7515   12.784   15.245   0.0000   0.0000   12.784   15.245  ?   ?    15.895   6.7515 0.000000 6.751483 
1 1 1   22    5  -56 o   18.206   6.6803   19.857   12.984   23.665   24.550   18.379   15.299   18.455   8.1886   17.502   7.0272 0.9530602 10.79045 
1 1 1   22    5  -55 o   12.052   5.6211  -3.1816   13.550  -3.0180   22.030  -3.2811   17.184   14.328   6.8273   13.167   6.2010 1.161378 9.223042 
1 1 1   22    5  -54 o   10.609   5.1456 -13.4454   13.865 -20.6786   22.343  -8.9157   17.681   12.599   6.1990   12.543   6.0144 0.5602646E-01 8.637114 
1 1 1   22    5  -53 o   12.716   5.8276  -0.0771   13.653 -13.0619   21.545   8.6367   17.650   13.153   6.3874   15.394   6.8796 -2.241695 9.387603 
1 1 1   22    5  -52 o   16.255   6.7705   13.551   14.865   0.2793   22.696   23.521   19.671   14.983   7.0777   18.861   7.8165 -3.878177 10.54478 
1 1 1   22    5  -51 o   18.503   7.4137   21.266   16.991  -4.7502   22.577   55.245   25.802   14.393   6.8729   25.638   9.4155 -11.24464 11.65713 
1 1 1   22    5  -50 o   13.860   6.3449   1.6125   16.125  -1.4801   21.853   5.3089   23.892   14.699   6.9440   15.949   7.4470 -1.249843 10.18223 
1 1 1   22    5  -49 o   14.702   6.1826   8.7741   12.576   16.299   22.959   5.5486   15.031   17.598   7.8566   14.417   6.4015 3.181233 10.13442 
1 1 1   22    5  -48 o   11.868   5.4790  -2.6288   12.381 -19.2886   21.967   5.1278   14.989   12.818   6.2736   14.341   6.3788 -1.523568 8.946903 
1 1 1   22    5  -47 o   14.572   5.9823   8.9747   11.378   26.304   22.382   2.9357   13.213   19.667   8.2580   13.382   5.9682 6.285639 10.18889 
1 1 1   22    5  -46 o   14.357   5.9379   8.2922   11.320   22.615   22.636   3.5150   13.073   18.928   8.1376   13.496   5.9824 5.432289 10.09998 
1 1 1   22    5  -45 o   14.409   5.9913   8.1584   11.612  -9.7630   23.045   14.257   13.444   14.141   6.8026   16.630   6.6174 -2.489077 9.490261 
1 1 1   22    5  -44 o   11.932   5.3091   0.9086   10.393 -15.8393   16.785   11.323   13.235   11.638   5.6484   15.724   6.4533 -4.086754 8.576114 
1 1 1   22    5  -43 o   12.493   5.4677   2.5931   10.599   6.2540   17.510   0.4764   13.315   15.305   6.8451   12.969   5.8698 2.335708 9.017190 
1 1 1   22    5  -42 o   15.253   5.9603   10.794   10.731  -4.5622   17.675   19.758   13.504   13.509   6.3393   18.710   6.8212 -5.200681 9.312101 
1 1 1   22    5  -41 o   15.960   6.0426   12.479   10.788   17.573   18.116   9.6799   13.428   18.077   7.4972   15.401   6.4264 2.676453 9.874541 
1 1 1   22    5  -40 o   11.474   5.2220  -1.9328   10.720 -19.1219   17.534   8.3282   13.547   11.662   5.6856   15.100   6.3868 -3.437680 8.550852 
1 1 1   22    5  -39 o   20.069   6.3568   21.841   11.659   8.3555   17.050   33.684   15.979   15.905   6.9486   23.824   7.4274 -7.918911 10.17100 
1 1 1   22    5  -38 o   10.426   4.8951  -6.7046   10.566 -34.3069   17.394   9.4339   13.300   10.239   5.1107   15.473   6.4212 -5.234741 8.206758 
1 1 1   22    5  -37 o   28.692   4.9279   39.435   11.110   27.771   18.009   46.602   14.117   21.444   7.8677   30.270   5.9336 -8.825619 9.854346 
1 1 1   22    5  -36 o   27.844   5.1014   37.448   11.152   35.217   18.833   38.652   13.839   23.873   8.1081   27.117   6.3698 -3.244806 10.31098 
1 1 1   22    5  -35 o   14.078   5.7538   6.9301   10.467   14.013   17.639   3.0808   13.004   17.623   7.3605   13.786   6.0443 3.837379 9.524230 
1 1 1   22    5  -34 o   14.033   5.9070   5.6987   11.497   2.4198   25.301   6.5519   12.906   16.857   7.7998   14.718   6.2300 2.139310 9.982484 
1 1 1   22    5  -33 o   27.402   5.6078   37.125   12.104   34.677   27.254   37.727   13.509   22.759   9.2910   27.041   6.2534 -4.282328 11.19945 
1 1 1   22    5  -32 o   16.525   6.2631   12.674   11.597   2.7127   24.585   15.525   13.152   16.876   7.7656   17.747   6.6824 -0.8710537 10.24489 
1 1 1   22    5  -31 o   33.128   3.8782   49.088   10.275   53.961   15.285   45.072   13.878   32.975   5.9033   30.113   5.8646 2.862232 8.321201 
1 1 1   22    5  -30 o   31.297   4.1462   44.332   10.318   32.736   15.234   54.158   14.024   24.407   7.1793   33.662   5.2847 -9.254673 8.914614 
1 1 1   22    5  -29 o   38.999   3.4266   66.454   10.782   51.585   15.520   80.326   14.991   32.065   6.1617   41.976   4.4488 -9.911221 7.599900 
1 1 1   22    5  -28 o   16.454   5.8914   12.661   10.017  -3.3244   14.915   25.799   13.521   13.300   6.0936   22.030   6.8266 -8.730217 9.150667 
1 1 1   22    5  -27 o   40.465   3.3486   71.136   10.947   88.752   16.495   57.270   14.634   44.002   4.6699   34.701   5.3449 9.301243 7.097543 
1 1 1   22    5  -26 o   18.762   5.8447   17.385   9.8967   19.326   15.094   15.922   13.108   19.468   7.1925   18.135   6.7021 1.333366 9.831020 
1 1 1   22    5  -25 o   52.157   2.9307  116.109   12.410  121.432   20.809  113.170   15.460   51.156   5.0563   50.760   3.7631 0.3960838 6.303006 
1 1 1   22    5  -24 o   38.689   3.3975   64.975   10.606   93.517   15.875   41.965   14.254   45.647   4.3178   29.021   6.2129 16.62571 7.565960 
1 1 1   22    5  -23 f   27.729   5.0596   36.029   11.015   27.740   18.600   40.507   13.670   22.395   8.0267   28.681   6.0384 -6.286299 10.04443 
1 1 1   22    5  -22 o   14.216   5.6235   7.1774   9.6544   3.9357   14.392   9.8295   13.018   14.860   6.4389   16.124   6.4793 -1.264081 9.134593 
1 1 1   22    5  -21 o   18.366   6.0696   16.352   10.561   9.5225   17.976   19.951   13.051   17.254   7.3302   19.908   6.7499 -2.653709 9.964538 
1 1 1   22    5  -20 o   21.177   5.5866   21.728   9.7815   10.926   14.569   30.592   13.198   16.885   6.8299   24.581   6.4917 -7.696112 9.422853 
1 1 1   22    5  -19 o   36.433   3.5447   57.734   10.394   53.272   15.526   61.358   13.993   33.204   5.9550   36.657   4.7980 -3.452309 7.647439 
1 1 1   22    5  -18 o   13.615   5.7453   3.9015   10.921   13.183   14.515  -8.2058   16.578   17.626   6.9189   13.329   6.2169 4.297247 9.301669 
1 1 1   22    5  -17 o   12.323   5.4633  -0.6311   10.906   7.4917   14.211 -12.2700   17.011   15.852   6.6127   12.896   6.1023 2.956880 8.998073 
1 1 1   22    5  -16 o   30.306   5.5065   43.368   13.102   36.548   14.873   67.006   27.688   26.799   6.7987   33.188   9.6557 -6.389118 11.80914 
1 1 1   22    5  -15 o   15.406   6.2833   7.6768   12.450   3.5688   14.444   19.551   24.557   14.920   6.4579   20.804   8.6866 -5.884239 10.82409 
1 1 1   22    5  -14 o   23.209   5.3476   25.509   9.9089   25.286   14.681   25.696   13.429   22.172   7.1451   22.506   6.7705 -0.3342609 9.843386 
1 1 1   22    5  -13 o   33.456   3.7912   48.986   10.157   51.597   15.062   46.808   13.756   32.917   5.8265   31.525   5.5558 1.392208 8.050792 
1 1 1   22    5  -12 o   55.481   2.5657  129.306   11.572  159.954   21.080  116.086   13.845   60.120   4.3305   52.075   3.2782 8.045132 5.431340 
1 1 1   22    5  -11 o   41.677   3.3039   74.523   11.132   82.643   15.933   66.776   15.561   42.910   4.6282   38.140   5.1357 4.769493 6.913457 
1 1 1   22    5  -10 o   17.930   5.6053   15.134   9.0940   20.983   14.811   11.595   11.522   20.557   7.1818   16.605   6.2541 3.952084 9.523205 
1 1 1   22    5   -9 o   9.0060   4.3305 -11.8051   9.3131  -4.2074   14.216 -17.5179   12.327   13.143   5.9940   9.9509   4.8322 3.192285 7.699294 
1 1 1   22    5   -8 o   21.375   5.4582   21.703   9.5423   10.548   14.303   30.651   12.810   16.910   6.7928   24.961   6.2971 -8.051626 9.262592 
1 1 1   22    5   -7 o   18.223   5.8007   15.672   9.6985   10.659   14.526   19.705   13.028   17.006   6.8407   20.071   6.7438 -3.064888 9.605877 
1 1 1   22    5   -6 o   33.480   4.1552   49.562   11.097   43.054   18.504   53.217   13.867   28.523   7.7557   34.027   5.1614 -5.503397 9.316219 
1 1 1   22    5   -5 o   40.324   3.0054   69.109   9.8079   75.573   15.732   64.999   12.544   40.932   4.8065   38.461   4.0625 2.470631 6.293334 
1 1 1   22    5   -4 o   19.196   5.5231   17.458   9.1058   16.431   14.693   18.098   11.602   18.954   7.0785   19.397   6.3593 -0.4433537 9.515520 
1 1 1   22    5   -3 o   18.374   5.7429   15.932   9.5466   17.237   17.578   15.386   11.370   19.593   7.6364   18.191   6.2960 1.402029 9.897165 
1 1 1   22    5   -2 o   20.576   5.5769   20.158   9.5859   1.9664   17.650   27.769   11.417   15.776   6.9743   24.020   5.8792 -8.243788 9.121756 
1 1 1   22    5   -1 o   43.437   2.9892   80.073   10.520   91.237   19.011   75.146   12.629   44.553   5.3410   41.596   3.7654 2.957058 6.534831 
1 1 1   22    5    0 o   27.894   4.4609   34.945   9.8015   23.028   17.758   40.165   11.754   21.429   7.8206   29.577   5.0567 -8.148043 9.313064 
1 1 1   22    5    1 o   38.654   3.5641   64.544   11.104   96.969   19.013   47.761   13.679   46.126   5.1441   32.044   5.4305 14.08251 7.480109 
1 1 1   22    5    2 o   30.373   4.4042   41.233   10.587   46.844   24.341   39.924   11.757   28.418   9.2038   29.471   5.0771 -1.053699 10.51128 
1 1 1   22    5    3 o   12.778   5.3584   3.1126   9.4051   36.535   18.313  -8.8614   10.961   26.148   7.9152   10.579   4.9731 15.56816 9.347829 
1 1 1   22    5    4 o   17.158   5.8101   13.477   9.6699 -17.1151   18.349   25.241   11.378   12.894   6.1678   22.795   6.0310 -9.901128 8.626387 
1 1 1   22    5    5 o   10.170   4.6641  -4.4885   8.7684   15.759   14.681 -15.7154   10.932   18.711   7.0571   9.4119   4.5659 9.299560 8.405372 
1 1 1   22    5    6 o   8.0127   3.9319 -15.9328   8.7995  -3.6784   14.493 -23.0871   11.074   13.389   6.0851   8.5447   4.2335 4.843880 7.412883 
1 1 1   22    5    7 o   67.702   2.2966  191.171   12.656  200.034   18.694  183.672   17.196   68.372   3.3645   65.638   3.2238 2.733948 4.659679 
1 1 1   22    5    8 o   36.364   3.3632   56.881   9.8563   52.745   15.825   59.502   12.598   33.161   6.0784   36.608   4.3039 -3.447571 7.447837 
1 1 1   22    5    9 o   38.648   3.1542   63.821   9.8507   67.688   16.035   61.477   12.484   38.316   5.2737   37.295   4.1782 1.020653 6.728259 
1 1 1   22    5   10 o   15.293   5.5699   9.8273   9.0013   18.928   14.967   4.6701   11.267   19.806   7.1869   14.081   5.8819 5.724948 9.286975 
1 1 1   22    5   11 o   24.885   5.0368   28.735   9.8661   23.003   19.252   30.777   11.489   21.357   8.0754   25.370   5.6957 -4.013083 9.881951 
1 1 1   22    5   12 o   15.813   5.7928   10.641   9.7569   26.145   19.559   5.5049   11.258   22.293   8.1959   14.328   5.9231 7.965031 10.11214 
1 1 1   22    5   13 o   18.389   5.7982   16.103   9.7100   9.8561   19.153   18.264   11.265   17.816   7.5675   19.393   6.2596 -1.576803 9.820929 
1 1 1   22    5   14 o   14.331   5.6563   7.1214   9.7471   2.5612   18.913   8.7707   11.374   16.174   7.1812   15.466   6.1082 0.7077341 9.427628 
1 1 1   22    5   15 o   39.043   3.4881   65.942   10.984   85.901   16.737   50.840   14.559   43.540   4.7950   32.767   5.6549 10.77310 7.414191 
1 1 1   22    5   16 o   41.344   3.0229   72.881   10.117   60.742   16.545   80.131   12.786   35.637   5.9019   42.907   3.6917 -7.270771 6.961378 
1 1 1   22    5   17 o   12.919   5.3017   4.3472   8.9324 -12.8638   14.720   14.379   11.238   11.796   5.6094   17.600   6.2467 -5.803709 8.395655 
1 1 1   22    5   18 o   30.165   4.3227   40.877   10.326   39.032   15.640   42.303   13.748   27.521   6.9665   29.575   5.9094 -2.054249 9.135214 
1 1 1   22    5   19 o   41.192   3.4049   73.338   11.331   73.228   16.189   73.444   15.865   39.811   5.1061   39.986   4.9746 -0.1750717 7.128682 
1 1 1   22    5   20 o   13.145   5.5556   3.4216   10.236   5.7492   14.731   1.2482   14.235   15.478   6.6075   14.199   6.2708 1.279488 9.109445 
1 1 1   22    5   21 o   27.664   4.9958   35.644   10.851   46.922   16.023   26.090   14.747   30.468   6.6398   22.275   7.1596 8.192827 9.764551 
1 1 1   22    5   22 o   11.393   5.0038  -0.0646   8.9464   5.8183   15.035  -3.2894   11.132   15.540   6.6556   11.726   5.3307 3.814004 8.527265 
1 1 1   22    5   23 f   24.456   4.8645   27.916   9.3560   25.339   15.729   29.328   11.639   21.788   7.4096   24.375   5.9179 -2.587540 9.482844 
1 1 1   22    5   24 o   11.458   5.0489  -0.1918   9.1773 -18.6120   15.007   10.813   11.599   11.048   5.3573   16.081   6.2211 -5.033262 8.209915 
1 1 1   22    5   25 o   14.610   5.5790   8.5973   9.2446   6.3468   15.185   9.9226   11.653   15.623   6.6900   15.738   6.1928 -0.1151571 9.116295 
1 1 1   22    5   26 o   18.858   5.6357   17.448   9.3276   18.752   15.645   16.729   11.618   19.293   7.2831   18.391   6.3645 0.9026623 9.672177 
1 1 1   22    5   27 o   23.201   5.4634   26.223   10.161   21.636   15.943   29.361   13.185   20.229   7.4057   23.740   6.5839 -3.510508 9.909210 
1 1 1   22    5   28 o   31.119   4.2805   43.966   10.571   71.528   16.612   25.210   13.703   38.710   5.4122   21.745   6.8920 16.96498 8.763128 
1 1 1   22    5   29 o   15.831   5.8819   11.270   10.120   5.9335   15.423   15.306   13.412   15.439   6.6777   17.810   6.7388 -2.370953 9.486962 
1 1 1   22    5   30 o   13.555   5.5277   5.8879   9.6340  -0.7396   14.597   11.003   12.824   13.639   6.1619   16.203   6.4579 -2.564365 8.926018 
1 1 1   22    5   31 o   27.971   4.6994   36.552   10.335   37.142   15.720   36.104   13.717   25.997   7.1809   26.347   6.4417 -0.3498878 9.646777 
1 1 1   22    5   32 o   44.668   3.0825   86.211   11.155   91.965   16.935   81.802   14.825   44.489   4.7429   42.343   4.3572 2.145855 6.440529 
1 1 1   22    5   33 o   10.464   4.8809  -6.0360   10.219   22.109   17.539 -20.4994   12.573   20.003   7.6730   9.4939   4.6670 10.50930 8.980897 
1 1 1   22    5   34 o   24.945   5.0605   29.987   9.9377   35.970   15.422   25.738   12.996   25.426   7.1459   21.824   6.6802 3.602095 9.782055 
1 1 1   22    5   35 o   30.253   4.2307   41.972   10.148   42.561   15.602   41.540   13.361   28.006   6.8840   28.654   5.9163 -0.6485939 9.077035 
1 1 1   22    5   36 o   13.042   5.6939   2.5436   11.433   1.4211   24.651   2.8512   12.904   16.465   7.6461   13.664   6.0050 2.800843 9.722276 
1 1 1   22    5   37 o   13.250   5.5391   5.1242   10.003  -6.7934   17.471   10.936   12.201   13.360   6.2797   15.797   6.2981 -2.437110 8.893857 
1 1 1   22    5   38 o   16.140   6.2092   12.347   11.508 -16.7505   16.851   37.781   15.755   11.748   5.6920   25.676   7.2248 -13.92787 9.197631 
1 1 1   22    5   39 o   26.189   5.8433   35.298   12.157   23.036   17.955   45.678   16.520   19.764   7.7137   28.403   7.1432 -8.638920 10.51317 
1 1 1   22    5   40 o   32.294   4.8081   49.947   12.272   53.056   18.046   47.273   16.738   30.324   7.3729   28.809   7.1589 1.515331 10.27668 
1 1 1   22    5   41 o   14.742   5.9886   8.9831   11.256   1.9215   16.718   14.839   15.224   14.382   6.5362   17.148   6.9651 -2.765791 9.551684 
1 1 1   22    5   42 o   10.169   4.8660 -10.1969   11.446 -14.5852   17.032  -6.5830   15.456   11.930   5.7661   12.467   5.8743 -0.5370932 8.231355 
1 1 1   22    5   43 o   29.313   5.3589   43.149   12.333   16.799   17.898   66.972   17.018   17.719   7.4085   35.771   6.0522 -18.05109 9.566336 
1 1 1   22    5   44 o   17.819   6.3987   17.379   11.826   35.074   17.201   1.5187   16.285   23.424   7.7462   14.060   6.4136 9.363979 10.05669 
1 1 1   22    5   45 o   12.285   5.5226   0.5244   11.559  -0.6038   16.580   1.5914   16.124   13.722   6.3367   13.992   6.3821 -0.2702551 8.993651 
1 1 1   22    5   46 o   14.493   5.9793   8.6320   11.440   13.823   16.596   3.9319   15.792   16.718   7.0701   14.330   6.4474 2.388394 9.568447 
1 1 1   22    5   47 o   11.842   5.7255 -13.7197   16.831   8.0338   24.640 -32.7472   23.044   16.552   7.6720   12.017   5.9799 4.534072 9.727224 
1 1 1   22    5   48 o   20.235   6.8891   24.422   13.597 -12.2900   23.715   42.401   16.596   13.937   6.7527   26.265   7.4236 -12.32788 10.03538 
1 1 1   22    5   49 o   12.143   5.6517  -3.5139   13.583  -6.9491   24.848  -2.0499   16.222   14.695   7.0679   13.273   6.1770 1.422141 9.386754 
1 1 1   22    5   50 o   10.630   5.2382 -21.9745   16.163 -19.2691   22.461 -24.8798   23.277   12.897   6.3189   12.624   6.2334 0.2722073 8.876059 
1 1 1   22    5   51 o   13.544   6.2942  -0.9244   16.749  -1.6961   23.985  -0.1899   23.400   15.023   7.1484   15.101   7.1494 -0.7873440E-01 10.11012 
1 1 1   22    5   52 o   12.607   6.0003  -7.1633   16.917 -24.5767   24.059   9.8640   23.791   12.776   6.3135   16.446   7.5934 -3.670412 9.875221 
1 1 1   22    5   53 o   11.337   5.5341 -16.6987   16.757  -4.7637   24.053 -27.9542   23.358   14.583   6.9983   12.300   6.1035 2.282900 9.285900 
1 1 1   22    5   54 o   13.132   6.1743  -3.1363   16.913   9.6024   24.096 -15.5071   23.746   16.316   7.5713   13.402   6.5517 2.914890 10.01240 
1 1 1   22    5   55 o   31.308   7.4186   60.315   18.641   57.856   27.031   62.545   25.741   25.286   9.5670   27.201   9.4700 -1.914995 13.46141 
1 1 1   22    5   56 o   12.564   5.9793  -6.5217   16.791 -16.4022   24.435   2.3192   23.114   13.429   6.5821   15.153   7.1535 -1.724187 9.720917 
1 1 1   22    5   57 o   14.526   6.5862   5.5478   16.854  -6.4495   24.049   17.129   23.628   14.263   6.8835   17.285   7.8215 -3.021802 10.41914 
1 1 1   22    5   58 o   14.982   6.7330   7.7960   17.164   12.874   24.793   3.1213   23.787   16.657   7.7123   15.267   7.2220 1.390458 10.56581 
1 1 1   22    5   59 o   14.745   6.6761   6.7149   17.244 -10.8719   25.207   22.185   23.641   13.971   6.8126   18.014   8.0118 -4.043083 10.51668 
1 1 1   22    5   60 o   14.598   6.6088   6.4769   16.892   2.8589   24.776   9.6191   23.089   15.266   7.2647   15.937   7.4006 -0.6702003 10.37042 
1 1 1   22    5   61 o   16.199   6.9812   14.245   16.737   21.000   24.565   8.3919   22.865   17.682   7.9906   15.701   7.3159 1.981063 10.83382 
1 1 1   22    5   62 o   16.463   7.0524   15.472   16.886  -4.1320   24.763   32.510   23.087   14.437   6.9717   19.887   8.3707 -5.450189 10.89370 
1 1 1   22    5   63 o   23.285   7.7909   38.518   17.389   52.138   25.818   27.209   23.526   23.530   9.2303   18.682   8.1620 4.847389 12.32135 
1 1 1   22    5   64 o   12.633   6.0009  -4.4739   16.756  -4.2238   25.004  -4.6778   22.574   14.371   6.9558   13.912   6.7027 0.4591331 9.659686 
1 1 1   22    5   65 o   15.631   6.8995   12.332   17.210   11.483   25.820   13.011   23.086   16.152   7.6050   16.177   7.4730 -0.2567863E-01 10.66216 
1 1 1   22    5   66 f   14.704   7.0481   0.9735   24.238   0.9735   24.238   0.0000   0.0000   14.704   7.0481  ?   ?  0.000000 7.048114 
1 1 1   22    5   67 o   13.186   6.4692 -13.6725   23.781 -13.6725   23.781   0.0000   0.0000   13.186   6.4692  ?   ?  0.000000 6.469151 
1 1 1   22    5   68 o   20.706   8.7672   40.573   25.569   40.573   25.569   0.0000   0.0000   20.706   8.7672  ?   ?  0.000000 8.767154 
1 1 1   22    5   69 o   18.622   8.2643   28.721   25.018   28.721   25.018   0.0000   0.0000   18.622   8.2643  ?   ?  0.000000 8.264261 
1 1 1   22    6  -61 o   13.464   6.5725  -9.6429   23.639   0.0000   0.0000  -9.6429   23.639  ?   ?    13.464   6.5725 0.000000 6.572535 
1 1 1   22    6  -60 o   17.686   8.0715   24.262   25.837   0.0000   0.0000   24.262   25.837  ?   ?    17.686   8.0715 0.000000 8.071527 
1 1 1   22    6  -59 o   13.471   6.5869 -10.6303   24.032   0.0000   0.0000 -10.6303   24.032  ?   ?    13.471   6.5869 0.000000 6.586851 
1 1 1   22    6  -58 o   12.995   6.4072 -17.1601   24.289   0.0000   0.0000 -17.1601   24.289  ?   ?    12.995   6.4072 0.000000 6.407166 
1 1 1   22    6  -57 o   13.055   6.4200 -15.7680   23.870   0.0000   0.0000 -15.7680   23.870  ?   ?    13.055   6.4200 0.000000 6.420018 
1 1 1   22    6  -56 o   18.782   7.1936   23.753   15.400   0.0000   0.0000   23.753   15.400  ?   ?    18.782   7.1936 0.000000 7.193637 
1 1 1   22    6  -55 o   21.461   7.4345   31.697   15.855   0.0000   0.0000   31.697   15.855  ?   ?    21.461   7.4345 0.000000 7.434523 
1 1 1   22    6  -54 o   14.863   7.1288   0.1168   24.881   0.0000   0.0000   0.1168   24.881  ?   ?    14.863   7.1288 0.000000 7.128824 
1 1 1   22    6  -53 o   12.869   6.3535 -20.0568   24.152   0.0000   0.0000 -20.0568   24.152  ?   ?    12.869   6.3535 0.000000 6.353488 
1 1 1   22    6  -52 o   20.103   6.7133   25.074   12.912   34.949   22.567   20.267   15.745   20.601   8.4375   17.807   7.1360 2.793673 11.05053 
1 1 1   22    6  -51 o   18.786   6.7261   21.818   13.057   14.258   22.354   25.734   16.086   16.600   7.5495   19.518   7.3813 -2.918364 10.55836 
1 1 1   22    6  -50 o   11.798   5.4713  -2.2047   12.553 -21.0185   21.135   8.0507   15.604   12.134   5.9814   14.741   6.5352 -2.607531 8.859270 
1 1 1   22    6  -49 o   13.538   5.9569   5.3228   12.733   3.1851   21.481   6.4808   15.810   14.917   6.9962   14.472   6.4861 0.4448404 9.540246 
1 1 1   22    6  -48 f   22.737   6.9510   32.025   14.076   18.823   25.449   37.844   16.896   17.590   8.0214   23.678   7.6682 -6.087942 11.09700 
1 1 1   22    6  -47 o   19.390   6.8877   23.384   13.665   6.5955   24.377   31.078   16.502   15.835   7.4351   21.402   7.5722 -5.566439 10.61220 
1 1 1   22    6  -46 o   9.1226   4.5209 -21.3766   12.658 -20.0637   22.194 -22.0096   15.409   12.571   6.1839   10.231   5.0555 2.339880 7.987455 
1 1 1   22    6  -45 o   13.106   5.8751   2.9216   12.978 -18.6690   23.605   12.276   15.538   13.068   6.4183   15.864   6.7794 -2.795093 9.335681 
1 1 1   22    6  -44 o   13.421   5.9590   4.1027   13.023   1.7939   23.747   5.0956   15.573   15.266   7.2197   14.268   6.4126 0.9972277 9.656421 
1 1 1   22    6  -43 f   11.952   5.5470  -2.7730   12.942   5.5086   23.883  -6.2160   15.399   15.811   7.4033   12.237   5.7951 3.574702 9.401690 
1 1 1   22    6  -42 o   14.262   6.1838   6.9867   13.290   24.586   24.410  -0.4282   15.844   18.893   8.2824   13.349   6.1752 5.543746 10.33105 
1 1 1   22    6  -41 o   10.486   4.9833  -7.9006   11.579   30.274   23.270 -20.4645   13.349   20.188   8.4445   9.5985   4.7358 10.58969 9.681797 
1 1 1   22    6  -40 o   16.359   6.3240   14.173   11.979   63.682   24.354  -1.6284   13.759   28.988   9.1881   12.526   5.7802 16.46223 10.85503 
1 1 1   22    6  -39 o   9.9395   4.7982 -11.8347   11.704 -17.6926   23.590  -9.9219   13.480   13.334   6.5212   11.028   5.2780 2.306757 8.389541 
1 1 1   22    6  -38 o   15.121   6.4055   9.5682   13.660   0.0000   0.0000   9.5682   13.660  ?   ?    15.121   6.4055 0.000000 6.405460 
1 1 1   22    6  -37 f   11.011   5.2791 -10.5411   13.613   0.0000   0.0000 -10.5411   13.613  ?   ?    11.011   5.2791 0.000000 5.279144 
1 1 1   22    6  -36 o   12.784   5.8410  -0.3225   13.581   0.0000   0.0000  -0.3225   13.581  ?   ?    12.784   5.8410 0.000000 5.840974 
1 1 1   22    6  -35 o   11.954   5.3340   0.8938   10.568   23.748   17.128 -13.1552   13.429   19.459   7.5509   10.588   5.1183 8.870358 9.122145 
1 1 1   22    6  -34 o   22.304   5.9697   26.840   11.068   30.156   17.890   24.783   14.087   21.407   7.8436   20.364   7.0099 1.042933 10.51953 
1 1 1   22    6  -33 o   12.349   5.4605   1.8852   10.825   3.3675   18.003   1.0458   13.548   14.794   6.7463   13.122   5.9317 1.671506 8.983232 
1 1 1   22    6  -32 o   11.904   5.3467   0.1110   10.809  -0.8786   17.540   0.7169   13.724   13.980   6.4776   13.133   5.9501 0.8467894 8.795591 
1 1 1   22    6  -31 o   24.942   5.5787   32.000   11.058   31.056   17.759   32.597   14.131   21.924   7.8449   23.735   6.8960 -1.810814 10.44494 
1 1 1   22    6  -30 o   14.260   5.8069   8.1241   10.613   24.483   18.115  -0.4262   13.097   19.876   7.7507   12.729   5.7851 7.146149 9.671606 
1 1 1   22    6  -29 f   15.091   5.9566   10.229   10.810   6.0773   17.776   12.666   13.618   15.429   6.8991   16.321   6.6027 -0.8921824 9.549512 
1 1 1   22    6  -28 o   11.818   5.2998  -0.1795   10.574  -9.8884   17.925   5.0020   13.095   12.900   6.1500   14.066   6.1182 -1.166267 8.674941 
1 1 1   22    6  -27 o   11.749   5.2953  -0.7776   10.705   4.4256   18.563  -3.3707   13.104   15.378   6.9481   12.213   5.6376 3.165224 8.947529 
1 1 1   22    6  -26 o   10.601   4.9548  -5.8336   10.620 -28.2213   17.343   7.5985   13.434   10.708   5.3041   14.918   6.3371 -4.209478 8.263853 
1 1 1   22    6  -25 o   32.399   4.0437   47.975   10.448   46.041   15.207   49.704   14.378   29.329   6.5287   31.261   5.8575 -1.931465 8.771200 
1 1 1   22    6  -24 o   20.192   5.8434   21.156   10.165   36.421   14.871   7.7696   13.926   25.530   6.9575   15.164   6.4473 10.36659 9.485509 
1 1 1   22    6  -23 f   12.670   5.6675   0.3357   12.009  -3.6218   16.431   4.8730   17.594   13.512   6.2638   15.425   6.8827 -1.912750 9.306249 
1 1 1   22    6  -22 o   19.289   6.2178   19.585   11.117   18.030   14.165   22.079   17.939   18.460   6.9385   19.734   7.7079 -1.274588 10.37082 
1 1 1   22    6  -21 o   24.339   5.7992   30.150   11.341   36.428   14.407   19.922   18.390   25.882   6.7571   19.165   7.7012 6.717100 10.24531 
1 1 1   22    6  -20 o   16.147   6.1676   12.117   11.300   18.368   14.671   2.9979   17.719   18.645   7.0495   15.174   6.8282 3.470590 9.814242 
1 1 1   22    6  -19 o   10.161   4.7480  -6.0597   9.7414 -16.0296   14.192   2.8220   13.395   10.809   5.2338   13.860   6.1037 -3.051105 8.040436 
1 1 1   22    6  -18 o   20.248   5.9992   21.176   10.605   28.623   13.900   10.801   16.407   22.808   6.8940   16.652   7.0353 6.156719 9.849989 
1 1 1   22    6  -17 f   13.702   5.6858   5.7762   10.428   1.0629   13.737   12.186   16.019   13.599   6.0739   16.970   7.0451 -3.370781 9.301916 
1 1 1   22    6  -16 o   12.990   5.5569   3.4773   10.458   0.8162   13.940   6.9035   15.818   13.632   6.1015   15.609   6.7571 -1.976975 9.104222 
1 1 1   22    6  -15 o   15.865   6.0048   11.419   10.651   13.604   14.388   8.7700   15.843   17.184   6.8432   16.091   6.8603 1.093105 9.689829 
1 1 1   22    6  -14 o   23.233   5.8223   27.281   11.004   46.446   15.136   5.7990   16.025   30.002   6.3852   15.444   6.7419 14.55822 9.285681 
1 1 1   22    6  -13 o   22.868   5.3975   25.722   9.8983   23.462   14.644   27.623   13.432   20.692   7.1460   22.638   6.7622 -1.946089 9.838292 
1 1 1   22    6  -12 o   26.087   4.8767   32.227   9.9891   47.430   15.023   20.180   13.374   30.503   6.2524   19.540   6.8245 10.96276 9.255596 
1 1 1   22    6  -11 o   12.713   5.3873   3.4879   9.6680   17.412   14.156  -8.6837   13.235   18.515   6.9410   11.533   5.4349 6.981508 8.815679 
1 1 1   22    6  -10 o   22.769   5.4628   25.537   10.009   31.077   14.930   21.014   13.488   23.752   7.1374   19.898   6.8590 3.853912 9.898911 
1 1 1   22    6   -9 o   10.852   5.0275  -5.2559   10.562  -6.0621   14.795  -4.4181   15.082   12.682   5.9010   13.090   6.0445 -0.4083223 8.447393 
1 1 1   22    6   -8 o   38.914   3.6889   66.968   11.562   57.780   15.733   77.756   17.048   34.225   5.8492   40.364   5.3101 -6.138721 7.900024 
1 1 1   22    6   -7 o   38.202   5.1796   69.206   15.714   84.384   19.823   43.535   25.779   41.189   6.0871   25.408   9.3974 15.78092 11.19658 
1 1 1   22    6   -6 o   23.281   5.4196   26.530   10.092   40.271   15.225   15.760   13.478   27.564   6.8149   17.943   6.7629 9.620930 9.601050 
1 1 1   22    6   -5 o   15.235   5.7409   10.080   9.7109   26.149   14.924  -1.7200   12.788   21.827   7.2152   12.713   5.7533 9.114409 9.228203 
1 1 1   22    6   -4 o   28.602   4.4527   37.628   10.044   60.142   15.325   20.673   13.298   35.306   5.5042   19.840   6.8115 15.46672 8.757422 
1 1 1   22    6   -3 o   18.456   6.0728   17.087   10.577   11.003   18.411   20.084   12.922   17.313   7.3888   19.630   6.7151 -2.316975 9.984383 
1 1 1   22    6   -2 o   27.536   5.1356   36.150   11.103   14.567   19.002   47.339   13.682   18.260   7.6339   31.204   5.5838 -12.94475 9.458122 
1 1 1   22    6   -1 o   18.111   6.0980   16.340   10.652   19.871   18.827   14.678   12.918   19.617   7.8228   17.529   6.6178 2.088274 10.24652 
1 1 1   22    6    0 o   16.806   5.8048   13.566   9.6626   10.248   14.601   16.151   12.888   16.366   6.7538   18.077   6.6519 -1.710806 9.479542 
1 1 1   22    6    1 o   12.112   5.2493   1.6083   9.5698   7.1672   14.672  -2.5073   12.625   15.537   6.6124   12.480   5.6750 3.057075 8.713728 
1 1 1   22    6    2 o   13.568   5.6522   5.1164   10.362 -10.2927   18.343   12.338   12.558   13.408   6.3426   16.637   6.4629 -3.228458 9.055277 
1 1 1   22    6    3 o   19.412   6.1145   19.147   10.801   4.9797   18.714   26.224   13.226   16.086   7.1428   22.209   6.7275 -6.122522 9.812147 
1 1 1   22    6    4 o   29.518   4.8658   40.869   11.300   20.565   19.574   51.019   13.840   19.823   7.9523   32.571   5.4018 -12.74769 9.613453 
1 1 1   22    6    5 o   14.792   5.9108   8.2942   10.770 -10.1727   18.903   17.171   13.106   13.608   6.4375   18.455   6.7210 -4.847029 9.306646 
1 1 1   22    6    6 o   32.750   3.9276   48.021   10.276   35.226   15.463   58.141   13.752   25.366   7.1647   35.225   4.9238 -9.859257 8.693484 
1 1 1   22    6    7 o   26.237   4.8630   32.469   10.018   35.794   15.102   29.855   13.387   25.717   7.0123   23.735   6.6532 1.982264 9.666282 
1 1 1   22    6    8 o   19.133   5.5521   18.157   9.1653   21.383   14.896   16.192   11.627   19.982   7.1805   18.002   6.3572 1.979557 9.590306 
1 1 1   22    6    9 o   26.309   4.5328   32.117   9.3701   33.701   14.940   31.089   12.031   24.863   7.0491   24.755   6.0207 0.1078320 9.270252 
1 1 1   22    6   10 o   36.163   3.4165   57.292   9.9520   57.786   16.085   56.985   12.668   34.029   6.0189   35.186   4.5210 -1.156803 7.527745 
1 1 1   22    6   11 o   39.023   3.3435   66.476   10.533   78.734   18.772   60.844   12.725   39.853   5.9614   36.499   4.3633 3.354713 7.387623 
1 1 1   22    6   12 o   18.119   5.8394   16.428   9.8058   26.613   17.597   11.842   11.809   21.528   7.7956   16.255   6.2802 5.272192 10.01059 
1 1 1   22    6   13 o   31.817   4.6939   47.198   11.809   60.660   18.683   38.242   15.239   33.699   7.0290   26.574   6.9552 7.125866 9.888515 
1 1 1   22    6   14 o   37.214   4.6002   64.108   13.658   94.829   19.044   31.574   19.598   44.423   5.3680   22.821   8.2318 21.60216 9.827373 
1 1 1   22    6   15 o   31.240   4.7148   45.654   11.633   68.286   18.229   30.106   15.109   36.559   6.3471   23.180   7.2217 13.37889 9.614505 
1 1 1   22    6   16 o   20.395   5.6416   20.949   9.6954  -2.8158   16.963   32.480   11.816   13.968   6.4357   25.372   5.8348 -11.40443 8.686975 
1 1 1   22    6   17 f   10.424   4.7422  -2.7105   8.8277   4.7260   14.376  -7.2118   11.185   14.671   6.3954   10.737   5.0396 3.934118 8.142405 
1 1 1   22    6   18 o   13.788   5.4448   7.2701   9.0361   16.229   14.531   1.6212   11.539   17.978   6.9608   12.879   5.6685 5.098768 8.976933 
1 1 1   22    6   19 o   22.360   5.1490   24.426   9.1910   17.038   14.701   29.167   11.776   18.230   7.0166   23.748   6.0631 -5.518658 9.273320 
1 1 1   22    6   20 o   20.623   5.3879   21.213   9.1556   16.847   14.595   24.045   11.756   18.129   6.9877   21.292   6.3182 -3.163368 9.420632 
1 1 1   22    6   21 o   22.414   5.1675   24.647   9.2481   33.020   14.688   19.147   11.904   24.311   7.0207   19.017   6.4464 5.293293 9.531357 
1 1 1   22    6   22 o   30.116   3.9311   41.103   9.4204   40.711   14.901   41.364   12.158   27.447   6.7160   29.066   5.3279 -1.618746 8.572689 
1 1 1   22    6   23 f   12.087   5.1454   3.0038   8.8883   3.8749   14.307   2.4563   11.343   14.320   6.3071   12.946   5.6613 1.374006 8.475261 
1 1 1   22    6   24 o   20.475   5.6860   21.515   9.8271   35.191   14.688   10.434   13.222   25.086   6.9459   15.780   6.4601 9.306444 9.485699 
1 1 1   22    6   25 o   29.891   4.3163   41.495   10.213   37.104   15.239   45.075   13.760   25.584   7.0716   29.700   5.8917 -4.116119 9.204299 
1 1 1   22    6   26 o   16.049   5.8026   12.656   9.7450   11.929   14.680   13.229   13.030   16.377   6.7664   16.564   6.5391 -0.1873856 9.409757 
1 1 1   22    6   27 o   42.890   3.4957   81.788   12.116   70.462   16.005   96.987   18.542   37.816   5.3407   44.607   5.1965 -6.790546 7.451615 
1 1 1   22    6   28 o   16.428   5.7936   13.632   9.6540   12.116   14.729   14.774   12.783   16.347   6.7680   16.995   6.5424 -0.6478329 9.413218 
1 1 1   22    6   29 f   32.517   3.9629   48.443   10.287   65.545   15.612   35.320   13.676   36.230   5.4555   25.273   6.5763 10.95759 8.544592 
1 1 1   22    6   30 o   21.949   5.8333   25.435   10.614   37.490   18.138   19.156   13.090   24.129   7.9532   18.517   6.7208 5.612352 10.41265 
1 1 1   22    6   31 o   25.433   5.4034   32.806   10.856   28.329   18.200   35.278   13.526   20.950   7.8669   25.197   6.5319 -4.247198 10.22518 
1 1 1   22    6   32 o   36.516   4.8506   64.594   14.082  102.789   25.861   48.497   16.789   41.168   7.9947   28.859   7.1688 12.30857 10.73813 
1 1 1   22    6   33 o   19.608   6.4034   21.600   11.769   27.227   17.438   16.893   15.949   20.600   7.7077   17.566   7.1312 3.034622 10.50062 
1 1 1   22    6   34 o   16.295   6.2638   13.631   11.705   32.179   17.563  -1.1924   15.700   22.167   7.8145   13.348   6.1650 8.818821 9.953615 
1 1 1   22    6   35 o   18.335   6.4146   18.848   11.818   16.409   17.328   20.968   16.160   17.411   7.2853   18.690   7.3112 -1.279499 10.32124 
1 1 1   22    6   36 o   18.756   6.1032   19.409   10.696   27.609   17.865   14.827   13.354   20.485   7.7715   16.728   6.6148 3.757225 10.20550 
1 1 1   22    6   37 f   13.937   5.9209   6.7819   11.728   26.635   24.941   1.1458   13.289   19.522   8.4677   12.977   5.8696 6.544847 10.30308 
1 1 1   22    6   38 o   21.662   5.9373   25.538   10.794   30.230   17.409   22.607   13.757   21.340   7.7500   19.435   6.9101 1.904255 10.38329 
1 1 1   22    6   39 o   20.552   6.0343   23.316   10.771   11.234   17.330   30.921   13.748   16.059   7.0107   22.829   6.8465 -6.770685 9.799191 
1 1 1   22    6   40 o   12.112   5.4871   0.0185   11.670 -37.6183   24.163   11.469   13.328   11.912   5.9577   15.575   6.4423 -3.662628 8.774805 
1 1 1   22    6   41 o   20.614   6.4558   24.561   12.058   10.516   25.292   28.692   13.717   16.759   7.7698   21.811   6.8932 -5.051661 10.38683 
1 1 1   22    6   42 o   11.901   5.4381  -0.9433   11.775 -19.6806   25.485   4.1429   13.278   13.513   6.6432   13.557   6.0183 -0.4337311E-01 8.963926 
1 1 1   22    6   43 f   18.201   6.4611   19.180   12.023   47.169   25.508   11.185   13.632   23.446   9.1814   15.432   6.4598 8.014136 11.22615 
1 1 1   22    6   44 o   14.066   6.1639   6.2584   13.508   16.442   25.776   2.4027   15.860   17.442   7.9985   13.805   6.3095 3.636689 10.18757 
1 1 1   22    6   45 o   18.048   6.7775   19.534   13.509   29.632   25.095   15.413   16.030   19.557   8.4884   16.705   6.9997 2.852156 11.00221 
1 1 1   22    6   46 o   13.098   5.9098   2.4779   13.374   28.926   25.664  -7.3822   15.670   19.310   8.4780   12.083   5.7576 7.226959 10.24830 
1 1 1   22    6   47 o   10.818   5.2017 -10.3789   13.437   10.327   25.081 -18.7136   15.913   16.396   7.6472   10.753   5.2788 5.642788 9.292266 
1 1 1   22    6   48 f   19.753   7.0966   24.982   14.548   28.721   27.024   23.456   17.263   19.106   8.5274   18.770   7.4889 0.3365078 11.34900 
1 1 1   22    6   49 o   10.534   5.1163 -13.4870   13.833  -4.1567   25.132 -17.5425   16.569   14.643   7.0595   11.089   5.4319 3.554499 8.907378 
1 1 1   22    6   50 o   12.702   5.8071   0.8146   13.452   12.670   25.795  -3.6141   15.765   16.638   7.7586   12.612   5.9395 4.026526 9.771057 
1 1 1   22    6   51 o   12.657   6.0103  -5.1343   16.779  -1.6086   25.178  -7.9510   22.504   14.845   7.1334   13.699   6.6228 1.145921 9.733822 
1 1 1   22    6   52 o   11.076   5.2957  -8.2990   13.495 -30.6226   25.349   0.5295   15.941   12.391   6.1826   13.290   6.1640 -0.8993645 8.730319 
1 1 1   22    6   53 o   12.736   5.8387   0.9355   13.721   7.3933   25.927  -1.5769   16.172   15.840   7.5068   12.972   6.0797 2.867679 9.659968 
1 1 1   22    6   54 o   11.398   5.3912  -5.4806   13.252   14.279   24.681 -13.4852   15.709   16.583   7.6838   11.161   5.4280 5.421994 9.407678 
1 1 1   22    6   55 o   21.377   6.8079   28.778   13.357   56.868   26.584   19.291   15.449   24.301   9.4135   17.428   7.0390 6.872992 11.75424 
1 1 1   22    6   56 o   14.922   6.2941   10.904   13.096 -37.8790   23.967   31.670   15.637   11.511   5.7821   21.491   7.3859 -9.979285 9.380037 
1 1 1   22    6   57 o   16.157   7.0237   14.787   17.239  -6.9435   25.118   34.141   23.704   14.075   6.8492   19.849   8.4244 -5.774577 10.85731 
1 1 1   22    6   58 o   16.361   7.0346   15.896   16.917   10.035   24.716   21.061   23.205   15.828   7.4489   17.378   7.8176 -1.550623 10.79817 
1 1 1   22    6   59 o   19.457   7.5434   27.639   17.082   20.308   25.406   33.686   23.076   17.176   7.9001   19.716   8.3374 -2.539942 11.48580 
1 1 1   22    6   60 o   12.596   5.9578  -2.9076   16.179   17.033   24.632 -18.0388   21.457   16.648   7.7005   12.234   6.0299 4.414202 9.780457 
1 1 1   22    6   61 o   13.105   6.1597  -0.6344   16.810   9.6203   25.109  -8.9647   22.630   15.716   7.4301   13.338   6.4929 2.378386 9.867352 
1 1 1   22    6   62 o   20.341   8.6819   39.353   25.424   39.353   25.424   0.0000   0.0000   20.341   8.6819  ?   ?  0.000000 8.681905 
1 1 1   22    6   63 o   19.036   8.4525   32.648   26.206   32.648   26.206   0.0000   0.0000   19.036   8.4525  ?   ?  0.000000 8.452482 
1 1 1   22    7  -54 o   14.229   6.9357  -4.7903   26.052   0.0000   0.0000  -4.7903   26.052  ?   ?    14.229   6.9357 0.000000 6.935654 
1 1 1   22    7  -53 o   13.980   6.8191  -6.2922   25.314   0.0000   0.0000  -6.2922   25.314  ?   ?    13.980   6.8191 0.000000 6.819090 
1 1 1   22    7  -52 o   15.276   6.6809   12.114   15.799   0.0000   0.0000   12.114   15.799  ?   ?    15.276   6.6809 0.000000 6.680872 
1 1 1   22    7  -51 o   17.202   7.1052   19.607   16.180   0.0000   0.0000   19.607   16.180  ?   ?    17.202   7.1052 0.000000 7.105190 
1 1 1   22    7  -50 o   12.776   6.0266  -2.0556   16.349   0.0000   0.0000  -2.0556   16.349  ?   ?    12.776   6.0266 0.000000 6.026638 
1 1 1   22    7  -49 o   12.033   5.5713  -0.7977   12.937 -23.4514   22.470   10.434   15.822   12.062   5.9858   15.003   6.6194 -2.941041 8.924444 
1 1 1   22    7  -48 o   19.180   6.8083   23.743   13.350   16.577   23.152   27.312   16.340   16.663   7.6185   19.616   7.4346 -2.952936 10.64493 
1 1 1   22    7  -47 o   9.6239   4.7323 -17.0786   12.957 -21.2683   21.393 -14.6514   16.283   12.019   5.9420   11.169   5.4527 0.8496628 8.064708 
1 1 1   22    7  -46 o   10.704   5.1355  -8.8739   12.935 -37.4169   21.536   7.2330   16.178   10.884   5.4690   14.466   6.5157 -3.581720 8.506711 
1 1 1   22    7  -45 o   11.834   5.5334  -2.8070   13.267   25.509   22.585 -17.7258   16.393   18.346   8.0063   10.897   5.3510 7.449381 9.629879 
1 1 1   22    7  -44 o   18.069   6.8221   20.677   13.728   47.799   23.936   7.3811   16.759   23.135   8.9403   14.633   6.6075 8.502211 11.11698 
1 1 1   22    7  -43 o   11.199   5.3179  -6.4364   13.136   30.024   22.712 -24.7645   16.103   19.352   8.2310   10.136   5.0361 9.215700 9.649417 
1 1 1   22    7  -42 o   18.201   7.3481   22.118   16.828   0.0000   0.0000   22.118   16.828  ?   ?    18.201   7.3481 0.000000 7.348120 
1 1 1   22    7  -41 o   15.203   6.7773   9.5836   17.018   0.0000   0.0000   9.5836   17.018  ?   ?    15.203   6.7773 0.000000 6.777286 
1 1 1   22    7  -40 o   17.359   7.2787   18.834   17.351   0.0000   0.0000   18.834   17.351  ?   ?    17.359   7.2787 0.000000 7.278657 
1 1 1   22    7  -38 o   9.6520   4.7638 -19.8640   13.548  -3.3031   23.053 -28.6012   16.745   14.349   6.8769   10.096   5.0354 4.253296 8.523361 
1 1 1   22    7  -37 o   10.241   4.9940 -14.8125   13.545 -22.1357   23.224 -11.0368   16.676   12.586   6.2166   11.869   5.7290 0.7171011 8.453889 
1 1 1   22    7  -36 o   13.465   6.0461   3.8412   13.810   4.6290   23.934   3.4481   16.908   15.464   7.2936   14.111   6.4737 1.352173 9.752211 
1 1 1   22    7  -35 f   15.682   6.5521   12.456   13.985 -22.9948   24.523   29.541   17.024   12.858   6.3578   20.681   7.6389 -7.823139 9.938579 
1 1 1   22    7  -34 o   34.683   4.7123   59.169   12.978   75.025   25.214   53.454   15.137   31.193   9.2521   31.124   6.1844 0.6845284E-01 11.12866 
1 1 1   22    7  -33 o   20.204   6.5903   24.421   12.468   41.583   25.064   18.777   14.372   21.990   8.9350   17.683   6.9013 4.307133 11.28993 
1 1 1   22    7  -32 o   10.069   4.8573 -11.2265   11.941 -27.5758   23.453  -5.5046   13.874   12.313   6.1110   11.773   5.5531 0.5395727 8.257160 
1 1 1   22    7  -31 o   14.769   6.1042   9.8793   11.953   20.857   23.702   6.1352   13.842   18.088   8.0347   14.111   6.2099 3.976631 10.15475 
1 1 1   22    7  -30 o   15.304   6.1947   11.442   11.995  -6.2180   23.457   17.695   13.958   14.312   6.8794   17.449   6.8037 -3.137180 9.675563 
1 1 1   22    7  -29 o   16.588   6.7127   14.906   14.080   50.888   24.961  -1.8866   17.052   24.638   9.2210   13.421   6.2748 11.21728 11.15349 
1 1 1   22    7  -28 o   11.568   5.4879  -7.2685   13.927 -10.8179   22.693  -5.1238   17.640   13.708   6.6330   13.115   6.2086 0.5930700 9.085399 
1 1 1   22    7  -27 o   12.141   5.8521 -11.6416   17.253 -19.3795   23.217  -2.0982   25.784   13.024   6.3903   15.256   7.3011 -2.231159 9.702643 
1 1 1   22    7  -26 f   19.125   7.6217   23.712   17.860   36.337   24.576   9.5828   26.000   21.333   8.7785   16.699   7.7877 4.633863 11.73505 
1 1 1   22    7  -25 o   13.833   6.0382   5.5775   12.852   13.485   17.792  -3.0507   18.584   16.559   7.1673   13.709   6.4539 2.850714 9.644851 
1 1 1   22    7  -24 o   14.073   5.8180   8.0352   10.863  -9.8750   17.480   19.304   13.865   12.467   5.9785   18.139   6.8543 -5.671283 9.095299 
1 1 1   22    7  -23 o   10.340   4.9384  -9.1226   11.670   3.8937   23.468 -13.3991   13.451   15.687   7.3428   10.514   5.0922 5.172132 8.935749 
1 1 1   22    7  -22 o   17.026   6.1847   15.794   11.087   16.548   18.069   15.338   14.042   17.340   7.3571   16.843   6.7426 0.4969559 9.979514 
1 1 1   22    7  -21 o   16.845   6.1641   15.310   11.043   7.9612   18.005   19.742   13.982   15.498   6.9356   18.341   6.8936 -2.842903 9.778791 
1 1 1   22    7  -20 o   20.858   6.1807   24.251   11.257   31.935   18.243   19.525   14.304   21.709   7.9260   18.260   6.9478 3.449055 10.54004 
1 1 1   22    7  -19 o   25.846   5.1210   33.527   10.408   33.931   14.968   33.150   14.481   23.642   7.1558   23.537   7.0191 0.1055107 10.02360 
1 1 1   22    7  -18 o   22.605   5.6069   26.830   10.281   17.596   14.846   35.340   14.252   17.652   6.9764   24.611   6.8522 -6.959024 9.778683 
1 1 1   22    7  -17 o   15.055   5.8119   10.860   10.108  -1.5264   14.762   21.794   13.869   12.960   5.9827   19.197   6.9248 -6.237751 9.151301 
1 1 1   22    7  -16 o   14.304   5.7072   8.9308   10.026   5.7537   14.717   11.682   13.696   14.456   6.3807   15.808   6.5340 -1.352160 9.132674 
1 1 1   22    7  -15 o   13.691   5.6326   7.1470   10.115  -3.0210   14.962   15.708   13.728   12.778   5.9417   17.087   6.7223 -4.309327 8.971805 
1 1 1   22    7  -14 o   29.621   4.4831   41.838   10.486   29.226   15.269   53.096   14.426   21.771   7.3008   32.044   5.7335 -10.27323 9.283010 
1 1 1   22    7  -13 o   14.038   5.8047   7.6034   10.815   10.239   14.539   4.3386   16.182   15.567   6.6021   14.537   6.5349 1.029952 9.289348 
1 1 1   22    7  -12 o   30.102   4.8274   44.073   11.445   47.141   19.543   42.472   14.120   26.708   8.1951   27.909   6.3501 -1.200611 10.36745 
1 1 1   22    7  -11 o   14.109   5.6141   8.4728   9.6762   17.219   13.704  -0.2230   13.665   17.667   6.7810   12.909   5.8831 4.758125 8.977348 
1 1 1   22    7  -10 o   16.582   5.8333   14.257   9.7823   19.946   14.260   9.2005   13.444   18.614   6.9690   15.140   6.3811 3.474527 9.449051 
1 1 1   22    7   -9 o   10.774   5.0011  -4.2895   10.528   10.270   16.772 -13.7549   13.523   16.007   6.9435   10.597   5.1259 5.409600 8.630581 
1 1 1   22    7   -8 o   19.825   6.5810   22.273   12.412   9.2908   26.804   25.817   14.004   17.198   7.9821   20.918   6.9915 -3.720087 10.61107 
1 1 1   22    7   -7 o   9.7044   4.7233 -14.9542   11.959 -37.7468   26.760  -9.2655   13.369   12.770   6.3689   11.194   5.3294 1.576763 8.304561 
1 1 1   22    7   -6 o   11.921   5.4418  -1.6314   11.754 -16.3105   27.059   1.7823   13.049   14.490   7.0640   13.176   5.8999 1.313497 9.203723 
1 1 1   22    7   -5 o   10.680   4.9720  -4.8085   10.524   9.4720   18.464 -11.6810   12.809   16.151   7.1369   10.585   5.0867 5.565867 8.764160 
1 1 1   22    7   -4 o   14.453   5.9433   8.2937   11.254   2.9618   14.405   16.647   18.030   13.878   6.2077   17.729   7.4257 -3.850505 9.678681 
1 1 1   22    7   -3 f   24.914   5.5022   31.688   10.875   24.119   14.450   41.578   16.517   20.213   7.0912   26.381   7.3885 -6.167242 10.24084 
1 1 1   22    7   -2 o   13.284   5.5699   5.6335   10.160   9.3227   13.482   0.7843   15.457   15.248   6.4062   13.750   6.2630 1.497788 8.959089 
1 1 1   22    7   -1 o   10.711   4.9565  -3.9869   10.222   2.3834   13.691 -12.0083   15.364   13.544   6.0555   11.632   5.5852 1.911557 8.237965 
1 1 1   22    7    0 o   8.6978   4.2226 -12.3054   9.3956  -6.0967   13.750 -17.7445   12.869   11.895   5.5847   9.8049   4.7997 2.089961 7.363777 
1 1 1   22    7    1 o   11.295   5.1207  -1.3784   10.185  -7.4816   16.260   2.5620   13.065   12.609   5.9664   13.384   5.9542 -0.7756462 8.429139 
1 1 1   22    7    2 o   30.657   4.1819   43.730   10.178   45.917   14.978   41.854   13.874   29.028   6.4927   27.946   6.2478 1.082788 9.010554 
1 1 1   22    7    3 f   12.513   5.3290   3.9463   9.5408  -4.1675   14.093   10.810   12.963   12.362   5.7546   15.593   6.3916 -3.231431 8.600445 
1 1 1   22    7    4 o   16.550   5.7878   14.072   9.6209   11.088   14.139   16.645   13.129   15.854   6.6032   17.557   6.6619 -1.703216 9.379969 
1 1 1   22    7    5 o   16.347   5.8723   13.650   9.9615  -9.1914   14.481   34.168   13.725   11.676   5.5557   24.629   6.6723 -12.95254 8.682418 
1 1 1   22    7    6 o   19.782   5.8547   20.856   10.106   10.080   14.408   31.289   14.177   15.601   6.5923   23.165   6.9538 -7.563153 9.581930 
1 1 1   22    7    7 o   22.075   6.2065   26.639   11.632   26.541   14.705   26.803   19.011   21.040   7.1643   20.371   7.9410 0.6689758 10.69518 
1 1 1   22    7    8 o   11.563   5.3004  -2.3383   11.305  -7.1171   14.224   5.8583   18.629   11.883   5.6103   15.445   6.9710 -3.561099 8.948198 
1 1 1   22    7    9 o   15.091   6.0838   10.142   11.517   19.639   14.648  -5.2362   18.640   18.501   7.0328   13.633   6.4321 4.867862 9.530615 
1 1 1   22    7   10 o   12.374   5.4378   2.2564   10.580  -4.1969   14.143   10.457   15.944   12.332   5.7488   15.905   6.8336 -3.572398 8.930080 
1 1 1   22    7   11 o   10.649   4.8849  -2.7488   9.6228   0.0953   13.714  -5.5071   13.506   12.991   5.9102   11.847   5.5534 1.144661 8.109921 
1 1 1   22    7   12 o   10.790   4.9348  -2.3398   9.7233 -21.8799   13.825   16.789   13.678   9.7365   4.8068   17.497   6.7592 -7.760686 8.294111 
1 1 1   22    7   13 o   15.973   5.8222   13.000   9.8378   3.2482   14.053   22.370   13.776   13.748   6.1416   19.499   6.9167 -5.751324 9.249853 
1 1 1   22    7   14 o   10.536   4.8642  -3.4594   9.7586 -30.5153   13.815   23.487   13.787   8.9021   4.4600   19.919   6.9309 -11.01702 8.241857 
1 1 1   22    7   15 o   14.127   5.7932   8.0266   10.656  -3.4550   14.119   23.224   16.243   12.407   5.7702   19.421   7.4003 -7.014676 9.383997 
1 1 1   22    7   16 o   18.433   6.0731   18.601   10.576   17.609   14.106   19.874   15.983   17.701   6.8572   18.368   7.2450 -0.6662674 9.975528 
1 1 1   22    7   17 o   12.734   5.5220   3.7166   10.601  -2.0519   14.092   11.235   16.089   12.637   5.8379   15.998   6.8689 -3.361134 9.014626 
1 1 1   22    7   18 o   18.563   6.1640   19.070   10.889   18.932   14.391   19.257   16.655   18.101   6.9486   18.128   7.3132 -0.2646065E-01 10.08788 
1 1 1   22    7   19 o   17.896   6.0890   17.550   10.622   28.317   14.121   3.5206   16.119   21.664   7.0098   14.280   6.4611 7.384604 9.533209 
1 1 1   22    7   20 o   15.820   6.0464   12.734   10.865   24.373   14.339  -2.9547   16.648   20.010   7.0605   13.256   6.1985 6.753987 9.395294 
1 1 1   22    7   21 o   42.713   3.5459   82.349   12.234   54.610   15.595  126.748   19.730   31.723   6.2531   51.084   4.7941 -19.36064 7.879380 
1 1 1   22    7   22 o   11.972   5.3495   1.0105   10.668   6.9140   13.874  -7.5303   16.687   14.448   6.2906   12.552   5.9698 1.896212 8.672424 
1 1 1   22    7   23 o   15.210   5.9618   11.273   10.764   11.988   13.955   10.222   16.912   15.811   6.5707   15.759   6.9016 0.5240250E-01 9.529199 
1 1 1   22    7   24 o   17.425   6.4232   16.999   12.026  -5.8556   16.719   41.501   17.311   12.783   6.0493   25.349   7.7003 -12.56550 9.792301 
1 1 1   22    7   25 o   20.398   6.5689   24.308   12.410   34.075   17.339   14.049   17.770   22.568   7.7767   16.685   7.1922 5.882181 10.59267 
1 1 1   22    7   26 f   52.661   3.3246  123.816   14.198   94.730   19.526  156.450   20.683   42.558   5.7776   57.274   4.4653 -14.71595 7.302003 
1 1 1   22    7   27 o   14.441   6.0983   8.3406   12.318  -9.5360   17.333   26.580   17.508   12.434   5.9601   19.986   7.6662 -7.551812 9.710486 
1 1 1   22    7   28 o   25.847   6.8173   39.220   14.567   15.113   23.525   54.211   18.552   17.241   7.8028   29.330   7.6729 -12.08920 10.94340 
1 1 1   22    7   29 o   30.500   6.0958   50.458   14.625   63.048   23.799   42.819   18.539   28.847   9.0748   25.027   8.0257 3.819902 12.11465 
1 1 1   22    7   30 o   17.187   6.7429   16.889   13.779   71.099   23.702 -10.7853   16.935   31.472   8.8638   12.101   5.8242 19.37091 10.60600 
1 1 1   22    7   31 o   14.345   6.2375   7.2964   13.602   25.910   22.075  -4.0964   17.271   19.122   8.1232   13.099   6.1836 6.022556 10.20904 
1 1 1   22    7   32 o   15.825   6.5044   12.805   13.472   19.283   22.279   9.0715   16.914   17.740   7.8396   15.313   6.7955 2.427705 10.37489 
1 1 1   22    7   33 o   11.509   5.5847 -13.6689   16.383   0.0000   0.0000 -13.6689   16.383  ?   ?    11.509   5.5847 0.000000 5.584661 
1 1 1   22    7   34 o   15.006   6.7493   7.5725   17.288   0.0000   0.0000   7.5725   17.288  ?   ?    15.006   6.7493 0.000000 6.749258 
1 1 1   22    7   35 f   13.194   6.0335   1.5024   14.532   3.9225   27.896   0.6010   17.025   15.894   7.6034   13.674   6.3516 2.220401 9.907260 
1 1 1   22    7   36 o   22.197   7.2991   32.185   15.280   41.877   27.778   27.979   18.298   21.234   9.0693   19.854   7.7758 1.379730 11.94633 
1 1 1   22    7   37 o   18.482   7.5985   23.091   18.391   30.209   27.226   17.117   24.942   19.233   8.5731   17.240   7.8918 1.992561 11.65244 
1 1 1   22    7   38 o   13.187   6.4881 -18.2249   24.477 -18.2249   24.477   0.0000   0.0000   13.187   6.4881  ?   ?  0.000000 6.488131 
1 1 1   22    7   39 o   22.258   9.2320   47.404   27.473   47.404   27.473   0.0000   0.0000   22.258   9.2320  ?   ?  0.000000 9.231982 
1 1 1   22    7   40 o   11.283   5.5255 -17.0402   17.107 -29.9262   25.821  -6.9585   22.839   12.560   6.2629   13.854   6.6915 -1.293603 9.165198 
1 1 1   22    7   41 o   15.282   6.8347   9.6996   17.455   20.381   26.480   1.4918   23.212   17.594   8.0826   14.849   7.0564 2.744763 10.72943 
1 1 1   22    7   42 o   14.746   6.6939   7.0319   17.473   32.796   25.709 -15.0857   23.821   19.579   8.5434   13.224   6.4852 6.354733 10.72599 
1 1 1   22    7   43 o   19.927   7.7671   29.108   18.185   10.754   28.031   42.447   23.897   16.356   7.7670   21.898   8.7860 -5.542645 11.72689 
1 1 1   22    7   44 o   21.833   7.9246   35.479   18.199 -13.8208   26.901   77.085   24.713   13.852   6.8129   31.371   9.1207 -17.51879 11.38431 
1 1 1   22    7   45 o   12.633   6.0226  -5.2951   17.185  -5.9624   25.544  -4.7434   23.227   14.286   6.9416   14.021   6.7662 0.2648592 9.693618 
1 1 1   22    7   46 o   13.630   6.3538   1.3887   17.279   22.951   26.535 -14.4856   22.767   17.712   8.1198   12.954   6.3499 4.758847 10.30793 
1 1 1   22    7   47 o   11.865   5.7382 -10.4606   16.932   1.7469   25.588 -19.9687   22.583   15.009   7.2068   12.419   6.1334 2.589934 9.463413 
1 1 1   22    7   48 o   16.107   7.0289   14.683   17.404   19.060   26.197   11.226   23.286   17.083   7.9158   15.883   7.3949 1.199939 10.83256 
1 1 1   22    7   49 o   9.9091   4.9477 -27.6598   16.358 -36.3696   24.756 -20.9102   21.793   11.721   5.8858   12.101   5.9853 -0.3803511 8.394464 
1 1 1   22    7   50 o   13.786   6.3989   3.0626   17.230   19.884   26.081  -9.9650   22.952   17.077   7.9078   13.306   6.4910 3.771418 10.23070 
1 1 1   22    7   51 o   11.099   5.4472 -16.5243   16.904  -4.8904   25.830 -25.2407   22.358   14.234   6.9309   11.855   5.8976 2.378920 9.100475 
1 1 1   22    7   52 o   14.858   6.7072   9.4489   17.252 -13.1249   25.878   27.506   23.145   13.494   6.6454   18.291   8.0401 -4.796927 10.43097 
1 1 1   22    7   53 o   13.456   6.2694   1.9977   16.788   3.9292   26.072   0.6296   21.942   15.068   7.2453   14.182   6.7731 0.8855028 9.918140 
1 1 1   22    7   54 o   13.838   6.3879   4.2031   16.827 -18.6903   26.088   20.514   22.020   13.101   6.4922   17.090   7.6575 -3.989323 10.03922 
1 1 1   22    7   55 o   16.798   7.1728   18.483   17.367   50.373   27.582  -2.4656   22.355   21.765   9.1546   13.897   6.6890 7.868076 11.33798 
1 1 1   22    7   56 o   12.297   5.8946  -6.3158   16.954 -26.9431   27.178   6.8261   21.693   12.757   6.3710   14.972   7.0249 -2.215093 9.483585 
1 1 1   22    8  -48 o   16.293   7.4563   16.043   22.246   0.0000   0.0000   16.043   22.246  ?   ?    16.293   7.4563 0.000000 7.456276 
1 1 1   22    8  -47 o   15.573   7.1523   12.196   20.718   0.0000   0.0000   12.196   20.718  ?   ?    15.573   7.1523 0.000000 7.152338 
1 1 1   22    8  -46 o   18.412   7.9645   28.154   21.942   0.0000   0.0000   28.154   21.942  ?   ?    18.412   7.9645 0.000000 7.964480 
1 1 1   22    8  -45 o   16.768   7.1438   18.732   17.159   0.0000   0.0000   18.732   17.159  ?   ?    16.768   7.1438 0.000000 7.143839 
1 1 1   22    8  -44 o   11.512   5.5890 -10.9451   16.463   0.0000   0.0000 -10.9451   16.463  ?   ?    11.512   5.5890 0.000000 5.589030 
1 1 1   22    8  -43 o   16.380   6.6671   16.765   13.984   40.396   23.167   3.2204   17.539   20.790   8.5357   13.728   6.4003 7.061971 10.66868 
1 1 1   22    8  -42 o   10.166   4.9612 -13.5272   13.445 -25.6560   21.484  -5.7193   17.237   11.543   5.7486   12.396   5.9423 -0.8528070 8.267844 
1 1 1   22    8  -41 o   16.645   7.0076   17.811   16.185   33.850   22.313  -0.0012   23.514   19.661   8.2496   14.321   6.8849 5.340298 10.74510 
1 1 1   22    8  -40 o   17.420   7.1049   20.497   15.919   33.319   22.965   8.6371   22.087   19.465   8.2777   15.237   7.1296 4.227267 10.92483 
1 1 1   22    8  -39 o   11.996   5.7361  -6.2432   15.845   4.9962   22.824 -16.6993   22.014   14.868   7.0453   12.453   6.1321 2.415104 9.340174 
1 1 1   22    8  -38 o   15.426   6.7864   12.277   16.519 -11.0714   23.711   34.297   23.027   13.334   6.5245   19.774   8.3436 -6.440533 10.59171 
1 1 1   22    8  -37 o   12.109   5.7884  -6.2562   16.102   10.060   22.883 -22.2587   22.663   15.616   7.2904   12.190   6.0425 3.425761 9.468986 
1 1 1   22    8  -36 o   12.682   5.8337   1.1275   13.858 -31.5017   22.923   19.922   17.397   11.590   5.7977   17.288   7.2709 -5.697338 9.299491 
1 1 1   22    8  -35 o   18.757   6.9668   23.289   14.196   36.587   23.151   15.275   17.971   20.387   8.4669   16.231   7.1112 4.156212 11.05699 
1 1 1   22    8  -34 o   9.5483   4.7223 -19.9781   13.556 -10.6535   22.184 -25.5349   17.125   13.142   6.4045   10.371   5.1598 2.770621 8.224441 
1 1 1   22    8  -33 f   15.034   6.4803   10.989   14.426   1.4674   22.815   17.332   18.621   14.587   6.9498   16.729   7.2858 -2.142217 10.06890 
1 1 1   22    8  -32 o   30.310   7.7344   61.104   19.170   85.492   25.134   27.184   29.642   33.503   9.0090   18.161   8.4169 15.34172 12.32912 
1 1 1   22    8  -31 o   14.932   6.7760   8.3082   17.884   3.9336   23.564   14.252   27.467   15.039   7.1357   16.609   7.8276 -1.570310 10.59199 
1 1 1   22    8  -30 o   16.113   7.0938   14.076   18.080   29.388   23.476  -8.2458   28.345   19.038   8.2366   14.515   7.1092 4.522338 10.88038 
1 1 1   22    8  -29 o   16.904   6.8460   17.375   14.659   53.917   24.342  -3.4166   18.362   24.598   9.1255   13.210   6.2771 11.38816 11.07592 
1 1 1   22    8  -28 o   8.1011   4.0695 -27.5186   11.880   5.5201   21.937 -41.2287   14.132   15.107   7.0806   8.0981   4.1106 7.009389 8.187300 
1 1 1   22    8  -27 o   12.744   5.7136   2.9834   12.281 -11.2264   22.328   9.1464   14.705   13.240   6.4465   14.733   6.4443 -1.492518 9.115149 
1 1 1   22    8  -26 o   10.395   4.9828  -8.9585   12.117  -1.7334   22.515 -11.9045   14.377   14.316   6.8435   10.890   5.2717 3.426037 8.638549 
1 1 1   22    8  -25 o   9.8171   4.7692 -12.7169   12.040 -25.4889   22.346  -7.4920   14.293   12.022   5.9665   11.484   5.4794 0.5388584 8.100812 
1 1 1   22    8  -24 o   9.2558   4.5580 -17.6407   12.166  -4.5111   23.575 -22.4067   14.204   14.229   6.8543   9.6402   4.7795 4.589278 8.356104 
1 1 1   22    8  -23 o   12.713   5.7418   2.1747   12.662  -8.2055   25.396   5.6090   14.608   14.190   6.9011   13.967   6.2490 0.2229586 9.309897 
1 1 1   22    8  -22 o   10.927   5.1753  -6.2741   12.287  -0.9754   24.569  -8.0414   14.189   14.794   7.0926   11.383   5.4393 3.410653 8.938200 
1 1 1   22    8  -21 o   10.827   5.1277  -6.3252   12.060 -13.0069   23.764  -4.0077   13.996   13.447   6.5696   11.956   5.6200 1.490841 8.645481 
1 1 1   22    8  -20 o   10.285   4.9376  -9.5032   11.997  -9.6523   23.907  -9.4531   13.869   13.803   6.7089   11.067   5.3117 2.736090 8.557051 
1 1 1   22    8  -19 o   12.362   5.5948   1.3012   12.095 -15.6840   24.279   6.9080   13.949   13.339   6.5427   14.160   6.2325 -0.8208246 9.036083 
1 1 1   22    8  -18 o   16.750   6.3891   16.072   12.115   18.166   24.478   15.393   13.943   17.350   7.8943   16.483   6.6764 0.8673325 10.33897 
1 1 1   22    8  -17 o   9.8544   4.7682 -11.6721   11.727 -22.8608   23.233  -7.8466   13.585   12.524   6.1917   11.219   5.3500 1.304688 8.182881 
1 1 1   22    8  -16 o   11.506   5.3093  -1.9315   11.608  -3.7020   24.270  -1.4064   13.218   14.538   6.9906   12.200   5.6425 2.337781 8.983627 
1 1 1   22    8  -15 o   25.639   6.1200   36.743   12.613   67.811   25.657   26.843   14.484   28.454   9.4622   20.433   7.1042 8.020863 11.83226 
1 1 1   22    8  -14 o   24.508   6.9804   36.918   14.616   0.0000   0.0000   36.918   14.616  ?   ?    24.508   6.9804 0.000000 6.980363 
1 1 1   22    8  -13 o   16.413   6.1771   14.917   11.235   6.5545   18.797   19.566   14.014   15.040   6.8720   17.915   6.8620 -2.875007 9.711420 
1 1 1   22    8  -12 o   13.830   5.7838   7.7580   10.913   0.9319   18.805   11.225   13.401   14.142   6.6043   15.285   6.4021 -1.143761 9.198029 
1 1 1   22    8  -11 o   9.2208   4.4815 -12.5841   10.663  -2.9237   14.746 -23.1694   15.436   12.468   5.8312   10.121   5.0116 2.347466 7.688905 
1 1 1   22    8  -10 o   9.3869   4.4953  -8.7179   9.8087 -19.8994   14.381   1.0096   13.413   10.034   4.9437   12.793   5.8296 -2.759190 7.643655 
1 1 1   22    8   -9 o   13.072   5.4818   6.1807   9.8441   2.3970   14.319   9.5716   13.555   13.348   6.0594   14.872   6.3432 -1.523761 8.772269 
1 1 1   22    8   -8 o   13.649   5.6139   7.7100   10.044  -4.7001   14.462   19.274   13.961   12.095   5.6939   17.879   6.8488 -5.783854 8.906566 
1 1 1   22    8   -7 o   28.478   4.7130   39.984   10.558   53.381   15.715   28.960   14.255   30.742   6.4759   21.469   7.0494 9.273230 9.572410 
1 1 1   22    8   -6 o   34.300   5.4679   60.968   14.775   0.0000   0.0000   60.968   14.775  ?   ?    34.300   5.4679 0.000000 5.467920 
1 1 1   22    8   -5 o   15.084   5.9880   11.284   10.983   1.0017   18.043   17.337   13.843   14.038   6.5269   17.253   6.7616 -3.214731 9.397861 
1 1 1   22    8   -4 o   17.977   5.8810   17.936   9.9249   3.8341   13.811   32.994   14.272   13.541   6.0660   23.158   6.9827 -9.616878 9.249583 
1 1 1   22    8   -3 o   12.329   5.3447   3.6978   9.9248   5.4001   14.087   2.0198   13.986   13.965   6.1993   13.202   5.9912 0.7638388 8.621281 
1 1 1   22    8   -2 o   20.560   5.8035   23.227   10.149   30.904   14.394   15.637   14.313   22.237   7.0655   16.719   6.7672 5.517584 9.783431 
1 1 1   22    8   -1 o   14.027   5.6121   8.8758   9.7216   20.318   13.637  -2.9480   13.863   18.321   6.8238   12.207   5.6907 6.113667 8.885285 
1 1 1   22    8    0 o   15.619   6.1113   12.655   11.294   15.065   14.372   8.7635   18.262   16.551   6.7506   15.446   6.9429 1.104504 9.683766 
1 1 1   22    8    1 o   17.077   6.2017   16.367   11.148   25.782   13.956  -0.2295   18.529   20.329   6.9779   13.968   6.5338 6.361620 9.559382 
1 1 1   22    8    2 o   17.442   6.2434   17.267   11.249   24.305   14.056   4.7301   18.761   19.725   6.9876   14.805   6.8020 4.920145 9.751656 
1 1 1   22    8    3 o   16.940   6.4485   16.236   12.326   19.691   13.739   1.9859   27.901   18.078   6.8250   15.807   7.5728 2.270953 10.19451 
1 1 1   22    8    4 o   15.429   6.1888   12.025   11.854   18.766   16.192   4.2379   17.402   17.615   7.1726   14.452   6.6066 3.163160 9.751613 
1 1 1   22    8    5 o   15.052   5.9413   11.258   10.755   21.915   13.968  -4.2613   16.855   18.837   6.9259   12.924   6.1033 5.913586 9.231419 
1 1 1   22    8    6 o   12.726   5.6314   3.2151   11.533  -7.7225   13.527   32.319   22.066   11.274   5.3659   20.484   8.3609 -9.209520 9.934672 
1 1 1   22    8    7 o   9.8939   4.7122  -7.8413   10.470 -19.0520   13.859   7.0645   15.981   9.9162   4.8796   14.710   6.5618 -4.793430 8.177269 
1 1 1   22    8    8 o   16.224   6.0593   14.302   10.767   4.4064   13.964   28.812   16.909   13.691   6.1188   20.561   7.6097 -6.870318 9.764548 
1 1 1   22    8    9 o   18.933   6.1737   20.562   10.942   4.8585   14.091   44.412   17.366   13.817   6.1627   26.009   7.6690 -12.19167 9.838363 
1 1 1   22    8   10 o   12.285   5.4125   2.8626   10.544   11.489   13.808  -9.2063   16.332   15.427   6.4822   12.043   5.7761 3.383687 8.682281 
1 1 1   22    8   11 o   15.190   5.9430   11.733   10.679   15.968   13.954   5.7442   16.593   16.759   6.7172   14.526   6.5655 2.233342 9.392928 
1 1 1   22    8   12 o   9.7147   4.6521  -8.8882   10.503 -14.1561   13.692  -1.3551   16.373   10.409   5.0635   13.200   6.1638 -2.790257 7.976933 
1 1 1   22    8   13 o   18.502   6.1624   19.679   10.882   19.399   14.023   20.103   17.251   17.857   6.8581   17.845   7.3503 0.1178360E-01 10.05292 
1 1 1   22    8   14 o   25.342   5.6206   34.303   11.306   42.745   14.761   22.320   17.587   26.902   6.7446   18.400   7.4816 8.501692 10.07292 
1 1 1   22    8   15 o   11.498   5.2411  -0.6201   10.852   6.7961   14.258 -10.8357   16.733   14.242   6.2836   11.925   5.7518 2.317460 8.518591 
1 1 1   22    8   16 o   10.447   4.9144  -5.3560   10.740   6.5878   14.028 -22.2702   16.694   14.135   6.2346   10.650   5.2624 3.484668 8.158618 
1 1 1   22    8   17 o   11.978   5.3582   1.6136   10.734   25.086   14.070 -31.0653   16.602   19.844   6.9946   9.8448   4.9260 9.999643 8.555107 
1 1 1   22    8   18 o   15.154   6.2008   11.462   12.174   24.069   17.284  -0.9536   17.151   18.838   7.5008   13.402   6.2746 5.436514 9.779200 
1 1 1   22    8   19 o   14.907   6.1471   10.757   12.083   28.761   17.199  -6.7904   16.980   20.251   7.6381   12.492   5.9638 7.758580 9.690638 
1 1 1   22    8   20 o   16.606   6.3719   15.762   12.098   9.7563   16.891   22.088   17.336   15.260   6.7805   18.231   7.4223 -2.970798 10.05314 
1 1 1   22    8   21 o   21.697   6.5350   28.261   12.506   19.892   17.687   36.627   17.684   17.619   7.3654   22.661   7.8517 -5.042377 10.76556 
1 1 1   22    8   22 o   20.361   6.5687   25.192   12.406   9.4389   17.403   41.468   17.689   15.245   6.8207   24.383   7.8417 -9.137872 10.39301 
1 1 1   22    8   23 o   18.822   6.5572   21.567   12.342   13.680   17.314   29.716   17.599   16.121   7.0232   20.379   7.7174 -4.257505 10.43468 
1 1 1   22    8   24 o   12.496   5.8544  -2.5610   14.971 -31.2982   27.952   8.9991   17.729   12.902   6.4459   15.183   6.8314 -2.281442 9.392406 
1 1 1   22    8   25 o   22.395   7.2610   33.023   15.147   11.874   27.575   42.163   18.127   16.520   7.8030   24.323   7.9472 -7.803125 11.13754 
1 1 1   22    8   26 o   16.268   6.7639   14.982   14.798 -31.9999   26.760   35.679   17.761   12.582   6.2892   22.186   7.8552 -9.604163 10.06273 
1 1 1   22    8   27 o   21.388   7.3139   30.783   15.328   13.349   28.314   38.010   18.231   16.674   7.8850   22.740   7.9662 -6.066904 11.20862 
1 1 1   22    8   28 o   9.9991   4.9173 -17.9400   14.001 -27.5668   26.886 -14.3578   16.401   12.867   6.4119   11.291   5.5036 1.575930 8.449985 
1 1 1   22    8   29 o   18.339   7.1286   22.196   15.285   18.971   27.905   23.578   18.270   17.273   8.0596   18.349   7.5616 -1.075876 11.05149 
1 1 1   22    8   30 o   17.188   6.9257   18.439   14.917  -0.4813   26.903   26.839   17.925   15.015   7.2549   19.251   7.6475 -4.236139 10.54123 
1 1 1   22    8   31 o   16.698   7.0864   16.963   16.770   0.0000   0.0000   16.963   16.770  ?   ?    16.698   7.0864 0.000000 7.086405 
1 1 1   22    8   32 o   13.357   6.3002  -1.1345   17.859   19.243   27.396 -16.1941   23.551   17.179   8.0058   12.957   6.3730 4.222034 10.23267 
1 1 1   22    8   33 f   15.412   6.9214   10.987   18.106  -9.2490   27.041   27.433   24.377   14.159   6.9366   18.452   8.1749 -4.292835 10.72124 
1 1 1   22    8   34 o   12.101   5.8469  -9.6509   17.479 -22.3939   25.795   1.1666   23.766   12.898   6.4027   14.667   7.0168 -1.768971 9.498986 
1 1 1   22    8   35 o   10.951   5.4151 -21.3844   17.793 -39.2316   26.644  -7.0196   23.904   11.989   6.0320   13.812   6.7122 -1.822926 9.024392 
1 1 1   22    8   36 o   14.747   6.7153   7.9424   17.757   16.806   26.755   0.9641   23.740   16.737   7.8363   14.602   6.9928 2.135155 10.50268 
1 1 1   22    8   37 o   11.425   5.5899 -15.1305   17.393 -31.2275   25.820  -1.7576   23.534   12.265   6.1380   14.254   6.8617 -1.989120 9.206434 
1 1 1   22    8   38 o   9.5621   4.8160 -36.1097   17.226 -21.5253   26.368 -46.9694   22.753   12.999   6.4564   10.583   5.3548 2.416126 8.388039 
1 1 1   22    8   39 o   16.791   7.2084   18.350   17.714   12.343   26.908   22.945   23.533   16.087   7.6308   17.500   7.8725 -1.413265 10.96387 
1 1 1   22    8   40 o   13.176   6.2332  -1.1688   17.722   20.019   27.040 -17.1215   23.463   16.976   7.9251   12.713   6.2738 4.262095 10.10782 
1 1 1   22    8   41 o   16.722   7.2781   18.419   18.556   5.0798   27.283   29.900   25.311   15.275   7.3620   18.447   8.2415 -3.171221 11.05085 
1 1 1   22    8   42 o   11.977   6.0195 -35.4222   26.164 -35.4222   26.164   0.0000   0.0000   11.977   6.0195  ?   ?  0.000000 6.019479 
1 1 1   22    8   43 o   10.960   5.5622 -52.8186   25.776 -52.8186   25.776   0.0000   0.0000   10.960   5.5622  ?   ?  0.000000 5.562222 
1 1 1   22    8   44 o   14.052   6.8979  -7.5866   27.153  -7.5866   27.153   0.0000   0.0000   14.052   6.8979  ?   ?  0.000000 6.897897 
1 1 1   22    8   45 o   14.098   6.5356   5.0906   17.891 -18.7182   26.971   23.802   23.910   13.184   6.5449   17.454   7.8859 -4.270271 10.24811 
1 1 1   22    8   46 o   19.934   7.7965   31.421   18.375   29.526   28.000   32.854   24.352   18.055   8.3004   18.980   8.2977 -0.9250278 11.73664 
1 1 1   22    8   47 o   17.612   7.3980   22.374   17.975   17.556   28.247   25.652   23.301   16.584   7.8525   17.825   7.9392 -1.240227 11.16658 
1 1 1   22    8   48 o   12.327   6.1385 -24.6012   24.472   0.0000   0.0000 -24.6012   24.472  ?   ?    12.327   6.1385 0.000000 6.138530 
1 1 1   22    9  -34 o   13.361   6.0964   4.5182   14.729 -18.2739   24.703   17.089   18.346   12.736   6.3124   16.264   7.1534 -3.527708 9.540298 
1 1 1   22    9  -33 o   10.230   4.9982 -13.6731   13.765  -0.6702   22.387 -21.5769   17.454   13.942   6.7064   10.684   5.2972 3.257677 8.546080 
1 1 1   22    9  -32 o   14.255   6.2557   9.2183   13.958   25.901   22.681  -0.9519   17.708   17.754   7.8745   13.073   6.1979 4.681191 10.02110 
1 1 1   22    9  -31 o   27.088   6.7873   45.992   14.955   26.030   24.101   58.489   19.070   17.654   7.9521   28.569   7.9158 -10.91531 11.22036 
1 1 1   22    9  -30 o   12.900   5.9014   3.1027   13.919   18.464   22.977  -5.8023   17.494   16.491   7.5585   12.372   5.9453 4.119686 9.616536 
1 1 1   22    9  -29 o   13.346   6.0617   4.7596   14.353   21.793   24.177  -4.5100   17.836   17.018   7.7825   12.636   6.0541 4.382371 9.859972 
1 1 1   22    9  -28 o   17.469   6.8596   20.452   14.271   46.535   24.214   6.5688   17.666   21.782   8.8071   14.268   6.5718 7.514206 10.98877 
1 1 1   22    9  -27 o   9.9390   4.8861 -16.4395   13.787 -21.2127   22.131 -13.4123   17.625   12.013   5.9578   11.565   5.6517 0.4486523 8.211966 
1 1 1   22    9  -26 o   16.420   6.7303   16.962   14.373  -1.2119   23.339   28.066   18.242   14.101   6.7991   19.015   7.6600 -4.914982 10.24222 
1 1 1   22    9  -25 o   13.905   6.1985   7.2009   14.234  -4.1049   23.723   13.560   17.792   13.877   6.7304   15.637   6.9527 -1.760327 9.676702 
1 1 1   22    9  -24 o   16.046   6.6931   15.558   14.557   12.789   23.897   17.193   18.356   15.868   7.4219   16.424   7.1917 -0.5559149 10.33463 
1 1 1   22    9  -23 o   14.773   6.4176   10.675   14.372   30.488   23.899  -0.5494   17.988   18.694   8.1952   13.294   6.2863 5.399489 10.32852 
1 1 1   22    9  -22 o   16.664   6.8041   17.568   14.620   52.297   24.555  -1.5035   18.196   23.329   9.0444   13.220   6.2723 10.10867 11.00646 
1 1 1   22    9  -21 o   16.186   6.4424   15.665   12.745   24.973   23.988   12.003   15.045   17.782   7.9779   15.195   6.5837 2.587263 10.34367 
1 1 1   22    9  -20 o   14.448   6.4436   8.5156   15.401   0.0000   0.0000   8.5156   15.401  ?   ?    14.448   6.4436 0.000000 6.443605 
1 1 1   22    9  -19 o   19.981   7.2861   28.106   15.409   0.0000   0.0000   28.106   15.409  ?   ?    19.981   7.2861 0.000000 7.286099 
1 1 1   22    9  -18 o   16.258   6.7909   15.995   15.016   0.0000   0.0000   15.995   15.016  ?   ?    16.258   6.7909 0.000000 6.790883 
1 1 1   22    9  -17 o   10.316   4.9710  -9.6562   12.427  -4.5255   23.424 -11.6659   14.660   13.899   6.7287   10.900   5.2875 2.999853 8.557697 
1 1 1   22    9  -16 o   22.678   6.6485   32.040   13.083   5.4822   24.292   42.892   15.528   15.123   7.1955   25.730   7.1482 -10.60683 10.14260 
1 1 1   22    9  -15 o   14.976   6.2636   11.661   12.800   2.7594   24.339   15.064   15.050   14.827   7.0952   16.032   6.7539 -1.205512 9.795802 
1 1 1   22    9  -14 o   11.988   5.5298  -0.3277   12.575   6.4508   23.854  -2.9366   14.799   15.213   7.2070   12.209   5.7512 3.004287 9.220451 
1 1 1   22    9  -13 o   15.371   6.3553   12.900   12.963 -13.6605   23.774   24.136   15.463   13.131   6.4476   18.695   7.1960 -5.563324 9.661968 
1 1 1   22    9  -12 o   10.372   4.9845  -9.0383   12.302   22.555   23.740 -20.6370   14.384   17.521   7.8924   9.7970   4.8488 7.724258 9.262833 
1 1 1   22    9  -11 o   15.151   6.3255   12.110   13.020 -13.2857   25.140   21.419   15.220   13.434   6.6029   17.893   7.0662 -4.459152 9.671034 
1 1 1   22    9  -10 o   14.867   6.4207   10.648   14.216 -13.6162   24.324   23.236   17.520   13.260   6.5131   18.117   7.4288 -4.856916 9.879680 
1 1 1   22    9   -9 o   17.872   6.6623   20.228   13.005   36.053   26.103   15.004   14.999   19.663   8.5938   16.063   6.7531 3.600845 10.92968 
1 1 1   22    9   -8 o   14.476   6.1906   9.6922   12.972   8.7115   25.645   10.029   15.037   15.703   7.4490   14.824   6.4996 0.8785391 9.885961 
1 1 1   22    9   -7 o   11.851   5.5168  -1.8128   12.951   22.249   25.159 -10.4878   15.107   17.494   7.9767   11.243   5.4331 6.251398 9.651247 
1 1 1   22    9   -6 o   23.143   6.2011   31.336   11.934   31.264   18.958   31.383   15.359   20.080   7.8997   21.345   7.3205 -1.264305 10.77013 
1 1 1   22    9   -5 o   15.195   6.5963   11.470   15.161   5.3737   18.787   22.853   25.672   14.480   6.7075   17.590   8.0346 -3.109504 10.46641 
1 1 1   22    9   -4 o   15.986   6.7344   14.614   14.963   10.835   18.487   21.792   25.477   15.388   6.9450   17.444   7.9816 -2.055871 10.58010 
1 1 1   22    9   -3 o   28.998   7.9434   58.238   19.327   71.983   27.575   44.968   27.095   27.246   9.7724   21.193   9.0013 6.052725 13.28623 
1 1 1   22    9   -2 o   16.416   6.8103   16.163   14.955   2.1896   27.275   22.169   17.883   15.198   7.3336   17.858   7.4311 -2.660180 10.44050 
1 1 1   22    9   -1 o   9.6822   4.7874 -20.0536   13.901 -26.6278   23.823 -16.6594   17.117   12.167   6.0586   11.204   5.4952 0.9631271 8.179479 
1 1 1   22    9    0 o   12.334   5.7803  -2.1081   14.613 -22.1557   25.350   7.8702   17.884   12.823   6.3624   14.783   6.7347 -1.959993 9.264805 
1 1 1   22    9    1 o   12.420   5.7857  -1.0475   14.284 -26.4219   24.530   11.972   17.571   12.342   6.1460   15.533   6.9079 -3.191232 9.246163 
1 1 1   22    9    2 o   16.571   6.9016   16.748   15.445  -2.5373   19.131   52.845   26.174   13.406   6.3805   23.178   9.2300 -9.772364 11.22068 
1 1 1   22    9    3 o   24.287   6.5738   35.726   13.330   45.876   19.177   26.238   18.541   24.626   8.1803   18.821   7.6710 5.804596 11.21435 
1 1 1   22    9    4 o   15.393   6.2743   12.892   12.405   2.5248   14.313   44.189   24.870   13.091   5.9872   21.643   8.8602 -8.551774 10.69342 
1 1 1   22    9    5 o   13.509   5.7631   7.3092   11.193 -13.6295   14.491   38.275   17.623   10.633   5.1806   22.807   7.8408 -12.17380 9.397677 
1 1 1   22    9    6 o   8.5178   4.2212 -18.7719   11.035 -18.1462   14.517 -19.6284   16.985   10.124   4.9841   10.855   5.3530 -0.7309465 7.314051 
1 1 1   22    9    7 o   10.200   4.8572  -7.0003   11.117 -30.7481   14.226   30.243   17.815   8.8406   4.4426   20.084   7.7257 -11.24292 8.911935 
1 1 1   22    9    8 o   12.194   5.5904   0.5618   12.579   11.635   17.935 -10.1612   17.649   15.467   6.9218   12.068   5.8417 3.399115 9.057435 
1 1 1   22    9    9 o   16.341   6.2160   15.609   11.448   17.647   14.873   12.647   17.934   16.806   6.8626   15.660   6.9706 1.146086 9.781830 
1 1 1   22    9   10 o   13.937   6.0463   7.8725   12.722   4.5269   14.724   17.726   25.269   13.561   6.1516   16.807   7.7831 -3.245754 9.920594 
1 1 1   22    9   11 o   13.440   5.9110   6.1180   12.525   2.6340   14.400   16.948   25.389   13.104   5.9977   16.692   7.7545 -3.587642 9.803285 
1 1 1   22    9   12 o   12.615   5.8372   0.4064   14.170   5.0947   17.352  -8.9788   24.550   14.158   6.5181   13.698   6.6893 0.4593592 9.339796 
1 1 1   22    9   13 o   17.095   6.4954   17.986   12.491   29.521   17.814   6.8264   17.521   19.798   7.6956   14.482   6.6236 5.315854 10.15357 
1 1 1   22    9   14 o   15.888   6.7464   14.467   15.214   16.977   28.354   13.452   18.030   16.737   7.9077   15.788   7.0106 0.9497366 10.56789 
1 1 1   22    9   15 o   9.7546   4.8287 -20.6016   14.289  -9.4522   27.774 -24.6150   16.664   14.142   6.9490   10.257   5.1007 3.885620 8.620084 
1 1 1   22    9   16 o   11.536   5.5041  -6.4427   14.418  -1.1757   26.995  -8.5448   17.054   14.741   7.1567   12.058   5.8137 2.683049 9.220470 
1 1 1   22    9   17 o   10.336   5.0644 -15.6254   14.426 -50.0186   26.822  -1.6281   17.111   11.409   5.7771   13.004   6.1437 -1.595575 8.433262 
1 1 1   22    9   18 o   15.666   6.6506   13.802   14.780  -1.4701   26.696   20.553   17.749   14.658   7.1166   17.326   7.3186 -2.667823 10.20821 
1 1 1   22    9   19 o   11.232   5.4045  -8.8179   14.563 -40.4731   26.192   5.3474   17.521   11.753   5.9221   14.177   6.5352 -2.423633 8.819322 
1 1 1   22    9   20 o   11.548   5.4990  -5.8541   14.245 -33.1845   25.915   5.9789   17.052   12.110   6.0733   14.203   6.5104 -2.092875 8.903383 
1 1 1   22    9   21 o   20.113   7.2659   28.433   15.276   8.9207   28.224   36.516   18.167   15.770   7.5715   21.726   7.9129 -5.955456 10.95180 
1 1 1   22    9   22 o   13.002   5.9776   2.3269   14.524 -27.0562   27.290   13.938   17.155   12.740   6.3658   15.749   6.9224 -3.008325 9.404410 
1 1 1   22    9   23 o   13.766   6.1922   6.1661   14.556   24.843   27.431  -1.1542   17.173   17.538   8.1171   13.029   6.1553 4.508554 10.18703 
1 1 1   22    9   24 o   14.214   6.3086   8.2675   14.582 -19.3400   26.016   20.915   17.608   12.994   6.4467   17.304   7.2985 -4.310459 9.737942 
1 1 1   22    9   25 o   14.772   6.4582   10.652   14.752   2.4798   26.552   14.301   17.742   14.891   7.1980   15.786   6.9850 -0.8947668 10.03002 
1 1 1   22    9   26 o   11.901   5.7631  -9.4870   17.215 -39.7295   25.012   17.738   23.731   11.460   5.7760   16.509   7.6086 -5.049012 9.552674 
1 1 1   22    9   27 o   14.161   6.5551   5.6089   17.898   3.8804   26.623   7.0341   24.176   14.996   7.2386   15.105   7.1845 -0.1087856 10.19876 
1 1 1   22    9   28 o   21.466   8.0283   37.487   18.915   60.914   28.549   19.157   25.253   23.205   9.4954   16.662   7.7383 6.542202 12.24927 
1 1 1   22    9   29 o   14.124   6.5598   5.4079   18.148 -21.2864   26.781   28.075   24.678   12.913   6.4290   17.981   8.0775 -5.067981 10.32366 
1 1 1   22    9   30 o   14.969   7.1374   6.5874   24.158   0.0000   0.0000   6.5874   24.158  ?   ?    14.969   7.1374 0.000000 7.137421 
1 1 1   22    9   31 o   13.875   6.4955   3.7214   18.369  -9.2638   27.238   14.555   24.879   13.839   6.8159   15.983   7.5067 -2.144007 10.13934 
1 1 1   22    9   32 o   11.648   5.6868 -12.5324   17.718   5.7897   27.303 -25.8614   23.288   15.163   7.3220   11.888   5.9310 3.274730 9.422762 
1 1 1   22    9   33 o   18.483   7.6666   27.035   18.948   23.761   28.772   29.541   25.179   17.136   8.0559   18.143   8.1540 -1.006990 11.46235 
1 1 1   22    9   34 o   20.458   7.9939   34.824   19.302   36.577   29.063   33.441   25.819   18.759   8.5610   18.705   8.3425 0.5423546E-01 11.95357 
1 1 1   22    9   35 o   12.393   5.9824  -7.0645   18.194   46.485   28.327 -44.6675   23.738   20.425   8.9389   10.844   5.4849 9.580469 10.48756 
1 1 1   22    9   36 o   13.456   6.3772   0.2292   18.714   5.3561   28.998  -3.4300   24.498   15.285   7.4201   13.986   6.7963 1.299634 10.06219 
1 1 1   22   10  -20 o   15.030   7.1671   7.2906   24.375   0.0000   0.0000   7.2906   24.375  ?   ?    15.030   7.1671 0.000000 7.167069 
1 1 1   22   10  -19 o   16.648   7.7006   20.054   24.633   0.0000   0.0000   20.054   24.633  ?   ?    16.648   7.7006 0.000000 7.700606 
1 1 1   22   10  -18 o   16.143   7.5041   16.594   23.830   0.0000   0.0000   16.594   23.830  ?   ?    16.143   7.5041 0.000000 7.504057 
1 1 1   22   10  -17 o   17.285   7.8552   24.472   24.144   0.0000   0.0000   24.472   24.144  ?   ?    17.285   7.8552 0.000000 7.855189 
1 1 1   22   10  -16 o   12.599   6.2299 -16.2983   23.553   0.0000   0.0000 -16.2983   23.553  ?   ?    12.599   6.2299 0.000000 6.229908 
1 1 1   22   10  -15 o   14.721   7.0550   5.1753   24.260   0.0000   0.0000   5.1753   24.260  ?   ?    14.721   7.0550 0.000000 7.055013 
1 1 1   22   10  -14 o   11.680   5.5564  -4.4638   14.472  -1.4329   25.781  -5.8583   17.487   14.223   6.9254   12.305   5.9213 1.917758 9.111680 
1 1 1   22   10  -13 o   12.709   5.8479   2.3944   13.940   21.767   24.726  -6.6318   16.878   16.831   7.7603   12.054   5.8047 4.776726 9.691074 
1 1 1   22   10  -12 o   18.579   7.0232   24.438   14.560   72.825   25.984   2.2921   17.579   27.260   9.5131   13.450   6.3147 13.80978 11.41818 
1 1 1   22   10  -11 o   16.806   7.2598   20.105   18.183  -1.6306   25.156   43.887   26.313   14.129   6.8708   20.256   8.7417 -6.126888 11.11870 
1 1 1   22   10  -10 o   13.141   6.2182   0.0855   17.660  -3.1013   24.201   3.7152   25.829   13.863   6.7409   14.722   7.1119 -0.8586359 9.798865 
1 1 1   22   10   -9 o   16.324   7.1246   17.858   17.888   6.9447   24.493   30.333   26.188   14.941   7.1412   18.000   8.1805 -3.059044 10.85900 
1 1 1   22   10   -8 o   11.348   5.4119  -5.4933   13.907 -46.6891   23.560   16.538   17.230   10.648   5.3944   16.043   6.9974 -5.395316 8.835357 
1 1 1   22   10   -7 o   12.711   5.8371   2.5860   13.794   10.920   23.539  -1.7730   17.024   15.341   7.2350   12.740   6.0508 2.601122 9.431702 
1 1 1   22   10   -6 o   13.943   6.2204   7.9553   14.365  -3.7382   24.678   13.948   17.666   13.866   6.7568   15.500   6.9077 -1.634052 9.662839 
1 1 1   22   10   -5 o   8.6181   4.3371 -30.1409   13.817 -28.1105   23.541 -31.2078   17.065   11.730   5.8688   9.7381   4.8898 1.992005 7.638906 
1 1 1   22   10   -4 o   14.644   6.3953   10.952   14.432   24.304   24.159   3.5444   17.995   17.228   7.8403   13.709   6.4212 3.519228 10.13423 
1 1 1   22   10   -3 o   11.372   5.4430  -6.2397   14.336 -39.8245   23.851   12.756   17.937   11.085   5.5934   15.277   6.8727 -4.192084 8.861154 
1 1 1   22   10   -2 o   15.969   7.0273   16.228   17.725   4.6749   24.644   28.610   25.514   14.700   7.0621   17.792   8.0815 -3.092563 10.73234 
1 1 1   22   10   -1 o   15.109   6.5260   12.780   14.689   21.461   24.904   8.1487   18.189   16.776   7.7540   14.472   6.6666 2.304228 10.22584 
1 1 1   22   10    0 o   13.318   5.8941   6.5128   12.638   8.8895   17.832   4.1138   17.915   14.559   6.6676   13.783   6.4398 0.7767229 9.269771 
1 1 1   22   10    1 o   15.208   6.2918   13.364   12.716   11.137   18.030   15.567   17.937   14.980   6.7999   15.833   7.0136 -0.8529530 9.768823 
1 1 1   22   10    2 o   10.944   5.2890  -9.2891   14.321 -16.4014   24.493  -5.5948   17.653   12.762   6.3181   12.376   5.9536 0.3860807 8.681220 
1 1 1   22   10    3 o   12.220   5.7247  -0.8095   14.312 -30.4495   23.553   16.542   18.021   11.579   5.8044   16.035   7.0699 -4.456194 9.147388 
1 1 1   22   10    4 o   16.086   6.7285   16.501   14.773   36.183   25.494   6.5504   18.127   19.035   8.4000   14.201   6.5818 4.833765 10.67146 
1 1 1   22   10    5 o   15.334   6.8803   13.070   17.848   0.0000   0.0000   13.070   17.848  ?   ?    15.334   6.8803 0.000000 6.880331 
1 1 1   22   10    6 o   16.739   7.2396   19.807   18.125   0.0000   0.0000   19.807   18.125  ?   ?    16.739   7.2396 0.000000 7.239615 
1 1 1   22   10    7 o   10.571   5.2537 -22.7909   17.574   0.0000   0.0000 -22.7909   17.574  ?   ?    10.571   5.2537 0.000000 5.253689 
1 1 1   22   10    8 o   15.968   7.5326   15.222   25.544   0.0000   0.0000   15.222   25.544  ?   ?    15.968   7.5326 0.000000 7.532562 
1 1 1   22   10    9 o   11.870   5.7505  -8.8226   17.192   0.0000   0.0000  -8.8226   17.192  ?   ?    11.870   5.7505 0.000000 5.750480 
1 1 1   22   10   10 o   25.003   7.9809   47.822   18.349   0.0000   0.0000   47.822   18.349  ?   ?    25.003   7.9809 0.000000 7.980932 
1 1 1   22   10   11 o   13.271   6.2578   1.0739   17.596   0.0000   0.0000   1.0739   17.596  ?   ?    13.271   6.2578 0.000000 6.257797 
1 1 1   22   10   12 o   11.498   5.6137 -12.2787   17.270   0.0000   0.0000 -12.2787   17.270  ?   ?    11.498   5.6137 0.000000 5.613720 
1 1 1   22   10   13 o   12.953   6.1552  -1.2388   17.659   0.0000   0.0000  -1.2388   17.659  ?   ?    12.953   6.1552 0.000000 6.155217 
1 1 1   22   10   14 o   10.485   5.2031 -21.6291   16.976   0.0000   0.0000 -21.6291   16.976  ?   ?    10.485   5.2031 0.000000 5.203087 
1 1 1   22   10   15 o   14.136   6.5277   6.5712   17.593   0.0000   0.0000   6.5712   17.593  ?   ?    14.136   6.5277 0.000000 6.527658 
1 1 1   22   10   16 o   13.886   6.7545  -3.1342   24.363   0.0000   0.0000  -3.1342   24.363  ?   ?    13.886   6.7545 0.000000 6.754513 
1 1 1   22   10   17 o   15.042   7.1656   7.8749   24.235   0.0000   0.0000   7.8749   24.235  ?   ?    15.042   7.1656 0.000000 7.165580 
1 1 1   22   10   18 o   14.696   7.0775   3.8685   25.107   0.0000   0.0000   3.8685   25.107  ?   ?    14.696   7.0775 0.000000 7.077479 
1 1 1   23    0  -67 o   8.4630   6.1136 -30.3497   21.779 -30.3497   21.779 -30.3497   21.779   8.4630   6.1136   8.4630   6.1136 0.000000 0.000000 
1 1 1   23    0  -66 o   12.794   8.4250   7.0327   22.408   7.0327   22.408   7.0327   22.408   12.794   8.4250   12.794   8.4250 0.000000 0.000000 
1 1 1   23    0  -65 f   11.589   7.8893  -1.4875   22.816  -1.4875   22.816  -1.4875   22.816   11.589   7.8893   11.589   7.8893 0.000000 0.000000 
1 1 1   23    0  -64 o   8.4475   5.9811 -15.4734   17.013 -15.4734   17.013 -15.4734   17.013   8.4475   5.9811   8.4475   5.9811 0.000000 0.000000 
1 1 1   23    0  -63 o   12.274   7.8783   7.3769   17.915   7.3769   17.915   7.3769   17.915   12.274   7.8783   12.274   7.8783 0.000000 0.000000 
1 1 1   23    0  -62 o   16.926   10.466   25.308   28.518   25.308   28.518   25.308   28.518   16.926   10.466   16.926   10.466 0.000000 0.000000 
1 1 1   23    0  -61 o   18.847   9.5126   27.872   18.092   27.872   18.092   27.872   18.092   18.847   9.5126   18.847   9.5126 0.000000 0.000000 
1 1 1   23    0  -60 o   18.427   9.5731   26.895   18.652   26.895   18.652   26.895   18.652   18.427   9.5731   18.427   9.5731 0.000000 0.000000 
1 1 1   23    0  -59 o   12.966   7.7604   10.983   14.608   10.983   14.608   10.983   14.608   12.966   7.7604   12.966   7.7604 0.000000 0.000000 
1 1 1   23    0  -58 o   14.213   7.9962   14.485   14.059   14.485   14.059   14.485   14.059   14.213   7.9962   14.213   7.9962 0.000000 0.000000 
1 1 1   23    0  -57 o   22.448   8.5189   31.549   14.641   31.549   14.641   31.549   14.641   22.448   8.5189   22.448   8.5189 0.000000 0.000000 
1 1 1   23    0  -56 o   7.2187   5.1730 -19.6661   14.248 -19.6661   14.248 -19.6661   14.248   7.2187   5.1730   7.2187   5.1730 0.000000 0.000000 
1 1 1   23    0  -55 o   27.834   7.6073   41.497   14.920   41.497   14.920   41.497   14.920   27.834   7.6073   27.834   7.6073 0.000000 0.000000 
1 1 1   23    0  -54 o   13.199   7.7552   11.254   14.106   11.254   14.106   11.254   14.106   13.199   7.7552   13.199   7.7552 0.000000 0.000000 
1 1 1   23    0  -53 o   32.077   6.6677   50.560   15.377   50.560   15.377   50.560   15.377   32.077   6.6677   32.077   6.6677 0.000000 0.000000 
1 1 1   23    0  -52 o   19.311   8.6847   25.109   14.625   25.109   14.625   25.109   14.625   19.311   8.6847   19.311   8.6847 0.000000 0.000000 
1 1 1   23    0  -51 o   31.973   6.4929   49.611   14.979   49.611   14.979   49.611   14.979   31.973   6.4929   31.973   6.4929 0.000000 0.000000 
1 1 1   23    0  -50 o   22.063   8.4760   29.821   14.415   29.821   14.415   29.821   14.415   22.063   8.4760   22.063   8.4760 0.000000 0.000000 
1 1 1   23    0  -49 o   8.1890   5.6932  -9.8589   13.447  -9.8589   13.447  -9.8589   13.447   8.1890   5.6932   8.1890   5.6932 0.000000 0.000000 
1 1 1   23    0  -48 o   7.3411   5.1353 -10.0382   11.414 -10.0382   11.414 -10.0382   11.414   7.3411   5.1353   7.3411   5.1353 0.000000 0.000000 
1 1 1   23    0  -47 o   8.5042   5.7246  -3.4272   11.361  -3.4272   11.361  -3.4272   11.361   8.5042   5.7246   8.5042   5.7246 0.000000 0.000000 
1 1 1   23    0  -46 o   10.976   6.9388   3.9159   13.279   3.9159   13.279   3.9159   13.279   10.976   6.9388   10.976   6.9388 0.000000 0.000000 
1 1 1   23    0  -45 o   6.9733   4.9960 -19.3806   13.258 -19.3806   13.258 -19.3806   13.258   6.9733   4.9960   6.9733   4.9960 0.000000 0.000000 
1 1 1   23    0  -44 o   13.358   7.7338   10.972   13.695   10.972   13.695   10.972   13.695   13.358   7.7338   13.358   7.7338 0.000000 0.000000 
1 1 1   23    0  -43 o   29.510   5.5221   40.550   11.922   40.550   11.922   40.550   11.922   29.510   5.5221   29.510   5.5221 0.000000 0.000000 
1 1 1   23    0  -42 o   19.406   8.2867   23.710   13.357   23.710   13.357   23.710   13.357   19.406   8.2867   19.406   8.2867 0.000000 0.000000 
1 1 1   23    0  -41 o   60.106   2.8814  150.306   14.043  150.306   14.043  150.306   14.043   60.106   2.8814   60.106   2.8814 0.000000 0.000000 
1 1 1   23    0  -40 o   14.398   7.4705   13.606   11.348   13.606   11.348   13.606   11.348   14.398   7.4705   14.398   7.4705 0.000000 0.000000 
1 1 1   23    0  -39 o   29.448   5.5001   40.223   11.853   40.223   11.853   40.223   11.853   29.448   5.5001   29.448   5.5001 0.000000 0.000000 
1 1 1   23    0  -38 o   34.121   4.5747   51.377   12.083   51.377   12.083   51.377   12.083   34.121   4.5747   34.121   4.5747 0.000000 0.000000 
1 1 1   23    0  -37 o   92.600   2.7335  354.484   20.593  354.484   20.593  354.484   20.593   92.600   2.7335   92.600   2.7335 0.000000 0.000000 
1 1 1   23    0  -36 o   85.021   2.7649  299.023   19.116  299.023   19.116  299.023   19.116   85.021   2.7649   85.021   2.7649 0.000000 0.000000 
1 1 1   23    0  -35 o   13.452   7.3333   11.543   11.405   11.543   11.405   11.543   11.405   13.452   7.3333   13.452   7.3333 0.000000 0.000000 
1 1 1   23    0  -34 f   26.058   6.3897   33.461   11.754   33.461   11.754   33.461   11.754   26.058   6.3897   26.058   6.3897 0.000000 0.000000 
1 1 1   23    0  -33 o   21.059   7.2627   24.671   11.226   24.671   11.226   24.671   11.226   21.059   7.2627   21.059   7.2627 0.000000 0.000000 
1 1 1   23    0  -32 o   14.469   7.7964   13.546   12.745   13.546   12.745   13.546   12.745   14.469   7.7964   14.469   7.7964 0.000000 0.000000 
1 1 1   23    0  -31 o   48.643   4.4429  101.427   17.261  101.427   17.261  101.427   17.261   48.643   4.4429   48.643   4.4429 0.000000 0.000000 
1 1 1   23    0  -30 o   90.714   3.1853  341.364   23.488  341.364   23.488  341.364   23.488   90.714   3.1853   90.714   3.1853 0.000000 0.000000 
1 1 1   23    0  -29 o   8.8317   5.9682  -4.8087   12.580  -4.8087   12.580  -4.8087   12.580   8.8317   5.9682   8.8317   5.9682 0.000000 0.000000 
1 1 1   23    0  -28 o   14.714   7.3899   13.947   10.891   13.947   10.891   13.947   10.891   14.714   7.3899   14.714   7.3899 0.000000 0.000000 
1 1 1   23    0  -27 o   39.698   3.7837   67.133   11.973   67.133   11.973   67.133   11.973   39.698   3.7837   39.698   3.7837 0.000000 0.000000 
1 1 1   23    0  -26 o   29.693   6.4366   42.094   13.659   42.094   13.659   42.094   13.659   29.693   6.4366   29.693   6.4366 0.000000 0.000000 
1 1 1   23    0  -25 o   35.216   4.9959   54.948   13.509   54.948   13.509   54.948   13.509   35.216   4.9959   35.216   4.9959 0.000000 0.000000 
1 1 1   23    0  -24 o   7.4526   5.2498 -13.4775   12.572 -13.4775   12.572 -13.4775   12.572   7.4526   5.2498   7.4526   5.2498 0.000000 0.000000 
1 1 1   23    0  -23 o   21.344   9.2813   28.694   16.720   28.694   16.720   28.694   16.720   21.344   9.2813   21.344   9.2813 0.000000 0.000000 
1 1 1   23    0  -22 o   43.822   4.1827   81.986   14.609   81.986   14.609   81.986   14.609   43.822   4.1827   43.822   4.1827 0.000000 0.000000 
1 1 1   23    0  -21 o   11.009   6.6792   5.3985   11.125   5.3985   11.125   5.3985   11.125   11.009   6.6792   11.009   6.6792 0.000000 0.000000 
1 1 1   23    0  -20 o   10.034   6.3738   2.1030   11.359   2.1030   11.359   2.1030   11.359   10.034   6.3738   10.034   6.3738 0.000000 0.000000 
1 1 1   23    0  -19 o   27.548   6.0730   36.094   11.930   36.094   11.930   36.094   11.930   27.548   6.0730   27.548   6.0730 0.000000 0.000000 
1 1 1   23    0  -18 o   40.487   4.5708   70.831   14.591   70.831   14.591   70.831   14.591   40.487   4.5708   40.487   4.5708 0.000000 0.000000 
1 1 1   23    0  -17 o  117.932   2.5632  571.887   24.614  571.887   24.614  571.887   24.614  117.932   2.5632  117.932   2.5632 0.000000 0.000000 
1 1 1   23    0  -16 o   41.545   3.8016   73.196   12.613   73.196   12.613   73.196   12.613   41.545   3.8016   41.545   3.8016 0.000000 0.000000 
1 1 1   23    0  -15 o   69.494   2.9935  199.880   16.886  199.880   16.886  199.880   16.886   69.494   2.9935   69.494   2.9935 0.000000 0.000000 
1 1 1   23    0  -14 o   10.532   6.5388   3.8009   11.242   3.8009   11.242   3.8009   11.242   10.532   6.5388   10.532   6.5388 0.000000 0.000000 
1 1 1   23    0  -13 o   18.950   7.6634   21.253   11.564   21.253   11.564   21.253   11.564   18.950   7.6634   18.950   7.6634 0.000000 0.000000 
1 1 1   23    0  -12 o   40.299   3.9163   69.102   12.567   69.102   12.567   69.102   12.567   40.299   3.9163   40.299   3.9163 0.000000 0.000000 
1 1 1   23    0  -11 o   15.375   7.5789   15.030   11.356   15.030   11.356   15.030   11.356   15.375   7.5789   15.375   7.5789 0.000000 0.000000 
1 1 1   23    0  -10 f   58.862   3.2906  144.149   15.675  144.149   15.675  144.149   15.675   58.862   3.2906   58.862   3.2906 0.000000 0.000000 
1 1 1   23    0   -9 o  118.827   2.5551  580.276   24.723  580.276   24.723  580.276   24.723  118.827   2.5551  118.827   2.5551 0.000000 0.000000 
1 1 1   23    0   -8 o   10.897   6.8432   3.3864   12.682   3.3864   12.682   3.3864   12.682   10.897   6.8432   10.897   6.8432 0.000000 0.000000 
1 1 1   23    0   -7 o   14.194   7.8128   12.443   13.078   12.443   13.078   12.443   13.078   14.194   7.8128   14.194   7.8128 0.000000 0.000000 
1 1 1   23    0   -6 f   19.974   8.1632   23.809   13.082   23.809   13.082   23.809   13.082   19.974   8.1632   19.974   8.1632 0.000000 0.000000 
1 1 1   23    0   -5 o   15.247   8.5356   14.322   15.921   14.322   15.921   14.322   15.921   15.247   8.5356   15.247   8.5356 0.000000 0.000000 
1 1 1   23    0   -4 o   37.951   6.1280   65.050   17.476   65.050   17.476   65.050   17.476   37.951   6.1280   37.951   6.1280 0.000000 0.000000 
1 1 1   23    0   -3 o   50.605   4.6354  109.205   18.733  109.205   18.733  109.205   18.733   50.605   4.6354   50.605   4.6354 0.000000 0.000000 
1 1 1   23    0   -2 o   25.983   7.2112   34.250   13.210   34.250   13.210   34.250   13.210   25.983   7.2112   25.983   7.2112 0.000000 0.000000 
1 1 1   23    0   -1 o   47.180   3.8003   93.787   14.390   93.787   14.390   93.787   14.390   47.180   3.8003   47.180   3.8003 0.000000 0.000000 
1 1 1   23    0    0 o   28.751   6.6587   39.802   13.577   39.802   13.577   39.802   13.577   28.751   6.6587   28.751   6.6587 0.000000 0.000000 
1 1 1   23    0    1 o   11.659   7.0519   6.1495   12.321   6.1495   12.321   6.1495   12.321   11.659   7.0519   11.659   7.0519 0.000000 0.000000 
1 1 1   23    0    2 o   41.468   4.3631   73.688   14.339   73.688   14.339   73.688   14.339   41.468   4.3631   41.468   4.3631 0.000000 0.000000 
1 1 1   23    0    3 o   76.803   3.4852  244.895   21.717  244.895   21.717  244.895   21.717   76.803   3.4852   76.803   3.4852 0.000000 0.000000 
1 1 1   23    0    4 o   58.000   3.4264  140.184   16.069  140.184   16.069  140.184   16.069   58.000   3.4264   58.000   3.4264 0.000000 0.000000 
1 1 1   23    0    5 o   59.509   3.3643  147.388   16.199  147.388   16.199  147.388   16.199   59.509   3.3643   59.509   3.3643 0.000000 0.000000 
1 1 1   23    0    6 f   65.862   3.1579  179.835   16.864  179.835   16.864  179.835   16.864   65.862   3.1579   65.862   3.1579 0.000000 0.000000 
1 1 1   23    0    7 o   20.296   8.2401   24.534   13.354   24.534   13.354   24.534   13.354   20.296   8.2401   20.296   8.2401 0.000000 0.000000 
1 1 1   23    0    8 o   43.481   4.2227   80.596   14.621   80.596   14.621   80.596   14.621   43.481   4.2227   43.481   4.2227 0.000000 0.000000 
1 1 1   23    0    9 o   42.795   4.2499   78.194   14.465   78.194   14.465   78.194   14.465   42.795   4.2499   42.795   4.2499 0.000000 0.000000 
1 1 1   23    0   10 f   10.182   6.5610   0.9135   12.583   0.9135   12.583   0.9135   12.583   10.182   6.5610   10.182   6.5610 0.000000 0.000000 
1 1 1   23    0   11 o   16.168   8.1106   16.794   13.110   16.794   13.110   16.794   13.110   16.168   8.1106   16.168   8.1106 0.000000 0.000000 
1 1 1   23    0   12 o   28.358   6.7406   39.044   13.524   39.044   13.524   39.044   13.524   28.358   6.7406   28.358   6.7406 0.000000 0.000000 
1 1 1   23    0   13 o   13.458   8.2108   8.2543   17.017   8.2543   17.017   8.2543   17.017   13.458   8.2108   13.458   8.2108 0.000000 0.000000 
1 1 1   23    0   14 o   6.1311   4.4524 -25.2617   12.362 -25.2617   12.362 -25.2617   12.362   6.1311   4.4524   6.1311   4.4524 0.000000 0.000000 
1 1 1   23    0   15 o   10.909   7.1290  -0.3895   15.589  -0.3895   15.589  -0.3895   15.589   10.909   7.1290   10.909   7.1290 0.000000 0.000000 
1 1 1   23    0   16 o   18.329   9.9401   22.286   20.846   22.286   20.846   22.286   20.846   18.329   9.9401   18.329   9.9401 0.000000 0.000000 
1 1 1   23    0   17 o   12.196   7.9545   0.3887   19.275   0.3887   19.275   0.3887   19.275   12.196   7.9545   12.196   7.9545 0.000000 0.000000 
1 1 1   23    0   18 o   17.813   9.6455   20.958   19.600   20.958   19.600   20.958   19.600   17.813   9.6455   17.813   9.6455 0.000000 0.000000 
1 1 1   23    0   19 o   12.121   7.9208   0.1255   19.241   0.1255   19.241   0.1255   19.241   12.121   7.9208   12.121   7.9208 0.000000 0.000000 
1 1 1   23    0   20 o   14.669   7.9788   13.627   13.470   13.627   13.470   13.627   13.470   14.669   7.9788   14.669   7.9788 0.000000 0.000000 
1 1 1   23    0   21 o   13.603   7.7563   11.010   13.468   11.010   13.468   11.010   13.468   13.603   7.7563   13.603   7.7563 0.000000 0.000000 
1 1 1   23    0   22 o   99.223   2.7008  405.716   21.808  405.716   21.808  405.716   21.808   99.223   2.7008   99.223   2.7008 0.000000 0.000000 
1 1 1   23    0   23 o   70.449   3.0997  205.840   17.722  205.840   17.722  205.840   17.722   70.449   3.0997   70.449   3.0997 0.000000 0.000000 
1 1 1   23    0   24 o   30.781   6.3057   44.647   13.985   44.647   13.985   44.647   13.985   30.781   6.3057   30.781   6.3057 0.000000 0.000000 
1 1 1   23    0   25 o   9.3791   6.2633  -3.2254   13.117  -3.2254   13.117  -3.2254   13.117   9.3791   6.2633   9.3791   6.2633 0.000000 0.000000 
1 1 1   23    0   26 o   17.471   8.2411   19.630   13.244   19.630   13.244   19.630   13.244   17.471   8.2411   17.471   8.2411 0.000000 0.000000 
1 1 1   23    0   27 o   50.062   3.7962  105.801   15.282  105.801   15.282  105.801   15.282   50.062   3.7962   50.062   3.7962 0.000000 0.000000 
1 1 1   23    0   28 o   9.4817   6.3053  -2.5526   13.056  -2.5526   13.056  -2.5526   13.056   9.4817   6.3053   9.4817   6.3053 0.000000 0.000000 
1 1 1   23    0   29 o   47.911   3.8929   97.285   14.965   97.285   14.965   97.285   14.965   47.911   3.8929   47.911   3.8929 0.000000 0.000000 
1 1 1   23    0   30 o   9.0307   6.0695  -3.9767   12.678  -3.9767   12.678  -3.9767   12.678   9.0307   6.0695   9.0307   6.0695 0.000000 0.000000 
1 1 1   23    0   31 o   29.427   6.6503   41.933   13.914   41.933   13.914   41.933   13.914   29.427   6.6503   29.427   6.6503 0.000000 0.000000 
1 1 1   23    0   32 o   61.362   4.1171  159.221   20.377  159.221   20.377  159.221   20.377   61.362   4.1171   61.362   4.1171 0.000000 0.000000 
1 1 1   23    0   33 o   60.847   3.3082  154.642   16.297  154.642   16.297  154.642   16.297   60.847   3.3082   60.847   3.3082 0.000000 0.000000 
1 1 1   23    0   34 f   47.483   5.1089   98.440   19.196   98.440   19.196   98.440   19.196   47.483   5.1089   47.483   5.1089 0.000000 0.000000 
1 1 1   23    0   35 o   47.202   5.1830   97.550   19.331   97.550   19.331   97.550   19.331   47.202   5.1830   47.202   5.1830 0.000000 0.000000 
1 1 1   23    0   36 o   30.002   8.6271   47.872   18.293   47.872   18.293   47.872   18.293   30.002   8.6271   30.002   8.6271 0.000000 0.000000 
1 1 1   23    0   37 o   18.632   8.2884   22.117   13.319   22.117   13.319   22.117   13.319   18.632   8.2884   18.632   8.2884 0.000000 0.000000 
1 1 1   23    0   38 o   7.3486   5.1952 -14.2927   12.676 -14.2927   12.676 -14.2927   12.676   7.3486   5.1952   7.3486   5.1952 0.000000 0.000000 
1 1 1   23    0   39 o   13.806   7.7691   12.056   13.276   12.056   13.276   12.056   13.276   13.806   7.7691   13.806   7.7691 0.000000 0.000000 
1 1 1   23    0   40 o   23.635   8.1311   31.618   14.093   31.618   14.093   31.618   14.093   23.635   8.1311   23.635   8.1311 0.000000 0.000000 
1 1 1   23    0   41 o   36.127   5.3087   58.757   14.646   58.757   14.646   58.757   14.646   36.127   5.3087   36.127   5.3087 0.000000 0.000000 
1 1 1   23    0   42 o   43.367   5.3415   83.557   18.115   83.557   18.115   83.557   18.115   43.367   5.3415   43.367   5.3415 0.000000 0.000000 
1 1 1   23    0   43 o   31.156   6.3457   46.356   14.259   46.356   14.259   46.356   14.259   31.156   6.3457   31.156   6.3457 0.000000 0.000000 
1 1 1   23    0   44 o   58.605   3.5099  144.577   16.628  144.577   16.628  144.577   16.628   58.605   3.5099   58.605   3.5099 0.000000 0.000000 
1 1 1   23    0   45 o   30.602   6.5244   45.318   14.302   45.318   14.302   45.318   14.302   30.602   6.5244   30.602   6.5244 0.000000 0.000000 
1 1 1   23    0   46 o   35.804   5.3140   58.078   14.506   58.078   14.506   58.078   14.506   35.804   5.3140   35.804   5.3140 0.000000 0.000000 
1 1 1   23    0   47 o   18.777   8.4350   23.123   13.796   23.123   13.796   23.123   13.796   18.777   8.4350   18.777   8.4350 0.000000 0.000000 
1 1 1   23    0   48 o   11.836   7.2187   7.0872   13.141   7.0872   13.141   7.0872   13.141   11.836   7.2187   11.836   7.2187 0.000000 0.000000 
1 1 1   23    0   49 o   28.754   6.6534   41.044   13.569   41.044   13.569   41.044   13.569   28.754   6.6534   28.754   6.6534 0.000000 0.000000 
1 1 1   23    0   50 o   25.171   7.6618   34.622   13.723   34.622   13.723   34.622   13.723   25.171   7.6618   25.171   7.6618 0.000000 0.000000 
1 1 1   23    0   51 o   24.588   8.5249   35.474   15.413   35.474   15.413   35.474   15.413   24.588   8.5249   24.588   8.5249 0.000000 0.000000 
1 1 1   23    0   52 o   29.126   7.7179   44.721   15.831   44.721   15.831   44.721   15.831   29.126   7.7179   29.126   7.7179 0.000000 0.000000 
1 1 1   23    0   53 o   10.975   7.0991   2.7462   14.918   2.7462   14.918   2.7462   14.918   10.975   7.0991   10.975   7.0991 0.000000 0.000000 
1 1 1   23    0   54 o   17.779   8.8955   22.834   15.750   22.834   15.750   22.834   15.750   17.779   8.8955   17.779   8.8955 0.000000 0.000000 
1 1 1   23    0   55 o   25.973   8.5014   39.224   15.951   39.224   15.951   39.224   15.951   25.973   8.5014   25.973   8.5014 0.000000 0.000000 
1 1 1   23    0   56 o   7.3244   5.2576 -21.3099   14.982 -21.3099   14.982 -21.3099   14.982   7.3244   5.2576   7.3244   5.2576 0.000000 0.000000 
1 1 1   23    0   57 o   17.047   8.9053   21.771   16.204   21.771   16.204   21.771   16.204   17.047   8.9053   17.047   8.9053 0.000000 0.000000 
1 1 1   23    0   58 o   45.557   5.0851   93.727   18.282   93.727   18.282   93.727   18.282   45.557   5.0851   45.557   5.0851 0.000000 0.000000 
1 1 1   23    0   59 o   17.023   8.8843   21.983   16.117   21.983   16.117   21.983   16.117   17.023   8.8843   17.023   8.8843 0.000000 0.000000 
1 1 1   23    0   60 o   12.446   7.8167   8.3679   16.551   8.3679   16.551   8.3679   16.551   12.446   7.8167   12.446   7.8167 0.000000 0.000000 
1 1 1   23    0   61 o   13.321   8.0928   11.905   16.378   11.905   16.378   11.905   16.378   13.321   8.0928   13.321   8.0928 0.000000 0.000000 
1 1 1   23    0   62 o   11.598   7.4910   5.2599   16.526   5.2599   16.526   5.2599   16.526   11.598   7.4910   11.598   7.4910 0.000000 0.000000 
1 1 1   23    0   63 o   11.433   7.3766   5.2227   15.972   5.2227   15.972   5.2227   15.972   11.433   7.3766   11.433   7.3766 0.000000 0.000000 
1 1 1   23    0   64 o   39.347   5.8840   74.094   17.629   74.094   17.629   74.094   17.629   39.347   5.8840   39.347   5.8840 0.000000 0.000000 
1 1 1   23    0   65 f   35.850   9.5614   75.591   24.141   75.591   24.141   75.591   24.141   35.850   9.5614   35.850   9.5614 0.000000 0.000000 
1 1 1   23    0   66 o   17.079   9.7699   25.763   21.466   25.763   21.466   25.763   21.466   17.079   9.7699   17.079   9.7699 0.000000 0.000000 
1 1 1   23    0   67 o   14.111   8.8352   14.611   20.972   14.611   20.972   14.611   20.972   14.111   8.8352   14.111   8.8352 0.000000 0.000000 
1 1 1   23    0   68 o   10.776   7.3819  -3.7118   20.660  -3.7118   20.660  -3.7118   20.660   10.776   7.3819   10.776   7.3819 0.000000 0.000000 
1 1 1   23    0   69 o   10.791   7.3420  -1.9217   19.702  -1.9217   19.702  -1.9217   19.702   10.791   7.3420   10.791   7.3420 0.000000 0.000000 
1 1 1   23    0   70 f   21.275   10.435   38.593   21.486   38.593   21.486   38.593   21.486   21.275   10.435   21.275   10.435 0.000000 0.000000 
1 1 1   23    0   75 o   23.813   10.563   45.794   21.635   45.794   21.635   45.794   21.635   23.813   10.563   23.813   10.563 0.000000 0.000000 
1 1 1   23    0   76 o   15.963   9.5523   23.922   22.126   23.922   22.126   23.922   22.126   15.963   9.5523   15.963   9.5523 0.000000 0.000000 
1 1 1   23    0   77 o   10.141   7.0540  -7.2461   20.716  -7.2461   20.716  -7.2461   20.716   10.141   7.0540   10.141   7.0540 0.000000 0.000000 
1 1 1   23    0   78 o   10.844   7.3970  -0.9781   20.273  -0.9781   20.273  -0.9781   20.273   10.844   7.3970   10.844   7.3970 0.000000 0.000000 
1 1 1   23    1  -65 o   11.481   5.7364 -36.2719   22.162   0.0000   0.0000 -36.2719   22.162  ?   ?    11.481   5.7364 0.000000 5.736433 
1 1 1   23    1  -64 o   14.835   6.6241   5.8557   16.328   37.178   23.177 -25.0039   23.006   22.169   8.7306   12.623   6.2260 9.545901 10.72320 
1 1 1   23    1  -63 o   21.633   8.7133   34.901   23.600   0.0000   0.0000   34.901   23.600  ?   ?    21.633   8.7133 0.000000 8.713270 
1 1 1   23    1  -62 o   20.124   8.4648   27.877   23.583   0.0000   0.0000   27.877   23.583  ?   ?    20.124   8.4648 0.000000 8.464778 
1 1 1   23    1  -61 o   11.879   5.9116 -33.7891   22.538   0.0000   0.0000 -33.7891   22.538  ?   ?    11.879   5.9116 0.000000 5.911615 
1 1 1   23    1  -60 o   11.843   5.6942 -12.4495   16.095 -11.1491   22.525 -13.8061   23.007   13.972   6.7224   13.809   6.6810 0.1628714 9.477673 
1 1 1   23    1  -59 o   19.642   6.7706   21.930   13.143   14.238   18.524   29.727   18.651   17.263   7.3905   21.440   7.9813 -4.177395 10.87754 
1 1 1   23    1  -58 o   14.682   6.2512   7.2870   13.124   1.5906   18.941   12.547   18.201   14.918   6.8469   16.920   7.2859 -2.001195 9.998195 
1 1 1   23    1  -57 o   28.201   5.9723   41.151   13.301   49.306   18.864   33.087   18.758   28.544   7.8591   22.769   8.0716 5.774767 11.26573 
1 1 1   23    1  -56 o   15.358   6.3387   9.3281   12.864   13.458   18.211   5.2148   18.175   17.353   7.3751   15.574   6.9691 1.778431 10.14694 
1 1 1   23    1  -55 o   38.382   4.5934   68.726   14.086   38.891   19.875   98.839   19.967   24.775   8.3296   44.813   5.5872 -20.03714 10.02994 
1 1 1   23    1  -54 o   15.157   6.0594   9.3126   11.324   11.647   14.689   5.8920   17.781   16.572   6.7995   15.817   6.9960 0.7549772 9.755877 
1 1 1   23    1  -53 o   26.499   5.4752   34.494   11.435   33.935   14.782   35.328   18.047   24.878   6.9974   24.388   7.9270 0.4897079 10.57360 
1 1 1   23    1  -52 o   7.9934   3.9464 -17.7661   9.3201  -2.4983   14.062 -29.7273   12.446   13.038   5.9520   8.4924   4.2516 4.545669 7.314571 
1 1 1   23    1  -51 o   33.057   3.9009   48.846   10.309   30.798   15.242   64.066   13.997   23.625   7.2350   37.186   4.7240 -13.56163 8.640683 
1 1 1   23    1  -50 o   23.090   5.4567   26.043   10.106   22.415   14.886   29.145   13.765   20.486   7.1968   23.419   6.8065 -2.933498 9.905633 
1 1 1   23    1  -49 o   29.922   4.0160   40.126   9.5482   39.678   14.857   40.442   12.463   27.670   6.6666   28.981   5.4761 -1.311281 8.627332 
1 1 1   23    1  -48 o   40.727   3.3388   71.863   10.987   71.654   15.687   72.064   15.393   39.277   5.0139   39.511   4.8832 -0.2334595 6.998889 
1 1 1   23    1  -47 o   19.222   5.8844   18.153   10.083   17.878   14.315   18.425   14.206   19.065   7.0112   19.259   6.9999 -0.1942329 9.907358 
1 1 1   23    1  -46 f   10.668   4.8928  -4.3716   9.6488  -9.3274   13.935   0.1932   13.374   11.949   5.6139   13.601   6.0389 -1.652132 8.245248 
1 1 1   23    1  -45 o   15.094   5.7551   9.0821   9.8280  -9.1784   14.341   25.251   13.495   12.195   5.7187   22.201   6.8096 -10.00535 8.892357 
1 1 1   23    1  -44 o   26.276   4.1295   30.848   8.5535   32.837   12.341   29.009   11.866   25.983   5.9545   24.343   6.0151 1.639896 8.463875 
1 1 1   23    1  -43 o   38.525   2.9011   63.022   9.0435   66.798   13.299   59.773   12.335   38.788   4.2770   36.729   4.1950 2.058636 5.990850 
1 1 1   23    1  -42 o   51.291   2.3018  109.835   9.5995  124.944   13.879   95.977   13.292   54.155   3.1576   47.224   3.4773 6.931213 4.697050 
1 1 1   23    1  -41 o   42.623   2.6961   76.535   9.3192   72.558   13.322   80.345   13.041   40.665   4.0738   43.033   3.7552 -2.367558 5.540579 
1 1 1   23    1  -40 o   43.339   2.6088   78.898   9.1738   87.006   13.284   71.504   12.685   44.890   3.6620   40.526   3.8874 4.363415 5.340622 
1 1 1   23    1  -39 f   44.813   2.7366   84.512   9.9490   83.738   15.511   85.053   12.968   43.522   4.4340   44.446   3.6104 -0.9236183 5.717980 
1 1 1   23    1  -38 o   40.059   2.7956   67.631   9.0715   66.122   12.800   69.153   12.858   38.888   4.0994   39.831   4.0150 -0.9427147 5.738093 
1 1 1   23    1  -37 o   13.368   5.2046   5.9073   8.1581   5.7283   11.629   6.0807   11.448   14.712   6.0445   14.758   6.0229 -0.4685116E-01 8.532984 
1 1 1   23    1  -36 o   23.171   4.6090   24.230   8.3989   29.125   11.934   19.425   11.823   24.742   5.9833   20.200   6.4016 4.542048 8.762458 
1 1 1   23    1  -35 o   41.306   2.7107   71.635   9.0764   70.453   13.012   72.756   12.667   40.272   4.0172   41.043   3.8304 -0.7711372 5.550704 
1 1 1   23    1  -34 o   30.659   3.5342   40.424   8.6710   35.631   12.262   45.219   12.264   27.705   5.6220   31.734   4.8983 -4.029829 7.456516 
1 1 1   23    1  -33 o   37.714   2.9356   60.003   8.9536   64.379   12.727   55.715   12.598   38.461   4.1239   35.576   4.4408 2.884998 6.060293 
1 1 1   23    1  -32 o   37.514   2.9165   59.315   8.8484   45.250   12.538   73.270   12.489   31.721   5.0156   41.291   3.7514 -9.570480 6.263345 
1 1 1   23    1  -31 o   27.475   4.1372   33.090   8.9787   37.867   11.976   26.960   13.568   28.835   5.2902   23.596   6.7268 5.238897 8.557840 
1 1 1   23    1  -30 o   17.205   5.5245   13.271   8.7821   18.429   11.954   7.2240   12.945   19.897   6.4504   15.811   6.4223 4.086566 9.102396 
1 1 1   23    1  -29 o   16.539   5.7144   11.753   9.3644   11.492   11.635   12.233   15.778   16.936   6.3041   18.227   7.1956 -1.290558 9.566485 
1 1 1   23    1  -28 o   15.018   5.5956   8.5541   9.1715  -0.7324   12.913   18.009   13.029   13.583   5.9868   19.815   6.7438 -6.231924 9.017803 
1 1 1   23    1  -27 o   39.621   3.2111   66.445   10.282   53.946   14.290   79.863   14.806   34.638   5.2233   42.861   4.2956 -8.223286 6.762809 
1 1 1   23    1  -26 o   25.950   5.0349   30.409   10.266   32.244   16.572   29.266   13.077   25.524   7.4826   24.792   6.4206 0.7320805 9.859729 
1 1 1   23    1  -25 o   21.537   5.8183   21.600   10.454   2.5601   16.419   34.578   13.557   15.890   6.8815   27.084   6.2651 -11.19440 9.306242 
1 1 1   23    1  -24 f   13.372   5.4078   4.5380   9.1312   1.9431   13.081   7.0040   12.752   14.385   6.1854   15.740   6.3814 -1.354121 8.887164 
1 1 1   23    1  -23 o   34.977   3.3029   51.908   9.3057   33.114   14.233   65.939   12.298   26.335   6.6345   39.167   3.9040 -12.83212 7.697881 
1 1 1   23    1  -22 o   24.313   4.6869   26.377   8.9522   37.836   14.443   19.229   11.408   28.333   6.4047   20.361   6.2637 7.972149 8.958471 
1 1 1   23    1  -21 o   34.006   3.1602   48.891   8.6598   49.774   12.485   48.072   12.022   33.622   4.6822   33.086   4.5803 0.5368347 6.549948 
1 1 1   23    1  -20 o   11.814   5.0579   0.8004   8.6770 -11.4709   11.187   19.328   13.747   10.408   4.9321   20.540   6.9275 -10.13198 8.503821 
1 1 1   23    1  -19 o   41.806   2.6718   72.967   9.0572   75.991   12.988   70.104   12.637   42.156   3.8210   40.449   3.8802 1.707016 5.445766 
1 1 1   23    1  -18 o   55.394   2.2955  127.139   10.343  160.628   16.297  104.554   13.383   61.784   3.2473   49.778   3.3172 12.00570 4.642065 
1 1 1   23    1  -17 o   10.661   4.7683  -2.5933   8.4970   5.2996   11.463 -12.2205   12.659   14.746   6.0234   11.159   5.2757 3.586894 8.007114 
1 1 1   23    1  -16 o   42.811   2.6094   76.379   9.0629   95.151   13.106   59.177   12.546   47.445   3.4115   36.988   4.2377 10.45733 5.440237 
1 1 1   23    1  -15 o   60.241   2.3812  150.442   11.670  127.516   20.107  162.087   14.331   54.220   4.5926   62.319   2.8284 -8.099194 5.393698 
1 1 1   23    1  -14 o   28.649   3.9608   35.448   9.0028   40.240   14.001   32.070   11.755   29.577   6.0126   26.519   5.6131 3.058092 8.225435 
1 1 1   23    1  -13 o   21.641   5.0793   21.150   8.8056   32.407   13.777   13.375   11.450   26.271   6.4755   17.833   6.3075 8.437952 9.039724 
1 1 1   23    1  -12 o   16.966   5.7529   12.303   9.4806   32.535   17.613   4.0493   11.249   25.833   7.7497   14.273   5.9127 11.56010 9.747689 
1 1 1   23    1  -11 o   55.137   2.5128  126.237   11.264  120.484   19.909  128.946   13.660   52.679   4.6852   55.495   3.0313 -2.815495 5.580339 
1 1 1   23    1  -10 f   48.333   2.7295   97.381   10.710  147.361   19.400   75.470   12.845   58.728   4.0779   42.090   3.7843 16.63725 5.563279 
1 1 1   23    1   -9 o   21.764   5.8663   21.782   10.641   19.241   16.673   23.529   13.823   20.981   7.5893   22.422   6.8945 -1.440733 10.25341 
1 1 1   23    1   -8 o   36.640   3.4318   56.845   10.130   53.978   14.043   59.956   14.628   34.944   5.0787   36.904   4.9903 -1.960201 7.120175 
1 1 1   23    1   -7 o   15.033   5.6670   8.0496   9.4646   7.9191   13.229   8.1865   13.546   16.354   6.5454   16.552   6.6238 -0.1978302 9.312235 
1 1 1   23    1   -6 o   47.757   2.5682   94.805   9.9611  103.453   15.093   88.132   13.258   49.345   3.7812   45.615   3.5947 3.730145 5.217234 
1 1 1   23    1   -5 o   10.807   4.7946  -2.0023   8.4151  -0.4548   12.819  -3.1743   11.155   13.759   6.0176   12.188   5.4564 1.570762 8.123003 
1 1 1   23    1   -4 o   26.079   4.3270   29.707   8.8760   39.669   13.542   22.204   11.753   29.520   5.8346   21.912   6.2653 7.607750 8.561335 
1 1 1   23    1   -3 o   25.349   4.4133   28.169   8.7879   37.621   13.618   21.423   11.504   28.639   6.0243   21.554   6.2099 7.084980 8.651933 
1 1 1   23    1   -2 o   20.765   5.3853   19.561   9.1914   33.686   13.228   6.3744   12.781   27.012   6.1465   15.703   6.3805 11.30858 8.859437 
1 1 1   23    1   -1 o   32.982   3.6727   46.368   9.7068   45.506   13.729   47.230   13.726   31.856   5.4849   32.529   5.3633 -0.6723957 7.671334 
1 1 1   23    1    0 f   22.119   5.2371   22.104   9.2954   17.201   13.175   26.964   13.116   19.768   6.7801   24.012   6.5301 -4.244165 9.413390 
1 1 1   23    1    1 o   7.3132   3.6467 -21.9204   8.7603 -27.1102   12.393 -16.7372   12.385   9.0229   4.4719   10.321   4.9707 -1.298134 6.686204 
1 1 1   23    1    2 o   13.537   5.4556   4.5594   9.2581  -2.1981   13.338   10.842   12.861   13.595   6.0338   17.249   6.5819 -3.654276 8.929035 
1 1 1   23    1    3 o   11.803   5.1395  -0.5045   9.2626   0.7335   13.151  -1.7233   13.049   14.230   6.1606   13.562   5.9961 0.6679754 8.596907 
1 1 1   23    1    4 o   40.002   3.1930   67.319   10.325   66.395   14.600   68.244   14.604   39.044   4.6805   39.628   4.6067 -0.5845642 6.567237 
1 1 1   23    1    5 o   37.128   3.3642   58.256   10.071   51.567   14.183   65.060   14.304   34.050   5.2807   38.668   4.6301 -4.617546 7.023085 
1 1 1   23    1    6 o   39.906   3.1931   67.010   10.300   65.344   14.597   68.662   14.537   38.700   4.7251   39.765   4.5676 -1.064735 6.571856 
1 1 1   23    1    7 o   23.829   5.0715   25.488   9.5485   25.324   13.574   25.648   13.434   23.222   6.7620   23.374   6.7035 -0.1520920 9.521599 
1 1 1   23    1    8 o   33.530   3.6392   47.901   9.7874   51.293   14.101   44.748   13.595   33.954   5.2653   31.563   5.4831 2.390707 7.601827 
1 1 1   23    1    9 o   17.620   5.7196   13.626   9.3972   3.7243   13.486   22.970   13.101   15.175   6.3931   22.191   6.6899 -7.016177 9.253469 
1 1 1   23    1   10 f   46.572   2.8261   90.579   10.678  101.574   15.302   80.142   14.908   48.824   3.8766   43.119   4.2987 5.704971 5.788497 
1 1 1   23    1   11 o   94.590   2.1022  368.964   16.209  358.175   21.181  384.210   25.180   92.737   2.8051   95.718   3.2318 -2.981194 4.279377 
1 1 1   23    1   12 o   57.639   2.8515  138.674   13.356  182.793   19.855  102.216   18.049   65.663   3.7248   48.527   4.6185 17.13601 5.933301 
1 1 1   23    1   13 o   42.776   3.4836   77.480   12.042   58.896   17.191   95.380   16.872   35.897   6.0926   46.949   4.4623 -11.05142 7.551954 
1 1 1   23    1   14 o   24.225   5.2476   26.547   10.062   29.700   16.066   24.512   12.907   24.816   7.3915   22.843   6.5768 1.973282 9.893845 
1 1 1   23    1   15 o   39.431   3.3873   65.802   10.782   67.797   17.161   64.502   13.859   38.863   5.5767   38.505   4.5002 0.3578758 7.165972 
1 1 1   23    1   16 o   24.804   4.7801   27.409   9.3144   38.966   13.413   16.647   12.944   29.159   5.8470   19.418   6.7180 9.740911 8.906117 
1 1 1   23    1   17 o   20.872   5.4127   19.904   9.2855   14.201   13.425   25.133   12.856   18.533   6.7942   23.093   6.5364 -4.560427 9.427895 
1 1 1   23    1   18 o   13.622   5.4877   4.7939   9.3629 -14.7736   13.603   22.407   12.906   11.266   5.3672   21.854   6.6509 -10.58786 8.546451 
1 1 1   23    1   19 o   49.001   2.7252  100.230   10.842   79.385   15.565  119.880   15.112   42.692   4.5422   53.203   3.5040 -10.51069 5.736727 
1 1 1   23    1   20 o   16.054   5.9449   9.9657   10.323   0.9239   13.722   21.754   15.668   14.448   6.2737   21.623   7.3944 -7.174703 9.697217 
1 1 1   23    1   21 o   37.062   3.7362   58.787   11.133   73.789   14.841   39.477   16.837   41.144   4.4984   28.492   7.2368 12.65173 8.520976 
1 1 1   23    1   22 o   16.418   6.0213   10.729   10.546   21.490   13.942  -3.6645   16.124   21.397   6.9684   14.456   6.5087 6.940916 9.535311 
1 1 1   23    1   23 o   25.249   5.4080   29.138   10.795   37.243   14.128   17.764   16.735   28.138   6.3148   20.279   7.5581 7.858763 9.848927 
1 1 1   23    1   24 f   64.892   2.3131  174.638   12.216  182.066   17.617  167.759   16.954   65.680   3.3012   63.034   3.3112 2.645950 4.675666 
1 1 1   23    1   25 o   14.331   5.7427   5.8394   10.196 -17.8426   16.368   20.857   13.034   12.183   5.8270   21.063   6.7270 -8.879537 8.899828 
1 1 1   23    1   26 o   58.165   2.6964  141.302   12.750  139.605   20.374  142.394   16.346   56.660   4.4469   57.931   3.4776 -1.270802 5.645213 
1 1 1   23    1   27 o   44.770   3.2152   84.739   11.656  101.567   18.852   74.327   14.829   47.954   4.8912   41.222   4.4855 6.731781 6.636530 
1 1 1   23    1   28 o   21.957   6.9725   23.089   14.019  -0.2497   26.528   32.133   16.514   18.518   8.3420   25.448   7.4719 -6.929525 11.19902 
1 1 1   23    1   29 o   35.050   5.4774   55.794   15.138   43.222   27.567   61.221   18.113   28.023   9.7973   36.117   6.3859 -8.093569 11.69475 
1 1 1   23    1   30 o   58.827   3.1820  146.079   15.202  137.130   21.979  154.286   21.048   55.711   4.8892   59.575   4.3646 -3.863419 6.553943 
1 1 1   23    1   31 o   20.002   7.0242   18.347   14.180   10.452   26.212   21.614   16.860   20.184   8.7179   21.421   7.6462 -1.236387 11.59600 
1 1 1   23    1   32 o   15.078   5.6737   8.5553   9.4774   6.7628   13.784   10.163   13.052   15.932   6.5670   16.781   6.5688 -0.8498125 9.288414 
1 1 1   23    1   33 o   23.852   5.0948   26.014   9.6047   27.002   13.858   25.101   13.324   23.519   6.8277   22.747   6.7202 0.7721844 9.580147 
1 1 1   23    1   34 o   16.140   5.7201   11.027   9.4202   7.9819   13.689   13.766   12.983   16.224   6.5991   18.012   6.6677 -1.788525 9.381212 
1 1 1   23    1   35 o   41.553   3.1088   73.151   10.454   69.840   15.044   76.243   14.536   39.621   4.7527   41.697   4.3402 -2.076611 6.436258 
1 1 1   23    1   36 o   13.101   5.3868   3.9674   9.2441  -1.4294   13.522   8.7023   12.666   13.588   6.0503   16.078   6.4147 -2.489921 8.817894 
1 1 1   23    1   37 o   17.108   6.0946   12.763   10.707   16.965   18.262   10.561   13.216   19.867   7.7720   16.834   6.6038 3.033724 10.19879 
1 1 1   23    1   38 o   35.628   3.5976   54.726   10.305   56.829   14.879   52.786   14.287   35.215   5.3514   33.925   5.3429 1.289360 7.562027 
1 1 1   23    1   39 f   48.956   3.1014  101.689   12.313   93.745   15.754  114.160   19.739   46.229   4.2275   50.493   4.8554 -4.264668 6.437915 
1 1 1   23    1   40 o   36.622   3.4829   57.746   10.272   66.283   15.330   50.789   13.838   38.202   5.0461   33.217   5.2878 4.984356 7.309195 
1 1 1   23    1   41 o   15.853   5.7360   10.705   9.5248   12.721   14.156   9.0368   12.875   17.621   6.8571   16.090   6.4513 1.531168 9.414833 
1 1 1   23    1   42 o   26.012   5.1619   31.452   10.559   37.563   14.804   25.125   15.064   27.417   6.6853   22.179   7.2446 5.238489 9.857868 
1 1 1   23    1   43 o   46.253   2.9201   90.752   10.953  106.199   16.116   77.491   14.932   49.180   4.0562   41.652   4.4676 7.527355 6.034285 
1 1 1   23    1   44 o   10.334   4.8359  -7.4755   10.167  -5.4183   16.002  -8.8679   13.165   13.609   6.2633   11.710   5.4872 1.899462 8.326992 
1 1 1   23    1   45 o   12.630   5.3440   2.8219   9.4894   12.962   14.064  -5.6532   12.857   17.470   6.8244   12.135   5.5955 5.335083 8.825103 
1 1 1   23    1   46 f   24.774   5.3131   29.163   10.408   28.311   14.241   30.139   15.247   23.305   6.9634   23.858   7.2223 -0.5538425 10.03246 
1 1 1   23    1   47 o   21.472   6.1616   23.130   11.347   19.468   16.912   26.129   15.303   19.755   7.5454   22.143   7.3056 -2.387991 10.50259 
1 1 1   23    1   48 o   22.096   6.0072   24.429   11.102   24.038   16.643   24.742   14.903   21.164   7.5919   21.555   7.2124 -0.3908062 10.47161 
1 1 1   23    1   49 o   19.018   6.2114   18.147   11.074   4.3476   16.176   30.320   15.192   15.379   6.7420   23.632   7.2205 -8.253487 9.878800 
1 1 1   23    1   50 o   31.447   7.2005   52.895   18.059   52.895   18.059   0.0000   0.0000   31.447   7.2005  ?   ?  0.000000 7.200492 
1 1 1   23    1   51 o   18.932   6.2829   18.246   11.314   21.743   16.275   14.975   15.738   20.101   7.4608   17.924   7.1508 2.177563 10.33425 
1 1 1   23    1   52 o   12.718   5.5631   1.6530   10.960  -1.9225   15.866   4.9159   15.157   13.826   6.3157   15.040   6.5614 -1.214854 9.107140 
1 1 1   23    1   53 o   11.176   5.1732  -4.9868   11.144  -5.8304   16.578  -4.2914   15.052   13.343   6.2213   13.040   6.0274 0.3034058 8.662228 
1 1 1   23    1   54 o   8.9796   4.3991 -17.1315   10.875 -16.6838   15.833 -17.5314   14.964   11.453   5.5415   10.974   5.3279 0.4793015 7.687254 
1 1 1   23    1   55 o   20.861   6.2660   23.097   11.509   25.603   17.067   21.007   15.586   20.899   7.6606   19.470   7.2864 1.429308 10.57242 
1 1 1   23    1   56 o   30.429   5.0789   44.805   12.154   23.755   17.459   64.598   16.930   20.128   7.6716   35.520   6.0648 -15.39180 9.779364 
1 1 1   23    1   57 o   12.180   5.4842  -0.4225   11.450 -10.5192   16.375   9.2373   16.017   12.328   5.8775   15.894   6.8393 -3.565587 9.017822 
1 1 1   23    1   58 o   11.249   5.2241  -4.5975   11.507   21.611   16.835 -27.5761   15.764   19.243   7.4809   10.092   5.0088 9.151240 9.002942 
1 1 1   23    1   59 o   18.555   6.3667   18.794   11.618   17.507   16.776   19.979   16.104   17.963   7.3058   18.683   7.3014 -0.7200432 10.32887 
1 1 1   23    1   60 o   23.910   6.5953   32.058   13.271   27.477   23.169   34.295   16.190   20.235   8.4423   23.626   7.4918 -3.391281 11.28715 
1 1 1   23    1   61 o   30.457   6.7352   51.650   16.277   52.879   23.554   50.526   22.520   26.784   9.0679   26.523   8.8658 0.2605343 12.68188 
1 1 1   23    1   62 o   24.792   7.2394   36.876   15.539   39.091   22.469   34.845   21.513   23.043   8.7215   22.097   8.4924 0.9453526 12.17310 
1 1 1   23    1   63 o   21.742   7.3102   29.160   15.308   25.225   21.822   32.972   21.479   19.568   8.1807   21.515   8.4251 -1.947168 11.74337 
1 1 1   23    1   64 o   18.226   7.1454   19.385   15.464   7.2904   21.943   31.319   21.797   16.096   7.3807   20.938   8.3944 -4.842360 11.17774 
1 1 1   23    1   65 o   14.836   6.5444   6.9587   15.460  -7.0154   22.352   19.774   21.405   14.178   6.7887   18.217   7.8730 -4.038643 10.39571 
1 1 1   23    1   66 o   25.201   7.3347   39.266   15.974   14.761   22.637   63.569   22.544   17.239   7.7410   30.164   8.6941 -12.92429 11.64089 
1 1 1   23    1   67 o   11.030   5.3411 -13.5022   14.789 -30.5397   21.042   3.1273   20.789   11.504   5.7226   15.072   7.0070 -3.568376 9.046868 
1 1 1   23    1   68 o   11.388   5.4933 -12.0468   15.271  -4.6606   21.989 -18.9286   21.225   14.239   6.7948   12.530   6.1398 1.709449 9.157873 
1 1 1   23    1   69 o   13.138   6.0544  -0.1240   15.021   7.3066   21.530  -7.1706   20.966   15.747   7.2537   13.676   6.5554 2.071337 9.776980 
1 1 1   23    1   70 o   17.348   7.0244   17.610   15.429  -1.3551   22.364   34.833   21.312   14.635   6.9464   21.375   8.3858 -6.739475 10.88924 
1 1 1   23    1   71 o   17.055   7.6911   15.476   22.620   15.476   22.620   0.0000   0.0000   17.055   7.6911  ?   ?  0.000000 7.691139 
1 1 1   23    1   72 o   13.936   6.6658  -4.7679   21.425  -4.7679   21.425   0.0000   0.0000   13.936   6.6658  ?   ?  0.000000 6.665776 
1 1 1   23    1   73 o   11.776   5.8386 -25.8707   21.210 -25.8707   21.210   0.0000   0.0000   11.776   5.8386  ?   ?  0.000000 5.838632 
1 1 1   23    1   74 o   13.359   6.4706  -9.9863   21.738  -9.9863   21.738   0.0000   0.0000   13.359   6.4706  ?   ?  0.000000 6.470588 
1 1 1   23    1   75 o   16.705   7.5774   15.015   22.337   15.015   22.337   0.0000   0.0000   16.705   7.5774  ?   ?  0.000000 7.577397 
1 1 1   23    1   76 o   11.107   5.5577 -33.3935   21.129 -33.3935   21.129   0.0000   0.0000   11.107   5.5577  ?   ?  0.000000 5.557677 
1 1 1   23    1   77 o   15.107   7.0875   5.3698   22.071   5.3698   22.071   0.0000   0.0000   15.107   7.0875  ?   ?  0.000000 7.087468 
1 1 1   23    2  -64 o   13.391   6.5493 -16.0099   23.807   0.0000   0.0000 -16.0099   23.807  ?   ?    13.391   6.5493 0.000000 6.549301 
1 1 1   23    2  -63 o   21.802   8.8681   39.383   24.721   0.0000   0.0000   39.383   24.721  ?   ?    21.802   8.8681 0.000000 8.868134 
1 1 1   23    2  -62 o   26.099   9.2412   55.407   24.582   0.0000   0.0000   55.407   24.582  ?   ?    26.099   9.2412 0.000000 9.241156 
1 1 1   23    2  -61 o   16.189   7.0214   12.214   17.146   16.927   25.321   8.2237   23.301   17.685   8.0400   16.213   7.4961 1.471964 10.99240 
1 1 1   23    2  -60 o   15.122   6.7527   7.1056   16.971  -8.6734   23.355   24.757   24.702   14.170   6.8249   19.088   8.3508 -4.917564 10.78496 
1 1 1   23    2  -59 o   13.190   6.1785  -3.4718   16.666   4.7226   23.836 -11.3098   23.312   15.939   7.4411   13.935   6.7378 2.004400 10.03837 
1 1 1   23    2  -58 o   14.200   6.4500   2.7710   16.254   7.4757   23.688  -1.4154   22.345   16.365   7.5633   14.920   7.0403 1.444897 10.33296 
1 1 1   23    2  -57 o   15.712   6.8495   9.5833   16.492   17.619   23.845   2.2145   22.834   18.048   8.0355   15.541   7.2644 2.506818 10.83239 
1 1 1   23    2  -56 o   28.648   5.5475   42.007   12.486   69.366   25.697   33.551   14.286   30.563   9.4007   23.950   6.9264 6.613173 11.67685 
1 1 1   23    2  -55 o   15.583   6.2790   11.303   12.261   9.6951   24.782   11.824   14.109   16.980   7.8072   15.996   6.6237 0.9833670 10.23842 
1 1 1   23    2  -54 o   13.985   5.8610   6.8776   11.242   3.5238   25.242   7.7075   12.557   16.273   7.6165   14.565   6.1542 1.707575 9.792148 
1 1 1   23    2  -53 o   10.805   4.9695  -3.2092   10.051  -8.6295   17.693  -0.6266   12.212   12.937   6.1514   12.358   5.6044 0.5793419 8.321585 
1 1 1   23    2  -52 o   21.917   5.8569   25.259   10.664   7.8942   18.145   34.421   13.180   15.898   7.0476   25.151   6.4105 -9.253798 9.526976 
1 1 1   23    2  -51 o   11.818   5.2685   0.2124   10.285  -3.8270   17.616   2.3011   12.667   13.732   6.4063   13.296   5.8918 0.4360981 8.703629 
1 1 1   23    2  -50 o   18.881   6.6847   19.377   12.862   0.4953   18.180   38.300   18.200   14.678   6.7260   24.868   7.9497 -10.18994 10.41331 
1 1 1   23    2  -49 o   12.314   5.6120  -2.0069   12.434  -7.1850   17.584   3.1717   17.585   13.333   6.2773   15.089   6.7949 -1.755587 9.250707 
1 1 1   23    2  -48 o   17.949   6.5987   16.533   12.678  -0.6519   18.273   32.484   17.605   14.666   6.7287   23.266   7.8396 -8.600770 10.33126 
1 1 1   23    2  -47 o   10.322   4.8389  -6.7547   10.256   4.3404   17.679 -12.3828   12.591   15.493   6.9071   10.575   5.0718 4.918390 8.569171 
1 1 1   23    2  -46 o   34.302   4.2030   53.522   11.507   43.597   19.172   59.110   14.386   27.060   8.0779   35.185   5.1700 -8.124510 9.590709 
1 1 1   23    2  -45 o   35.589   4.0444   57.033   11.525   45.107   19.135   63.823   14.438   27.749   8.0134   36.865   4.9278 -9.115746 9.407290 
1 1 1   23    2  -44 o   13.034   5.5616   3.4062   10.428   16.015   18.299  -2.6576   12.690   18.505   7.5906   12.463   5.6759 6.041601 9.478009 
1 1 1   23    2  -43 o   15.372   5.7691   10.297   9.7847   4.6108   14.591   14.943   13.190   14.890   6.4675   17.680   6.6844 -2.790089 9.301083 
1 1 1   23    2  -42 o   49.501   2.8577  104.559   11.482   74.987   16.777  130.613   15.747   39.794   5.3039   54.690   3.5516 -14.89544 6.383190 
1 1 1   23    2  -41 o   25.598   5.1364   31.092   10.345   9.1018   15.462   48.909   13.918   16.393   6.8722   31.909   5.5524 -15.51632 8.834882 
1 1 1   23    2  -40 o   35.852   3.6157   56.305   10.423   39.480   15.246   71.067   14.281   27.582   6.8198   39.592   4.5050 -12.01001 8.173424 
1 1 1   23    2  -39 o   39.057   3.1370   65.534   9.9033   70.971   13.444   59.082   14.643   39.873   4.1994   35.552   5.2071 4.320675 6.689418 
1 1 1   23    2  -38 o   46.783   2.8903   93.073   10.968   91.509   13.795   95.761   18.085   45.763   3.7304   45.713   4.9312 0.4971313E-01 6.183217 
1 1 1   23    2  -37 o   26.281   5.3357   32.660   11.040   26.384   14.783   40.574   16.599   22.482   7.1624   27.815   7.2488 -5.333260 10.19046 
1 1 1   23    2  -36 o   33.198   3.5704   47.962   9.5101   47.362   12.797   48.703   14.213   32.010   5.0733   32.033   5.6497 -0.2283859E-01 7.593237 
1 1 1   23    2  -35 o   46.902   2.5246   92.432   9.6164   89.490   13.862   95.160   13.351   45.312   3.7877   46.942   3.5147 -1.630062 5.167226 
1 1 1   23    2  -34 o   14.307   5.3627   8.0289   8.4493  -4.5243   12.262   19.377   11.659   12.136   5.5470   19.914   6.3624 -7.777955 8.440949 
1 1 1   23    2  -33 o   13.666   5.4144   6.0679   8.9630   11.764   12.240  -0.5193   13.162   16.841   6.4222   13.486   5.9890 3.355672 8.781425 
1 1 1   23    2  -32 o   39.234   2.9076   65.247   9.2329   59.816   13.430   70.114   12.714   36.525   4.6137   40.051   3.9454 -3.526440 6.070581 
1 1 1   23    2  -31 o   41.029   2.9749   71.391   9.8819   63.653   15.512   76.677   12.820   37.257   5.2533   42.037   3.7817 -4.780312 6.472848 
1 1 1   23    2  -30 o   11.149   4.9198  -0.9406   8.7438  -9.3889   13.846   4.6638   11.277   12.066   5.6455   14.166   5.8984 -2.099656 8.164741 
1 1 1   23    2  -29 o   14.475   5.4329   8.0313   8.6781   14.282   13.595   3.7331   11.274   18.160   6.8034   13.894   5.8489 4.265790 8.971935 
1 1 1   23    2  -28 o   17.993   5.3494   15.000   8.4211   0.6676   12.217   27.971   11.623   13.460   5.8811   24.199   5.9376 -10.73885 8.357240 
1 1 1   23    2  -27 o   11.501   4.9234   1.0525   8.2197   3.2988   11.926  -0.9800   11.345   14.072   5.9740   12.617   5.5841 1.454079 8.177442 
1 1 1   23    2  -26 o   15.966   5.5713   10.994   8.9118   4.3508   14.208   15.303   11.443   15.291   6.5072   18.321   6.3173 -3.029873 9.069342 
1 1 1   23    2  -25 o   14.766   5.3155   8.8795   8.1668   8.8950   12.022   8.8661   11.129   15.942   6.2848   15.655   6.0834 0.2871904 8.746776 
1 1 1   23    2  -24 o   19.779   5.0922   18.048   8.2589   23.167   12.285   13.827   11.156   21.907   6.4479   17.682   6.2287 4.224236 8.965048 
1 1 1   23    2  -23 o   22.666   4.7114   23.258   8.4204   21.439   12.206   24.909   11.631   21.144   6.4744   22.835   6.1235 -1.691610 8.911484 
1 1 1   23    2  -22 o   19.431   5.4737   17.542   9.0377   29.644   12.381   3.7379   13.223   24.939   6.1335   14.807   6.2886 10.13130 8.784472 
1 1 1   23    2  -21 o   19.355   5.4567   17.373   8.9781   12.669   12.274   22.786   13.167   17.463   6.4797   21.730   6.7370 -4.266598 9.347349 
1 1 1   23    2  -20 f   66.381   3.1722  186.120   17.115   0.0000   0.0000  186.120   17.115  ?   ?    66.381   3.1722 0.000000 3.172178 
1 1 1   23    2  -19 o   19.173   6.0343   17.050   10.522   11.243   17.578   20.291   13.134   18.314   7.4672   20.692   6.7651 -2.378674 10.07603 
1 1 1   23    2  -18 o   40.225   3.5016   69.099   11.367   96.305   27.740   63.608   12.462   43.753   8.0754   38.289   4.0542 5.463917 9.035940 
1 1 1   23    2  -17 o   72.280   2.3953  217.205   14.093  268.729   33.739  206.315   15.511   77.435   5.3785   70.246   2.7139 7.188835 6.024442 
1 1 1   23    2  -16 o   19.559   7.0859   17.045   14.541 -12.0549   25.142   31.672   17.825   16.344   7.6342   25.044   7.8502 -8.699900 10.95020 
1 1 1   23    2  -15 o   53.487   2.6323  119.509   11.442  126.199   20.085  116.296   13.921   53.631   4.6400   52.414   3.2747 1.216404 5.679201 
1 1 1   23    2  -14 o   23.757   4.8934   25.529   9.1607   24.535   14.153   26.246   12.017   22.524   6.9852   23.521   6.1863 -0.9974499 9.330735 
1 1 1   23    2  -13 o   42.426   3.4132   76.558   11.704   77.734   18.623   75.790   15.048   41.304   5.6817   41.579   4.5120 -0.2748871 7.255318 
1 1 1   23    2  -12 o   15.497   5.9609   8.5941   10.605  -7.0569   15.979   20.915   14.178   13.668   6.2789   21.049   7.0347 -7.381109 9.429280 
1 1 1   23    2  -11 o   85.623   2.5020  305.048   17.444  297.809   24.595  312.374   24.744   83.676   3.6144   85.767   3.5469 -2.090942 5.064041 
1 1 1   23    2  -10 o   26.377   4.4983   30.858   9.3252   37.423   14.447   26.169   12.209   28.038   6.4547   23.478   6.2640 4.560101 8.994425 
1 1 1   23    2   -9 o   53.897   2.3823  120.756   10.441  130.286   16.397  114.259   13.540   55.267   3.6603   52.012   3.2092 3.254589 4.867975 
1 1 1   23    2   -8 o   19.903   5.3882   18.239   8.9541   17.265   13.836   18.942   11.746   19.607   6.9338   20.155   6.3798 -0.5487862 9.422314 
1 1 1   23    2   -7 o   35.738   3.2837   54.234   9.4590   64.442   14.845   47.256   12.273   38.106   4.8919   32.637   4.7527 5.469242 6.820470 
1 1 1   23    2   -6 o   24.820   4.6807   27.549   9.1227   22.134   14.251   31.309   11.874   21.575   7.0465   25.970   5.7602 -4.394472 9.101242 
1 1 1   23    2   -5 o   23.660   4.8148   25.205   8.9698   23.117   14.063   26.637   11.646   21.985   6.9837   23.813   6.0025 -1.828180 9.208758 
1 1 1   23    2   -4 o   12.175   5.1143   2.1025   8.5909   2.2528   13.364   1.9966   11.215   14.565   6.2570   13.510   5.7664 1.054330 8.508932 
1 1 1   23    2   -3 o   33.417   3.4873   47.694   9.3596   50.146   14.323   45.867   12.365   33.230   5.4785   32.088   4.8808 1.141891 7.337255 
1 1 1   23    2   -2 o   36.545   3.2043   56.566   9.4490   48.922   14.549   62.143   12.426   32.706   5.6622   37.884   4.0886 -5.177830 6.984091 
1 1 1   23    2   -1 o   30.123   3.8099   39.179   9.1461   39.382   14.112   39.032   12.010   28.988   6.1622   29.392   5.2032 -0.4043121 8.065071 
1 1 1   23    2    0 o   14.776   5.4913   8.2452   8.8221   24.247   13.993  -2.3123   11.366   22.473   6.9414   12.415   5.5363 10.05777 8.878794 
1 1 1   23    2    1 o   39.122   3.0449   64.540   9.6339   74.115   14.978   57.784   12.582   41.136   4.5425   36.394   4.3256 4.741993 6.272583 
1 1 1   23    2    2 o   28.835   4.0019   36.148   9.1532   47.252   14.393   28.607   11.861   32.103   5.7091   24.717   5.9572 7.386267 8.251233 
1 1 1   23    2    3 o   41.721   2.8769   73.102   9.7240   83.512   15.503   66.350   12.485   43.774   4.4046   39.226   3.9588 4.547726 5.922274 
1 1 1   23    2    4 o   27.829   4.4568   34.199   9.7693   40.861   14.453   28.594   13.256   29.509   6.2056   24.448   6.5289 5.060350 9.007489 
1 1 1   23    2    5 o   14.825   5.6306   7.9268   9.3845   10.949   13.953   5.4304   12.681   17.373   6.7943   15.187   6.2833 2.186017 9.254322 
1 1 1   23    2    6 o   32.219   3.9296   44.918   10.107   54.010   14.840   37.051   13.804   34.514   5.4559   28.060   6.2003 6.453869 8.258964 
1 1 1   23    2    7 o   11.317   5.0964  -3.2814   9.8925   13.977   13.595 -22.7012   14.421   18.334   6.8163   10.565   5.1521 7.769251 8.544377 
1 1 1   23    2    8 o   9.4479   4.5138 -11.5949   9.7647   2.2233   15.842 -20.0615   12.401   15.556   6.7481   9.7893   4.7746 5.766919 8.266381 
1 1 1   23    2    9 o   43.504   3.2287   80.086   11.368  111.038   18.981   62.772   14.196   50.297   4.6833   37.700   4.7227 12.59699 6.651053 
1 1 1   23    2   10 o   55.384   2.7143  128.243   12.217  135.802   19.972  123.724   15.443   55.862   4.4221   53.930   3.5322 1.931995 5.659637 
1 1 1   23    2   11 o   12.553   5.3203   1.8874   9.4326   5.2093   14.017  -0.8621   12.752   15.617   6.5446   13.468   5.9422 2.149034 8.839731 
1 1 1   23    2   12 o   34.530   3.6078   51.104   10.005   38.007   14.601   62.698   13.737   28.232   6.4817   37.763   4.5545 -9.531664 7.921870 
1 1 1   23    2   13 o   35.275   3.5600   53.258   10.097   52.088   14.818   54.271   13.794   33.774   5.5768   34.842   5.0000 -1.068417 7.490014 
1 1 1   23    2   14 o   22.869   5.2223   23.980   9.5207   19.198   14.028   28.064   12.964   20.344   6.9955   24.206   6.4528 -3.861782 9.517153 
1 1 1   23    2   15 o   39.589   3.1443   66.315   10.064   88.687   15.095   48.415   13.502   45.240   4.1391   32.730   5.2374 12.51035 6.675479 
1 1 1   23    2   16 o   25.654   4.7895   29.578   9.6474   28.625   14.174   30.401   13.168   24.244   6.8635   25.204   6.3991 -0.9599743 9.383830 
1 1 1   23    2   17 o   19.927   5.5716   18.433   9.4009   14.034   14.053   21.995   12.648   18.385   6.9109   21.464   6.5939 -3.078590 9.551920 
1 1 1   23    2   18 o   29.845   4.1159   38.941   9.7470   28.972   14.541   47.076   13.135   24.316   6.9743   32.280   5.1658 -7.964705 8.679055 
1 1 1   23    2   19 o   16.683   5.7169   12.135   9.3664   11.555   14.182   12.584   12.474   17.546   6.8533   17.501   6.5247 0.4465866E-01 9.462537 
1 1 1   23    2   20 f   11.094   4.9722  -2.5909   9.2906   9.6817   14.150 -11.8901   12.317   16.921   6.7704   10.925   5.1765 5.996002 8.522565 
1 1 1   23    2   21 o   13.464   5.4750   4.6360   9.4188  -5.6992   14.157   12.845   12.616   13.019   5.9541   17.603   6.5621 -4.584070 8.860739 
1 1 1   23    2   22 o   14.968   5.8355   7.7149   10.267  -7.2099   18.221   14.657   12.427   14.508   6.6792   18.256   6.5588 -3.748108 9.361120 
1 1 1   23    2   23 o   18.774   6.0484   16.328   10.521   22.197   18.156   13.362   12.909   21.569   7.9021   17.826   6.6391 3.742422 10.32088 
1 1 1   23    2   24 o   17.949   6.4566   14.128   12.047   12.383   18.293   15.464   16.009   18.677   7.6167   19.110   7.3306 -0.4323940 10.57126 
1 1 1   23    2   25 o   16.680   6.8391   8.5001   14.847   17.009   18.591  -6.4807   24.669   19.975   7.8336   16.784   7.7433 3.190693 11.01467 
1 1 1   23    2   26 o   18.718   6.5561   16.010   12.348   16.525   14.078   14.293   25.710   19.125   6.9657   20.515   8.7426 -1.390474 11.17833 
1 1 1   23    2   27 o   36.238   4.6576   58.561   13.440   58.978   15.529   57.315   26.830   35.792   5.4982   31.567   9.5859 4.225180 11.05077 
1 1 1   23    2   28 o   31.209   4.5067   43.410   11.134   38.817   14.743   49.506   16.985   28.213   6.5385   31.796   6.7615 -3.582819 9.405806 
1 1 1   23    2   29 o   9.0628   4.3491 -11.5913   9.2868 -14.2214   13.882  -9.4607   12.494   11.316   5.3995   11.372   5.3344 -0.5666351E-01 7.590139 
1 1 1   23    2   30 o   11.909   5.1937   0.1553   9.4895   12.082   14.062  -9.8169   12.859   17.456   6.8226   11.487   5.3954 5.969516 8.698158 
1 1 1   23    2   31 o   13.295   5.6048   3.2249   10.376   1.7615   17.125   4.0738   13.043   15.597   6.8837   14.669   6.2382 0.9282503 9.289785 
1 1 1   23    2   32 o   14.924   5.6705   8.5949   9.5205   23.242   14.192  -3.3901   12.838   21.534   7.0316   12.705   5.7555 8.829211 9.086772 
1 1 1   23    2   33 o   21.024   5.5857   21.108   9.7343   31.771   14.317   11.939   13.275   25.075   6.8236   17.127   6.6473 7.947647 9.526168 
1 1 1   23    2   34 o   15.146   5.6825   9.2393   9.4919   12.007   14.079   6.9334   12.852   17.286   6.8055   15.349   6.3354 1.936930 9.297911 
1 1 1   23    2   35 o   16.174   5.7877   11.530   9.6660   21.276   14.590   3.9055   12.905   20.595   7.1318   14.457   6.1783 6.138449 9.435788 
1 1 1   23    2   36 o   39.510   3.3254   67.219   10.611   75.988   15.617   59.700   14.461   40.922   4.7713   36.000   5.0679 4.921730 6.960526 
1 1 1   23    2   37 o   17.493   6.0746   14.330   10.588   20.725   17.711   10.774   13.208   20.370   7.7355   16.562   6.5693 3.807823 10.14857 
1 1 1   23    2   38 o   21.734   6.5280   23.983   12.491   32.360   28.653   22.017   13.880   23.456   9.5449   20.736   6.9608 2.719513 11.81349 
1 1 1   23    2   39 o   34.370   4.1671   52.802   11.437   43.190   18.763   58.484   14.426   27.914   7.8950   35.420   5.1471 -7.506069 9.424660 
1 1 1   23    2   40 o   16.120   6.0333   11.388   10.686   37.000   17.887  -2.8281   13.326   25.726   7.8299   12.838   5.8349 12.88794 9.764853 
1 1 1   23    2   41 o   26.593   5.6765   34.489   11.930   26.557   18.177   40.491   15.813   21.874   7.9227   27.697   7.0015 -5.823814 10.57305 
1 1 1   23    2   42 o   20.935   7.6747   23.857   17.131  -1.9352   24.286   49.399   24.168   16.415   7.6115   27.859   9.1805 -11.44356 11.92542 
1 1 1   23    2   43 o   15.391   6.1078   9.4004   11.423   24.418   16.810  -3.4856   15.571   21.053   7.6198   13.507   6.2025 7.545465 9.825037 
1 1 1   23    2   44 o   25.223   5.8779   31.872   11.861   27.365   17.808   35.465   15.900   21.876   7.8525   25.318   7.3027 -3.442171 10.72335 
1 1 1   23    2   45 o   19.654   6.3595   20.044   11.623   20.751   17.024   19.427   15.907   19.687   7.5576   19.248   7.3259 0.4394665 10.52549 
1 1 1   23    2   46 o   19.999   6.4170   20.995   11.850   20.176   17.367   21.709   16.211   19.440   7.5865   19.924   7.4362 -0.4843102 10.62321 
1 1 1   23    2   47 o   16.206   6.2622   11.965   11.743   9.0115   17.013   14.653   16.228   16.350   7.0424   17.673   7.1865 -1.322744 10.06186 
1 1 1   23    2   48 o   16.777   6.3217   13.613   11.775   7.3088   17.431   18.905   15.970   15.986   7.0038   18.845   7.2972 -2.858504 10.11449 
1 1 1   23    2   49 o   17.125   6.2732   14.740   11.442   4.4469   16.704   23.841   15.706   15.116   6.7279   20.387   7.3673 -5.271822 9.977020 
1 1 1   23    2   50 o   16.730   6.2673   13.918   11.537   25.398   16.982   4.0784   15.722   20.651   7.6292   14.702   6.5366 5.948222 10.04643 
1 1 1   23    2   51 o   15.219   6.1441   9.8673   11.765   10.574   17.275   9.2560   16.067   16.413   7.0830   15.888   6.8437 0.5241508 9.849088 
1 1 1   23    2   52 o   11.537   5.2865  -2.5997   11.231   5.1154   16.589  -9.1282   15.260   14.998   6.6884   12.051   5.7252 2.947231 8.804132 
1 1 1   23    2   53 o   18.259   6.3435   18.127   11.547   12.008   17.000   23.367   15.733   16.543   7.0811   19.787   7.3371 -3.244076 10.19680 
1 1 1   23    2   54 o   22.891   6.2597   28.661   12.014   21.442   17.909   34.567   16.200   18.966   7.6072   23.708   7.4911 -4.741261 10.67640 
1 1 1   23    2   55 o   24.194   6.0545   31.438   11.911   46.205   17.705   19.231   16.097   27.424   7.6382   18.298   7.2540 9.126553 10.53388 
1 1 1   23    2   56 o   22.430   7.5524   31.767   16.339   36.223   24.015   27.928   22.293   21.917   8.8028   20.187   8.3394 1.729485 12.12575 
1 1 1   23    2   57 o   23.173   7.5269   33.799   16.273   31.379   23.559   36.008   22.503   20.795   8.5800   22.092   8.6317 -1.296497 12.17055 
1 1 1   23    2   58 o   14.844   6.5627   6.6099   15.629  -5.2718   23.140   16.576   21.194   14.609   6.9710   17.649   7.7278 -3.040339 10.40744 
1 1 1   23    2   59 o   15.053   6.6209   7.6554   15.718   9.3218   22.537   6.0774   21.931   16.431   7.5140   15.845   7.3068 0.5861092 10.48092 
1 1 1   23    2   60 o   22.405   7.5074   32.267   16.146   58.333   23.801   10.044   21.976   27.700   9.1098   16.406   7.4709 11.29314 11.78140 
1 1 1   23    2   61 o   16.823   6.9712   15.251   15.645   11.100   22.350   19.238   21.906   16.545   7.5340   17.959   7.8604 -1.414297 10.88791 
1 1 1   23    2   62 o   12.039   5.7280  -7.6315   15.390 -17.0660   22.060   1.3157   21.482   12.922   6.3166   14.898   6.9902 -1.976326 9.421426 
1 1 1   23    2   63 o   19.631   7.4392   25.125   16.359   25.597   23.530   24.683   22.760   19.035   8.2407   18.891   8.1412 0.1444435 11.58397 
1 1 1   23    2   64 o   12.129   5.7853  -7.9609   15.905  -2.8631   23.350 -12.3737   21.725   14.647   6.9929   13.253   6.4309 1.394075 9.500411 
1 1 1   23    2   65 o   20.280   7.5387   27.610   16.628   59.356   24.302  -0.3390   22.802   27.098   9.2103   14.804   7.0230 12.29414 11.58238 
1 1 1   23    2   66 o   13.442   6.1959   0.9122   15.742   11.913   22.606  -9.4466   21.936   16.436   7.5198   13.542   6.5448 2.894879 9.969042 
1 1 1   23    2   67 o   14.523   6.5299   6.2859   16.169 -17.8295   23.124   29.358   22.618   12.958   6.3617   19.584   8.2665 -6.626241 10.43108 
1 1 1   23    2   68 o   14.619   6.5367   7.1225   15.956   6.8645   23.083   7.3586   22.081   15.631   7.3055   15.577   7.2349 0.5361938E-01 10.28169 
1 1 1   23    2   69 o   16.508   6.9958   15.315   16.305   73.849   24.836 -29.0249   21.616   30.749   9.1977   11.604   5.7771 19.14488 10.86148 
1 1 1   23    2   70 o   16.176   6.9200   14.174   16.219   3.1823   23.326   24.461   22.566   15.096   7.1444   18.382   8.0129 -3.285868 10.73545 
1 1 1   23    2   71 o   13.538   6.5635  -8.8301   22.505  -8.8301   22.505   0.0000   0.0000   13.538   6.5635  ?   ?  0.000000 6.563487 
1 1 1   23    2   72 o   14.375   6.8716  -1.1307   22.694  -1.1307   22.694   0.0000   0.0000   14.375   6.8716  ?   ?  0.000000 6.871558 
1 1 1   23    2   73 o   13.574   6.5711  -7.3125   22.336  -7.3125   22.336   0.0000   0.0000   13.574   6.5711  ?   ?  0.000000 6.571075 
1 1 1   23    2   74 o   13.147   6.3916 -10.2968   21.732 -10.2968   21.732   0.0000   0.0000   13.147   6.3916  ?   ?  0.000000 6.391619 
1 1 1   23    2   75 o   12.041   5.9750 -24.4479   22.382 -24.4479   22.382   0.0000   0.0000   12.041   5.9750  ?   ?  0.000000 5.975004 
1 1 1   23    2   76 o   12.603   6.2052 -18.3064   22.516 -18.3064   22.516   0.0000   0.0000   12.603   6.2052  ?   ?  0.000000 6.205157 
1 1 1   23    3  -62 o   17.130   7.7742   16.968   23.551   0.0000   0.0000   16.968   23.551  ?   ?    17.130   7.7742 0.000000 7.774204 
1 1 1   23    3  -61 o   17.705   7.9767   19.946   24.263   0.0000   0.0000   19.946   24.263  ?   ?    17.705   7.9767 0.000000 7.976730 
1 1 1   23    3  -60 o   15.366   7.2473   3.7225   23.625   0.0000   0.0000   3.7225   23.625  ?   ?    15.366   7.2473 0.000000 7.247263 
1 1 1   23    3  -59 o   10.878   5.2538 -11.8979   14.074   0.0000   0.0000 -11.8979   14.074  ?   ?    10.878   5.2538 0.000000 5.253824 
1 1 1   23    3  -58 o   13.143   5.7953   4.0918   12.112 -10.4438   23.575   9.3039   14.117   13.841   6.7123   14.932   6.4232 -1.091158 9.290421 
1 1 1   23    3  -57 o   16.626   6.3987   15.293   12.225   41.595   23.683   5.7380   14.274   22.493   8.8352   14.111   6.2534 8.381956 10.82432 
1 1 1   23    3  -56 o   11.212   5.2540  -4.8488   12.072   7.7059   23.174  -9.5243   14.142   16.011   7.4278   11.284   5.4020 4.727028 9.184436 
1 1 1   23    3  -55 o   29.426   5.6169   45.230   12.981   23.327   25.312   53.047   15.122   18.648   8.2923   31.238   6.1575 -12.58988 10.32842 
1 1 1   23    3  -54 o   18.616   6.6269   20.227   12.656   21.976   25.357   19.647   14.606   18.513   8.2614   18.177   6.9945 0.3351402 10.82465 
1 1 1   23    3  -53 o   9.9491   4.8288 -13.6615   12.267 -36.4884   23.597  -5.2071   14.361   11.852   5.9214   12.117   5.6947 -0.2653723 8.215438 
1 1 1   23    3  -52 o   15.548   6.8555   8.9236   16.948   13.223   23.938   4.6023   23.998   17.185   7.8144   15.941   7.4499 1.244145 10.79660 
1 1 1   23    3  -51 o   25.850   7.9242   43.565   18.278   52.672   26.106   34.808   25.599   25.242   9.4335   21.163   8.8549 4.079105 12.93836 
1 1 1   23    3  -50 o   22.117   6.6329   28.179   12.904   76.739   25.099   10.733   15.044   33.138   9.0419   15.733   6.6955 17.40573 11.25108 
1 1 1   23    3  -49 f   17.240   6.5922   16.148   12.919 -13.7503   24.401   27.792   15.228   14.022   6.8069   21.229   7.2889 -7.206729 9.973103 
1 1 1   23    3  -48 o   26.381   5.8404   36.545   12.227   46.734   26.602   33.817   13.768   23.898   9.3709   24.338   6.7193 -0.4397354 11.53095 
1 1 1   23    3  -47 o   17.419   6.1014   16.185   10.695  -6.2949   17.840   28.796   13.362   13.253   6.2648   22.370   6.7587 -9.117619 9.215630 
1 1 1   23    3  -46 o   43.052   3.8507   84.315   13.371   83.744   20.093   84.769   17.913   39.513   6.4616   41.111   5.4817 -1.598267 8.473512 
1 1 1   23    3  -45 o   20.257   6.5880   23.039   12.464   5.3714   18.687   37.198   16.729   15.474   6.9832   24.651   7.5855 -9.176961 10.31037 
1 1 1   23    3  -44 o   12.296   5.5650  -0.6929   11.968  -5.3942   18.226   2.8706   15.868   13.637   6.4111   14.378   6.4666 -0.7413206 9.105979 
1 1 1   23    3  -43 o   18.582   6.1999   18.367   11.014   17.229   18.462   18.996   13.723   18.174   7.5556   18.616   6.8614 -0.4414845 10.20618 
1 1 1   23    3  -42 o   16.359   6.1259   13.061   11.020   13.440   18.080   12.837   13.901   17.305   7.3515   16.601   6.6869 0.7038918 9.937757 
1 1 1   23    3  -41 o   20.248   6.1476   21.640   11.036   26.387   18.577   19.051   13.719   20.935   7.9288   18.801   6.8718 2.134369 10.49226 
1 1 1   23    3  -40 o   45.446   3.3172   90.422   12.204   49.787   19.643  115.970   15.575   28.808   8.0532   50.985   3.7743 -22.17644 8.893830 
1 1 1   23    3  -39 o   19.543   6.2364   19.981   11.204 -10.6094   18.825   36.763   13.943   13.358   6.3496   26.322   6.5299 -12.96409 9.108036 
1 1 1   23    3  -38 o   11.318   5.1718  -3.1415   10.650 -17.7912   17.655   5.2387   13.353   12.070   5.8428   14.504   6.2431 -2.433728 8.550689 
1 1 1   23    3  -37 o   11.564   5.3428  -4.7392   11.806  -8.3824   18.026  -2.0027   15.623   13.473   6.3472   13.687   6.2579 -0.2137022 8.913397 
1 1 1   23    3  -36 o   10.960   5.1405  -7.3975   11.599  -7.6378   17.365  -7.2039   15.587   13.388   6.2827   12.789   5.9856 0.5994568 8.677599 
1 1 1   23    3  -35 o   42.315   3.4951   78.472   11.948   92.703   20.216   70.832   14.812   43.468   5.8540   39.077   4.7474 4.391190 7.537109 
1 1 1   23    3  -34 o   25.444   5.3795   31.399   10.808   13.262   17.618   42.343   13.686   17.743   7.3790   29.155   5.9600 -11.41202 9.485314 
1 1 1   23    3  -33 o   19.493   6.0672   19.175   10.667   14.005   17.243   22.381   13.577   17.939   7.3645   20.586   6.8841 -2.646301 10.08098 
1 1 1   23    3  -32 o   31.355   4.4940   44.963   11.158   43.355   18.430   45.894   14.020   27.759   7.8153   30.607   5.8322 -2.847649 9.751593 
1 1 1   23    3  -31 o   31.546   4.0805   44.605   10.247   50.239   15.195   39.905   13.878   31.889   6.0671   28.217   6.2030 3.672424 8.676769 
1 1 1   23    3  -30 o   9.7195   4.5954  -8.4873   9.6074   11.242   14.202 -25.1325   13.045   16.767   6.7572   9.3218   4.6143 7.444892 8.182372 
1 1 1   23    3  -29 o   15.607   5.8127   10.473   9.8951   9.4515   14.804   11.297   13.304   16.419   6.7904   16.639   6.5951 -0.2201576 9.466031 
1 1 1   23    3  -28 o   10.049   4.7080  -7.2020   9.6818 -14.4193   14.056  -0.6873   13.355   11.193   5.3658   13.366   5.9779 -2.173216 8.032884 
1 1 1   23    3  -27 o   22.405   5.8296   24.618   10.747   5.3776   17.675   35.905   13.538   16.245   7.0864   26.824   6.2993 -10.57887 9.481472 
1 1 1   23    3  -26 f   14.447   5.8256   6.8527   10.562   3.7170   18.112   8.4686   13.002   16.052   7.0822   15.749   6.4219 0.3036385 9.560196 
1 1 1   23    3  -25 o   30.875   4.1648   42.520   10.215   37.867   15.012   46.533   13.939   27.252   6.7843   31.238   5.6835 -3.986362 8.850358 
1 1 1   23    3  -24 o   29.972   4.7247   40.980   11.161   33.637   18.208   45.399   14.126   24.801   7.9539   30.753   5.8487 -5.952555 9.872786 
1 1 1   23    3  -23 o   25.807   4.9197   30.782   9.9718   29.646   14.723   31.744   13.554   23.945   7.0616   25.137   6.5499 -1.192543 9.631596 
1 1 1   23    3  -22 o   23.566   5.2214   26.104   9.7658   27.225   14.380   25.144   13.305   23.028   7.0227   22.299   6.7459 0.7285404 9.737819 
1 1 1   23    3  -21 o   26.677   4.6153   32.332   9.6732   44.978   14.292   21.642   13.140   30.625   5.9395   20.830   6.7636 9.795168 9.001349 
1 1 1   23    3  -20 o   11.265   4.9314  -0.1824   8.6270  -9.3861   13.533   6.1187   11.197   11.847   5.5552   14.529   5.9461 -2.682147 8.137331 
1 1 1   23    3  -19 o   36.093   3.5493   56.358   10.307   59.349   18.736   55.059   12.343   34.505   6.9026   35.139   4.4057 -0.6342316 8.188773 
1 1 1   23    3  -18 o   18.703   5.5218   16.526   8.9981   35.002   14.115   3.8774   11.679   26.564   6.5583   14.033   5.9327 12.53055 8.843553 
1 1 1   23    3  -17 o   25.579   5.0618   30.220   10.181   36.594   14.431   23.904   14.365   27.191   6.5820   21.808   7.0710 5.382887 9.660322 
1 1 1   23    3  -16 o   9.7835   4.6914 -12.7445   10.760   2.6203   13.817 -36.4296   17.155   14.576   6.3126   10.362   5.1567 4.214417 8.151113 
1 1 1   23    3  -15 o   24.370   5.7952   28.352   11.343   26.809   14.601   30.702   18.014   23.030   7.0866   24.151   7.9243 -1.120790 10.63083 
1 1 1   23    3  -14 o   26.478   5.2939   32.552   11.026   25.385   14.479   42.446   17.012   22.481   7.0792   28.911   7.2365 -6.429867 10.12336 
1 1 1   23    3  -13 o   53.690   2.7128  121.160   11.834  141.497   16.563   99.949   16.915   57.419   3.5561   47.578   4.4117 9.840267 5.666497 
1 1 1   23    3  -12 o   35.145   3.4189   53.056   9.6710   61.713   14.992   46.886   12.656   36.824   5.1340   32.121   4.9960 4.702526 7.163662 
1 1 1   23    3  -11 o   21.461   5.2884   21.527   9.1906   23.913   14.368   19.875   11.957   21.933   7.0686   20.305   6.4381 1.627989 9.561032 
1 1 1   23    3  -10 o   29.148   4.0754   37.397   9.4186   54.715   14.685   25.295   12.276   34.478   5.4026   22.777   6.3662 11.70061 8.349626 
1 1 1   23    3   -9 o   22.380   5.5095   23.573   9.9825   47.516   17.798   12.583   12.058   30.737   7.2260   17.249   6.4180 13.48800 9.664702 
1 1 1   23    3   -8 o   14.430   5.7532   6.5940   10.181 -14.8024   21.904   12.491   11.499   14.661   6.9340   17.106   6.2850 -2.444206 9.358479 
1 1 1   23    3   -7 o   14.005   5.6115   5.9189   9.7346  -0.7452   17.032   9.1522   11.863   15.129   6.7597   15.932   6.2547 -0.8032513 9.209536 
1 1 1   23    3   -6 o   28.821   4.4223   36.994   10.058   77.961   18.562   19.964   11.968   41.035   5.7031   20.377   6.4385 20.65729 8.601156 
1 1 1   23    3   -5 o   28.984   4.1123   36.992   9.4434   48.865   15.135   29.424   12.084   32.173   5.9915   24.783   6.0381 7.389935 8.506289 
1 1 1   23    3   -4 o   55.248   2.4260  127.394   10.899  148.155   17.423  114.046   13.970   58.732   3.6573   51.733   3.3306 6.998734 4.946603 
1 1 1   23    3   -3 f   53.585   2.6420  120.370   11.505  155.732   17.123   91.268   15.533   60.355   3.4953   45.660   4.2212 14.69492 5.480503 
1 1 1   23    3   -2 o   43.307   3.0741   79.501   10.781  105.503   16.233   58.981   14.421   49.224   4.0824   36.116   5.0352 13.10793 6.482254 
1 1 1   23    3   -1 o   26.492   4.8608   31.862   10.110   42.858   14.967   22.634   13.711   29.849   6.3468   21.496   6.9030 8.352571 9.377222 
1 1 1   23    3    0 o   11.808   5.1659  -0.2303   9.4536   0.8203   13.955  -1.1212   12.852   14.277   6.2605   13.320   5.9166 0.9569845 8.613943 
1 1 1   23    3    1 o   34.145   3.5098   50.154   9.6300   48.931   15.485   50.925   12.297   32.101   6.1416   33.811   4.5794 -1.710804 7.660902 
1 1 1   23    3    2 o   25.904   4.6379   30.233   9.4338   40.730   15.292   23.783   11.987   28.872   6.6365   22.155   6.3250 6.717010 9.167826 
1 1 1   23    3    3 f   34.221   3.7530   50.751   10.297   44.603   18.363   53.572   12.437   29.502   7.5918   34.736   4.4978 -5.234047 8.824167 
1 1 1   23    3    4 o   30.283   4.2600   40.531   10.225   22.685   18.279   48.660   12.336   21.576   7.9248   32.944   4.7292 -11.36807 9.228608 
1 1 1   23    3    5 o   30.856   4.1187   41.860   10.101   55.828   18.501   35.928   12.057   33.658   6.9728   27.775   5.5197 5.882479 8.893103 
1 1 1   23    3    6 o   12.076   5.1457   1.6184   8.9043 -10.7078   14.525   9.0392   11.270   12.209   5.7346   15.718   6.1179 -3.509008 8.385433 
1 1 1   23    3    7 o   37.076   3.4521   58.995   10.313   57.834   15.337   59.953   13.933   35.419   5.4897   36.563   4.7900 -1.143909 7.285716 
1 1 1   23    3    8 o   37.364   3.1989   59.499   9.6493   63.089   15.352   57.155   12.406   37.221   5.2018   35.989   4.3149 1.232410 6.758470 
1 1 1   23    3    9 o   10.864   4.8653  -2.2751   8.8774  -9.9575   14.247   2.6013   11.350   12.190   5.7109   13.593   5.8012 -1.402628 8.140547 
1 1 1   23    3   10 o   20.071   5.4279   18.917   9.0926   38.339   14.677   6.8187   11.583   28.002   6.5476   15.017   6.0843 12.98449 8.938096 
1 1 1   23    3   11 o   36.678   3.2650   57.481   9.6597   43.692   15.039   67.166   12.603   30.097   6.3309   39.235   3.9964 -9.137577 7.486795 
1 1 1   23    3   12 o   16.701   5.6324   12.533   9.0874   27.244   14.682   3.3971   11.570   23.264   7.0964   13.911   5.8940 9.353262 9.224840 
1 1 1   23    3   13 o   32.666   3.6452   46.224   9.5409   41.217   14.959   49.658   12.387   29.076   6.4775   33.252   4.7011 -4.175837 8.003674 
1 1 1   23    3   14 o   23.664   4.9608   25.771   9.2627   21.675   14.529   28.575   12.023   20.985   7.1218   24.322   6.0808 -3.336399 9.364604 
1 1 1   23    3   15 o   23.521   4.8978   25.426   9.0848   26.081   14.371   24.989   11.725   22.754   7.0356   22.663   6.1784 0.9133530E-01 9.363396 
1 1 1   23    3   16 o   39.678   3.6150   68.028   11.564   39.325   19.884   82.697   14.215   26.919   8.2676   43.464   4.0591 -16.54474 9.210270 
1 1 1   23    3   17 o   47.302   3.1790   95.346   12.186   56.394   20.693  116.029   15.079   32.795   7.8459   51.898   3.5863 -19.10286 8.626669 
1 1 1   23    3   18 o   13.903   5.7350   4.9612   10.523   40.630   18.614 -11.7924   12.757   27.599   7.8829   11.059   5.2482 16.54072 9.470101 
1 1 1   23    3   19 o   14.615   5.6859   7.7301   9.7308   4.6206   14.678   10.168   12.998   15.354   6.5761   16.463   6.5209 -1.109216 9.261061 
1 1 1   23    3   20 o   33.811   4.3952   51.048   11.827   50.063   15.585   52.386   18.162   32.204   6.1611   32.128   7.1221 0.7574844E-01 9.417255 
1 1 1   23    3   21 o   47.831   3.6900   99.223   14.276  115.339   16.771   56.816   27.204   51.282   4.0446   30.515   9.7154 20.76727 10.52368 
1 1 1   23    3   22 o   18.737   6.3147   16.819   11.422   9.2676   14.761   28.091   18.033   16.581   6.8110   22.955   7.9299 -6.373783 10.45344 
1 1 1   23    3   23 o   30.985   4.2012   42.778   10.338   43.092   15.413   42.521   13.939   29.378   6.5979   29.679   5.9685 -0.3013535 8.896914 
1 1 1   23    3   24 o   11.419   5.0897  -1.4309   9.5938  -7.9948   14.435   3.7626   12.840   12.464   5.8094   14.361   6.1507 -1.896791 8.460518 
1 1 1   23    3   25 o   23.917   5.2223   27.009   9.8954   40.813   15.146   16.728   13.071   28.440   6.6526   18.699   6.7254 9.741009 9.459791 
1 1 1   23    3   26 f   30.039   4.2654   40.493   10.151   26.120   14.826   53.176   13.928   22.341   7.1785   33.767   5.2288 -11.42593 8.880936 
1 1 1   23    3   27 o   21.160   5.6443   21.776   9.9147   14.750   14.944   27.301   13.251   18.135   7.0488   23.073   6.6702 -4.937593 9.704439 
1 1 1   23    3   28 o   21.163   5.6591   21.851   9.9516   8.9525   14.730   32.681   13.498   16.299   6.7601   25.364   6.4994 -9.065434 9.377695 
1 1 1   23    3   29 o   21.907   5.9666   23.852   10.941   17.269   14.777   31.840   16.277   18.872   7.0882   24.198   7.4885 -5.326326 10.31117 
1 1 1   23    3   30 o   16.746   6.3339   12.487   11.846   0.3040   18.453   21.028   15.451   15.328   6.9263   20.156   7.3038 -4.828608 10.06573 
1 1 1   23    3   31 o   15.055   5.9615   8.6412   10.861   7.9992   14.963   9.3559   15.788   15.969   6.7313   16.534   6.9386 -0.5647058 9.667192 
1 1 1   23    3   32 o   11.928   5.3276  -0.9701   10.569   5.9163   14.651  -8.4426   15.262   15.300   6.5617   12.570   5.8959 2.729807 8.821464 
1 1 1   23    3   33 o   36.360   3.6593   58.273   10.699   72.580   16.050   46.832   14.352   39.272   5.1366   30.775   5.9364 8.497425 7.850211 
1 1 1   23    3   34 o   16.281   5.8564   12.371   9.9112   27.249   14.875   0.4920   13.292   22.308   7.1923   13.434   5.9890 8.874125 9.359387 
1 1 1   23    3   35 o   14.593   5.8854   7.7627   10.782   21.264   15.403  -5.2097   15.098   19.931   7.2821   12.966   6.0086 6.965112 9.440982 
1 1 1   23    3   36 o   34.324   4.1486   53.340   11.372   54.090   15.997   52.575   16.170   32.664   6.2354   31.999   6.4229 0.6653557 8.951735 
1 1 1   23    3   37 o   11.529   5.3018  -4.0449   11.435  -2.8489   17.077  -5.0170   15.396   14.033   6.4625   13.055   6.0558 0.9777403 8.856429 
1 1 1   23    3   38 o   18.277   6.7960   17.112   13.515   29.440   26.236   12.659   15.768   21.637   9.0021   17.078   7.0301 4.559248 11.42187 
1 1 1   23    3   39 o   17.132   6.6540   14.081   13.309 -38.5026   24.679   35.647   15.805   12.518   6.2224   25.089   7.2938 -12.57100 9.587397 
1 1 1   23    3   40 o   20.667   6.3366   22.708   11.687   8.8208   17.318   34.320   15.837   16.278   7.0585   24.455   7.3514 -8.177025 10.19144 
1 1 1   23    3   41 o   19.308   6.4570   19.954   11.945   17.870   17.998   21.595   15.968   18.514   7.5533   19.601   7.3669 -1.086916 10.55097 
1 1 1   23    3   42 o   39.196   4.0703   70.068   12.816   62.806   19.207   75.895   17.206   33.524   7.2406   39.138   5.5484 -5.614037 9.121996 
1 1 1   23    3   43 o   9.3001   4.5413 -15.9812   11.313 -28.3711   17.093  -6.3224   15.092   10.594   5.2506   12.485   5.8584 -1.891681 7.867042 
1 1 1   23    3   44 o   23.534   6.2469   29.833   12.182   4.3226   17.791   52.354   16.716   15.151   6.8277   30.797   6.8370 -15.64618 9.662453 
1 1 1   23    3   45 o   11.007   5.2853 -11.9391   13.767 -24.1613   17.517   7.8018   22.263   11.088   5.4621   16.533   7.5249 -5.444445 9.298326 
1 1 1   23    3   46 o   21.306   6.3502   25.122   11.855   31.536   18.021   20.228   15.741   22.063   7.9018   18.704   7.2441 3.358454 10.71982 
1 1 1   23    3   47 o   15.342   6.1768   10.703   11.855   11.523   17.844   10.056   15.861   16.453   7.1492   15.816   6.8060 0.6368027 9.870792 
1 1 1   23    3   48 o   29.526   7.5686   52.699   18.299   52.699   18.299   0.0000   0.0000   29.526   7.5686  ?   ?  0.000000 7.568594 
1 1 1   23    3   49 f   31.538   5.0794   49.201   12.615   52.971   18.547   45.957   17.208   29.376   7.6656   27.473   7.4829 1.902878 10.71236 
1 1 1   23    3   50 o   11.565   5.4506  -6.4607   13.323 -29.4243   24.438   3.2511   15.893   12.658   6.2744   14.210   6.4238 -1.552011 8.979641 
1 1 1   23    3   51 o   18.898   8.1787   22.813   23.163   0.0000   0.0000   22.813   23.163  ?   ?    18.898   8.1787 0.000000 8.178739 
1 1 1   23    3   52 o   16.373   7.5381   8.4331   23.207   0.0000   0.0000   8.4331   23.207  ?   ?    16.373   7.5381 0.000000 7.538088 
1 1 1   23    3   53 o   15.925   7.3344   6.9292   22.001   0.0000   0.0000   6.9292   22.001  ?   ?    15.925   7.3344 0.000000 7.334391 
1 1 1   23    3   54 o   18.047   7.9657   19.494   22.936   0.0000   0.0000   19.494   22.936  ?   ?    18.047   7.9657 0.000000 7.965694 
1 1 1   23    3   55 o   15.324   7.1464   3.7778   21.892   0.0000   0.0000   3.7778   21.892  ?   ?    15.324   7.1464 0.000000 7.146374 
1 1 1   23    3   56 o   14.743   6.9840  -0.8343   22.395   0.0000   0.0000  -0.8343   22.395  ?   ?    14.743   6.9840 0.000000 6.984036 
1 1 1   23    3   57 o   23.896   8.9367   46.599   23.437   0.0000   0.0000   46.599   23.437  ?   ?    23.896   8.9367 0.000000 8.936739 
1 1 1   23    3   58 o   11.840   5.7056 -11.1434   16.379   34.396   24.535 -47.7510   21.998   20.600   8.6475   10.575   5.3407 10.02448 10.16375 
1 1 1   23    3   59 o   19.086   7.4902   24.174   17.007   31.107   25.084   18.276   23.137   19.785   8.5367   17.525   7.8511 2.259193 11.59806 
1 1 1   23    3   60 o   12.003   5.7621  -9.4206   16.333 -19.4685   23.907  -0.6246   22.368   13.018   6.4064   14.621   6.9419 -1.603333 9.446239 
1 1 1   23    3   61 o   12.600   5.9652  -4.9042   16.293  -5.2428   23.379  -4.5846   22.718   14.232   6.8479   14.179   6.8037 0.5289173E-01 9.653159 
1 1 1   23    3   62 o   18.084   7.3388   21.261   16.884   52.765   24.853  -5.7427   23.009   24.488   9.1935   14.058   6.7718 10.42998 11.41830 
1 1 1   23    3   63 f   17.954   7.3100   20.944   16.817   36.593   24.645   7.3076   23.006   20.611   8.6605   15.608   7.2944 5.002846 11.32309 
1 1 1   23    3   64 o   18.289   7.3693   22.313   16.889   30.896   24.585   14.643   23.242   19.416   8.4145   16.654   7.6214 2.762215 11.35296 
1 1 1   23    3   65 o   15.771   6.8834   12.558   16.698   8.9744   24.562   15.637   22.768   15.905   7.4666   16.735   7.6141 -0.8291721 10.66415 
1 1 1   23    3   66 f   11.352   5.5248 -13.6189   16.352 -21.4652   23.574  -6.3419   22.702   12.587   6.2257   13.788   6.6625 -1.200803 9.118565 
1 1 1   23    3   67 o   16.089   6.9458   14.396   16.622 -13.2192   23.991   39.891   23.052   13.339   6.5345   21.388   8.6125 -8.048766 10.81087 
1 1 1   23    3   68 o   12.073   5.7733  -6.7557   16.049   7.9017   23.353 -19.8738   22.093   15.468   7.2673   12.304   6.0747 3.164037 9.471813 
1 1 1   23    3   69 o   14.722   7.0680   0.4422   24.588   0.4422   24.588   0.0000   0.0000   14.722   7.0680  ?   ?  0.000000 7.067997 
1 1 1   23    3   70 o   14.854   7.0798   2.6140   23.728   2.6140   23.728   0.0000   0.0000   14.854   7.0798  ?   ?  0.000000 7.079827 
1 1 1   23    3   71 f   18.315   8.1722   26.590   24.804   26.590   24.804   0.0000   0.0000   18.315   8.1722  ?   ?  0.000000 8.172209 
1 1 1   23    4  -61 f   14.510   7.0080  -2.3175   25.044   0.0000   0.0000  -2.3175   25.044  ?   ?    14.510   7.0080 0.000000 7.007999 
1 1 1   23    4  -60 o   19.182   8.4303   31.614   25.435   0.0000   0.0000   31.614   25.435  ?   ?    19.182   8.4303 0.000000 8.430254 
1 1 1   23    4  -59 o   12.132   6.0728 -33.5974   25.345   0.0000   0.0000 -33.5974   25.345  ?   ?    12.132   6.0728 0.000000 6.072801 
1 1 1   23    4  -58 o   16.357   6.8053   15.357   14.994   0.0000   0.0000   15.357   14.994  ?   ?    16.357   6.8053 0.000000 6.805287 
1 1 1   23    4  -57 o   22.140   7.3620   32.867   15.532   0.0000   0.0000   32.867   15.532  ?   ?    22.140   7.3620 0.000000 7.361977 
1 1 1   23    4  -56 o   19.622   7.3305   25.994   15.761   0.0000   0.0000   25.994   15.761  ?   ?    19.622   7.3305 0.000000 7.330474 
1 1 1   23    4  -55 o   17.832   8.0000   21.395   24.119   21.395   24.119   0.0000   0.0000   17.832   8.0000  ?   ?  0.000000 8.000026 
1 1 1   23    4  -54 o   15.220   7.1987   3.2245   23.615   3.2245   23.615   0.0000   0.0000   15.220   7.1987  ?   ?  0.000000 7.198669 
1 1 1   23    4  -53 o   14.391   6.9095  -4.0099   23.504  -4.0099   23.504   0.0000   0.0000   14.391   6.9095  ?   ?  0.000000 6.909463 
1 1 1   23    4  -52 o   10.927   5.2928 -12.7953   14.545   4.0152   23.809 -22.8045   18.371   15.430   7.2766   11.201   5.5318 4.228838 9.140551 
1 1 1   23    4  -51 o   18.916   6.7337   21.749   13.067   40.433   24.627   14.426   15.417   21.802   8.8575   16.374   6.8629 5.428291 11.20512 
1 1 1   23    4  -50 o   25.070   6.5179   36.369   13.442   43.466   24.805   33.418   15.993   22.510   8.9784   22.520   7.4701 -0.1005173E-01 11.67962 
1 1 1   23    4  -49 o   13.522   5.9582   4.8369   12.781  -7.5263   24.133   9.6565   15.068   14.259   6.8851   15.178   6.5826 -0.9188261 9.525522 
1 1 1   23    4  -48 o   14.943   6.2978   9.7929   13.095   16.706   24.842   7.1327   15.410   17.476   7.9521   14.691   6.5046 2.785576 10.27355 
1 1 1   23    4  -47 o   12.805   5.8227   0.7975   13.290  -0.5475   25.672   1.2899   15.533   15.371   7.3369   13.565   6.2164 1.805898 9.616338 
1 1 1   23    4  -46 o   12.799   5.8055   0.9121   13.112  -3.2440   24.245   2.6302   15.588   14.882   7.1107   13.870   6.3065 1.012179 9.504361 
1 1 1   23    4  -45 o   13.134   5.9085   2.1019   13.258   1.5710   24.768   2.3151   15.696   15.585   7.3716   13.871   6.3153 1.714190 9.706843 
1 1 1   23    4  -44 o   18.008   6.7999   18.760   13.640   8.7113   25.592   22.746   16.120   16.641   7.7493   19.116   7.3501 -2.474754 10.68059 
1 1 1   23    4  -43 o   11.319   5.2498  -3.6063   11.565   13.163   24.291  -8.5216   13.151   17.195   7.8394   11.122   5.2927 6.072497 9.458787 
1 1 1   23    4  -42 o   17.658   6.4651   17.388   12.150   56.607   25.938   6.3620   13.753   26.308   9.4727   14.332   6.2513 11.97631 11.34949 
1 1 1   23    4  -41 o   26.386   5.9754   37.206   12.552   28.484   25.915   39.879   14.348   19.905   8.6328   26.535   6.6479 -6.629641 10.89582 
1 1 1   23    4  -40 o   13.228   5.6430   5.1824   10.731  -5.5764   17.939   11.178   13.391   13.303   6.2867   15.630   6.4607 -2.327121 9.014613 
1 1 1   23    4  -39 o   18.752   6.4706   19.758   12.005   12.475   18.187   25.382   15.983   16.628   7.2215   20.233   7.4137 -3.604582 10.34957 
1 1 1   23    4  -38 o   28.383   5.5494   41.168   12.379   23.899   25.794   46.335   14.110   19.308   8.4877   29.586   6.0548 -10.27783 10.42601 
1 1 1   23    4  -37 o   12.016   5.4915  -1.6380   12.013   10.084   25.853  -4.8662   13.567   17.200   7.9322   12.008   5.6084 5.192459 9.714649 
1 1 1   23    4  -36 o   22.920   6.4775   29.201   12.636   51.560   28.002   23.484   14.159   24.984   9.6658   20.041   7.0205 4.943386 11.94633 
1 1 1   23    4  -35 o   9.2761   4.5040 -13.5302   10.700  -7.3239   17.576 -17.1851   13.488   13.111   6.2038   10.185   4.9702 2.925729 7.949220 
1 1 1   23    4  -34 o   17.025   6.1351   14.957   10.883   34.964   17.781   2.9736   13.761   23.556   7.8781   13.783   6.1223 9.773324 9.977296 
1 1 1   23    4  -33 o   15.749   6.0599   11.689   10.964   3.5401   17.701   16.762   13.965   15.035   6.7898   17.803   6.8422 -2.768202 9.639323 
1 1 1   23    4  -32 o   19.262   6.2329   19.818   11.165   12.209   18.482   24.189   14.009   17.039   7.3396   20.627   6.9932 -3.587961 10.13776 
1 1 1   23    4  -31 o   27.341   5.2194   36.609   11.208   37.748   17.971   35.885   14.339   24.827   7.8953   25.532   6.7774 -0.7047558 10.40524 
1 1 1   23    4  -30 o   12.238   5.4268   0.6705   10.767   14.651   17.908  -7.2434   13.474   17.693   7.4049   11.761   5.5238 5.932045 9.238201 
1 1 1   23    4  -29 o   10.495   4.8274  -3.8263   9.4892   1.1567   13.168  -9.2086   13.686   13.345   5.9547   11.547   5.4669 1.798669 8.083593 
1 1 1   23    4  -28 o   18.984   5.7997   18.405   9.8016   22.331   13.985   14.614   13.741   20.139   6.9821   17.325   6.7520 2.814234 9.712840 
1 1 1   23    4  -27 o   36.429   3.5752   58.777   10.480   67.779   14.947   50.074   14.697   37.819   4.9686   31.538   5.9347 6.280691 7.740024 
1 1 1   23    4  -26 o   61.860   2.6454  162.880   13.309  169.966   21.169  158.248   17.114   61.160   4.2730   60.012   3.5138 1.147884 5.532234 
1 1 1   23    4  -25 o   9.2833   4.4387  -9.8934   9.4819  -7.6824   13.883 -11.8265   12.981   11.958   5.6135   10.869   5.1958 1.089386 7.649021 
1 1 1   23    4  -24 o   12.339   5.3312   2.1759   9.8088   28.389   14.420 -20.4004   13.382   22.692   7.0527   9.9221   4.8648 12.77032 8.567756 
1 1 1   23    4  -23 o   32.314   4.0459   47.122   10.424   47.254   15.065   47.002   14.439   30.418   6.2838   30.611   6.0013 -0.1931553 8.689156 
1 1 1   23    4  -22 o   24.552   5.7076   30.004   11.206   45.865   14.570   7.0411   17.531   30.130   6.1411   16.169   7.0551 13.96149 9.353436 
1 1 1   23    4  -21 o   20.646   6.1325   21.868   11.071   12.478   14.305   35.893   17.483   16.938   6.7971   24.969   7.7668 -8.030653 10.32099 
1 1 1   23    4  -20 o   30.696   4.7937   43.977   11.603   64.563   15.191   15.149   17.976   36.900   5.1938   18.261   7.5104 18.63904 9.131368 
1 1 1   23    4  -19 o   21.112   6.1809   22.830   11.314   34.238   14.798   6.7733   17.555   25.252   6.9639   16.203   7.0652 9.048971 9.920293 
1 1 1   23    4  -18 o   24.485   5.6771   29.562   11.110   31.675   18.741   28.416   13.796   23.341   8.0831   23.102   6.8415 0.2392712 10.58975 
1 1 1   23    4  -17 o   10.862   4.9612  -3.5364   9.7863 -10.4554   14.373   2.4429   13.362   11.843   5.6059   13.976   6.1274 -2.133089 8.304873 
1 1 1   23    4  -16 o   29.030   4.4653   38.582   10.229   25.377   14.914   50.310   14.055   21.691   7.2142   32.340   5.5303 -10.64927 9.090004 
1 1 1   23    4  -15 o   23.614   5.3577   26.933   10.075   24.358   15.130   28.984   13.506   21.301   7.2668   23.515   6.7139 -2.214329 9.893623 
1 1 1   23    4  -14 o   21.145   5.6870   22.059   10.014  -1.6263   14.552   43.369   13.803   13.559   6.1366   29.710   5.9075 -16.15117 8.517983 
1 1 1   23    4  -13 o   15.218   5.9231   9.2504   10.564   11.477   14.088   6.3913   15.966   16.788   6.7424   15.850   6.8247 0.9374523 9.593565 
1 1 1   23    4  -12 o   35.968   3.6359   56.741   10.514   51.717   15.356   61.174   14.426   32.452   6.0270   36.269   5.0132 -3.817524 7.839447 
1 1 1   23    4  -11 o   28.637   5.5462   39.422   12.479   46.294   15.298   25.757   21.572   30.365   6.3837   21.641   8.4525 8.723207 10.59230 
1 1 1   23    4  -10 f   40.511   5.0378   76.114   16.278   76.114   16.278   0.0000   0.0000   40.511   5.0378  ?   ?  0.000000 5.037752 
1 1 1   23    4   -9 o   27.904   5.6297   37.575   12.363   46.653   15.301   20.505   20.982   30.551   6.3517   20.307   8.2027 10.24400 10.37437 
1 1 1   23    4   -8 o   22.698   6.2981   26.048   12.062   14.634   14.831   48.351   20.731   18.004   7.0152   29.077   8.3234 -11.07316 10.88539 
1 1 1   23    4   -7 o   9.7276   4.6023  -8.7226   9.6664 -20.3014   14.293   1.0368   13.122   10.519   5.1293   13.659   6.0272 -3.140601 7.914341 
1 1 1   23    4   -6 o   32.393   3.9923   46.635   10.319   63.934   15.461   32.741   13.857   36.927   5.2872   25.255   6.6432 11.67170 8.490379 
1 1 1   23    4   -5 o   13.910   5.7302   5.5268   10.486   7.2850   16.802   4.4052   13.420   16.398   7.0299   14.643   6.2800 1.755637 9.426433 
1 1 1   23    4   -4 o   14.444   5.6206   7.8644   9.5101  -2.9137   14.102   16.856   12.880   13.198   6.0000   18.629   6.6792 -5.431095 8.978407 
1 1 1   23    4   -3 o   27.266   4.7042   34.212   10.078   46.511   15.325   24.839   13.378   30.555   6.3600   21.925   6.7897 8.629105 9.303143 
1 1 1   23    4   -2 o   47.060   3.9527   97.648   15.023   0.0000   0.0000   97.648   15.023  ?   ?    47.060   3.9527 0.000000 3.952692 
1 1 1   23    4   -1 o   27.574   5.0333   35.510   10.897   30.042   18.193   38.569   13.607   23.288   7.9679   27.927   6.1446 -4.638515 10.06199 
1 1 1   23    4    0 o   31.735   4.4415   45.576   11.175   43.397   18.480   46.832   14.032   28.128   7.7921   31.208   5.7267 -3.079775 9.670172 
1 1 1   23    4    1 o   12.553   5.4605   1.2489   10.434 -17.7015   22.871   6.2291   11.725   14.251   6.8351   14.595   6.0403 -0.3447065 9.121629 
1 1 1   23    4    2 o   15.893   5.8152   11.096   9.8278   7.9061   17.758   12.505   11.800   16.803   7.2155   16.820   6.3304 -0.1754951E-01 9.598830 
1 1 1   23    4    3 o   9.6223   4.6014 -11.1230   10.198 -18.4096   17.419  -7.3232   12.579   12.170   5.8697   11.629   5.4212 0.5410900 7.990194 
1 1 1   23    4    4 o   13.042   5.4818   3.6683   9.8794   2.1081   17.899   4.3519   11.847   15.587   6.9495   14.058   5.9607 1.528917 9.155618 
1 1 1   23    4    5 o   31.823   4.0533   45.124   10.276   48.135   18.287   43.735   12.423   29.976   7.5023   30.547   5.1736 -0.5707512 9.113240 
1 1 1   23    4    6 o   35.108   3.5364   53.758   9.9828   57.923   16.025   51.116   12.762   34.600   5.8927   33.318   4.8403 1.281395 7.625753 
1 1 1   23    4    7 o   13.071   5.3882   4.5331   9.2807  -9.0183   14.766   13.383   11.932   12.348   5.7944   17.156   6.3844 -4.807495 8.621755 
1 1 1   23    4    8 o   21.235   5.7197   22.120   10.121   26.139   19.524   20.644   11.835   21.850   8.1597   20.229   6.4041 1.621208 10.37271 
1 1 1   23    4    9 o   29.943   4.4167   40.688   10.457   47.254   19.842   38.164   12.305   28.971   8.0924   28.186   5.5531 0.7853012 9.814421 
1 1 1   23    4   10 f   24.074   5.3030   27.723   10.125   34.238   19.280   25.241   11.898   24.446   8.2039   22.329   6.2769 2.116564 10.32973 
1 1 1   23    4   11 o   24.476   5.3595   28.743   10.396   11.160   19.505   35.721   12.287   17.829   7.6068   27.074   5.7455 -9.245661 9.532785 
1 1 1   23    4   12 o   26.362   4.5901   31.989   9.5056   37.877   15.504   28.442   12.033   26.791   7.0171   23.771   6.1600 3.020149 9.337340 
1 1 1   23    4   13 o   33.129   3.7177   48.387   9.8666   68.713   15.837   35.493   12.614   38.253   5.2145   26.803   5.9305 11.44976 7.896894 
1 1 1   23    4   14 o   36.073   3.4768   56.802   10.097   69.576   16.077   48.481   12.976   38.417   5.2728   32.111   5.1297 6.305721 7.356348 
1 1 1   23    4   15 o   14.299   5.7809   6.9535   10.431   9.9043   14.748   3.9993   14.756   16.419   6.7827   14.871   6.4811 1.547624 9.381383 
1 1 1   23    4   16 o   17.540   6.0973   14.901   10.669   11.326   15.334   18.255   14.853   16.927   6.9464   19.051   7.1165 -2.123962 9.944667 
1 1 1   23    4   17 o   20.607   5.9869   21.395   10.651   13.589   15.151   29.022   14.977   17.536   7.0094   23.108   7.1887 -5.572439 10.04031 
1 1 1   23    4   18 o   19.156   5.8556   18.309   9.9896   19.848   15.009   17.085   13.385   19.555   7.1811   18.510   6.7843 1.045654 9.879022 
1 1 1   23    4   19 o   24.174   4.9816   27.769   9.4895   16.222   14.905   35.640   12.306   18.272   7.0566   26.830   5.7963 -8.558056 9.131936 
1 1 1   23    4   20 o   11.479   5.0418   0.3355   9.0848   5.6831   14.685  -2.9799   11.563   15.151   6.5346   11.880   5.4134 3.271056 8.485603 
1 1 1   23    4   21 o   14.160   5.5402   7.7709   9.2810   12.794   14.949   4.6201   11.839   17.140   6.9236   13.930   5.9344 3.209936 9.118856 
1 1 1   23    4   22 o   15.371   5.6280   10.660   9.2078   0.3864   14.771   17.190   11.776   13.915   6.2501   18.410   6.4055 -4.495204 8.949592 
1 1 1   23    4   23 o   29.417   4.1537   39.334   9.6835   33.409   15.247   43.339   12.536   24.583   7.1691   29.966   5.3275 -5.382959 8.931861 
1 1 1   23    4   24 o   29.314   4.1390   39.082   9.6153   41.643   15.366   37.433   12.327   27.923   6.8124   27.471   5.6921 0.4516697 8.877452 
1 1 1   23    4   25 o   19.572   5.5933   19.214   9.3691   24.121   14.924   16.021   12.037   20.852   7.2134   17.838   6.4490 3.013683 9.675873 
1 1 1   23    4   26 o   17.772   5.6553   15.774   9.2189   21.771   14.380   11.589   12.012   19.975   7.0684   16.121   6.3042 3.853825 9.471275 
1 1 1   23    4   27 o   23.083   5.0877   25.866   9.3146   25.252   14.924   26.259   11.921   21.193   7.2175   22.331   6.2851 -1.137571 9.570545 
1 1 1   23    4   28 o   32.562   4.4626   49.154   11.534   42.169   15.599   57.579   17.130   27.814   6.9108   33.106   6.5796 -5.292629 9.542046 
1 1 1   23    4   29 o   17.145   6.1081   14.723   10.754   10.162   14.461   20.367   16.086   16.028   6.6771   19.271   7.3592 -3.242701 9.936848 
1 1 1   23    4   30 o   27.215   5.7776   37.485   12.420   55.509   18.834   23.613   16.523   31.240   7.4926   20.253   7.5173 10.98703 10.61360 
1 1 1   23    4   31 o   20.274   6.1787   21.832   11.133   13.551   15.193   31.438   16.362   17.011   6.9399   22.980   7.5529 -5.968239 10.25709 
1 1 1   23    4   32 o   12.272   5.5314  -0.5428   11.684 -16.0411   17.405   12.169   15.763   12.019   5.8141   16.639   6.9543 -4.619387 9.064587 
1 1 1   23    4   33 o   11.248   5.3322  -8.8152   13.101 -19.7414   17.110   6.6665   20.367   11.454   5.5913   16.177   7.2964 -4.722829 9.192408 
1 1 1   23    4   34 o   20.148   6.9821   23.322   13.985  -2.6394   18.175   61.002   21.896   14.043   6.5364   30.896   8.4514 -16.85341 10.68412 
1 1 1   23    4   35 o   15.496   6.4353   10.064   13.373   22.406   17.897  -5.5381   20.122   19.371   7.6584   14.105   6.6634 5.265574 10.15143 
1 1 1   23    4   36 o   11.747   5.5207  -6.3667   13.494 -16.6975   17.799   7.5951   20.692   11.953   5.8052   16.195   7.3249 -4.241911 9.346307 
1 1 1   23    4   37 o   10.631   5.0345  -7.8393   11.622  -2.0590   17.123 -12.7758   15.824   13.694   6.3639   11.678   5.6227 2.016152 8.491986 
1 1 1   23    4   38 o   10.323   4.9200  -9.0842   11.456   7.3745   17.397 -21.6851   15.222   15.462   6.8750   10.372   5.1060 5.089307 8.563743 
1 1 1   23    4   39 o   11.923   5.5559  -4.2941   13.187   31.757   25.454 -17.5208   15.418   20.743   8.7634   10.898   5.3173 9.844988 10.25040 
1 1 1   23    4   40 o   15.697   6.1856   12.053   11.640  -2.8836   17.090   24.978   15.898   13.463   6.2902   20.048   7.3859 -6.585165 9.701422 
1 1 1   23    4   41 o   18.245   6.4233   18.694   11.863   27.650   17.656   11.322   16.017   20.558   7.7422   15.999   6.8613 4.559165 10.34503 
1 1 1   23    4   42 o   12.347   5.5436   0.9331   11.605   3.9343   17.083  -1.6390   15.814   14.585   6.6201   13.244   6.1414 1.341482 9.030091 
1 1 1   23    4   43 o   11.882   5.4361  -1.4128   11.813   12.449   17.553 -12.8884   15.971   16.399   7.1085   11.610   5.6047 4.789133 9.052282 
1 1 1   23    4   44 o   10.453   5.0524 -12.7283   13.079  -8.2583   24.042 -14.6071   15.587   14.372   6.9227   11.236   5.4512 3.135756 8.811286 
1 1 1   23    4   45 o   36.166   5.1179   65.267   14.667   69.291   26.932   63.571   17.488   29.119   9.6947   33.766   6.5901 -4.647440 11.72248 
1 1 1   23    4   46 o   17.155   7.2261   16.270   17.225   10.116   24.845   21.966   23.903   16.647   7.7118   18.479   8.1450 -1.832140 11.21662 
1 1 1   23    4   47 o   17.247   7.2512   16.846   17.294   4.3957   24.558   29.095   24.358   15.794   7.4305   19.731   8.4615 -3.937364 11.26097 
1 1 1   23    4   48 o   14.982   6.7612   6.6397   17.516 -18.7205   25.217   30.287   24.350   13.483   6.6243   19.881   8.4914 -6.398193 10.76963 
1 1 1   23    4   49 o   25.924   7.8414   44.842   17.978   36.842   25.799   52.395   25.066   20.923   8.8301   24.785   9.2476 -3.862211 12.78625 
1 1 1   23    4   50 o   10.101   5.0382 -29.1730   16.759 -28.4303   24.145 -29.8634   23.281   12.405   6.1640   12.080   6.0110 0.3246574 8.609710 
1 1 1   23    4   51 o   15.149   6.7850   8.2216   17.269 -21.9800   25.136   35.221   23.766   13.114   6.4755   20.804   8.6038 -7.690104 10.76831 
1 1 1   23    4   52 o   12.166   5.8750 -11.2485   17.581 -16.2189   25.917  -7.0114   23.929   13.721   6.7360   14.188   6.8519 -0.4668798 9.608469 
1 1 1   23    4   53 o   21.555   7.8273   32.956   17.758   53.646   25.619   13.824   24.636   24.529   9.3063   16.785   7.7417 7.744518 12.10536 
1 1 1   23    4   54 o   18.448   7.4318   22.567   17.172  -7.7889   24.764   50.684   23.833   14.194   6.8825   24.431   9.0358 -10.23756 11.35843 
1 1 1   23    4   55 o   22.118   7.8591   35.057   17.793   5.8993   25.269   63.732   25.058   15.707   7.4342   27.416   9.3519 -11.70863 11.94677 
1 1 1   23    4   56 o   20.747   7.7337   30.857   17.523   19.216   25.616   41.096   24.024   17.425   7.9843   21.694   8.7721 -4.268957 11.86161 
1 1 1   23    4   57 o   14.852   6.6894   7.9340   17.052   0.4444   24.765   14.686   23.514   14.925   7.1462   16.634   7.6321 -1.708695 10.45551 
1 1 1   23    4   58 o   10.728   5.2824 -19.4581   16.330  -0.9150   23.800 -35.9552   22.448   14.600   6.9947   11.279   5.6557 3.321599 8.995155 
1 1 1   23    4   59 o   14.136   6.4756   4.6005   16.837   40.907   25.299 -24.2689   22.559   21.114   8.8165   12.125   6.0135 8.989383 10.67203 
1 1 1   23    4   60 o   15.511   6.8348   11.815   16.819  -0.0600   24.479   22.433   23.147   14.707   7.0586   17.727   7.9032 -3.019829 10.59642 
1 1 1   23    4   61 f   14.872   6.6636   9.0177   16.675  -5.2962   24.365   21.631   22.871   14.106   6.8369   17.533   7.8338 -3.427013 10.39763 
1 1 1   23    4   62 o   10.330   5.1224 -22.8932   16.346 -46.1883   23.940  -2.5501   22.372   10.972   5.5445   14.018   6.7331 -3.046526 8.722125 
1 1 1   23    4   63 o   17.701   7.3135   21.514   17.150   25.604   25.088   17.926   23.497   17.982   8.1054   16.805   7.6801 1.177320 11.16608 
1 1 1   23    4   64 f   13.049   6.1455  -1.2589   16.876   6.3913   24.767  -7.8894   23.057   15.343   7.2904   13.554   6.5882 1.789162 9.826216 
1 1 1   23    4   65 o   19.956   8.6473   37.540   25.957   37.540   25.957   0.0000   0.0000   19.956   8.6473  ?   ?  0.000000 8.647346 
1 1 1   23    4   66 f   13.121   6.4699 -16.7278   24.782 -16.7278   24.782   0.0000   0.0000   13.121   6.4699  ?   ?  0.000000 6.469912 
1 1 1   23    5  -58 o   17.721   8.2504   25.681   28.984   0.0000   0.0000   25.681   28.984  ?   ?    17.721   8.2504 0.000000 8.250416 
1 1 1   23    5  -57 o   13.104   6.4771 -17.2791   25.369   0.0000   0.0000 -17.2791   25.369  ?   ?    13.104   6.4771 0.000000 6.477130 
1 1 1   23    5  -56 o   15.053   7.2408   3.2201   26.096   0.0000   0.0000   3.2201   26.096  ?   ?    15.053   7.2408 0.000000 7.240760 
1 1 1   23    5  -55 o   12.505   5.8611  -1.5943   15.034   0.0000   0.0000  -1.5943   15.034  ?   ?    12.505   5.8611 0.000000 5.861071 
1 1 1   23    5  -54 o   12.957   6.0300   0.2744   15.460   0.0000   0.0000   0.2744   15.460  ?   ?    12.957   6.0300 0.000000 6.029997 
1 1 1   23    5  -53 f   14.121   6.3987   5.9620   15.878   0.0000   0.0000   5.9620   15.878  ?   ?    14.121   6.3987 0.000000 6.398660 
1 1 1   23    5  -52 o   14.226   6.4134   6.4466   15.714   0.0000   0.0000   6.4466   15.714  ?   ?    14.226   6.4134 0.000000 6.413377 
1 1 1   23    5  -51 o   16.284   6.5334   15.360   13.214   25.054   23.292   10.758   16.047   18.213   8.0335   15.215   6.6913 2.997444 10.45522 
1 1 1   23    5  -50 o   13.037   5.8940   3.0333   13.383   8.6651   23.381   0.2894   16.320   15.672   7.3337   13.269   6.1822 2.402575 9.591794 
1 1 1   23    5  -49 o   21.594   6.9665   29.873   13.954   50.830   25.301   20.712   16.728   23.424   9.1524   17.761   7.2682 5.662687 11.68730 
1 1 1   23    5  -48 o   14.569   6.2706   9.1707   13.469  -1.8193   23.665   14.436   16.381   14.500   6.9541   16.188   6.9405 -1.688505 9.824957 
1 1 1   23    5  -47 o   10.928   5.2270  -8.4500   13.173  -4.9424   23.602 -10.0368   15.875   14.192   6.8417   11.685   5.6275 2.507133 8.858813 
1 1 1   23    5  -46 o   14.407   6.2575   8.2055   13.658   2.2845   24.287   10.944   16.516   15.139   7.2007   15.466   6.7953 -0.3270092 9.900817 
1 1 1   23    5  -45 f   20.126   6.8494   25.383   13.440   30.708   24.623   23.124   16.041   19.496   8.4351   18.721   7.2953 0.7754822 11.15228 
1 1 1   23    5  -44 o   9.5188   4.6883 -18.4857   12.889 -25.8089   22.586 -14.9487   15.696   12.134   6.0178   11.063   5.3905 1.070889 8.079115 
1 1 1   23    5  -43 o   11.549   5.4336  -4.8729   13.135   7.9342   23.609 -10.6144   15.808   15.872   7.4085   11.650   5.6121 4.221799 9.294150 
1 1 1   23    5  -42 o   10.083   4.9133 -14.4960   13.046 -26.9405   23.723  -9.1013   15.620   12.362   6.1372   11.796   5.6554 0.5656128 8.345621 
1 1 1   23    5  -41 o   13.251   6.1454  -0.2281   15.840   0.0000   0.0000  -0.2281   15.840  ?   ?    13.251   6.1454 0.000000 6.145375 
1 1 1   23    5  -40 o   11.172   5.4332 -14.5719   15.739   0.0000   0.0000 -14.5719   15.739  ?   ?    11.172   5.4332 0.000000 5.433212 
1 1 1   23    5  -39 o   11.065   5.3905 -15.4545   15.681   0.0000   0.0000 -15.4545   15.681  ?   ?    11.065   5.3905 0.000000 5.390503 
1 1 1   23    5  -38 o   12.585   5.7787  -0.4528   13.513   10.434   25.771  -4.5813   15.870   16.626   7.7537   12.619   5.9481 4.006955 9.772458 
1 1 1   23    5  -37 o   11.149   5.2334  -5.1950   12.062   1.8208   24.452  -7.4513   13.867   15.430   7.3059   11.497   5.4605 3.933118 9.121003 
1 1 1   23    5  -36 f   7.8822   3.9696 -29.9633   11.691 -41.2618   23.727 -26.3409   13.435   11.515   5.7797   9.0336   4.5064 2.481337 7.328940 
1 1 1   23    5  -35 o   13.214   5.8187   3.9611   12.171   23.208   25.189  -1.9008   13.901   18.688   8.2932   12.499   5.7827 6.189409 10.11021 
1 1 1   23    5  -34 f   13.354   5.8671   4.2914   12.311 -33.3147   25.099   16.204   14.126   12.433   6.1955   17.074   6.7868 -4.640670 9.189422 
1 1 1   23    5  -33 o   11.833   5.4417  -1.9448   12.047   8.3170   25.058  -5.0296   13.739   16.488   7.6748   11.905   5.5874 4.582953 9.493185 
1 1 1   23    5  -32 o   12.199   5.5402  -0.1749   11.985   0.3774   24.740  -0.3443   13.701   15.458   7.3281   12.771   5.8471 2.687341 9.374928 
1 1 1   23    5  -31 o   24.410   5.8233   31.799   11.425   30.643   18.364   32.529   14.593   21.228   7.9162   23.160   7.0767 -1.931602 10.61825 
1 1 1   23    5  -30 o   11.315   5.1901  -2.1564   10.861  -4.5655   18.121  -0.8056   13.569   13.432   6.3387   12.660   5.8047 0.7719803 8.594980 
1 1 1   23    5  -29 o   13.264   5.6949   5.0858   11.058 -10.2665   17.652   15.001   14.186   12.535   6.0103   16.812   6.7611 -4.276890 9.046351 
1 1 1   23    5  -28 o   9.9214   4.7353  -8.9522   10.690  -6.0384   17.481 -10.6926   13.510   13.080   6.1885   10.969   5.2588 2.111266 8.121145 
1 1 1   23    5  -27 o   16.881   6.1688   15.185   11.054   13.287   17.825   16.371   14.091   16.719   7.2050   17.308   6.8101 -0.5890636 9.914101 
1 1 1   23    5  -26 o   10.718   5.2151 -15.9791   14.549  -5.1342   25.428 -21.2575   17.740   15.132   7.2442   11.359   5.5759 3.772460 9.141629 
1 1 1   23    5  -25 o   21.657   6.6573   26.945   12.890   29.061   18.063   24.750   18.399   21.072   7.8525   19.731   7.7762 1.341299 11.05130 
1 1 1   23    5  -24 o   18.839   6.2084   19.492   11.053   18.242   13.876   21.660   18.282   18.030   6.8469   18.927   7.6526 -0.8969917 10.26856 
1 1 1   23    5  -23 o   11.456   5.0981   0.4023   9.5875   4.8975   13.456  -4.2333   13.664   14.032   6.1504   12.163   5.6635 1.868870 8.360761 
1 1 1   23    5  -22 o   14.758   5.6977   9.9701   9.7147   15.641   13.840   4.4628   13.639   17.222   6.7574   14.001   6.1626 3.220859 9.145514 
1 1 1   23    5  -21 o   15.612   5.7884   11.922   9.7916   10.661   13.778   13.209   13.918   15.708   6.5283   16.489   6.6735 -0.7816458 9.335697 
1 1 1   23    5  -20 o   24.583   5.5276   30.814   10.807   19.830   13.944   47.336   17.102   18.758   6.9161   28.481   7.3252 -9.722277 10.07428 
1 1 1   23    5  -19 o   16.143   6.0272   12.916   10.652   14.381   13.995   10.899   16.421   16.931   6.7470   16.266   6.9609 0.6651897 9.694151 
1 1 1   23    5  -18 o   11.682   5.2555  -0.5931   10.489  -9.7377   13.657   12.559   16.378   11.321   5.3889   16.706   7.0421 -5.385415 8.867471 
1 1 1   23    5  -17 o   30.197   4.6512   43.316   11.082   31.119   14.173   62.507   17.778   23.350   6.9393   34.059   6.6420 -10.70923 9.605716 
1 1 1   23    5  -16 f   17.470   6.2271   15.892   11.179   18.248   18.666   14.575   13.958   18.428   7.6234   17.081   6.7602 1.346689 10.18907 
1 1 1   23    5  -15 o   17.220   5.9210   15.187   10.050   29.120   14.154   1.0208   14.272   22.592   6.9817   13.580   6.1181 9.011844 9.283049 
1 1 1   23    5  -14 o   12.501   5.3850   3.0163   9.9491   5.2227   14.132   0.8482   14.009   14.518   6.3346   13.473   6.0664 1.044811 8.770901 
1 1 1   23    5  -13 o   16.139   5.8456   12.727   9.8958   19.737   13.769   5.2362   14.233   18.975   6.8920   14.571   6.3574 4.403852 9.376393 
1 1 1   23    5  -12 o   36.314   3.7392   59.171   10.910   70.519   15.111   46.812   15.770   38.437   4.9366   29.409   6.7248 9.027473 8.342273 
1 1 1   23    5  -11 o   26.613   4.9305   34.087   10.302   29.911   14.160   38.784   15.016   23.057   6.9560   26.489   6.8900 -3.432545 9.790668 
1 1 1   23    5  -10 o   14.104   5.6632   7.6329   9.9370   1.6452   13.833   14.017   14.284   13.646   6.0949   17.080   6.8128 -3.433883 9.141264 
1 1 1   23    5   -9 o   30.520   4.3095   43.061   10.423   40.473   14.557   45.785   14.932   27.471   6.5862   29.508   6.3928 -2.037237 9.178568 
1 1 1   23    5   -8 o   35.953   3.7241   57.852   10.756   53.699   15.175   62.045   15.248   32.549   5.9382   35.584   5.4286 -3.034389 8.045571 
1 1 1   23    5   -7 o   29.467   5.0031   41.700   11.588   34.762   17.783   46.821   15.277   23.924   7.8745   29.784   6.4773 -5.859594 10.19624 
1 1 1   23    5   -6 o   13.797   5.9460   4.4380   12.142  -0.5619   16.339   10.605   18.145   14.051   6.4151   16.791   7.2528 -2.739439 9.682749 
1 1 1   23    5   -5 o   11.718   5.3824  -3.4422   11.738   3.7849   16.489 -10.8681   16.714   14.957   6.6691   12.519   5.9598 2.438087 8.944065 
1 1 1   23    5   -4 f   10.153   4.8623 -11.1770   11.476   4.7618   16.312 -26.8000   16.149   15.122   6.6940   10.434   5.1594 4.687791 8.451583 
1 1 1   23    5   -3 o   10.718   5.0063  -6.0957   10.812 -17.1429   14.246   8.9142   16.606   10.663   5.1820   16.134   6.9534 -5.470371 8.671989 
1 1 1   23    5   -2 o   18.285   6.5092   17.462   12.210   7.6769   17.021   27.836   17.526   15.941   6.9539   21.610   7.7859 -5.668717 10.43916 
1 1 1   23    5   -1 o   27.809   4.7913   36.712   10.469   55.110   15.249   20.307   14.400   33.105   5.8653   19.297   7.0423 13.80808 9.164945 
1 1 1   23    5    0 o   14.542   5.9597   7.7207   11.268   17.651   19.039   2.3676   13.979   18.603   7.6978   13.908   6.1746 4.695022 9.868236 
1 1 1   23    5    1 o   13.311   5.7086   3.9773   11.088  -5.7191   18.757   9.1850   13.746   13.973   6.5483   15.600   6.5052 -1.627033 9.230245 
1 1 1   23    5    2 o   14.672   5.9723   8.1484   11.222   14.138   19.109   4.9952   13.865   17.763   7.5523   14.501   6.3016 3.261440 9.836056 
1 1 1   23    5    3 o   27.225   5.4548   36.651   11.683   30.692   19.526   39.974   14.582   22.223   8.1857   27.313   6.6195 -5.089903 10.52731 
1 1 1   23    5    4 f   33.156   4.0789   50.062   10.792   63.133   15.609   38.093   14.937   35.830   5.5214   26.340   6.8821 9.490068 8.823218 
1 1 1   23    5    5 o   24.914   5.1808   30.330   10.178   25.712   14.651   34.638   14.150   21.295   7.1515   25.188   6.7536 -3.892973 9.836441 
1 1 1   23    5    6 o   20.095   5.8821   20.885   10.248   14.989   14.771   26.357   14.230   17.480   6.9426   21.633   7.0394 -4.152596 9.887042 
1 1 1   23    5    7 o   14.428   5.7161   8.3979   9.9892   18.523   14.341  -1.1441   13.922   18.624   6.9854   13.102   5.9583 5.522283 9.181295 
1 1 1   23    5    8 o   9.7970   4.6344  -7.8692   9.7947 -14.4873   14.081  -1.6651   13.633   10.922   5.2701   12.880   5.8724 -1.957669 7.890388 
1 1 1   23    5    9 o   15.094   6.0350   9.4620   11.235   15.759   14.262  -0.8354   18.238   17.657   6.8794   14.548   6.6921 3.108843 9.597408 
1 1 1   23    5   10 o   12.963   5.6530   2.6874   11.241  -1.1741   14.231   9.0947   18.331   13.186   6.0072   16.442   7.1936 -3.256893 9.371970 
1 1 1   23    5   11 o   12.361   5.5225   0.2227   11.364   8.4587   14.399 -13.3772   18.503   15.472   6.5663   12.785   6.1361 2.687731 8.987111 
1 1 1   23    5   12 o   16.765   6.2790   13.917   11.579   24.845   14.730  -3.7541   18.731   20.830   7.1681   14.175   6.6105 6.655311 9.750911 
1 1 1   23    5   13 o   30.773   4.3987   44.109   10.720   46.069   15.666   42.383   14.702   29.126   6.7333   28.103   6.5408 1.022913 9.387225 
1 1 1   23    5   14 o   15.446   6.2152   10.254   11.995   32.270   17.565  -8.9848   16.420   22.876   7.8292   12.596   5.9707 10.28010 9.846105 
1 1 1   23    5   15 o   11.005   5.0948  -4.3947   10.818   3.5769   17.560  -9.2717   13.735   15.044   6.7810   11.471   5.4444 3.572476 8.696180 
1 1 1   23    5   16 f   14.084   5.8230   7.0760   10.882   11.288   17.597   4.4679   13.847   16.640   7.1647   14.207   6.2328 2.432751 9.496396 
1 1 1   23    5   17 o   24.449   5.7587   30.827   11.286   20.675   18.515   36.830   14.238   19.013   7.6963   25.789   6.7096 -6.776001 10.21038 
1 1 1   23    5   18 o   28.486   5.0931   39.725   11.392   42.597   18.676   38.023   14.377   25.991   8.0178   26.193   6.7058 -0.2017918 10.45237 
1 1 1   23    5   19 o   21.934   5.7312   25.049   10.358   28.875   15.694   22.095   13.788   21.876   7.4018   19.667   6.9249 2.208933 10.13611 
1 1 1   23    5   20 o   27.152   4.9264   35.893   10.502   23.789   15.259   46.787   14.476   20.045   7.2591   29.765   6.1692 -9.720604 9.526441 
1 1 1   23    5   21 o   14.402   5.8674   8.3487   10.842   23.635   14.696  -9.9106   16.061   20.028   7.1397   12.199   5.8174 7.829198 9.209601 
1 1 1   23    5   22 o   22.303   5.9057   26.431   10.905   31.104   14.979   21.163   15.905   22.808   7.2028   18.992   7.3013 3.816610 10.25616 
1 1 1   23    5   23 o   17.874   6.1291   17.198   10.766   13.229   14.922   21.507   15.549   16.531   6.8251   19.087   7.2481 -2.556465 9.955812 
1 1 1   23    5   24 o   20.964   6.1011   23.972   11.053   9.7459   14.993   40.906   16.358   15.564   6.6556   26.049   7.3731 -10.48520 9.932801 
1 1 1   23    5   25 o   9.6854   4.6500 -10.3623   10.644 -22.3834   14.419   4.0306   15.777   9.9474   4.9106   14.395   6.4633 -4.447581 8.117124 
1 1 1   23    5   26 o   11.094   5.0920  -2.5730   10.480  -7.8693   14.441   3.3194   15.232   11.799   5.5948   14.084   6.3349 -2.285363 8.451777 
1 1 1   23    5   27 o   17.190   6.3887   16.012   11.941   24.783   17.463   8.3091   16.365   19.761   7.6364   15.391   6.7632 4.370282 10.20078 
1 1 1   23    5   28 o   24.802   5.9991   33.087   11.995   37.107   17.554   29.567   16.428   23.831   7.8227   21.490   7.5595 2.340736 10.87845 
1 1 1   23    5   29 o   13.717   6.0749   4.1389   13.449   8.7771   23.987   2.0121   16.243   16.545   7.6339   14.025   6.4004 2.520041 9.962018 
1 1 1   23    5   30 o   10.299   4.9211  -9.3168   11.611 -24.8888   17.512   2.8990   15.510   10.871   5.3750   13.984   6.3315 -3.112714 8.305337 
1 1 1   23    5   31 o   14.760   6.1191   9.3247   12.061   19.209   18.050   1.3511   16.212   18.017   7.4789   13.855   6.3496 4.162598 9.810784 
1 1 1   23    5   32 o   35.481   4.4939   60.263   12.706   26.124   17.547   97.898   18.424   19.957   7.6698   44.220   5.2111 -24.26292 9.272635 
1 1 1   23    5   33 o   19.959   6.4455   22.938   11.943   21.277   17.047   24.539   16.737   18.555   7.4288   19.563   7.4978 -1.008402 10.55477 
1 1 1   23    5   34 f   23.014   6.3312   29.905   12.248   30.991   17.429   28.845   17.215   21.475   7.7606   20.818   7.6831 0.6569118 10.92049 
1 1 1   23    5   35 o   12.073   5.4767  -0.0572   11.670   14.963   17.077 -13.2197   15.986   16.823   7.1455   11.517   5.5714 5.305567 9.060858 
1 1 1   23    5   36 f   17.888   6.4308   18.294   11.949   12.575   17.521   23.268   16.338   16.266   7.0760   19.107   7.3856 -2.840452 10.22824 
1 1 1   23    5   37 o   16.226   6.6855   13.705   14.278   22.378   25.953   9.9409   17.098   18.425   8.2798   15.602   6.8823 2.823734 10.76669 
1 1 1   23    5   38 o   16.931   7.1137   15.981   16.626   9.6355   25.510   20.667   21.922   16.497   7.7005   18.065   7.8858 -1.567457 11.02192 
1 1 1   23    5   39 o   16.324   7.0026   13.681   16.693   9.6615   25.970   16.511   21.790   16.492   7.7214   17.222   7.6738 -0.7301559 10.88606 
1 1 1   23    5   40 o   12.267   5.8882  -9.3178   17.047  -2.4660   25.209 -15.0907   23.139   14.931   7.1652   13.261   6.4797 1.669794 9.660606 
1 1 1   23    5   41 o   16.823   7.7994   13.240   25.486   13.240   25.486   0.0000   0.0000   16.823   7.7994  ?   ?  0.000000 7.799435 
1 1 1   23    5   42 o   11.585   5.6581 -16.2230   17.582 -51.3485   25.706   14.655   24.102   11.339   5.7317   16.895   7.7428 -5.556747 9.633473 
1 1 1   23    5   43 o   11.944   5.7878 -12.5460   17.438  -8.5829   25.847 -15.8567   23.623   14.345   6.9731   13.238   6.4848 1.107149 9.522418 
1 1 1   23    5   44 o   19.722   7.7264   27.442   18.071   50.613   27.607   10.069   23.904   23.009   9.3668   16.163   7.5141 6.845633 12.00831 
1 1 1   23    5   45 f   12.291   5.9360 -10.6719   17.967  -3.9624   26.714 -16.2139   24.279   14.859   7.1913   13.300   6.5274 1.558565 9.711945 
1 1 1   23    5   46 o   15.818   7.0401   11.737   18.287   32.213   26.598  -6.6187   25.183   19.502   8.5940   14.327   6.9456 5.174533 11.04982 
1 1 1   23    5   47 o   16.378   7.1619   14.660   18.152   24.398   26.695   6.2850   24.755   18.186   8.2629   15.640   7.3893 2.546184 11.08495 
1 1 1   23    5   48 o   16.650   7.2032   16.162   17.953   8.2647   26.067   23.287   24.762   15.956   7.5517   17.993   8.0862 -2.036177 11.06415 
1 1 1   23    5   49 o   16.844   7.2441   17.209   17.950   11.886   26.500   21.723   24.400   16.373   7.7077   17.686   7.9809 -1.313374 11.09520 
1 1 1   23    5   50 o   23.372   7.8884   39.504   17.825   37.430   26.138   41.307   24.371   20.223   8.7200   21.414   8.7691 -1.190723 12.36674 
1 1 1   23    5   51 o   12.042   5.8164 -10.0482   17.262 -10.3180   24.847  -9.7965   23.998   13.766   6.7237   13.657   6.6569 0.1082659 9.461638 
1 1 1   23    5   52 o   14.353   6.5808   5.5226   17.438   9.2446   25.186   2.0955   24.168   15.844   7.4759   14.889   7.1102 0.9549999 10.31718 
1 1 1   23    5   53 f   16.294   7.0511   15.510   17.213   20.081   25.705   11.794   23.175   17.232   7.9335   15.964   7.4137 1.268222 10.85832 
1 1 1   23    5   54 o   11.568   5.6324 -12.9909   17.048   4.9928   24.466 -29.9636   23.769   15.164   7.2169   11.907   5.9482 3.257040 9.352263 
1 1 1   23    5   55 o   19.463   7.6250   28.162   17.600   41.314   26.075   17.156   23.852   20.605   8.7933   16.675   7.6643 3.929630 11.66467 
1 1 1   23    5   56 o   14.848   6.6702   9.4525   16.829   16.709   24.601   3.0699   23.072   16.564   7.6737   14.680   6.9927 1.883896 10.38193 
1 1 1   23    5   57 o   16.777   7.1641   18.212   17.325   55.134   25.628 -12.8638   23.512   23.669   9.2220   13.113   6.4330 10.55644 11.24407 
1 1 1   23    5   58 o   12.682   6.0082  -2.9117   16.584   7.4255   24.270 -11.9659   22.713   15.334   7.2658   13.038   6.3811 2.295583 9.670052 
1 1 1   23    5   59 o   16.091   7.0131   15.217   17.279   19.500   25.378   11.515   23.593   16.960   7.8349   15.799   7.3846 1.161476 10.76653 
1 1 1   23    5   60 o   16.766   7.1807   17.983   17.500   23.372   26.019   13.532   23.648   17.559   8.0461   16.125   7.4886 1.433697 10.99179 
1 1 1   23    6  -51 o   13.771   6.5485   0.0402   20.058   0.0000   0.0000   0.0402   20.058  ?   ?    13.771   6.5485 0.000000 6.548453 
1 1 1   23    6  -50 o   10.370   5.1235 -19.7546   15.812   0.0000   0.0000 -19.7546   15.812  ?   ?    10.370   5.1235 0.000000 5.123513 
1 1 1   23    6  -49 f   18.393   7.3712   24.546   16.801   0.0000   0.0000   24.546   16.801  ?   ?    18.393   7.3712 0.000000 7.371199 
1 1 1   23    6  -48 o   12.286   5.6785   0.2487   13.356   58.916   25.851 -21.1132   15.599   24.331   9.3198   10.166   5.0344 14.16505 10.59263 
1 1 1   23    6  -47 o   17.478   6.7175   19.637   13.461   47.375   24.819   8.0770   16.022   22.091   8.9220   14.440   6.4958 7.651236 11.03614 
1 1 1   23    6  -46 o   15.426   6.4580   13.086   13.627   8.5224   24.562   15.116   16.380   15.498   7.3335   16.051   6.9118 -0.5530195 10.07732 
1 1 1   23    6  -45 o   18.034   7.3212   22.733   16.810   0.0000   0.0000   22.733   16.810  ?   ?    18.034   7.3212 0.000000 7.321221 
1 1 1   23    6  -44 o   11.932   5.7364  -8.1365   16.323   0.0000   0.0000  -8.1365   16.323  ?   ?    11.932   5.7364 0.000000 5.736443 
1 1 1   23    6  -43 o   16.407   7.0407   16.094   16.885   0.0000   0.0000   16.094   16.885  ?   ?    16.407   7.0407 0.000000 7.040701 
1 1 1   23    6  -42 o   17.150   6.7796   18.371   14.024   11.079   24.168   22.073   17.220   15.947   7.4604   17.931   7.3600 -1.983541 10.47987 
1 1 1   23    6  -41 o   11.699   5.5258  -4.5781   13.830   9.2358   23.792 -11.6271   16.996   15.699   7.3629   11.746   5.6970 3.952763 9.309599 
1 1 1   23    6  -40 f   9.8429   4.8453 -18.0184   13.706  -8.6442   23.997 -22.5570   16.697   13.746   6.6902   10.516   5.2079 3.229915 8.478332 
1 1 1   23    6  -39 o   16.432   6.6840   15.855   14.044   9.4003   23.609   19.390   17.471   15.766   7.3751   17.311   7.2838 -1.544628 10.36559 
1 1 1   23    6  -38 o   22.182   7.0835   31.921   14.453   58.645   25.470   19.230   17.552   25.321   9.3452   17.310   7.2932 8.010796 11.85427 
1 1 1   23    6  -37 o   12.833   5.8733   1.3652   13.806 -24.5293   23.186   15.590   17.185   12.279   6.0911   16.471   7.0860 -4.192105 9.344145 
1 1 1   23    6  -36 o   15.519   6.5652   12.339   14.318   24.134   25.302   6.7831   17.366   18.118   8.1558   14.677   6.6669 3.441221 10.53394 
1 1 1   23    6  -35 o   19.937   7.0394   25.796   14.256   53.208   24.522   11.803   17.521   24.541   9.1486   15.708   6.9463 8.832487 11.48686 
1 1 1   23    6  -34 o   13.439   6.0762   3.5374   14.226   11.367   25.186  -0.1311   17.240   16.337   7.6340   13.509   6.3136 2.827972 9.906561 
1 1 1   23    6  -33 o   14.951   6.4409   9.9630   14.237   21.729   24.322   3.8306   17.559   17.870   8.0241   14.252   6.5597 3.618518 10.36420 
1 1 1   23    6  -32 o   23.204   7.0799   34.085   14.613   23.135   24.284   40.301   18.295   18.134   8.0890   23.718   7.9919 -5.584406 11.37111 
1 1 1   23    6  -31 o   16.860   6.9374   16.674   15.347   44.240   25.250   0.5264   19.326   22.225   8.9909   14.109   6.6231 8.116192 11.16698 
1 1 1   23    6  -30 o   12.492   5.9974  -8.5153   17.705  -0.4737   24.218 -17.7492   25.951   14.864   7.1035   13.531   6.6621 1.333272 9.738738 
1 1 1   23    6  -29 o   16.375   7.1566   14.095   18.103   23.845   24.805   2.9828   26.480   18.329   8.1759   15.590   7.4442 2.739265 11.05718 
1 1 1   23    6  -28 o   18.052   6.9842   20.206   14.621   47.358   25.859   7.4470   17.726   22.924   9.1592   15.017   6.7870 7.906924 11.39973 
1 1 1   23    6  -27 o   13.982   6.1899   5.8263   13.950   2.7370   24.326   7.3399   17.028   15.341   7.2706   14.907   6.7019 0.4341707 9.888245 
1 1 1   23    6  -26 o   13.032   5.7946   3.4829   12.359  -2.2044   25.076   5.3079   14.205   14.922   7.1571   13.942   6.2050 0.9800625 9.472365 
1 1 1   23    6  -25 o   15.211   6.2788   11.136   12.624   24.794   25.162   6.5417   14.594   18.658   8.2837   14.327   6.3375 4.330702 10.42994 
1 1 1   23    6  -24 o   19.612   6.6727   23.152   12.756   10.412   25.726   27.306   14.689   16.563   7.7318   20.705   7.1567 -4.142143 10.53559 
1 1 1   23    6  -23 o   12.219   5.5941  -0.5650   12.539   12.024   26.581  -4.1687   14.221   16.876   7.8718   12.134   5.6915 4.742230 9.713816 
1 1 1   23    6  -22 o   18.452   6.2960   19.539   11.358   17.064   18.105   21.145   14.584   17.254   7.3442   18.548   7.0251 -1.293936 10.16316 
1 1 1   23    6  -21 o   13.371   5.7552   5.5965   11.347   33.017   18.597 -10.6667   14.322   21.631   7.9851   11.192   5.3788 10.43898 9.627685 
1 1 1   23    6  -20 o   16.070   6.2024   13.656   11.510  -9.7287   18.205   29.230   14.856   12.643   6.0729   21.513   7.2012 -8.870173 9.420040 
1 1 1   23    6  -19 o   15.297   6.0836   11.537   11.357   9.4297   18.493   12.812   14.390   15.715   7.0311   15.998   6.6623 -0.2835131 9.686222 
1 1 1   23    6  -18 f   17.672   6.2722   17.591   11.330   16.207   17.742   18.544   14.723   17.118   7.2776   17.749   6.9679 -0.6309376 10.07546 
1 1 1   23    6  -17 o   14.707   5.7287   10.359   9.8878   12.517   13.457   7.8274   14.577   15.849   6.5061   14.747   6.4341 1.101860 9.150244 
1 1 1   23    6  -16 o   14.687   5.7271   10.290   9.8906  -6.0444   13.650   28.346   14.351   11.670   5.5055   21.409   7.0753 -9.738772 8.964949 
1 1 1   23    6  -15 o   16.892   6.2096   15.628   11.227  -5.5722   18.337   28.341   14.200   13.267   6.2949   21.469   7.0350 -8.202244 9.440174 
1 1 1   23    6  -14 o   12.214   5.3000   3.2353   9.7793   6.1514   13.488   0.0031   14.200   14.122   6.1747   12.964   5.9420 1.158125 8.569378 
1 1 1   23    6  -13 o   20.325   5.7692   22.371   10.001   14.523   13.816   31.012   14.496   16.525   6.6629   22.472   7.0843 -5.946619 9.725283 
1 1 1   23    6  -12 o   12.687   5.5116   3.8190   10.601   3.6953   15.908   3.9177   14.218   14.174   6.4155   13.795   6.1691 0.3788433 8.900336 
1 1 1   23    6  -11 o   10.900   5.0332  -3.0669   10.458  -7.0937   15.650   0.1825   14.058   12.250   5.8134   12.972   5.9329 -0.7214832 8.306333 
1 1 1   23    6  -10 o   35.633   4.6180   61.333   13.098   33.520   18.108   91.855   18.970   22.145   7.9219   42.109   5.6705 -19.96429 9.742216 
1 1 1   23    6   -9 o   18.847   6.3804   20.271   11.661   34.798   19.061   11.581   14.742   22.284   8.1069   15.788   6.6696 6.495951 10.49792 
1 1 1   23    6   -8 o   13.178   5.7112   4.6581   11.327   5.9089   18.071   3.8486   14.538   15.087   6.8322   13.889   6.2225 1.198295 9.241190 
1 1 1   23    6   -7 o   15.586   6.1093   12.122   11.302   2.6318   17.991   18.309   14.527   14.495   6.6599   17.790   6.9399 -3.295899 9.618531 
1 1 1   23    6   -6 o   14.051   5.8857   7.5758   11.328   0.4059   18.133   12.165   14.507   14.163   6.5705   15.941   6.6677 -1.778318 9.361086 
1 1 1   23    6   -5 o   12.555   5.3905   4.0934   9.9074  -6.3257   13.595   15.896   14.469   11.643   5.4933   17.036   6.8360 -5.392440 8.769720 
1 1 1   23    6   -4 o   12.835   5.4522   4.9343   9.9438   10.363   13.785  -0.9553   14.358   15.351   6.4652   12.877   5.9286 2.474153 8.771969 
1 1 1   23    6   -3 o   10.712   5.0165  -5.2567   10.976   1.3967   13.684 -17.2582   18.379   13.136   5.9475   11.918   5.8127 1.218456 8.316292 
1 1 1   23    6   -2 o   12.908   5.4704   5.1224   9.9711   8.1696   13.846   1.8394   14.371   14.776   6.3587   13.439   6.0887 1.337386 8.803665 
1 1 1   23    6   -1 o   15.305   5.7913   11.655   9.9056   10.823   13.996   12.490   14.021   15.518   6.5238   15.997   6.6115 -0.4787731 9.288234 
1 1 1   23    6    0 o   11.835   5.2280   1.6372   9.8979   4.9995   14.057  -1.6688   13.939   14.047   6.2163   12.607   5.8179 1.439157 8.514097 
1 1 1   23    6    1 o   17.506   6.1386   16.824   10.827   7.2300   14.118   30.522   16.870   14.596   6.3505   21.576   7.6541 -6.980462 9.945549 
1 1 1   23    6    2 o   21.767   6.4549   27.088   12.274   18.468   17.197   36.039   17.524   17.825   7.3399   23.307   7.8212 -5.482258 10.72596 
1 1 1   23    6    3 o   15.653   6.0427   12.341   10.926   18.848   14.359   3.3921   16.840   17.998   6.9327   14.386   6.5465 3.612413 9.535131 
1 1 1   23    6    4 o   19.928   6.6261   23.204   12.582   28.260   14.059   2.8642   28.199   21.593   6.9949   16.252   7.7383 5.340900 10.43117 
1 1 1   23    6    5 o   12.205   5.4860   0.7865   11.401  -3.6400   14.186   8.8607   19.159   12.325   5.7494   15.836   7.1154 -3.511471 9.147909 
1 1 1   23    6    6 o   10.480   4.9595  -7.1420   11.240  -0.2902   13.957 -19.7822   18.957   12.869   5.8957   11.837   5.8008 1.032529 8.270954 
1 1 1   23    6    7 o   11.980   5.2834   1.9434   10.071   5.9153   14.339  -1.9233   14.147   14.310   6.3080   12.616   5.8357 1.694197 8.593365 
1 1 1   23    6    8 o   9.0939   4.3887 -10.7444   9.7746   6.1711   13.925 -27.1746   13.724   14.268   6.2553   9.1116   4.5468 5.156722 7.733209 
1 1 1   23    6    9 o   19.538   5.8996   20.899   10.183   8.8800   14.283   33.321   14.521   15.011   6.4589   23.469   7.0358 -8.458345 9.550918 
1 1 1   23    6   10 o   12.272   5.4275   2.1657   10.700  -3.1277   14.091   9.3753   16.445   12.361   5.7543   15.487   6.7934 -3.125413 8.902897 
1 1 1   23    6   11 o   22.024   5.6587   25.829   10.213   22.324   14.379   29.397   14.508   19.149   7.0294   21.833   7.1082 -2.683428 9.996940 
1 1 1   23    6   12 o   18.848   5.9219   19.525   10.138   20.272   14.341   18.780   14.332   18.417   6.9684   17.910   6.9189 0.5070400 9.819855 
1 1 1   23    6   13 o   9.6533   4.6272  -9.5047   10.447  -9.8833   13.985  -9.0269   15.712   11.214   5.3696   11.982   5.7250 -0.7681561 7.849073 
1 1 1   23    6   14 o   13.338   5.6692   5.8718   10.762  -8.2998   14.123   25.494   16.619   11.501   5.4762   19.823   7.5012 -8.322533 9.287422 
1 1 1   23    6   15 o   14.320   5.8189   8.9749   10.630   30.467   14.306 -17.5249   15.885   22.302   7.0386   10.969   5.3618 11.33232 8.848162 
1 1 1   23    6   16 o   10.025   4.7619  -7.6392   10.552   1.4056   13.996 -19.5523   16.063   13.174   5.9845   10.812   5.3069 2.362057 7.998595 
1 1 1   23    6   17 o   9.4394   4.5521 -10.8278   10.470 -13.2547   13.917  -7.6636   15.891   10.702   5.1821   12.217   5.8149 -1.515474 7.788942 
1 1 1   23    6   18 f   8.6639   4.2603 -16.3570   10.503  -8.8597   13.947 -26.1780   15.962   11.328   5.4072   10.112   5.0224 1.216242 7.379923 
1 1 1   23    6   19 o   40.833   3.6439   76.014   12.001   78.409   15.921   72.863   18.264   39.672   5.0367   36.351   6.3970 3.320335 8.141886 
1 1 1   23    6   20 o   14.225   5.8361   8.7023   10.820   26.114   14.496 -13.2025   16.259   20.419   7.1067   11.585   5.6076 8.834393 9.052660 
1 1 1   23    6   21 o   11.413   5.2772  -2.7069   11.550 -20.7392   16.506   14.596   16.168   10.823   5.3257   16.586   6.9945 -5.762648 8.791242 
1 1 1   23    6   22 o   13.435   5.8297   5.3979   11.831  -2.1611   16.460   13.478   17.018   13.182   6.1636   16.351   7.0431 -3.169146 9.359282 
1 1 1   23    6   23 o   19.768   6.4714   22.958   12.017   16.262   17.179   29.375   16.817   17.003   7.1919   20.867   7.6112 -3.863968 10.47158 
1 1 1   23    6   24 o   27.592   5.8533   40.968   12.757   38.567   18.009   43.386   18.073   23.582   7.9289   25.300   7.9008 -1.717693 11.19332 
1 1 1   23    6   25 o   11.024   5.1723  -4.9370   11.759 -18.0269   16.817   7.5857   16.449   11.173   5.4730   14.906   6.6528 -3.733094 8.614727 
1 1 1   23    6   26 o   15.955   6.3361   13.569   12.301   35.340   17.856  -6.0977   16.971   22.431   7.8818   12.670   6.0244 9.761330 9.920496 
1 1 1   23    6   27 o   10.894   5.1488  -6.2099   12.042   4.3686   17.582 -15.5566   16.527   14.454   6.6200   11.317   5.5179 3.137623 8.618095 
1 1 1   23    6   28 o   29.699   5.5262   46.323   12.886   61.212   18.502   32.298   17.957   31.555   7.3331   21.294   7.8489 10.26123 10.74152 
1 1 1   23    6   29 o   25.407   6.8056   38.760   14.377   25.813   24.238   45.788   17.858   18.697   8.2229   26.076   7.7991 -7.379230 11.33323 
1 1 1   23    6   30 o   11.122   5.4576 -18.3407   16.948   0.0000   0.0000 -18.3407   16.948  ?   ?    11.122   5.4576 0.000000 5.457583 
1 1 1   23    6   31 o   17.458   7.3089   19.023   17.455   0.0000   0.0000   19.023   17.455  ?   ?    17.458   7.3089 0.000000 7.308915 
1 1 1   23    6   32 o   14.262   6.5413   4.1633   17.248   0.0000   0.0000   4.1633   17.248  ?   ?    14.262   6.5413 0.000000 6.541317 
1 1 1   23    6   33 o   23.368   8.0725   39.917   18.687   0.0000   0.0000   39.917   18.687  ?   ?    23.368   8.0725 0.000000 8.072477 
1 1 1   23    6   34 o   15.342   6.8215   10.118   17.125   0.0000   0.0000   10.118   17.125  ?   ?    15.342   6.8215 0.000000 6.821506 
1 1 1   23    6   35 o   26.884   7.9607   50.022   18.679   0.0000   0.0000   50.022   18.679  ?   ?    26.884   7.9607 0.000000 7.960709 
1 1 1   23    6   36 o   17.227   7.8917   18.337   25.008   0.0000   0.0000   18.337   25.008  ?   ?    17.227   7.8917 0.000000 7.891716 
1 1 1   23    6   37 o   12.298   5.9370  -9.8524   17.924 -32.8517   26.035   10.869   24.712   12.356   6.1803   16.136   7.5473 -3.780414 9.754922 
1 1 1   23    6   38 o   13.718   6.4420   0.1995   18.314  -8.9697   27.134   7.8708   24.819   14.304   6.9950   15.726   7.4203 -1.422025 10.19759 
1 1 1   23    6   39 o   19.200   7.7292   27.114   18.560   16.788   27.031   36.325   25.530   16.934   7.9115   20.074   8.6364 -3.140572 11.71239 
1 1 1   23    6   40 f   14.646   6.7436   6.1286   18.581 -18.7321   27.294   27.605   25.368   13.499   6.6807   18.482   8.2545 -4.983188 10.61930 
1 1 1   23    6   41 o   26.009   8.1866   49.853   19.366   36.184   27.998   62.391   26.815   19.575   8.7117   25.338   9.5416 -5.763344 12.92032 
1 1 1   23    6   42 o   20.075   8.8542   39.777   28.287   39.777   28.287   0.0000   0.0000   20.075   8.8542  ?   ?  0.000000 8.854172 
1 1 1   23    6   43 o   19.312   8.5673   34.203   26.862   34.203   26.862   0.0000   0.0000   19.312   8.5673  ?   ?  0.000000 8.567290 
1 1 1   23    6   44 o   13.945   6.8424 -10.3713   26.626 -10.3713   26.626   0.0000   0.0000   13.945   6.8424  ?   ?  0.000000 6.842370 
1 1 1   23    6   45 o   12.053   6.0332 -31.5509   25.007 -31.5509   25.007   0.0000   0.0000   12.053   6.0332  ?   ?  0.000000 6.033248 
1 1 1   23    6   46 o   10.880   5.3892 -22.0758   17.900 -52.5649   26.194   4.6356   24.518   11.142   5.6495   15.037   7.1754 -3.894723 9.132596 
1 1 1   23    6   47 o   23.190   8.0277   41.330   18.484   36.420   26.817   45.774   25.513   19.417   8.5898   21.498   8.9049 -2.081682 12.37258 
1 1 1   23    6   48 o   15.451   6.9316   12.266   18.106  -8.2388   26.835   29.401   24.531   14.014   6.8748   18.438   8.1831 -4.424125 10.68766 
1 1 1   23    6   49 f   16.517   7.1371   17.511   17.584  -1.0109   25.564   34.140   24.224   14.473   7.0119   19.321   8.3629 -4.847898 10.91351 
1 1 1   23    6   50 o   11.300   5.5524 -16.6623   17.732 -23.5388   25.514 -10.2374   24.662   12.617   6.2805   13.494   6.6138 -0.8774624 9.120669 
1 1 1   23    6   51 o   11.794   5.7330 -11.2958   17.468 -10.0235   26.176 -12.3173   23.453   13.759   6.7578   13.091   6.4231 0.6677446 9.323287 
1 1 1   23    6   52 o   18.923   7.5675   26.932   17.668   12.544   25.745   39.741   24.291   15.977   7.5443   20.472   8.5998 -4.495587 11.44001 
1 1 1   23    6   53 o   13.011   6.4388 -18.1124   25.335   0.0000   0.0000 -18.1124   25.335  ?   ?    13.011   6.4388 0.000000 6.438799 
1 1 1   23    7  -44 o   13.103   6.3885  -9.1303   22.148   0.0000   0.0000  -9.1303   22.148  ?   ?    13.103   6.3885 0.000000 6.388496 
1 1 1   23    7  -43 o   10.969   5.4963 -31.6108   21.017   0.0000   0.0000 -31.6108   21.017  ?   ?    10.969   5.4963 0.000000 5.496334 
1 1 1   23    7  -42 o   19.445   8.2085   33.636   22.304   0.0000   0.0000   33.636   22.304  ?   ?    19.445   8.2085 0.000000 8.208549 
1 1 1   23    7  -41 o   11.268   5.4527  -9.9547   15.340 -40.4121   22.248   17.648   21.179   10.733   5.4141   16.439   7.4251 -5.706053 9.189375 
1 1 1   23    7  -40 f   11.505   5.5588  -9.2149   15.797  -5.7883   22.834 -12.3604   21.878   13.521   6.5686   12.706   6.2278 0.8153715 9.051631 
1 1 1   23    7  -39 o   12.483   5.8655  -1.2136   15.218   7.5820   22.232  -8.9681   20.875   14.969   7.0507   12.822   6.2405 2.146668 9.415787 
1 1 1   23    7  -38 o   20.489   7.6329   31.952   17.064   48.563   24.391   16.027   23.883   22.240   8.8921   16.239   7.5361 6.000460 11.65606 
1 1 1   23    7  -37 o   12.297   5.8718  -4.8837   16.478   8.2947   24.246 -16.1946   22.463   15.295   7.2518   12.520   6.1706 2.775433 9.521811 
1 1 1   23    7  -36 o   12.481   5.7943   0.1901   14.136   17.619   24.514  -8.4932   17.303   16.559   7.6673   12.069   5.8282 4.489608 9.630979 
1 1 1   23    7  -35 o   17.023   7.2787   19.677   17.926 -10.7286   23.970   58.264   27.003   13.336   6.5328   23.606   9.3833 -10.26957 11.43346 
1 1 1   23    7  -34 o   12.462   5.9678  -5.5954   17.288 -12.9214   22.989   3.9404   26.227   12.972   6.3635   15.086   7.2574 -2.113964 9.652143 
1 1 1   23    7  -33 o   26.451   7.9954   50.764   18.695   34.678   24.798   71.945   28.456   19.457   8.4415   26.278   9.8433 -6.820978 12.96724 
1 1 1   23    7  -32 o   21.204   7.1587   30.513   14.680   23.618   24.602   34.325   18.293   17.612   7.9743   21.068   7.8919 -3.455080 11.21925 
1 1 1   23    7  -31 o   15.317   6.5742   12.334   14.728   14.467   24.832   11.177   18.292   16.311   7.6082   15.366   6.9240 0.9454546 10.28720 
1 1 1   23    7  -30 o   10.168   4.9845 -15.8965   14.026 -30.2749   23.686  -8.1310   17.407   11.845   5.9205   12.230   5.8908 -0.3845510 8.351862 
1 1 1   23    7  -29 o   16.920   6.8629   18.028   14.756   34.037   25.849   10.289   17.973   19.334   8.4978   15.199   6.8549 4.134426 10.91801 
1 1 1   23    7  -28 o   14.640   6.4169   9.4370   14.648  -4.7140   24.790   17.029   18.157   14.172   6.8754   16.602   7.2129 -2.429830 9.964796 
1 1 1   23    7  -27 o   14.964   6.5080   10.654   14.814   46.474   25.128  -8.4265   18.339   22.074   8.9547   12.473   6.0176 9.600197 10.78884 
1 1 1   23    7  -26 o   17.098   6.9221   18.495   14.980   48.394   24.905   1.5475   18.750   22.645   9.0081   13.905   6.5262 8.739908 11.12376 
1 1 1   23    7  -25 o   13.776   6.2197   5.1897   14.841   31.378   24.562  -9.8696   18.626   19.159   8.3555   12.405   6.0042 6.753097 10.28903 
1 1 1   23    7  -24 f   12.131   5.5936  -0.3980   12.851 -13.7959   25.449   4.1876   14.889   13.540   6.6526   13.599   6.1756 -0.5961418E-01 9.077181 
1 1 1   23    7  -23 o   20.646   6.8170   27.151   13.323   25.843   26.274   27.604   15.458   18.163   8.2303   20.057   7.3002 -1.894842 11.00141 
1 1 1   23    7  -22 o   14.143   6.1197   8.1290   12.964 -23.6088   25.333   19.389   15.090   12.782   6.3452   17.448   6.9881 -4.666146 9.439034 
1 1 1   23    7  -21 o   17.620   6.6615   19.192   13.099   18.769   26.534   19.329   15.063   17.194   7.9670   17.449   6.9841 -0.2543125 10.59480 
1 1 1   23    7  -20 o   11.254   5.3098  -5.0239   12.703 -18.8309   25.063  -0.2503   14.737   13.111   6.4728   12.764   5.9223 0.3469372 8.773335 
1 1 1   23    7  -19 o   9.9223   4.8263 -13.0721   12.433  -3.5025   24.643 -16.3399   14.400   14.426   6.9635   10.335   5.0630 4.090586 8.609535 
1 1 1   23    7  -18 o   19.578   6.7290   24.069   12.979   3.6845   25.168   31.454   15.149   15.289   7.2886   21.699   7.2720 -6.409576 10.29589 
1 1 1   23    7  -17 o   26.061   7.1146   42.708   15.534   0.0000   0.0000   42.708   15.534  ?   ?    26.061   7.1146 0.000000 7.114554 
1 1 1   23    7  -16 o   21.567   7.3002   31.141   15.266   0.0000   0.0000   31.141   15.266  ?   ?    21.567   7.3002 0.000000 7.300207 
1 1 1   23    7  -15 o   24.082   7.1569   37.143   15.076   0.0000   0.0000   37.143   15.076  ?   ?    24.082   7.1569 0.000000 7.156949 
1 1 1   23    7  -14 o   13.146   5.8456   4.2332   12.580 -25.4733   25.482   13.807   14.466   12.759   6.3388   15.942   6.6624 -3.182391 9.196118 
1 1 1   23    7  -13 o   13.133   5.8274   4.3311   12.434  -7.7044   24.892   8.3322   14.352   14.119   6.8588   14.516   6.3575 -0.3963346 9.352091 
1 1 1   23    7  -12 o   14.307   6.1374   8.5251   12.822  -7.6985   25.640   13.935   14.806   14.252   6.9321   16.003   6.7178 -1.750946 9.653162 
1 1 1   23    7  -11 o   18.198   6.2074   19.405   11.040   12.555   16.909   24.494   14.575   15.816   6.9144   19.368   7.0825 -3.552583 9.897998 
1 1 1   23    7  -10 o   9.2959   4.4670  -9.1509   9.8731  -5.8961   13.540 -12.8459   14.427   11.465   5.4310   10.801   5.2411 0.6638794 7.547534 
1 1 1   23    7   -9 o   11.401   5.2089  -0.7152   10.798   7.8332   14.163 -12.5835   16.688   14.376   6.3053   11.630   5.6418 2.745607 8.460837 
1 1 1   23    7   -8 o   12.212   5.3541   3.3422   10.203   3.7101   14.229   2.9527   14.639   13.465   6.0836   13.411   6.1033 0.5390549E-01 8.617469 
1 1 1   23    7   -7 o   10.973   5.0237  -1.3353   10.111   13.498   14.071 -17.1725   14.539   15.860   6.5950   10.331   5.0664 5.528555 8.316347 
1 1 1   23    7   -6 o   17.118   5.9530   16.578   10.170   21.051   14.058   11.666   14.731   18.271   6.9025   15.419   6.5956 2.851982 9.547073 
1 1 1   23    7   -5 o   11.863   5.2442   2.3577   9.9779  -3.8590   13.919   8.9287   14.310   11.948   5.6126   14.681   6.3905 -2.732584 8.505271 
1 1 1   23    7   -4 o   20.687   5.9495   24.224   10.568   47.324   14.771  -0.0061   15.127   28.658   6.4760   12.993   6.0187 15.66425 8.840986 
1 1 1   23    7   -3 o   16.240   5.9679   14.622   10.368   24.620   14.433   3.9603   14.904   19.490   7.0597   13.694   6.2027 5.796523 9.397482 
1 1 1   23    7   -2 o   13.539   5.7976   6.7221   11.405   30.554   14.333 -34.4027   18.828   21.836   7.0619   10.346   5.1866 11.49031 8.761905 
1 1 1   23    7   -1 o   15.599   6.1411   13.017   11.464   8.7101   14.191   21.107   19.450   14.617   6.3632   17.836   7.6027 -3.219682 9.914200 
1 1 1   23    7    0 o   12.138   5.4553   1.6033   11.272   3.0728   13.937  -1.1752   19.164   13.275   6.0070   13.797   6.5134 -0.5224447 8.860485 
1 1 1   23    7    1 o   10.757   5.0465  -4.6490   11.191  -7.7629   13.677   1.6573   19.464   11.238   5.3617   14.263   6.6799 -3.025090 8.565558 
1 1 1   23    7    2 o   13.114   5.5301   6.3672   10.107   1.0253   14.208   11.839   14.379   12.933   5.9335   15.443   6.5581 -2.510160 8.843903 
1 1 1   23    7    3 o   13.468   5.6133   7.3610   10.227   4.2263   14.393   10.558   14.534   13.629   6.1416   15.125   6.5119 -1.496097 8.951202 
1 1 1   23    7    4 o   12.268   5.4167   3.0088   10.615   6.0597   14.093  -0.9911   16.137   13.963   6.1994   13.097   6.1170 0.8659763 8.709166 
1 1 1   23    7    5 o   9.9149   4.7798 -10.4431   11.518  -4.3884   16.311 -16.4657   16.268   12.612   5.9705   11.055   5.4082 1.557917 8.055734 
1 1 1   23    7    6 o   14.240   6.0167   8.7319   12.001   18.383   14.477 -12.4704   21.457   17.336   6.8771   12.972   6.3165 4.363911 9.337654 
1 1 1   23    7    7 o   9.8474   4.7145  -8.6103   10.773   4.6705   14.076 -27.3847   16.736   13.638   6.1156   10.165   5.0641 3.473361 7.940111 
1 1 1   23    7    8 o   11.860   5.4305  -0.4121   11.821   11.555   14.069 -29.1585   21.804   15.314   6.4945   11.611   5.7840 3.703282 8.696765 
1 1 1   23    7    9 o   13.749   5.9399   6.9191   12.174   10.754   14.406  -2.6625   22.770   15.138   6.4996   14.287   6.8438 0.8505259 9.438410 
1 1 1   23    7   10 o   12.490   5.6314   1.9785   12.119  -1.9917   14.301   12.093   22.826   12.383   5.7754   16.228   7.4729 -3.844512 9.444524 
1 1 1   23    7   11 o   18.784   6.2645   20.834   11.244   28.938   14.713   9.4540   17.435   20.989   7.1658   15.222   6.8176 5.767314 9.890773 
1 1 1   23    7   12 o   45.038   3.4011   92.037   12.394   84.164   16.040  103.703   19.525   40.933   4.9048   44.414   5.5111 -3.481113 7.377638 
1 1 1   23    7   13 o   19.710   6.2494   22.884   11.266   11.271   14.673   39.564   17.585   15.286   6.5616   23.669   7.8322 -8.382668 10.21755 
1 1 1   23    7   14 o   27.758   5.3403   40.342   11.645   33.266   15.160   50.526   18.187   22.478   7.2621   27.390   7.7817 -4.912754 10.64391 
1 1 1   23    7   15 o   17.660   6.4822   18.741   12.227   10.998   17.600   25.965   16.999   15.527   6.9089   19.293   7.5124 -3.765938 10.20634 
1 1 1   23    7   16 o   9.5093   4.6401 -13.9241   11.748 -20.1884   16.673  -7.7475   16.556   10.780   5.3137   12.174   5.8326 -1.393828 7.890123 
1 1 1   23    7   17 o   13.716   6.4142   0.7049   17.835   0.7049   17.835   0.0000   0.0000   13.716   6.4142  ?   ?  0.000000 6.414209 
1 1 1   23    7   18 o   21.911   6.5599   29.130   12.629   31.675   18.191   26.761   17.548   20.682   7.8430   19.366   7.6058 1.316122 10.92523 
1 1 1   23    7   19 o   13.565   5.9429   6.1210   12.548   10.744   17.964   1.7164   17.536   15.460   6.9226   13.789   6.4188 1.671799 9.440501 
1 1 1   23    7   20 o   9.8006   4.7756 -13.5935   12.324   11.909   17.635 -37.9383   17.230   15.649   6.9420   9.5065   4.7917 6.142243 8.435123 
1 1 1   23    7   21 o   20.308   6.6635   25.714   12.738   5.1925   17.972   46.432   18.057   14.424   6.6380   25.747   7.8730 -11.32354 10.29789 
1 1 1   23    7   22 o   19.258   7.3074   25.461   15.797 -13.1625   28.967   41.810   18.846   14.207   7.0034   23.603   8.1086 -9.395646 10.71432 
1 1 1   23    7   23 o   35.283   5.7901   67.578   16.076  105.515   29.694   51.850   19.120   35.434   9.9002   26.968   8.0709 8.466221 12.77316 
1 1 1   23    7   24 f   15.845   6.6810   13.897   14.749 -20.9970   26.624   29.346   17.716   13.200   6.5441   19.958   7.6970 -6.757910 10.10290 
1 1 1   23    7   25 o   23.589   7.2692   36.921   15.356   50.964   28.876   31.383   18.133   21.947   9.3056   20.421   7.8098 1.525120 12.14853 
1 1 1   23    7   26 o   11.067   5.3378 -10.0854   14.411   7.7128   26.557 -17.5138   17.157   15.714   7.4899   11.133   5.4686 4.580654 9.273847 
1 1 1   23    7   27 o   17.428   6.9368   19.589   14.776   36.278   28.152   13.243   17.359   19.461   8.6933   15.772   6.9471 3.688148 11.12809 
1 1 1   23    7   28 o   16.139   7.0410   14.988   17.456   0.0000   0.0000   14.988   17.456  ?   ?    16.139   7.0410 0.000000 7.041020 
1 1 1   23    7   29 o   24.223   7.2366   38.795   15.382   72.227   28.669   25.282   18.227   26.487   9.8884   18.565   7.5909 7.922255 12.46603 
1 1 1   23    7   30 o   16.203   7.1348   15.319   18.298 -29.1320   27.322   51.469   24.639   12.698   6.3486   23.351   9.0579 -10.65265 11.06120 
1 1 1   23    7   31 o   12.577   6.0412  -6.5665   18.020 -34.8231   26.076   19.263   24.931   12.084   6.0645   16.978   7.8153 -4.894159 9.892264 
1 1 1   23    7   32 o   9.3131   4.7057 -39.7401   17.209 -19.5194   26.440 -54.6010   22.667   13.151   6.5203   10.165   5.1646 2.985908 8.317914 
1 1 1   23    7   33 o   12.682   6.0560  -4.5565   17.533 -26.3447   26.465   12.489   23.407   12.661   6.3173   15.904   7.4078 -3.243450 9.735692 
1 1 1   23    7   34 o   12.798   6.1217  -4.5111   18.075 -17.1548   26.805   6.0330   24.478   13.337   6.6039   15.138   7.2085 -1.801383 9.776182 
1 1 1   23    7   35 o   9.8144   4.9251 -31.9233   17.185 -29.2404   26.213 -33.9456   22.758   12.384   6.1955   11.307   5.6732 1.077221 8.400599 
1 1 1   23    7   36 o   13.402   6.3043   0.7222   17.669   16.464   26.316 -12.1986   23.842   16.443   7.7220   13.164   6.4621 3.279430 10.06916 
1 1 1   23    7   37 o   8.9917   4.5536 -41.2990   16.691 -30.6347   25.851 -48.9220   21.856   12.187   6.1049   10.174   5.1586 2.012918 7.992614 
1 1 1   23    7   38 o   12.465   5.9801  -5.5035   17.533   21.432   26.186 -27.3925   23.605   16.992   7.8874   11.895   5.9398 5.097240 9.873801 
1 1 1   23    7   39 o   10.169   5.0782 -27.1194   17.251 -37.7357   25.528 -18.1966   23.404   11.667   5.8744   12.520   6.1945 -0.8536959 8.536989 
1 1 1   23    7   40 f   17.499   7.3844   22.210   18.040  -0.1031   26.628   41.140   24.526   14.603   7.0938   20.508   8.6296 -5.904708 11.17102 
1 1 1   23    7   41 o   20.001   7.7481   31.456   18.010   8.8835   26.500   50.832   24.551   15.489   7.4099   22.707   8.9722 -7.217346 11.63652 
1 1 1   23    7   42 o   11.072   5.4493 -17.2240   17.303 -30.7474   25.501  -5.6843   23.556   12.081   6.0535   13.654   6.6419 -1.573459 8.986611 
1 1 1   23    7   43 o   16.666   7.2157   18.543   18.044 -30.3227   26.840   58.839   24.373   12.385   6.2067   24.927   9.1517 -12.54194 11.05789 
1 1 1   23    7   44 o   14.486   6.9704   1.1318   24.224   0.0000   0.0000   1.1318   24.224  ?   ?    14.486   6.9704 0.000000 6.970377 
1 1 1   23    8  -32 o   12.243   6.0776 -21.0005   23.244   0.0000   0.0000 -21.0005   23.244  ?   ?    12.243   6.0776 0.000000 6.077637 
1 1 1   23    8  -31 o   19.172   8.4387   36.058   25.574   0.0000   0.0000   36.058   25.574  ?   ?    19.172   8.4387 0.000000 8.438700 
1 1 1   23    8  -30 o   18.284   8.1965   30.790   25.265   0.0000   0.0000   30.790   25.265  ?   ?    18.284   8.1965 0.000000 8.196525 
1 1 1   23    8  -29 o   14.217   6.6385   5.5285   18.985   0.0000   0.0000   5.5285   18.985  ?   ?    14.217   6.6385 0.000000 6.638538 
1 1 1   23    8  -28 o   14.280   6.3559   8.9100   14.906   4.1385   24.000   11.907   19.019   14.649   7.0197   15.260   6.9494 -0.6112223 9.877787 
1 1 1   23    8  -27 o   15.052   6.5218   12.279   14.762  -0.3216   24.453   19.505   18.517   14.233   6.8864   16.735   7.2773 -2.502872 10.01906 
1 1 1   23    8  -26 o   10.127   4.9632 -14.7829   13.879 -22.7250   22.360  -9.8051   17.702   11.885   5.9102   11.926   5.7913 -0.4090023E-01 8.274601 
1 1 1   23    8  -25 o   12.039   5.6526  -1.7190   14.090   8.8017   23.308  -7.7774   17.687   15.125   7.1532   12.157   5.8760 2.968243 9.257172 
1 1 1   23    8  -24 f   13.040   5.9902   3.2135   14.543   38.250   25.163 -14.3597   17.821   19.585   8.5001   11.462   5.6187 8.122334 10.18930 
1 1 1   23    8  -23 o   18.347   7.0593   23.738   14.877   32.437   27.014   19.952   17.824   18.353   8.3280   16.880   7.2386 1.472145 11.03411 
1 1 1   23    8  -22 f   11.144   5.4902 -17.4368   17.713   0.0000   0.0000 -17.4368   17.713  ?   ?    11.144   5.4902 0.000000 5.490217 
1 1 1   23    8  -21 o   13.235   6.2644  -0.2310   17.946   0.0000   0.0000  -0.2310   17.946  ?   ?    13.235   6.2644 0.000000 6.264352 
1 1 1   23    8  -20 o   12.221   5.9071  -8.0028   17.875   0.0000   0.0000  -8.0028   17.875  ?   ?    12.221   5.9071 0.000000 5.907091 
1 1 1   23    8  -19 o   15.401   6.6131   13.373   14.914   7.8487   24.804   16.501   18.666   15.229   7.2532   16.194   7.1651 -0.9648886 10.19549 
1 1 1   23    8  -18 o   15.490   6.3484   13.851   12.786   21.276   25.408   11.333   14.796   16.972   7.8401   14.901   6.4920 2.071058 10.17909 
1 1 1   23    8  -17 o   18.811   6.6999   23.239   12.938  -1.1931   25.390   31.808   15.037   14.366   6.9667   21.307   7.2449 -6.940910 10.05103 
1 1 1   23    8  -16 o   13.697   6.0100   7.3758   12.879   26.861   26.575   1.3946   14.724   17.755   8.1344   12.824   5.9394 4.931293 10.07193 
1 1 1   23    8  -15 o   28.924   5.8839   47.017   13.400   50.833   26.600   45.719   15.512   21.986   9.0984   26.688   7.0328 -4.701511 11.49959 
1 1 1   23    8  -14 o   11.150   5.2751  -4.7404   12.701   36.522   25.991 -17.6851   14.558   19.406   8.5257   10.114   4.9815 9.292236 9.874336 
1 1 1   23    8  -13 o   12.534   5.7171   2.1522   12.939 -23.0200   25.025   11.337   15.116   12.541   6.2389   14.985   6.5447 -2.444515 9.041946 
1 1 1   23    8  -12 o   13.404   5.9255   6.1621   12.740 -27.6341   24.724   18.378   14.865   12.168   6.0769   16.854   6.8687 -4.685316 9.171021 
1 1 1   23    8  -11 o   14.820   6.2807   11.293   13.143   41.415   26.213   1.1773   15.190   20.327   8.7482   12.940   6.0068 7.387042 10.61188 
1 1 1   23    8  -10 o   17.370   6.6358   19.269   13.083  -1.9647   24.630   27.613   15.441   14.274   6.9075   19.728   7.2771 -5.454090 10.03336 
1 1 1   23    8   -9 o   16.274   6.4795   16.013   12.896   45.099   25.693   6.2165   14.911   21.232   8.8767   13.855   6.2466 7.377135 10.85429 
1 1 1   23    8   -8 o   13.625   6.2149   4.6927   15.292  -5.1142   25.739   10.043   19.011   14.142   6.8934   15.138   6.9145 -0.9963808 9.763699 
1 1 1   23    8   -7 o   19.984   7.7651   30.937   18.131   23.890   25.475   38.171   25.812   17.516   8.0020   19.855   8.6131 -2.338490 11.75659 
1 1 1   23    8   -6 o   11.655   5.6899 -13.4042   17.736 -25.2985   25.681  -2.5569   24.525   12.551   6.2562   14.217   6.8830 -1.665956 9.301379 
1 1 1   23    8   -5 o   25.912   6.9067   42.380   14.853   56.073   27.205   36.565   17.728   23.088   9.3352   21.920   7.8387 1.168158 12.18977 
1 1 1   23    8   -4 o   14.433   6.3223   9.2514   14.199 -50.6534   24.278   40.394   17.505   10.754   5.4512   23.375   7.8166 -12.62053 9.529702 
1 1 1   23    8   -3 o   8.8139   4.3552 -17.6316   11.437 -19.0757   15.788 -16.0368   16.591   10.444   5.1525   11.028   5.4089 -0.5836668 7.470248 
1 1 1   23    8   -2 o   10.721   5.0844  -5.7087   11.932  -4.7285   16.766  -6.7146   16.985   12.446   5.9374   12.239   5.8753 0.2070284 8.353007 
1 1 1   23    8   -1 o   10.228   4.9157  -8.8507   11.968  -6.0228   16.693 -11.8419   17.168   12.251   5.8662   11.667   5.6742 0.5837126 8.161478 
1 1 1   23    8    0 o   13.132   5.7853   5.5614   12.045   5.9359   16.830   5.1684   17.245   14.146   6.4783   14.080   6.4878 0.6672955E-01 9.168419 
1 1 1   23    8    1 o   16.230   6.3632   15.720   12.265  -0.0507   17.168   32.157   17.527   13.221   6.2175   20.571   7.7210 -7.350525 9.913211 
1 1 1   23    8    2 o   12.365   5.7339  -0.0816   13.786   11.109   16.791 -23.2299   24.150   15.141   6.7419   12.386   6.1562 2.755300 9.129793 
1 1 1   23    8    3 o   15.779   6.3285   14.425   12.394   7.6515   17.230   21.688   17.841   14.517   6.6122   17.549   7.3708 -3.031921 9.901974 
1 1 1   23    8    4 o   19.078   6.2868   22.298   11.334   37.944   14.692  -0.6960   17.811   24.148   7.0360   13.262   6.2661 10.88684 9.421738 
1 1 1   23    8    5 o   15.969   6.4048   15.030   12.694   22.408   14.610  -7.6978   25.642   18.198   6.9974   13.905   6.8002 4.293012 9.757363 
1 1 1   23    8    6 o   22.859   6.0059   30.264   11.334   24.979   14.625   38.212   17.935   19.075   7.0739   22.374   7.8962 -3.298216 10.60143 
1 1 1   23    8    7 o   24.621   5.8180   34.134   11.490   33.745   14.740   34.736   18.344   22.367   7.1548   21.062   7.9003 1.304871 10.65858 
1 1 1   23    8    8 o   13.165   5.6681   6.5703   11.013 -14.2064   14.071   39.424   17.694   10.344   5.0541   22.904   7.8573 -12.55992 9.342436 
1 1 1   23    8    9 o   20.886   6.5901   27.548   12.542   24.010   17.574   31.221   17.904   18.153   7.4415   20.126   7.7441 -1.972767 10.74003 
1 1 1   23    8   10 o   9.4633   4.6293 -14.0622   11.912 -14.4954   16.749 -13.6188   16.944   11.231   5.4930   11.387   5.5598 -0.1560936 7.815626 
1 1 1   23    8   11 o   13.029   5.7809   5.0598   12.236  -9.9311   17.498   19.404   17.117   11.962   5.7966   16.994   7.1831 -5.032026 9.230233 
1 1 1   23    8   12 o   10.728   5.2222 -12.6288   14.630   10.795   28.361 -21.1217   17.078   15.902   7.6228   10.663   5.2786 5.238398 9.272034 
1 1 1   23    8   13 o   16.408   6.7894   16.865   14.810   13.420   27.584   18.260   17.554   16.125   7.6709   16.674   7.1673 -0.5491295 10.49827 
1 1 1   23    8   14 o   21.073   8.0490   36.237   19.245   22.906   28.557   47.331   26.050   17.209   8.0697   21.468   8.9540 -4.259188 12.05378 
1 1 1   23    8   15 o   15.615   7.0045   13.301   18.482   5.4455   27.254   19.990   25.149   15.240   7.3481   16.850   7.7894 -1.609939 10.70838 
1 1 1   23    8   16 o   18.669   7.6296   26.919   18.402   36.137   27.559   19.501   24.720   19.046   8.5476   16.762   7.7395 2.284241 11.53092 
1 1 1   23    8   17 o   14.342   6.3795   8.7703   14.993   15.383   26.569   5.6811   18.160   16.240   7.6674   14.214   6.5877 2.026192 10.10875 
1 1 1   23    8   18 o   12.814   5.9319   1.5109   14.659 -43.5870   26.874   20.611   17.489   11.642   5.8824   17.161   7.2578 -5.518969 9.342267 
1 1 1   23    8   19 o   13.865   6.2508   6.6719   14.928   1.6325   27.720   8.7304   17.717   14.865   7.2250   14.653   6.6862 0.2116995 9.844063 
1 1 1   23    8   20 o   12.796   5.9060   1.8756   14.375 -43.8530   26.070   21.850   17.230   11.442   5.7826   17.465   7.2830 -6.022760 9.299505 
1 1 1   23    8   21 o   11.044   5.3295  -9.1688   14.412   12.295   26.720 -17.9755   17.116   15.819   7.5323   10.920   5.3831 4.898715 9.258142 
1 1 1   23    8   22 f   17.532   6.9677   21.133   14.886   30.355   26.943   17.081   17.860   18.087   8.2500   16.259   7.1071 1.828335 10.88917 
1 1 1   23    8   23 o   11.629   5.5403  -5.1046   14.497 -13.2790   27.529  -1.9675   17.054   13.559   6.7103   12.769   6.0621 0.7903614 9.043042 
1 1 1   23    8   24 f   24.270   8.2112   47.302   19.314   18.276   28.917   70.677   25.950   16.454   7.8351   26.848   9.4959 -10.39395 12.31103 
1 1 1   23    8   25 o   9.2896   4.7059 -42.5914   17.908 -53.7852   25.766 -32.1304   24.908   10.852   5.5126   11.809   5.9265 -0.9572105 8.093972 
1 1 1   23    8   26 o   16.373   7.1434   17.775   17.967 -13.5216   25.956   46.567   24.896   13.289   6.5655   21.364   8.8178 -8.074426 10.99363 
1 1 1   23    8   27 o   16.881   7.7236   21.304   23.854   0.0000   0.0000   21.304   23.854  ?   ?    16.881   7.7236 0.000000 7.723639 
1 1 1   23    8   28 o   15.346   6.9507   12.498   18.713   27.681   27.742  -0.1762   25.347   17.612   8.1555   14.356   6.9616 3.255539 10.72264 
1 1 1   23    8   29 o   13.596   6.3736   2.6694   17.793  -4.4828   26.540   8.5081   23.980   14.111   6.9045   15.151   7.1916 -1.039436 9.969471 
1 1 1   23    8   30 o   11.962   5.8271 -10.9635   18.317   14.116   27.784 -30.2421   24.360   16.003   7.6370   11.814   5.9196 4.188643 9.662562 
1 1 1   23    8   31 o   14.167   6.5730   5.8209   18.151 -15.7587   27.766   21.925   23.986   13.432   6.6633   17.004   7.7666 -3.571957 10.23326 
1 1 1   23    8   32 o   17.520   8.0922   26.159   27.058   0.0000   0.0000   26.159   27.058  ?   ?    17.520   8.0922 0.000000 8.092156 
1 1 1   23    9   -9 o   14.720   7.0695   4.5942   24.653   0.0000   0.0000   4.5942   24.653  ?   ?    14.720   7.0695 0.000000 7.069483 
1 1 1   23    9   -8 o   27.226   9.4925   72.227   25.868   0.0000   0.0000   72.227   25.868  ?   ?    27.226   9.4925 0.000000 9.492485 
1 1 1   23    9   -7 o   13.230   6.2721   0.0159   18.130   0.0000   0.0000   0.0159   18.130  ?   ?    13.230   6.2721 0.000000 6.272135 
1 1 1   23    9   -6 o   25.429   7.9842   49.130   18.431   0.0000   0.0000   49.130   18.431  ?   ?    25.429   7.9842 0.000000 7.984235 
1 1 1   23    9   -5 o   12.570   6.0241  -4.1589   17.686   0.0000   0.0000  -4.1589   17.686  ?   ?    12.570   6.0241 0.000000 6.024082 
1 1 1   23    9   -4 o   11.469   5.6095 -13.0713   17.472   0.0000   0.0000 -13.0713   17.472  ?   ?    11.469   5.6095 0.000000 5.609535 
1 1 1   23    9   -3 o   13.207   6.2461   0.4110   17.776   0.0000   0.0000   0.4110   17.776  ?   ?    13.207   6.2461 0.000000 6.246096 
1 1 1   23    9   -2 o   14.439   6.9715   2.1012   24.734   0.0000   0.0000   2.1012   24.734  ?   ?    14.439   6.9715 0.000000 6.971457 
1 1 1   23    9   -1 o   17.892   7.4304   24.520   17.828   0.0000   0.0000   24.520   17.828  ?   ?    17.892   7.4304 0.000000 7.430392 
1 1 1   23    9    0 o   14.081   6.5001   6.4234   17.421   0.0000   0.0000   6.4234   17.421  ?   ?    14.081   6.5001 0.000000 6.500105 
1 1 1   23    9    1 o   12.200   5.8838  -6.6839   17.493   0.0000   0.0000  -6.6839   17.493  ?   ?    12.200   5.8838 0.000000 5.883775 
1 1 1   23    9    2 o   11.304   5.5478 -14.7985   17.534   0.0000   0.0000 -14.7985   17.534  ?   ?    11.304   5.5478 0.000000 5.547809 
1 1 1   23    9    3 o   10.145   5.0741 -27.7886   17.523   0.0000   0.0000 -27.7886   17.523  ?   ?    10.145   5.0741 0.000000 5.074096 
1 1 1   23    9    5 o   16.276   7.1029   17.625   17.775   0.0000   0.0000   17.625   17.775  ?   ?    16.276   7.1029 0.000000 7.102896 
1 1 1   23    9    6 o   17.203   7.3565   21.871   18.317   0.0000   0.0000   21.871   18.317  ?   ?    17.203   7.3565 0.000000 7.356530 
1 1 1   23    9    7 o   13.498   6.3471   2.2058   17.878   0.0000   0.0000   2.2058   17.878  ?   ?    13.498   6.3471 0.000000 6.347118 
1 1 1   24    0  -62 o   10.120   7.1475 -14.6667   23.808 -14.6667   23.808 -14.6667   23.808   10.120   7.1475   10.120   7.1475 0.000000 0.000000 
1 1 1   24    0  -61 o   9.1733   6.5807 -24.8262   23.316 -24.8262   23.316 -24.8262   23.316   9.1733   6.5807   9.1733   6.5807 0.000000 0.000000 
1 1 1   24    0  -60 o   16.714   10.045   26.410   24.671   26.410   24.671   26.410   24.671   16.714   10.045   16.714   10.045 0.000000 0.000000 
1 1 1   24    0  -59 o   12.321   8.2938   3.3641   23.843   3.3641   23.843   3.3641   23.843   12.321   8.2938   12.321   8.2938 0.000000 0.000000 
1 1 1   24    0  -58 o   10.408   7.3171 -13.1465   24.046 -13.1465   24.046 -13.1465   24.046   10.408   7.3171   10.408   7.3171 0.000000 0.000000 
1 1 1   24    0  -57 o   17.343   10.218   28.259   24.603   28.259   24.603   28.259   24.603   17.343   10.218   17.343   10.218 0.000000 0.000000 
1 1 1   24    0  -56 o   9.7857   6.9590 -20.0053   23.936 -20.0053   23.936 -20.0053   23.936   9.7857   6.9590   9.7857   6.9590 0.000000 0.000000 
1 1 1   24    0  -55 f   14.754   9.4156   16.265   25.137   16.265   25.137   16.265   25.137   14.754   9.4156   14.754   9.4156 0.000000 0.000000 
1 1 1   24    0  -54 f   26.721   9.6397   46.974   19.241   46.974   19.241   46.974   19.241   26.721   9.6397   26.721   9.6397 0.000000 0.000000 
1 1 1   24    0  -53 o   16.715   9.2934   23.240   18.718   23.240   18.718   23.240   18.718   16.715   9.2934   16.715   9.2934 0.000000 0.000000 
1 1 1   24    0  -52 o   18.019   9.5231   26.602   18.697   26.602   18.697   26.602   18.697   18.019   9.5231   18.019   9.5231 0.000000 0.000000 
1 1 1   24    0  -51 o   15.852   9.1779   20.254   19.287   20.254   19.287   20.254   19.287   15.852   9.1779   15.852   9.1779 0.000000 0.000000 
1 1 1   24    0  -50 o   17.217   9.4999   24.217   19.389   24.217   19.389   24.217   19.389   17.217   9.4999   17.217   9.4999 0.000000 0.000000 
1 1 1   24    0  -49 o   12.977   8.2001   9.2846   18.522   9.2846   18.522   9.2846   18.522   12.977   8.2001   12.977   8.2001 0.000000 0.000000 
1 1 1   24    0  -48 o   33.017   5.7461   51.997   14.063   51.997   14.063   51.997   14.063   33.017   5.7461   33.017   5.7461 0.000000 0.000000 
1 1 1   24    0  -47 o   7.1797   5.1091 -15.2783   12.977 -15.2783   12.977 -15.2783   12.977   7.1797   5.1091   7.1797   5.1091 0.000000 0.000000 
1 1 1   24    0  -46 o   10.178   6.6382   1.6980   13.422   1.6980   13.422   1.6980   13.422   10.178   6.6382   10.178   6.6382 0.000000 0.000000 
1 1 1   24    0  -45 o   33.131   6.0834   52.825   14.795   52.825   14.795   52.825   14.795   33.131   6.0834   33.131   6.0834 0.000000 0.000000 
1 1 1   24    0  -44 o   56.412   3.6455  136.004   16.601  136.004   16.601  136.004   16.601   56.412   3.6455   56.412   3.6455 0.000000 0.000000 
1 1 1   24    0  -43 o   11.162   7.0575   5.0039   13.745   5.0039   13.745   5.0039   13.745   11.162   7.0575   11.162   7.0575 0.000000 0.000000 
1 1 1   24    0  -42 o   20.775   8.5090   27.829   14.205   27.829   14.205   27.829   14.205   20.775   8.5090   20.775   8.5090 0.000000 0.000000 
1 1 1   24    0  -41 o   19.141   8.5608   24.723   14.209   24.723   14.209   24.723   14.209   19.141   8.5608   19.141   8.5608 0.000000 0.000000 
1 1 1   24    0  -40 o   8.7913   5.8996  -2.6775   11.895  -2.6775   11.895  -2.6775   11.895   8.7913   5.8996   8.7913   5.8996 0.000000 0.000000 
1 1 1   24    0  -39 o   7.9118   5.4519  -6.8743   11.661  -6.8743   11.661  -6.8743   11.661   7.9118   5.4519   7.9118   5.4519 0.000000 0.000000 
1 1 1   24    0  -38 o   23.994   7.1101   30.960   12.095   30.960   12.095   30.960   12.095   23.994   7.1101   23.994   7.1101 0.000000 0.000000 
1 1 1   24    0  -37 o   43.060   3.8298   79.770   13.186   79.770   13.186   79.770   13.186   43.060   3.8298   43.060   3.8298 0.000000 0.000000 
1 1 1   24    0  -36 o   25.341   6.7813   33.168   12.103   33.168   12.103   33.168   12.103   25.341   6.7813   25.341   6.7813 0.000000 0.000000 
1 1 1   24    0  -35 o   16.079   7.8282   17.422   12.058   17.422   12.058   17.422   12.058   16.079   7.8282   16.079   7.8282 0.000000 0.000000 
1 1 1   24    0  -34 o   7.8153   5.4874 -12.4022   13.394 -12.4022   13.394 -12.4022   13.394   7.8153   5.4874   7.8153   5.4874 0.000000 0.000000 
1 1 1   24    0  -33 o   8.7007   5.9498  -6.3564   13.294  -6.3564   13.294  -6.3564   13.294   8.7007   5.9498   8.7007   5.9498 0.000000 0.000000 
1 1 1   24    0  -32 o   15.177   8.1565   15.732   13.916   15.732   13.916   15.732   13.916   15.177   8.1565   15.177   8.1565 0.000000 0.000000 
1 1 1   24    0  -31 o   31.338   6.3886   47.175   14.437   47.175   14.437   47.175   14.437   31.338   6.3886   31.338   6.3886 0.000000 0.000000 
1 1 1   24    0  -30 o   37.350   4.4053   61.158   12.923   61.158   12.923   61.158   12.923   37.350   4.4053   37.350   4.4053 0.000000 0.000000 
1 1 1   24    0  -29 o   40.158   4.7797   71.103   15.063   71.103   15.063   71.103   15.063   40.158   4.7797   40.158   4.7797 0.000000 0.000000 
1 1 1   24    0  -28 o   9.6326   6.2909   0.1494   12.111   0.1494   12.111   0.1494   12.111   9.6326   6.2909   9.6326   6.2909 0.000000 0.000000 
1 1 1   24    0  -27 o   45.683   3.7293   88.843   13.667   88.843   13.667   88.843   13.667   45.683   3.7293   45.683   3.7293 0.000000 0.000000 
1 1 1   24    0  -26 o   11.863   7.0544   7.7101   11.924   7.7101   11.924   7.7101   11.924   11.863   7.0544   11.863   7.0544 0.000000 0.000000 
1 1 1   24    0  -25 o   18.660   7.8125   21.561   11.913   21.561   11.913   21.561   11.913   18.660   7.8125   18.660   7.8125 0.000000 0.000000 
1 1 1   24    0  -24 o   6.7682   4.8180 -15.0666   11.578 -15.0666   11.578 -15.0666   11.578   6.7682   4.8180   6.7682   4.8180 0.000000 0.000000 
1 1 1   24    0  -23 o   17.496   7.7349   19.384   11.601   19.384   11.601   19.384   11.601   17.496   7.7349   17.496   7.7349 0.000000 0.000000 
1 1 1   24    0  -22 o   49.758   3.3599  104.186   13.483  104.186   13.483  104.186   13.483   49.758   3.3599   49.758   3.3599 0.000000 0.000000 
1 1 1   24    0  -21 o   43.179   4.4677   80.822   15.306   80.822   15.306   80.822   15.306   43.179   4.4677   43.179   4.4677 0.000000 0.000000 
1 1 1   24    0  -20 o   16.977   8.3314   19.206   13.698   19.206   13.698   19.206   13.698   16.977   8.3314   16.977   8.3314 0.000000 0.000000 
1 1 1   24    0  -19 o   41.140   4.6364   73.866   15.041   73.866   15.041   73.866   15.041   41.140   4.6364   41.140   4.6364 0.000000 0.000000 
1 1 1   24    0  -18 o   17.848   9.3409   22.039   17.853   22.039   17.853   22.039   17.853   17.848   9.3409   17.848   9.3409 0.000000 0.000000 
1 1 1   24    0  -17 o   50.843   3.3205  108.557   13.625  108.557   13.625  108.557   13.625   50.843   3.3205   50.843   3.3205 0.000000 0.000000 
1 1 1   24    0  -16 o   31.823   5.1229   45.844   12.257   45.844   12.257   45.844   12.257   31.823   5.1229   31.823   5.1229 0.000000 0.000000 
1 1 1   24    0  -15 o   14.740   8.1524   14.164   14.316   14.164   14.316   14.164   14.316   14.740   8.1524   14.740   8.1524 0.000000 0.000000 
1 1 1   24    0  -14 o   14.333   8.4940   12.046   17.180   12.046   17.180   12.046   17.180   14.333   8.4940   14.333   8.4940 0.000000 0.000000 
1 1 1   24    0  -13 o   10.757   6.9145   2.0208   13.863   2.0208   13.863   2.0208   13.863   10.757   6.9145   10.757   6.9145 0.000000 0.000000 
1 1 1   24    0  -12 o   10.287   6.5610   2.3208   12.182   2.3208   12.182   2.3208   12.182   10.287   6.5610   10.287   6.5610 0.000000 0.000000 
1 1 1   24    0  -11 o   9.7462   6.2910   1.0326   11.632   1.0326   11.632   1.0326   11.632   9.7462   6.2910   9.7462   6.2910 0.000000 0.000000 
1 1 1   24    0  -10 o   11.959   7.0192   7.9931   11.534   7.9931   11.534   7.9931   11.534   11.959   7.0192   11.959   7.0192 0.000000 0.000000 
1 1 1   24    0   -9 o   19.410   7.6960   22.502   11.738   22.502   11.738   22.502   11.738   19.410   7.6960   19.410   7.6960 0.000000 0.000000 
1 1 1   24    0   -8 f   9.0741   6.1084  -4.1084   12.937  -4.1084   12.937  -4.1084   12.937   9.0741   6.1084   9.0741   6.1084 0.000000 0.000000 
1 1 1   24    0   -7 o   32.396   5.7932   48.486   13.843   48.486   13.843   48.486   13.843   32.396   5.7932   32.396   5.7932 0.000000 0.000000 
1 1 1   24    0   -6 o   20.491   8.2548   25.475   13.433   25.475   13.433   25.475   13.433   20.491   8.2548   20.491   8.2548 0.000000 0.000000 
1 1 1   24    0   -5 o   6.9514   4.9580 -17.0013   12.488 -17.0013   12.488 -17.0013   12.488   6.9514   4.9580   6.9514   4.9580 0.000000 0.000000 
1 1 1   24    0   -4 o   7.2423   5.1480 -16.4797   13.044 -16.4797   13.044 -16.4797   13.044   7.2423   5.1480   7.2423   5.1480 0.000000 0.000000 
1 1 1   24    0   -3 o   9.3658   6.2545  -2.9557   13.081  -2.9557   13.081  -2.9557   13.081   9.3658   6.2545   9.3658   6.2545 0.000000 0.000000 
1 1 1   24    0   -2 o   31.942   6.1686   47.879   14.335   47.879   14.335   47.879   14.335   31.942   6.1686   31.942   6.1686 0.000000 0.000000 
1 1 1   24    0   -1 f   19.882   8.2739   24.354   13.379   24.354   13.379   24.354   13.379   19.882   8.2739   19.882   8.2739 0.000000 0.000000 
1 1 1   24    0    0 f   21.443   8.2078   27.193   13.539   27.193   13.539   27.193   13.539   21.443   8.2078   21.443   8.2078 0.000000 0.000000 
1 1 1   24    0    1 f   8.5835   5.8793  -7.1612   13.100  -7.1612   13.100  -7.1612   13.100   8.5835   5.8793   8.5835   5.8793 0.000000 0.000000 
1 1 1   24    0    2 o   32.353   5.9516   48.628   14.130   48.628   14.130   48.628   14.130   32.353   5.9516   32.353   5.9516 0.000000 0.000000 
1 1 1   24    0    3 o   13.741   7.7514   11.807   13.257   11.807   13.257   11.807   13.257   13.741   7.7514   13.741   7.7514 0.000000 0.000000 
1 1 1   24    0    4 o   8.5672   5.8574  -6.7154   12.870  -6.7154   12.870  -6.7154   12.870   8.5672   5.8574   8.5672   5.8574 0.000000 0.000000 
1 1 1   24    0    5 o   7.2877   5.1640 -15.1392   12.768 -15.1392   12.768 -15.1392   12.768   7.2877   5.1640   7.2877   5.1640 0.000000 0.000000 
1 1 1   24    0    6 o   40.832   4.5781   72.542   14.746   72.542   14.746   72.542   14.746   40.832   4.5781   40.832   4.5781 0.000000 0.000000 
1 1 1   24    0    7 o   13.178   7.9649   9.0208   15.694   9.0208   15.694   9.0208   15.694   13.178   7.9649   13.178   7.9649 0.000000 0.000000 
1 1 1   24    0    8 f   34.430   6.6058   55.940   16.566   55.940   16.566   55.940   16.566   34.430   6.6058   34.430   6.6058 0.000000 0.000000 
1 1 1   24    0    9 o   21.803   9.0273   29.647   15.945   29.647   15.945   29.647   15.945   21.803   9.0273   21.803   9.0273 0.000000 0.000000 
1 1 1   24    0   10 o   60.617   3.3902  153.828   16.631  153.828   16.631  153.828   16.631   60.617   3.3902   60.617   3.3902 0.000000 0.000000 
1 1 1   24    0   11 o   24.814   7.8803   33.551   14.024   33.551   14.024   33.551   14.024   24.814   7.8803   24.814   7.8803 0.000000 0.000000 
1 1 1   24    0   12 o   28.885   6.7981   41.026   13.904   41.026   13.904   41.026   13.904   28.885   6.7981   28.885   6.7981 0.000000 0.000000 
1 1 1   24    0   13 o   32.168   5.9022   48.094   13.939   48.094   13.939   48.094   13.939   32.168   5.9022   32.168   5.9022 0.000000 0.000000 
1 1 1   24    0   14 o   13.940   7.7963   12.370   13.266   12.370   13.266   12.370   13.266   13.940   7.7963   13.940   7.7963 0.000000 0.000000 
1 1 1   24    0   15 o   9.0920   6.1093  -3.7572   12.831  -3.7572   12.831  -3.7572   12.831   9.0920   6.1093   9.0920   6.1093 0.000000 0.000000 
1 1 1   24    0   16 o   20.478   8.1923   25.409   13.260   25.409   13.260   25.409   13.260   20.478   8.1923   20.478   8.1923 0.000000 0.000000 
1 1 1   24    0   17 o   10.520   6.7431   2.1313   13.069   2.1313   13.069   2.1313   13.069   10.520   6.7431   10.520   6.7431 0.000000 0.000000 
1 1 1   24    0   18 o   45.825   4.1692   90.044   15.262   90.044   15.262   90.044   15.262   45.825   4.1692   45.825   4.1692 0.000000 0.000000 
1 1 1   24    0   19 o   7.4342   5.2552 -14.4831   12.959 -14.4831   12.959 -14.4831   12.959   7.4342   5.2552   7.4342   5.2552 0.000000 0.000000 
1 1 1   24    0   20 o   25.721   7.6251   35.163   13.905   35.163   13.905   35.163   13.905   25.721   7.6251   25.721   7.6251 0.000000 0.000000 
1 1 1   24    0   21 o   7.8141   5.4846 -12.7357   13.347 -12.7357   13.347 -12.7357   13.347   7.8141   5.4846   7.8141   5.4846 0.000000 0.000000 
1 1 1   24    0   22 o   17.426   8.2937   20.049   13.442   20.049   13.442   20.049   13.442   17.426   8.2937   17.426   8.2937 0.000000 0.000000 
1 1 1   24    0   23 o   13.331   7.6907   10.878   13.469   10.878   13.469   10.878   13.469   13.331   7.6907   13.331   7.6907 0.000000 0.000000 
1 1 1   24    0   24 o   32.317   7.9393   53.052   18.110   53.052   18.110   53.052   18.110   32.317   7.9393   32.317   7.9393 0.000000 0.000000 
1 1 1   24    0   25 o   21.499   9.4844   30.405   17.444   30.405   17.444   30.405   17.444   21.499   9.4844   21.499   9.4844 0.000000 0.000000 
1 1 1   24    0   26 o   39.625   6.4045   72.831   19.067   72.831   19.067   72.831   19.067   39.625   6.4045   39.625   6.4045 0.000000 0.000000 
1 1 1   24    0   27 o   42.854   4.6024   80.139   15.609   80.139   15.609   80.139   15.609   42.854   4.6024   42.854   4.6024 0.000000 0.000000 
1 1 1   24    0   28 o   23.464   9.4761   34.764   17.689   34.764   17.689   34.764   17.689   23.464   9.4761   23.464   9.4761 0.000000 0.000000 
1 1 1   24    0   29 o   15.162   8.5879   15.336   16.361   15.336   16.361   15.336   16.361   15.162   8.5879   15.162   8.5879 0.000000 0.000000 
1 1 1   24    0   30 o   36.014   6.5563   61.379   17.359   61.379   17.359   61.379   17.359   36.014   6.5563   36.014   6.5563 0.000000 0.000000 
1 1 1   24    0   31 o   20.109   9.3623   27.578   17.051   27.578   17.051   27.578   17.051   20.109   9.3623   20.109   9.3623 0.000000 0.000000 
1 1 1   24    0   32 o   9.6965   6.6183  -6.8248   16.282  -6.8248   16.282  -6.8248   16.282   9.6965   6.6183   9.6965   6.6183 0.000000 0.000000 
1 1 1   24    0   33 o   28.127   8.6995   44.121   17.459   44.121   17.459   44.121   17.459   28.127   8.6995   28.127   8.6995 0.000000 0.000000 
1 1 1   24    0   34 o   11.893   7.2935   6.9958   13.582   6.9958   13.582   6.9958   13.582   11.893   7.2935   11.893   7.2935 0.000000 0.000000 
1 1 1   24    0   35 o   12.304   7.4253   8.3459   13.596   8.3459   13.596   8.3459   13.596   12.304   7.4253   12.304   7.4253 0.000000 0.000000 
1 1 1   24    0   36 o   15.241   8.1462   16.114   13.812   16.114   13.812   16.114   13.812   15.241   8.1462   15.241   8.1462 0.000000 0.000000 
1 1 1   24    0   37 o   31.902   6.3093   48.991   14.586   48.991   14.586   48.991   14.586   31.902   6.3093   31.902   6.3093 0.000000 0.000000 
1 1 1   24    0   38 o   11.354   7.1790   4.8247   14.224   4.8247   14.224   4.8247   14.224   11.354   7.1790   11.354   7.1790 0.000000 0.000000 
1 1 1   24    0   39 o   10.619   6.8151   2.9377   13.401   2.9377   13.401   2.9377   13.401   10.619   6.8151   10.619   6.8151 0.000000 0.000000 
1 1 1   24    0   40 o   10.003   6.8148  -5.7370   17.090  -5.7370   17.090  -5.7370   17.090   10.003   6.8148   10.003   6.8148 0.000000 0.000000 
1 1 1   24    0   41 o   9.1593   6.1887  -3.7267   13.517  -3.7267   13.517  -3.7267   13.517   9.1593   6.1887   9.1593   6.1887 0.000000 0.000000 
1 1 1   24    0   42 o   14.588   8.4699   14.836   16.499   14.836   16.499   14.836   16.499   14.588   8.4699   14.588   8.4699 0.000000 0.000000 
1 1 1   24    0   43 o   7.3590   5.2846 -21.8482   15.203 -21.8482   15.203 -21.8482   15.203   7.3590   5.2846   7.3590   5.2846 0.000000 0.000000 
1 1 1   24    0   44 o   11.964   7.5914   6.1655   16.063   6.1655   16.063   6.1655   16.063   11.964   7.5914   11.964   7.5914 0.000000 0.000000 
1 1 1   24    0   45 o   14.317   8.3122   14.489   15.890   14.489   15.890   14.489   15.890   14.317   8.3122   14.317   8.3122 0.000000 0.000000 
1 1 1   24    0   46 o   24.367   8.9512   37.159   16.427   37.159   16.427   37.159   16.427   24.367   8.9512   24.367   8.9512 0.000000 0.000000 
1 1 1   24    0   47 o   9.5510   6.5212  -5.2763   15.837  -5.2763   15.837  -5.2763   15.837   9.5510   6.5212   9.5510   6.5212 0.000000 0.000000 
1 1 1   24    0   48 o   19.101   9.2130   27.084   16.649   27.084   16.649   27.084   16.649   19.101   9.2130   19.101   9.2130 0.000000 0.000000 
1 1 1   24    0   49 o   14.067   8.3241   14.154   16.454   14.154   16.454   14.154   16.454   14.067   8.3241   14.067   8.3241 0.000000 0.000000 
1 1 1   24    0   50 o   11.909   7.6071   6.4550   16.453   6.4550   16.453   6.4550   16.453   11.909   7.6071   11.909   7.6071 0.000000 0.000000 
1 1 1   24    0   51 o   10.828   7.1751   1.3384   16.663   1.3384   16.663   1.3384   16.663   10.828   7.1751   10.828   7.1751 0.000000 0.000000 
1 1 1   24    0   52 o   13.085   7.9947   11.501   16.183   11.501   16.183   11.501   16.183   13.085   7.9947   13.085   7.9947 0.000000 0.000000 
1 1 1   24    0   53 o   21.629   9.2705   33.330   16.708   33.330   16.708   33.330   16.708   21.629   9.2705   21.629   9.2705 0.000000 0.000000 
1 1 1   24    0   54 f   9.7314   6.6431  -4.0959   16.417  -4.0959   16.417  -4.0959   16.417   9.7314   6.6431   9.7314   6.6431 0.000000 0.000000 
1 1 1   24    0   55 f   13.306   8.1146   12.557   16.603   12.557   16.603   12.557   16.603   13.306   8.1146   13.306   8.1146 0.000000 0.000000 
1 1 1   24    0   56 o   11.440   7.7975  -1.6404   22.436  -1.6404   22.436  -1.6404   22.436   11.440   7.7975   11.440   7.7975 0.000000 0.000000 
1 1 1   24    0   57 o   8.9371   6.3852 -21.6278   21.056 -21.6278   21.056 -21.6278   21.056   8.9371   6.3852   8.9371   6.3852 0.000000 0.000000 
1 1 1   24    0   58 o   11.140   7.5859  -1.6647   21.127  -1.6647   21.127  -1.6647   21.127   11.140   7.5859   11.140   7.5859 0.000000 0.000000 
1 1 1   24    0   59 o   17.414   9.9957   27.979   22.582   27.979   22.582   27.979   22.582   17.414   9.9957   17.414   9.9957 0.000000 0.000000 
1 1 1   24    0   60 o   16.233   9.6056   23.766   21.912   23.766   21.912   23.766   21.912   16.233   9.6056   16.233   9.6056 0.000000 0.000000 
1 1 1   24    0   61 o   22.531   10.784   43.497   22.762   43.497   22.762   43.497   22.762   22.531   10.784   22.531   10.784 0.000000 0.000000 
1 1 1   24    0   62 o   12.166   8.0924   5.3475   21.528   5.3475   21.528   5.3475   21.528   12.166   8.0924   12.166   8.0924 0.000000 0.000000 
1 1 1   24    0   63 o   13.344   8.6028   11.985   21.664   11.985   21.664   11.985   21.664   13.344   8.6028   13.344   8.6028 0.000000 0.000000 
1 1 1   24    0   64 o   10.840   7.4580  -3.5913   21.619  -3.5913   21.619  -3.5913   21.619   10.840   7.4580   10.840   7.4580 0.000000 0.000000 
1 1 1   24    0   65 o   17.035   9.9845   28.176   23.285   28.176   23.285   28.176   23.285   17.035   9.9845   17.035   9.9845 0.000000 0.000000 
1 1 1   24    0   66 o   12.809   8.4125   9.2755   22.116   9.2755   22.116   9.2755   22.116   12.809   8.4125   12.809   8.4125 0.000000 0.000000 
1 1 1   24    0   67 o   9.4342   6.7084 -17.4857   22.221 -17.4857   22.221 -17.4857   22.221   9.4342   6.7084   9.4342   6.7084 0.000000 0.000000 
1 1 1   24    0   68 o   12.436   8.2341   7.6580   21.874   7.6580   21.874   7.6580   21.874   12.436   8.2341   12.436   8.2341 0.000000 0.000000 
1 1 1   24    0   69 o   12.849   8.4539   9.8307   22.483   9.8307   22.483   9.8307   22.483   12.849   8.4539   12.849   8.4539 0.000000 0.000000 
1 1 1   24    0   70 f   10.380   7.2165  -6.3766   21.604  -6.3766   21.604  -6.3766   21.604   10.380   7.2165   10.380   7.2165 0.000000 0.000000 
1 1 1   24    0   71 o   8.7756   6.2928 -21.8518   21.229 -21.8518   21.229 -21.8518   21.229   8.7756   6.2928   8.7756   6.2928 0.000000 0.000000 
1 1 1   24    0   72 o   8.3445   6.0251 -26.7004   21.029 -26.7004   21.029 -26.7004   21.029   8.3445   6.0251   8.3445   6.0251 0.000000 0.000000 
1 1 1   24    0   73 o   20.980   10.619   41.455   22.582   41.455   22.582   41.455   22.582   20.980   10.619   20.980   10.619 0.000000 0.000000 
1 1 1   24    0   74 o   11.804   7.9193   5.0900   21.411   5.0900   21.411   5.0900   21.411   11.804   7.9193   11.804   7.9193 0.000000 0.000000 
1 1 1   24    1  -61 o   14.226   6.8819  -7.6802   24.395   0.0000   0.0000  -7.6802   24.395  ?   ?    14.226   6.8819 0.000000 6.881889 
1 1 1   24    1  -60 o   14.588   6.6476   4.9593   17.440   5.0343   24.488   4.8820   24.843   15.720   7.4030   15.746   7.4281 -0.2647781E-01 10.48718 
1 1 1   24    1  -59 o   14.319   6.5212   4.0942   16.752 -20.3818   23.115   31.171   24.312   12.825   6.3090   19.993   8.5103 -7.168427 10.59378 
1 1 1   24    1  -58 f   12.491   5.9541  -7.4073   16.787   0.2776   23.649 -15.2131   23.834   15.075   7.1517   13.472   6.5815 1.602657 9.719193 
1 1 1   24    1  -57 f   24.922   7.8603   41.574   17.844   41.752   25.208   41.395   25.262   22.280   8.9941   22.185   8.9864 0.9493256E-01 12.71412 
1 1 1   24    1  -56 o   12.739   6.0538  -6.7499   17.086  -6.4225   25.139  -7.0310   23.293   14.694   7.0781   14.268   6.8575 0.4265213 9.855221 
1 1 1   24    1  -55 o   17.789   7.4081   18.509   17.792 -16.9384   25.411   52.595   24.919   13.800   6.7530   25.401   9.2650 -11.60057 11.46488 
1 1 1   24    1  -54 o   27.424   7.8521   48.290   18.447   49.068   25.814   47.478   26.371   24.274   9.3093   23.709   9.3201 0.5651684 13.17302 
1 1 1   24    1  -53 o   16.882   7.1880   14.459   17.352   50.506   24.979 -19.1587   24.122   25.058   9.2535   13.389   6.5576 11.66959 11.34151 
1 1 1   24    1  -52 o   12.740   5.7301   1.1745   12.463 -21.9117   24.425   9.3002   14.491   13.254   6.5132   15.268   6.5365 -2.013953 9.227544 
1 1 1   24    1  -51 o   12.272   5.6098  -1.1574   12.546  -9.2402   24.693   1.6554   14.567   14.532   7.0036   13.541   6.1329 0.9907827 9.309288 
1 1 1   24    1  -50 o   10.247   4.9495 -12.7323   12.495 -13.7265   24.849 -12.3959   14.455   14.157   6.8714   11.156   5.3720 3.001066 8.722053 
1 1 1   24    1  -49 o   12.328   5.4232   2.1177   10.549 -27.6881   18.110   17.423   12.978   10.922   5.4116   17.785   6.6503 -6.863515 8.573891 
1 1 1   24    1  -48 o   14.571   5.8712   9.0059   10.720   3.5965   18.504   11.739   13.152   15.036   6.8501   15.893   6.4669 -0.8570223 9.420447 
1 1 1   24    1  -47 o   19.641   6.1788   20.977   11.033   29.440   18.963   16.647   13.565   21.274   8.0211   17.600   6.7487 3.674686 10.48256 
1 1 1   24    1  -46 o   35.560   4.0497   58.041   11.530   66.517   19.786   53.684   14.187   34.137   7.3296   32.725   5.5142 1.412144 9.172227 
1 1 1   24    1  -45 o   21.426   6.0332   24.351   10.982   10.839   18.653   31.520   13.587   16.693   7.2807   23.781   6.7157 -7.087727 9.905015 
1 1 1   24    1  -44 o   9.6371   4.5399  -6.8262   9.2223   3.0370   12.788 -17.5165   13.313   13.567   5.9697   10.128   4.9415 3.438967 7.749557 
1 1 1   24    1  -43 o   24.540   4.9912   29.181   9.6439   34.806   13.728   23.699   13.551   25.377   6.5815   20.629   6.8771 4.747816 9.518929 
1 1 1   24    1  -42 o   26.219   4.7216   32.562   9.7201   23.576   13.856   41.268   13.639   20.622   6.9551   28.349   6.0842 -7.726954 9.240735 
1 1 1   24    1  -41 o   16.404   5.7474   13.069   9.4899   12.350   13.607   13.751   13.242   16.596   6.6396   17.011   6.6286 -0.4151688 9.382030 
1 1 1   24    1  -40 o   15.709   5.9294   11.191   10.369   8.4519   13.585   15.014   16.048   15.454   6.4574   17.782   7.1769 -2.327730 9.654343 
1 1 1   24    1  -39 o   32.868   4.1888   49.129   10.968   33.188   14.351   71.521   17.009   24.746   6.8708   38.273   5.6189 -13.52755 8.875851 
1 1 1   24    1  -38 o   13.805   5.6738   6.0615   10.250  -4.1419   13.599   19.484   15.598   12.524   5.7675   19.267   7.2724 -6.742688 9.281794 
1 1 1   24    1  -37 o   21.039   5.6374   22.051   9.8629   20.221   14.369   23.682   13.562   19.593   7.0511   21.026   6.8744 -1.433922 9.847586 
1 1 1   24    1  -36 o   26.148   5.2568   32.865   10.816   45.531   17.423   24.923   13.796   28.828   7.3826   21.564   6.9242 7.264360 10.12164 
1 1 1   24    1  -35 o   18.740   6.0611   17.557   10.558   9.2611   16.567   23.231   13.701   16.603   7.0445   20.938   6.9129 -4.334831 9.869870 
1 1 1   24    1  -34 o   9.5992   4.5875 -10.6627   10.102 -23.9433   16.019  -1.8928   13.017   10.849   5.3200   12.854   5.8122 -2.005086 7.879370 
1 1 1   24    1  -33 o   36.827   3.5375   59.281   10.489   60.184   15.332   58.487   14.381   35.553   5.4649   35.321   5.1462 0.2322960 7.506555 
1 1 1   24    1  -32 o   22.498   5.7830   24.937   10.663   29.341   14.109   19.071   16.284   23.638   6.8971   19.546   7.4185 4.091568 10.12939 
1 1 1   24    1  -31 o   12.810   5.4002   3.3204   9.6324   1.9189   13.910   4.6114   13.351   14.186   6.2346   14.669   6.2771 -0.4829607 8.847165 
1 1 1   24    1  -30 o   9.2994   4.4422 -10.3452   9.4488   0.7025   13.769 -20.1785   12.990   13.872   6.1450   9.8921   4.8381 3.979922 7.821002 
1 1 1   24    1  -29 f   15.529   5.9486   9.7558   10.532   20.129   17.011   3.3081   13.411   20.107   7.5935   14.405   6.2288 5.702645 9.821380 
1 1 1   24    1  -28 o   27.501   4.5885   34.463   9.9240   36.604   14.245   32.444   13.833   26.964   6.5472   25.280   6.6318 1.684835 9.319183 
1 1 1   24    1  -27 o   13.594   5.4422   5.8642   9.1474   17.619   12.460  -7.8769   13.472   19.057   6.5912   12.031   5.6091 7.025958 8.654823 
1 1 1   24    1  -26 o   20.400   5.4693   19.898   9.2803   4.9023   12.487   38.398   13.870   14.576   6.1468   27.963   6.2431 -13.38740 8.761243 
1 1 1   24    1  -25 o   11.678   5.0279   1.0940   8.6650 -10.5068   12.432   12.053   12.084   11.067   5.2311   16.866   6.3930 -5.798302 8.260468 
1 1 1   24    1  -24 o   14.447   5.3619   8.3526   8.4059   12.410   12.081   4.5451   11.703   17.024   6.4057   14.210   5.9692 2.813993 8.755827 
1 1 1   24    1  -23 f   16.209   5.4187   11.882   8.4121   4.1203   12.158   19.010   11.651   14.281   6.0460   19.781   6.3644 -5.499958 8.778378 
1 1 1   24    1  -22 o   11.421   5.0212  -0.4935   9.0310   3.1311   14.397  -2.8452   11.596   14.890   6.4460   12.202   5.5045 2.687597 8.476505 
1 1 1   24    1  -21 o   22.681   5.1420   23.979   9.2868   8.6529   14.939   33.633   11.856   16.568   6.8336   26.670   5.6306 -10.10214 8.854504 
1 1 1   24    1  -20 o   19.796   5.4945   18.528   9.1790  -1.5392   14.593   31.665   11.807   13.921   6.2360   25.799   5.7603 -11.87755 8.489335 
1 1 1   24    1  -19 o   12.977   5.4907   2.7225   10.018   14.558   14.531  -7.9994   13.830   18.365   6.9990   12.300   5.7173 6.065043 9.037354 
1 1 1   24    1  -18 o   35.535   3.4554   54.304   9.8826   58.020   13.180   49.530   14.937   36.054   4.5885   32.416   5.8687 3.637478 7.449525 
1 1 1   24    1  -17 o   9.5387   4.5398 -10.3869   9.6830 -21.3550   13.969  -0.2411   13.435   10.385   5.0658   13.760   6.0839 -3.374572 7.916831 
1 1 1   24    1  -16 o   21.873   5.6940   22.703   10.250   30.848   12.425   5.3578   18.132   25.328   6.0927   16.786   7.2505 8.542192 9.470504 
1 1 1   24    1  -15 o   13.530   5.5509   4.5684   9.7887   14.425   11.898 -16.0806   17.221   17.961   6.4218   12.640   6.0267 5.320529 8.806830 
1 1 1   24    1  -14 o   32.780   3.6895   46.536   9.6876   33.275   12.747   64.669   14.906   26.374   6.0570   37.886   4.9444 -11.51221 7.818887 
1 1 1   24    1  -13 o   25.157   5.5500   29.647   11.075   54.402   17.573   13.333   14.265   33.463   6.6764   17.995   6.9155 15.46886 9.612432 
1 1 1   24    1  -12 o   34.417   4.1330   51.934   11.364   36.202   17.621   63.135   14.869   26.472   7.7031   37.414   5.0004 -10.94163 9.183742 
1 1 1   24    1  -11 o   12.745   5.5147   0.9727   10.526  -2.4371   21.972   1.9882   11.991   16.545   7.5088   13.737   5.9145 2.808129 9.558430 
1 1 1   24    1  -10 o   21.869   5.6063   22.517   10.040   41.175   17.356   13.133   12.309   28.509   7.4034   17.563   6.4939 10.94622 9.847910 
1 1 1   24    1   -9 o   22.785   5.1005   23.923   9.2367   42.942   14.315   10.356   12.090   30.130   6.0389   16.474   6.3573 13.65592 8.768310 
1 1 1   24    1   -8 o   22.908   5.1174   24.181   9.3146   45.195   14.304   8.7114   12.273   31.058   5.8651   15.952   6.3308 15.10565 8.630136 
1 1 1   24    1   -7 o   17.396   5.6474   13.760   9.1613   30.212   14.314   2.3425   11.923   24.728   6.8605   13.825   5.9242 10.90283 9.064353 
1 1 1   24    1   -6 o   29.135   4.0715   37.231   9.4059   27.554   14.405   44.423   12.419   23.584   6.9928   31.324   5.0341 -7.740059 8.616303 
1 1 1   24    1   -5 o   11.051   4.8921  -1.3722   8.7127   7.3392   13.258  -7.9942   11.559   15.841   6.4751   11.175   5.2052 4.666071 8.307928 
1 1 1   24    1   -4 o   11.466   5.0061  -0.2558   8.8384   3.5100   13.491  -3.0876   11.699   14.821   6.3251   12.313   5.5439 2.508259 8.410787 
1 1 1   24    1   -3 o   17.455   5.6050   13.869   9.0400  -2.6129   13.741   26.448   12.004   13.433   6.0315   23.479   6.1863 -10.04653 8.639940 
1 1 1   24    1   -2 o   15.875   5.5955   10.711   9.0042   20.739   13.740   3.1630   11.921   20.793   6.9246   14.073   5.9736 6.719281 9.145204 
1 1 1   24    1   -1 o   19.028   5.4688   16.828   8.9321   29.245   13.727   7.7092   11.763   24.441   6.6941   15.462   6.1776 8.978973 9.108983 
1 1 1   24    1    0 o   21.518   5.5135   21.663   9.7139   19.239   13.982   23.925   13.506   20.203   6.9824   22.142   6.8161 -1.938658 9.757687 
1 1 1   24    1    1 o   23.569   5.6012   26.022   10.602   26.623   14.034   25.223   16.180   23.253   6.9039   22.541   7.5146 0.7115879 10.20460 
1 1 1   24    1    2 o   13.340   5.5613   3.5394   10.042   9.0945   13.448  -3.4635   15.099   16.462   6.5957   13.867   6.2658 2.595428 9.097430 
1 1 1   24    1    3 o   11.586   5.2667  -4.2419   10.864 -17.4873   15.484   8.6009   15.246   11.698   5.6143   16.849   6.9218 -5.150326 8.912438 
1 1 1   24    1    4 o   8.6180   4.2259 -18.1212   10.109 -32.6736   15.866  -8.1779   13.115   10.170   5.0436   11.987   5.5704 -1.817637 7.514488 
1 1 1   24    1    5 o   28.811   4.7132   37.239   10.687   30.187   16.829   42.004   13.834   24.371   7.6261   29.925   5.8810 -5.554153 9.630316 
1 1 1   24    1    6 o   9.7993   4.6017  -8.0713   9.3429  -7.8891   13.514  -8.2382   12.931   12.242   5.6769   11.876   5.5228 0.3659763 7.920134 
1 1 1   24    1    7 o   33.762   3.7854   49.376   10.239   56.459   14.734   42.761   14.238   35.198   5.2995   30.100   6.0135 5.097633 8.015406 
1 1 1   24    1    8 o   15.334   5.7085   9.2654   9.5413   14.775   13.688   4.0586   13.307   18.443   6.8428   14.882   6.3139 3.560747 9.310701 
1 1 1   24    1    9 o   18.426   5.7539   15.765   9.5856   9.7729   13.574   21.724   13.538   16.685   6.6461   21.158   6.8648 -4.473333 9.554903 
1 1 1   24    1   10 o   12.417   5.2957   1.7132   9.4460  -9.2666   13.385   12.608   13.333   11.908   5.5648   17.579   6.7031 -5.670897 8.711987 
1 1 1   24    1   11 o   28.608   4.4285   36.416   9.9938   40.744   14.482   32.481   13.809   29.150   6.2802   25.784   6.5563 3.365849 9.078878 
1 1 1   24    1   12 o   25.760   4.9230   30.230   9.9607   25.125   14.173   35.212   14.002   22.520   6.9909   26.916   6.4635 -4.395889 9.520970 
1 1 1   24    1   13 o   41.379   3.1734   72.804   10.622   62.684   15.093   82.735   14.952   37.186   5.1146   43.416   4.2806 -6.229355 6.669540 
1 1 1   24    1   14 o   34.580   3.7363   51.808   10.365   41.014   14.869   62.008   14.455   29.094   6.4402   37.123   4.8962 -8.028404 8.090002 
1 1 1   24    1   15 o   14.583   5.6316   7.6240   9.4926  -4.7122   13.697   19.025   13.168   12.908   5.8857   19.965   6.7798 -7.056832 8.978106 
1 1 1   24    1   16 o   17.317   5.7611   13.659   9.5109   15.791   13.562   11.594   13.342   18.715   6.8337   17.166   6.6635 1.549835 9.544695 
1 1 1   24    1   17 o   10.817   4.9177  -3.8275   9.4727   3.8994   13.690 -10.9254   13.121   14.914   6.3684   11.444   5.3986 3.469918 8.348687 
1 1 1   24    1   18 o   14.997   5.7172   8.5205   9.6979   18.559   13.965  -0.8290   13.477   19.774   6.9686   13.630   6.0564 6.144365 9.232600 
1 1 1   24    1   19 o   40.533   3.5731   70.819   11.685   89.613   19.584   60.430   14.560   44.018   5.5836   36.474   5.0312 7.544037 7.515928 
1 1 1   24    1   20 o   20.523   6.6578   20.582   12.734   27.875   18.047   13.353   17.969   23.125   7.9353   18.618   7.5653 4.507137 10.96370 
1 1 1   24    1   21 o   13.949   5.9916   2.7065   12.250  -1.2385   17.543   6.4599   17.112   15.110   6.7971   16.625   7.1100 -1.515764 9.836315 
1 1 1   24    1   22 o   16.204   6.0915   10.833   10.919   17.260   13.976   0.7648   17.493   19.169   6.9465   15.463   6.8835 3.706520 9.779346 
1 1 1   24    1   23 f   18.118   5.8531   15.468   9.8478   26.315   14.242   5.5294   13.632   22.751   6.9985   15.230   6.4226 7.521358 9.498883 
1 1 1   24    1   24 o   15.564   5.8042   9.9776   9.8724   17.241   14.125   3.0408   13.804   19.116   6.9751   14.604   6.3170 4.512288 9.410489 
1 1 1   24    1   25 o   14.974   5.9379   7.8701   10.788 -13.5054   14.109   37.960   16.740   11.444   5.4560   26.914   7.4008 -15.47015 9.194545 
1 1 1   24    1   26 o   43.358   3.1018   80.255   10.890   94.228   15.963   68.090   14.895   46.070   4.3005   38.710   4.8247 7.359375 6.463092 
1 1 1   24    1   27 o   25.358   5.0435   29.963   10.058   28.057   14.519   31.723   13.948   23.273   7.0482   24.979   6.7086 -1.705326 9.730509 
1 1 1   24    1   28 o   12.111   5.3845  -0.9414   10.669  -4.8137   17.081   1.5359   13.662   14.099   6.4823   14.078   6.1832 0.2116299E-01 8.958362 
1 1 1   24    1   29 f   9.8063   4.6209  -8.1316   9.5652  -4.8816   13.704 -11.2195   13.358   12.669   5.8180   11.367   5.3875 1.301820 7.929340 
1 1 1   24    1   30 o   13.099   5.4688   3.9866   9.7323   7.7031   14.372   0.8387   13.227   15.874   6.6378   13.686   6.0446 2.187292 8.977634 
1 1 1   24    1   31 o   13.752   5.5857   5.8323   9.7908   4.8844   14.022   6.7343   13.677   14.969   6.4197   15.362   6.4531 -0.3927717 9.102473 
1 1 1   24    1   32 o   10.083   4.7167  -6.8769   9.6580  -7.2836   13.942  -6.5017   13.392   12.254   5.7108   12.144   5.6382 0.1105356 8.025153 
1 1 1   24    1   33 o   13.465   5.7376   3.6087   11.072   15.212   14.448 -12.8999   17.233   18.056   6.9542   12.744   6.0627 5.311840 9.225903 
1 1 1   24    1   34 o   25.480   5.5601   31.588   11.223   42.433   14.569   15.758   17.601   28.966   6.3461   18.553   7.5061 10.41303 9.829250 
1 1 1   24    1   35 o   11.905   5.3454  -1.4332   10.794  -6.2424   13.990   5.6389   16.965   12.380   5.7531   15.849   6.9275 -3.468794 9.004958 
1 1 1   24    1   36 o   17.148   6.2472   14.048   11.325   21.833   14.810   3.0884   17.573   20.231   7.1720   15.428   6.8816 4.802988 9.939528 
1 1 1   24    1   37 o   13.213   5.6138   3.8374   10.545  -5.5564   14.176   15.475   15.779   12.531   5.8121   18.066   7.1756 -5.535237 9.234148 
1 1 1   24    1   38 o   13.978   5.8727   5.4583   11.331 -40.1865   16.038   50.954   16.012   9.3395   4.6965   31.454   6.4612 -22.11473 7.987761 
1 1 1   24    1   39 o   10.554   4.9703  -7.8909   11.037   5.1310   16.190 -19.1973   15.085   15.338   6.7339   10.864   5.2914 4.474428 8.564122 
1 1 1   24    1   40 o   19.402   6.8503   20.084   13.500  -1.5719   24.103   29.983   16.296   16.085   7.5003   22.800   7.5396 -6.715269 10.63487 
1 1 1   24    1   41 o   16.762   6.9368   11.906   15.463   0.0000   0.0000   11.906   15.463  ?   ?    16.762   6.9368 0.000000 6.936847 
1 1 1   24    1   42 o   26.707   6.3907   37.588   13.726   43.814   23.904   34.525   16.766   25.237   9.0928   24.222   7.6164 1.015104 11.86125 
1 1 1   24    1   43 o   16.334   6.9472   10.340   16.179  -1.7224   23.376   21.431   22.416   15.678   7.3355   19.546   8.2388 -3.867550 11.03126 
1 1 1   24    1   44 o   22.910   6.8399   29.444   13.745   4.6512   23.582   42.201   16.915   16.521   7.6034   26.888   7.4573 -10.36717 10.64999 
1 1 1   24    1   45 o   16.226   6.2683   12.713   11.763  -2.9448   16.557   28.675   16.716   13.548   6.2829   21.691   7.6258 -8.143590 9.880666 
1 1 1   24    1   46 o   23.719   6.1146   30.011   11.898   32.819   17.323   27.504   16.369   22.887   7.7763   21.230   7.5386 1.657207 10.83056 
1 1 1   24    1   47 o   12.158   5.4860  -0.3079   11.529   16.368   16.626 -15.7551   16.002   17.626   7.2331   11.411   5.5330 6.214434 9.106728 
1 1 1   24    1   48 o   27.413   5.6303   38.548   12.160   29.985   17.564   46.432   16.852   21.630   7.7941   28.105   7.2937 -6.474749 10.67449 
1 1 1   24    1   49 o   12.888   5.6860   2.6440   11.675  -2.6998   16.618   7.8517   16.406   13.425   6.2492   15.391   6.7671 -1.965798 9.211248 
1 1 1   24    1   50 o   21.151   6.4300   25.196   12.068   5.5844   17.241   44.031   16.896   15.040   6.7545   26.948   7.4451 -11.90718 10.05252 
1 1 1   24    1   51 o   29.375   5.3722   43.664   12.390   31.164   17.749   55.545   17.303   21.749   7.8353   31.155   6.9862 -9.406227 10.49762 
1 1 1   24    1   52 o   24.696   7.4926   38.006   16.397   17.555   23.489   57.445   22.900   17.964   7.9880   28.237   8.9044 -10.27324 11.96232 
1 1 1   24    1   53 o   14.293   6.4046   4.4100   15.407   2.6826   21.755   6.1484   21.824   15.334   7.1420   15.860   7.3049 -0.5266066 10.21610 
1 1 1   24    1   54 o   12.435   5.8636  -5.7133   15.452  -4.0871   22.437  -7.1803   21.311   14.532   6.9145   13.905   6.6501 0.6264915 9.593465 
1 1 1   24    1   55 o   12.403   5.8349  -5.0542   15.143  -8.5879   21.576  -1.6238   21.258   13.758   6.6091   14.546   6.8646 -0.7878160 9.529052 
1 1 1   24    1   56 o   13.864   6.3136   2.4853   15.698  -9.8254   22.493   14.174   21.917   13.790   6.6556   17.005   7.6279 -3.215613 10.12333 
1 1 1   24    1   57 f   13.537   6.1864   1.6038   15.245  -2.2421   22.310   4.9727   20.880   14.576   6.9239   15.308   7.0839 -0.7319279 9.905613 
1 1 1   24    1   58 f   11.500   5.5366 -11.1089   15.336 -33.5451   21.906   10.459   21.477   11.478   5.7301   16.204   7.3814 -4.726510 9.344456 
1 1 1   24    1   59 o   14.006   6.3464   3.7868   15.621   19.531   22.568 -10.6955   21.644   17.823   7.8824   13.395   6.4807 4.427256 10.20452 
1 1 1   24    1   60 o   12.191   5.7827  -6.2894   15.452 -23.0609   21.992   10.064   21.716   12.282   6.0634   16.096   7.3665 -3.814023 9.540977 
1 1 1   24    1   61 o   17.760   7.2001   19.466   16.233   45.100   23.803  -2.8242   22.196   23.166   8.9252   14.340   6.8384 8.826467 11.24381 
1 1 1   24    1   62 o   11.892   5.6916  -8.5632   15.676 -17.6124   22.452   0.0447   21.897   12.820   6.2889   14.602   6.9139 -1.781725 9.346289 
1 1 1   24    1   63 o   12.590   5.9173  -3.3124   15.507 -11.7918   22.465   4.4053   21.432   13.335   6.4865   15.058   7.0382 -1.722900 9.571364 
1 1 1   24    1   64 o   12.839   6.0114  -2.0535   15.748   13.420   22.469 -16.9931   22.078   16.481   7.5237   12.718   6.2383 3.762558 9.773549 
1 1 1   24    1   65 o   12.310   5.8191  -4.5852   15.391  -5.4792   22.418  -3.7881   21.168   13.925   6.7015   13.871   6.6320 0.5418873E-01 9.428388 
1 1 1   24    1   66 o   8.4694   4.2950 -42.3521   15.183 -50.3992   21.752 -34.7053   21.204   10.243   5.1884   11.036   5.5285 -0.7930841 7.581859 
1 1 1   24    1   67 o   11.530   5.5471  -9.5128   15.331 -28.8315   21.947   8.8984   21.425   11.630   5.7949   15.533   7.1839 -3.903231 9.229787 
1 1 1   24    1   68 o   15.865   6.7835   13.632   15.571   27.354   22.820   1.6778   21.299   18.705   8.1066   14.456   6.8371 4.248900 10.60481 
1 1 1   24    1   69 f   16.239   6.9248   15.255   16.148  -2.1795   22.342   34.325   23.366   14.109   6.7639   19.967   8.4137 -5.858092 10.79538 
1 1 1   24    1   70 o   12.190   5.7880  -4.9253   15.553 -33.9517   21.924   24.484   22.068   11.205   5.6143   18.099   7.9062 -6.894598 9.696809 
1 1 1   24    1   71 o   15.398   6.7580   11.677   16.293   35.728   23.382 -11.0201   22.715   20.254   8.4679   13.246   6.4610 7.007487 10.65125 
1 1 1   24    1   72 o   12.795   6.2756 -15.0950   22.326 -15.0950   22.326   0.0000   0.0000   12.795   6.2756  ?   ?  0.000000 6.275574 
1 1 1   24    2  -60 o   13.325   6.5698 -17.9307   25.542   0.0000   0.0000 -17.9307   25.542  ?   ?    13.325   6.5698 0.000000 6.569829 
1 1 1   24    2  -59 o   15.392   7.3269   3.9087   25.243   0.0000   0.0000   3.9087   25.243  ?   ?    15.392   7.3269 0.000000 7.326922 
1 1 1   24    2  -58 o   19.913   8.6754   34.623   26.421   0.0000   0.0000   34.623   26.421  ?   ?    19.913   8.6754 0.000000 8.675443 
1 1 1   24    2  -57 o   15.628   7.4004   5.2529   25.095   0.0000   0.0000   5.2529   25.095  ?   ?    15.628   7.4004 0.000000 7.400361 
1 1 1   24    2  -56 o   15.993   7.0516   12.377   17.930 -20.4594   24.800   48.334   25.951   13.093   6.4590   23.052   9.1871 -9.958866 11.23038 
1 1 1   24    2  -55 o   17.936   7.4038   20.528   17.554   39.114   24.472   0.8265   25.195   21.429   8.7827   15.221   7.2662 6.208310 11.39879 
1 1 1   24    2  -54 o   15.904   6.4150   13.357   12.812   18.460   23.998   11.323   15.153   17.551   7.9177   15.538   6.6687 2.012821 10.35186 
1 1 1   24    2  -53 o   18.019   8.0718   20.994   24.452   20.994   24.452   0.0000   0.0000   18.019   8.0718  ?   ?  0.000000 8.071757 
1 1 1   24    2  -52 o   14.427   6.1498   8.3690   12.727 -11.9553   24.400   15.965   14.916   13.856   6.7447   16.828   6.8722 -2.971864 9.629007 
1 1 1   24    2  -51 o   20.031   6.7620   24.291   13.098   35.696   25.025   19.988   15.371   20.866   8.7445   18.080   7.1131 2.785900 11.27222 
1 1 1   24    2  -50 o   14.755   6.2212   9.2430   12.787   11.107   25.290   8.6028   14.821   16.736   7.7627   14.945   6.5046 1.790962 10.12769 
1 1 1   24    2  -49 o   14.017   6.0706   6.4541   12.780   33.018   26.048  -1.9681   14.667   20.390   8.7473   12.731   5.9074 7.659150 10.55517 
1 1 1   24    2  -48 o   26.217   6.4518   38.673   13.693   50.008   26.091   34.364   16.086   24.231   9.3421   23.175   7.4801 1.056749 11.96773 
1 1 1   24    2  -47 o   14.193   6.3878   4.0447   15.516  -3.1683   25.207   8.4449   19.688   15.144   7.2398   15.841   7.1567 -0.6974497 10.18004 
1 1 1   24    2  -46 o   21.307   7.3727   28.671   15.590   50.601   26.124   16.541   19.430   24.576   9.3800   17.456   7.5224 7.119598 12.02377 
1 1 1   24    2  -45 f   19.872   7.3091   24.553   15.558   13.021   25.092   31.755   19.830   17.278   7.9115   21.329   8.1645 -4.051214 11.36887 
1 1 1   24    2  -44 o   21.900   6.3741   27.006   12.064   14.907   25.953   30.341   13.625   17.666   8.0728   22.751   6.8143 -5.085051 10.56430 
1 1 1   24    2  -43 f   24.077   6.2015   31.749   12.245   4.5256   26.576   39.086   13.797   16.399   7.7197   26.561   6.4399 -10.16209 10.05313 
1 1 1   24    2  -42 o   9.7037   4.6446  -9.5917   10.441 -21.0145   17.936  -3.7366   12.841   11.465   5.6235   11.890   5.5207 -0.4253435 7.880460 
1 1 1   24    2  -41 o   20.453   6.0723   22.779   10.857   23.870   18.432   22.199   13.435   19.530   7.7559   19.556   6.8394 -0.2577019E-01 10.34079 
1 1 1   24    2  -40 o   16.884   6.1074   14.936   10.797  -2.3668   18.270   24.223   13.385   13.974   6.5206   20.433   6.8352 -6.458980 9.446593 
1 1 1   24    2  -39 o   10.175   4.7602  -5.5844   9.8406   6.9226   14.876 -15.3152   13.122   14.933   6.5078   10.237   4.9745 4.696324 8.191232 
1 1 1   24    2  -38 o   11.176   5.0776  -1.7759   10.079   5.5534   15.363  -7.3133   13.354   14.782   6.5221   11.560   5.4512 3.221660 8.500212 
1 1 1   24    2  -37 o   16.780   5.9727   14.360   10.280   9.6391   15.407   18.149   13.803   15.825   6.7565   18.246   6.8510 -2.421149 9.622172 
1 1 1   24    2  -36 o   25.175   5.3693   31.647   10.682   28.136   13.904   36.706   16.688   22.233   6.9278   24.735   7.5697 -2.501348 10.26135 
1 1 1   24    2  -35 o   8.6590   4.2009 -12.3822   9.2582  -9.8758   13.133 -14.8586   13.054   11.129   5.2939   10.357   5.0161 0.7718678 7.292915 
1 1 1   24    2  -34 o   13.279   5.4409   5.8475   9.3892   14.373   13.454  -2.2471   13.109   17.117   6.6782   12.538   5.7325 4.579012 8.801110 
1 1 1   24    2  -33 o   18.659   5.7922   17.812   9.7292  -3.4965   13.629   39.954   13.893   12.529   5.7713   27.628   6.3081 -15.09919 8.549823 
1 1 1   24    2  -32 o   30.013   4.2545   41.401   10.117   41.491   14.426   41.314   14.193   28.090   6.4383   28.127   6.3421 -0.3751373E-01 9.037379 
1 1 1   24    2  -31 o   11.454   5.0822  -0.1275   9.4570  -6.3056   13.340   6.1147   13.409   11.927   5.5677   14.719   6.2944 -2.792182 8.403499 
1 1 1   24    2  -30 o   14.722   5.6513   9.1930   9.5189   3.7520   13.774   14.167   13.169   14.254   6.2360   17.195   6.6350 -2.940463 9.105584 
1 1 1   24    2  -29 o   35.586   4.6382   58.819   13.134   78.563   28.810   53.639   14.757   34.013   9.8357   32.996   5.6922 1.017075 11.36407 
1 1 1   24    2  -28 o   29.384   5.0096   41.010   11.569   25.233   19.086   50.174   14.547   20.973   8.0143   31.808   5.8250 -10.83542 9.907557 
1 1 1   24    2  -27 o   11.236   5.1421  -3.5373   10.582   25.018   17.685 -19.4632   13.207   21.040   7.7831   9.9659   4.8750 11.07437 9.183838 
1 1 1   24    2  -26 o   11.860   5.1844   0.9320   9.5041   12.264   14.089  -8.5312   12.875   16.835   6.7490   11.409   5.3713 5.426474 8.625559 
1 1 1   24    2  -25 o   11.614   5.1477  -0.2734   9.6762   19.841   13.865 -19.3726   13.510   19.493   6.9364   10.151   4.9580 9.342082 8.526171 
1 1 1   24    2  -24 o   20.979   5.6341   21.828   9.8378   34.730   14.201   9.9229   13.641   25.693   6.7092   16.087   6.5711 9.605604 9.391033 
1 1 1   24    2  -23 o   17.712   5.9238   15.346   10.053   31.903   14.248  -1.0716   14.188   24.509   6.8615   13.483   6.0848 11.02539 9.170938 
1 1 1   24    2  -22 o   18.688   6.2137   17.434   11.065   15.792   14.331   19.857   17.409   18.170   6.9444   19.696   7.6210 -1.525587 10.31041 
1 1 1   24    2  -21 o   12.588   5.5036   1.1812   10.714  -2.2520   13.788   6.4141   17.022   13.112   5.9499   16.108   6.9911 -2.995486 9.180209 
1 1 1   24    2  -20 o   13.967   5.8051   5.4313   10.894   4.9018   14.145   6.2032   17.080   14.935   6.4269   16.110   6.9974 -1.175164 9.500991 
1 1 1   24    2  -19 o   22.321   5.5376   24.257   10.027   16.842   14.433   31.175   13.941   18.647   7.0048   24.454   6.7651 -5.807791 9.738273 
1 1 1   24    2  -18 o   11.555   5.1480  -1.0771   9.8036 -27.2589   14.068   23.646   13.670   9.6284   4.7706   21.308   6.8970 -11.68006 8.386156 
1 1 1   24    2  -17 o   13.251   5.4740   4.6628   9.6053   1.8165   13.884   7.2754   13.302   14.141   6.2213   15.393   6.4075 -1.251293 8.930901 
1 1 1   24    2  -16 o   17.578   6.0725   14.691   10.575   22.284   17.313   10.173   13.356   20.702   7.6929   16.314   6.5603 4.388269 10.11034 
1 1 1   24    2  -15 o   25.240   4.9777   29.784   9.8774   30.632   14.308   29.012   13.653   24.246   6.9065   23.706   6.7444 0.5398922 9.653367 
1 1 1   24    2  -14 o   30.654   4.1840   42.063   10.182   22.156   14.251   62.824   14.553   20.762   7.0531   36.929   4.9598 -16.16672 8.622384 
1 1 1   24    2  -13 o   13.891   5.5991   6.1556   9.7527   20.787   14.014  -7.5855   13.581   20.250   6.9908   12.092   5.6355 8.158236 8.979476 
1 1 1   24    2  -12 o   31.508   4.5984   45.132   11.462   47.694   14.671   41.118   18.365   31.370   5.9550   27.407   7.8305 3.962706 9.837626 
1 1 1   24    2  -11 o   12.764   5.5171   1.7196   10.514   1.8989   13.845   1.4753   16.162   14.224   6.2365   14.969   6.6429 -0.7453318 9.111661 
1 1 1   24    2  -10 o   20.578   5.9813   20.806   10.629   30.569   14.033   7.6651   16.281   24.399   6.8018   16.458   6.9832 7.940649 9.748309 
1 1 1   24    2   -9 o   32.866   4.2462   48.260   11.110   48.682   14.527   47.666   17.245   31.871   5.8055   30.416   7.0874 1.455050 9.161633 
1 1 1   24    2   -8 o   23.854   5.6512   27.423   10.819   22.550   14.082   34.443   16.901   21.036   7.0104   25.341   7.5892 -4.305599 10.33159 
1 1 1   24    2   -7 o   24.403   5.4905   28.420   10.657   30.318   16.731   27.125   13.824   23.799   7.6237   22.995   6.8581 0.8046150 10.25449 
1 1 1   24    2   -6 o   22.027   5.9530   23.768   10.941   22.296   14.591   25.660   16.537   20.932   7.1362   22.100   7.5955 -1.167820 10.42195 
1 1 1   24    2   -5 o   15.572   6.2248   8.6765   11.949   47.215   17.778 -23.0817   16.139   30.111   7.3162   11.133   5.4336 18.97761 9.113257 
1 1 1   24    2   -4 o   14.152   5.9490   4.6115   11.637   20.358   17.400  -8.1315   15.653   20.323   7.6788   12.988   6.0524 7.334394 9.777246 
1 1 1   24    2   -3 o   27.227   5.8009   35.677   12.480   52.411   18.446   21.548   16.949   31.851   7.2657   20.690   7.6256 11.16076 10.53282 
1 1 1   24    2   -2 o   13.762   5.6953   4.8844   10.424  -2.5393   22.019   7.0285   11.834   16.164   7.4050   14.992   6.1216 1.171360 9.607673 
1 1 1   24    2   -1 o   35.536   3.7203   55.139   10.617   36.458   17.730   65.583   13.257   25.990   7.7705   38.362   4.3140 -12.37205 8.887744 
1 1 1   24    2    0 o   25.511   5.1098   30.374   10.255   13.708   17.425   39.204   12.685   18.379   7.4566   28.713   5.6208 -10.33445 9.337776 
1 1 1   24    2    1 o   46.301   2.9636   91.144   11.126   93.575   19.236   89.922   13.640   44.910   5.3603   45.461   3.7130 -0.5503616 6.520697 
1 1 1   24    2    2 o   12.558   5.2929   2.8696   9.2508  -9.8350   14.280   12.057   12.143   12.087   5.6801   16.839   6.4028 -4.752229 8.559155 
1 1 1   24    2    3 o   13.248   5.3785   5.0219   9.0727  -2.8782   13.940   10.827   11.950   13.234   5.9960   16.341   6.3164 -3.107595 8.709192 
1 1 1   24    2    4 o   27.432   4.3960   33.939   9.4980   29.988   14.685   36.781   12.453   24.072   7.0401   27.725   5.7009 -3.652390 9.058870 
1 1 1   24    2    5 o   29.330   4.1319   38.316   9.6054   52.024   14.785   28.305   12.635   33.112   5.6822   23.798   6.3825 9.313633 8.545394 
1 1 1   24    2    6 o   11.600   5.0745   0.1240   9.1195   12.790   13.880  -9.4969   12.097   17.418   6.7866   11.039   5.2000 6.379427 8.549727 
1 1 1   24    2    7 o   29.900   4.1448   39.839   9.8306   35.584   15.027   43.023   12.998   26.321   6.9153   30.185   5.4846 -3.863340 8.826177 
1 1 1   24    2    8 o   26.839   4.5762   32.804   9.6528   28.039   15.034   36.145   12.591   23.158   7.2020   27.363   5.8238 -4.204847 9.262087 
1 1 1   24    2    9 o   27.514   4.8143   34.829   10.404   29.308   15.181   39.720   14.287   23.628   7.2178   28.294   6.3509 -4.666054 9.614034 
1 1 1   24    2   10 o   30.025   4.4238   40.681   10.503   39.674   15.263   41.586   14.475   27.910   6.7775   28.997   6.3040 -1.086611 9.256089 
1 1 1   24    2   11 o   20.885   5.7305   21.235   10.049   6.6236   14.586   34.437   13.865   15.688   6.6311   26.122   6.5296 -10.43396 9.306253 
1 1 1   24    2   12 o   42.588   3.5415   78.744   12.183   93.673   20.350   70.403   15.211   44.387   5.7600   39.229   4.8606 5.157589 7.536800 
1 1 1   24    2   13 o   18.315   6.1694   16.190   10.903   18.427   18.425   14.984   13.525   19.682   7.7740   18.035   6.7796 1.646898 10.31491 
1 1 1   24    2   14 o   20.704   6.1481   21.330   11.129   33.217   18.624   14.729   13.879   24.386   8.0601   17.976   6.8427 6.410172 10.57296 
1 1 1   24    2   15 o   19.637   6.7031   19.313   12.874   10.079   18.667   27.689   17.778   17.525   7.4584   22.526   7.8684 -5.000734 10.84154 
1 1 1   24    2   16 o   22.444   6.0736   25.108   11.380   20.077   14.598   32.902   18.169   19.908   7.1138   24.275   7.9579 -4.367554 10.67399 
1 1 1   24    2   17 o   17.889   6.2890   15.329   11.369   14.098   14.532   17.271   18.254   17.790   6.9407   19.227   7.6909 -1.436979 10.35973 
1 1 1   24    2   18 o   36.860   4.0234   60.396   11.893   54.102   15.206   70.308   19.084   33.470   5.7826   37.538   6.4702 -4.068092 8.677630 
1 1 1   24    2   19 o   22.356   5.6067   24.423   10.198   24.372   14.926   24.468   13.966   21.430   7.2185   21.579   6.9702 -0.1489773 10.03448 
1 1 1   24    2   20 o   11.840   5.2321  -0.1784   9.9230  -4.8563   14.456   3.9896   13.646   12.897   5.9419   14.533   6.2835 -1.635636 8.648052 
1 1 1   24    2   21 o   9.6618   4.6373 -11.9492   10.569  -8.2589   14.114 -16.6602   15.946   12.117   5.6791   11.684   5.6303 0.4331636 7.996979 
1 1 1   24    2   22 o   22.717   5.5054   25.211   10.087   38.766   15.032   14.110   13.604   27.210   6.7975   17.510   6.7470 9.700693 9.577504 
1 1 1   24    2   23 o   21.306   5.7936   22.643   10.325   3.2998   15.074   39.741   14.172   14.769   6.4904   27.928   6.3671 -13.15923 9.092038 
1 1 1   24    2   24 o   27.967   4.7806   36.519   10.507   24.181   15.159   47.928   14.577   21.106   7.2715   31.089   5.9690 -9.982836 9.407645 
1 1 1   24    2   25 o   13.997   5.6595   6.7172   9.9996   10.760   14.681   3.2192   13.657   16.525   6.7909   14.215   6.2142 2.310427 9.205041 
1 1 1   24    2   26 o   14.354   5.6941   7.7886   9.9240   1.8374   14.594   12.908   13.535   14.188   6.3035   16.953   6.6733 -2.765159 9.179667 
1 1 1   24    2   27 o   11.666   5.2977  -2.5058   10.958  -9.5258   17.779   1.7956   13.917   13.265   6.2656   13.917   6.1707 -0.6518250 8.794015 
1 1 1   24    2   28 o   14.268   5.7097   7.5610   10.065  -9.1850   14.421   23.468   14.055   11.970   5.6507   20.775   7.0047 -8.804554 8.999748 
1 1 1   24    2   29 o   19.408   5.8997   19.184   10.159   12.764   14.781   24.932   13.987   16.991   6.8769   21.330   6.9816 -4.339001 9.799772 
1 1 1   24    2   30 o   11.782   5.2222   0.0922   9.9590  -9.0229   14.479   8.2775   13.720   11.981   5.6575   15.435   6.4721 -3.454053 8.596270 
1 1 1   24    2   31 o   22.047   5.9694   25.047   10.989   26.640   14.805   23.092   16.399   21.759   7.1861   20.257   7.4947 1.501266 10.38320 
1 1 1   24    2   32 o   11.424   5.2204  -2.9576   10.852   4.0096   14.662 -11.3986   16.139   14.529   6.3925   12.255   5.8405 2.273908 8.658800 
1 1 1   24    2   33 o   10.540   4.9934  -8.7990   11.450  -9.5994   16.670  -8.0841   15.755   12.687   6.0147   12.571   5.9258 0.1159210 8.443397 
1 1 1   24    2   34 o   15.626   6.2077   10.678   11.812   7.9755   17.106   13.141   16.331   15.961   6.9667   17.082   7.1043 -1.121526 9.950152 
1 1 1   24    2   35 o   30.973   5.0517   46.373   12.315   53.455   17.852   39.943   17.011   30.830   7.2297   25.980   7.5711 4.849644 10.46848 
1 1 1   24    2   36 o   8.5722   4.2493 -21.4725   11.209 -21.8596   16.567 -21.1456   15.223   11.025   5.4070   10.547   5.1747 0.4780560 7.484138 
1 1 1   24    2   37 o   17.666   6.8442   16.473   14.054   17.344   17.667   14.972   23.193   18.084   7.4425   17.998   7.9738 0.8663368E-01 10.90742 
1 1 1   24    2   38 o   17.935   6.8529   17.466   13.954   13.013   16.944   26.851   24.597   16.838   7.1335   20.211   8.5799 -3.372864 11.15800 
1 1 1   24    2   39 o   13.376   6.0103   1.6151   13.673   7.2109   17.040  -8.5025   22.912   15.463   6.8436   14.393   6.8868 1.069998 9.708947 
1 1 1   24    2   40 o   20.255   7.0334   24.224   14.194   33.137   17.278   5.7240   24.893   22.768   7.7656   16.490   7.6666 6.278330 10.91245 
1 1 1   24    2   41 o   32.154   5.7639   53.349   14.552   52.453   25.640   53.774   17.675   25.736   9.3964   30.379   7.2406 -4.643772 11.86252 
1 1 1   24    2   42 o   15.102   6.1236   10.193   11.744   15.664   17.070   5.2758   16.183   17.283   7.2313   14.744   6.5883 2.539337 9.782474 
1 1 1   24    2   43 f   16.114   6.2586   13.172   11.774   21.314   16.559   4.8470   16.745   18.796   7.3865   14.745   6.6363 4.050962 9.929808 
1 1 1   24    2   44 o   16.716   6.2720   14.864   11.564   5.8114   16.610   23.379   16.109   14.876   6.6590   19.435   7.3780 -4.558595 9.938690 
1 1 1   24    2   45 f   12.019   5.4641  -0.6406   11.697 -27.2591   17.011   23.234   16.111   10.483   5.2031   19.350   7.3707 -8.866478 9.022162 
1 1 1   24    2   46 o   9.9888   4.8970 -18.0914   13.549 -13.0122   17.190 -26.4233   22.016   12.022   5.8062   12.185   6.0248 -0.1630049 8.367217 
1 1 1   24    2   47 o   20.148   6.8685   24.326   13.517   21.696   23.578   25.614   16.496   18.554   8.1368   19.985   7.4928 -1.431189 11.06116 
1 1 1   24    2   48 o   25.925   7.6297   42.859   17.202   53.795   24.338   31.944   24.315   25.959   9.1949   20.469   8.6016 5.489521 12.59101 
1 1 1   24    2   49 o   33.039   7.0307   63.592   18.353   46.938   26.025   80.068   25.886   23.379   9.2377   32.956   9.2564 -9.576887 13.07731 
1 1 1   24    2   50 o   23.257   7.8034   36.543   17.444   18.239   24.792   54.491   24.549   17.757   8.0258   25.796   9.2243 -8.038431 12.22707 
1 1 1   24    2   51 o   12.597   5.9594  -5.3857   16.200 -16.8854   22.765   6.4117   23.058   13.064   6.3926   15.779   7.3505 -2.715184 9.741426 
1 1 1   24    2   52 o   13.607   6.2966   0.5774   16.493 -14.0055   23.616   14.462   23.043   13.495   6.5836   16.930   7.6861 -3.435070 10.12031 
1 1 1   24    2   53 o   11.969   5.9516 -29.1871   22.670   0.0000   0.0000 -29.1871   22.670  ?   ?    11.969   5.9516 0.000000 5.951588 
1 1 1   24    2   54 o   15.540   7.2653   5.6712   22.857   0.0000   0.0000   5.6712   22.857  ?   ?    15.540   7.2653 0.000000 7.265258 
1 1 1   24    2   55 o   20.027   8.5501   32.688   24.670   0.0000   0.0000   32.688   24.670  ?   ?    20.027   8.5501 0.000000 8.550139 
1 1 1   24    2   56 o   13.786   6.6783  -8.9679   23.175   0.0000   0.0000  -8.9679   23.175  ?   ?    13.786   6.6783 0.000000 6.678318 
1 1 1   24    2   57 o   12.050   5.9649 -24.0287   21.804   0.0000   0.0000 -24.0287   21.804  ?   ?    12.050   5.9649 0.000000 5.964888 
1 1 1   24    2   58 o   10.010   5.0847 -56.0729   21.908   0.0000   0.0000 -56.0729   21.908  ?   ?    10.010   5.0847 0.000000 5.084738 
1 1 1   24    2   59 o   16.051   6.9321   13.717   16.570   15.235   23.983   12.330   22.920   16.760   7.6966   16.260   7.4879 0.4994583 10.73806 
1 1 1   24    2   60 o   13.492   6.2491   1.3895   16.301  -1.1579   23.364   3.8059   22.755   14.518   6.9485   15.025   7.0942 -0.5069962 9.930261 
1 1 1   24    2   61 o   15.570   6.8146   11.956   16.464   9.0466   23.951   14.562   22.670   15.802   7.4037   16.500   7.5418 -0.6974220 10.56850 
1 1 1   24    2   62 o   13.659   6.2866   2.9532   16.124   11.740   23.546  -4.8068   22.127   16.069   7.4658   13.807   6.6481 2.261794 9.996795 
1 1 1   24    2   63 o   14.090   6.4166   5.3587   16.215   3.6572   23.587   6.8835   22.328   14.978   7.1161   15.236   7.1417 -0.2585230 10.08181 
1 1 1   24    2   64 o   16.719   7.0397   17.379   16.338   15.010   23.423   19.624   22.799   16.417   7.5637   17.132   7.7241 -0.7142773 10.81069 
1 1 1   24    2   65 o   21.429   7.6330   33.308   16.793   26.076   23.793   40.487   23.706   18.179   8.0641   21.112   8.6473 -2.932642 11.82398 
1 1 1   24    2   66 o   15.504   6.7936   12.362   16.407   16.700   23.394   8.1625   23.016   16.653   7.6304   15.411   7.2323 1.241762 10.51329 
1 1 1   24    2   67 o   15.032   6.6613   10.288   16.195   16.787   23.268   4.1830   22.553   16.668   7.6269   14.846   7.0255 1.822031 10.36959 
1 1 1   24    2   68 o   17.149   7.9896   19.239   27.253   19.239   27.253   0.0000   0.0000   17.149   7.9896  ?   ?  0.000000 7.989589 
1 1 1   24    3  -58 o   16.140   7.5723   12.819   25.199   0.0000   0.0000   12.819   25.199  ?   ?    16.140   7.5723 0.000000 7.572317 
1 1 1   24    3  -57 o   14.992   7.1900   2.4746   25.293   0.0000   0.0000   2.4746   25.293  ?   ?    14.992   7.1900 0.000000 7.189952 
1 1 1   24    3  -56 o   11.794   5.6141  -6.0150   14.822   0.0000   0.0000  -6.0150   14.822  ?   ?    11.794   5.6141 0.000000 5.614146 
1 1 1   24    3  -55 o   15.044   6.8451   8.5463   18.402   0.0000   0.0000   8.5463   18.402  ?   ?    15.044   6.8451 0.000000 6.845052 
1 1 1   24    3  -54 o   22.120   8.2481   38.577   19.935   0.0000   0.0000   38.577   19.935  ?   ?    22.120   8.2481 0.000000 8.248107 
1 1 1   24    3  -53 o   13.287   6.0645   2.6789   14.588   15.454   23.809  -5.0012   18.460   16.691   7.6663   13.033   6.2210 3.658287 9.872870 
1 1 1   24    3  -52 o   20.569   7.3443   28.771   15.556  -2.9856   24.389   50.551   20.198   14.474   6.9720   25.989   8.3812 -11.51478 10.90200 
1 1 1   24    3  -51 o   10.667   5.1267  -9.7254   13.018 -14.2064   23.758  -7.8028   15.562   13.300   6.5128   11.873   5.6793 1.427371 8.641247 
1 1 1   24    3  -50 o   10.466   5.0485 -10.8984   12.900   3.0720   24.266 -16.4016   15.230   15.221   7.2277   10.693   5.2317 4.528045 8.922476 
1 1 1   24    3  -49 o   14.001   6.1231   6.8193   13.269   5.2017   24.616   7.4818   15.754   15.560   7.3564   14.629   6.5212 0.9305449 9.830732 
1 1 1   24    3  -48 o   23.408   6.7157   33.031   13.481   39.399   24.618   30.304   16.112   21.352   8.7862   21.146   7.4820 0.2060051 11.54026 
1 1 1   24    3  -47 o   10.945   5.2165  -7.9161   12.877 -14.1113   24.221  -5.4752   15.203   13.528   6.6141   12.178   5.7647 1.349310 8.773706 
1 1 1   24    3  -46 o   14.291   6.2015   7.5983   13.390   4.3947   25.654   8.7977   15.698   15.701   7.4486   14.987   6.6035 0.7136507 9.954324 
1 1 1   24    3  -45 o   11.511   5.3981  -4.4501   12.783   74.331   25.234 -31.6499   14.827   30.947   9.2742   9.1291   4.5803 21.81785 10.34365 
1 1 1   24    3  -44 o   12.525   5.7251   0.1854   13.066 -20.5122   25.168   7.8213   15.287   13.250   6.5308   14.746   6.5060 -1.495658 9.218394 
1 1 1   24    3  -43 o   23.857   6.7759   33.981   13.792   19.592   26.512   39.320   16.149   17.882   8.1669   24.804   7.4160 -6.922024 11.03155 
1 1 1   24    3  -42 o   16.421   6.9255   14.126   15.853   0.0000   0.0000   14.126   15.853  ?   ?    16.421   6.9255 0.000000 6.925487 
1 1 1   24    3  -41 o   21.687   7.5606   31.090   16.410   0.0000   0.0000   31.090   16.410  ?   ?    21.687   7.5606 0.000000 7.560623 
1 1 1   24    3  -40 o   11.880   5.6680  -8.5571   15.283   0.0000   0.0000  -8.5571   15.283  ?   ?    11.880   5.6680 0.000000 5.667953 
1 1 1   24    3  -39 o   12.037   5.5834  -2.8576   13.084   26.330   25.593 -13.1865   15.225   19.259   8.4607   11.249   5.4406 8.010455 10.05901 
1 1 1   24    3  -38 o   19.670   6.5600   22.531   12.330  -0.1878   25.815   29.245   14.034   15.540   7.4007   21.966   6.9763 -6.425829 10.17051 
1 1 1   24    3  -37 o   9.3845   4.5882 -15.6381   11.652 -16.4893   24.377 -15.3860   13.266   13.632   6.6589   10.181   4.9596 3.451507 8.302883 
1 1 1   24    3  -36 o   11.405   5.2975  -3.7363   11.843  -4.0650   25.021  -3.6414   13.444   15.029   7.1926   12.064   5.6174 2.965405 9.126247 
1 1 1   24    3  -35 o   17.566   6.1999   16.963   11.058   1.5284   17.963   26.382   14.031   14.347   6.6148   20.885   6.9985 -6.537366 9.629931 
1 1 1   24    3  -34 o   16.784   5.8254   14.900   9.7364   3.3871   13.665   26.770   13.876   13.611   6.0699   21.128   6.9559 -7.517130 9.231942 
1 1 1   24    3  -33 o   12.977   5.4495   5.4009   9.7491   19.293   13.826  -8.3362   13.749   18.297   6.8596   11.432   5.4320 6.864981 8.749881 
1 1 1   24    3  -32 o   10.154   4.7279  -4.6158   9.5213 -21.6873   13.387   12.858   13.544   9.5474   4.7166   16.176   6.5699 -6.628695 8.087611 
1 1 1   24    3  -31 o   16.185   5.7469   13.446   9.5125   0.0903   13.461   26.769   13.444   12.888   5.8604   21.386   6.8321 -8.497534 9.001199 
1 1 1   24    3  -30 o   15.639   5.7689   12.178   9.7037   13.273   13.384   10.965   14.090   16.346   6.5693   15.739   6.5763 0.6067219 9.295392 
1 1 1   24    3  -29 o   17.228   6.0974   15.730   10.701   13.370   16.107   17.595   14.317   16.697   7.0077   17.844   6.9093 -1.146982 9.841073 
1 1 1   24    3  -28 o   23.777   5.2823   28.482   9.9721   28.902   13.968   28.045   14.242   22.271   6.9444   21.825   7.0377 0.4461269 9.887059 
1 1 1   24    3  -27 o   13.512   5.5237   6.6754   9.6495  -6.3034   13.329   20.969   13.988   11.708   5.4975   19.157   6.9484 -7.448847 8.860147 
1 1 1   24    3  -26 o   12.849   5.5709   3.3578   10.785  -0.8788   13.508   10.810   17.915   12.833   5.8487   16.473   7.1606 -3.640234 9.245613 
1 1 1   24    3  -25 o   18.117   6.1907   17.447   10.982   5.6462   13.866   37.305   17.987   14.464   6.2934   24.351   7.9137 -9.887145 10.11104 
1 1 1   24    3  -24 o   16.569   6.1330   13.756   10.984   15.076   13.766   11.443   18.221   17.222   6.7448   16.758   7.2534 0.4640236 9.904762 
1 1 1   24    3  -23 o   30.129   4.3113   42.193   10.287   44.545   14.327   39.691   14.779   29.135   6.2217   26.844   6.7593 2.290781 9.186850 
1 1 1   24    3  -22 o   22.355   5.5369   25.336   10.037   12.625   14.011   38.732   14.384   16.549   6.6964   26.693   6.6383 -10.14415 9.429193 
1 1 1   24    3  -21 o   23.999   5.2045   28.361   9.8877   29.339   13.946   27.372   14.021   22.869   6.9039   22.014   6.9707 0.8550377 9.810974 
1 1 1   24    3  -20 o   12.165   5.2571   2.3448   9.5421   4.8053   13.477  -0.1287   13.512   14.294   6.2121   13.146   5.9349 1.148499 8.591474 
1 1 1   24    3  -19 o   10.383   4.8036  -4.5179   9.5915 -16.8452   13.305   8.8209   13.840   10.252   4.9881   15.492   6.4985 -5.240175 8.192163 
1 1 1   24    3  -18 o   16.442   5.8234   13.232   9.7621   25.868   13.761   0.4324   13.851   21.560   6.9148   13.425   6.0396 8.134165 9.180961 
1 1 1   24    3  -17 o   14.571   5.6780   8.8586   9.7163   6.4422   13.777   11.250   13.706   14.865   6.3688   16.221   6.6012 -1.356464 9.172703 
1 1 1   24    3  -16 f   14.766   5.6815   9.3515   9.6364   8.9135   13.595   9.7938   13.661   15.522   6.4707   15.794   6.5266 -0.2721481 9.190548 
1 1 1   24    3  -15 o   31.897   4.5883   47.439   11.587   32.791   19.060   56.025   14.593   23.108   8.1414   33.853   5.4751 -10.74519 9.811159 
1 1 1   24    3  -14 o   20.696   6.0239   22.174   10.774   8.6946   13.955   42.066   16.953   15.578   6.5294   27.229   7.4318 -11.65167 9.892619 
1 1 1   24    3  -13 o   12.874   5.5394   3.0806   10.506  -7.7490   13.728   18.384   16.320   11.856   5.5709   18.778   7.3467 -6.922249 9.220041 
1 1 1   24    3  -12 o   24.040   5.6820   28.990   10.957   32.790   14.654   24.171   16.503   24.388   7.0032   20.670   7.5399 3.717783 10.29050 
1 1 1   24    3  -11 o   11.485   5.2213  -2.5020   10.681   2.8198   14.111  -9.6397   16.342   14.150   6.2466   12.647   5.9837 1.502747 8.650149 
1 1 1   24    3  -10 o   24.458   5.6602   29.876   11.061   32.857   14.398   25.582   17.279   24.548   6.9063   21.122   7.7134 3.426529 10.35345 
1 1 1   24    3   -9 o   20.338   6.1500   21.426   11.060   28.627   14.219   10.396   17.597   22.822   6.9880   16.858   7.2099 5.964108 10.04067 
1 1 1   24    3   -8 o   13.681   5.5898   6.1545   9.8750 -16.0350   13.787   29.533   14.151   10.664   5.1625   23.241   6.9407 -12.57634 8.650090 
1 1 1   24    3   -7 o   9.4305   4.5024  -9.8019   9.6802  -3.9772   13.748 -15.5285   13.632   12.595   5.7998   10.662   5.1548 1.932536 7.759501 
1 1 1   24    3   -6 o   14.816   5.8837   8.6478   10.607   10.819   16.624   7.1569   13.775   16.810   7.0909   15.195   6.4344 1.615296 9.575105 
1 1 1   24    3   -5 o   29.185   5.3732   41.287   12.312   63.595   18.173   22.361   16.739   35.038   6.6051   20.172   7.5507 14.86598 10.03198 
1 1 1   24    3   -4 o   37.800   4.2558   64.943   12.885   48.555   18.403   80.703   18.047   29.335   7.6263   40.765   5.5773 -11.42955 9.448126 
1 1 1   24    3   -3 o   40.469   3.6732   72.454   11.986   52.288   15.833   99.516   18.342   32.039   6.2874   46.054   4.9643 -14.01530 8.010961 
1 1 1   24    3   -2 o   14.197   5.8353   6.6547   10.843 -10.8964   14.188   31.298   16.812   11.606   5.5157   23.326   7.6554 -11.71913 9.435504 
1 1 1   24    3   -1 o   19.760   5.8375   19.747   10.054  -4.5575   14.529   42.077   13.926   12.826   5.9262   28.818   6.1178 -15.99152 8.517442 
1 1 1   24    3    0 o   12.855   5.4400   3.7159   9.8353   3.7444   14.072   3.6887   13.752   14.422   6.3063   14.303   6.2448 0.1186428 8.875066 
1 1 1   24    3    1 o   19.767   5.8330   19.757   10.043   32.230   14.645   8.6844   13.798   24.296   7.0087   15.653   6.5216 8.643723 9.573577 
1 1 1   24    3    2 o   18.486   5.9324   17.218   10.128   24.617   14.730   10.584   13.948   21.161   7.1708   16.243   6.6407 4.917500 9.773387 
1 1 1   24    3    3 o   30.391   4.3827   42.410   10.544   41.893   15.423   42.864   14.448   28.052   6.8135   28.901   6.3100 -0.8497200 9.286572 
1 1 1   24    3    4 o   21.011   5.7783   22.289   10.204   22.290   14.744   22.288   14.136   20.258   7.1585   20.309   7.0207 -0.5132866E-01 10.02670 
1 1 1   24    3    5 o   11.598   5.3602  -4.8611   11.900   15.739   28.021  -9.3939   13.144   19.373   8.6624   11.359   5.3720 8.014284 10.19287 
1 1 1   24    3    6 o   10.529   5.0224 -10.9532   11.991 -30.4371   28.064  -6.6019   13.263   14.170   6.9670   11.896   5.5525 2.274093 8.908991 
1 1 1   24    3    7 o   20.472   6.5822   22.230   12.464   40.275   28.767   18.060   13.829   23.917   9.6246   18.694   6.8884 5.223600 11.83562 
1 1 1   24    3    8 o   47.252   3.6928   98.815   14.111   82.620   30.805  103.115   15.874   34.182   10.248   47.830   4.1114 -13.64771 11.04184 
1 1 1   24    3    9 o   23.722   5.8763   28.528   11.304   37.532   18.592   23.248   14.237   25.047   8.0377   20.621   7.0488 4.426208 10.69065 
1 1 1   24    3   10 o   12.400   5.3981   1.8191   10.213  -9.0287   14.931   11.356   14.000   12.185   5.7513   16.424   6.6761 -4.238831 8.811812 
1 1 1   24    3   11 o   21.909   6.1546   24.949   11.443   30.517   14.821   16.732   18.004   23.402   7.1283   18.463   7.5461 4.939463 10.38053 
1 1 1   24    3   12 o   19.917   6.2944   20.771   11.437   29.920   14.814   7.2710   17.996   23.137   7.1414   16.191   7.1042 6.946444 10.07321 
1 1 1   24    3   13 o   15.544   6.0859   10.425   11.206   11.445   14.343   8.8262   17.952   16.468   6.7336   16.500   7.1703 -0.3171539E-01 9.836353 
1 1 1   24    3   14 o   18.214   5.9531   16.878   10.171   13.902   15.023   19.396   13.821   17.288   6.9558   19.079   6.9086 -1.790546 9.803612 
1 1 1   24    3   15 o   10.550   4.8740  -4.4883   9.8230 -21.5505   14.071   11.731   13.719   10.084   4.9529   16.415   6.6321 -6.331809 8.277450 
1 1 1   24    3   16 f   16.536   5.9320   13.322   10.161   15.992   14.816   10.951   13.961   17.872   6.9979   16.197   6.6355 1.675011 9.643661 
1 1 1   24    3   17 o   13.808   5.7995   5.6274   11.044   9.1013   14.425   0.7058   17.169   15.741   6.6205   14.575   6.6238 1.165965 9.365156 
1 1 1   24    3   18 o   19.857   5.8830   20.359   10.199   15.238   14.462   25.425   14.385   17.551   6.9013   21.247   7.0855 -3.696110 9.890965 
1 1 1   24    3   19 o   21.715   5.7206   24.085   10.265   11.656   14.820   35.549   14.233   16.487   6.8040   25.534   6.7403 -9.047102 9.577362 
1 1 1   24    3   20 o   9.5714   4.5755  -9.9217   10.065 -17.8598   14.499  -2.5374   13.984   10.666   5.1935   12.828   5.8858 -2.161567 7.849523 
1 1 1   24    3   21 o   10.607   4.9142  -4.6451   10.091 -14.7767   14.610   4.5957   13.953   11.095   5.3570   14.360   6.2793 -3.265092 8.253953 
1 1 1   24    3   22 o   14.296   5.7285   8.1087   10.145  -2.3625   14.800   17.389   13.934   13.117   6.0321   18.111   6.8650 -4.993129 9.138571 
1 1 1   24    3   23 o   9.3538   4.4872 -10.3266   9.8667  -6.2591   14.488 -13.8451   13.475   12.277   5.7542   10.676   5.1526 1.600935 7.723936 
1 1 1   24    3   24 o   16.786   6.0037   14.309   10.400   12.538   14.986   15.954   14.444   16.569   6.8402   17.550   6.8981 -0.9815693 9.714553 
1 1 1   24    3   25 o   13.454   5.7294   5.0409   11.028  -3.0894   14.591   15.872   16.841   12.824   5.9301   17.633   7.2627 -4.809118 9.376140 
1 1 1   24    3   26 o   18.107   6.2442   17.553   11.179   12.810   15.044   23.404   16.707   16.566   6.8476   19.789   7.5135 -3.223337 10.16570 
1 1 1   24    3   27 o   26.489   6.1464   37.334   13.015   47.149   19.509   29.464   17.470   27.093   8.1628   21.594   7.7743 5.499010 11.27253 
1 1 1   24    3   28 o   34.947   4.6757   58.341   12.986   68.647   19.010   49.324   17.781   35.182   6.8754   28.752   7.5069 6.429613 10.17963 
1 1 1   24    3   29 o   27.504   5.7690   39.244   12.520   30.019   18.286   47.384   17.179   21.451   7.9182   28.257   7.3793 -6.805389 10.82363 
1 1 1   24    3   30 o   23.723   6.3280   31.029   12.462   24.853   17.955   36.770   17.310   19.844   7.7225   23.997   7.7607 -4.153284 10.94834 
1 1 1   24    3   31 o   27.344   5.8358   39.195   12.611   56.916   18.606   24.133   17.153   30.899   7.4701   19.666   7.5766 11.23344 10.63988 
1 1 1   24    3   32 o   14.698   6.1167   8.7805   12.118  -4.6177   17.539   21.016   16.761   13.340   6.2769   18.718   7.4080 -5.378733 9.709682 
1 1 1   24    3   33 o   10.898   5.1335  -6.4885   11.789   14.236   17.213 -24.7951   16.178   16.865   7.1692   10.409   5.1499 6.456086 8.827183 
1 1 1   24    3   34 o   25.822   6.0646   35.995   12.546   29.198   18.011   42.402   17.486   20.954   7.8347   25.808   7.7172 -4.853275 10.99716 
1 1 1   24    3   35 o   16.223   6.2989   13.634   11.924   23.808   17.237   4.2954   16.514   19.373   7.5587   14.511   6.5553 4.861801 10.00530 
1 1 1   24    3   36 o   21.089   6.4646   25.499   12.165   27.318   17.600   23.835   16.833   20.358   7.7158   19.393   7.4965 0.9652405 10.75780 
1 1 1   24    3   37 o   12.191   5.5066   0.3273   11.650  -1.5106   16.942   1.9756   16.045   13.548   6.3077   13.918   6.3552 -0.3694115 8.954104 
1 1 1   24    3   38 o   10.609   5.0274  -7.3921   11.626 -20.3406   16.609   5.0465   16.279   10.958   5.3822   14.547   6.5455 -3.588709 8.474183 
1 1 1   24    3   39 o   20.937   6.5101   25.431   12.285   24.255   17.536   26.565   17.215   19.334   7.6002   20.082   7.6263 -0.7479019 10.76678 
1 1 1   24    3   40 o   18.993   6.9604   21.927   14.089   24.487   17.433   17.107   23.921   19.359   7.5876   17.608   7.9277 1.751156 10.97359 
1 1 1   24    3   41 o   18.543   7.4753   21.825   17.388   17.222   24.666   26.372   24.515   17.598   7.9744   19.169   8.3540 -1.571720 11.54903 
1 1 1   24    3   42 o   15.783   6.9290   10.899   17.140   7.6959   24.386   14.026   24.097   16.132   7.5296   17.010   7.7751 -0.8774204 10.82349 
1 1 1   24    3   43 o   17.120   7.8138   15.103   24.218   15.103   24.218   0.0000   0.0000   17.120   7.8138  ?   ?  0.000000 7.813799 
1 1 1   24    3   44 o   20.066   8.6232   32.703   25.399   32.703   25.399   0.0000   0.0000   20.066   8.6232  ?   ?  0.000000 8.623232 
1 1 1   24    3   45 o   15.488   6.8326   10.248   16.855 -12.0912   23.836   32.592   23.838   13.670   6.6566   20.175   8.4998 -6.505619 10.79615 
1 1 1   24    3   46 o   17.326   7.2802   18.081   17.415   4.1438   25.139   30.942   24.149   15.608   7.3953   19.761   8.4486 -4.153478 11.22805 
1 1 1   24    3   47 o   22.877   7.9523   37.298   18.147   57.539   26.463   19.329   24.934   25.169   9.4785   17.626   7.9993 7.542784 12.40287 
1 1 1   24    3   48 o   14.931   6.7308   7.5518   17.305   23.787   25.014  -7.3525   23.967   18.285   8.1794   14.093   6.8186 4.191718 10.64870 
1 1 1   24    3   49 o   19.104   7.5381   25.059   17.308   48.663   25.260   4.1725   23.762   23.252   9.1273   15.325   7.2401 7.926516 11.65019 
1 1 1   24    3   50 o   12.506   5.9635  -6.3302   16.874  -4.0958   24.218  -8.4385   23.524   14.412   6.9434   13.839   6.7097 0.5732059 9.655573 
1 1 1   24    3   51 o   14.934   6.7549   7.8662   17.603 -17.3794   25.189   31.963   24.609   13.323   6.5604   19.586   8.4532 -6.262682 10.70025 
1 1 1   24    3   52 o   20.468   7.7759   30.601   17.901   33.318   26.046   28.169   24.644   19.584   8.5711   18.808   8.2809 0.7761936 11.91795 
1 1 1   24    3   53 o   18.839   7.6268   25.320   18.185   46.009   26.216   6.1319   25.247   21.979   9.0577   15.569   7.3871 6.409263 11.68810 
1 1 1   24    3   54 o   11.524   5.6125 -13.7487   16.956 -27.7471   24.297  -0.4578   23.675   12.271   6.1115   14.580   6.9826 -2.309098 9.279390 
1 1 1   24    3   55 o   16.194   7.0392   14.772   17.311 -19.6942   24.294   50.323   24.673   12.848   6.3483   23.375   9.0650 -10.52705 11.06682 
1 1 1   24    3   56 o   11.728   5.6815 -11.1162   16.772 -30.3793   24.487   5.9068   23.020   12.078   6.0341   15.165   7.1529 -3.087633 9.358086 
1 1 1   24    3   57 o   12.437   5.9542  -6.2575   17.180   0.3990   24.460 -12.7388   24.136   14.663   7.0420   13.329   6.5348 1.333618 9.606894 
1 1 1   24    3   58 o   12.113   5.8250  -7.8497   16.858 -25.7195   24.046   9.4239   23.641   12.247   6.0963   15.592   7.3213 -3.345259 9.527117 
1 1 1   24    3   59 o   14.646   6.6197   8.3245   16.866   8.0251   24.689   8.5865   23.096   15.466   7.3283   15.391   7.2299 0.7458401E-01 10.29443 
1 1 1   24    3   60 o   9.2711   4.6704 -35.2570   16.241 -21.2908   23.573 -47.8774   22.409   12.452   6.1707   10.443   5.2874 2.008821 8.126151 
1 1 1   24    3   61 o   9.3094   4.6830 -33.5881   16.021 -56.3286   22.977 -12.0720   22.350   10.170   5.1703   12.973   6.3453 -2.803130 8.185057 
1 1 1   24    3   62 o   15.563   6.8891   12.532   17.276   15.488   24.629   9.6686   24.238   16.458   7.6428   15.665   7.3736 0.7924538 10.61990 
1 1 1   24    4  -54 o   17.465   8.1452   24.086   28.442   0.0000   0.0000   24.086   28.442  ?   ?    17.465   8.1452 0.000000 8.145233 
1 1 1   24    4  -53 o   11.883   5.6686  -5.7073   15.277   0.0000   0.0000  -5.7073   15.277  ?   ?    11.883   5.6686 0.000000 5.668632 
1 1 1   24    4  -52 o   14.021   6.3396   6.5079   15.487   0.0000   0.0000   6.5079   15.487  ?   ?    14.021   6.3396 0.000000 6.339568 
1 1 1   24    4  -51 o   18.664   7.2799   24.582   15.985   0.0000   0.0000   24.582   15.985  ?   ?    18.664   7.2799 0.000000 7.279859 
1 1 1   24    4  -50 o   12.699   5.7831   2.2732   13.173   15.806   24.372  -3.3121   15.657   16.470   7.6327   12.394   5.8618 4.075717 9.623855 
1 1 1   24    4  -49 o   10.562   5.0866  -9.6043   12.963   7.2403   23.681 -16.8114   15.490   15.325   7.2365   10.618   5.2115 4.707769 8.917747 
1 1 1   24    4  -48 o   13.471   5.9746   5.6421   13.054 -14.3204   24.258   13.780   15.488   13.221   6.4960   15.794   6.7596 -2.572702 9.374967 
1 1 1   24    4  -47 o   11.294   5.3534  -5.6542   13.197 -10.0316   24.281  -3.8191   15.722   13.638   6.6583   12.404   5.8687 1.234434 8.875523 
1 1 1   24    4  -46 o   14.403   6.2356   8.8981   13.473   6.8078   24.224   9.8344   16.212   15.448   7.3019   15.002   6.6556 0.4461946 9.880013 
1 1 1   24    4  -45 o   15.457   6.7584   11.820   16.160   0.0000   0.0000   11.820   16.160  ?   ?    15.457   6.7584 0.000000 6.758437 
1 1 1   24    4  -44 o   13.051   6.0679   0.1189   15.593   0.0000   0.0000   0.1189   15.593  ?   ?    13.051   6.0679 0.000000 6.067911 
1 1 1   24    4  -43 o   15.084   6.7491   9.3441   17.042   0.0000   0.0000   9.3441   17.042  ?   ?    15.084   6.7491 0.000000 6.749080 
1 1 1   24    4  -42 o   17.256   6.8431   18.265   14.330  -8.8361   25.005   31.519   17.486   14.012   6.8221   20.902   7.7380 -6.889964 10.31593 
1 1 1   24    4  -41 o   11.819   5.5576  -4.1102   13.708   11.076   23.818 -11.6315   16.763   16.154   7.5067   11.763   5.6941 4.390510 9.421905 
1 1 1   24    4  -40 o   18.363   6.9051   21.282   14.033   3.8541   24.296   30.005   17.190   15.303   7.2566   20.588   7.6626 -5.284719 10.55331 
1 1 1   24    4  -39 o   17.043   6.7283   17.240   13.795   22.929   25.327   14.840   16.450   18.056   8.1409   16.377   6.9866 1.679201 10.72786 
1 1 1   24    4  -38 o   10.050   4.9155 -15.8401   13.411 -18.1965   23.707 -14.7311   16.264   13.011   6.3985   11.277   5.4930 1.734290 8.432868 
1 1 1   24    4  -37 o   15.826   6.5555   13.163   13.827 -11.6685   24.509   24.756   16.747   13.776   6.7178   19.147   7.4562 -5.370163 10.03610 
1 1 1   24    4  -36 o   14.171   6.2045   7.0511   13.660   13.257   24.964   4.3988   16.320   16.697   7.7334   14.155   6.4427 2.541991 10.06551 
1 1 1   24    4  -35 o   10.494   5.0955 -13.4275   13.698  -5.1361   25.313 -16.8608   16.289   14.594   7.0478   11.073   5.4162 3.520453 8.888595 
1 1 1   24    4  -34 o   22.428   7.1431   31.953   14.705   0.9744   26.470   45.782   17.685   15.433   7.3890   26.277   7.7369 -10.84444 10.69846 
1 1 1   24    4  -33 o   12.303   5.6039   0.2800   12.375   21.150   25.771  -5.9748   14.109   18.018   8.1593   11.758   5.5620 6.259852 9.874721 
1 1 1   24    4  -32 o   12.545   5.6521   1.5735   12.184 -11.1263   25.030   5.5167   13.947   14.053   6.8384   13.956   6.1834 0.9699154E-01 9.219404 
1 1 1   24    4  -31 o   14.002   6.0504   6.8265   12.637  -7.1708   24.942   11.660   14.657   14.452   6.9834   15.635   6.6296 -1.182721 9.629157 
1 1 1   24    4  -30 o   13.236   6.1123  -0.1235   15.424   14.799   25.918  -8.3066   19.193   17.240   7.9475   13.071   6.2670 4.168968 10.12117 
1 1 1   24    4  -29 o   11.292   5.2851  -4.6212   12.150   0.0646   16.041 -10.9262   18.608   13.463   6.2226   12.610   6.0780 0.8526697 8.698442 
1 1 1   24    4  -28 o   10.380   4.9727  -9.7069   12.028 -24.1516   15.561   11.736   18.960   10.141   5.0232   16.234   7.1999 -6.092942 8.779016 
1 1 1   24    4  -27 o   10.530   4.8475  -2.7596   9.5936  -9.1658   13.030   4.8232   14.177   10.913   5.2140   13.954   6.2053 -3.041251 8.105027 
1 1 1   24    4  -26 o   10.377   4.8093  -3.6510   9.6776 -15.4713   13.195   10.111   14.237   10.111   4.9300   15.281   6.5088 -5.170291 8.165120 
1 1 1   24    4  -25 o   14.216   5.6501   9.0792   9.7894  -3.4899   13.228   24.296   14.555   11.971   5.5734   19.819   7.1009 -7.848229 9.026919 
1 1 1   24    4  -24 o   17.026   5.8459   15.611   9.7952   42.125   13.709 -12.0404   14.000   27.711   6.2219   10.920   5.2658 16.79051 8.151120 
1 1 1   24    4  -23 o   8.3722   4.1001 -14.1156   9.4214  -6.6322   13.014 -22.3571   13.657   11.344   5.3588   9.5454   4.7243 1.798267 7.143949 
1 1 1   24    4  -22 o   14.413   5.8136   9.1822   10.523   11.532   13.550   5.6115   16.704   15.635   6.4841   14.762   6.6374 0.8732977 9.278874 
1 1 1   24    4  -21 o   9.9270   4.7137  -7.6601   10.318  -7.0166   13.246  -8.6534   16.456   11.389   5.3881   12.323   5.8798 -0.9337406 7.975231 
1 1 1   24    4  -20 o   13.426   5.6378   6.2794   10.434   8.8222   13.388   2.3443   16.654   14.869   6.3217   14.158   6.4686 0.7113342 9.044691 
1 1 1   24    4  -19 o   19.351   6.0623   20.679   10.632   19.284   13.616   22.858   17.018   18.239   6.8135   19.110   7.4945 -0.8710938 10.12876 
1 1 1   24    4  -18 o   11.548   5.1556   0.5287   9.8852 -11.2104   13.536   13.945   14.471   10.890   5.2324   16.511   6.7588 -5.621192 8.547472 
1 1 1   24    4  -17 o   17.553   5.9512   16.620   10.146   13.684   14.132   19.743   14.574   16.426   6.6962   18.370   7.0072 -1.944122 9.692299 
1 1 1   24    4  -16 o   17.501   5.9359   16.468   10.093   27.898   14.167   4.6847   14.384   21.530   7.0252   14.121   6.2665 7.409463 9.413959 
1 1 1   24    4  -15 o   12.685   5.4400   4.1535   10.069   6.7097   14.074   1.4735   14.410   14.534   6.3318   13.443   6.0930 1.091003 8.787247 
1 1 1   24    4  -14 o   16.471   5.8771   14.158   9.9597   10.648   14.056   17.696   14.114   15.580   6.5432   17.752   6.8638 -2.171603 9.482871 
1 1 1   24    4  -13 o   14.045   5.8295   7.5342   10.965   10.680   18.002   5.6790   13.825   16.188   7.1041   14.245   6.2394 1.942314 9.455065 
1 1 1   24    4  -12 o   20.995   5.7534   23.435   10.137   18.597   13.951   28.847   14.754   18.092   6.8666   21.797   7.1726 -3.704508 9.929576 
1 1 1   24    4  -11 o   13.565   5.6985   6.2406   10.666  -0.2770   16.339   11.081   14.080   13.719   6.3194   15.744   6.5759 -2.024295 9.120105 
1 1 1   24    4  -10 o   33.900   4.2642   53.837   11.523   55.826   17.908   52.432   15.054   30.984   7.2241   31.471   6.0883 -0.4868984 9.447444 
1 1 1   24    4   -9 o   13.360   5.8225   4.1753   11.909  -4.6488   16.630   13.464   17.062   13.104   6.1491   16.777   7.1349 -3.672532 9.419039 
1 1 1   24    4   -8 o   17.669   6.0406   16.715   10.456   22.181   14.901   11.414   14.675   19.350   7.1467   15.969   6.6947 3.380946 9.792529 
1 1 1   24    4   -7 o   17.646   5.9875   16.598   10.270   27.977   14.311   4.5146   14.747   21.697   7.0595   14.281   6.3410 7.415795 9.489139 
1 1 1   24    4   -6 o   21.513   5.7092   24.326   10.177   16.823   14.218   32.208   14.573   17.582   6.8636   23.365   7.0582 -5.782169 9.845107 
1 1 1   24    4   -5 o   26.566   5.5674   36.144   11.670   34.556   14.538   39.022   19.570   24.382   6.9673   24.035   8.2626 0.3466930 10.80803 
1 1 1   24    4   -4 o   11.338   5.1110  -0.7489   9.9772 -14.9148   13.911   14.259   14.318   10.625   5.1536   16.788   6.7780 -6.163092 8.514697 
1 1 1   24    4   -3 o   23.591   6.0797   29.903   11.764   24.341   19.418   33.129   14.788   19.677   7.9112   23.692   7.0996 -4.014523 10.62971 
1 1 1   24    4   -2 o   21.812   6.2746   26.147   11.753   31.075   19.354   23.269   14.793   21.602   8.1123   19.813   7.1512 1.789106 10.81429 
1 1 1   24    4   -1 o   17.594   6.6077   16.765   12.841 -14.7062   26.170   26.746   14.738   14.454   7.0239   21.139   7.1726 -6.684864 10.03901 
1 1 1   24    4    0 o   27.824   5.5013   39.304   12.035   80.855   20.283   16.726   14.951   38.443   6.7168   17.599   6.9865 20.84420 9.691604 
1 1 1   24    4    1 o   13.071   5.6570   3.9770   11.082   5.1663   14.288   2.1811   17.558   14.340   6.3098   14.565   6.6497 -0.2251959 9.166882 
1 1 1   24    4    2 o   12.958   5.6562   3.3374   11.277   3.8545   14.329   2.4960   18.279   14.046   6.2428   14.792   6.7653 -0.7460251 9.205487 
1 1 1   24    4    3 o   23.662   5.9123   29.663   11.370   31.758   14.823   26.668   17.723   23.110   7.1454   20.520   7.7506 2.590170 10.54172 
1 1 1   24    4    4 o   22.520   6.0630   27.329   11.375   29.467   14.967   24.404   17.503   22.124   7.2209   19.840   7.6510 2.283468 10.52042 
1 1 1   24    4    5 o   19.799   6.3315   21.736   11.544   37.815   14.904  -2.3758   18.251   25.590   6.9615   13.966   6.5172 11.62308 9.536071 
1 1 1   24    4    6 o   8.4700   4.2050 -21.5413   11.137 -12.4332   14.292 -35.6230   17.771   11.115   5.3498   10.154   5.0832 0.9609518 7.379611 
1 1 1   24    4    7 o   15.623   6.1600   11.637   11.551   20.510   14.807  -2.1541   18.461   18.793   7.0874   14.044   6.5538 4.748960 9.653177 
1 1 1   24    4    8 o   13.722   5.8444   5.8934   11.478   10.868   14.833  -1.5297   18.119   15.845   6.6916   14.041   6.5323 1.804179 9.351400 
1 1 1   24    4    9 o   22.696   5.6468   26.902   10.405   21.865   15.062   31.500   14.389   19.203   7.1678   23.091   7.0217 -3.888475 10.03397 
1 1 1   24    4   10 o   19.800   5.9095   21.104   10.261   30.387   14.824   12.566   14.218   22.446   7.1746   16.207   6.6739 6.238657 9.798772 
1 1 1   24    4   11 o   17.736   6.0751   16.980   10.577  -1.2082   15.090   34.546   14.830   13.174   6.0699   24.130   7.0794 -10.95666 9.325316 
1 1 1   24    4   12 o   9.1592   4.4232 -11.2874   9.9696 -15.6870   14.065  -6.8444   14.134   10.551   5.1324   11.846   5.5926 -1.294645 7.590709 
1 1 1   24    4   13 o   11.109   5.0688  -1.8876   10.181  -1.2683   14.410  -2.5049   14.387   12.922   5.9457   12.683   5.8732 0.2384615 8.357316 
1 1 1   24    4   14 o   11.220   5.1836  -3.2950   11.110  -1.1541   14.498  -6.3413   17.294   12.964   5.9646   13.003   6.1530 -0.3905773E-01 8.569420 
1 1 1   24    4   15 o   16.702   5.9512   14.724   10.209   3.8319   14.353   25.876   14.524   13.930   6.2161   20.640   7.1171 -6.709909 9.449535 
1 1 1   24    4   16 o   11.718   5.2455   0.4208   10.307  -4.4995   14.694   5.1861   14.461   12.413   5.8103   14.254   6.3067 -1.841825 8.575177 
1 1 1   24    4   17 o   13.178   5.7077   4.4878   11.298  -7.5628   17.794   12.626   14.623   12.951   6.1613   16.165   6.7226 -3.213520 9.118953 
1 1 1   24    4   18 o   22.978   6.4409   29.853   12.547   22.888   18.282   36.054   17.250   19.051   7.6705   23.510   7.7564 -4.459360 10.90863 
1 1 1   24    4   19 o   39.433   4.3535   73.532   13.761   66.987   20.051   79.359   18.920   33.321   7.5567   38.387   6.2622 -5.066761 9.814265 
1 1 1   24    4   20 o   10.748   5.0991  -7.7631   12.025 -18.2073   17.198   2.2283   16.821   11.421   5.5819   14.178   6.4865 -2.756267 8.557558 
1 1 1   24    4   21 o   12.664   5.6530   1.9550   11.882  -1.4456   17.094   5.1343   16.528   13.601   6.3334   14.644   6.5917 -1.042933 9.141311 
1 1 1   24    4   22 o   14.652   6.0585   9.2067   11.781  -3.5590   17.068   20.822   16.281   13.248   6.2207   18.481   7.3052 -5.233098 9.594901 
1 1 1   24    4   23 o   15.378   6.1590   11.462   11.721   16.357   16.397   6.3471   16.762   17.193   7.1317   14.906   6.6796 2.287218 9.771309 
1 1 1   24    4   24 o   12.926   5.7019   3.3049   11.735   1.9213   16.275   4.8034   16.937   13.931   6.3760   14.626   6.6198 -0.6951046 9.191035 
1 1 1   24    4   25 o   26.559   5.9107   37.840   12.467   58.612   18.043   18.861   17.246   31.461   7.1926   17.840   7.3488 13.62033 10.28292 
1 1 1   24    4   26 o   27.934   6.5037   43.954   14.531   40.814   24.197   45.725   18.173   22.437   8.8941   26.404   7.8605 -3.967085 11.86981 
1 1 1   24    4   27 o   30.093   5.4308   46.575   12.832   12.383   17.940   82.391   18.361   16.278   7.1191   39.483   5.8844 -23.20527 9.236243 
1 1 1   24    4   28 o   35.545   4.6573   61.406   13.170   45.378   18.658   77.321   18.592   25.925   8.0168   37.646   6.2797 -11.72072 10.18351 
1 1 1   24    4   29 o   31.402   5.1805   49.859   12.799   70.508   18.702   31.670   17.553   35.174   6.7683   21.514   7.7864 13.65931 10.31689 
1 1 1   24    4   30 o   20.934   6.5307   25.775   12.351   25.262   17.243   26.315   17.701   19.499   7.5735   19.741   7.6719 -0.2428818 10.78039 
1 1 1   24    4   31 o   15.736   6.2493   12.824   11.967  -8.1749   16.800   34.456   17.051   12.374   5.9142   22.548   7.7138 -10.17402 9.720097 
1 1 1   24    4   32 o   10.688   5.0596  -6.7188   11.716 -21.4574   16.423   8.5592   16.720   10.684   5.2677   15.163   6.7412 -4.479448 8.555281 
1 1 1   24    4   33 o   13.828   5.9807   6.5701   12.370   11.265   17.635   2.0221   17.357   15.820   6.9835   14.027   6.4797 1.792792 9.526616 
1 1 1   24    4   34 o   14.006   6.2326   5.5649   14.326   30.222   25.513  -5.7890   17.313   19.497   8.5091   12.793   6.0833 6.704187 10.45999 
1 1 1   24    4   35 o   9.7584   4.8178 -20.3961   13.893 -24.8126   24.851 -18.3881   16.757   12.784   6.3354   11.074   5.4323 1.710444 8.345469 
1 1 1   24    4   36 o   11.733   5.5543  -5.8753   14.120   13.009   25.102 -14.6157   17.077   16.672   7.7333   11.579   5.6375 5.093287 9.569982 
1 1 1   24    4   37 o   15.326   6.5037   11.285   14.124   13.894   25.201   10.091   17.054   16.782   7.7719   15.402   6.8299 1.380428 10.34654 
1 1 1   24    4   38 o   18.641   7.5618   23.636   17.917  -0.1873   25.596   46.526   25.090   15.089   7.2354   22.825   9.0539 -7.736382 11.58983 
1 1 1   24    4   39 o   11.011   5.4259 -20.5576   17.334  -9.9938   25.126 -30.1521   23.945   14.006   6.8234   12.120   6.0413 1.886072 9.113500 
1 1 1   24    4   40 o   13.905   6.4826   1.3151   17.991  -3.9860   25.749   6.3713   25.147   14.656   7.0854   15.706   7.4285 -1.049759 10.26570 
1 1 1   24    4   41 o   19.042   7.6653   25.728   18.253   11.316   26.617   38.522   25.080   16.399   7.7214   20.834   8.7442 -4.435509 11.66540 
1 1 1   24    4   42 o   16.420   7.1448   15.151   17.873   36.295   26.006  -3.7752   24.605   20.162   8.6959   14.441   6.9675 5.721839 11.14291 
1 1 1   24    4   43 o   20.966   7.8758   32.675   18.245   12.991   26.087   51.523   25.527   16.478   7.7226   23.493   9.1893 -7.014978 12.00336 
1 1 1   24    4   44 o   14.944   6.8055   7.9293   18.240   21.237   25.863  -5.2404   25.728   17.539   8.0314   14.399   6.9897 3.140029 10.64701 
1 1 1   24    4   45 o   17.709   8.0614   22.637   25.563   22.637   25.563   0.0000   0.0000   17.709   8.0614  ?   ?  0.000000 8.061383 
1 1 1   24    4   46 o   14.220   6.9121  -6.0527   25.389  -6.0527   25.389   0.0000   0.0000   14.220   6.9121  ?   ?  0.000000 6.912111 
1 1 1   24    4   47 o   14.596   7.0289  -1.0542   24.750  -1.0542   24.750   0.0000   0.0000   14.596   7.0289  ?   ?  0.000000 7.028851 
1 1 1   24    4   48 o   18.140   7.4920   23.325   17.987   14.132   25.218   32.846   25.665   16.379   7.6488   19.221   8.4572 -2.842129 11.40301 
1 1 1   24    4   49 o   11.057   5.4382 -17.9633   17.144   9.6470   24.260 -45.5049   24.230   15.682   7.3801   11.063   5.5890 4.619481 9.257585 
1 1 1   24    4   50 o   17.725   7.3717   21.931   17.583   0.8979   25.177   41.955   24.566   14.737   7.0949   21.081   8.7356 -6.343549 11.25383 
1 1 1   24    4   51 o   14.457   6.6189   6.9034   17.555   1.8042   25.012   11.854   24.644   14.771   7.1009   15.904   7.4701 -1.133347 10.30653 
1 1 1   24    4   52 o   12.263   5.8855  -6.5423   17.019 -14.4617   24.458   0.8919   23.697   13.121   6.4616   14.459   6.9410 -1.338527 9.483097 
1 1 1   24    4   53 o   16.891   7.2146   18.933   17.580   16.373   25.967   21.098   23.888   16.487   7.7194   17.140   7.7988 -0.6539001 10.97318 
1 1 1   24    4   54 o   12.672   6.0320  -3.6997   17.105   8.0761   24.692 -14.5651   23.718   15.399   7.3061   12.976   6.3848 2.423396 9.702865 
1 1 1   24    4   55 o   15.530   6.9067   12.728   17.567   4.6672   25.344   20.182   24.370   15.074   7.2205   16.998   7.7884 -1.924489 10.62048 
1 1 1   24    4   56 o   16.770   7.2212   18.263   17.878   30.373   25.743   6.9808   24.848   18.581   8.3056   15.324   7.2872 3.256715 11.04932 
1 1 1   24    5  -49 o   12.582   6.1597 -12.8621   21.208   0.0000   0.0000 -12.8621   21.208  ?   ?    12.582   6.1597 0.000000 6.159694 
1 1 1   24    5  -48 o   19.256   8.1531   32.071   22.114   0.0000   0.0000   32.071   22.114  ?   ?    19.256   8.1531 0.000000 8.153060 
1 1 1   24    5  -47 o   11.015   5.4856 -25.6755   19.561   0.0000   0.0000 -25.6755   19.561  ?   ?    11.015   5.4856 0.000000 5.485609 
1 1 1   24    5  -46 o   17.462   7.1807   21.185   16.429   0.0000   0.0000   21.185   16.429  ?   ?    17.462   7.1807 0.000000 7.180664 
1 1 1   24    5  -45 o  ?   ?  -53.9563   12.956 -35.3183   23.124 -62.4840   15.642   11.282   5.6687  ?   ?  0.000000 5.668709 
1 1 1   24    5  -44 o   21.421   7.0179   30.889   14.131   26.558   25.000   32.923   17.130   17.827   8.0582   20.823   7.6676 -2.995766 11.12321 
1 1 1   24    5  -43 o   11.987   5.6060  -1.7215   13.629   24.175   24.434 -13.4160   16.420   17.526   7.9400   11.229   5.4807 6.297044 9.647873 
1 1 1   24    5  -42 o   17.694   6.8280   20.607   13.947  -8.4664   24.077   35.290   17.110   13.564   6.6239   21.735   7.7084 -8.171036 10.16342 
1 1 1   24    5  -41 o   14.040   6.1822   7.8782   13.738   2.6156   24.456   10.305   16.606   14.761   7.0767   14.960   6.6802 -0.1989393 9.731579 
1 1 1   24    5  -40 o   9.4676   4.6863 -19.9677   13.451  -1.0687   24.323 -28.2941   16.144   14.378   6.9350   9.7508   4.8758 4.627471 8.477489 
1 1 1   24    5  -39 o   13.420   6.0587   4.6383   14.083   25.106   25.548  -4.2958   16.879   17.821   8.0916   12.578   5.9884 5.243506 10.06654 
1 1 1   24    5  -38 o   9.0892   4.5343 -24.7241   13.608 -38.4360   23.586 -17.8820   16.661   11.306   5.6866   10.907   5.3640 0.3984699 7.817302 
1 1 1   24    5  -37 o   16.726   6.8099   17.297   14.594   16.351   25.544   17.755   17.782   16.652   7.7503   16.764   7.2099 -0.1114178 10.58534 
1 1 1   24    5  -36 o   13.831   6.1760   6.1814   14.194   13.320   24.271   2.4709   17.499   16.216   7.5496   13.791   6.4172 2.424802 9.908456 
1 1 1   24    5  -35 o   17.936   6.9338   20.942   14.401   32.417   24.606   14.963   17.761   19.313   8.3935   16.185   7.0810 3.127296 10.98139 
1 1 1   24    5  -34 o   16.760   7.2740   17.431   18.427   14.124   24.550   21.699   27.888   16.393   7.6188   17.472   8.1204 -1.079374 11.13495 
1 1 1   24    5  -33 o   12.466   6.0153  -8.8624   18.347   31.823   24.337 -62.4288   27.925   19.319   8.3721   11.175   5.6830 8.143421 10.11871 
1 1 1   24    5  -32 o   15.082   6.8712   8.5406   18.622 -13.8632   25.110   35.920   27.759   13.498   6.6275   19.647   8.7129 -6.148361 10.94707 
1 1 1   24    5  -31 o   10.943   5.3654 -17.0392   16.286 -19.1858   24.283 -15.2843   21.956   12.916   6.3755   12.733   6.2404 0.1834965 8.921296 
1 1 1   24    5  -30 o   10.069   5.0111 -25.8346   16.201 -20.2388   24.042 -30.4892   21.927   12.795   6.3209   11.499   5.7393 1.296628 8.537810 
1 1 1   24    5  -29 o   14.577   6.6174   6.6468   17.077 -25.4001   24.481   37.020   23.833   12.513   6.2160   20.667   8.5876 -8.153794 10.60121 
1 1 1   24    5  -28 o   19.651   7.5554   27.213   17.032   7.6269   25.297   43.454   23.036   15.797   7.4652   22.477   8.7473 -6.680515 11.49977 
1 1 1   24    5  -27 o   13.571   5.9598   5.8511   12.690   0.0672   25.251   7.8053   14.678   14.957   7.1760   14.443   6.3736 0.5143509 9.597766 
1 1 1   24    5  -26 o   8.9353   4.4344 -21.2625   12.342 -31.8747   24.478 -17.6450   14.291   12.099   6.0430   10.176   4.9969 1.923457 7.841300 
1 1 1   24    5  -25 o   10.232   4.9520 -11.8191   12.668 -12.2328   24.947 -11.6754   14.705   13.741   6.7173   11.066   5.3507 2.675689 8.587875 
1 1 1   24    5  -24 o   11.475   5.3781  -3.9961   12.657   0.4608   25.770  -5.4133   14.531   15.124   7.2543   11.906   5.6358 3.217882 9.186238 
1 1 1   24    5  -23 o   21.586   6.0959   26.644   11.195   16.812   16.379   35.263   15.336   16.859   7.0705   23.271   7.2798 -6.412231 10.14826 
1 1 1   24    5  -22 o   14.098   5.8454   8.7631   11.009   22.534   16.472  -2.3537   14.800   18.452   7.3306   12.503   5.8457 5.949021 9.376046 
1 1 1   24    5  -21 o   12.259   5.4519   2.4732   10.945  -1.8926   15.991   6.3206   15.012   12.938   6.0580   14.241   6.3557 -1.302207 8.780345 
1 1 1   24    5  -20 o   15.308   6.0143   12.176   10.976   22.397   16.350   3.7900   14.809   18.474   7.3149   13.677   6.1903 4.796499 9.582617 
1 1 1   24    5  -19 o   13.139   5.6607   5.5579   10.997   31.698   16.715 -14.3928   14.603   21.432   7.6172   10.719   5.2176 10.71356 9.232814 
1 1 1   24    5  -18 o   11.017   5.0274  -1.1528   10.019  -9.2790   13.710   8.1613   14.678   11.063   5.3023   14.636   6.4193 -3.573417 8.325979 
1 1 1   24    5  -17 o   12.298   5.3563   3.5898   10.066   13.788   13.780  -8.0768   14.739   16.043   6.5844   11.630   5.5535 4.412602 8.613694 
1 1 1   24    5  -16 o   9.0878   4.4300 -13.3652   10.635 -26.0491   15.390  -1.7713   14.714   9.8248   4.8885   12.642   5.8832 -2.817159 7.649184 
1 1 1   24    5  -15 o   7.7858   3.9005 -24.1376   10.558 -14.5577   15.405 -32.6214   14.497   11.032   5.3676   8.9128   4.4797 2.119531 6.991329 
1 1 1   24    5  -14 o   14.739   5.9030   10.479   10.767 -19.2714   15.496   38.251   14.972   10.541   5.1816   24.927   7.0531 -14.38599 8.751917 
1 1 1   24    5  -13 o   11.694   5.2853   0.2448   10.752   8.8154   15.407  -7.8916   15.012   14.978   6.5728   11.786   5.6213 3.192851 8.648719 
1 1 1   24    5  -12 o   13.403   5.7849   5.7625   11.526   24.253   17.999  -7.0895   15.006   18.985   7.6223   11.909   5.6632 7.076191 9.495897 
1 1 1   24    5  -11 o   14.374   5.9432   9.0826   11.337   5.5917   17.526   11.594   14.865   14.713   6.6888   15.604   6.6486 -0.8909025 9.430996 
1 1 1   24    5  -10 o   12.189   5.4556   1.5912   11.145   24.324   17.763 -13.1681   14.313   19.065   7.5999   10.815   5.2414 8.250259 9.232038 
1 1 1   24    5   -9 o   14.580   5.9674   9.6970   11.278 -13.7715   17.598   26.056   14.693   11.916   5.7837   20.226   7.1460 -8.309582 9.193258 
1 1 1   24    5   -8 o   16.842   5.9651   15.593   10.243   25.886   14.110   4.1282   14.892   20.338   7.0151   13.890   6.2544 6.447411 9.398381 
1 1 1   24    5   -7 o   26.274   5.3689   35.778   11.110   52.378   14.236   9.9260   17.767   31.424   5.7704   15.625   6.9476 15.79905 9.031408 
1 1 1   24    5   -6 o   19.963   5.9358   22.175   10.368   25.766   14.011   17.828   15.414   20.339   6.9913   17.403   7.0304 2.935263 9.914905 
1 1 1   24    5   -5 o   11.772   5.2185   1.6660   9.9484   3.4122   13.524  -0.3928   14.686   13.396   6.0018   12.957   5.9765 0.4389973 8.469913 
1 1 1   24    5   -4 o   9.7383   4.6089  -6.6462   9.7103  -5.4429   13.252  -8.0412   14.269   11.566   5.4465   11.535   5.4959 0.3057671E-01 7.737537 
1 1 1   24    5   -3 o   8.8107   4.2863 -12.4477   9.8180 -15.9363   13.520  -8.5556   14.281   10.156   4.9605   11.464   5.4721 -1.307942 7.385856 
1 1 1   24    5   -2 o   14.738   5.9855   10.101   11.241   0.9269   13.796   28.221   19.388   12.950   5.9057   19.993   7.9497 -7.042310 9.903268 
1 1 1   24    5   -1 o   13.614   5.6302   7.3942   10.177   14.456   13.946  -0.6501   14.885   16.393   6.6635   12.978   5.9970 3.415146 8.964681 
1 1 1   24    5    0 o   12.699   5.5974   3.2856   11.287   1.7449   13.868   6.3087   19.427   13.142   5.9650   15.231   6.9694 -2.089028 9.173523 
1 1 1   24    5    1 o   22.417   6.2040   28.394   11.721   28.651   14.456   27.900   20.028   21.361   7.1024   19.815   8.0104 1.546247 10.70566 
1 1 1   24    5    2 o   14.075   5.9082   7.9399   11.452   8.1555   14.193   7.5373   19.389   14.682   6.3778   15.433   7.0237 -0.7519131 9.487290 
1 1 1   24    5    3 o   15.268   6.0189   11.676   11.025  -4.2601   16.424   24.748   14.875   12.833   6.0496   19.749   7.1650 -6.915842 9.377385 
1 1 1   24    5    4 o   14.038   5.6822   8.6634   10.092   3.4626   14.147   14.053   14.401   13.579   6.1066   16.289   6.7133 -2.710562 9.075142 
1 1 1   24    5    5 o   11.366   5.1282  -0.0698   10.070 -17.8078   13.859   19.772   14.658   10.076   4.9424   18.054   6.9909 -7.977681 8.561521 
1 1 1   24    5    6 o   13.800   5.6575   7.9764   10.158   12.555   14.053   2.9674   14.699   15.822   6.5860   13.613   6.1635 2.209335 9.020224 
1 1 1   24    5    7 o   10.761   5.0225  -4.2861   10.847 -11.9188   13.796   8.0680   17.552   10.785   5.2072   15.223   6.8275 -4.438062 8.586610 
1 1 1   24    5    8 o   32.046   5.9808   55.377   15.049   55.377   15.049   0.0000   0.0000   32.046   5.9808  ?   ?  0.000000 5.980836 
1 1 1   24    5    9 o   12.636   5.5510   3.4669   11.017   3.7745   13.962   2.9596   17.933   13.574   6.0884   14.348   6.6131 -0.7739668 8.988975 
1 1 1   24    5   10 o   15.847   6.2872   13.193   12.101   7.2717   14.133   29.461   23.426   14.414   6.3109   19.675   8.3636 -5.261436 10.47741 
1 1 1   24    5   11 o   17.529   6.1952   17.439   11.043   31.086   14.288  -2.8142   17.405   22.336   7.0321   13.287   6.2524 9.048957 9.409720 
1 1 1   24    5   12 o   14.434   5.9167   9.4061   11.109   21.543   14.442  -8.1841   17.386   18.607   7.0032   12.518   5.9922 6.088570 9.216964 
1 1 1   24    5   13 o   16.907   6.2040   16.054   11.198   17.375   14.521   14.115   17.591   17.211   6.8679   16.435   7.1201 0.7760086 9.892583 
1 1 1   24    5   14 o   19.112   6.1960   21.034   11.030  -1.1319   14.364   52.883   17.218   12.667   5.8665   29.401   7.2343 -16.73426 9.314053 
1 1 1   24    5   15 o   11.106   5.1286  -2.4758   10.859 -12.2996   14.041   12.143   17.128   10.794   5.2215   15.924   6.9605 -5.130440 8.701267 
1 1 1   24    5   16 o   12.654   5.5728   3.5263   11.168  -5.2010   14.575   15.937   17.380   12.022   5.6767   16.795   7.1737 -4.773655 9.148029 
1 1 1   24    5   17 o   16.288   6.1659   14.637   11.232  -2.8944   14.533   40.634   17.698   12.380   5.7895   24.274   7.8469 -11.89430 9.751479 
1 1 1   24    5   18 o   18.141   6.5480   19.678   12.403   12.138   17.449   27.379   17.634   15.901   6.9857   19.807   7.6685 -3.905987 10.37328 
1 1 1   24    5   19 o   17.320   6.5359   17.652   12.597   22.283   17.739   12.942   17.891   18.323   7.4898   16.094   7.0720 2.228865 10.30102 
1 1 1   24    5   20 o   12.980   5.7562   3.8313   12.115 -15.9494   17.083   23.847   17.184   11.419   5.5769   18.794   7.4805 -7.374974 9.330545 
1 1 1   24    5   21 o   11.963   5.4809  -0.4787   12.066   12.228   17.077 -13.1476   17.052   15.831   6.9340   11.715   5.6875 4.115909 8.968218 
1 1 1   24    5   22 o   25.086   6.1998   35.723   12.604   23.465   17.837   47.948   17.813   18.558   7.5386   26.794   7.7297 -8.235575 10.79720 
1 1 1   24    5   23 o   15.397   6.2953   12.227   12.536   24.173   17.538  -0.2542   17.926   18.775   7.5288   13.661   6.4021 5.114035 9.882801 
1 1 1   24    5   24 o   19.638   6.5931   23.554   12.452   22.781   17.664   24.318   17.556   18.367   7.4868   18.802   7.5351 -0.4357109 10.62213 
1 1 1   24    5   25 o   14.740   6.3635   9.3860   13.953 -10.9535   22.846   21.486   17.621   13.438   6.5378   18.014   7.4252 -4.576100 9.893265 
1 1 1   24    5   26 o   23.564   6.5732   33.178   13.101   46.028   18.350   19.819   18.711   25.632   7.9544   17.525   7.4631 8.106749 10.90735 
1 1 1   24    5   27 o   23.226   7.2417   35.175   15.190   62.470   27.538   23.238   18.211   25.439   9.6492   18.367   7.5571 7.072502 12.25632 
1 1 1   24    5   28 o   10.629   5.1780 -14.2019   14.462 -38.4701   24.903  -1.8517   17.765   11.754   5.9028   13.326   6.2849 -1.571766 8.622265 
1 1 1   24    5   29 o   15.750   6.6712   13.168   14.815  -9.3413   25.983   24.012   18.033   14.111   6.8886   18.533   7.5609 -4.422604 10.22838 
1 1 1   24    5   30 o   26.953   7.1155   45.522   15.860   22.465   27.379   57.167   19.458   17.746   8.1763   28.811   8.0009 -11.06519 11.43972 
1 1 1   24    5   31 o   15.033   6.5423   10.410   14.990  -4.5813   26.209   17.697   18.274   14.541   7.0576   16.918   7.2930 -2.377236 10.14877 
1 1 1   24    5   32 o   16.314   7.6253   12.754   25.153   0.0000   0.0000   12.754   25.153  ?   ?    16.314   7.6253 0.000000 7.625315 
1 1 1   24    5   33 o   14.217   6.8854  -4.7655   24.599   0.0000   0.0000  -4.7655   24.599  ?   ?    14.217   6.8854 0.000000 6.885407 
1 1 1   24    5   34 o   12.894   6.3690 -18.9397   24.384   0.0000   0.0000 -18.9397   24.384  ?   ?    12.894   6.3690 0.000000 6.369028 
1 1 1   24    5   35 o   12.831   6.3494 -20.2047   24.631   0.0000   0.0000 -20.2047   24.631  ?   ?    12.831   6.3494 0.000000 6.349406 
1 1 1   24    5   36 o   14.070   6.8584  -7.1337   25.480   0.0000   0.0000  -7.1337   25.480  ?   ?    14.070   6.8584 0.000000 6.858380 
1 1 1   24    5   37 o   13.327   6.5534 -14.1992   24.857   0.0000   0.0000 -14.1992   24.857  ?   ?    13.327   6.5534 0.000000 6.553356 
1 1 1   24    5   38 o   17.143   7.8812   20.125   25.243   0.0000   0.0000   20.125   25.243  ?   ?    17.143   7.8812 0.000000 7.881190 
1 1 1   24    5   39 o   17.765   7.5630   22.715   19.206  -5.0578   27.086   50.795   27.236   14.416   7.0368   22.133   9.1871 -7.716990 11.57238 
1 1 1   24    5   40 o   23.263   8.1145   42.099   18.904   49.051   27.541   35.907   25.995   21.597   9.1194   19.495   8.5467 2.102118 12.49838 
1 1 1   24    5   41 o   14.992   6.8008   9.7072   17.995   19.046   26.041   1.1715   24.896   16.851   7.8369   14.660   7.0571 2.190984 10.54607 
1 1 1   24    5   42 o   11.547   5.6423 -13.8286   17.552 -14.8466   25.105 -12.8552   24.549   13.199   6.5088   13.261   6.5195 -0.6264019E-01 9.212379 
1 1 1   24    5   43 o   10.661   5.2862 -22.2136   17.397 -16.0377   25.618 -27.4994   23.700   13.167   6.5082   11.942   5.9619 1.224281 8.826153 
1 1 1   24    5   44 o   14.061   6.5367   4.6822   18.089   28.627   26.216 -17.0798   24.993   18.057   8.1978   12.950   6.4062 5.106212 10.40399 
1 1 1   24    5   45 o   16.364   7.1289   17.033   17.839   3.4789   26.010   29.071   24.512   14.929   7.1933   18.293   8.1456 -3.363760 10.86711 
1 1 1   24    5   46 o   11.655   5.6814 -12.3957   17.491 -27.1624   25.344   1.0356   24.171   12.307   6.1472   14.468   6.9619 -2.160908 9.287435 
1 1 1   24    5   47 o   13.032   6.2049  -2.4275   18.126  -2.5242   26.113  -2.3377   25.181   14.363   6.9883   14.259   6.9200 0.1048069 9.834744 
1 1 1   24    5   48 o   12.256   6.1173 -26.8007   24.909 -26.8007   24.909   0.0000   0.0000   12.256   6.1173  ?   ?  0.000000 6.117253 
1 1 1   24    6  -39 o   15.780   7.3601   12.957   23.232   0.0000   0.0000   12.957   23.232  ?   ?    15.780   7.3601 0.000000 7.360057 
1 1 1   24    6  -36 o   17.321   6.9192   20.303   14.755   9.8241   26.104   25.223   17.886   15.515   7.4037   18.230   7.4939 -2.714192 10.53442 
1 1 1   24    6  -35 o   12.852   5.9067   2.4806   14.165 -23.3190   23.797   16.638   17.628   12.193   6.0690   16.190   7.0692 -3.996539 9.316998 
1 1 1   24    6  -34 o   13.678   6.1627   6.2568   14.485   10.903   24.834   3.8606   17.833   15.552   7.3636   13.824   6.4479 1.728509 9.787604 
1 1 1   24    6  -33 o   14.458   6.3563   9.7818   14.470   38.635   24.471  -5.7291   17.942   19.913   8.5089   12.500   6.0104 7.413351 10.41760 
1 1 1   24    6  -32 o   10.515   5.1141 -12.0151   13.951  -5.8379   24.106 -15.1259   17.106   13.703   6.6774   11.212   5.4978 2.490698 8.649470 
1 1 1   24    6  -31 o   10.903   5.2707  -9.9468   14.250  -3.6791   24.014 -13.3530   17.703   13.922   6.7568   11.588   5.6633 2.333728 8.816287 
1 1 1   24    6  -30 o   23.278   7.2639   37.092   15.279   38.134   26.157   36.552   18.825   19.611   8.5860   21.285   7.9990 -1.674566 11.73473 
1 1 1   24    6  -29 o   9.4237   4.6982 -24.5052   14.509 -13.2592   24.584 -30.5157   17.972   13.190   6.4924   10.162   5.0907 3.028073 8.250232 
1 1 1   24    6  -28 o   19.784   7.2791   27.894   15.433   12.173   26.049   36.396   19.157   15.909   7.5353   21.177   8.0444 -5.267724 11.02238 
1 1 1   24    6  -27 o   15.604   6.6519   13.814   14.892   39.114   25.550   0.7976   18.326   20.036   8.6302   13.557   6.3906 6.479115 10.73870 
1 1 1   24    6  -26 o   13.657   6.1940   5.2152   14.919   7.7452   26.004   3.9738   18.215   15.463   7.3817   14.036   6.5366 1.427433 9.859844 
1 1 1   24    6  -25 o   16.579   6.8448   17.237   15.007   34.397   26.453   9.0930   18.224   19.133   8.4941   14.916   6.7963 4.217223 10.87843 
1 1 1   24    6  -24 o   17.383   7.0164   20.030   15.340   36.900   27.035   12.020   18.629   19.504   8.6266   15.507   6.9875 3.997317 11.10149 
1 1 1   24    6  -23 o   20.049   7.2624   28.106   15.274   21.470   26.908   31.261   18.553   17.229   7.9969   20.044   7.8358 -2.814938 11.19599 
1 1 1   24    6  -22 o   14.532   6.4457   8.8860   15.198   50.065   27.007 -10.1990   18.386   22.030   9.1467   12.226   5.9287 9.804010 10.90009 
1 1 1   24    6  -21 o   16.695   7.3220   17.778   19.096   0.0000   0.0000   17.778   19.096  ?   ?    16.695   7.3220 0.000000 7.321987 
1 1 1   24    6  -20 o   14.451   6.4312   8.3974   15.257   0.0000   0.0000   8.3974   15.257  ?   ?    14.451   6.4312 0.000000 6.431203 
1 1 1   24    6  -19 o   12.908   6.0094   0.2595   15.373   0.0000   0.0000   0.2595   15.373  ?   ?    12.908   6.0094 0.000000 6.009362 
1 1 1   24    6  -18 o   18.956   7.2001   24.775   15.346   0.0000   0.0000   24.775   15.346  ?   ?    18.956   7.2001 0.000000 7.200095 
1 1 1   24    6  -17 o   15.759   6.4715   14.053   13.320   60.607   27.154  -0.7001   15.286   24.483   9.5056   12.737   5.9503 11.74629 11.21442 
1 1 1   24    6  -16 o   14.132   5.8858   9.3285   11.233   40.581   16.795 -15.9666   15.110   24.085   7.6296   10.583   5.1848 13.50237 9.224584 
1 1 1   24    6  -15 o   11.534   5.3053  -0.8025   11.458   11.818   17.134 -11.0116   15.410   15.453   6.8497   11.284   5.4616 4.168831 8.760506 
1 1 1   24    6  -14 o   15.984   6.1818   14.584   11.451   20.609   17.140   9.7274   15.388   17.524   7.2823   14.826   6.5351 2.698071 9.784625 
1 1 1   24    6  -13 o   11.100   5.1813  -3.1603   11.549 -15.5275   17.270   6.8459   15.534   11.379   5.5681   14.237   6.4012 -2.858368 8.484006 
1 1 1   24    6  -12 f   9.0075   4.4310 -16.2201   11.397 -12.2238   16.993 -19.4871   15.365   11.667   5.6673   10.321   5.0900 1.345710 7.617512 
1 1 1   24    6  -11 o   13.212   5.7744   5.6780   11.785  -2.5054   17.691   12.206   15.801   13.114   6.2110   15.473   6.7254 -2.358356 9.154668 
1 1 1   24    6  -10 o   14.969   6.3548   11.047   13.494   17.266   25.929   8.7366   15.803   16.890   7.8430   14.702   6.5438 2.188200 10.21439 
1 1 1   24    6   -9 o   8.8368   4.3562 -16.9278   11.212  -1.1856   16.826 -29.5001   15.036   13.110   6.1624   9.2884   4.6535 3.821875 7.722051 
1 1 1   24    6   -8 o   11.040   5.1389  -2.9147   11.235 -18.2055   16.573   10.088   15.283   10.893   5.3554   14.944   6.5522 -4.050659 8.462388 
1 1 1   24    6   -7 o   11.244   5.1975  -1.8471   11.193  -6.8850   16.613   2.3402   15.146   12.240   5.8585   13.307   6.1130 -1.067286 8.467068 
1 1 1   24    6   -6 o   21.651   6.2107   27.525   11.531   44.220   14.673   0.5695   18.645   27.162   6.6754   13.790   6.4834 13.37282 9.305640 
1 1 1   24    6   -5 o   17.773   6.4171   19.156   11.913   22.669   14.813   12.722   20.046   18.512   7.0637   15.947   7.2114 2.564939 10.09457 
1 1 1   24    6   -4 o   18.597   6.4024   21.028   11.751   14.293   14.454   34.159   20.182   15.962   6.6645   20.708   8.1495 -4.746083 10.52756 
1 1 1   24    6   -3 o   17.784   6.4016   19.137   11.845   18.171   14.706   20.921   19.987   17.092   6.8802   17.542   7.5946 -0.4498940 10.24769 
1 1 1   24    6   -2 o   15.721   5.9784   13.677   10.588   8.3297   14.297   20.173   15.757   14.409   6.3269   17.610   7.1101 -3.200807 9.517504 
1 1 1   24    6   -1 o   12.036   5.3385   2.6694   10.425   17.207   14.270 -13.9681   15.266   16.824   6.7757   10.915   5.3177 5.908999 8.613256 
1 1 1   24    6    0 o   14.278   5.8189   9.7971   10.668   20.834   14.722  -2.4032   15.479   17.931   6.9887   12.584   5.9137 5.346781 9.154972 
1 1 1   24    6    1 o   12.137   5.3699   2.9755   10.483   9.1874   14.361  -4.1084   15.336   14.626   6.3836   12.274   5.8039 2.351905 8.627563 
1 1 1   24    6    2 o   18.616   6.6874   21.811   12.918   26.064   14.717   7.5311   26.967   19.735   7.1315   15.818   7.5419 3.916184 10.37966 
1 1 1   24    6    3 o   16.944   6.2750   16.919   11.501   14.506   14.735   20.680   18.398   16.032   6.7138   17.558   7.4356 -1.525969 10.01815 
1 1 1   24    6    4 o   15.940   6.1647   14.308   11.387   4.1752   14.472   30.780   18.452   13.518   6.1188   20.224   7.8402 -6.705357 9.945291 
1 1 1   24    6    5 o   10.531   4.9753  -5.5839   11.224 -18.7775   14.261   15.883   18.192   9.9871   4.9213   16.466   7.1857 -6.478710 8.709421 
1 1 1   24    6    6 o   15.088   6.5118   10.979   14.603   6.7964   17.738   19.779   25.726   14.631   6.6813   17.266   7.9447 -2.635506 10.38065 
1 1 1   24    6    7 o   15.112   6.0738   12.030   11.442   17.313   14.811   4.2104   18.019   16.815   6.8551   14.231   6.5838 2.584688 9.504670 
1 1 1   24    6    8 o   13.260   5.7442   6.1033   11.448  -4.6961   14.680   22.865   18.289   11.967   5.6646   18.074   7.5176 -6.107445 9.412846 
1 1 1   24    6    9 o   35.430   4.4177   61.366   12.482   58.100   16.055   66.357   19.847   31.733   6.4274   31.690   7.7488 0.4367447E-01 10.06750 
1 1 1   24    6   10 o   14.317   5.9620   9.6383   11.524   2.9873   14.902   19.530   18.174   13.360   6.1097   17.255   7.3519 -3.895463 9.559257 
1 1 1   24    6   11 o   23.202   6.1374   31.141   11.785   46.053   15.252   9.0480   18.565   27.462   6.8393   15.117   6.8771 12.34441 9.698985 
1 1 1   24    6   12 f   10.779   5.1398  -7.2435   12.532  -4.1386   17.240 -10.7226   18.250   12.766   6.0705   12.204   5.9156 0.5611525 8.476139 
1 1 1   24    6   13 o   12.636   5.8290   0.5591   13.976   11.298   17.268 -19.8349   23.797   15.384   6.8444   12.686   6.2709 2.698153 9.282740 
1 1 1   24    6   14 o   24.633   9.5046   60.488   27.023   0.0000   0.0000   60.488   27.023  ?   ?    24.633   9.5046 0.000000 9.504592 
1 1 1   24    6   15 o   16.277   6.7651   15.699   14.795   19.776   18.349   8.1241   25.011   17.236   7.3666   15.602   7.3880 1.633253 10.43309 
1 1 1   24    6   16 o   23.655   6.5046   33.811   12.931   21.972   17.693   47.386   18.947   17.796   7.3973   25.258   8.1149 -7.462122 10.98047 
1 1 1   24    6   17 o   25.917   6.2461   38.993   13.039   57.248   18.318   20.240   18.565   29.379   7.5940   17.299   7.4023 12.07965 10.60482 
1 1 1   24    6   18 o   9.1567   4.5153 -17.4937   12.077 -18.7654   16.532 -16.0382   17.685   10.774   5.3072   11.421   5.5981 -0.6463785 7.713959 
1 1 1   24    6   19 o   16.896   6.9219   18.098   15.192   22.311   27.080   16.163   18.352   17.414   8.0617   16.379   7.1810 1.034649 10.79616 
1 1 1   24    6   20 o   20.077   7.2785   28.120   15.346   22.551   26.754   30.850   18.734   17.432   8.0498   19.935   7.8497 -2.502771 11.24357 
1 1 1   24    6   21 o   20.296   7.3132   28.889   15.463   27.388   26.998   29.622   18.864   18.086   8.2529   19.545   7.8182 -1.458799 11.36812 
1 1 1   24    6   22 o   11.147   5.3688  -9.2669   14.455 -37.2978   25.320   4.2866   17.606   11.759   5.9113   14.038   6.4992 -2.279087 8.785447 
1 1 1   24    6   23 o   26.409   7.1124   44.800   15.650   91.108   29.279   26.276   18.518   30.855   10.101   18.686   7.6470 12.16944 12.66944 
1 1 1   24    6   24 o   13.312   6.1024   3.2211   14.987  -8.7888   26.886   8.6354   18.052   14.036   6.8844   14.832   6.7604 -0.7960911 9.648783 
1 1 1   24    6   25 o   11.627   5.6668 -12.7954   17.375   0.0000   0.0000 -12.7954   17.375  ?   ?    11.627   5.6668 0.000000 5.666831 
1 1 1   24    6   26 o   18.971   7.1678   25.107   15.161   5.1114   27.321   34.003   18.224   15.301   7.3725   20.880   7.8653 -5.579223 10.78039 
1 1 1   24    6   27 o   19.013   7.7366   28.191   18.823   34.199   27.219   22.684   26.059   18.909   8.4897   17.287   7.9691 1.622578 11.64395 
1 1 1   24    6   28 o   20.393   7.9315   33.447   18.930   8.6627   26.904   57.750   26.642   15.573   7.4543   23.576   9.3367 -8.003207 11.94744 
1 1 1   24    6   29 o   11.129   5.5034 -20.2967   18.386 -35.7726   27.099  -7.0958   25.028   12.138   6.1040   13.797   6.7411 -1.659049 9.093987 
1 1 1   24    6   30 o   11.499   5.6263 -14.0809   17.616 -41.6879   25.421   11.421   24.433   11.443   5.7742   15.676   7.3862 -4.232934 9.375333 
1 1 1   24    6   31 o   11.774   5.7401 -12.0523   17.868  -4.1636   26.194 -18.9180   24.437   14.183   6.9223   12.678   6.2826 1.505357 9.348232 
1 1 1   24    6   32 o   23.249   8.1367   43.305   19.017   35.397   27.910   50.157   25.982   18.788   8.5013   21.907   9.0215 -3.118835 12.39597 
1 1 1   24    6   33 o   13.406   6.3275   0.8194   18.074 -21.1957   25.606   22.678   25.515   12.699   6.3163   17.093   7.8819 -4.394497 10.10052 
1 1 1   24    6   34 o   17.707   7.4796   23.536   18.538   31.364   27.410   16.936   25.166   18.222   8.3152   16.322   7.6284 1.899996 11.28432 
1 1 1   24    6   35 o   15.096   6.8754   10.852   18.624   13.137   26.582   8.6480   26.102   15.912   7.5584   15.387   7.3592 0.5247335 10.54926 
1 1 1   24    6   36 o   19.539   7.8325   31.035   18.974   22.289   27.558   38.919   26.164   17.009   7.9603   19.620   8.5887 -2.610958 11.71035 
1 1 1   24    6   37 o   13.357   6.2968   0.8077   17.798   7.0380   25.600  -5.0209   24.761   15.173   7.2651   13.867   6.7598 1.305651 9.923555 
1 1 1   24    6   38 o   13.794   6.4745   2.8612   18.459  -3.2048   27.158   8.0706   25.167   14.365   7.0190   15.271   7.2822 -0.9062767 10.11420 
1 1 1   24    6   39 o   10.770   5.4798 -59.0589   26.227   0.0000   0.0000 -59.0589   26.227  ?   ?    10.770   5.4798 0.000000 5.479814 
1 1 1   24    7  -25 o   11.573   5.8017 -31.1821   23.550   0.0000   0.0000 -31.1821   23.550  ?   ?    11.573   5.8017 0.000000 5.801723 
1 1 1   24    7  -24 o   13.479   6.5836  -7.0401   23.824   0.0000   0.0000  -7.0401   23.824  ?   ?    13.479   6.5836 0.000000 6.583581 
1 1 1   24    7  -23 o   11.134   5.6064 -36.8568   23.254   0.0000   0.0000 -36.8568   23.254  ?   ?    11.134   5.6064 0.000000 5.606361 
1 1 1   24    7  -22 o   14.606   7.0208   3.7054   24.428   0.0000   0.0000   3.7054   24.428  ?   ?    14.606   7.0208 0.000000 7.020778 
1 1 1   24    7  -21 o   10.438   5.1312 -16.1671   15.197 -23.0976   26.324 -12.7024   18.613   12.641   6.3064   11.830   5.7871 0.8110676 8.559237 
1 1 1   24    7  -20 o   14.286   6.3872   8.8895   15.232 -15.3707   25.940   21.657   18.818   13.117   6.4956   17.138   7.3944 -4.020782 9.842247 
1 1 1   24    7  -19 o   17.151   6.9823   20.318   15.341   19.208   24.860   21.001   19.496   16.510   7.6711   16.951   7.4173 -0.4413376 10.67064 
1 1 1   24    7  -18 o   15.338   6.6337   13.502   15.219   29.449   25.107   4.2388   19.136   18.014   8.1151   14.014   6.5823 3.999708 10.44899 
1 1 1   24    7  -17 o   16.374   6.8674   17.580   15.452   3.1022   25.279   26.218   19.525   14.629   7.0596   18.081   7.6587 -3.452052 10.41603 
1 1 1   24    7  -16 o   13.162   6.0741   3.2491   15.195   4.1729   25.130   2.7167   19.077   14.722   7.0878   13.783   6.5044 0.9386425 9.619940 
1 1 1   24    7  -15 o   14.912   6.5641   11.658   15.476   35.358   26.104  -1.1854   19.217   18.835   8.3953   13.283   6.3423 5.552026 10.52170 
1 1 1   24    7  -14 o   10.359   4.9959  -9.0911   12.614 -11.0795   24.190  -8.3485   14.783   13.154   6.4678   11.232   5.4146 1.922699 8.435102 
1 1 1   24    7  -13 o   14.092   6.1143   9.2635   13.012   34.047   25.961   0.9480   15.038   18.649   8.3381   12.722   5.9295 5.927080 10.23144 
1 1 1   24    7  -12 o   18.297   6.7582   22.576   13.325  -7.8734   25.715   33.752   15.580   13.682   6.7153   21.581   7.3737 -7.899689 9.973323 
1 1 1   24    7  -11 o   13.266   6.1165   3.5446   15.360 -48.1532   25.288   33.768   19.335   11.004   5.5763   20.061   7.9511 -9.057210 9.711555 
1 1 1   24    7  -10 o   11.639   5.4263  -1.4044   12.605 -10.6017   16.761   10.567   19.123   11.570   5.6224   15.027   6.8903 -3.456277 8.893086 
1 1 1   24    7   -9 o   12.005   5.7120  -4.1327   15.305 -10.6273   25.409  -0.4344   19.174   13.431   6.6089   13.406   6.3827 0.2534485E-01 9.187818 
1 1 1   24    7   -8 o   21.976   6.5155   30.412   12.506   23.816   17.039   38.116   18.415   17.936   7.3371   21.759   7.9602 -3.822721 10.82578 
1 1 1   24    7   -7 o   28.564   5.6308   45.118   12.644   41.018   17.648   49.442   18.124   23.159   7.8491   25.921   7.8801 -2.762308 11.12227 
1 1 1   24    7   -6 o   14.112   6.0115   9.5743   12.147  -0.5970   16.595   21.316   17.830   12.872   6.0719   17.215   7.3063 -4.342402 9.499994 
1 1 1   24    7   -5 o   13.368   5.8061   7.1259   11.757   7.3304   16.202   6.8984   17.089   14.151   6.4324   14.197   6.5114 -0.4660797E-01 9.152760 
1 1 1   24    7   -4 o   19.119   6.5505   23.642   12.297   15.476   17.118   32.350   17.677   15.905   6.9552   20.281   7.7219 -4.375899 10.39239 
1 1 1   24    7   -3 o   11.045   5.1940  -3.5423   11.977   19.501   16.279 -30.7360   17.685   16.904   7.0663   10.012   5.0203 6.891763 8.668077 
1 1 1   24    7   -2 o   18.222   6.5227   21.445   12.278   35.528   16.820   5.3816   17.964   21.697   7.6476   14.074   6.5331 7.622673 10.05819 
1 1 1   24    7   -1 o   9.4045   4.6051 -14.0390   11.876 -29.8285   16.054   5.0428   17.649   9.5260   4.7776   13.972   6.4820 -4.445789 8.052468 
1 1 1   24    7    0 o   10.067   4.8520  -9.1657   11.852  -4.8081   16.325 -14.0224   17.234   12.207   5.8332   11.351   5.5559 0.8563786 8.055722 
1 1 1   24    7    1 o   18.241   6.6461   21.880   12.817   33.957   17.957   9.3370   18.301   20.684   7.8039   14.781   6.7638 5.903155 10.32711 
1 1 1   24    7    2 o   16.520   6.6870   17.495   13.977   20.265   16.821   11.320   25.118   17.058   7.1604   15.601   7.3921 1.457419 10.29148 
1 1 1   24    7    3 o   18.551   6.5923   22.447   12.520   28.788   17.228   15.350   18.225   19.345   7.5542   15.900   7.0553 3.444989 10.33646 
1 1 1   24    7    4 o   8.6569   4.3016 -20.0238   11.758 -31.8415   16.330  -7.3000   16.945   9.4705   4.7592   12.041   5.8029 -2.570693 7.504929 
1 1 1   24    7    5 o   12.881   5.7534   4.7422   12.326 -11.0623   17.016   22.192   17.880   11.609   5.6464   17.428   7.3528 -5.819259 9.270670 
1 1 1   24    7    6 o   16.437   7.0738   17.857   17.137   31.196   22.539  -0.4189   26.382   18.765   8.0942   14.472   7.0372 4.292931 10.72559 
1 1 1   24    7    7 o   16.594   6.4635   17.348   12.586   3.1768   17.064   34.260   18.641   13.554   6.3170   20.490   7.8972 -6.936507 10.11289 
1 1 1   24    7    8 o   11.063   5.2162  -3.8933   12.224 -15.1502   16.807   8.7494   17.812   11.090   5.4405   14.601   6.6782 -3.510665 8.613783 
1 1 1   24    7    9 o   11.906   5.4927   0.2528   12.414   3.8684   16.898  -3.9865   18.297   13.626   6.3287   12.771   6.1222 0.8549147 8.805319 
1 1 1   24    7   10 o   13.777   6.2560   6.2785   15.278   18.402   26.841   0.4674   18.583   16.448   7.7475   13.411   6.3557 3.036781 10.02091 
1 1 1   24    7   11 o   10.466   5.1262 -14.5401   14.744   14.156   26.962 -26.7813   17.610   15.948   7.5859   10.272   5.1295 5.675988 9.157318 
1 1 1   24    7   12 o   20.214   7.3109   29.879   15.471   20.040   27.923   34.237   18.584   16.615   7.8492   20.432   7.8825 -3.817459 11.12403 
1 1 1   24    7   13 o   14.427   6.4067   9.6457   15.060   13.799   27.875   7.9336   17.896   15.913   7.6091   14.427   6.6337 1.486390 10.09475 
1 1 1   24    7   14 o   14.222   6.3156   8.9785   14.632   24.969   27.624   2.7423   17.251   17.189   8.0199   13.472   6.3029 3.716314 10.20023 
1 1 1   24    7   15 o   23.367   7.2410   37.820   15.212   13.657   27.459   48.521   18.273   15.877   7.5811   25.351   7.9486 -9.473318 10.98421 
1 1 1   24    7   16 o   12.393   5.7912  -0.1720   14.495   3.8527   26.679  -1.8578   17.266   14.837   7.1821   12.797   6.0825 2.039288 9.411684 
1 1 1   24    7   17 o   14.742   6.4757   11.064   14.992   10.801   26.501   11.188   18.180   15.532   7.4249   15.029   6.8245 0.5037518 10.08478 
1 1 1   24    7   18 o   29.218   6.6907   52.660   15.591   19.785   27.398   68.404   18.961   16.575   7.8135   32.234   7.3761 -15.65880 10.74512 
1 1 1   24    7   19 o   16.792   7.2948   19.997   18.569   38.295   28.139   5.8837   24.713   18.999   8.5722   14.872   7.1256 4.126981 11.14704 
1 1 1   24    7   20 o   11.055   5.4586 -18.4692   17.852   3.6440   26.388 -37.1336   24.243   14.796   7.1577   11.345   5.7142 3.450541 9.158854 
1 1 1   24    7   21 o   14.228   6.9401  -2.2619   26.220  -2.2619   26.220   0.0000   0.0000   14.228   6.9401  ?   ?  0.000000 6.940062 
1 1 1   24    7   22 o   12.691   6.0736  -3.6249   17.842  -5.0022   26.460  -2.4765   24.161   14.019   6.8665   13.941   6.7689 0.7736969E-01 9.641912 
1 1 1   24    7   23 o   14.052   6.5623   5.0116   18.562   3.8443   27.063   6.0486   25.508   14.885   7.2121   14.968   7.1893 -0.8296013E-01 10.18334 
1 1 1   24    7   24 o   13.610   6.6787  -8.3158   25.387   0.0000   0.0000  -8.3158   25.387  ?   ?    13.610   6.6787 0.000000 6.678664 
1 1 1   24    7   25 o   19.660   8.7489   42.139   28.233   0.0000   0.0000   42.139   28.233  ?   ?    19.660   8.7489 0.000000 8.748915 
1 1 1   25    0  -58 o   21.053   11.427   47.005   27.572   47.005   27.572   47.005   27.572   21.053   11.427   21.053   11.427 0.000000 0.000000 
1 1 1   25    0  -57 o   10.227   7.2354 -14.2623   24.743 -14.2623   24.743 -14.2623   24.743   10.227   7.2354   10.227   7.2354 0.000000 0.000000 
1 1 1   25    0  -56 o   7.5461   5.5563 -55.9635   24.277 -55.9635   24.277 -55.9635   24.277   7.5461   5.5563   7.5461   5.5563 0.000000 0.000000 
1 1 1   25    0  -55 o   20.176   10.971   41.061   25.462   41.061   25.462   41.061   25.462   20.176   10.971   20.176   10.971 0.000000 0.000000 
1 1 1   25    0  -54 o   10.807   7.5711  -9.3898   25.092  -9.3898   25.092  -9.3898   25.092   10.807   7.5711   10.807   7.5711 0.000000 0.000000 
1 1 1   25    0  -53 o   12.581   8.4921   5.2980   25.328   5.2980   25.328   5.2980   25.328   12.581   8.4921   12.581   8.4921 0.000000 0.000000 
1 1 1   25    0  -52 o   14.307   9.2822   15.949   25.760   15.949   25.760   15.949   25.760   14.307   9.2822   14.307   9.2822 0.000000 0.000000 
1 1 1   25    0  -51 o   12.311   8.3909   2.1471   25.972   2.1471   25.972   2.1471   25.972   12.311   8.3909   12.311   8.3909 0.000000 0.000000 
1 1 1   25    0  -50 o   22.165   11.357   46.804   26.012   46.804   26.012   46.804   26.012   22.165   11.357   22.165   11.357 0.000000 0.000000 
1 1 1   25    0  -49 o   12.160   8.3035   0.7467   25.692   0.7467   25.692   0.7467   25.692   12.160   8.3035   12.160   8.3035 0.000000 0.000000 
1 1 1   25    0  -48 o   33.792   6.6625   58.302   16.323   58.302   16.323   58.302   16.323   33.792   6.6625   33.792   6.6625 0.000000 0.000000 
1 1 1   25    0  -47 o   40.523   5.4044   77.565   16.964   77.565   16.964   77.565   16.964   40.523   5.4044   40.523   5.4044 0.000000 0.000000 
1 1 1   25    0  -46 o   13.919   8.0822   15.083   15.025   15.083   15.025   15.083   15.025   13.919   8.0822   13.919   8.0822 0.000000 0.000000 
1 1 1   25    0  -45 o   21.023   9.0761   31.954   16.000   31.954   16.000   31.954   16.000   21.023   9.0761   21.023   9.0761 0.000000 0.000000 
1 1 1   25    0  -44 o   5.7648   4.2200 -28.2822   12.546 -28.2822   12.546 -28.2822   12.546   5.7648   4.2200   5.7648   4.2200 0.000000 0.000000 
1 1 1   25    0  -43 f   12.981   7.5532   12.335   13.166   12.335   13.166   12.335   13.166   12.981   7.5532   12.981   7.5532 0.000000 0.000000 
1 1 1   25    0  -42 o   9.7291   6.5606  -1.6495   15.045  -1.6495   15.045  -1.6495   15.045   9.7291   6.5606   9.7291   6.5606 0.000000 0.000000 
1 1 1   25    0  -41 o   13.831   8.1144   14.466   15.404   14.466   15.404   14.466   15.404   13.831   8.1144   13.831   8.1144 0.000000 0.000000 
1 1 1   25    0  -40 o   9.0609   6.2243  -5.5977   14.925  -5.5977   14.925  -5.5977   14.925   9.0609   6.2243   9.0609   6.2243 0.000000 0.000000 
1 1 1   25    0  -39 f   8.0829   5.6327  -8.7695   13.373  -8.7695   13.373  -8.7695   13.373   8.0829   5.6327   8.0829   5.6327 0.000000 0.000000 
1 1 1   25    0  -38 o   12.175   7.3498   9.5988   13.331   9.5988   13.331   9.5988   13.331   12.175   7.3498   12.175   7.3498 0.000000 0.000000 
1 1 1   25    0  -37 o   16.140   8.1833   19.376   13.422   19.376   13.422   19.376   13.422   16.140   8.1833   16.140   8.1833 0.000000 0.000000 
1 1 1   25    0  -36 o   9.9143   6.4791   1.7122   12.878   1.7122   12.878   1.7122   12.878   9.9143   6.4791   9.9143   6.4791 0.000000 0.000000 
1 1 1   25    0  -35 o   20.467   8.3411   27.562   13.669   27.562   13.669   27.562   13.669   20.467   8.3411   20.467   8.3411 0.000000 0.000000 
1 1 1   25    0  -34 o   23.819   8.0088   33.575   13.885   33.575   13.885   33.575   13.885   23.819   8.0088   23.819   8.0088 0.000000 0.000000 
1 1 1   25    0  -33 o   9.3376   6.2684  -2.0147   13.450  -2.0147   13.450  -2.0147   13.450   9.3376   6.2684   9.3376   6.2684 0.000000 0.000000 
1 1 1   25    0  -32 o   7.6284   5.4477 -18.7269   15.259 -18.7269   15.259 -18.7269   15.259   7.6284   5.4477   7.6284   5.4477 0.000000 0.000000 
1 1 1   25    0  -31 o   16.123   8.2424   18.983   13.683   18.983   13.683   18.983   13.683   16.123   8.2424   16.123   8.2424 0.000000 0.000000 
1 1 1   25    0  -30 o   7.4603   5.2771 -13.4655   13.139 -13.4655   13.139 -13.4655   13.139   7.4603   5.2771   7.4603   5.2771 0.000000 0.000000 
1 1 1   25    0  -29 o   9.8161   6.4792   0.1682   13.374   0.1682   13.374   0.1682   13.374   9.8161   6.4792   9.8161   6.4792 0.000000 0.000000 
1 1 1   25    0  -28 o   15.721   8.2739   18.047   14.067   18.047   14.067   18.047   14.067   15.721   8.2739   15.721   8.2739 0.000000 0.000000 
1 1 1   25    0  -27 o   13.479   7.7995   12.420   13.916   12.420   13.916   12.420   13.916   13.479   7.7995   13.479   7.7995 0.000000 0.000000 
1 1 1   25    0  -26 o   14.471   8.0689   14.958   14.158   14.958   14.158   14.958   14.158   14.471   8.0689   14.471   8.0689 0.000000 0.000000 
1 1 1   25    0  -25 o   15.587   8.9783   17.922   18.314   17.922   18.314   17.922   18.314   15.587   8.9783   15.587   8.9783 0.000000 0.000000 
1 1 1   25    0  -24 o   9.0768   6.3474 -12.7289   17.400 -12.7289   17.400 -12.7289   17.400   9.0768   6.3474   9.0768   6.3474 0.000000 0.000000 
1 1 1   25    0  -23 o   16.355   9.1615   20.061   18.355   20.061   18.355   20.061   18.355   16.355   9.1615   16.355   9.1615 0.000000 0.000000 
1 1 1   25    0  -22 o   10.305   6.9824  -4.2637   17.450  -4.2637   17.450  -4.2637   17.450   10.305   6.9824   10.305   6.9824 0.000000 0.000000 
1 1 1   25    0  -21 o   18.042   8.5506   22.643   14.273   22.643   14.273   22.643   14.273   18.042   8.5506   18.042   8.5506 0.000000 0.000000 
1 1 1   25    0  -20 o   8.9202   6.0891  -5.6345   13.790  -5.6345   13.790  -5.6345   13.790   8.9202   6.0891   8.9202   6.0891 0.000000 0.000000 
1 1 1   25    0  -19 o   8.8690   6.0657  -6.0572   13.827  -6.0572   13.827  -6.0572   13.827   8.8690   6.0657   8.8690   6.0657 0.000000 0.000000 
1 1 1   25    0  -18 o   17.130   8.4575   20.599   14.152   20.599   14.152   20.599   14.152   17.130   8.4575   17.130   8.4575 0.000000 0.000000 
1 1 1   25    0  -17 o   33.689   5.9745   53.673   14.869   53.673   14.869   53.673   14.869   33.689   5.9745   33.689   5.9745 0.000000 0.000000 
1 1 1   25    0  -16 o   19.086   8.6150   24.546   14.393   24.546   14.393   24.546   14.393   19.086   8.6150   19.086   8.6150 0.000000 0.000000 
1 1 1   25    0  -15 o   36.497   5.6160   61.513   15.533   61.513   15.533   61.513   15.533   36.497   5.6160   36.497   5.6160 0.000000 0.000000 
1 1 1   25    0  -14 o   49.418   5.2883  109.060   20.688  109.060   20.688  109.060   20.688   49.418   5.2883   49.418   5.2883 0.000000 0.000000 
1 1 1   25    0  -13 o   9.1623   6.2105  -4.5659   13.829  -4.5659   13.829  -4.5659   13.829   9.1623   6.2105   9.1623   6.2105 0.000000 0.000000 
1 1 1   25    0  -12 o   9.4180   6.3307  -3.1665   13.801  -3.1665   13.801  -3.1665   13.801   9.4180   6.3307   9.4180   6.3307 0.000000 0.000000 
1 1 1   25    0  -11 o   7.6029   5.3694 -13.9547   13.424 -13.9547   13.424 -13.9547   13.424   7.6029   5.3694   7.6029   5.3694 0.000000 0.000000 
1 1 1   25    0  -10 o   31.314   6.9194   48.652   15.447   48.652   15.447   48.652   15.447   31.314   6.9194   31.314   6.9194 0.000000 0.000000 
1 1 1   25    0   -9 o   15.431   9.4934   14.828   23.180   14.828   23.180   14.828   23.180   15.431   9.4934   15.431   9.4934 0.000000 0.000000 
1 1 1   25    0   -8 o   54.843   4.6264  130.852   20.331  130.852   20.331  130.852   20.331   54.843   4.6264   54.843   4.6264 0.000000 0.000000 
1 1 1   25    0   -7 o   12.760   8.0081   7.3814   17.336   7.3814   17.336   7.3814   17.336   12.760   8.0081   12.760   8.0081 0.000000 0.000000 
1 1 1   25    0   -6 o   64.239   4.2903  177.136   22.232  177.136   22.232  177.136   22.232   64.239   4.2903   64.239   4.2903 0.000000 0.000000 
1 1 1   25    0   -5 o   18.863   8.6590   23.980   14.558   23.980   14.558   23.980   14.558   18.863   8.6590   18.863   8.6590 0.000000 0.000000 
1 1 1   25    0   -4 o   9.9418   6.5600  -0.5378   13.692  -0.5378   13.692  -0.5378   13.692   9.9418   6.5600   9.9418   6.5600 0.000000 0.000000 
1 1 1   25    0   -3 o   11.723   7.5385   3.7714   16.502   3.7714   16.502   3.7714   16.502   11.723   7.5385   11.723   7.5385 0.000000 0.000000 
1 1 1   25    0   -2 o   50.723   4.6570  112.268   18.862  112.268   18.862  112.268   18.862   50.723   4.6570   50.723   4.6570 0.000000 0.000000 
1 1 1   25    0   -1 o   15.976   8.8299   18.054   16.782   18.054   16.782   18.054   16.782   15.976   8.8299   15.976   8.8299 0.000000 0.000000 
1 1 1   25    0    0 o   13.265   8.0795   9.8613   16.415   9.8613   16.415   9.8613   16.415   13.265   8.0795   13.265   8.0795 0.000000 0.000000 
1 1 1   25    0    1 o   9.7452   6.4855  -1.7447   13.857  -1.7447   13.857  -1.7447   13.857   9.7452   6.4855   9.7452   6.4855 0.000000 0.000000 
1 1 1   25    0    2 o   14.613   8.0721   14.592   14.016   14.592   14.016   14.592   14.016   14.613   8.0721   14.613   8.0721 0.000000 0.000000 
1 1 1   25    0    3 o   8.2568   5.7452 -10.1776   13.772 -10.1776   13.772 -10.1776   13.772   8.2568   5.7452   8.2568   5.7452 0.000000 0.000000 
1 1 1   25    0    4 o   55.405   3.7621  130.648   16.808  130.648   16.808  130.648   16.808   55.405   3.7621   55.405   3.7621 0.000000 0.000000 
1 1 1   25    0    5 o   84.059   2.9751  294.654   20.327  294.654   20.327  294.654   20.327   84.059   2.9751   84.059   2.9751 0.000000 0.000000 
1 1 1   25    0    6 o   37.481   5.2871   63.724   15.229   63.724   15.229   63.724   15.229   37.481   5.2871   37.481   5.2871 0.000000 0.000000 
1 1 1   25    0    7 o   22.414   8.5110   30.641   14.610   30.641   14.610   30.641   14.610   22.414   8.5110   22.414   8.5110 0.000000 0.000000 
1 1 1   25    0    8 o   23.957   8.2555   33.323   14.512   33.323   14.512   33.323   14.512   23.957   8.2555   23.957   8.2555 0.000000 0.000000 
1 1 1   25    0    9 o   32.475   6.1760   50.315   14.631   50.315   14.631   50.315   14.631   32.475   6.1760   32.475   6.1760 0.000000 0.000000 
1 1 1   25    0   10 o   12.632   7.6429   8.9806   14.482   8.9806   14.482   8.9806   14.482   12.632   7.6429   12.632   7.6429 0.000000 0.000000 
1 1 1   25    0   11 o   67.680   3.3071  192.629   18.145  192.629   18.145  192.629   18.145   67.680   3.3071   67.680   3.3071 0.000000 0.000000 
1 1 1   25    0   12 o   29.312   7.1945   43.861   14.886   43.861   14.886   43.861   14.886   29.312   7.1945   29.312   7.1945 0.000000 0.000000 
1 1 1   25    0   13 o   12.625   7.5566   9.3731   13.853   9.3731   13.853   9.3731   13.853   12.625   7.5566   12.625   7.5566 0.000000 0.000000 
1 1 1   25    0   14 o   17.141   8.4125   20.421   13.967   20.421   13.967   20.421   13.967   17.141   8.4125   17.141   8.4125 0.000000 0.000000 
1 1 1   25    0   15 o   13.596   8.2971   10.812   17.383   10.812   17.383   10.812   17.383   13.596   8.2971   13.596   8.2971 0.000000 0.000000 
1 1 1   25    0   16 o   8.1324   5.7959 -20.5050   16.943 -20.5050   16.943 -20.5050   16.943   8.1324   5.7959   8.1324   5.7959 0.000000 0.000000 
1 1 1   25    0   17 o   7.6400   5.4899 -24.2136   16.522 -24.2136   16.522 -24.2136   16.522   7.6400   5.4899   7.6400   5.4899 0.000000 0.000000 
1 1 1   25    0   18 o   11.066   7.0153   4.4130   13.683   4.4130   13.683   4.4130   13.683   11.066   7.0153   11.066   7.0153 0.000000 0.000000 
1 1 1   25    0   19 o   12.111   7.3664   8.1015   13.604   8.1015   13.604   8.1015   13.604   12.111   7.3664   12.111   7.3664 0.000000 0.000000 
1 1 1   25    0   20 o   9.1089   6.1745  -4.3273   13.671  -4.3273   13.671  -4.3273   13.671   9.1089   6.1745   9.1089   6.1745 0.000000 0.000000 
1 1 1   25    0   21 o   26.213   7.8158   37.840   14.536   37.840   14.536   37.840   14.536   26.213   7.8158   26.213   7.8158 0.000000 0.000000 
1 1 1   25    0   22 o   30.352   6.8689   46.328   14.821   46.328   14.821   46.328   14.821   30.352   6.8689   30.352   6.8689 0.000000 0.000000 
1 1 1   25    0   23 o   18.117   8.5642   22.925   14.310   22.925   14.310   22.925   14.310   18.117   8.5642   18.117   8.5642 0.000000 0.000000 
1 1 1   25    0   24 o   8.4142   5.9661 -17.8373   17.138 -17.8373   17.138 -17.8373   17.138   8.4142   5.9661   8.4142   5.9661 0.000000 0.000000 
1 1 1   25    0   25 o   29.444   7.0667   44.497   14.710   44.497   14.710   44.497   14.710   29.444   7.0667   29.444   7.0667 0.000000 0.000000 
1 1 1   25    0   26 o   21.705   8.5913   30.125   14.637   30.125   14.637   30.125   14.637   21.705   8.5913   21.705   8.5913 0.000000 0.000000 
1 1 1   25    0   27 o   15.394   8.2987   17.313   14.447   17.313   14.447   17.313   14.447   15.394   8.2987   15.394   8.2987 0.000000 0.000000 
1 1 1   25    0   28 o   10.563   6.8536   2.5189   14.050   2.5189   14.050   2.5189   14.050   10.563   6.8536   10.563   6.8536 0.000000 0.000000 
1 1 1   25    0   29 o   18.741   8.5650   24.450   14.238   24.450   14.238   24.450   14.238   18.741   8.5650   18.741   8.5650 0.000000 0.000000 
1 1 1   25    0   30 o   10.861   6.9632   3.9818   13.944   3.9818   13.944   3.9818   13.944   10.861   6.9632   10.861   6.9632 0.000000 0.000000 
1 1 1   25    0   31 o   7.3064   5.2062 -16.3626   13.644 -16.3626   13.644 -16.3626   13.644   7.3064   5.2062   7.3064   5.2062 0.000000 0.000000 
1 1 1   25    0   32 o   8.5492   5.9113  -7.7171   13.999  -7.7171   13.999  -7.7171   13.999   8.5492   5.9113   8.5492   5.9113 0.000000 0.000000 
1 1 1   25    0   33 o   17.606   9.1089   23.873   16.839   23.873   16.839   23.873   16.839   17.606   9.1089   17.606   9.1089 0.000000 0.000000 
1 1 1   25    0   34 o   11.938   7.5615   6.8890   15.856   6.8890   15.856   6.8890   15.856   11.938   7.5615   11.938   7.5615 0.000000 0.000000 
1 1 1   25    0   35 o   7.5701   5.4166 -19.4569   15.378 -19.4569   15.378 -19.4569   15.378   7.5701   5.4166   7.5701   5.4166 0.000000 0.000000 
1 1 1   25    0   36 o   13.618   8.2055   12.965   16.552   12.965   16.552   12.965   16.552   13.618   8.2055   13.618   8.2055 0.000000 0.000000 
1 1 1   25    0   37 o   25.384   8.9138   40.330   16.717   40.330   16.717   40.330   16.717   25.384   8.9138   25.384   8.9138 0.000000 0.000000 
1 1 1   25    0   38 o   10.121   6.8048  -1.3082   15.965  -1.3082   15.965  -1.3082   15.965   10.121   6.8048   10.121   6.8048 0.000000 0.000000 
1 1 1   25    0   39 f   25.157   9.0133   40.409   16.888   40.409   16.888   40.409   16.888   25.157   9.0133   25.157   9.0133 0.000000 0.000000 
1 1 1   25    0   40 o   12.422   7.8009   9.1906   16.479   9.1906   16.479   9.1906   16.479   12.422   7.8009   12.422   7.8009 0.000000 0.000000 
1 1 1   25    0   41 o   20.123   9.3499   30.772   17.001   30.772   17.001   30.772   17.001   20.123   9.3499   20.123   9.3499 0.000000 0.000000 
1 1 1   25    0   42 o   9.0411   6.2945  -9.0615   16.595  -9.0615   16.595  -9.0615   16.595   9.0411   6.2945   9.0411   6.2945 0.000000 0.000000 
1 1 1   25    0   45 o   30.671   11.202   67.341   25.808   67.341   25.808   67.341   25.808   30.671   11.202   30.671   11.202 0.000000 0.000000 
1 1 1   25    0   46 o   15.549   9.7089   21.188   25.146   21.188   25.146   21.188   25.146   15.549   9.7089   15.549   9.7089 0.000000 0.000000 
1 1 1   25    0   47 o   21.038   11.325   43.550   26.871   43.550   26.871   43.550   26.871   21.038   11.325   21.038   11.325 0.000000 0.000000 
1 1 1   25    0   48 o   21.364   10.759   40.738   23.119   40.738   23.119   40.738   23.119   21.364   10.759   21.364   10.759 0.000000 0.000000 
1 1 1   25    0   49 o   12.819   8.4613   8.0883   22.805   8.0883   22.805   8.0883   22.805   12.819   8.4613   12.819   8.4613 0.000000 0.000000 
1 1 1   25    0   50 o   27.309   10.981   56.812   23.784   56.812   23.784   56.812   23.784   27.309   10.981   27.309   10.981 0.000000 0.000000 
1 1 1   25    0   51 o   15.274   9.4055   20.830   22.804   20.830   22.804   20.830   22.804   15.274   9.4055   15.274   9.4055 0.000000 0.000000 
1 1 1   25    0   52 o   9.7449   6.9001 -15.5238   22.655 -15.5238   22.655 -15.5238   22.655   9.7449   6.9001   9.7449   6.9001 0.000000 0.000000 
1 1 1   25    0   53 o   12.894   8.4927   9.3128   22.784   9.3128   22.784   9.3128   22.784   12.894   8.4927   12.894   8.4927 0.000000 0.000000 
1 1 1   25    0   54 o   11.530   7.8190   1.3949   21.967   1.3949   21.967   1.3949   21.967   11.530   7.8190   11.530   7.8190 0.000000 0.000000 
1 1 1   25    0   55 o   8.5781   6.1735 -25.1036   21.252 -25.1036   21.252 -25.1036   21.252   8.5781   6.1735   8.5781   6.1735 0.000000 0.000000 
1 1 1   25    0   56 o   13.097   8.5619   11.007   22.517   11.007   22.517   11.007   22.517   13.097   8.5619   13.097   8.5619 0.000000 0.000000 
1 1 1   25    0   57 o   10.837   7.4780  -3.6156   22.130  -3.6156   22.130  -3.6156   22.130   10.837   7.4780   10.837   7.4780 0.000000 0.000000 
1 1 1   25    0   58 o   23.325   11.206   49.763   24.602   49.763   24.602   49.763   24.602   23.325   11.206   23.325   11.206 0.000000 0.000000 
1 1 1   25    0   59 o   9.2856   6.6141 -17.8223   21.948 -17.8223   21.948 -17.8223   21.948   9.2856   6.6141   9.2856   6.6141 0.000000 0.000000 
1 1 1   25    0   60 o   14.942   9.2754   20.768   22.610   20.768   22.610   20.768   22.610   14.942   9.2754   14.942   9.2754 0.000000 0.000000 
1 1 1   25    0   61 o   11.534   7.8252   2.3366   22.057   2.3366   22.057   2.3366   22.057   11.534   7.8252   11.534   7.8252 0.000000 0.000000 
1 1 1   25    0   62 o   7.0815   5.2136 -49.8257   21.323 -49.8257   21.323 -49.8257   21.323   7.0815   5.2136   7.0815   5.2136 0.000000 0.000000 
1 1 1   25    0   63 o   16.308   9.8115   27.344   23.593   27.344   23.593   27.344   23.593   16.308   9.8115   16.308   9.8115 0.000000 0.000000 
1 1 1   25    0   64 o   9.8351   6.9406 -11.8844   22.293 -11.8844   22.293 -11.8844   22.293   9.8351   6.9406   9.8351   6.9406 0.000000 0.000000 
1 1 1   25    0   65 o   12.679   8.3729   10.225   22.373   10.225   22.373   10.225   22.373   12.679   8.3729   12.679   8.3729 0.000000 0.000000 
1 1 1   25    0   66 o   8.8770   6.3531 -19.7003   21.205 -19.7003   21.205 -19.7003   21.205   8.8770   6.3531   8.8770   6.3531 0.000000 0.000000 
1 1 1   25    0   67 o   13.876   8.8168   16.714   21.758   16.714   21.758   16.714   21.758   13.876   8.8168   13.876   8.8168 0.000000 0.000000 
1 1 1   25    0   68 o   10.129   7.0959  -8.4056   22.032  -8.4056   22.032  -8.4056   22.032   10.129   7.0959   10.129   7.0959 0.000000 0.000000 
1 1 1   25    1  -57 o   12.706   6.3239 -25.7075   25.821   0.0000   0.0000 -25.7075   25.821  ?   ?    12.706   6.3239 0.000000 6.323872 
1 1 1   25    1  -56 o   17.413   7.9813   20.422   25.624   0.0000   0.0000   20.422   25.624  ?   ?    17.413   7.9813 0.000000 7.981251 
1 1 1   25    1  -55 o   20.064   7.8984   30.338   18.963   45.396   26.149   13.635   27.540   21.854   9.0302   16.624   7.8358 5.229797 11.95592 
1 1 1   25    1  -54 o   13.169   6.2465  -3.3324   18.030   6.0653   25.090 -13.3662   25.926   15.572   7.3813   13.758   6.7506 1.814432 10.00270 
1 1 1   25    1  -53 o   15.068   6.8665   7.8785   18.608   11.270   26.728   4.6892   25.921   16.377   7.7193   15.542   7.4057 0.8350916 10.69729 
1 1 1   25    1  -52 o   27.589   8.1298   53.354   19.520   51.498   28.498   54.994   26.792   22.695   9.4069   24.069   9.4143 -1.373962 13.30859 
1 1 1   25    1  -51 o   23.778   6.9348   35.007   14.267   33.505   27.671   35.551   16.650   19.648   8.7072   22.780   7.6236 -3.131483 11.57300 
1 1 1   25    1  -50 o   14.391   6.2299   8.1346   13.447 -20.5758   25.632   19.037   15.795   13.245   6.5402   17.545   7.1061 -4.299692 9.657728 
1 1 1   25    1  -49 o   21.702   7.4113   31.333   15.738   55.539   26.730   18.489   19.471   24.533   9.4564   17.389   7.5121 7.144255 12.07701 
1 1 1   25    1  -48 o   17.098   6.9688   17.169   15.302 -16.4920   26.021   34.964   18.920   13.713   6.7356   21.874   8.0576 -8.161258 10.50205 
1 1 1   25    1  -47 o   14.383   6.4064   6.4097   15.173   35.972   26.329  -8.2892   18.566   20.499   8.7942   12.822   6.1519 7.677288 10.73235 
1 1 1   25    1  -46 o   10.311   5.0570 -17.8820   14.498 -17.8722   25.440 -17.8868   17.643   13.522   6.6452   11.463   5.6131 2.058558 8.698617 
1 1 1   25    1  -45 o   17.563   7.0690   18.450   15.522   0.0000   0.0000   18.450   15.522  ?   ?    17.563   7.0690 0.000000 7.069027 
1 1 1   25    1  -44 o   13.741   6.2325   2.9896   15.108   0.0000   0.0000   2.9896   15.108  ?   ?    13.741   6.2325 0.000000 6.232475 
1 1 1   25    1  -43 o   21.388   6.4963   26.653   12.321   19.421   19.574   31.400   15.857   17.873   7.6229   21.991   7.4402 -4.118479 10.65201 
1 1 1   25    1  -42 o   15.416   6.2275   11.586   12.094   28.929   19.619   0.9562   15.360   20.305   8.0214   13.475   6.1773 6.830133 10.12432 
1 1 1   25    1  -41 o   24.842   5.7427   32.791   11.396   60.275   16.400   7.1282   15.847   33.252   6.2806   14.875   6.5906 18.37780 9.103913 
1 1 1   25    1  -40 o   14.054   5.8528   7.7815   11.106  -0.0938   15.451   16.199   15.974   13.355   6.1493   17.147   7.0688 -3.791741 9.369191 
1 1 1   25    1  -39 o   11.061   5.0385  -1.5268   10.007  -4.2156   15.115   0.5716   13.353   12.551   5.8809   12.854   5.8417 -0.3030052 8.289202 
1 1 1   25    1  -38 o   13.319   5.4398   6.8329   9.3476   13.548   12.947  -0.4794   13.510   16.242   6.4837   12.702   5.8120 3.540083 8.707314 
1 1 1   25    1  -37 o   25.453   4.8092   31.839   9.6123   46.622   13.569   16.949   13.619   29.838   5.7879   17.428   6.7413 12.40947 8.885086 
1 1 1   25    1  -36 o   12.179   5.3464   2.3073   10.203  -4.3865   13.376   11.622   15.779   11.938   5.5734   16.041   6.8429 -4.103234 8.825421 
1 1 1   25    1  -35 o   13.029   5.4368   5.6602   9.6117   12.910   13.527  -1.7315   13.659   16.173   6.5668   12.561   5.7831 3.611112 8.750278 
1 1 1   25    1  -34 o   17.626   5.8051   16.507   9.6638   15.187   13.538   17.878   13.799   16.939   6.6720   17.854   6.8165 -0.9155560 9.538393 
1 1 1   25    1  -33 o   16.869   5.8264   14.900   9.7349   21.342   13.670   8.2711   13.867   19.165   6.8797   14.953   6.3977 4.212580 9.394743 
1 1 1   25    1  -32 o   13.429   5.8505   4.2681   12.016   26.162   26.663  -1.3112   13.460   19.736   8.6540   12.632   5.7879 7.104167 10.41113 
1 1 1   25    1  -31 o   14.453   5.8958   8.4946   10.965   25.884   18.672  -0.6575   13.546   20.189   7.8700   12.828   5.8507 7.360589 9.806521 
1 1 1   25    1  -30 o   22.942   5.9749   27.977   11.283   29.808   18.667   26.924   14.163   21.443   7.9843   21.431   7.0260 0.1164436E-01 10.63547 
1 1 1   25    1  -29 o   25.067   5.7477   32.474   11.494   39.781   19.104   28.329   14.389   24.725   8.1628   22.011   7.0719 2.714680 10.80018 
1 1 1   25    1  -28 o   24.048   5.8070   30.015   11.253   16.918   14.099   53.003   18.679   17.808   6.8669   29.910   7.6361 -12.10190 10.26964 
1 1 1   25    1  -27 o   37.837   4.3122   66.385   13.063   60.660   17.672   73.281   19.395   33.486   6.7083   36.904   6.6938 -3.418659 9.476709 
1 1 1   25    1  -26 o   11.815   5.3265  -0.8827   10.838  -2.0335   13.817   0.9580   17.474   12.796   5.8634   14.542   6.6372 -1.746358 8.856156 
1 1 1   25    1  -25 o   16.038   5.8330   12.498   9.8667   16.129   13.792   8.6922   14.121   17.682   6.7987   15.439   6.5250 2.243402 9.423233 
1 1 1   25    1  -24 o   16.619   5.8584   13.715   9.8707   14.723   13.883   12.686   14.037   17.262   6.7694   16.628   6.7118 0.6340656 9.532737 
1 1 1   25    1  -23 o   14.427   5.6882   8.4973   9.8486  -1.6291   13.865   18.809   13.992   12.976   5.9187   18.722   6.9234 -5.745423 9.108484 
1 1 1   25    1  -22 o   19.638   5.8200   19.827   9.9805   10.686   13.826   29.772   14.422   16.050   6.5923   23.019   7.0354 -6.969398 9.641390 
1 1 1   25    1  -21 o   13.925   5.6476   6.9619   9.9920   11.179   14.274   2.9098   13.992   16.303   6.6975   14.052   6.2112 2.250788 9.134263 
1 1 1   25    1  -20 o   21.981   5.5885   24.317   10.034   30.326   14.463   18.740   13.932   23.316   7.0289   18.797   6.9161 4.519707 9.860907 
1 1 1   25    1  -19 o   14.798   5.7334   9.2508   9.8629   1.4461   14.214   16.499   13.697   13.834   6.1786   18.016   6.8117 -4.182367 9.196463 
1 1 1   25    1  -18 o   27.942   4.7445   36.789   10.420   36.843   14.926   36.737   14.554   25.981   6.9230   26.091   6.7818 -0.1097736 9.691231 
1 1 1   25    1  -17 o   30.139   4.4577   42.023   10.622   61.136   15.586   25.451   14.514   35.319   5.6005   21.404   7.1166 13.91437 9.056060 
1 1 1   25    1  -16 o   29.876   4.3816   41.108   10.354   27.148   14.695   54.868   14.590   22.077   7.1513   33.523   5.5320 -11.44564 9.041226 
1 1 1   25    1  -15 o   16.463   5.8710   12.987   9.9380   11.543   14.100   14.413   14.010   16.521   6.7057   17.420   6.8093 -0.8985786 9.556859 
1 1 1   25    1  -14 o   10.407   4.9107  -8.2205   10.869 -25.6147   17.812   2.0997   13.720   11.319   5.5622   13.888   6.1439 -2.569158 8.287697 
1 1 1   25    1  -13 o   13.223   5.6879   3.3053   11.070  -6.2363   17.985   9.1243   14.045   13.810   6.4525   15.829   6.5861 -2.018746 9.220167 
1 1 1   25    1  -12 o   21.810   5.7462   23.908   10.357   27.217   14.634   20.587   14.659   22.227   7.1308   19.660   7.1157 2.566919 10.07384 
1 1 1   25    1  -11 o   46.457   3.3963   94.216   12.773   97.984   16.378   88.367   20.406   46.386   4.3835   42.057   6.1327 4.328941 7.538284 
1 1 1   25    1  -10 o   25.350   5.2664   31.075   10.527   28.790   14.851   33.382   14.924   22.855   7.1656   24.741   7.0555 -1.885921 10.05617 
1 1 1   25    1   -9 o   20.862   6.1263   22.334   11.101   26.726   14.588   16.293   17.109   22.088   7.1229   18.433   7.4207 3.655796 10.28602 
1 1 1   25    1   -8 f   25.060   5.6353   31.012   11.231   30.333   14.804   31.934   17.240   23.536   7.1148   23.568   7.7532 -0.3183937E-01 10.52289 
1 1 1   25    1   -7 o   12.500   5.6028  -0.7645   11.800  -4.7366   16.543   3.3498   16.836   13.611   6.3010   15.239   6.7703 -1.628234 9.248769 
1 1 1   25    1   -6 o   13.083   5.5814   3.4425   10.498   3.9736   16.245   3.0618   13.755   15.210   6.7090   14.208   6.2233 1.001822 9.150999 
1 1 1   25    1   -5 o   29.305   4.8572   40.248   11.197   41.608   17.213   39.250   14.743   27.345   7.4987   27.379   6.6685 -0.3413200E-01 10.03494 
1 1 1   25    1   -4 o   31.132   5.0975   45.877   12.489   45.916   17.410   45.836   17.925   28.973   7.3588   28.719   7.5564 0.2537270 10.54757 
1 1 1   25    1   -3 o   17.085   6.1561   13.972   10.957   4.8816   14.326   26.785   17.008   14.864   6.4326   21.832   7.6908 -6.967558 10.02626 
1 1 1   25    1   -2 o   13.701   5.7230   5.1393   10.666   7.2727   13.950   2.1376   16.548   15.386   6.4932   14.936   6.6689 0.4505663 9.307828 
1 1 1   25    1   -1 f   29.787   4.8734   41.548   11.424   16.807   14.859   77.319   17.866   18.466   7.0677   39.987   5.6375 -21.52088 9.040657 
1 1 1   25    1    0 o   16.667   6.4010   12.508   12.216   11.508   17.683   13.421   16.897   17.337   7.3132   17.696   7.2801 -0.3582344 10.31904 
1 1 1   25    1    1 f   33.532   4.3393   51.157   11.583   60.811   19.024   45.471   14.601   33.860   7.1188   30.072   6.1636 3.787420 9.416375 
1 1 1   25    1    2 o   34.349   4.2653   53.481   11.686   48.075   18.739   56.922   14.949   29.249   7.7401   34.349   5.5266 -5.099760 9.510676 
1 1 1   25    1    3 o   25.602   5.7262   32.412   11.650   18.094   18.488   41.843   15.004   19.133   7.7101   28.381   6.6093 -9.247911 10.15518 
1 1 1   25    1    4 o   39.387   3.5182   68.012   11.177   48.288   15.621   88.700   15.999   30.726   6.4430   44.055   4.5191 -13.32852 7.869862 
1 1 1   25    1    5 o   52.680   3.0931  119.511   13.224  109.557   17.197  133.911   20.685   49.192   4.3330   53.871   4.7594 -4.679001 6.436368 
1 1 1   25    1    6 o   47.109   3.4190   96.796   13.040  115.918   16.769   67.543   20.741   50.886   4.0767   35.294   7.4439 15.59227 8.487143 
1 1 1   25    1    7 o   38.625   3.5141   65.460   10.943   58.511   15.499   72.370   15.454   34.637   5.6864   39.348   4.9257 -4.710651 7.523181 
1 1 1   25    1    8 f   20.959   5.8458   22.152   10.363   13.740   15.020   29.793   14.316   17.445   6.9769   23.443   6.9759 -5.997770 9.866184 
1 1 1   25    1    9 o   24.910   5.8211   31.031   11.606   38.853   19.120   26.467   14.604   25.568   8.1454   21.981   7.1299 3.587814 10.82517 
1 1 1   25    1   10 o   31.082   5.5432   47.013   13.529   63.340   19.120   30.641   19.147   34.563   7.0261   22.738   8.1445 11.82467 10.75637 
1 1 1   25    1   11 o   28.552   5.9812   40.913   13.474   45.815   18.848   35.790   19.270   28.170   7.8937   24.404   8.2018 3.765446 11.38333 
1 1 1   25    1   12 o   37.157   4.1429   62.389   12.335   80.028   15.907   35.794   19.533   41.465   4.7946   24.320   8.2575 17.14535 9.548505 
1 1 1   25    1   13 o   13.923   5.8458   5.4442   11.216  -4.1973   14.205   21.409   18.278   12.755   5.8815   19.882   7.7761 -7.126404 9.749839 
1 1 1   25    1   14 o   21.402   5.7214   23.062   10.174   13.605   14.366   32.576   14.409   17.221   6.8446   24.482   6.9166 -7.261017 9.730810 
1 1 1   25    1   15 o   17.445   5.9317   15.111   10.080   27.475   14.440   3.3615   14.077   22.299   7.0758   14.296   6.2777 8.003139 9.459177 
1 1 1   25    1   16 o   21.447   5.6588   23.133   10.035   5.7322   14.000   41.520   14.391   14.843   6.3907   28.272   6.3946 -13.42941 9.040531 
1 1 1   25    1   17 o   10.807   4.9370  -3.1701   9.6958   0.1365   13.803  -6.3907   13.623   13.429   6.0362   12.060   5.6286 1.368937 8.253250 
1 1 1   25    1   18 o   16.294   5.8964   12.693   10.065   2.0240   14.344   23.041   14.128   14.023   6.2386   20.479   7.0210 -6.455566 9.392295 
1 1 1   25    1   19 o   15.952   5.8906   11.926   10.122   8.5143   14.208   15.443   14.424   15.584   6.5636   17.705   6.9126 -2.120600 9.532274 
1 1 1   25    1   20 o   11.467   5.1455  -1.0243   9.9831  -7.7868   14.146   5.6863   14.091   12.005   5.6451   14.781   6.3881 -2.776852 8.524992 
1 1 1   25    1   21 o   15.205   6.0341   9.6787   11.150  -4.5632   14.210   32.491   17.984   12.580   5.8295   23.157   7.9221 -10.57700 9.835798 
1 1 1   25    1   22 o   17.008   5.9839   14.446   10.294   10.138   14.466   18.865   14.652   16.015   6.6754   18.771   7.0564 -2.755812 9.713599 
1 1 1   25    1   23 o   11.306   5.1118  -1.6824   10.067 -14.9289   14.117   12.027   14.361   10.879   5.2560   16.511   6.7429 -5.632238 8.549394 
1 1 1   25    1   24 o   11.832   5.3465  -1.2943   10.995  -7.7194   17.246   3.1050   14.271   13.126   6.1910   14.116   6.2544 -0.9903479 8.800328 
1 1 1   25    1   25 o   13.865   5.6613   6.9172   10.121   7.8641   14.262   5.9567   14.365   15.248   6.5053   14.787   6.4200 0.4616451 9.139745 
1 1 1   25    1   26 o   19.593   5.9655   20.195   10.382   25.268   14.859   15.357   14.512   20.877   7.1989   17.416   6.8929 3.460804 9.966717 
1 1 1   25    1   27 o   24.910   5.3484   31.002   10.536   29.282   15.048   32.657   14.756   22.332   7.2369   23.810   7.0818 -1.477621 10.12544 
1 1 1   25    1   28 o   17.941   6.1888   17.058   10.982   18.173   14.521   15.567   16.787   18.235   6.9849   17.544   7.2410 0.6903286 10.06084 
1 1 1   25    1   29 o   21.430   6.3455   25.178   11.868   19.494   16.599   31.125   16.977   18.584   7.3665   22.350   7.6953 -3.766703 10.65281 
1 1 1   25    1   30 o   15.815   6.2492   11.854   11.910 -12.7274   16.843   36.441   16.845   12.106   5.8216   24.274   7.6345 -12.16877 9.600872 
1 1 1   25    1   31 o   14.286   5.9822   7.4448   11.697   1.0465   16.853   13.392   16.248   14.183   6.4904   16.751   7.0348 -2.567606 9.571554 
1 1 1   25    1   32 o   17.339   6.3746   16.156   11.832   5.4698   16.703   26.921   16.764   14.949   6.6857   20.697   7.5913 -5.747984 10.11567 
1 1 1   25    1   33 o   10.167   4.8737 -10.4256   11.593 -10.6901   16.644 -10.1763   16.157   12.224   5.8545   12.122   5.7954 0.1021042 8.237827 
1 1 1   25    1   34 o   13.418   5.8436   4.4228   11.977   15.390   17.043  -6.2794   16.836   17.198   7.2126   12.888   6.0905 4.309718 9.440085 
1 1 1   25    1   35 o   18.609   6.5171   19.598   12.201 -16.2463   17.269   55.322   17.240   11.718   5.6969   31.096   6.9738 -19.37859 9.004961 
1 1 1   25    1   36 o   17.609   6.4092   17.157   11.916   2.6565   16.907   31.470   16.796   14.330   6.5358   22.046   7.6513 -7.716521 10.06275 
1 1 1   25    1   37 o   16.714   6.4200   14.925   12.290   9.0110   17.818   20.291   16.974   15.716   6.9747   18.382   7.3944 -2.665215 10.16480 
1 1 1   25    1   38 o   14.825   6.1122   9.5575   11.945   8.0864   17.154   10.942   16.642   15.390   6.8360   15.934   6.9141 -0.5438805 9.722963 
1 1 1   25    1   39 o   9.8206   4.7506 -12.3874   11.620 -35.9669   16.688   9.8104   16.191   9.6321   4.8364   15.588   6.7914 -5.956304 8.337464 
1 1 1   25    1   40 o   25.146   6.1578   34.730   12.520   41.817   18.042   28.148   17.387   25.124   7.9010   20.600   7.6987 4.524296 11.03157 
1 1 1   25    1   41 o   36.551   4.5042   64.079   13.136   43.296   18.394   85.712   18.767   25.437   7.9748   40.348   5.8788 -14.91139 9.907436 
1 1 1   25    1   42 o   34.750   4.7592   59.046   13.128   74.170   18.570   43.938   18.560   36.642   6.4530   25.500   8.0129 11.14232 10.28825 
1 1 1   25    1   43 o   13.471   6.2461  -0.4126   16.351   14.725   22.988 -15.9109   23.261   17.102   7.7291   13.314   6.5037 3.787839 10.10132 
1 1 1   25    1   44 o   14.514   6.5362   5.5180   16.271   15.749   22.908  -4.8973   23.114   17.208   7.7519   14.377   6.8890 2.831247 10.37065 
1 1 1   25    1   45 o   13.534   6.2672   0.2795   16.382 -23.6143   23.098   24.462   23.237   12.537   6.1937   18.714   8.1448 -6.177652 10.23226 
1 1 1   25    1   46 o   22.347   9.0624   43.933   25.726   43.933   25.726   0.0000   0.0000   22.347   9.0624  ?   ?  0.000000 9.062439 
1 1 1   25    1   47 o   18.609   8.2284   24.810   24.578   24.810   24.578   0.0000   0.0000   18.609   8.2284  ?   ?  0.000000 8.228415 
1 1 1   25    1   48 o   18.373   8.1293   23.526   24.029   23.526   24.029   0.0000   0.0000   18.373   8.1293  ?   ?  0.000000 8.129289 
1 1 1   25    1   49 o   17.115   7.8100   16.230   24.178   16.230   24.178   0.0000   0.0000   17.115   7.8100  ?   ?  0.000000 7.810026 
1 1 1   25    1   50 o   12.184   5.8176  -7.3795   16.169 -10.2807   22.973  -4.5318   22.760   13.594   6.6002   14.160   6.7986 -0.5663166 9.475455 
1 1 1   25    1   51 o   12.559   5.9578  -5.1249   16.410 -12.8782   23.268   2.5488   23.148   13.376   6.5277   15.030   7.1141 -1.653496 9.655119 
1 1 1   25    1   52 o   13.422   6.2489   0.2425   16.629 -11.6661   23.848   11.512   23.199   13.577   6.6219   16.199   7.4859 -2.621407 9.994414 
1 1 1   25    1   53 o   14.075   6.4299   4.4054   16.448   7.5867   23.764   1.4797   22.789   15.656   7.3480   14.755   7.0059 0.9012461 10.15261 
1 1 1   25    1   54 o   16.515   7.5991   14.158   23.539   0.0000   0.0000   14.158   23.539  ?   ?    16.515   7.5991 0.000000 7.599052 
1 1 1   25    1   55 o   14.176   6.7977  -2.6534   22.591   0.0000   0.0000  -2.6534   22.591  ?   ?    14.176   6.7977 0.000000 6.797716 
1 1 1   25    1   56 o   11.908   5.9106 -24.8982   21.961   0.0000   0.0000 -24.8982   21.961  ?   ?    11.908   5.9106 0.000000 5.910550 
1 1 1   25    1   57 o   14.402   6.9140  -1.3206   23.520   0.0000   0.0000  -1.3206   23.520  ?   ?    14.402   6.9140 0.000000 6.914009 
1 1 1   25    1   58 o   13.855   6.7113  -5.9209   23.391   0.0000   0.0000  -5.9209   23.391  ?   ?    13.855   6.7113 0.000000 6.711268 
1 1 1   25    1   59 o   13.085   6.4117 -13.0709   23.135   0.0000   0.0000 -13.0709   23.135  ?   ?    13.085   6.4117 0.000000 6.411728 
1 1 1   25    1   60 o   15.877   6.9214   14.183   16.839   10.240   23.574   18.290   24.061   15.665   7.3413   16.821   7.7189 -1.156084 10.65253 
1 1 1   25    1   61 o   20.382   7.6347   30.762   17.119   28.592   24.312   32.897   24.109   18.501   8.1820   19.325   8.3538 -0.8239021 11.69320 
1 1 1   25    1   62 o   14.515   6.5608   7.7685   16.568 -15.9485   23.144   32.699   23.729   12.804   6.3015   19.350   8.3255 -6.545790 10.44137 
1 1 1   25    1   63 o   19.634   7.5610   28.268   17.077 -28.2990   23.075   96.770   25.393   11.837   5.9051   36.574   8.6532 -24.73732 10.47605 
1 1 1   25    2  -55 f   18.276   7.6908   25.369   19.482   0.0000   0.0000   25.369   19.482  ?   ?    18.276   7.6908 0.000000 7.690832 
1 1 1   25    2  -54 o   12.797   6.1561  -6.1162   18.875   0.0000   0.0000  -6.1162   18.875  ?   ?    12.797   6.1561 0.000000 6.156140 
1 1 1   25    2  -53 o   12.893   6.1890  -5.5258   18.842   0.0000   0.0000  -5.5258   18.842  ?   ?    12.893   6.1890 0.000000 6.188951 
1 1 1   25    2  -52 o   11.960   5.5477  -1.0897   12.917 -31.2658   24.771   10.180   15.138   12.032   6.0198   14.850   6.5159 -2.818206 8.871021 
1 1 1   25    2  -51 o   10.096   4.9096 -12.6982   12.843 -18.9838   24.759 -10.3841   15.023   12.927   6.3914   11.229   5.4243 1.698825 8.382926 
1 1 1   25    2  -50 o   12.979   5.8567   3.3222   13.141 -20.1368   24.638   12.650   15.536   12.848   6.3564   15.546   6.7131 -2.697993 9.244978 
1 1 1   25    2  -49 f   12.651   5.7701   1.6551   13.176 -31.9760   24.813   14.862   15.549   12.069   6.0364   16.134   6.8343 -4.065184 9.118405 
1 1 1   25    2  -48 o   13.290   5.9528   4.3733   13.295   47.269   25.357 -11.8901   15.614   22.402   9.0286   11.290   5.4722 11.11175 10.55752 
1 1 1   25    2  -47 o   15.482   6.7682   11.792   16.200   0.0000   0.0000   11.792   16.200  ?   ?    15.482   6.7682 0.000000 6.768224 
1 1 1   25    2  -46 o   18.329   7.2601   22.488   16.111   0.0000   0.0000   22.488   16.111  ?   ?    18.329   7.2601 0.000000 7.260090 
1 1 1   25    2  -45 o   28.130   7.3556   50.398   17.054   0.0000   0.0000   50.398   17.054  ?   ?    28.130   7.3556 0.000000 7.355553 
1 1 1   25    2  -44 o   16.718   6.6598   16.372   13.632 -32.3370   25.505   35.849   16.128   12.308   6.1503   23.041   7.4942 -10.73335 9.694811 
1 1 1   25    2  -43 o   15.321   6.4637   11.602   13.816   23.077   25.965   7.0701   16.318   18.034   8.1760   14.609   6.5651 3.425045 10.48556 
1 1 1   25    2  -42 o   21.414   7.0145   29.201   14.118   37.729   26.295   25.747   16.734   20.582   8.8083   19.401   7.4811 1.181585 11.55652 
1 1 1   25    2  -41 o   14.176   6.1877   7.2641   13.495   2.8531   25.118   9.0538   16.000   15.372   7.3150   15.029   6.6423 0.3438168 9.880775 
1 1 1   25    2  -40 o   13.205   5.9505   3.0401   13.509   1.7446   24.871   3.5822   16.090   15.238   7.2587   13.953   6.3687 1.284183 9.656556 
1 1 1   25    2  -39 o   12.369   5.7071  -0.9105   13.408   0.6469   25.135  -1.5299   15.851   15.166   7.2448   13.000   6.0686 2.166686 9.450692 
1 1 1   25    2  -38 f   11.679   5.4759  -4.2098   13.143   8.7759   25.039  -9.1480   15.441   16.163   7.5719   11.733   5.6246 4.429634 9.432431 
1 1 1   25    2  -37 o   14.019   6.1483   6.3753   13.465 -21.1486   25.152   17.432   15.942   13.173   6.4997   17.193   7.0720 -4.019361 9.605190 
1 1 1   25    2  -36 o   24.260   6.8885   35.593   14.256   57.374   26.321   26.551   16.959   25.439   9.4791   19.839   7.5611 5.599367 12.12534 
1 1 1   25    2  -35 o   16.491   6.1779   14.907   11.210   9.8482   15.614   20.288   16.105   15.303   6.6680   18.087   7.2277 -2.784665 9.833696 
1 1 1   25    2  -34 o   17.820   6.2837   18.086   11.356   38.812   15.862  -3.7064   16.266   24.823   7.3322   12.879   6.0554 11.94427 9.509406 
1 1 1   25    2  -33 o   15.328   5.9249   11.862   10.515   20.299   16.146   5.6490   13.855   18.172   7.2451   14.033   6.1927 4.138867 9.531111 
1 1 1   25    2  -32 o   37.018   4.4804   65.787   13.245   82.116   17.985   46.439   19.578   39.617   5.7360   25.817   8.2443 13.80012 10.04341 
1 1 1   25    2  -31 o   20.546   6.1764   23.779   11.179   21.922   13.938   27.129   18.716   19.024   6.9306   19.956   7.8497 -0.9323101 10.47143 
1 1 1   25    2  -30 o   11.872   5.3245   0.7105   10.675 -13.7697   13.083   29.552   18.465   10.288   4.9917   20.746   7.8936 -10.45800 9.339467 
1 1 1   25    2  -29 o   22.430   5.9524   27.456   11.062   26.453   13.769   29.281   18.579   20.888   6.9312   20.678   7.9059 0.2106514 10.51402 
1 1 1   25    2  -28 o   27.614   4.6983   37.216   10.197   33.768   14.248   40.836   14.600   23.789   6.9281   26.633   6.7250 -2.843824 9.655247 
1 1 1   25    2  -27 o   19.327   5.8035   20.257   9.8737   36.239   14.102   4.8849   13.830   24.958   6.7640   13.944   6.1685 11.01385 9.154377 
1 1 1   25    2  -26 o   25.071   5.1449   31.736   10.162   19.977   14.305   43.713   14.438   18.387   6.9591   28.013   6.4553 -9.626760 9.492069 
1 1 1   25    2  -25 o   14.441   5.7073   9.4549   9.9365   22.046   13.947  -3.5232   14.160   19.207   6.9422   12.355   5.7571 6.851608 9.018779 
1 1 1   25    2  -24 o   13.764   5.5962   7.6597   9.8394   10.983   13.815   4.2383   14.018   15.576   6.5103   13.893   6.1747 1.683142 8.972805 
1 1 1   25    2  -23 o   19.046   5.8912   19.664   10.075   19.338   14.223   19.992   14.273   18.259   6.9324   18.482   6.9610 -0.2235565 9.824141 
1 1 1   25    2  -22 o   38.760   3.5186   67.595   10.996   83.148   15.663   52.480   15.441   41.548   4.7075   31.128   6.3018 10.41998 7.865980 
1 1 1   25    2  -21 o   16.791   5.9489   14.895   10.188   9.1136   14.250   20.941   14.572   15.195   6.4931   18.834   7.0461 -3.638829 9.581635 
1 1 1   25    2  -20 o   16.289   5.8632   13.714   9.9361  -0.4423   13.849   28.730   14.264   12.900   5.8957   21.910   7.0411 -9.010136 9.183472 
1 1 1   25    2  -19 o   9.3823   4.4850  -8.9868   9.6697 -17.8096   13.456   0.4341   13.905   10.027   4.9082   13.107   5.9583 -3.080179 7.719617 
1 1 1   25    2  -18 o   10.240   4.7782  -5.0237   9.8095   3.7723   13.772 -14.0808   13.975   13.819   6.1323   10.740   5.1986 3.079491 8.039343 
1 1 1   25    2  -17 o   25.115   5.1936   31.583   10.281   35.968   14.262   26.838   14.834   25.093   6.8033   21.093   7.1955 4.000145 9.902506 
1 1 1   25    2  -16 o   22.754   5.9277   27.569   11.103   51.304   14.698  -3.9746   16.944   31.328   5.9737   13.342   6.2435 17.98517 8.640955 
1 1 1   25    2  -15 o   11.308   5.1683  -2.2096   10.644 -12.0957   13.752   12.568   16.813   10.949   5.2640   16.611   7.0740 -5.662023 8.817682 
1 1 1   25    2  -14 o   11.292   5.1595  -2.2342   10.598   6.5998   13.927 -14.3866   16.334   14.626   6.3359   11.700   5.6529 2.926897 8.491122 
1 1 1   25    2  -13 o   10.727   4.9280  -3.1157   9.8460 -12.9884   13.756   7.2550   14.099   10.847   5.2278   14.853   6.4044 -4.006140 8.267200 
1 1 1   25    2  -12 o   16.598   6.1948   14.034   11.250   3.9766   18.345   20.096   14.243   15.149   6.8697   18.828   6.9811 -3.679018 9.794332 
1 1 1   25    2  -11 o   13.987   5.7702   7.1726   10.653 -15.7079   15.805   26.225   14.422   11.364   5.5076   21.145   7.0955 -9.780766 8.982183 
1 1 1   25    2  -10 o   12.882   5.5520   3.7133   10.586   12.387   16.041  -2.9780   14.089   16.586   6.9792   12.637   5.8378 3.948606 9.098842 
1 1 1   25    2   -9 o   11.494   5.2265  -1.7668   10.709   20.744   16.889 -16.9026   13.849   18.986   7.4602   10.402   5.0675 8.583851 9.018516 
1 1 1   25    2   -8 o   14.307   5.9368   7.4768   11.368   16.958   14.498  -7.6572   18.317   17.824   6.9387   13.343   6.3194 4.481388 9.385127 
1 1 1   25    2   -7 o   22.279   6.0454   26.372   11.256   27.874   14.815   24.321   17.313   21.783   7.1882   20.096   7.6441 1.687845 10.49296 
1 1 1   25    2   -6 o   10.930   4.9822  -2.3401   9.8040 -15.4793   14.060   10.095   13.678   10.694   5.1855   15.635   6.5020 -4.941404 8.316569 
1 1 1   25    2   -5 o   17.289   5.9550   15.441   10.167   12.975   14.646   17.735   14.124   16.634   6.8032   18.119   6.9015 -1.484434 9.690939 
1 1 1   25    2   -4 o   17.686   5.9404   16.268   10.109   13.777   14.516   18.614   14.085   16.868   6.8195   18.436   6.9210 -1.568407 9.716262 
1 1 1   25    2   -3 f   10.835   5.0305  -4.7402   10.658 -33.1770   16.554   15.396   13.930   9.9559   4.9720   17.339   6.7863 -7.382742 8.412808 
1 1 1   25    2   -2 o   10.060   4.7278  -6.5535   9.8962 -10.3201   14.258  -3.0525   13.746   11.515   5.4885   12.543   5.7844 -1.027996 7.973844 
1 1 1   25    2   -1 o   17.301   5.9141   15.412   10.022   20.859   14.447   10.358   13.915   19.238   7.0487   15.784   6.5606 3.453723 9.629461 
1 1 1   25    2    0 o   14.809   5.7966   9.5812   10.163   13.943   14.830   5.7185   13.956   16.967   6.8808   14.546   6.3215 2.421317 9.343856 
1 1 1   25    2    1 o   18.132   5.9685   17.204   10.216   28.102   14.569   6.6621   14.329   22.003   7.1201   14.879   6.4361 7.123797 9.597919 
1 1 1   25    2    2 o   11.990   5.5148  -3.0511   12.382 -17.4953   18.090   9.6789   16.983   12.066   5.8582   16.164   6.9993 -4.097290 9.127378 
1 1 1   25    2    3 f   22.974   6.6001   29.209   13.013   35.874   19.280   23.633   17.635   23.522   8.1954   19.913   7.6795 3.609173 11.23120 
1 1 1   25    2    4 o   16.217   6.4539   12.362   12.790  -1.3049   18.878   23.957   17.388   14.488   6.7154   20.020   7.6497 -5.531782 10.17911 
1 1 1   25    2    5 o   20.373   6.2426   22.431   11.345   18.464   14.659   28.356   17.915   18.364   7.0222   21.333   7.8437 -2.968746 10.52782 
1 1 1   25    2    6 o   22.706   6.1716   27.613   11.720   26.577   15.201   29.129   18.401   21.204   7.2825   21.484   7.9407 -0.2797451 10.77450 
1 1 1   25    2    7 o   20.717   6.3340   23.409   11.688   18.363   14.960   31.315   18.726   18.305   7.0695   22.100   8.0360 -3.794943 10.70307 
1 1 1   25    2    8 o   19.964   6.3539   21.778   11.637   30.157   14.927   8.7948   18.580   22.646   7.1950   16.196   7.1582 6.449314 10.14924 
1 1 1   25    2    9 o   26.312   5.5665   35.142   11.566   37.055   19.023   34.020   14.568   23.868   8.1481   24.364   6.9784 -0.4967747 10.72799 
1 1 1   25    2   10 o   31.303   4.7420   46.884   11.721   50.463   19.207   44.760   14.796   28.579   7.9539   28.792   6.4633 -0.2130108 10.24880 
1 1 1   25    2   11 o   24.344   5.8736   31.002   11.521   26.687   18.759   33.616   14.598   20.565   7.9233   24.132   7.0083 -3.566847 10.57802 
1 1 1   25    2   12 o   13.588   5.7662   5.5574   11.102   0.7075   17.963   8.5549   14.122   14.479   6.6536   15.214   6.4814 -0.7347317 9.288636 
1 1 1   25    2   13 o   12.058   5.4232  -0.0982   11.160  -8.7622   18.355   4.9827   14.056   13.138   6.2523   14.280   6.2718 -1.141470 8.855844 
1 1 1   25    2   14 o   14.668   5.8118   9.4137   10.328   22.341   14.796  -2.8684   14.422   19.527   7.1368   12.730   5.8896 6.797676 9.253176 
1 1 1   25    2   15 o   11.935   5.2831   1.1734   10.158   4.8218   14.562  -2.2854   14.178   14.337   6.3368   12.734   5.8731 1.603695 8.639947 
1 1 1   25    2   16 o   14.032   5.6984   7.8531   10.188   4.4926   14.415   11.206   14.400   14.204   6.2901   15.903   6.6467 -1.698258 9.151188 
1 1 1   25    2   17 o   10.741   5.0441  -6.1711   11.228 -14.0104   14.424   5.8877   17.889   10.952   5.2966   15.290   6.8723 -4.338134 8.676514 
1 1 1   25    2   18 o   14.181   5.7164   8.3677   10.167   8.9119   14.440   7.8327   14.319   15.243   6.5253   14.942   6.4483 0.3010883 9.173950 
1 1 1   25    2   19 o   8.1076   4.0198 -19.3063   10.053 -14.1078   14.291 -24.3971   14.143   10.857   5.2557   9.6180   4.7686 1.238559 7.096654 
1 1 1   25    2   20 o   11.971   5.2927   1.5046   10.166   1.2272   14.794   1.7529   13.994   13.536   6.1505   13.402   6.0462 0.1343870 8.624672 
1 1 1   25    2   21 o   15.944   5.9128   12.952   10.218   13.895   14.782   12.089   14.141   16.585   6.8147   15.998   6.6284 0.5871735 9.506600 
1 1 1   25    2   22 o   14.644   5.9456   9.3114   11.087   26.199   14.837 -12.0430   16.685   20.685   7.1905   12.013   5.7814 8.671732 9.226492 
1 1 1   25    2   23 o   13.372   5.8641   4.1066   12.246   14.748   18.341  -4.4542   16.451   17.051   7.3278   12.995   6.1034 4.056495 9.536654 
1 1 1   25    2   24 o   20.118   6.5490   23.341   12.315   27.736   17.578   19.105   17.259   20.556   7.7286   18.055   7.3849 2.501638 10.68958 
1 1 1   25    2   25 o   24.922   6.1905   34.103   12.519   46.327   17.956   22.541   17.464   26.979   7.7539   18.969   7.5442 8.009733 10.81842 
1 1 1   25    2   26 o   26.175   6.0088   36.936   12.549   45.449   17.876   28.664   17.621   26.639   7.7608   20.763   7.7522 5.876078 10.96936 
1 1 1   25    2   27 o   30.767   5.2984   47.951   12.809   61.273   18.326   35.224   17.911   32.356   7.1398   22.835   7.9022 9.520979 10.64995 
1 1 1   25    2   28 o   11.642   5.3772  -2.6695   11.947   7.2572   16.925 -12.5274   16.866   15.125   6.7497   11.936   5.7616 3.189201 8.874321 
1 1 1   25    2   29 o   12.432   5.6176   0.6875   12.136   3.1522   17.111  -1.8074   17.216   14.362   6.5598   13.545   6.3234 0.8170061 9.111374 
1 1 1   25    2   30 o   19.530   6.5709   22.313   12.368   31.953   17.444   12.568   17.538   21.775   7.7769   16.314   7.0883 5.460768 10.52253 
1 1 1   25    2   31 o   19.877   6.5159   23.051   12.181   47.457   17.553   0.3815   16.918   27.425   7.5930   13.792   6.3803 13.63332 9.917725 
1 1 1   25    2   32 o   12.820   5.6902   2.8614   11.865 -11.3996   16.528   18.025   17.043   11.917   5.7401   17.555   7.2755 -5.637885 9.267198 
1 1 1   25    2   33 o   15.428   6.2658   11.672   12.319   21.894   17.588   1.8274   17.260   18.534   7.5015   14.076   6.4877 4.457954 9.917839 
1 1 1   25    2   34 o   34.298   4.8020   57.929   13.058   65.465   18.622   50.639   18.316   33.351   7.0698   27.978   7.7599 5.372387 10.49752 
1 1 1   25    2   35 o   14.175   6.0145   7.8953   12.078   21.154   17.219  -4.9450   16.945   18.263   7.4113   12.868   6.0896 5.394923 9.592226 
1 1 1   25    2   36 o   11.636   5.3714  -2.1011   11.897 -20.8195   17.403   14.324   16.302   11.090   5.4593   16.423   6.9789 -5.333233 8.860534 
1 1 1   25    2   37 o   9.9779   4.8899 -16.9783   13.474   12.193   24.118 -30.2147   16.246   16.589   7.6544   9.8115   4.9039 6.777535 9.090494 
1 1 1   25    2   38 f   13.721   6.1120   4.8697   13.814   58.821   24.818 -19.3512   16.629   26.404   9.2910   10.937   5.3744 15.46719 10.73345 
1 1 1   25    2   39 o   15.610   6.9447   10.528   17.775   33.919   25.501 -11.5759   24.790   20.112   8.6418   13.867   6.7605 6.244946 10.97203 
1 1 1   25    2   40 o   11.071   5.4197 -17.1849   16.415  -9.2049   23.269 -25.0911   23.161   13.780   6.6793   12.341   6.1160 1.438488 9.056454 
1 1 1   25    2   41 o   16.650   7.1312   15.647   17.261   7.8738   24.548   23.248   24.275   15.915   7.4691   18.197   8.1044 -2.281847 11.02126 
1 1 1   25    2   42 o   12.501   5.9611  -6.4537   16.862 -11.9349   23.895  -1.0164   23.799   13.595   6.6299   14.704   7.0309 -1.109221 9.663789 
1 1 1   25    2   43 o   14.991   6.7335   8.3230   17.144   3.3256   24.261   13.307   24.228   15.245   7.2356   16.545   7.6475 -1.300222 10.52803 
1 1 1   25    2   44 o   12.815   6.0597  -3.6913   16.713  -9.1518   23.524   1.8746   23.750   13.737   6.6719   14.970   7.1204 -1.232608 9.757767 
1 1 1   25    2   45 o   13.298   6.2640  -1.7140   17.549   34.386   25.222 -35.5860   24.432   19.918   8.5770   11.822   5.9240 8.096526 10.42394 
1 1 1   25    2   46 o   13.622   6.3526   0.9612   17.298   20.755   24.971 -17.3012   23.985   17.520   7.9724   13.027   6.4123 4.492667 10.23110 
1 1 1   25    2   47 o   13.135   6.1752  -1.4267   16.908   2.3734   23.977  -5.1854   23.846   14.948   7.1224   14.101   6.8173 0.8466158 9.859208 
1 1 1   25    2   48 o   14.171   6.5041   4.7308   17.096  -3.5213   23.896   13.383   24.468   14.257   6.8758   16.357   7.6035 -2.100056 10.25137 
1 1 1   25    2   49 f   12.460   6.1633 -21.1534   23.122 -21.1534   23.122   0.0000   0.0000   12.460   6.1633  ?   ?  0.000000 6.163338 
1 1 1   25    2   50 o   14.149   6.8091  -2.8214   23.134  -2.8214   23.134   0.0000   0.0000   14.149   6.8091  ?   ?  0.000000 6.809074 
1 1 1   25    2   51 o   11.458   5.7522 -36.1247   23.566 -36.1247   23.566   0.0000   0.0000   11.458   5.7522  ?   ?  0.000000 5.752243 
1 1 1   25    2   52 o   14.518   7.0025  -0.9750   24.795  -0.9750   24.795   0.0000   0.0000   14.518   7.0025  ?   ?  0.000000 7.002470 
1 1 1   25    2   53 o   9.2971   4.6775 -33.6753   16.013 -49.0021   22.986 -19.2246   22.320   10.534   5.3359   12.328   6.0901 -1.793471 8.097019 
1 1 1   25    2   54 o   13.149   6.1816  -0.2356   16.942  -2.6741   24.412   2.0305   23.533   14.208   6.8758   14.588   6.9797 -0.3800611 9.797589 
1 1 1   25    2   55 f   17.058   7.2091   19.456   17.236   14.602   24.566   24.164   24.191   16.235   7.5710   17.651   7.9575 -1.416164 10.98371 
1 1 1   25    2   56 o   13.623   6.3202   2.9082   16.781   26.099   24.569 -17.3711   22.975   17.953   8.0628   12.602   6.2166 5.351629 10.18108 
1 1 1   25    2   57 o   11.022   5.4034 -15.8882   16.498  -8.6341   23.369 -23.0958   23.294   13.458   6.5619   12.218   6.0684 1.239948 8.937807 
1 1 1   25    2   58 o   13.647   6.3539   2.3886   17.191   15.348   24.888  -9.4379   23.775   16.403   7.6395   13.488   6.5858 2.914200 10.08635 
1 1 1   25    3  -51 o   12.113   5.9041 -11.9232   18.875   0.0000   0.0000 -11.9232   18.875  ?   ?    12.113   5.9041 0.000000 5.904100 
1 1 1   25    3  -50 o   14.027   6.6189   2.4375   19.750   0.0000   0.0000   2.4375   19.750  ?   ?    14.027   6.6189 0.000000 6.618883 
1 1 1   25    3  -49 o   15.715   6.7575   14.214   15.616   0.0000   0.0000   14.214   15.616  ?   ?    15.715   6.7575 0.000000 6.757549 
1 1 1   25    3  -48 o   22.356   7.6035   36.428   16.563   0.0000   0.0000   36.428   16.563  ?   ?    22.356   7.6035 0.000000 7.603502 
1 1 1   25    3  -47 o   24.060   6.8911   37.173   14.206   55.562   28.453   31.068   16.395   22.348   9.3421   20.527   7.5109 1.821268 11.98698 
1 1 1   25    3  -46 o   18.647   6.8438   23.091   13.629   30.791   25.063   19.859   16.240   18.628   8.2691   17.185   7.1101 1.442917 10.90557 
1 1 1   25    3  -45 o   19.813   6.8945   26.030   13.643   73.321   26.248   8.5266   15.969   28.129   9.5719   14.525   6.5135 13.60420 11.57785 
1 1 1   25    3  -44 o   10.735   5.1748  -9.6783   13.497   30.668   25.870 -24.7657   15.820   18.638   8.3291   9.9358   4.9458 8.701958 9.686831 
1 1 1   25    3  -43 o   11.695   5.5107  -3.7728   13.600   14.966   25.441 -11.2703   16.093   16.403   7.6675   11.445   5.5492 4.958206 9.464882 
1 1 1   25    3  -42 o   9.9460   4.8735 -15.6053   13.369 -18.7718   25.038 -14.3425   15.811   12.989   6.4227   11.009   5.3744 1.979273 8.374715 
1 1 1   25    3  -41 o   16.532   6.6509   16.472   13.733 -15.7362   24.956   30.461   16.447   13.236   6.5199   20.606   7.5253 -7.370188 9.956927 
1 1 1   25    3  -40 o   23.685   6.8984   35.446   14.126 -22.2556   25.505   60.978   16.965   12.858   6.3801   32.043   6.7106 -19.18433 9.259487 
1 1 1   25    3  -39 o   10.647   5.1429 -10.7341   13.497  -3.3644   24.853 -13.8167   16.074   14.375   6.9524   11.191   5.4534 3.184227 8.836020 
1 1 1   25    3  -38 o   16.018   6.6370   14.574   14.179  -2.9835   25.710   22.248   16.997   14.563   7.0497   18.047   7.3487 -3.484317 10.18341 
1 1 1   25    3  -37 o   13.933   6.2052   6.3000   14.231  -7.8989   25.937   12.415   17.022   14.164   6.9077   15.668   6.8909 -1.503476 9.757103 
1 1 1   25    3  -36 o   11.074   5.3082  -8.6581   13.749  -4.4347   24.936 -10.5029   16.480   14.365   6.9514   11.764   5.6824 2.601620 8.978458 
1 1 1   25    3  -35 o   19.657   7.8498   28.793   18.984   39.023   26.361   17.770   27.364   20.549   8.8072   17.147   7.9942 3.402349 11.89431 
1 1 1   25    3  -34 o   15.453   6.9558   10.247   18.402   29.976   25.440 -11.4056   26.651   19.067   8.4035   14.060   6.8876 5.006804 10.86546 
1 1 1   25    3  -33 o   14.929   6.4211   10.170   14.105   7.7160   16.715   16.240   26.286   14.759   6.6374   16.982   7.8897 -2.223594 10.31031 
1 1 1   25    3  -32 o   22.750   6.3749   30.391   12.293   32.600   17.020   27.983   17.774   21.482   7.6808   19.786   7.6882 1.695831 10.86746 
1 1 1   25    3  -31 o   17.188   7.2455   18.162   17.339   0.0000   0.0000   18.162   17.339  ?   ?    17.188   7.2455 0.000000 7.245502 
1 1 1   25    3  -30 o   10.979   5.1969  -6.1759   12.352 -42.2626   17.819   27.204   17.138   9.4788   4.7893   19.753   7.5828 -10.27440 8.968650 
1 1 1   25    3  -29 o   10.944   5.1109  -3.8839   11.258   11.204   15.650 -20.0655   16.207   15.443   6.7030   10.670   5.2557 4.772605 8.517770 
1 1 1   25    3  -28 o   11.830   5.3170   1.1120   10.707  -3.4193   15.919   4.8549   14.468   12.677   5.9698   13.810   6.1959 -1.132887 8.603971 
1 1 1   25    3  -27 f   17.188   6.1617   16.876   10.961   28.294   16.626   8.0970   14.578   20.287   7.5387   14.581   6.3962 5.705705 9.886543 
1 1 1   25    3  -26 o   8.1787   4.0619 -19.6313   10.430 -26.2495   15.735 -14.4432   13.931   9.9276   4.9402   10.451   5.0891 -0.5233908 7.092593 
1 1 1   25    3  -25 o   14.113   5.8158   8.7454   10.807   23.857   16.496  -2.6198   14.305   18.964   7.3959   12.354   5.7664 6.610543 9.378185 
1 1 1   25    3  -24 o   17.441   6.4173   17.658   11.995   2.5614   16.363   35.197   17.637   13.864   6.3634   22.405   7.8362 -8.540380 10.09454 
1 1 1   25    3  -23 o   16.418   6.0984   14.833   10.878   3.7179   13.940   32.137   17.394   13.517   6.0716   21.490   7.7547 -7.973810 9.848808 
1 1 1   25    3  -22 o   16.299   6.0232   14.471   10.587   13.419   13.522   16.138   17.017   15.982   6.5367   16.894   7.1525 -0.9122753 9.689548 
1 1 1   25    3  -21 o   15.316   5.9620   11.968   10.704   16.518   13.765   5.0077   17.023   16.987   6.7164   14.514   6.5958 2.473613 9.413563 
1 1 1   25    3  -20 o   8.6804   4.2392 -13.4743   9.8669 -25.1707   13.655  -0.6929   14.274   9.2109   4.5866   12.761   5.8883 -3.550361 7.463841 
1 1 1   25    3  -19 o   27.521   4.8700   37.709   10.526   50.127   15.012   25.701   14.763   30.007   6.3364   20.112   7.1574 9.894960 9.559231 
1 1 1   25    3  -18 o   19.744   5.9038   21.598   10.234   13.113   14.369   30.335   14.581   16.030   6.6650   21.998   7.1233 -5.967703 9.755210 
1 1 1   25    3  -17 o   10.819   4.9562  -1.9857   9.8616  -7.0737   13.756   3.3934   14.145   11.506   5.4573   13.585   6.1079 -2.078828 8.190809 
1 1 1   25    3  -16 o   15.194   5.8436   11.590   10.191   21.339   14.286   1.4883   14.542   18.687   6.9795   13.309   6.0667 5.378604 9.247614 
1 1 1   25    3  -15 o   13.864   5.7680   7.6510   10.771 -11.3465   15.967   23.515   14.591   11.716   5.6428   19.427   7.0890 -7.710789 9.060620 
1 1 1   25    3  -14 o   13.737   5.7375   7.2800   10.718  -1.9011   16.377   14.159   14.176   13.234   6.1750   16.369   6.6939 -3.134937 9.107031 
1 1 1   25    3  -13 o   16.846   6.1037   15.533   10.790   5.3483   16.457   23.211   14.289   14.570   6.5664   19.400   7.0248 -4.829711 9.615860 
1 1 1   25    3  -12 o   10.701   4.9256  -2.6663   9.9028   0.9572   13.597  -6.7595   14.451   12.944   5.8872   11.843   5.6103 1.100639 8.132277 
1 1 1   25    3  -11 o   22.836   5.5770   27.591   10.291   35.157   14.372   19.631   14.741   24.223   6.9292   18.113   7.0116 6.109161 9.857849 
1 1 1   25    3  -10 o   14.306   5.9185   8.6060   11.252   5.7652   17.901   10.461   14.467   14.958   6.7842   15.395   6.5593 -0.4377069 9.436619 
1 1 1   25    3   -9 o   11.439   5.1499  -0.0002   10.094 -10.7106   13.906   11.926   14.674   11.050   5.3077   15.816   6.6663 -4.766114 8.521266 
1 1 1   25    3   -8 o   24.016   5.3695   29.858   10.247   34.196   14.010   24.868   15.028   24.015   6.8321   19.894   7.2039 4.121645 9.928453 
1 1 1   25    3   -7 o   15.708   5.8758   12.739   10.133   7.2495   14.045   18.697   14.633   14.512   6.3238   17.835   6.9629 -3.323545 9.405970 
1 1 1   25    3   -6 o   17.125   6.3478   16.279   11.775   6.6971   18.191   23.188   15.447   15.199   6.8718   19.245   7.2430 -4.046003 9.984159 
1 1 1   25    3   -5 o   15.444   6.1579   11.755   11.665 -19.5772   18.776   31.452   14.886   11.761   5.7655   22.476   7.1902 -10.71478 9.216256 
1 1 1   25    3   -4 o   14.469   6.2273   7.6781   13.283   17.831   18.924  -2.1831   18.650   17.589   7.4983   13.836   6.4987 3.753164 9.922593 
1 1 1   25    3   -3 o   17.268   6.2700   16.552   11.394   8.4688   18.478   21.511   14.473   15.588   6.9971   18.817   7.0257 -3.228669 9.915640 
1 1 1   25    3   -2 o   21.563   5.8303   25.219   10.492   16.623   14.638   34.300   15.045   17.195   6.8841   23.576   7.1820 -6.381392 9.948456 
1 1 1   25    3   -1 o   11.655   5.2167   0.6368   10.192   2.9057   14.272  -1.7243   14.559   13.582   6.1186   12.757   5.9075 0.8255539 8.505050 
1 1 1   25    3    0 o   10.013   4.7724  -8.4018   10.781   3.2888   16.232 -17.6304   14.422   14.164   6.4383   10.383   5.0825 3.780204 8.202633 
1 1 1   25    3    1 o   12.652   5.5790   2.9387   11.226  -0.9149   14.201   9.3601   18.331   12.791   5.8917   15.742   7.0247 -2.950773 9.168288 
1 1 1   25    3    2 o   11.844   5.3581  -0.0658   11.079  -6.6370   13.946   11.174   18.240   11.696   5.5319   16.093   7.1034 -4.397353 9.003333 
1 1 1   25    3    3 o   14.455   5.9792   8.8773   11.480   13.851   14.619   0.8743   18.543   16.368   6.7564   14.280   6.6315 2.088103 9.467071 
1 1 1   25    3    4 o   15.015   5.8305   11.000   10.217  -3.3979   14.222   26.355   14.688   12.341   5.7568   20.545   7.1534 -8.204818 9.182152 
1 1 1   25    3    5 o   18.052   5.9875   17.981   10.275   24.781   14.613   11.331   14.451   19.969   7.1195   15.643   6.6056 4.325575 9.711882 
1 1 1   25    3    6 o   12.664   5.4466   4.2991   10.148  -1.2469   14.174   10.132   14.535   12.712   5.8664   15.335   6.5554 -2.622347 8.797045 
1 1 1   25    3    7 o   21.003   6.2407   24.958   11.464   16.241   14.426   39.896   18.885   17.060   6.8326   23.936   8.1194 -6.876760 10.61174 
1 1 1   25    3    8 o   13.407   5.7506   5.6690   11.255   21.109   14.521 -17.5650   17.813   18.649   7.0217   11.646   5.6894 7.003251 9.037364 
1 1 1   25    3    9 o   17.237   6.2187   16.479   11.185   27.416   14.488   0.3431   17.598   20.988   7.1117   13.953   6.4731 7.035207 9.616557 
1 1 1   25    3   10 o   11.865   5.3432   0.4177   10.873   6.5135   14.072  -8.6105   17.126   14.328   6.2848   12.488   5.9694 1.840360 8.667903 
1 1 1   25    3   11 o   17.265   5.9665   16.316   10.209   24.488   14.279   7.7720   14.601   19.903   7.0436   14.737   6.4344 5.165615 9.540156 
1 1 1   25    3   12 o   15.386   5.8505   12.005   10.139   7.2478   14.264   16.864   14.416   14.535   6.3527   17.226   6.8531 -2.690216 9.344602 
1 1 1   25    3   13 o   29.904   4.9430   44.461   11.629   39.066   14.868   52.963   18.663   25.587   6.9500   28.757   7.7762 -3.170084 10.42933 
1 1 1   25    3   14 o   24.580   5.3712   31.307   10.460   16.617   14.583   46.876   15.013   17.127   6.8662   28.774   6.5486 -11.64646 9.488327 
1 1 1   25    3   15 o   9.6020   4.6263 -10.6635   10.754 -28.4025   13.683   18.001   17.394   8.9515   4.4780   17.517   7.3121 -8.565617 8.574368 
1 1 1   25    3   16 o   10.220   4.8501  -7.3747   10.893  -0.2084   13.965 -18.5109   17.408   12.800   5.8763   11.376   5.5716 1.424110 8.097721 
1 1 1   25    3   17 o   18.035   6.2619   18.510   11.251   20.436   14.541   15.637   17.759   18.328   6.9973   16.923   7.2404 1.405432 10.06907 
1 1 1   25    3   18 o   37.100   4.1308   64.797   12.280   50.151   15.853   86.774   19.419   29.467   6.7459   40.008   6.1511 -10.54170 9.129264 
1 1 1   25    3   19 o   11.354   5.3164  -4.5313   12.318 -17.3574   17.063   9.4278   17.801   11.354   5.5515   15.540   6.9292 -4.185474 8.878755 
1 1 1   25    3   20 o   11.994   5.4960  -0.8968   12.140   3.4868   17.164  -5.2844   17.172   14.283   6.5414   12.880   6.1058 1.402864 8.948188 
1 1 1   25    3   21 o   23.180   7.1089   33.568   14.708   69.163   25.530   15.884   17.994   29.284   9.4209   16.897   7.2599 12.38663 11.89362 
1 1 1   25    3   22 o   12.557   5.7909  -0.8076   13.780   4.0719   23.222  -3.4596   17.120   15.397   7.2380   13.103   6.1766 2.294150 9.515223 
1 1 1   25    3   23 o   44.019   4.6123   94.400   16.304  104.309   28.323   89.488   19.940   37.741   9.2737   40.281   6.2771 -2.540054 11.19841 
1 1 1   25    3   24 o   35.320   5.4548   64.787   15.200   68.915   25.004   62.368   19.143   29.352   9.3106   31.529   7.5486 -2.176836 11.98622 
1 1 1   25    3   25 o   16.788   6.7989   16.202   14.457   5.2915   24.533   22.007   17.894   15.643   7.3802   18.286   7.5040 -2.642251 10.52505 
1 1 1   25    3   26 o   8.7300   4.3431 -22.5431   12.129 -27.0271   16.912 -17.7951   17.403   10.299   5.1244   11.343   5.5587 -1.044623 7.560349 
1 1 1   25    3   27 f   10.163   4.8897 -10.1549   11.912 -17.5628   16.901  -2.8435   16.791   11.188   5.4815   13.025   6.1327 -1.836930 8.225384 
1 1 1   25    3   28 o   12.865   5.7298   3.3784   12.134   1.9319   17.075   4.8543   17.247   13.845   6.4066   14.390   6.5778 -0.5453482 9.182120 
1 1 1   25    3   29 o   12.608   5.6785   2.1219   12.285  -2.8710   17.360   7.1312   17.388   13.148   6.2045   14.825   6.7089 -1.677276 9.138116 
1 1 1   25    3   30 o   10.413   4.9894  -9.0487   12.122 -33.0254   17.184   14.704   17.104   9.8890   4.9573   16.374   7.0569 -6.484639 8.624052 
1 1 1   25    3   31 o   14.743   6.4315   8.9970   14.562 -36.2987   24.407   34.032   18.145   11.809   5.9183   21.600   7.9018 -9.790640 9.872436 
1 1 1   25    3   32 o   14.867   6.4699   9.5313   14.662   15.041   25.355   6.7633   17.971   16.816   7.7903   14.800   6.7458 2.015440 10.30511 
1 1 1   25    3   33 o   15.291   6.5813   11.245   14.837   37.708   25.667  -2.0353   18.183   20.520   8.7398   13.413   6.3357 7.107463 10.79463 
1 1 1   25    3   34 o   11.873   5.7670 -12.6854   17.583 -29.4094   24.626   4.7077   25.114   12.272   6.1188   15.429   7.3341 -3.156530 9.551354 
1 1 1   25    3   35 o   10.566   5.2367 -23.5333   17.003   17.584   24.745 -60.3100   23.402   17.054   7.8265   10.193   5.1855 6.860400 9.388464 
1 1 1   25    3   36 o   16.728   7.2431   16.826   18.183   12.191   25.352   21.736   26.093   16.300   7.6304   17.629   8.0704 -1.328991 11.10651 
1 1 1   25    3   37 o   19.606   7.7421   28.427   18.270   29.281   26.183   27.616   25.505   18.729   8.3739   18.506   8.2701 0.2230816 11.76935 
1 1 1   25    3   38 o   14.404   6.6167   5.5412   17.744 -12.3426   24.515   25.221   25.717   13.494   6.6096   18.063   8.1680 -4.568510 10.50732 
1 1 1   25    3   39 o   19.574   7.7877   28.857   18.616   46.411   26.973   12.888   25.726   21.604   9.0678   16.299   7.6482 5.305244 11.86254 
1 1 1   25    3   40 o   29.745   7.7347   59.247   18.927   28.430   26.266   92.534   27.298   18.459   8.3094   33.579   9.5313 -15.11950 12.64487 
1 1 1   25    3   41 o   14.568   6.6462   7.0164   17.499   14.981   24.526  -1.2429   24.975   16.458   7.6374   14.565   7.0257 1.892489 10.37739 
1 1 1   25    3   42 o   11.443   5.5952 -14.8842   17.338 -25.0885   24.191  -4.1055   24.863   12.338   6.1375   14.234   6.9007 -1.895847 9.235211 
1 1 1   25    3   43 o   16.016   7.0516   14.586   17.870   29.693   24.884  -1.4994   25.678   18.634   8.2573   14.566   7.0498 4.067837 10.85738 
1 1 1   25    3   44 o   11.211   5.4911 -15.4678   16.912   0.0457   23.841 -31.1815   23.994   14.440   6.9397   11.827   5.9182 2.613756 9.120541 
1 1 1   25    3   45 o   17.985   7.4029   23.173   17.483   3.9138   24.398   43.499   25.065   14.908   7.1259   21.148   8.7988 -6.240185 11.32245 
1 1 1   25    3   46 o   16.454   7.1530   17.141   17.880   42.225   25.354  -7.6726   25.217   20.720   8.7495   13.824   6.7566 6.896368 11.05466 
1 1 1   25    3   47 o   16.377   7.1348   16.986   17.868   54.211   25.194 -20.6893   25.346   23.393   9.1353   12.768   6.3397 10.62511 11.11959 
1 1 1   25    3   48 o   12.757   6.0535  -2.6128   16.966   24.721   24.081 -29.5544   23.907   17.642   7.9475   11.854   5.9282 5.787893 9.914975 
1 1 1   25    3   49 o   14.207   6.5262   6.1480   17.260   12.123   24.362   0.1267   24.457   15.816   7.4284   14.438   6.9613 1.378807 10.18038 
1 1 1   25    3   50 o   20.635   7.8049   33.159   17.987   48.400   26.023   19.216   24.890   21.746   8.9992   16.787   7.7565 4.958591 11.88059 
1 1 1   25    3   51 o   10.412   5.1879 -26.0039   17.589 -64.1353   25.097   10.802   24.657   10.327   5.2642   15.698   7.4037 -5.371200 9.084426 
1 1 1   25    4  -43 o   14.718   6.8854   6.7993   20.586   0.0000   0.0000   6.7993   20.586  ?   ?    14.718   6.8854 0.000000 6.885371 
1 1 1   25    4  -42 o   18.775   8.1186   30.864   22.784   0.0000   0.0000   30.864   22.784  ?   ?    18.775   8.1186 0.000000 8.118626 
1 1 1   25    4  -41 o   14.565   6.9071   4.6044   22.022   0.0000   0.0000   4.6044   22.022  ?   ?    14.565   6.9071 0.000000 6.907107 
1 1 1   25    4  -40 o   13.954   6.1929   7.7070   14.049   7.6175   24.536   7.7507   17.137   15.191   7.2288   14.412   6.5761 0.7781382 9.772463 
1 1 1   25    4  -39 o   11.157   5.5045 -18.5335   18.021 -41.0738   24.241   9.3148   26.945   11.186   5.6440   15.554   7.4490 -4.367228 9.345717 
1 1 1   25    4  -38 o   15.159   6.8654   11.236   18.251   32.493   25.624 -10.6524   26.001   18.649   8.3147   13.591   6.6872 5.057613 10.67021 
1 1 1   25    4  -37 o   12.425   5.9811  -6.5427   17.881 -26.9007   23.898   19.350   26.952   11.998   5.9892   16.730   7.8435 -4.732168 9.868676 
1 1 1   25    4  -36 o   11.878   5.6056  -3.2995   14.173   15.959   24.197 -13.3572   17.486   16.290   7.5685   11.550   5.6414 4.739225 9.439688 
1 1 1   25    4  -35 o   13.242   6.0005   4.2931   13.965   2.2309   25.079   5.2198   16.812   14.735   7.0907   13.973   6.4268 0.7623281 9.569825 
1 1 1   25    4  -34 o   15.683   6.5756   14.158   14.160   27.379   24.821   7.7792   17.241   18.073   8.1113   14.518   6.6134 3.554952 10.46571 
1 1 1   25    4  -33 o   14.404   6.5495   7.3616   16.815 -32.1782   24.781   41.100   22.890   11.915   5.9698   21.239   8.5718 -9.324775 10.44579 
1 1 1   25    4  -32 o   15.216   6.7851   11.217   17.069   33.611   25.186  -7.8074   23.214   19.206   8.4165   13.520   6.5805 5.685606 10.68363 
1 1 1   25    4  -31 o   13.974   6.4337   4.6341   16.905   9.8700   25.151   0.3187   22.833   15.726   7.4351   14.342   6.8655 1.383821 10.12009 
1 1 1   25    4  -30 o   19.037   7.5322   26.570   17.324   22.147   25.623   30.294   23.512   17.389   7.9742   18.899   8.2094 -1.510509 11.44477 
1 1 1   25    4  -29 o   29.102   6.5827   50.357   15.249   58.921   26.637   46.183   18.598   24.267   9.4167   24.979   8.0412 -0.7123280 12.38284 
1 1 1   25    4  -28 o   11.251   5.2383  -2.5291   11.685   0.0644   15.894  -5.5794   17.237   13.015   6.0762   12.521   5.9862 0.4942760 8.529578 
1 1 1   25    4  -27 o   8.5939   4.2795 -21.9469   11.893 -15.6927   16.432 -28.8271   17.235   11.071   5.4202   10.125   5.0589 0.9462051 7.414205 
1 1 1   25    4  -26 o   18.733   6.5791   22.024   12.440   28.445   17.395   15.304   17.797   19.668   7.6158   16.234   7.0954 3.433979 10.40893 
1 1 1   25    4  -25 o   17.273   6.5122   18.283   12.499   5.5856   17.106   32.826   18.307   14.258   6.5299   20.765   7.8695 -6.507592 10.22591 
1 1 1   25    4  -24 o   14.484   6.1099   9.8690   12.343   8.7122   16.952   11.174   18.006   14.839   6.6780   15.441   6.9211 -0.6020012 9.617520 
1 1 1   25    4  -23 o   14.958   6.2085   11.357   12.437   17.341   17.027   4.5129   18.210   16.761   7.1278   14.301   6.6173 2.459364 9.725938 
1 1 1   25    4  -22 o   10.705   5.0223  -4.3284   11.086  -0.2024   16.778  -7.5250   14.768   13.265   6.2091   11.577   5.5366 1.687693 8.319122 
1 1 1   25    4  -21 o   10.928   5.0962  -3.3184   11.133 -32.6261   16.814   19.557   14.855   9.7239   4.8786   17.515   6.9604 -7.790597 8.499895 
1 1 1   25    4  -20 o   19.690   6.6163   24.112   12.540   33.952   22.651   19.764   15.058   20.118   8.3668   17.575   7.0001 2.543301 10.90888 
1 1 1   25    4  -19 o   22.780   6.5565   31.381   12.830   47.534   23.353   24.398   15.355   23.292   8.8737   19.033   7.2084 4.259300 11.43256 
1 1 1   25    4  -18 o   17.441   6.5265   18.431   12.504 -12.1433   22.315   32.425   15.096   13.119   6.3998   22.069   7.2549 -8.950152 9.674288 
1 1 1   25    4  -17 o   14.902   6.0348   11.274   11.389   16.524   17.018   7.0156   15.328   16.663   7.1074   14.335   6.4084 2.328004 9.569887 
1 1 1   25    4  -16 o   17.672   6.3099   18.537   11.483   26.021   17.301   12.645   15.351   19.201   7.5488   15.649   6.7143 3.551835 10.10278 
1 1 1   25    4  -15 o   18.278   6.3659   20.017   11.632   40.924   17.445   3.2791   15.609   24.173   7.7886   13.663   6.2500 10.50978 9.986228 
1 1 1   25    4  -14 o   13.543   5.8558   6.5284   11.852   1.4945   18.745   9.8814   15.299   14.036   6.5677   15.000   6.5668 -0.9638329 9.287449 
1 1 1   25    4  -13 o   10.794   5.0824  -5.1172   11.534 -27.7952   18.423   9.5028   14.792   10.692   5.3246   14.851   6.4802 -4.158536 8.387197 
1 1 1   25    4  -12 o   9.8251   4.7418 -10.6239   11.414 -21.6429   17.957  -3.1541   14.785   11.079   5.4713   12.324   5.7878 -1.244856 7.964511 
1 1 1   25    4  -11 o   13.845   5.9145   7.5701   11.819   24.785   18.770  -3.7382   15.213   18.706   7.6819   12.364   5.8264 6.342376 9.641468 
1 1 1   25    4  -10 o   23.406   5.6058   29.688   10.554   44.757   14.412   12.259   15.500   27.776   6.4838   15.615   6.7238 12.16122 9.340747 
1 1 1   25    4   -9 o   13.654   5.8683   6.9292   11.764  -3.5769   18.247   14.401   15.388   13.220   6.2748   16.154   6.8186 -2.933772 9.266412 
1 1 1   25    4   -8 o   13.257   5.5738   6.7842   10.219   3.2816   13.888   10.919   15.089   13.280   6.0042   15.251   6.6007 -1.970603 8.922996 
1 1 1   25    4   -7 o   12.392   5.3904   4.0307   10.166   17.182   13.862 -11.2703   14.952   16.966   6.7299   11.197   5.4098 5.768946 8.634660 
1 1 1   25    4   -6 o   14.225   5.7535   9.5392   10.338   0.6858   13.985   20.205   15.350   12.782   5.8727   17.813   7.0765 -5.030480 9.195911 
1 1 1   25    4   -5 o   13.175   5.5826   6.3959   10.380   8.9368   14.273   3.5439   15.122   14.660   6.3819   13.641   6.2059 1.019481 8.901792 
1 1 1   25    4   -4 o   16.420   6.4404   15.393   12.568   18.304   14.234   5.0927   26.775   17.313   6.8345   15.710   7.4970 1.603226 10.14471 
1 1 1   25    4   -3 o   18.121   6.3721   19.546   11.672   9.4322   14.548   37.822   19.556   14.827   6.4487   22.243   8.1922 -7.416321 10.42583 
1 1 1   25    4   -2 o   15.042   6.1154   11.416   11.749  -1.7237   14.600   35.555   19.789   12.526   5.8397   21.484   8.1725 -8.957664 10.04453 
1 1 1   25    4   -1 o   17.337   6.3322   17.632   11.646   15.609   14.469   21.355   19.623   16.481   6.7537   17.850   7.6233 -1.369072 10.18469 
1 1 1   25    4    0 o   10.340   4.8514  -4.7758   10.348   5.7352   14.180 -16.7495   15.134   13.895   6.1908   10.606   5.1947 3.288558 8.081473 
1 1 1   25    4    1 o   16.943   6.0511   16.337   10.561   20.866   14.452   11.147   15.470   18.139   6.9633   15.361   6.6659 2.777587 9.639623 
1 1 1   25    4    2 o   15.004   5.8684   11.604   10.411   18.841   14.378   3.6286   15.093   17.479   6.8786   13.655   6.2075 3.824001 9.265459 
1 1 1   25    4    3 o   16.189   5.9762   14.549   10.417   23.909   14.365   4.1665   15.129   19.218   7.0306   13.769   6.2418 5.449276 9.401558 
1 1 1   25    4    4 o   14.527   5.9473   10.059   11.206   6.5038   16.791   12.914   15.048   14.555   6.5892   15.758   6.7010 -1.202267 9.397942 
1 1 1   25    4    5 o   9.2381   4.4552 -10.0044   10.030 -12.1033   13.566  -7.4740   14.896   10.561   5.1144   11.703   5.5867 -1.142108 7.574227 
1 1 1   25    4    6 o   11.295   5.1423  -0.4760   10.405  -1.1048   14.306   0.2302   15.162   12.542   5.8247   13.027   6.0313 -0.4848185 8.384748 
1 1 1   25    4    7 o   13.823   5.8374   7.8296   11.287   7.7427   14.392   7.9683   18.192   14.389   6.3322   15.044   6.8295 -0.6541996 9.313335 
1 1 1   25    4    8 o   11.915   5.4086   0.5369   11.407 -11.1784   14.508   19.509   18.462   11.046   5.3346   17.448   7.4211 -6.402510 9.139518 
1 1 1   25    4    9 o   25.223   5.8418   35.006   11.775   28.426   15.049   45.393   18.907   20.666   7.2378   25.044   8.1118 -4.378017 10.87136 
1 1 1   25    4   10 o   17.123   6.5309   17.426   12.659   18.806   14.569   13.174   25.569   17.432   6.9042   16.553   7.7208 0.8788147 10.35755 
1 1 1   25    4   11 o   19.972   6.3313   23.704   11.564   11.452   14.703   43.573   18.724   15.332   6.5745   24.489   8.0810 -9.157261 10.41763 
1 1 1   25    4   12 o   12.826   5.6368   4.3010   11.371   8.5888   14.650  -2.1952   18.033   14.619   6.4123   13.354   6.3085 1.264339 8.995249 
1 1 1   25    4   13 o   11.707   5.4401  -2.3093   12.510 -12.2783   14.493   26.832   24.779   10.886   5.2755   18.593   8.2396 -7.707011 9.783788 
1 1 1   25    4   14 o   24.086   7.0360   36.633   14.676   16.611   17.673   81.104   26.339   16.736   7.1928   31.458   9.4862 -14.72168 11.90476 
1 1 1   25    4   15 o   15.199   6.4916   11.249   14.231   23.733   17.557 -12.6615   24.297   18.528   7.4964   13.513   6.6108 5.014174 9.994955 
1 1 1   25    4   16 o   19.913   7.1436   26.318   14.736   32.419   18.156   14.541   25.225   20.928   7.8575   16.645   7.7315 4.283037 11.02345 
1 1 1   25    4   17 o   13.626   5.9813   6.1490   12.769   4.1944   17.952   8.1502   18.165   14.281   6.5944   15.002   6.8162 -0.7218513 9.484040 
1 1 1   25    4   18 o   13.624   5.9523   6.3967   12.514   3.9415   17.714   8.8426   17.681   14.183   6.5498   15.053   6.7930 -0.8697224 9.436322 
1 1 1   25    4   19 o   12.413   5.6626   1.0592   12.698   9.9942   17.853  -8.0888   18.064   15.283   6.8675   12.521   6.0233 2.761896 9.134652 
1 1 1   25    4   20 o   11.811   5.4893  -1.9790   12.745   3.8945   17.909  -8.0066   18.142   14.189   6.5643   12.543   6.0345 1.646388 8.916595 
1 1 1   25    4   21 o   14.318   6.1334   8.9184   12.772   19.157   18.018  -1.4202   18.106   17.222   7.3283   13.400   6.3274 3.821636 9.681961 
1 1 1   25    4   22 o   13.858   6.2136   5.7465   14.526   14.138   25.262   1.6012   17.755   16.481   7.6831   13.766   6.4251 2.715492 10.01556 
1 1 1   25    4   23 o   12.897   5.7997   3.3514   12.758   10.192   18.197  -3.2629   17.893   15.295   6.8979   13.065   6.2046 2.230720 9.277807 
1 1 1   25    4   24 o   12.531   5.8328  -0.8181   14.473 -21.2865   24.722   9.8547   17.851   12.778   6.3301   15.171   6.8380 -2.392999 9.318171 
1 1 1   25    4   25 o   12.106   5.7080  -3.5490   14.635 -33.9703   25.476   11.437   17.881   12.057   6.0429   15.459   6.9153 -3.401894 9.183543 
1 1 1   25    4   26 o   9.3206   4.6615 -27.7000   14.789 -38.4212   25.839 -22.4769   18.035   11.860   5.9634   10.930   5.4131 0.9296446 8.053817 
1 1 1   25    4   27 o   13.302   6.0849   3.0722   14.797 -22.4314   24.731   17.293   18.467   12.654   6.2795   16.658   7.2553 -4.004262 9.595391 
1 1 1   25    4   28 o   15.403   6.9337   11.216   18.288   3.2650   25.938   19.077   25.791   15.112   7.2562   17.002   7.8697 -1.889984 10.70444 
1 1 1   25    4   29 o   14.300   6.6435   4.6497   18.638   20.105   26.873  -9.6769   25.873   17.124   7.9628   13.860   6.7889 3.263918 10.46399 
1 1 1   25    4   30 o   20.295   7.9217   32.342   18.938   35.168   26.849   29.543   26.718   19.324   8.5695   18.439   8.3330 0.8853359 11.95304 
1 1 1   25    4   31 o   18.764   7.6071   26.223   18.120   38.706   25.777   14.030   25.477   20.103   8.6637   16.261   7.6241 3.842176 11.54067 
1 1 1   25    4   32 o   11.437   5.5983 -14.9804   17.499 -16.8530   24.756 -13.1105   24.739   13.017   6.4273   13.319   6.5471 -0.3023090 9.174678 
1 1 1   25    4   33 o   11.550   5.6335 -13.1437   17.268   1.9697   24.267 -28.6479   24.579   14.662   7.0345   12.099   6.0449 2.562850 9.274976 
1 1 1   25    4   34 o   10.762   5.3386 -22.7284   17.812 -32.7645   26.210 -14.1155   24.281   12.167   6.1027   13.104   6.4501 -0.9360256 8.879566 
1 1 1   25    4   35 o   17.259   7.9175   22.513   25.288   0.0000   0.0000   22.513   25.288  ?   ?    17.259   7.9175 0.000000 7.917536 
1 1 1   25    4   36 o   16.426   7.6666   16.773   25.277   0.0000   0.0000   16.773   25.277  ?   ?    16.426   7.6666 0.000000 7.666643 
1 1 1   25    4   37 o   13.012   6.4176 -14.7974   24.435   0.0000   0.0000 -14.7974   24.435  ?   ?    13.012   6.4176 0.000000 6.417568 
1 1 1   25    4   38 o   19.444   8.6035   38.423   26.915   0.0000   0.0000   38.423   26.915  ?   ?    19.444   8.6035 0.000000 8.603505 
1 1 1   25    4   39 o   13.371   6.5556 -10.0383   24.303   0.0000   0.0000 -10.0383   24.303  ?   ?    13.371   6.5556 0.000000 6.555623 
1 1 1   25    4   40 o   16.989   7.8019   21.327   24.647   0.0000   0.0000   21.327   24.647  ?   ?    16.989   7.8019 0.000000 7.801948 
1 1 1   25    4   41 o   14.162   6.5663   5.5309   18.070   12.509   25.611  -1.3870   25.499   15.838   7.4926   14.345   6.9622 1.493322 10.22800 
1 1 1   25    4   42 o   16.295   7.1378   16.938   18.097   17.285   25.573   16.591   25.613   16.432   7.6831   16.344   7.6571 0.8835411E-01 10.84713 
1 1 1   25    4   43 o   16.141   7.1463   16.023   18.597   15.187   26.983   16.780   25.667   16.250   7.6883   16.408   7.6801 -0.1584682 10.86713 
1 1 1   25    5  -33 o   16.530   7.6175   18.445   23.780   0.0000   0.0000   18.445   23.780  ?   ?    16.530   7.6175 0.000000 7.617490 
1 1 1   25    5  -32 o   15.096   7.1248   8.4820   22.910   0.0000   0.0000   8.4820   22.910  ?   ?    15.096   7.1248 0.000000 7.124834 
1 1 1   25    5  -31 o   15.384   7.2421   10.625   23.393   0.0000   0.0000   10.625   23.393  ?   ?    15.384   7.2421 0.000000 7.242118 
1 1 1   25    5  -30 o   15.331   7.2543   9.9167   24.033   0.0000   0.0000   9.9167   24.033  ?   ?    15.331   7.2543 0.000000 7.254305 
1 1 1   25    5  -29 o   18.857   7.1496   25.463   15.115 -13.3281   26.557   44.051   18.383   13.406   6.6266   23.770   8.0109 -10.36353 10.39649 
1 1 1   25    5  -28 o   12.567   5.8587   0.3620   14.696 -35.6090   26.085   17.088   17.787   11.858   5.9664   16.237   7.0953 -4.379242 9.270437 
1 1 1   25    5  -27 o   8.6747   4.3689 -31.4803   14.167  -7.9662   25.046 -42.5439   17.180   13.603   6.6667   9.0506   4.5875 4.552557 8.092534 
1 1 1   25    5  -26 o   17.142   6.9921   20.183   15.419   12.879   26.749   23.818   18.870   15.823   7.5347   17.671   7.5088 -1.848561 10.63738 
1 1 1   25    5  -25 o   12.500   5.8338   0.1151   14.631 -13.1785   25.804   6.4137   17.762   13.289   6.5619   14.184   6.5533 -0.8951540 9.273878 
1 1 1   25    5  -24 o   13.861   6.4573   4.3068   17.796   0.0000   0.0000   4.3068   17.796  ?   ?    13.861   6.4573 0.000000 6.457334 
1 1 1   25    5  -23 o   12.904   6.1513  -2.5263   17.923   0.0000   0.0000  -2.5263   17.923  ?   ?    12.904   6.1513 0.000000 6.151282 
1 1 1   25    5  -22 o   16.608   7.2448   18.613   18.477   0.0000   0.0000   18.613   18.477  ?   ?    16.608   7.2448 0.000000 7.244833 
1 1 1   25    5  -21 o   15.272   6.5966   12.862   15.010   9.3309   25.473   14.741   18.577   15.443   7.3536   15.836   7.0689 -0.3936148 10.20024 
1 1 1   25    5  -20 o   13.308   6.1036   3.7511   15.017   3.3652   25.772   3.9494   18.477   14.844   7.1545   13.976   6.5336 0.8677998 9.688876 
1 1 1   25    5  -19 o   10.480   5.0074  -7.1177   12.023   10.353   16.207 -28.5020   17.930   14.821   6.6101   10.287   5.1430 4.534492 8.375172 
1 1 1   25    5  -18 f   9.2354   4.5336 -15.0564   11.734 -22.3459   15.805  -6.1029   17.516   10.096   5.0117   12.393   5.9538 -2.297015 7.782340 
1 1 1   25    5  -17 o   18.893   6.6321   23.141   12.640   9.7959   16.827   40.423   19.149   14.797   6.6567   22.365   8.1272 -7.568166 10.50539 
1 1 1   25    5  -16 o   14.968   6.0056   12.243   11.166  -2.9982   16.389   25.446   15.254   12.547   5.9528   18.983   7.1858 -6.436314 9.331168 
1 1 1   25    5  -15 o   10.795   5.0519  -3.3414   11.099  -1.8294   16.533  -4.5819   14.975   12.765   6.0331   11.931   5.6690 0.8340893 8.278635 
1 1 1   25    5  -14 o   12.280   5.4745   3.2884   11.105  -4.5442   16.726   9.4623   14.850   12.433   5.9310   14.534   6.4124 -2.100772 8.734719 
1 1 1   25    5  -13 o   13.232   5.7211   6.6153   11.311   12.206   16.689   1.8652   15.383   15.333   6.7801   13.109   6.0714 2.223846 9.101214 
1 1 1   25    5  -12 o   13.343   5.7471   6.9675   11.330   24.725   17.255  -6.4914   15.022   18.397   7.4359   11.685   5.5871 6.711798 9.300992 
1 1 1   25    5  -11 o   18.573   6.3530   21.363   11.565   28.625   17.005   15.112   15.776   19.608   7.5466   15.980   6.8303 3.627912 10.17860 
1 1 1   25    5  -10 o   8.9878   4.4156 -15.2397   11.202   6.2266   16.908 -32.0360   14.956   14.204   6.5002   8.9984   4.5263 5.205236 7.920853 
1 1 1   25    5   -9 f   15.238   6.3149   12.708   12.839   22.692   17.110  -0.1594   19.424   17.884   7.3383   13.659   6.4805 4.224949 9.790161 
1 1 1   25    5   -8 o   12.555   5.7313   1.9576   13.037 -11.3942   17.315   19.434   19.810   11.762   5.7151   16.942   7.4431 -5.180335 9.384115 
1 1 1   25    5   -7 o   12.444   5.8653  -2.3390   15.432   10.263   25.604  -9.5287   19.339   15.740   7.4597   12.510   6.0698 3.229937 9.617163 
1 1 1   25    5   -6 o   14.588   5.9808   10.926   11.353   9.2725   16.883   12.292   15.339   14.790   6.6593   15.292   6.6368 -0.5026684 9.401806 
1 1 1   25    5   -5 o   12.523   5.5780   3.6740   11.504   28.477   17.166 -16.5488   15.500   19.555   7.5673   10.612   5.2097 8.943235 9.187224 
1 1 1   25    5   -4 o   17.633   6.3149   19.065   11.510   33.123   17.684   8.7333   15.160   20.844   7.7693   14.460   6.4243 6.384429 10.08132 
1 1 1   25    5   -3 o   14.685   5.9506   11.263   11.081   5.7158   14.183   19.957   17.755   13.637   6.1251   17.156   7.2865 -3.518819 9.518893 
1 1 1   25    5   -2 o   17.687   6.1158   18.738   10.727   27.925   14.709   8.3011   15.678   20.152   7.1472   14.442   6.4669 5.710032 9.638598 
1 1 1   25    5   -1 o   16.725   6.3093   16.890   11.736   20.813   14.918   10.518   19.011   17.659   6.9888   15.255   6.9474 2.403425 9.854409 
1 1 1   25    5    0 o   15.630   6.1371   13.900   11.423   19.152   14.619   5.6656   18.305   17.179   6.8790   14.348   6.6372 2.831365 9.558952 
1 1 1   25    5    1 o   16.689   6.5339   17.142   12.916   24.480   18.028   9.4032   18.513   18.262   7.5171   15.009   6.8432 3.253114 10.16544 
1 1 1   25    5    2 o   13.111   5.6991   6.0511   11.347   19.765   14.377 -16.6083   18.480   17.399   6.8686   11.554   5.6752 5.844945 8.909896 
1 1 1   25    5    3 o   19.054   6.7466   23.631   13.102   25.808   15.055   16.838   26.597   19.276   7.1717   16.596   7.7840 2.680040 10.58413 
1 1 1   25    5    4 o   11.715   5.3364   0.6480   11.226  -1.5801   14.269   4.2673   18.187   12.246   5.7301   14.100   6.5546 -1.853978 8.706088 
1 1 1   25    5    5 o   11.209   5.1975  -1.8499   11.322   13.438   14.641 -24.5963   17.859   15.541   6.6093   10.634   5.2868 4.907310 8.463622 
1 1 1   25    5    6 o   14.895   6.2404   11.544   12.739   5.2242   14.751   30.083   25.265   13.642   6.1758   18.547   8.2635 -4.905026 10.31633 
1 1 1   25    5    7 o   13.501   5.9270   6.5773   12.540  -2.6592   17.184   17.100   18.341   12.844   6.0942   16.481   7.2032 -3.636216 9.435384 
1 1 1   25    5    8 o   15.149   6.0587   12.594   11.327   9.8218   14.335   17.201   18.480   14.592   6.3731   16.497   7.2199 -1.904919 9.630301 
1 1 1   25    5    9 f   11.603   5.4060  -1.9498   12.482 -14.2739   17.210   11.730   18.132   11.408   5.5773   15.377   6.9144 -3.968460 8.883403 
1 1 1   25    5   10 o   22.828   6.5868   32.346   12.934   36.209   18.137   28.349   18.449   21.619   7.9014   19.177   7.7109 2.441526 11.04040 
1 1 1   25    5   11 o   12.851   6.1191  -3.2891   17.633  -3.2891   17.633   0.0000   0.0000   12.851   6.1191  ?   ?  0.000000 6.119121 
1 1 1   25    5   12 o   16.072   6.4013   15.364   12.591   9.6350   17.508   21.502   18.122   14.904   6.7395   17.456   7.3853 -2.551870 9.998154 
1 1 1   25    5   13 o   12.320   5.6161   1.7096   12.461   3.8093   16.933  -0.7710   18.404   13.766   6.3736   13.354   6.3276 0.4121227 8.981161 
1 1 1   25    5   14 o   15.084   6.8476   10.304   18.285   0.0000   0.0000   10.304   18.285  ?   ?    15.084   6.8476 0.000000 6.847574 
1 1 1   25    5   15 o   28.190   5.8723   44.611   13.055   57.017   18.407   32.054   18.519   28.861   7.6872   20.121   7.8394 8.739904 10.97948 
1 1 1   25    5   16 o   16.020   6.7275   15.519   14.858   9.8570   25.578   18.402   18.253   15.594   7.4093   16.671   7.2374 -1.077009 10.35755 
1 1 1   25    5   17 o   15.802   6.6868   14.760   14.860   13.187   26.413   15.489   17.975   16.007   7.5834   16.029   7.0643 -0.2224350E-01 10.36398 
1 1 1   25    5   18 f   16.224   6.8163   16.402   15.265   6.5847   26.202   21.445   18.781   15.247   7.3136   17.286   7.4217 -2.039059 10.41970 
1 1 1   25    5   19 o   15.335   6.9035   12.106   18.132   33.044   26.256  -6.9807   25.069   18.700   8.3714   13.780   6.7357 4.919636 10.74482 
1 1 1   25    5   20 o   12.312   5.9398  -7.3318   17.864 -18.7785   25.710   3.3537   24.840   12.925   6.4120   14.745   7.0853 -1.819430 9.555914 
1 1 1   25    5   21 o   13.039   6.4067 -12.3343   23.609   0.0000   0.0000 -12.3343   23.609  ?   ?    13.039   6.4067 0.000000 6.406700 
1 1 1   25    5   22 o   14.786   6.5140   10.792   15.270 -17.8433   26.530   24.980   18.674   13.111   6.5059   18.049   7.5583 -4.937866 9.972662 
1 1 1   25    5   23 o   13.998   6.4992   5.0489   17.796   14.112   25.363  -3.7400   24.977   15.954   7.5197   14.002   6.8174 1.951877 10.15006 
1 1 1   25    5   24 o   11.598   5.6763 -13.5706   17.971   0.3897   26.013 -26.3177   24.857   14.500   7.0363   12.182   6.0850 2.318404 9.302549 
1 1 1   25    5   25 o   16.557   7.2412   18.717   18.562   18.659   26.886   18.769   25.657   16.488   7.7625   16.496   7.7074 -0.8300781E-02 10.93894 
1 1 1   25    5   26 o   16.884   7.2910   20.151   18.327  -4.8343   26.086   44.504   25.753   14.021   6.8569   20.663   8.7759 -6.642818 11.13704 
1 1 1   25    5   27 o   10.305   5.1453 -26.7412   17.677   3.1563   25.521 -54.3142   24.509   14.707   7.0960   10.537   5.3551 4.169709 8.889861 
1 1 1   25    5   28 o   11.673   5.7026 -12.6334   17.899 -13.4997   25.450 -11.7856   25.177   13.215   6.5238   13.307   6.5537 -0.9163952E-01 9.247182 
1 1 1   25    5   29 o   12.601   6.0690  -5.7048   18.464 -16.4042   25.987   5.2049   26.241   13.084   6.4829   14.985   7.2217 -1.901637 9.704665 
1 1 1   25    5   30 o   12.195   5.8951  -7.8007   17.821   3.8939   25.277 -19.3584   25.129   14.760   7.1066   12.714   6.3126 2.046061 9.505404 
1 1 1   25    5   31 o   13.034   6.2204  -2.2512   18.435 -25.5250   26.877   18.428   25.334   12.622   6.3082   16.474   7.6844 -3.852552 9.942054 
1 1 1   25    5   32 o   12.721   6.1191  -5.2077   18.639   35.372   26.925 -42.5483   25.828   18.863   8.4585   11.440   5.7784 7.423368 10.24383 
1 1 1   25    6  -15 o   13.861   6.4150   5.1699   17.128   0.2798   23.179   11.052   25.422   14.099   6.7925   15.514   7.3759 -1.415755 10.02706 
1 1 1   25    6  -14 o   15.277   7.1773   10.579   22.776   10.579   22.776   0.0000   0.0000   15.277   7.1773  ?   ?  0.000000 7.177325 
1 1 1   25    6  -13 o   15.941   7.3560   15.529   22.282   15.529   22.282   0.0000   0.0000   15.941   7.3560  ?   ?  0.000000 7.355952 
1 1 1   25    6  -12 o   15.313   7.1296   11.534   21.646   11.534   21.646   0.0000   0.0000   15.313   7.1296  ?   ?  0.000000 7.129643 
1 1 1   25    6  -11 o   13.233   6.1616   2.6029   16.175   21.769   21.440 -22.7121   24.641   16.955   7.5794   12.330   6.1434 4.624575 9.756415 
1 1 1   25    6  -10 o   14.893   6.6422   11.370   16.367   5.0475   21.893   19.382   24.643   14.448   6.8620   16.486   7.6521 -2.037566 10.27822 
1 1 1   25    6   -9 o   15.786   6.5542   15.368   13.866   27.578   21.744   6.9984   18.002   18.004   7.8565   14.249   6.5881 3.754976 10.25316 
1 1 1   25    6   -8 o   11.302   5.2994  -2.5193   12.312  -9.5546   16.982   5.2773   17.877   11.716   5.6852   13.949   6.4894 -2.233627 8.627502 
1 1 1   25    6   -7 o   9.7626   4.7519 -11.8127   12.111 -14.8199   16.565  -8.3597   17.751   11.009   5.4007   12.058   5.8422 -1.049259 7.956022 
1 1 1   25    6   -6 o   13.615   6.2120   5.7133   15.290   4.1853   27.220   6.4177   18.482   14.872   7.2124   14.214   6.6078 0.6576538 9.781697 
1 1 1   25    6   -5 o   9.2678   4.5542 -15.0901   11.936 -18.9205   16.258 -10.6115   17.580   10.497   5.1881   11.757   5.7233 -1.259696 7.724793 
1 1 1   25    6   -4 o   10.991   5.1977  -4.2609   12.306 -18.5439   16.744   12.513   18.145   10.690   5.2800   15.230   6.8764 -4.539392 8.669669 
1 1 1   25    6   -3 o   12.784   5.7227   4.6481   12.269   13.975   16.789  -6.0413   17.974   15.459   6.8196   12.389   5.9720 3.070276 9.064862 
1 1 1   25    6   -2 o   11.754   5.4251   0.1334   12.130  -5.4749   16.432   6.8492   17.981   12.077   5.7929   14.219   6.5780 -2.141901 8.765165 
1 1 1   25    6   -1 f   17.424   6.5091   19.785   12.427   30.482   17.165   8.0044   18.014   19.716   7.5836   14.416   6.6386 5.300015 10.07878 
1 1 1   25    6    0 o   11.500   5.3446  -1.0645   12.082   10.907   16.525 -14.8119   17.709   14.802   6.6328   11.347   5.5700 3.455161 8.661334 
1 1 1   25    6    1 f   11.138   5.2355  -3.1024   12.146   12.816   17.056 -19.4802   17.300   15.228   6.7868   10.775   5.3299 4.453200 8.629542 
1 1 1   25    6    2 o   14.877   6.4241   11.999   14.227   8.8938   17.148   18.854   25.481   14.474   6.5943   16.400   7.6685 -1.925718 10.11388 
1 1 1   25    6    3 o   16.534   6.7511   18.030   14.392   18.431   23.042   17.773   18.430   16.344   7.5196   16.272   7.1629 0.7195663E-01 10.38514 
1 1 1   25    6    4 o   12.507   5.8162   0.8337   14.341   25.316   23.128 -14.4573   18.278   17.442   7.8289   11.540   5.6634 5.902740 9.662642 
1 1 1   25    6    5 o   16.382   6.7749   17.599   14.736   30.480   23.394   9.1267   18.974   18.327   8.0687   14.705   6.7864 3.622065 10.54324 
1 1 1   25    6    6 o   11.444   5.4688  -5.7359   14.351 -20.1754   22.627   3.9812   18.562   12.089   6.0003   13.853   6.4992 -1.763834 8.845531 
1 1 1   25    6    7 o   12.546   6.2469 -21.2878   25.312   0.0000   0.0000 -21.2878   25.312  ?   ?    12.546   6.2469 0.000000 6.246947 
1 1 1   25    6    8 o   14.465   6.6581   8.2447   18.091   0.0000   0.0000   8.2447   18.091  ?   ?    14.465   6.6581 0.000000 6.658081 
1 1 1   25    6    9 o   15.038   6.8364   11.395   18.307   0.0000   0.0000   11.395   18.307  ?   ?    15.038   6.8364 0.000000 6.836380 
1 1 1   25    6   10 o   12.279   5.9329  -7.0329   17.990   0.0000   0.0000  -7.0329   17.990  ?   ?    12.279   5.9329 0.000000 5.932924 
1 1 1   25    6   11 o   12.435   5.8554  -1.0927   15.309   0.7453   27.442  -1.9233   18.446   14.600   7.1168   13.023   6.2170 1.576637 9.449870 
1 1 1   25    6   12 o   16.152   6.8474   16.825   15.630   13.410   28.573   18.283   18.672   15.877   7.6215   16.400   7.2150 -0.5236616 10.49490 
1 1 1   25    6   13 o   23.069   8.1565   43.638   19.145   0.0000   0.0000   43.638   19.145  ?   ?    23.069   8.1565 0.000000 8.156547 
1 1 1   25    6   14 o   18.766   8.4226   35.475   26.765   0.0000   0.0000   35.475   26.765  ?   ?    18.766   8.4226 0.000000 8.422642 
1 1 1   25    6   15 o   12.794   6.3804 -22.3057   26.852   0.0000   0.0000 -22.3057   26.852  ?   ?    12.794   6.3804 0.000000 6.380429 
1 1 1   26    0  -54 o   11.079   7.7663  -6.1729   26.511  -6.1729   26.511  -6.1729   26.511   11.079   7.7663   11.079   7.7663 0.000000 0.000000 
1 1 1   26    0  -53 o   13.359   8.9173   12.749   26.539   12.749   26.539   12.749   26.539   13.359   8.9173   13.359   8.9173 0.000000 0.000000 
1 1 1   26    0  -52 o   12.414   8.5080   4.6708   27.520   4.6708   27.520   4.6708   27.520   12.414   8.5080   12.414   8.5080 0.000000 0.000000 
1 1 1   26    0  -51 o   17.191   10.375   32.980   26.552   32.980   26.552   32.980   26.552   17.191   10.375   17.191   10.375 0.000000 0.000000 
1 1 1   26    0  -47 o   12.209   7.6707   10.407   15.952   10.407   15.952   10.407   15.952   12.209   7.6707   12.209   7.6707 0.000000 0.000000 
1 1 1   26    0  -46 o   14.434   8.4371   17.955   16.552   17.955   16.552   17.955   16.552   14.434   8.4371   14.434   8.4371 0.000000 0.000000 
1 1 1   26    0  -45 o   10.226   6.8387   1.4024   15.736   1.4024   15.736   1.4024   15.736   10.226   6.8387   10.226   6.8387 0.000000 0.000000 
1 1 1   26    0  -44 o   13.650   8.1890   15.274   16.342   15.274   16.342   15.274   16.342   13.650   8.1890   13.650   8.1890 0.000000 0.000000 
1 1 1   26    0  -43 o   10.842   7.1171   4.3428   15.797   4.3428   15.797   4.3428   15.797   10.842   7.1171   10.842   7.1171 0.000000 0.000000 
1 1 1   26    0  -42 o   32.051   7.4259   56.032   16.878   56.032   16.878   56.032   16.878   32.051   7.4259   32.051   7.4259 0.000000 0.000000 
1 1 1   26    0  -41 o   6.9411   5.0226 -23.2848   15.007 -23.2848   15.007 -23.2848   15.007   6.9411   5.0226   6.9411   5.0226 0.000000 0.000000 
1 1 1   26    0  -40 o   8.2332   5.7950 -11.0820   15.222 -11.0820   15.222 -11.0820   15.222   8.2332   5.7950   8.2332   5.7950 0.000000 0.000000 
1 1 1   26    0  -39 f   16.924   8.8693   24.077   16.112   24.077   16.112   24.077   16.112   16.924   8.8693   16.924   8.8693 0.000000 0.000000 
1 1 1   26    0  -38 o   15.349   8.5604   19.916   15.940   19.916   15.940   19.916   15.940   15.349   8.5604   15.349   8.5604 0.000000 0.000000 
1 1 1   26    0  -37 o   11.128   7.2539   5.1774   15.995   5.1774   15.995   5.1774   15.995   11.128   7.2539   11.128   7.2539 0.000000 0.000000 
1 1 1   26    0  -36 o   11.543   7.4311   6.8935   16.090   6.8935   16.090   6.8935   16.090   11.543   7.4311   11.543   7.4311 0.000000 0.000000 
1 1 1   26    0  -35 o   16.001   8.8102   21.731   16.637   21.731   16.637   21.731   16.637   16.001   8.8102   16.001   8.8102 0.000000 0.000000 
1 1 1   26    0  -34 o   19.174   10.927   37.938   26.710   37.938   26.710   37.938   26.710   19.174   10.927   19.174   10.927 0.000000 0.000000 
1 1 1   26    0  -33 o   9.4769   6.5733  -7.2540   17.657  -7.2540   17.657  -7.2540   17.657   9.4769   6.5733   9.4769   6.5733 0.000000 0.000000 
1 1 1   26    0  -32 o   10.995   7.3203   2.4565   17.683   2.4565   17.683   2.4565   17.683   10.995   7.3203   10.995   7.3203 0.000000 0.000000 
1 1 1   26    0  -31 o   15.804   8.2478   19.708   13.890   19.708   13.890   19.708   13.890   15.804   8.2478   15.804   8.2478 0.000000 0.000000 
1 1 1   26    0  -30 o   11.686   7.2412   8.5408   13.721   8.5408   13.721   8.5408   13.721   11.686   7.2412   11.686   7.2412 0.000000 0.000000 
1 1 1   26    0  -29 o   13.402   7.7880   13.732   13.968   13.732   13.968   13.732   13.968   13.402   7.7880   13.402   7.7880 0.000000 0.000000 
1 1 1   26    0  -28 o   29.392   6.9657   45.870   14.489   45.870   14.489   45.870   14.489   29.392   6.9657   29.392   6.9657 0.000000 0.000000 
1 1 1   26    0  -27 o   8.9269   6.0755  -3.2890   13.512  -3.2890   13.512  -3.2890   13.512   8.9269   6.0755   8.9269   6.0755 0.000000 0.000000 
1 1 1   26    0  -26 o   6.4806   4.6962 -22.7404   13.365 -22.7404   13.365 -22.7404   13.365   6.4806   4.6962   6.4806   4.6962 0.000000 0.000000 
1 1 1   26    0  -25 o   11.792   7.2627   8.7905   13.601   8.7905   13.601   8.7905   13.601   11.792   7.2627   11.792   7.2627 0.000000 0.000000 
1 1 1   26    0  -24 o   11.351   7.1443   7.0463   13.906   7.0463   13.906   7.0463   13.906   11.351   7.1443   11.351   7.1443 0.000000 0.000000 
1 1 1   26    0  -23 o   35.276   5.7010   60.029   15.109   60.029   15.109   60.029   15.109   35.276   5.7010   35.276   5.7010 0.000000 0.000000 
1 1 1   26    0  -22 o   17.202   8.4935   22.610   14.273   22.610   14.273   22.610   14.273   17.202   8.4935   17.202   8.4935 0.000000 0.000000 
1 1 1   26    0  -21 o   15.899   8.3236   19.707   14.180   19.707   14.180   19.707   14.180   15.899   8.3236   15.899   8.3236 0.000000 0.000000 
1 1 1   26    0  -20 f   13.508   7.8806   13.667   14.393   13.667   14.393   13.667   14.393   13.508   7.8806   13.508   7.8806 0.000000 0.000000 
1 1 1   26    0  -19 o   37.706   5.2564   66.638   15.258   66.638   15.258   66.638   15.258   37.706   5.2564   37.706   5.2564 0.000000 0.000000 
1 1 1   26    0  -18 o   27.165   7.6800   41.424   14.725   41.424   14.725   41.424   14.725   27.165   7.6800   27.165   7.6800 0.000000 0.000000 
1 1 1   26    0  -17 o   19.569   8.6537   27.265   14.521   27.265   14.521   27.265   14.521   19.569   8.6537   19.569   8.6537 0.000000 0.000000 
1 1 1   26    0  -16 o   6.2652   4.5633 -26.6563   13.548 -26.6563   13.548 -26.6563   13.548   6.2652   4.5633   6.2652   4.5633 0.000000 0.000000 
1 1 1   26    0  -15 o   25.351   8.1146   37.997   14.780   37.997   14.780   37.997   14.780   25.351   8.1146   25.351   8.1146 0.000000 0.000000 
1 1 1   26    0  -14 o   33.922   5.9942   56.058   15.030   56.058   15.030   56.058   15.030   33.922   5.9942   33.922   5.9942 0.000000 0.000000 
1 1 1   26    0  -13 o   8.7776   6.1337 -10.4970   16.165 -10.4970   16.165 -10.4970   16.165   8.7776   6.1337   8.7776   6.1337 0.000000 0.000000 
1 1 1   26    0  -12 o   20.132   9.3315   30.344   16.928   30.344   16.928   30.344   16.928   20.132   9.3315   20.132   9.3315 0.000000 0.000000 
1 1 1   26    0  -11 o   33.027   7.6834   58.022   17.988   58.022   17.988   58.022   17.988   33.027   7.6834   33.027   7.6834 0.000000 0.000000 
1 1 1   26    0  -10 o   14.215   9.2573   11.843   25.965   11.843   25.965   11.843   25.965   14.215   9.2573   14.215   9.2573 0.000000 0.000000 
1 1 1   26    0   -9 o   35.140   6.0071   59.780   15.699   59.780   15.699   59.780   15.699   35.140   6.0071   35.140   6.0071 0.000000 0.000000 
1 1 1   26    0   -8 o   52.345   4.0078  119.643   16.864  119.643   16.864  119.643   16.864   52.345   4.0078   52.345   4.0078 0.000000 0.000000 
1 1 1   26    0   -7 o   21.224   8.7041   30.323   14.859   30.323   14.859   30.323   14.859   21.224   8.7041   21.224   8.7041 0.000000 0.000000 
1 1 1   26    0   -6 o   14.801   8.2030   16.617   14.529   16.617   14.529   16.617   14.529   14.801   8.2030   14.801   8.2030 0.000000 0.000000 
1 1 1   26    0   -5 o   7.2724   5.2562 -25.6817   16.197 -25.6817   16.197 -25.6817   16.197   7.2724   5.2562   7.2724   5.2562 0.000000 0.000000 
1 1 1   26    0   -4 o   16.987   8.5595   21.723   14.635   21.723   14.635   21.723   14.635   16.987   8.5595   16.987   8.5595 0.000000 0.000000 
1 1 1   26    0   -3 o   11.935   7.3968   8.1666   14.323   8.1666   14.323   8.1666   14.323   11.935   7.3968   11.935   7.3968 0.000000 0.000000 
1 1 1   26    0   -2 o   10.598   6.9084   2.7695   14.509   2.7695   14.509   2.7695   14.509   10.598   6.9084   10.598   6.9084 0.000000 0.000000 
1 1 1   26    0   -1 o   18.229   8.6524   24.280   14.620   24.280   14.620   24.280   14.620   18.229   8.6524   18.229   8.6524 0.000000 0.000000 
1 1 1   26    0    0 o   10.648   6.9292   2.9850   14.507   2.9850   14.507   2.9850   14.507   10.648   6.9292   10.648   6.9292 0.000000 0.000000 
1 1 1   26    0    1 o   22.238   8.5684   31.940   14.713   31.940   14.713   31.940   14.713   22.238   8.5684   22.238   8.5684 0.000000 0.000000 
1 1 1   26    0    2 o   7.0570   5.0707 -19.9647   14.087 -19.9647   14.087 -19.9647   14.087   7.0570   5.0707   7.0570   5.0707 0.000000 0.000000 
1 1 1   26    0    3 o   11.850   7.3694   7.8624   14.337   7.8624   14.337   7.8624   14.337   11.850   7.3694   11.850   7.3694 0.000000 0.000000 
1 1 1   26    0    4 o   32.241   8.8007   59.085   19.993   59.085   19.993   59.085   19.993   32.241   8.8007   32.241   8.8007 0.000000 0.000000 
1 1 1   26    0    5 o   48.940   9.2896  130.486   33.176  130.486   33.176  130.486   33.176   48.940   9.2896   48.940   9.2896 0.000000 0.000000 
1 1 1   26    0    6 o   27.932   12.532   65.398   30.449   65.398   30.449   65.398   30.449   27.932   12.532   27.932   12.532 0.000000 0.000000 
1 1 1   26    0    7 o   14.445   9.4871   11.612   28.129   11.612   28.129   11.612   28.129   14.445   9.4871   14.445   9.4871 0.000000 0.000000 
1 1 1   26    0    8 o   35.487   7.7916   66.385   19.728   66.385   19.728   66.385   19.728   35.487   7.7916   35.487   7.7916 0.000000 0.000000 
1 1 1   26    0    9 o   13.518   7.8909   13.235   14.445   13.235   14.445   13.235   14.445   13.518   7.8909   13.518   7.8909 0.000000 0.000000 
1 1 1   26    0   10 o   12.633   7.6024   10.682   14.171   10.682   14.171   10.682   14.171   12.633   7.6024   12.633   7.6024 0.000000 0.000000 
1 1 1   26    0   11 o   9.8491   6.5279   0.4003   13.803   0.4003   13.803   0.4003   13.803   9.8491   6.5279   9.8491   6.5279 0.000000 0.000000 
1 1 1   26    0   12 o   17.171   8.5100   22.157   14.351   22.157   14.351   22.157   14.351   17.171   8.5100   17.171   8.5100 0.000000 0.000000 
1 1 1   26    0   13 o   8.5085   5.8860  -7.2171   13.921  -7.2171   13.921  -7.2171   13.921   8.5085   5.8860   8.5085   5.8860 0.000000 0.000000 
1 1 1   26    0   14 o   6.5708   4.7521 -22.0689   13.344 -22.0689   13.344 -22.0689   13.344   6.5708   4.7521   6.5708   4.7521 0.000000 0.000000 
1 1 1   26    0   15 o   8.9692   6.1306  -4.5840   14.079  -4.5840   14.079  -4.5840   14.079   8.9692   6.1306   8.9692   6.1306 0.000000 0.000000 
1 1 1   26    0   16 o   6.9098   4.9624 -18.6368   13.415 -18.6368   13.415 -18.6368   13.415   6.9098   4.9624   6.9098   4.9624 0.000000 0.000000 
1 1 1   26    0   17 o   7.8100   5.5069 -12.1758   13.940 -12.1758   13.940 -12.1758   13.940   7.8100   5.5069   7.8100   5.5069 0.000000 0.000000 
1 1 1   26    0   18 o   13.937   8.0387   14.770   14.711   14.770   14.711   14.770   14.711   13.937   8.0387   13.937   8.0387 0.000000 0.000000 
1 1 1   26    0   19 o   11.908   7.3903   8.5728   14.346   8.5728   14.346   8.5728   14.346   11.908   7.3903   11.908   7.3903 0.000000 0.000000 
1 1 1   26    0   20 f   18.724   9.5373   28.783   18.280   28.783   18.280   28.783   18.280   18.724   9.5373   18.724   9.5373 0.000000 0.000000 
1 1 1   26    0   21 o   19.145   8.7689   27.027   14.927   27.027   14.927   27.027   14.927   19.145   8.7689   19.145   8.7689 0.000000 0.000000 
1 1 1   26    0   22 o   9.9274   6.6460  -0.3005   14.931  -0.3005   14.931  -0.3005   14.931   9.9274   6.6460   9.9274   6.6460 0.000000 0.000000 
1 1 1   26    0   23 o   33.091   7.9904   60.118   18.685   60.118   18.685   60.118   18.685   33.091   7.9904   33.091   7.9904 0.000000 0.000000 
1 1 1   26    0   24 o   23.716   9.4150   39.117   17.560   39.117   17.560   39.117   17.560   23.716   9.4150   23.716   9.4150 0.000000 0.000000 
1 1 1   26    0   25 o   11.042   7.2558   3.6224   16.486   3.6224   16.486   3.6224   16.486   11.042   7.2558   11.042   7.2558 0.000000 0.000000 
1 1 1   26    0   26 o   7.9004   5.6622 -20.5526   17.093 -20.5526   17.093 -20.5526   17.093   7.9004   5.6622   7.9004   5.6622 0.000000 0.000000 
1 1 1   26    0   27 o   15.845   8.8470   21.038   17.048   21.038   17.048   21.038   17.048   15.845   8.8470   15.845   8.8470 0.000000 0.000000 
1 1 1   26    0   28 o   23.985   9.4815   40.282   17.836   40.282   17.836   40.282   17.836   23.985   9.4815   23.985   9.4815 0.000000 0.000000 
1 1 1   26    0   29 o   8.5670   6.0378 -12.6609   16.692 -12.6609   16.692 -12.6609   16.692   8.5670   6.0378   8.5670   6.0378 0.000000 0.000000 
1 1 1   26    0   30 o   10.448   7.0257   0.0614   17.028   0.0614   17.028   0.0614   17.028   10.448   7.0257   10.448   7.0257 0.000000 0.000000 
1 1 1   26    0   31 o   10.425   7.0070   0.1455   16.902   0.1455   16.902   0.1455   16.902   10.425   7.0070   10.425   7.0070 0.000000 0.000000 
1 1 1   26    0   32 o   15.113   8.6838   19.161   17.069   19.161   17.069   19.161   17.069   15.113   8.6838   15.113   8.6838 0.000000 0.000000 
1 1 1   26    0   33 o   9.3971   6.5076  -6.8082   17.131  -6.8082   17.131  -6.8082   17.131   9.3971   6.5076   9.3971   6.5076 0.000000 0.000000 
1 1 1   26    0   34 o   23.559   9.4991   39.703   17.784   39.703   17.784   39.703   17.784   23.559   9.4991   23.559   9.4991 0.000000 0.000000 
1 1 1   26    0   35 o   10.230   6.9055  -0.5310   16.756  -0.5310   16.756  -0.5310   16.756   10.230   6.9055   10.230   6.9055 0.000000 0.000000 
1 1 1   26    0   36 o   8.6560   6.0990 -12.2345   17.000 -12.2345   17.000 -12.2345   17.000   8.6560   6.0990   8.6560   6.0990 0.000000 0.000000 
1 1 1   26    0   37 o   16.734   9.1259   24.413   17.669   24.413   17.669   24.413   17.669   16.734   9.1259   16.734   9.1259 0.000000 0.000000 
1 1 1   26    0   38 o   23.938   11.479   52.502   25.801   52.502   25.801   52.502   25.801   23.938   11.479   23.938   11.479 0.000000 0.000000 
1 1 1   26    0   39 f   14.193   9.2119   16.017   25.409   16.017   25.409   16.017   25.409   14.193   9.2119   14.193   9.2119 0.000000 0.000000 
1 1 1   26    0   40 o   7.4888   5.5021 -49.5237   22.791 -49.5237   22.791 -49.5237   22.791   7.4888   5.5021   7.4888   5.5021 0.000000 0.000000 
1 1 1   26    0   41 o   14.356   9.1659   17.406   23.857   17.406   23.857   17.406   23.857   14.356   9.1659   14.356   9.1659 0.000000 0.000000 
1 1 1   26    0   42 o   12.107   8.2100   3.6012   24.222   3.6012   24.222   3.6012   24.222   12.107   8.2100   12.107   8.2100 0.000000 0.000000 
1 1 1   26    0   43 o   20.914   10.939   42.858   24.472   42.858   24.472   42.858   24.472   20.914   10.939   20.914   10.939 0.000000 0.000000 
1 1 1   26    0   44 o   9.0349   6.4839 -23.1070   22.726 -23.1070   22.726 -23.1070   22.726   9.0349   6.4839   9.0349   6.4839 0.000000 0.000000 
1 1 1   26    0   45 o   8.0063   5.8319 -36.2605   22.153 -36.2605   22.153 -36.2605   22.153   8.0063   5.8319   8.0063   5.8319 0.000000 0.000000 
1 1 1   26    0   46 o   11.966   8.1328   3.3498   24.046   3.3498   24.046   3.3498   24.046   11.966   8.1328   11.966   8.1328 0.000000 0.000000 
1 1 1   26    0   47 o   10.198   7.1709 -10.3833   23.139 -10.3833   23.139 -10.3833   23.139   10.198   7.1709   10.198   7.1709 0.000000 0.000000 
1 1 1   26    0   48 o   11.385   7.8400  -0.8743   24.020  -0.8743   24.020  -0.8743   24.020   11.385   7.8400   11.385   7.8400 0.000000 0.000000 
1 1 1   26    0   49 o   11.630   7.9393   1.8666   23.452   1.8666   23.452   1.8666   23.452   11.630   7.9393   11.630   7.9393 0.000000 0.000000 
1 1 1   26    0   50 o   9.1355   6.5589 -22.8418   23.362 -22.8418   23.362 -22.8418   23.362   9.1355   6.5589   9.1355   6.5589 0.000000 0.000000 
1 1 1   26    0   51 o   9.0105   6.4738 -23.0955   22.938 -23.0955   22.938 -23.0955   22.938   9.0105   6.4738   9.0105   6.4738 0.000000 0.000000 
1 1 1   26    0   52 o   13.901   9.0046   16.618   24.112   16.618   24.112   16.618   24.112   13.901   9.0046   13.901   9.0046 0.000000 0.000000 
1 1 1   26    0   53 o   18.849   10.472   37.224   23.745   37.224   23.745   37.224   23.745   18.849   10.472   18.849   10.472 0.000000 0.000000 
1 1 1   26    0   54 o   10.931   7.5634  -2.3794   23.013  -2.3794   23.013  -2.3794   23.013   10.931   7.5634   10.931   7.5634 0.000000 0.000000 
1 1 1   26    0   55 o   16.876   10.090   31.222   24.649   31.222   24.649   31.222   24.649   16.876   10.090   16.876   10.090 0.000000 0.000000 
1 1 1   26    1  -51 o   13.662   6.4243   1.5422   18.320   0.0000   0.0000   1.5422   18.320  ?   ?    13.662   6.4243 0.000000 6.424350 
1 1 1   26    1  -50 o   14.276   6.4281   7.6865   15.729   0.0000   0.0000   7.6865   15.729  ?   ?    14.276   6.4281 0.000000 6.428050 
1 1 1   26    1  -49 o   13.118   5.9105   4.3703   13.326   3.9226   26.543   4.5212   15.409   15.070   7.2627   13.592   6.2147 1.477645 9.558722 
1 1 1   26    1  -48 o   13.154   5.9413   4.2417   13.561   22.994   28.201  -1.3985   15.466   17.293   8.0800   12.580   5.9117 4.712664 10.01171 
1 1 1   26    1  -47 o   9.9284   4.8656 -15.3461   13.338 -24.3751   27.222 -12.4940   15.300   12.922   6.4413   11.004   5.3529 1.918090 8.375183 
1 1 1   26    1  -46 o   18.637   6.8423   22.854   13.624   4.5728   26.529   29.403   15.878   15.238   7.3225   20.298   7.3970 -5.059740 10.40837 
1 1 1   26    1  -45 o   12.273   5.6827  -0.2918   13.464 -36.0248   25.725   13.190   15.802   11.936   5.9948   15.598   6.7530 -3.662486 9.029951 
1 1 1   26    1  -44 o   9.6991   4.7720 -17.2608   13.238 -33.7149   26.893 -11.9992   15.208   12.349   6.1921   11.081   5.3778 1.268109 8.201398 
1 1 1   26    1  -43 o   13.511   5.8127   7.0231   11.564   4.0356   16.653   9.8048   16.070   13.896   6.3932   14.927   6.6241 -1.031157 9.206109 
1 1 1   26    1  -42 o   9.2721   4.5362 -14.3038   11.445  -3.2055   16.326 -25.0259   16.047   12.657   5.9861   10.043   4.9963 2.613864 7.797188 
1 1 1   26    1  -41 o   13.611   6.0993   5.2264   13.976   13.043   27.106   2.3961   16.311   16.406   7.7453   13.571   6.2734 2.835255 9.967257 
1 1 1   26    1  -40 o   10.896   5.2408  -9.5088   13.663 -30.0970   26.891  -2.3440   15.864   12.646   6.3186   12.692   5.9715 -0.4674149E-01 8.693861 
1 1 1   26    1  -39 o   14.596   6.3621   9.0993   14.223 -14.9613   27.216   18.139   16.682   13.795   6.7980   17.020   7.1367 -3.224771 9.856260 
1 1 1   26    1  -38 o   11.970   5.4436   0.6161   11.619   5.5044   16.173  -4.5995   16.705   14.179   6.4377   12.625   5.9956 1.553282 8.797280 
1 1 1   26    1  -37 o   25.459   6.8720   39.780   14.591   48.241   17.199   18.058   27.558   27.137   7.5171   17.208   8.0228 9.928705 10.99417 
1 1 1   26    1  -36 o   16.193   6.6247   14.783   13.892   20.142   16.223   0.0453   26.900   17.690   7.1882   15.162   7.3080 2.527838 10.25066 
1 1 1   26    1  -35 o   10.040   4.9155 -16.0271   13.512 -10.6261   15.849 -30.4005   25.855   11.591   5.5926   12.509   6.2421 -0.9182730 8.380971 
1 1 1   26    1  -34 o   14.515   6.5711   6.2933   16.698   0.0000   0.0000   6.2933   16.698  ?   ?    14.515   6.5711 0.000000 6.571081 
1 1 1   26    1  -33 o   16.113   6.2942   14.390   11.963   6.8718   16.638   22.438   17.215   14.640   6.5997   18.342   7.4224 -3.702148 9.932188 
1 1 1   26    1  -32 o   15.246   6.1637   11.866   11.859   15.650   16.674   7.9933   16.870   16.600   7.0561   14.915   6.6911 1.684609 9.724169 
1 1 1   26    1  -31 o   17.564   6.4401   18.191   12.064   7.9616   17.153   28.203   16.970   14.963   6.7270   20.146   7.5896 -5.183523 10.14174 
1 1 1   26    1  -30 o   16.303   6.2940   14.813   11.855  -2.8122   16.508   33.579   17.035   12.952   6.0931   21.957   7.6997 -9.004606 9.818934 
1 1 1   26    1  -29 o   14.891   6.1335   10.607   12.012   5.1002   16.552   16.735   17.460   14.341   6.5122   16.946   7.2126 -2.604587 9.717474 
1 1 1   26    1  -28 o   23.297   6.3388   31.303   12.356   17.328   17.368   45.625   17.581   17.118   7.2356   26.233   7.7115 -9.115686 10.57456 
1 1 1   26    1  -27 o   13.309   5.6800   6.1079   10.880 -21.4824   16.477   27.437   14.488   10.674   5.2653   20.717   7.1097 -10.04324 8.847092 
1 1 1   26    1  -26 o   19.109   5.8879   20.375   10.075   26.913   14.086   13.527   14.417   20.680   7.0123   16.062   6.6770 4.618217 9.682727 
1 1 1   26    1  -25 o   17.793   5.8815   17.571   9.9170   11.502   13.789   24.072   14.273   15.455   6.4850   19.563   7.0290 -4.108408 9.563540 
1 1 1   26    1  -24 o   15.552   5.8467   12.606   10.059   18.665   13.941   6.0254   14.528   17.712   6.8287   14.215   6.3038 3.497260 9.293473 
1 1 1   26    1  -23 o   9.7672   4.6174  -6.4444   9.6951 -13.5657   13.362   1.4725   14.089   10.386   5.0406   13.141   5.9830 -2.754745 7.823289 
1 1 1   26    1  -22 f   8.7485   4.2535 -12.1757   9.6296  -8.6373   13.488 -15.8548   13.753   11.149   5.3207   10.271   5.0136 0.8782921 7.310726 
1 1 1   26    1  -21 o   19.448   5.8391   20.801   9.9958   11.634   13.776   30.994   14.527   15.573   6.5045   22.323   7.0985 -6.750307 9.627936 
1 1 1   26    1  -20 o   13.752   5.5897   7.9438   9.8133   4.6737   13.628   11.466   14.143   13.754   6.1019   15.584   6.5551 -1.830667 8.955601 
1 1 1   26    1  -19 o   11.305   5.1448  -1.0348   10.402   18.236   13.903 -25.5393   15.678   17.674   6.8181   10.053   4.9908 7.620173 8.449484 
1 1 1   26    1  -18 o   18.412   6.1090   19.007   10.696   20.597   14.071   16.830   16.462   18.496   6.9230   17.232   7.1467 1.263519 9.950031 
1 1 1   26    1  -17 o   10.792   5.0562  -5.0933   11.167  -4.7685   15.671  -5.4282   15.917   12.581   5.9241   12.557   5.9305 0.2360344E-01 8.382453 
1 1 1   26    1  -16 o   12.607   5.5094   3.4470   10.726   19.417   16.406  -8.4747   14.175   17.978   7.2563   11.487   5.4742 6.491067 9.089583 
1 1 1   26    1  -15 o   14.880   5.9410   10.442   10.872   8.5668   16.505   11.879   14.450   15.280   6.7503   15.788   6.6324 -0.5074110 9.463365 
1 1 1   26    1  -14 o   22.833   5.9270   28.394   11.127   51.813   17.109   11.230   14.647   29.459   7.1891   15.644   6.6302 13.81457 9.779733 
1 1 1   26    1  -13 o   20.797   5.8866   23.639   10.427   32.774   14.876   14.817   14.619   23.033   7.1643   16.654   6.8026 6.378820 9.879420 
1 1 1   26    1  -12 o   27.063   5.0356   36.662   10.700   42.517   15.094   30.748   15.171   27.010   6.8476   22.114   7.2729 4.895424 9.989242 
1 1 1   26    1  -11 f   15.480   5.9089   12.093   10.367   4.4293   14.404   20.331   14.934   13.964   6.2293   18.393   7.0738 -4.429197 9.425677 
1 1 1   26    1  -10 o   35.804   3.8065   58.917   10.939   48.949   15.192   69.652   15.766   29.647   6.4684   37.019   5.3822 -7.371632 8.414717 
1 1 1   26    1   -9 o   24.090   5.5626   30.408   10.702   39.714   15.486   21.900   14.808   25.644   7.1439   18.955   7.1004 6.689005 10.07232 
1 1 1   26    1   -8 o   27.530   5.5666   39.360   12.062   17.902   19.123   53.539   15.545   17.679   7.5371   31.285   6.3136 -13.60626 9.832071 
1 1 1   26    1   -7 o   13.740   5.6744   7.3727   10.318   13.477   14.505   1.1202   14.680   16.306   6.7305   13.369   6.0947 2.937203 9.079943 
1 1 1   26    1   -6 o   15.693   6.1443   12.373   11.422   20.053   14.538  -0.0123   18.462   18.378   7.0015   14.175   6.5943 4.203168 9.617990 
1 1 1   26    1   -5 o   33.435   4.0663   52.151   10.855   51.911   15.108   52.408   15.606   30.953   6.2042   30.825   6.4197 0.1281223 8.927736 
1 1 1   26    1   -4 o   20.245   6.1951   22.967   11.178   35.303   14.965   7.3977   16.811   24.134   7.1199   15.164   6.7495 8.969512 9.810703 
1 1 1   26    1   -3 o   19.866   5.8951   21.527   10.235   32.771   14.353   9.8947   14.598   23.366   6.9927   15.357   6.5673 8.008958 9.593068 
1 1 1   26    1   -2 o   17.976   6.5494   18.374   12.447   1.0285   24.546   24.378   14.441   15.530   7.3436   19.962   7.0816 -4.431273 10.20178 
1 1 1   26    1   -1 o   19.343   6.3294   21.211   11.496   33.598   18.827   13.848   14.516   22.046   8.0515   16.438   6.7535 5.608521 10.50891 
1 1 1   26    1    0 o   14.462   6.1970   7.6093   13.046   3.1679   18.065   12.450   18.861   14.626   6.7030   16.517   7.2594 -1.891708 9.880725 
1 1 1   26    1    1 o   16.602   6.5875   14.620   13.286   23.471   19.096   6.3155   18.497   19.079   7.7816   15.272   6.9145 3.807632 10.40979 
1 1 1   26    1    2 o   17.787   6.3463   17.690   11.614   32.065   14.879  -4.7205   18.578   22.848   7.1738   13.518   6.3909 9.329744 9.607697 
1 1 1   26    1    3 o   13.925   5.8702   7.0978   11.382   4.3834   14.455   11.527   18.464   14.004   6.2444   16.275   7.1668 -2.270926 9.505547 
1 1 1   26    1    4 o   22.556   5.7303   27.125   10.555   36.521   15.024   17.966   14.833   24.612   7.0984   17.688   6.9787 6.924055 9.954373 
1 1 1   26    1    5 o   13.576   5.6175   7.0065   10.139   14.503   14.499  -0.1673   14.183   16.616   6.7792   12.970   5.9422 3.646268 9.014825 
1 1 1   26    1    6 o   9.8404   4.6638  -7.2431   10.010  -9.6996   14.368  -4.9256   13.955   11.418   5.4607   12.015   5.6364 -0.5969200 7.847825 
1 1 1   26    1    7 o   21.583   5.7918   25.084   10.401   49.122   14.970   2.6505   14.462   29.901   6.3389   13.618   6.1448 16.28283 8.828359 
1 1 1   26    1    8 o   16.498   5.9595   14.484   10.276   8.7494   14.327   20.559   14.747   14.993   6.4603   18.514   7.0520 -3.521112 9.563840 
1 1 1   26    1    9 o   11.003   5.1260  -4.2788   11.218 -11.8547   14.178   8.4065   18.346   11.027   5.3125   15.596   6.9887 -4.569479 8.778627 
1 1 1   26    1   10 o   14.541   5.9725   9.1522   11.348   15.300   14.648  -0.0778   17.948   16.824   6.8325   14.013   6.5134 2.810204 9.439709 
1 1 1   26    1   11 f   10.406   4.9304  -7.2867   11.169 -13.3246   14.121   2.8032   18.254   10.799   5.2270   14.553   6.6947 -3.753740 8.493581 
1 1 1   26    1   12 o   10.884   5.0862  -4.7511   11.183   8.0649   14.265 -25.1877   18.014   14.781   6.4077   10.982   5.4338 3.798632 8.401423 
1 1 1   26    1   13 o   14.969   6.0652   10.404   11.512   4.0343   14.948   19.687   18.045   14.002   6.2886   18.044   7.4828 -4.042147 9.774397 
1 1 1   26    1   14 o   8.1815   4.0831 -23.3814   11.082 -43.8755   17.359  -9.2839   14.397   9.3210   4.7116   11.459   5.4764 -2.138157 7.224267 
1 1 1   26    1   15 o   16.304   6.2043   14.155   11.408   3.1148   17.761   21.910   14.884   14.468   6.6365   18.888   7.1096 -4.419271 9.725721 
1 1 1   26    1   16 o   14.705   6.0091   9.7130   11.414   2.9113   18.149   14.163   14.680   14.511   6.6755   16.444   6.7776 -1.933044 9.513058 
1 1 1   26    1   17 o   20.208   6.7650   24.483   13.111   33.375   18.347   15.204   18.743   21.919   7.9567   16.959   7.3483 4.960379 10.83085 
1 1 1   26    1   18 o   22.104   6.1616   27.372   11.516   22.825   15.038   33.819   17.908   19.140   7.1585   22.182   7.8842 -3.041431 10.64915 
1 1 1   26    1   19 o   12.174   5.5302   0.0306   11.952   0.8717   16.670  -0.8592   17.145   13.783   6.3611   13.615   6.3411 0.1679802 8.981859 
1 1 1   26    1   20 o   13.700   6.1001   4.3069   13.746 -13.4198   23.199   13.898   17.065   13.536   6.5859   16.496   7.0785 -2.960623 9.668423 
1 1 1   26    1   21 o   24.488   6.1950   33.455   12.373   29.538   17.530   37.345   17.467   20.808   7.7392   23.510   7.8070 -2.701847 10.99294 
1 1 1   26    1   22 f   19.491   6.6321   22.639   12.601   18.454   17.694   26.947   17.951   17.586   7.3604   19.887   7.7267 -2.300802 10.67129 
1 1 1   26    1   23 o   16.684   6.4300   15.458   12.357   44.229   17.522 -13.0080   17.429   25.977   7.7148   11.967   5.7958 14.01029 9.649362 
1 1 1   26    1   24 o   19.314   6.6083   22.285   12.514  -8.5037   17.360   55.586   18.055   12.492   5.9817   29.966   7.4286 -17.47448 9.537557 
1 1 1   26    1   25 o   11.016   5.1845  -5.4874   11.976 -14.8847   16.472   5.0512   17.443   11.401   5.5478   14.597   6.6503 -3.195698 8.660528 
1 1 1   26    1   26 o   8.8655   4.3908 -20.2670   11.870 -19.7258   16.643 -20.8274   16.935   10.922   5.3692   10.915   5.3754 0.7587433E-02 7.597570 
1 1 1   26    1   27 o   12.327   5.5988   0.6749   12.242  -1.4709   17.092   2.9353   17.543   13.371   6.2613   14.197   6.5427 -0.8265829 9.055945 
1 1 1   26    1   28 o   9.0903   4.4839 -18.4487   11.939 -14.4376   16.550 -22.8011   17.240   11.439   5.5652   10.806   5.3411 0.6330452 7.713507 
1 1 1   26    1   29 o   16.708   6.4429   15.905   12.412   25.693   17.515   6.0318   17.591   19.328   7.5964   14.709   6.6926 4.618682 10.12403 
1 1 1   26    1   30 o   13.233   5.8648   4.3416   12.558   5.6328   17.469   2.9609   18.065   14.591   6.6506   14.243   6.5905 0.3477039 9.362980 
1 1 1   26    1   31 o   23.456   7.9994   39.543   18.334   39.543   18.334   0.0000   0.0000   23.456   7.9994  ?   ?  0.000000 7.999366 
1 1 1   26    1   32 o   23.181   6.6470   32.289   13.210   31.321   18.471   33.301   18.900   20.713   7.8917   21.190   8.0037 -0.4774780 11.24003 
1 1 1   26    1   33 o   11.884   5.6313  -5.7135   14.578   2.0916   24.326 -10.0869   18.209   15.128   7.1988   12.415   5.9910 2.713402 9.365604 
1 1 1   26    1   34 o   9.4523   4.7601 -36.9916   16.798 -59.8025   23.369 -12.6073   24.162   10.244   5.2084   13.554   6.6224 -3.310024 8.425209 
1 1 1   26    1   35 o   14.144   6.5362   3.3177   17.684 -17.8738   24.601   25.972   25.436   13.165   6.4827   18.451   8.2514 -5.286311 10.49337 
1 1 1   26    1   36 o   12.761   6.0959  -6.0241   17.794 -28.2253   24.906   17.123   25.431   12.429   6.1898   17.062   7.8681 -4.633394 10.01103 
1 1 1   26    1   37 o   20.488   7.8391   31.039   18.276   54.137   26.141   8.9575   25.560   23.929   9.3165   15.965   7.5324 7.963422 11.98061 
1 1 1   26    1   38 o   21.463   7.8619   34.012   17.971   16.297   24.417   54.953   26.547   16.829   7.7422   23.873   9.3611 -7.043224 12.14793 
1 1 1   26    1   39 o   17.464   7.3361   20.045   17.676   16.615   24.211   23.960   25.865   16.820   7.7276   17.925   8.1399 -1.104784 11.22382 
1 1 1   26    1   40 o   11.698   5.6785 -12.1221   16.985  -3.4202   23.574 -21.5151   24.492   14.198   6.8430   12.743   6.3105 1.455340 9.308550 
1 1 1   26    1   41 o   11.629   5.6625 -13.3114   17.245   2.7130   24.339 -29.4652   24.438   14.962   7.1421   12.140   6.0595 2.821437 9.366257 
1 1 1   26    1   42 o   11.208   5.5040 -17.4461   17.346 -37.0756   24.431   2.5088   24.632   11.635   5.8435   14.953   7.1507 -3.317415 9.234625 
1 1 1   26    1   43 o   21.587   7.8510   34.948   17.874   37.764   24.802   31.905   25.783   20.306   8.6177   19.053   8.4259 1.253117 12.05240 
1 1 1   26    1   44 o   13.281   6.2489  -0.5177   17.381 -10.8312   24.211   10.450   24.967   13.493   6.6005   15.854   7.4690 -2.360766 9.967622 
1 1 1   26    1   45 o   14.571   6.6258   7.5985   17.209   4.5321   23.736   10.997   24.987   14.970   7.1200   15.872   7.4759 -0.9021711 10.32394 
1 1 1   26    1   46 o   16.997   7.2159   19.088   17.400   8.2623   24.032   31.017   25.226   15.419   7.2836   18.770   8.3159 -3.350452 11.05463 
1 1 1   26    1   47 o   19.527   7.6714   28.993   17.857   16.530   24.922   42.142   25.598   16.506   7.6730   20.718   8.7720 -4.212053 11.65435 
1 1 1   26    1   48 o   10.444   5.1774 -22.0441   16.649   6.3930   23.902 -48.8460   23.204   15.095   7.1696   10.561   5.3507 4.534309 8.946143 
1 1 1   26    1   49 o   11.605   5.6442 -11.7036   16.989 -22.8937   23.959  -0.3885   24.093   12.338   6.1325   14.342   6.9137 -2.003891 9.241522 
1 1 1   26    1   50 o   12.821   6.0887  -2.6987   17.233  -6.4212   24.348   1.0380   24.394   13.788   6.7171   14.539   6.9956 -0.7518435 9.698359 
1 1 1   26    1   51 o   12.140   5.8442  -7.5070   17.080 -11.1951   24.313  -3.9135   23.999   13.349   6.5476   13.974   6.7759 -0.6252470 9.422528 
1 1 1   26    1   52 o   15.078   6.7822   10.611   17.462 -11.9662   24.584   33.600   24.807   13.340   6.5514   19.155   8.3746 -5.815251 10.63274 
1 1 1   26    2  -46 o   15.957   7.2201   14.574   20.130   0.0000   0.0000   14.574   20.130  ?   ?    15.957   7.2201 0.000000 7.220052 
1 1 1   26    2  -45 o   14.800   6.9154   7.2601   20.660   0.0000   0.0000   7.2601   20.660  ?   ?    14.800   6.9154 0.000000 6.915353 
1 1 1   26    2  -44 o   18.979   7.9587   30.037   20.749   0.0000   0.0000   30.037   20.749  ?   ?    18.979   7.9587 0.000000 7.958695 
1 1 1   26    2  -43 o   13.544   6.0670   6.0097   13.814   17.927   27.284   1.9014   16.020   16.565   7.8053   13.206   6.1433 3.359421 9.932914 
1 1 1   26    2  -42 o   11.496   5.4511  -4.6426   13.706 -30.4581   25.504   5.8402   16.252   12.109   6.0656   13.944   6.3781 -1.835138 8.801837 
1 1 1   26    2  -41 o   23.230   6.9325   35.281   14.122   44.413   26.704   31.736   16.639   20.604   8.8481   20.581   7.5606 0.2315903E-01 11.63838 
1 1 1   26    2  -40 o   15.606   7.0127   13.263   18.617   16.956   25.555   9.0858   27.175   16.432   7.6822   15.592   7.4709 0.8401871 10.71596 
1 1 1   26    2  -39 o   11.512   5.6448 -15.3265   18.034 -26.7443   24.963  -2.8640   26.080   12.270   6.1245   14.350   6.9822 -2.079355 9.287625 
1 1 1   26    2  -38 f   11.063   5.2948  -7.3724   13.566 -18.4456   15.516   28.560   27.950   10.400   5.1264   18.026   8.2892 -7.625613 9.746386 
1 1 1   26    2  -37 o   14.322   6.1946   9.3128   13.272  -5.8012   21.098   19.211   17.074   13.298   6.4251   16.984   7.1763 -3.685427 9.632279 
1 1 1   26    2  -36 o   9.7562   4.7248 -10.9229   11.579 -17.4394   16.189  -4.0978   16.568   10.760   5.2905   12.497   5.9449 -1.736801 7.958114 
1 1 1   26    2  -35 o   15.713   6.2149   14.071   11.790   0.0661   16.240   29.679   17.145   13.066   6.1136   19.997   7.6070 -6.931305 9.759190 
1 1 1   26    2  -34 o   17.696   6.4767   19.421   12.192   45.002   17.066  -7.2445   17.424   25.544   7.6205   12.342   5.9316 13.20220 9.656918 
1 1 1   26    2  -33 o   16.521   6.3615   16.255   12.088   21.316   16.854   10.895   17.345   17.674   7.2710   15.247   6.8165 2.426530 9.966578 
1 1 1   26    2  -32 o   8.1105   4.0683 -25.8483   11.664 -22.3282   15.839 -30.0193   17.241   10.193   5.0526   10.032   5.0196 0.1615009 7.122174 
1 1 1   26    2  -31 o   10.248   4.9121  -8.4822   11.770   0.7159   16.110 -19.0113   17.237   13.198   6.1466   10.999   5.4181 2.198492 8.193722 
1 1 1   26    2  -30 o   10.142   4.8722  -9.0736   11.725 -21.4531   16.243   4.3957   16.943   10.435   5.1623   14.018   6.4489 -3.582831 8.260654 
1 1 1   26    2  -29 o   13.551   5.9114   6.5399   12.302   0.4690   17.017   13.187   17.806   13.394   6.2643   15.827   7.0005 -2.432249 9.394025 
1 1 1   26    2  -28 o   12.749   5.7017   3.4325   12.148  -8.7767   16.480   17.961   17.978   11.944   5.7476   16.902   7.2591 -4.957748 9.258988 
1 1 1   26    2  -27 o   10.235   4.9737 -12.7746   13.118 -24.6439   16.578   7.1023   21.453   10.288   5.1114   15.197   7.0828 -4.908691 8.734572 
1 1 1   26    2  -26 o   20.923   7.0926   28.853   14.410   38.824   17.935   10.692   24.205   23.042   7.9104   15.992   7.4764 7.050041 10.88444 
1 1 1   26    2  -25 o   15.805   6.6219   13.614   14.344   16.723   18.201   8.5164   23.304   16.701   7.2388   15.641   7.3201 1.059566 10.29486 
1 1 1   26    2  -24 o   9.2827   4.6096 -22.3721   13.416 -18.7212   17.435 -27.6725   21.008   11.162   5.4887   11.454   5.7014 -0.2927237 7.913972 
1 1 1   26    2  -23 o   11.603   5.3900  -2.2874   12.265  -4.0418   17.542  -0.6097   17.154   12.938   6.1442   13.347   6.2574 -0.4088640 8.769608 
1 1 1   26    2  -22 o   9.8212   4.7224  -9.5495   11.074 -20.0357   17.294  -2.2615   14.418   11.002   5.4209   12.344   5.7709 -1.342902 7.917629 
1 1 1   26    2  -21 o   13.761   5.8190   7.7153   11.240   19.879   17.809  -0.3380   14.491   17.526   7.3630   12.718   5.8910 4.808448 9.429580 
1 1 1   26    2  -20 o   11.654   5.4071  -2.1905   12.286  -4.3856   21.965  -1.1911   14.821   13.923   6.6833   12.671   5.8994 1.251988 8.914559 
1 1 1   26    2  -19 o   35.421   4.8099   62.656   13.529   63.629   24.419   62.225   16.252   27.620   9.2322   33.410   6.1955 -5.789869 11.11835 
1 1 1   26    2  -18 f   9.8407   4.7234  -9.2136   10.968   8.3298   16.377 -23.4793   14.768   14.853   6.6332   9.7650   4.8469 5.088424 8.215334 
1 1 1   26    2  -17 o   18.052   6.0208   18.701   10.387   7.1007   14.399   31.286   14.998   14.252   6.3001   21.810   7.2338 -7.557409 9.592658 
1 1 1   26    2  -16 o   25.102   5.2722   32.925   10.444   25.040   14.602   41.183   14.944   19.585   7.0999   25.928   6.9357 -6.342154 9.925367 
1 1 1   26    2  -15 o   14.042   5.7197   8.9983   10.301  -4.7818   14.252   24.069   14.904   11.909   5.6205   19.176   7.1354 -7.266552 9.083193 
1 1 1   26    2  -14 o   11.557   5.1990   0.7646   10.264  -2.7322   14.181   4.6120   14.875   12.236   5.7211   13.825   6.2356 -1.589308 8.462513 
1 1 1   26    2  -13 o   31.610   4.4168   48.501   11.071   30.617   15.173   68.857   16.188   21.530   7.2780   35.929   5.7189 -14.39890 9.256109 
1 1 1   26    2  -12 f   12.437   5.4321   3.8015   10.414 -12.3617   14.361   21.729   15.124   10.863   5.2613   18.391   7.1068 -7.527841 8.842350 
1 1 1   26    2  -11 o   14.269   5.7642   9.5297   10.362   16.296   14.523   2.5112   14.791   16.746   6.8024   13.404   6.1135 3.341660 9.145947 
1 1 1   26    2  -10 o   11.536   5.1879   0.6949   10.210 -14.0124   14.087   16.970   14.819   10.553   5.1342   16.953   6.8771 -6.399950 8.582166 
1 1 1   26    2   -9 o   17.977   6.3539   19.000   11.617   13.618   18.654   22.410   14.847   16.277   7.1841   18.693   7.0863 -2.415409 10.09093 
1 1 1   26    2   -8 o   17.406   6.3772   17.673   11.825   7.7293   19.318   23.632   14.954   15.259   6.9698   19.101   7.1396 -3.842483 9.977526 
1 1 1   26    2   -7 o   12.703   5.6571   3.0205   11.827 -16.4860   19.069   15.217   15.078   11.990   5.8637   16.475   6.8368 -4.484440 9.006927 
1 1 1   26    2   -6 o   11.001   5.1524  -4.4141   11.584  -7.5794   18.536  -2.3858   14.838   12.852   6.1613   12.546   5.8615 0.3062334 8.504058 
1 1 1   26    2   -5 f   21.087   5.8607   24.738   10.436   24.194   14.472   25.328   15.062   19.429   7.0647   19.697   7.2002 -0.2674980 10.08726 
1 1 1   26    2   -4 o   10.014   4.7978  -9.0677   11.203   5.0698   14.126 -33.0364   18.392   13.814   6.1652   10.336   5.1738 3.477693 8.048453 
1 1 1   26    2   -3 o   14.136   5.9309   8.4277   11.532   2.7907   14.382   18.579   19.300   13.392   6.0769   17.397   7.4971 -4.004353 9.650620 
1 1 1   26    2   -2 o   9.7792   4.7622 -13.8689   12.202  -2.1509   14.014 -50.5863   24.808   12.336   5.7410   11.138   5.6304 1.197393 8.041167 
1 1 1   26    2   -1 o   12.034   5.3365   2.2205   10.412   18.943   14.588 -15.1479   14.867   17.626   6.9311   10.740   5.2360 6.886307 8.686519 
1 1 1   26    2    0 o   9.8640   4.6720  -6.5852   10.014  -2.7638   13.957 -10.6408   14.378   12.208   5.6975   11.131   5.3593 1.077697 7.822042 
1 1 1   26    2    1 o   9.6482   4.6133  -8.4320   10.244 -15.5750   14.432  -1.1776   14.544   10.519   5.1350   12.679   5.8829 -2.159768 7.808782 
1 1 1   26    2    2 o   13.526   5.7599   6.6948   11.144   3.3807   16.676   9.3693   14.981   14.054   6.4407   14.978   6.5289 -0.9234066 9.171107 
1 1 1   26    2    3 o   14.436   5.8136   9.8445   10.505   11.864   14.805   7.7973   14.907   15.575   6.6356   14.595   6.4328 0.9791937 9.241911 
1 1 1   26    2    4 o   34.146   3.9908   54.804   10.899   42.850   14.955   68.346   15.917   26.782   6.8298   36.040   5.5997 -9.257488 8.831967 
1 1 1   26    2    5 f   14.713   5.8139   10.677   10.309   0.3556   14.286   21.892   14.892   12.878   5.9235   18.544   7.0810 -5.666322 9.231993 
1 1 1   26    2    6 o   10.351   4.8508  -4.7507   10.290  -3.8511   14.510  -5.6607   14.594   12.194   5.7290   11.930   5.6475 0.2641764 8.044608 
1 1 1   26    2    7 o   22.417   5.7708   27.574   10.607   21.647   14.667   34.074   15.360   18.480   7.0343   22.879   7.3020 -4.398691 10.13905 
1 1 1   26    2    8 o   8.9706   4.3582 -11.9647   10.058  -1.8154   13.864 -23.2427   14.614   12.329   5.7286   9.7554   4.8386 2.574042 7.498635 
1 1 1   26    2    9 o   9.9767   4.7308  -6.7483   10.324   0.3434   14.465 -14.1129   14.740   12.910   5.9464   10.799   5.2534 2.110652 7.934563 
1 1 1   26    2   10 o   17.420   6.0718   17.296   10.583   17.863   14.735   16.691   15.211   17.226   6.9032   16.868   6.9199 0.3579712 9.774472 
1 1 1   26    2   11 o   8.6341   4.2620 -17.5622   10.855 -33.3941   14.092   5.5362   17.021   8.6559   4.3592   14.471   6.5839 -5.815236 7.896167 
1 1 1   26    2   12 f   20.661   6.2016   24.763   11.276   25.923   14.624   23.061   17.710   19.957   7.1214   18.477   7.5095 1.480595 10.34928 
1 1 1   26    2   13 o   9.9175   4.8097 -12.3501   12.107  -3.5408   14.001 -38.4571   24.103   12.044   5.6486   11.608   5.8265 0.4355087 8.115033 
1 1 1   26    2   14 o   12.599   5.6988   1.8058   12.529   17.634   17.167 -16.2326   18.326   17.065   7.2024   11.756   5.7491 5.308326 9.215525 
1 1 1   26    2   15 o   11.489   5.4568  -6.5261   13.849 -12.5825   16.844   6.1090   24.329   11.691   5.6707   15.585   7.3518 -3.894086 9.284719 
1 1 1   26    2   16 o   18.621   7.0589   22.386   14.732   10.753   18.150   44.849   25.222   15.584   6.9694   22.235   8.9891 -6.651493 11.37443 
1 1 1   26    2   17 o   28.089   6.7787   47.009   15.342   40.051   18.750   61.101   26.685   23.313   8.0845   25.612   9.5443 -2.298903 12.50812 
1 1 1   26    2   18 f   24.735   7.1112   38.631   15.101   21.358   18.301   75.471   26.728   17.915   7.4909   29.586   9.6491 -11.67101 12.21552 
1 1 1   26    2   19 o   16.474   6.7454   15.617   14.419   23.306   24.281   11.428   17.921   18.056   8.0690   15.674   6.9730 2.381652 10.66451 
1 1 1   26    2   20 o   16.649   6.5066   16.123   12.789   22.800   17.921   9.1946   18.257   18.284   7.5072   15.266   6.8947 3.018270 10.19289 
1 1 1   26    2   21 o   23.251   6.6567   32.778   13.259   37.110   18.977   28.648   18.531   22.172   8.0857   19.762   7.7994 2.409187 11.23424 
1 1 1   26    2   22 o   30.374   5.7343   49.800   13.677   40.372   19.242   59.427   19.445   23.078   8.1756   29.726   7.8932 -6.648256 11.36413 
1 1 1   26    2   23 o   15.168   6.3355   11.603   13.070   11.939   18.302   11.252   18.672   15.743   7.0227   15.646   7.0275 0.9771347E-01 9.934970 
1 1 1   26    2   24 o   13.062   5.8670   3.5501   13.015 -19.4743   18.331   26.955   18.481   11.371   5.5988   19.226   7.7221 -7.854416 9.538218 
1 1 1   26    2   25 o   18.199   7.0375   21.583   14.839   24.325   25.645   20.203   18.194   18.020   8.1519   17.503   7.4024 0.5171432 11.01136 
1 1 1   26    2   26 o   9.6354   4.7749 -21.6849   14.115 -42.8930   23.849 -10.2502   17.512   11.188   5.6388   12.094   5.8457 -0.9061632 8.122149 
1 1 1   26    2   27 o   9.2896   4.7041 -44.2069   17.787   0.0000   0.0000 -44.2069   17.787  ?   ?    9.2896   4.7041 0.000000 4.704095 
1 1 1   26    2   28 o   15.693   7.0167   12.172   18.385   0.0000   0.0000   12.172   18.385  ?   ?    15.693   7.0167 0.000000 7.016717 
1 1 1   26    2   29 o   21.373   9.0124   45.197   26.839   0.0000   0.0000   45.197   26.839  ?   ?    21.373   9.0124 0.000000 9.012362 
1 1 1   26    2   30 o   21.914   7.9879   36.735   18.518   49.243   26.154   24.161   26.223   22.383   9.1152   17.796   8.1255 4.587328 12.21106 
1 1 1   26    2   31 o   27.431   7.8804   52.477   18.551   60.991   26.292   44.037   26.178   25.093   9.4483   21.226   8.9227 3.866493 12.99556 
1 1 1   26    2   32 o   17.028   7.2529   18.890   17.678   29.811   25.261   8.4074   24.748   18.692   8.2994   15.590   7.3723 3.102205 11.10092 
1 1 1   26    2   33 o   19.056   7.5945   26.793   17.733   17.614   24.859   36.305   25.304   16.780   7.7525   19.824   8.5639 -3.043888 11.55168 
1 1 1   26    2   34 o   14.112   6.5134   4.7087   17.484 -17.5731   25.044   25.895   24.421   13.060   6.4516   18.039   8.0748 -4.979774 10.33561 
1 1 1   26    2   35 o   14.444   6.5980   6.9052   17.316   12.668   24.570   1.2172   24.408   16.036   7.5086   14.658   7.0386 1.377492 10.29178 
1 1 1   26    2   36 o   14.944   6.7647   9.5211   17.694   5.4464   25.149   13.515   24.898   15.172   7.2473   16.121   7.5518 -0.9495888 10.46675 
1 1 1   26    2   37 o   19.409   7.6977   28.912   18.134   18.657   25.796   38.932   25.497   16.783   7.8036   20.074   8.6335 -3.290066 11.63753 
1 1 1   26    2   38 f   20.684   7.8552   33.514   18.264   44.383   26.070   23.037   25.594   20.952   8.8610   17.357   7.9636 3.594414 11.91371 
1 1 1   26    2   39 o   13.601   6.3654   2.1153   17.625   23.030   24.979 -18.6233   24.874   17.331   7.9199   12.833   6.3558 4.498166 10.15484 
1 1 1   26    2   40 o   13.748   6.4161   3.1481   17.699 -19.4026   24.731   26.825   25.341   12.720   6.3067   17.838   8.0830 -5.117126 10.25226 
1 1 1   26    2   41 o   17.752   7.4250   23.162   17.988   47.400   26.290   1.8300   24.664   21.308   8.9485   14.577   7.0190 6.730409 11.37290 
1 1 1   26    2   42 o   16.977   7.1985   19.726   17.280   16.232   24.669   23.093   24.213   16.297   7.5953   17.294   7.8622 -0.9977894 10.93177 
1 1 1   26    2   43 o   12.296   5.8946  -5.7441   16.966 -38.8262   23.974   27.447   24.013   11.265   5.6746   18.026   8.0422 -6.761035 9.842643 
1 1 1   26    2   44 o   14.091   6.5040   5.5870   17.434  -4.8036   25.136   15.218   24.200   13.995   6.8196   16.149   7.5253 -2.153832 10.15565 
1 1 1   26    2   45 o   13.090   6.1961  -1.0756   17.561  -2.7137   25.171   0.4778   24.511   14.213   6.9027   14.444   6.9653 -0.2305222 9.806291 
1 1 1   26    3  -37 o   13.161   6.4045  -7.7529   21.959   0.0000   0.0000  -7.7529   21.959  ?   ?    13.161   6.4045 0.000000 6.404491 
1 1 1   26    3  -36 o   11.229   5.5951 -25.6313   20.464   0.0000   0.0000 -25.6313   20.464  ?   ?    11.229   5.5951 0.000000 5.595141 
1 1 1   26    3  -35 o   13.224   6.4153  -6.0725   21.584   0.0000   0.0000  -6.0725   21.584  ?   ?    13.224   6.4153 0.000000 6.415339 
1 1 1   26    3  -34 f   10.665   5.2746 -19.8887   16.907   16.779   28.062 -40.7851   21.184   16.342   7.7636   10.399   5.2504 5.942707 9.372272 
1 1 1   26    3  -33 o   11.353   5.5422 -12.8653   16.815  -5.7912   26.057 -17.9130   22.011   13.968   6.8360   12.211   6.0353 1.757100 9.118910 
1 1 1   26    3  -32 o   11.437   5.3761  -3.0023   12.809  -3.8450   16.107  -1.5526   21.126   12.285   5.8491   13.639   6.5488 -1.354332 8.780607 
1 1 1   26    3  -31 o   14.672   6.0962   11.471   12.009   8.7262   16.700   14.410   17.282   14.487   6.5635   15.679   6.9178 -1.192285 9.535993 
1 1 1   26    3  -30 o   17.831   6.4644   20.364   12.105   43.436   17.032  -3.1919   17.209   24.470   7.6740   12.647   6.0283 11.82334 9.758613 
1 1 1   26    3  -29 o   13.155   5.7792   6.1199   11.942   10.097   16.650   1.9071   17.137   14.772   6.6355   13.396   6.2719 1.376096 9.130490 
1 1 1   26    3  -28 o   18.211   6.5054   21.251   12.207   22.246   16.987   20.188   17.552   17.613   7.2781   17.038   7.2409 0.5747604 10.26657 
1 1 1   26    3  -27 o   11.728   5.3977  -0.0409   11.886   8.0510   16.564  -8.6303   17.066   14.404   6.5301   11.953   5.7760 2.450737 8.718060 
1 1 1   26    3  -26 o   15.844   6.2890   14.823   12.114   30.950   16.772  -2.7618   17.514   20.300   7.5664   12.839   6.1091 7.461137 9.724739 
1 1 1   26    3  -25 o   11.598   5.4697  -3.6075   13.454 -24.8323   21.048   11.056   17.495   11.486   5.7152   15.119   6.7958 -3.633518 8.879529 
1 1 1   26    3  -24 o   12.240   5.6777  -0.1737   13.531  -9.8258   20.682   7.0490   17.891   12.743   6.2045   14.449   6.6399 -1.705606 9.087577 
1 1 1   26    3  -23 o   14.001   6.1728   7.8439   13.737   6.6983   21.238   8.6679   18.012   14.839   6.9586   14.767   6.7395 0.7143688E-01 9.687286 
1 1 1   26    3  -22 o   18.079   6.8780   21.741   14.018   11.050   22.103   28.933   18.130   15.562   7.2316   19.400   7.6960 -3.837678 10.56047 
1 1 1   26    3  -21 o   11.999   5.5022   0.4998   12.195   2.0590   16.855  -1.2128   17.664   13.487   6.2835   13.160   6.2249 0.3271599 8.844856 
1 1 1   26    3  -20 o   20.072   6.5943   25.524   12.473   34.961   17.238   15.154   18.070   21.634   7.7304   16.078   7.0846 5.555841 10.48571 
1 1 1   26    3  -19 o   13.846   5.9958   7.8996   12.464   29.780   17.400 -15.1569   17.861   19.908   7.6410   11.525   5.6444 8.383383 9.499677 
1 1 1   26    3  -18 o   10.024   4.8536 -11.0117   12.205 -11.9686   17.007  -9.9955   17.525   11.625   5.6523   12.004   5.8135 -0.3794498 8.108301 
1 1 1   26    3  -17 f   16.369   6.8516   16.385   15.334   5.5830   27.497   21.260   18.474   15.434   7.4262   17.457   7.4242 -2.023515 10.50080 
1 1 1   26    3  -16 o   15.574   6.4522   13.592   13.398   73.735   28.970  -2.7721   15.111   26.503   9.9308   12.315   5.8045 14.18833 11.50276 
1 1 1   26    3  -15 o   16.388   6.5620   16.192   13.303   57.132   28.602   4.8917   15.027   22.948   9.4595   13.669   6.2059 9.279111 11.31349 
1 1 1   26    3  -14 o   11.343   5.3574  -4.6115   12.995   2.4153   27.764  -6.5826   14.705   15.183   7.3442   11.619   5.5479 3.563915 9.204183 
1 1 1   26    3  -13 o   19.613   6.3687   23.571   11.650   19.892   17.908   26.271   15.340   17.211   7.3143   19.437   7.2378 -2.225824 10.29003 
1 1 1   26    3  -12 o   10.369   4.9240  -6.3348   11.268 -27.3390   17.381   8.8934   14.799   10.281   5.1282   14.505   6.4005 -4.224035 8.201549 
1 1 1   26    3  -11 o   10.757   5.0502  -4.1590   11.244 -30.0007   17.021   15.847   14.976   9.9488   4.9795   16.276   6.7888 -6.327116 8.419205 
1 1 1   26    3  -10 o   12.131   5.4766   1.8616   11.505   15.010   17.735  -7.6927   15.118   16.132   7.0661   11.611   5.5658 4.520877 8.994885 
1 1 1   26    3   -9 o   10.614   5.0234  -5.6459   11.537   17.144   14.559 -44.1115   18.915   16.673   6.7967   9.6360   4.8763 7.036646 8.364986 
1 1 1   26    3   -8 o   8.3109   4.1463 -22.3099   11.384 -36.4581   14.064   4.5722   19.386   8.3489   4.2226   14.433   6.7287 -6.083651 7.943937 
1 1 1   26    3   -7 o   15.108   6.1026   12.176   11.614   16.692   14.429   3.8667   19.571   16.558   6.7600   14.363   6.7175 2.195123 9.530061 
1 1 1   26    3   -6 o   11.666   5.3419  -0.1568   11.442  -1.1903   18.346   0.5013   14.638   13.408   6.3426   12.787   5.9223 0.6212330 8.677681 
1 1 1   26    3   -5 o   14.999   5.9006   11.984   10.577   20.410   14.555   2.5554   15.396   17.712   6.9357   13.353   6.1448 4.358904 9.266208 
1 1 1   26    3   -4 o   11.918   5.3245   2.1938   10.564  -5.1455   14.406   10.733   15.538   11.773   5.5843   15.064   6.6058 -3.290455 8.649872 
1 1 1   26    3   -3 o   11.315   5.1681  -0.3723   10.620   7.4044   14.827  -8.5651   15.218   14.220   6.3333   11.544   5.5471 2.675392 8.419092 
1 1 1   26    3   -2 o   12.668   5.5147   4.8434   10.658   3.1205   14.708   6.7490   15.468   13.308   6.0798   14.192   6.3836 -0.8843403 8.815540 
1 1 1   26    3   -1 o   13.076   5.7084   5.5220   11.489   20.515   14.840 -16.9123   18.153   17.722   6.9839   11.498   5.6433 6.223889 8.978990 
1 1 1   26    3    0 o   11.560   5.2731   0.0429   11.009   2.1826   14.856  -2.5631   16.395   13.165   6.0500   12.757   6.0229 0.4080324 8.536871 
1 1 1   26    3    1 o   11.729   5.3979  -0.6277   11.883  -3.8540   15.058   4.6973   19.345   12.183   5.7581   14.473   6.7388 -2.289436 8.863853 
1 1 1   26    3    2 o   13.961   5.7966   8.9354   10.847   21.432   15.341  -3.5561   15.338   17.941   7.0913   12.312   5.8165 5.628905 9.171598 
1 1 1   26    3    3 o   8.8393   4.3311 -14.1936   10.554  -4.6476   14.548 -24.7996   15.335   11.899   5.6344   9.7883   4.8719 2.110571 7.448613 
1 1 1   26    3    4 o   18.784   6.4759   21.842   12.024   29.880   15.570   9.9621   18.928   20.718   7.3527   15.275   6.9468 5.442939 10.11539 
1 1 1   26    3    5 o   14.115   6.1137   8.3041   12.964 -18.0429   17.933   37.145   18.762   11.313   5.5639   21.914   8.0321 -10.60028 9.770940 
1 1 1   26    3    6 o   26.733   5.8458   39.698   12.383   46.990   16.187   29.410   19.227   27.056   7.2096   19.511   7.8624 7.545397 10.66755 
1 1 1   26    3    7 o   22.279   6.3693   29.782   12.147   52.101   15.786  -2.6135   19.019   29.443   6.7251   13.355   6.3579 16.08802 9.254777 
1 1 1   26    3    8 o   15.719   6.2285   13.947   11.862   32.781   15.385 -13.6603   18.627   21.847   7.3284   11.952   5.8342 9.895047 9.367189 
1 1 1   26    3    9 o   19.550   7.1794   26.199   15.001   23.370   18.238   32.116   26.379   18.078   7.5121   18.950   8.4433 -0.8718128 11.30138 
1 1 1   26    3   10 o   15.677   6.4234   13.824   13.085  -0.0462   18.201   28.664   18.826   13.519   6.3715   19.352   7.7865 -5.832432 10.06107 
1 1 1   26    3   11 o   16.807   6.5522   17.282   12.943   29.699   18.108   4.3108   18.508   19.796   7.7405   14.230   6.6141 5.566305 10.18147 
1 1 1   26    3   12 o   21.740   6.6877   29.734   13.005   37.758   18.237   21.433   18.549   22.252   7.9513   17.547   7.4500 4.704866 10.89615 
1 1 1   26    3   13 o   14.297   6.1340   9.2237   12.811   14.290   17.638   3.5666   18.638   15.949   7.0146   14.123   6.5888 1.826041 9.623721 
1 1 1   26    3   14 o   8.6821   4.3258 -22.4748   12.219 -26.8802   16.516 -17.1478   18.161   10.015   4.9962   11.437   5.6197 -1.422167 7.519508 
1 1 1   26    3   15 o   13.937   6.0740   7.8215   12.960   19.619   18.382  -3.8396   18.275   17.105   7.3433   12.981   6.1946 4.124019 9.607120 
1 1 1   26    3   16 o   21.651   6.6773   29.563   12.954   43.546   18.054   14.723   18.599   24.299   7.9307   16.052   7.1245 8.247169 10.66089 
1 1 1   26    3   17 f   17.384   6.6016   19.028   12.899   13.831   18.036   24.468   18.455   15.836   7.0231   18.238   7.5658 -2.401979 10.32303 
1 1 1   26    3   18 o   11.660   5.4305  -1.9133   12.573   25.566   17.700 -29.9040   17.864   18.630   7.5309   10.219   5.1125 8.411649 9.102307 
1 1 1   26    3   19 o   11.683   5.5675  -5.8922   14.661 -21.1315   24.399   2.7204   18.342   12.612   6.2550   13.896   6.5003 -1.283032 9.021030 
1 1 1   26    3   20 o   11.824   5.7592 -12.3551   17.878 -14.6821   25.541 -10.1197   25.033   13.325   6.5700   13.616   6.6714 -0.2913151 9.363368 
1 1 1   26    3   21 o   12.092   5.8571  -9.7400   17.809 -35.0538   25.057   16.098   25.315   11.802   5.9258   16.448   7.6755 -4.646971 9.696789 
1 1 1   26    3   22 o   13.916   6.5209   2.7975   18.593 -34.9520   26.026   42.142   26.570   12.006   6.0299   20.423   8.7988 -8.417252 10.66673 
1 1 1   26    3   23 o   12.035   5.8181  -8.9741   17.358 -12.8901   24.788  -5.2066   24.314   13.291   6.5374   13.898   6.7577 -0.6073656 9.402306 
1 1 1   26    3   24 o   18.925   7.6805   27.733   18.494   34.346   25.831   20.778   26.491   19.076   8.4350   16.986   7.9013 2.089945 11.55768 
1 1 1   26    3   25 o   11.989   5.8291 -10.8708   18.085 -18.8573   24.872  -1.9114   26.343   12.801   6.3426   14.452   7.0285 -1.650846 9.467219 
1 1 1   26    3   26 o   19.506   7.7223   29.811   18.219   20.324   25.287   40.051   26.273   16.881   7.8064   19.938   8.6691 -3.056391 11.66588 
1 1 1   26    3   27 o   12.199   5.8904  -7.9172   17.664  -2.6664   24.942 -13.2009   25.020   14.163   6.8767   13.243   6.5244 0.9195127 9.479308 
1 1 1   26    3   28 o   17.089   7.3002   20.536   18.002   12.644   25.653   28.193   25.269   15.845   7.4969   17.990   8.1194 -2.144209 11.05114 
1 1 1   26    3   29 o   12.137   5.8619  -7.8878   17.523  -8.2783   24.843  -7.5012   24.720   13.588   6.6552   13.638   6.6708 -0.4927158E-01 9.422931 
1 1 1   26    3   30 o   19.202   7.6680   29.126   18.115   37.771   25.571   20.416   25.667   19.483   8.5106   16.758   7.7890 2.725460 11.53684 
1 1 1   26    3   31 o   14.858   6.7377   10.154   17.645   14.071   24.705   6.0758   25.209   15.915   7.4764   15.009   7.1928 0.9055271 10.37466 
1 1 1   26    3   32 o   14.336   6.6086   7.0005   17.918   16.144   25.228  -2.3066   25.453   16.202   7.5934   14.198   6.9058 2.004256 10.26400 
1 1 1   26    3   33 o   19.208   7.6743   29.141   18.154  -3.0051   24.989   65.066   26.417   14.074   6.8447   25.155   9.4709 -11.08177 11.68544 
1 1 1   26    3   34 f   10.242   5.1088 -25.9391   17.241 -20.5571   24.721 -31.0366   24.058   12.570   6.2447   11.716   5.8720 0.8542042 8.571849 
1 1 1   26    3   35 o   14.220   6.5758   6.2737   17.945 -15.9164   25.037   29.718   25.735   12.977   6.4180   18.114   8.1829 -5.136633 10.39956 
1 1 1   26    3   36 o   15.389   6.9461   12.494   18.496   28.043   26.088  -3.2212   26.228   17.866   8.1373   14.238   6.9443 3.628222 10.69764 
1 1 1   26    4  -24 o   12.717   6.2752 -15.1761   23.455   0.0000   0.0000 -15.1761   23.455  ?   ?    12.717   6.2752 0.000000 6.275161 
1 1 1   26    4  -23 o   14.336   6.8865   2.0332   23.419   0.0000   0.0000   2.0332   23.419  ?   ?    14.336   6.8865 0.000000 6.886456 
1 1 1   26    4  -22 o   10.013   4.9653 -21.0075   15.364  -5.7638   20.663 -39.8595   22.978   13.034   6.3122   10.893   5.4959 2.140965 8.369528 
1 1 1   26    4  -21 o   27.588   7.4555   52.025   17.161   51.788   23.131   52.315   25.595   23.318   8.8437   22.283   9.0383 1.034931 12.64528 
1 1 1   26    4  -20 o   12.126   5.5501   1.5481   12.331  -3.9676   16.837   7.9303   18.111   12.405   5.9267   14.448   6.6543 -2.042972 8.910944 
1 1 1   26    4  -19 o   13.469   5.9004   7.2496   12.368   12.098   16.928   1.6989   18.113   15.109   6.7457   13.473   6.3518 1.635532 9.265523 
1 1 1   26    4  -18 o   11.759   5.4370  -0.1390   12.262 -16.8215   16.682   19.472   18.087   10.857   5.3445   16.693   7.2259 -5.836398 8.987608 
1 1 1   26    4  -17 o   14.084   6.0357   9.5326   12.377  -3.3355   16.752   25.003   18.368   12.472   5.9457   17.965   7.5077 -5.493264 9.576891 
1 1 1   26    4  -16 o   11.688   5.4296  -0.7940   12.446   0.8287   16.917  -2.7090   18.377   13.114   6.1687   12.921   6.1784 0.1924849 8.730772 
1 1 1   26    4  -15 o   16.308   6.4043   16.639   12.441   15.163   17.142   18.282   18.084   15.759   6.9236   16.428   7.1668 -0.6685934 9.964968 
1 1 1   26    4  -14 o   10.258   4.9551  -9.5611   12.531  -9.8248   16.730  -9.2242   18.912   11.632   5.6440   12.265   5.9629 -0.6337347 8.210399 
1 1 1   26    4  -13 o   13.254   6.0429   4.5687   14.437   10.115   16.879 -10.5460   27.865   14.704   6.6363   13.752   6.7958 0.9518023 9.498652 
1 1 1   26    4  -12 o   13.251   6.0752   4.1307   14.859   5.1968   17.465   1.3374   28.271   13.898   6.4480   14.743   7.1948 -0.8451805 9.661349 
1 1 1   26    4  -11 o   11.667   5.5546  -4.6807   14.521  -3.7883   16.866  -7.2378   28.549   12.430   5.9369   14.083   6.9440 -1.652747 9.135960 
1 1 1   26    4  -10 o   9.3770   4.5607 -11.4318   11.097   0.3715   16.571 -21.0269   14.941   12.968   6.1018   9.8497   4.8866 3.118102 7.817313 
1 1 1   26    4   -9 o   12.558   5.5536   4.6922   11.201   23.601   17.128  -9.4388   14.806   17.803   7.3275   11.098   5.3671 6.704577 9.082824 
1 1 1   26    4   -8 o   11.754   5.3519   1.2897   11.276   4.3736   17.200  -1.0344   14.932   13.736   6.3817   12.367   5.8106 1.369124 8.630707 
1 1 1   26    4   -7 o   11.029   5.1327  -1.9831   11.199  -4.4745   17.037  -0.0878   14.860   12.397   5.9336   12.510   5.8517 -0.1128864 8.333645 
1 1 1   26    4   -6 o   12.673   5.6150   4.8068   11.502   17.460   17.305  -5.2059   15.394   16.297   7.0611   11.864   5.6681 4.432240 9.054583 
1 1 1   26    4   -5 o   9.5524   4.6408 -11.2441   11.402   12.141   17.467 -28.6074   15.051   15.181   6.8095   9.2382   4.6322 5.942348 8.235716 
1 1 1   26    4   -4 o   16.211   6.7640   16.770   14.874   8.1250   27.340   20.405   17.728   15.342   7.3879   16.968   7.2461 -1.625856 10.34833 
1 1 1   26    4   -3 o   10.401   5.0064  -8.6419   12.518 -11.3404   16.994  -5.4406   18.509   11.553   5.6246   12.633   6.0823 -1.080377 8.284361 
1 1 1   26    4   -2 o   9.9628   4.8264 -10.5205   12.104 -13.6101   16.870  -7.2426   17.377   11.267   5.5111   12.142   5.8576 -0.8747034 8.042655 
1 1 1   26    4   -1 o   10.907   5.1673  -4.8443   12.263  -8.2722   16.897  -1.0296   17.824   11.889   5.7456   13.059   6.1992 -1.169980 8.452375 
1 1 1   26    4    0 o   17.887   6.5956   20.964   12.682   9.0821   17.400   34.430   18.523   14.605   6.6495   20.553   7.8851 -5.948238 10.31457 
1 1 1   26    4    1 o   11.132   5.1520  -1.2487   11.047 -10.5973   13.908   14.731   18.183   10.654   5.1641   15.738   7.0113 -5.083846 8.707809 
1 1 1   26    4    2 o   13.419   5.7712   7.6112   11.393   2.3602   14.657   15.628   18.110   12.907   5.9594   15.915   7.0489 -3.008737 9.230447 
1 1 1   26    4    3 o   10.896   5.0840  -2.4981   11.101 -11.9329   14.250   12.070   17.706   10.605   5.1602   15.190   6.8314 -4.585356 8.561258 
1 1 1   26    4    4 o   14.788   6.4404   11.312   14.551   14.614   17.368   3.5383   26.651   15.683   6.9266   14.838   7.1817 0.8453627 9.977675 
1 1 1   26    4    5 o   17.494   6.8944   20.944   14.462   28.944   17.539   3.9518   25.563   19.238   7.5891   14.770   7.1205 4.467334 10.40657 
1 1 1   26    4    6 o   15.433   6.3149   13.963   12.626   5.2698   17.430   23.561   18.315   13.931   6.4557   17.650   7.4440 -3.719599 9.853355 
1 1 1   26    4    7 o   12.452   5.6534   2.8369   12.470  -4.9834   17.154   11.599   18.158   12.359   5.9255   15.116   6.8466 -2.756656 9.054743 
1 1 1   26    4    8 o   9.5416   4.6721 -13.9875   12.219 -24.9684   16.581  -0.9361   18.077   10.078   5.0241   13.103   6.2267 -3.025068 8.000834 
1 1 1   26    4    9 o   13.522   5.9472   7.2346   12.678   10.944   17.242   2.8673   18.708   14.907   6.7193   13.747   6.4729 1.159856 9.329871 
1 1 1   26    4   10 o   15.442   6.3695   14.076   12.979   11.875   17.799   16.575   18.967   15.119   6.8200   16.064   7.1584 -0.9445972 9.887082 
1 1 1   26    4   11 o   9.2995   4.5800 -16.2171   12.297  -6.1212   16.840 -27.7501   17.998   12.115   5.8248   10.304   5.1516 1.811245 7.776048 
1 1 1   26    4   12 o   14.519   6.1735   10.968   12.769   5.9949   17.704   16.360   18.436   14.065   6.5137   16.015   7.1016 -1.950422 9.636478 
1 1 1   26    4   13 o   13.861   6.2458   7.1591   14.883   0.9635   25.541   10.344   18.312   14.435   6.9970   14.878   6.7922 -0.4436588 9.751540 
1 1 1   26    4   14 o   12.236   5.7710  -1.8739   14.983  -1.3260   25.880  -2.1501   18.375   14.260   6.9422   12.990   6.2023 1.269718 9.309307 
1 1 1   26    4   15 o   14.032   6.3006   7.8801   14.996 -27.0347   25.797   25.700   18.429   12.280   6.1440   18.123   7.5428 -5.842990 9.728424 
1 1 1   26    4   16 o   13.462   6.1333   5.2108   14.835   22.731   26.313  -2.9536   17.963   16.948   7.8806   12.801   6.1175 4.147395 9.976326 
1 1 1   26    4   17 o   12.161   5.7410  -2.1993   14.887   23.138   26.048 -14.4904   18.142   17.012   7.8864   11.520   5.6514 5.492464 9.702285 
1 1 1   26    4   18 o   12.166   5.9016  -8.7263   18.258   0.0000   0.0000  -8.7263   18.258  ?   ?    12.166   5.9016 0.000000 5.901553 
1 1 1   26    4   19 o   14.570   6.7261   8.2875   18.658   26.880   26.140 -11.0209   26.639   17.527   8.0438   13.550   6.6863 3.976607 10.45986 
1 1 1   26    4   20 o   12.107   5.8703  -8.7068   18.014 -13.2289   25.083  -3.8893   25.889   13.132   6.4815   14.034   6.8567 -0.9024982 9.435229 
1 1 1   26    4   21 o   11.984   5.8367 -10.5742   18.347   1.8925   25.577 -23.7906   26.334   14.538   7.0363   12.594   6.2866 1.944242 9.435570 
1 1 1   26    4   22 o   16.892   7.3408   20.473   18.818   6.6299   26.571   34.405   26.655   15.118   7.2808   18.633   8.3806 -3.515308 11.10152 
1 1 1   26    4   23 o   11.307   5.5810 -18.1910   18.600   3.8137   27.159 -37.6290   25.526   14.911   7.2247   11.615   5.8515 3.295860 9.297125 
1 1 1   27    0  -46 o   15.843   9.3262   25.186   20.465   25.186   20.465   25.186   20.465   15.843   9.3262   15.843   9.3262 0.000000 0.000000 
1 1 1   27    0  -45 o   29.199   10.191   61.143   21.933   61.143   21.933   61.143   21.933   29.199   10.191   29.199   10.191 0.000000 0.000000 
1 1 1   27    0  -44 o   20.299   9.3339   33.800   16.919   33.800   16.919   33.800   16.919   20.299   9.3339   20.299   9.3339 0.000000 0.000000 
1 1 1   27    0  -43 o   12.264   8.4343   4.6968   27.589   4.6968   27.589   4.6968   27.589   12.264   8.4343   12.264   8.4343 0.000000 0.000000 
1 1 1   27    0  -42 o   17.715   10.629   37.628   27.539   37.628   27.539   37.628   27.539   17.715   10.629   17.715   10.629 0.000000 0.000000 
1 1 1   27    0  -41 o   10.998   7.7156  -5.9224   26.315  -5.9224   26.315  -5.9224   26.315   10.998   7.7156   10.998   7.7156 0.000000 0.000000 
1 1 1   27    0  -40 o   7.3767   5.3129 -20.2903   15.874 -20.2903   15.874 -20.2903   15.874   7.3767   5.3129   7.3767   5.3129 0.000000 0.000000 
1 1 1   27    0  -39 o   8.0213   5.6938 -13.3418   15.764 -13.3418   15.764 -13.3418   15.764   8.0213   5.6938   8.0213   5.6938 0.000000 0.000000 
1 1 1   27    0  -38 o   9.9639   6.7382   0.2346   16.093   0.2346   16.093   0.2346   16.093   9.9639   6.7382   9.9639   6.7382 0.000000 0.000000 
1 1 1   27    0  -37 o   8.3294   5.8841 -11.6879   16.158 -11.6879   16.158 -11.6879   16.158   8.3294   5.8841   8.3294   5.8841 0.000000 0.000000 
1 1 1   27    0  -36 o   7.4715   5.3818 -20.9469   16.311 -20.9469   16.311 -20.9469   16.311   7.4715   5.3818   7.4715   5.3818 0.000000 0.000000 
1 1 1   27    0  -35 o   7.5845   5.4568 -20.5101   16.550 -20.5101   16.550 -20.5101   16.550   7.5845   5.4568   7.5845   5.4568 0.000000 0.000000 
1 1 1   27    0  -34 o   9.6127   6.6121  -3.5287   16.973  -3.5287   16.973  -3.5287   16.973   9.6127   6.6121   9.6127   6.6121 0.000000 0.000000 
1 1 1   27    0  -33 o   9.4431   6.5108  -4.2696   16.688  -4.2696   16.688  -4.2696   16.688   9.4431   6.5108   9.4431   6.5108 0.000000 0.000000 
1 1 1   27    0  -32 o   11.308   7.4395   5.8894   17.408   5.8894   17.408   5.8894   17.408   11.308   7.4395   11.308   7.4395 0.000000 0.000000 
1 1 1   27    0  -31 o   16.501   9.0894   24.878   17.716   24.878   17.716   24.878   17.716   16.501   9.0894   16.501   9.0894 0.000000 0.000000 
1 1 1   27    0  -30 o   14.191   8.5118   17.698   17.649   17.698   17.649   17.698   17.649   14.191   8.5118   14.191   8.5118 0.000000 0.000000 
1 1 1   27    0  -29 o   10.647   7.1276   2.4045   17.173   2.4045   17.173   2.4045   17.173   10.647   7.1276   10.647   7.1276 0.000000 0.000000 
1 1 1   27    0  -28 o   8.6048   6.0710 -11.8429   17.023 -11.8429   17.023 -11.8429   17.023   8.6048   6.0710   8.6048   6.0710 0.000000 0.000000 
1 1 1   27    0  -27 f   13.072   8.1082   13.458   17.246   13.458   17.246   13.458   17.246   13.072   8.1082   13.072   8.1082 0.000000 0.000000 
1 1 1   27    0  -26 o   13.630   8.3492   15.471   17.752   15.471   17.752   15.471   17.752   13.630   8.3492   13.630   8.3492 0.000000 0.000000 
1 1 1   27    0  -25 o   12.959   8.0668   12.942   17.222   12.942   17.222   12.942   17.222   12.959   8.0668   12.959   8.0668 0.000000 0.000000 
1 1 1   27    0  -24 o   12.505   7.9493   10.898   17.710   10.898   17.710   10.898   17.710   12.505   7.9493   12.505   7.9493 0.000000 0.000000 
1 1 1   27    0  -23 o   13.048   8.5078   11.676   22.026   11.676   22.026   11.676   22.026   13.048   8.5078   13.048   8.5078 0.000000 0.000000 
1 1 1   27    0  -22 o   11.423   7.7699   1.4600   22.036   1.4600   22.036   1.4600   22.036   11.423   7.7699   11.423   7.7699 0.000000 0.000000 
1 1 1   27    0  -20 o   15.080   8.7226   20.065   17.395   20.065   17.395   20.065   17.395   15.080   8.7226   15.080   8.7226 0.000000 0.000000 
1 1 1   27    0  -19 o   6.9250   4.9976 -20.8805   14.381 -20.8805   14.381 -20.8805   14.381   6.9250   4.9976   6.9250   4.9976 0.000000 0.000000 
1 1 1   27    0  -18 o   6.4695   4.7051 -25.2897   14.097 -25.2897   14.097 -25.2897   14.097   6.4695   4.7051   6.4695   4.7051 0.000000 0.000000 
1 1 1   27    0  -17 o   12.704   7.6949   12.272   14.714   12.272   14.714   12.272   14.714   12.704   7.6949   12.704   7.6949 0.000000 0.000000 
1 1 1   27    0  -16 o   14.106   8.0792   16.433   14.705   16.433   14.705   16.433   14.705   14.106   8.0792   14.106   8.0792 0.000000 0.000000 
1 1 1   27    0  -15 f   11.945   7.4474   9.6147   14.740   9.6147   14.740   9.6147   14.740   11.945   7.4474   11.945   7.4474 0.000000 0.000000 
1 1 1   27    0  -14 o   7.1586   5.1435 -18.7952   14.487 -18.7952   14.487 -18.7952   14.487   7.1586   5.1435   7.1586   5.1435 0.000000 0.000000 
1 1 1   27    0  -13 o   11.650   7.3211   8.5804   14.542   8.5804   14.542   8.5804   14.542   11.650   7.3211   11.650   7.3211 0.000000 0.000000 
1 1 1   27    0  -12 o   40.743   5.1648   78.414   16.403   78.414   16.403   78.414   16.403   40.743   5.1648   40.743   5.1648 0.000000 0.000000 
1 1 1   27    0  -11 o   6.9772   5.0270 -20.0357   14.272 -20.0357   14.272 -20.0357   14.272   6.9772   5.0270   6.9772   5.0270 0.000000 0.000000 
1 1 1   27    0  -10 o   9.3386   6.3323  -1.8633   14.404  -1.8633   14.404  -1.8633   14.404   9.3386   6.3323   9.3386   6.3323 0.000000 0.000000 
1 1 1   27    0   -9 o   11.373   7.2147   7.4838   14.498   7.4838   14.498   7.4838   14.498   11.373   7.2147   11.373   7.2147 0.000000 0.000000 
1 1 1   27    0   -8 o   12.047   7.4405   9.9830   14.371   9.9830   14.371   9.9830   14.371   12.047   7.4405   12.047   7.4405 0.000000 0.000000 
1 1 1   27    0   -7 o   24.761   8.5033   39.068   15.431   39.068   15.431   39.068   15.431   24.761   8.5033   24.761   8.5033 0.000000 0.000000 
1 1 1   27    0   -6 o   25.142   10.162   47.259   20.337   47.259   20.337   47.259   20.337   25.142   10.162   25.142   10.162 0.000000 0.000000 
1 1 1   27    0   -5 o   16.227   9.2470   23.892   19.126   23.892   19.126   23.892   19.126   16.227   9.2470   16.227   9.2470 0.000000 0.000000 
1 1 1   27    0   -4 o   8.7931   6.2225 -14.0954   18.331 -14.0954   18.331 -14.0954   18.331   8.7931   6.2225   8.7931   6.2225 0.000000 0.000000 
1 1 1   27    0   -3 o   11.058   7.4118   2.3122   18.670   2.3122   18.670   2.3122   18.670   11.058   7.4118   11.058   7.4118 0.000000 0.000000 
1 1 1   27    0   -2 f   17.075   8.6324   23.560   14.912   23.560   14.912   23.560   14.912   17.075   8.6324   17.075   8.6324 0.000000 0.000000 
1 1 1   27    0   -1 o   11.358   7.4041   5.8178   16.668   5.8178   16.668   5.8178   16.668   11.358   7.4041   11.358   7.4041 0.000000 0.000000 
1 1 1   27    0    0 o   9.4969   6.4171  -1.2677   14.537  -1.2677   14.537  -1.2677   14.537   9.4969   6.4171   9.4969   6.4171 0.000000 0.000000 
1 1 1   27    0    1 o   12.738   7.6760   12.179   14.488   12.179   14.488   12.179   14.488   12.738   7.6760   12.738   7.6760 0.000000 0.000000 
1 1 1   27    0    2 f   22.584   8.7669   34.908   15.355   34.908   15.355   34.908   15.355   22.584   8.7669   22.584   8.7669 0.000000 0.000000 
1 1 1   27    0    3 o   32.854   6.5616   55.603   15.596   55.603   15.596   55.603   15.596   32.854   6.5616   32.854   6.5616 0.000000 0.000000 
1 1 1   27    0    4 o   11.266   7.1966   6.8602   14.727   6.8602   14.727   6.8602   14.727   11.266   7.1966   11.266   7.1966 0.000000 0.000000 
1 1 1   27    0    5 o   9.0458   6.1985  -3.9808   14.593  -3.9808   14.593  -3.9808   14.593   9.0458   6.1985   9.0458   6.1985 0.000000 0.000000 
1 1 1   27    0    6 o   9.4106   6.3831  -1.9090   14.659  -1.9090   14.659  -1.9090   14.659   9.4106   6.3831   9.4106   6.3831 0.000000 0.000000 
1 1 1   27    0    7 o   8.9868   6.1849  -4.8928   14.898  -4.8928   14.898  -4.8928   14.898   8.9868   6.1849   8.9868   6.1849 0.000000 0.000000 
1 1 1   27    0    8 o   20.624   8.9489   31.500   15.547   31.500   15.547   31.500   15.547   20.624   8.9489   20.624   8.9489 0.000000 0.000000 
1 1 1   27    0    9 o   12.605   7.7115   11.698   15.101   11.698   15.101   11.698   15.101   12.605   7.7115   12.605   7.7115 0.000000 0.000000 
1 1 1   27    0   10 o   12.643   7.7039   11.882   14.937   11.882   14.937   11.882   14.937   12.643   7.7039   12.643   7.7039 0.000000 0.000000 
1 1 1   27    0   11 o   9.3045   6.3283  -2.3681   14.610  -2.3681   14.610  -2.3681   14.610   9.3045   6.3283   9.3045   6.3283 0.000000 0.000000 
1 1 1   27    0   12 o   9.7400   6.5524  -0.2428   14.840  -0.2428   14.840  -0.2428   14.840   9.7400   6.5524   9.7400   6.5524 0.000000 0.000000 
1 1 1   27    0   13 o   12.394   7.8471   10.361   17.059   10.361   17.059   10.361   17.059   12.394   7.8471   12.394   7.8471 0.000000 0.000000 
1 1 1   27    0   14 o   10.880   7.2096   3.5140   16.823   3.5140   16.823   3.5140   16.823   10.880   7.2096   10.880   7.2096 0.000000 0.000000 
1 1 1   27    0   15 f   15.466   8.8223   21.118   17.435   21.118   17.435   21.118   17.435   15.466   8.8223   15.466   8.8223 0.000000 0.000000 
1 1 1   27    0   16 o   13.597   8.9246   13.289   24.830   13.289   24.830   13.289   24.830   13.597   8.9246   13.597   8.9246 0.000000 0.000000 
1 1 1   27    0   17 o   11.280   7.4200   5.2185   17.309   5.2185   17.309   5.2185   17.309   11.280   7.4200   11.280   7.4200 0.000000 0.000000 
1 1 1   27    0   18 o   21.863   11.237   47.148   25.516   47.148   25.516   47.148   25.516   21.863   11.237   21.863   11.237 0.000000 0.000000 
1 1 1   27    0   19 o   25.088   11.524   56.466   25.786   56.466   25.786   56.466   25.786   25.088   11.524   25.088   11.524 0.000000 0.000000 
1 1 1   27    0   20 o   9.1470   6.5703 -24.0134   23.567 -24.0134   23.567 -24.0134   23.567   9.1470   6.5703   9.1470   6.5703 0.000000 0.000000 
1 1 1   27    0   21 o   12.154   8.2269   4.4983   24.095   4.4983   24.095   4.4983   24.095   12.154   8.2269   12.154   8.2269 0.000000 0.000000 
1 1 1   27    0   22 o   35.605   10.811   85.850   27.382   85.850   27.382   85.850   27.382   35.605   10.811   35.605   10.811 0.000000 0.000000 
1 1 1   27    0   23 o   10.907   7.2873   2.9181   17.793   2.9181   17.793   2.9181   17.793   10.907   7.2873   10.907   7.2873 0.000000 0.000000 
1 1 1   27    0   24 o   8.6899   6.1401 -12.7313   17.625 -12.7313   17.625 -12.7313   17.625   8.6899   6.1401   8.6899   6.1401 0.000000 0.000000 
1 1 1   27    0   25 o   16.850   9.2432   25.852   18.238   25.852   18.238   25.852   18.238   16.850   9.2432   16.850   9.2432 0.000000 0.000000 
1 1 1   27    0   26 o   8.5058   6.0363 -14.5270   17.676 -14.5270   17.676 -14.5270   17.676   8.5058   6.0363   8.5058   6.0363 0.000000 0.000000 
1 1 1   27    0   27 f   7.2787   5.2862 -28.1334   17.445 -28.1334   17.445 -28.1334   17.445   7.2787   5.2862   7.2787   5.2862 0.000000 0.000000 
1 1 1   27    0   28 o   9.0303   6.3284  -9.4001   17.563  -9.4001   17.563  -9.4001   17.563   9.0303   6.3284   9.0303   6.3284 0.000000 0.000000 
1 1 1   27    0   29 o   10.768   7.5381  -7.2771   24.727  -7.2771   24.727  -7.2771   24.727   10.768   7.5381   10.768   7.5381 0.000000 0.000000 
1 1 1   27    0   30 o   11.045   7.6701  -3.7649   24.233  -3.7649   24.233  -3.7649   24.233   11.045   7.6701   11.045   7.6701 0.000000 0.000000 
1 1 1   27    0   31 o   14.755   9.4763   21.002   25.967   21.002   25.967   21.002   25.967   14.755   9.4763   14.755   9.4763 0.000000 0.000000 
1 1 1   27    0   32 o   14.222   9.2373   18.121   25.608   18.121   25.608   18.121   25.608   14.222   9.2373   14.222   9.2373 0.000000 0.000000 
1 1 1   27    0   33 o   11.506   7.9310  -0.1109   24.727  -0.1109   24.727  -0.1109   24.727   11.506   7.9310   11.506   7.9310 0.000000 0.000000 
1 1 1   27    0   34 o   7.6509   5.6154 -46.8490   23.282 -46.8490   23.282 -46.8490   23.282   7.6509   5.6154   7.6509   5.6154 0.000000 0.000000 
1 1 1   27    0   35 o   14.322   9.2205   19.008   24.777   19.008   24.777   19.008   24.777   14.322   9.2205   14.322   9.2205 0.000000 0.000000 
1 1 1   27    0   36 o   15.717   9.7718   26.235   25.194   26.235   25.194   26.235   25.194   15.717   9.7718   15.717   9.7718 0.000000 0.000000 
1 1 1   27    0   37 o   11.914   8.0933   4.6140   23.750   4.6140   23.750   4.6140   23.750   11.914   8.0933   11.914   8.0933 0.000000 0.000000 
1 1 1   27    0   38 o   15.518   9.7134   25.670   25.327   25.670   25.327   25.670   25.327   15.518   9.7134   15.518   9.7134 0.000000 0.000000 
1 1 1   27    0   39 o   10.930   7.6017  -3.5035   24.030  -3.5035   24.030  -3.5035   24.030   10.930   7.6017   10.930   7.6017 0.000000 0.000000 
1 1 1   27    0   40 o   15.760   9.7971   27.104   25.314   27.104   25.314   27.104   25.314   15.760   9.7971   15.760   9.7971 0.000000 0.000000 
1 1 1   27    0   41 o   11.699   8.0104   3.0482   24.267   3.0482   24.267   3.0482   24.267   11.699   8.0104   11.699   8.0104 0.000000 0.000000 
1 1 1   27    0   42 o   15.275   9.6453   25.117   25.575   25.117   25.575   25.117   25.575   15.275   9.6453   15.275   9.6453 0.000000 0.000000 
1 1 1   27    0   43 o   16.686   10.069   31.254   25.000   31.254   25.000   31.254   25.000   16.686   10.069   16.686   10.069 0.000000 0.000000 
1 1 1   27    0   44 o   12.205   8.2653   6.8288   24.385   6.8288   24.385   6.8288   24.385   12.205   8.2653   12.205   8.2653 0.000000 0.000000 
1 1 1   27    0   45 o   11.453   7.8771   1.3050   24.075   1.3050   24.075   1.3050   24.075   11.453   7.8771   11.453   7.8771 0.000000 0.000000 
1 1 1   27    0   46 o   21.231   11.188   48.024   25.744   48.024   25.744   48.024   25.744   21.231   11.188   21.231   11.188 0.000000 0.000000 
1 1 1   27    1  -39 o   15.050   6.5831   11.744   15.345   43.070   22.033 -17.7621   21.384   21.811   8.5355   12.122   5.9831 9.689613 10.42366 
1 1 1   27    1  -38 o   10.338   5.0591 -14.4650   14.266 -27.6749   19.788  -0.1703   20.585   10.896   5.4408   13.748   6.5644 -2.852113 8.526069 
1 1 1   27    1  -37 o   15.969   6.6919   15.653   14.653   30.821   20.432  -0.4121   21.027   19.131   7.9504   13.771   6.5912 5.359968 10.32731 
1 1 1   27    1  -36 o   14.408   6.4022   9.2262   15.062  -0.5597   20.837   19.935   21.797   13.722   6.5662   16.772   7.5580 -3.049568 10.01187 
1 1 1   27    1  -35 o   13.121   5.7674   6.0254   11.907   26.243   16.650 -15.1422   17.036   18.763   7.3965   11.183   5.4840 7.580612 9.207754 
1 1 1   27    1  -34 o   9.4576   4.6114 -12.5210   11.542   2.2233   16.282 -27.4152   16.365   13.270   6.1801   9.8310   4.9148 3.439401 7.896175 
1 1 1   27    1  -33 o   16.251   6.2641   16.062   11.729   19.104   16.264   12.764   16.932   16.814   7.0483   15.330   6.8012 1.484340 9.794625 
1 1 1   27    1  -32 o   12.510   5.6160   3.5629   11.906   8.0831   16.734  -1.0714   16.944   14.388   6.5391   12.902   6.1008 1.486670 8.943119 
1 1 1   27    1  -31 o   11.919   5.4466   1.0215   11.813   3.1772   16.679  -1.1482   16.733   13.531   6.2857   12.861   6.0759 0.6701918 8.742230 
1 1 1   27    1  -30 o   13.054   5.7530   5.6230   11.922   15.421   16.738  -4.4644   16.984   15.970   6.9318   12.469   5.9560 3.500712 9.139161 
1 1 1   27    1  -29 o   13.760   6.0678   7.3096   13.281   3.8862   16.913   12.815   21.449   13.731   6.3618   15.699   7.2347 -1.968389 9.633965 
1 1 1   27    1  -28 o   12.051   5.5931  -0.5643   13.160   2.7736   16.635  -6.1479   21.514   13.506   6.2752   13.291   6.4377 0.2147379 8.990144 
1 1 1   27    1  -27 o   16.799   6.6675   17.862   13.614   11.471   17.260   28.385   22.147   15.208   6.7993   18.494   8.0006 -3.285547 10.49955 
1 1 1   27    1  -26 o   13.599   6.0853   5.9692   13.858   27.832   22.366  -7.6530   17.655   18.396   7.9987   12.283   5.9206 6.112705 9.951542 
1 1 1   27    1  -25 o   9.7982   4.8155 -16.5061   13.360  -5.2406   21.374 -23.7300   17.116   13.417   6.4788   10.461   5.1968 2.956196 8.305525 
1 1 1   27    1  -24 o   15.053   6.4200   11.747   13.883  -5.5005   22.453   22.423   17.665   13.609   6.5881   17.781   7.3913 -4.171582 9.901191 
1 1 1   27    1  -23 o   11.211   5.2689  -3.7885   12.290  -5.8086   17.392  -1.7736   17.370   12.486   5.9812   13.035   6.1677 -0.5488071 8.591575 
1 1 1   27    1  -22 o   10.681   5.1089  -7.6746   12.589  -2.5649   17.283 -13.4486   18.372   12.909   6.1212   11.861   5.7907 1.048570 8.426264 
1 1 1   27    1  -21 o   9.8974   4.8178 -12.7650   12.453 -27.1715   17.324   2.6358   17.912   10.264   5.1196   13.830   6.4543 -3.565897 8.238256 
1 1 1   27    1  -20 o   14.254   6.1156   9.1392   12.734   12.123   17.780   5.9969   18.247   15.499   6.9171   14.438   6.6603 1.061283 9.602395 
1 1 1   27    1  -19 o   16.398   6.5348   16.152   13.129   29.700   18.333   1.8897   18.811   19.715   7.7646   13.901   6.5285 5.813403 10.14447 
1 1 1   27    1  -18 o   10.861   5.1747  -6.8110   12.652  -4.1541   17.632  -9.6316   18.167   12.805   6.1031   12.255   5.9311 0.5495005 8.510314 
1 1 1   27    1  -17 o   13.903   6.0696   7.5642   12.990   3.7799   17.894   11.780   18.886   14.044   6.5195   15.557   7.0206 -1.512444 9.580839 
1 1 1   27    1  -16 o   11.372   5.2488  -1.3281   11.353 -24.4070   17.333   16.010   15.024   10.522   5.2274   16.337   6.8058 -5.815650 8.581656 
1 1 1   27    1  -15 o   10.521   4.9843  -5.9008   11.412   10.177   18.245 -16.2348   14.627   15.225   6.8829   10.374   5.0863 4.851161 8.558302 
1 1 1   27    1  -14 o   14.717   6.0599   10.942   11.721   20.756   19.109   5.0227   14.841   17.425   7.4839   13.712   6.2023 3.713435 9.719966 
1 1 1   27    1  -13 o   25.446   5.5207   34.988   11.121   30.331   15.958   39.386   15.507   20.747   7.4350   24.453   7.2566 -3.705433 10.38931 
1 1 1   27    1  -12 o   14.995   6.1605   11.658   12.078   12.913   19.493   10.876   15.388   15.877   7.1516   15.100   6.5989 0.7766933 9.730907 
1 1 1   27    1  -11 o   12.131   5.5109   1.1877   11.870  -0.5912   19.201   2.2883   15.103   13.703   6.4840   13.261   6.0964 0.4417791 8.899852 
1 1 1   27    1  -10 o   16.834   6.7669   17.379   14.205   15.079   20.292   19.588   19.891   16.340   7.3338   17.208   7.5117 -0.8678551 10.49811 
1 1 1   27    1   -9 o   17.512   6.4491   18.667   12.119   19.468   15.512   17.412   19.414   17.381   7.0414   16.774   7.3688 0.6076965 10.19220 
1 1 1   27    1   -8 o   16.411   6.3286   15.711   11.976   31.346   15.280  -9.1871   19.282   21.457   7.3030   12.663   6.1240 8.794315 9.530912 
1 1 1   27    1   -7 o   15.112   6.1672   11.948   12.003   7.1405   15.187   19.950   19.593   14.269   6.3787   17.315   7.5077 -3.045883 9.851620 
1 1 1   27    1   -6 o   15.633   5.9967   13.504   10.713   20.298   15.114   6.6434   15.187   17.686   7.0233   14.167   6.3526 3.519079 9.470034 
1 1 1   27    1   -5 o   15.580   5.9955   13.362   10.732   24.865   15.042   1.4349   15.317   19.197   7.1635   13.181   6.0883 6.016408 9.401223 
1 1 1   27    1   -4 o   9.8673   4.7771 -11.3033   11.812   6.4822   19.110 -22.3005   15.027   14.779   6.8170   9.9265   4.9205 4.852046 8.407278 
1 1 1   27    1   -3 o   12.367   5.4470   3.6203   10.673   1.6681   14.862   5.6988   15.336   13.114   6.0357   14.006   6.3231 -0.8923149 8.741314 
1 1 1   27    1   -2 o   14.198   6.0025   8.9901   11.956   9.6296   14.998   7.8753   19.802   14.809   6.4922   15.102   6.9564 -0.2923317 9.515252 
1 1 1   27    1   -1 o   9.1144   4.4319 -12.0166   10.461 -11.1565   14.897 -12.8535   14.693   11.126   5.3814   10.838   5.2658 0.2886505 7.529149 
1 1 1   27    1    0 o   11.705   5.2879   0.9345   10.749   5.0562   15.046  -3.3610   15.360   13.820   6.2488   12.391   5.8439 1.429126 8.555593 
1 1 1   27    1    1 o   15.092   6.1038   11.924   11.635   15.990   15.170   6.1142   18.131   16.439   6.8427   14.575   6.6927 1.864238 9.571558 
1 1 1   27    1    2 o   14.946   5.9699   11.630   10.983   14.029   15.330   9.1006   15.742   15.919   6.7663   14.791   6.5604 1.128164 9.424541 
1 1 1   27    1    3 o   15.969   6.2294   14.427   11.705   15.002   17.884   13.996   15.482   16.259   7.1095   15.916   6.7836 0.3428574 9.826554 
1 1 1   27    1    4 o   7.8376   3.9143 -21.4992   10.264 -24.3509   14.404 -18.5573   14.629   9.4858   4.7214   10.153   4.9994 -0.6670589 6.876463 
1 1 1   27    1    5 o   17.389   6.1427   17.771   10.856   20.831   15.068   14.468   15.654   17.862   7.0380   16.038   6.8279 1.823469 9.805779 
1 1 1   27    1    6 o   10.816   5.0346  -3.0930   10.785  -7.8889   15.169   1.8087   15.336   11.653   5.5831   13.251   6.1103 -1.597714 8.276900 
1 1 1   27    1    7 o   19.749   6.3972   23.701   11.759   22.752   15.418   25.021   18.182   18.408   7.1583   18.637   7.5960 -0.2285862 10.43745 
1 1 1   27    1    8 o   11.051   5.1562  -3.2111   11.418   4.8420   15.056 -14.1133   17.518   13.762   6.2338   11.625   5.6709 2.137210 8.427331 
1 1 1   27    1    9 o   11.277   5.3188  -4.7357   12.727  -6.1669   17.971  -3.2959   18.025   12.692   6.0797   13.086   6.2184 -0.3946114 8.696671 
1 1 1   27    1   10 o   13.505   5.9388   6.0537   12.639   17.077   17.670  -5.4939   18.085   16.680   7.1808   12.803   6.1238 3.877661 9.437421 
1 1 1   27    1   11 o   8.7797   4.3654 -21.5876   12.184 -31.0220   17.153 -11.9806   17.309   9.9444   4.9804   11.789   5.7251 -1.844338 7.588190 
1 1 1   27    1   12 o   13.942   6.0354   7.8060   12.621   17.357   17.952  -1.5277   17.747   16.721   7.2183   13.250   6.2589 3.470721 9.553934 
1 1 1   27    1   13 o   12.750   5.9021   0.4296   14.509  -4.2883   18.132   8.8282   24.192   12.949   6.1768   15.630   7.3601 -2.680981 9.608593 
1 1 1   27    1   14 o   11.485   5.3826  -3.3174   12.676 -11.4959   17.915   4.8823   17.938   12.000   5.8268   14.264   6.5886 -2.264187 8.795501 
1 1 1   27    1   15 o   15.277   6.3566   12.441   13.084  -3.4520   18.364   28.825   18.646   13.098   6.2388   19.467   7.7777 -6.369828 9.970735 
1 1 1   27    1   16 o   14.881   6.5039   10.335   14.953   42.603   25.112  -7.3907   18.613   21.161   8.8058   12.649   6.0924 8.511680 10.70791 
1 1 1   27    1   17 o   14.486   6.1681   9.8647   12.779   31.845   18.037 -12.2863   18.107   20.465   7.7982   11.944   5.8131 8.520945 9.726514 
1 1 1   27    1   18 o   11.364   5.3313  -3.4891   12.488  -5.9791   17.710  -1.0266   17.612   12.583   6.0297   13.240   6.2483 -0.6567783 8.683279 
1 1 1   27    1   19 o   15.136   6.3179   12.112   12.985   10.518   17.879   13.892   18.889   15.206   6.8494   15.930   7.1182 -0.7238789 9.878435 
1 1 1   27    1   20 o   19.397   6.7687   24.390   13.154   28.929   18.846   20.078   18.369   19.365   7.7910   17.217   7.3649 2.147535 10.72107 
1 1 1   27    1   21 o   21.401   6.7536   29.236   13.171   26.193   18.392   32.440   18.871   18.708   7.6343   20.317   7.9141 -1.608912 10.99620 
1 1 1   27    1   22 o   12.209   5.6124   0.4904   12.798 -28.2200   17.951   30.170   18.252   10.381   5.1835   19.818   7.7648 -9.436697 9.335944 
1 1 1   27    1   23 o   13.234   6.2487  -0.8432   17.655 -37.9363   24.120   41.967   25.912   11.429   5.7489   20.654   8.7884 -9.224469 10.50171 
1 1 1   27    1   24 o   13.313   6.5199 -11.1708   23.827 -11.1708   23.827   0.0000   0.0000   13.313   6.5199  ?   ?  0.000000 6.519904 
1 1 1   27    1   25 o   18.663   8.2978   30.932   25.338   30.932   25.338   0.0000   0.0000   18.663   8.2978  ?   ?  0.000000 8.297777 
1 1 1   27    1   26 o   11.380   5.7216 -36.7420   23.755 -36.7420   23.755   0.0000   0.0000   11.380   5.7216  ?   ?  0.000000 5.721630 
1 1 1   27    1   27 o   12.703   6.0788  -4.6141   17.861   18.067   24.892 -28.6828   25.642   16.631   7.7097   12.290   6.1454 4.341314 9.859273 
1 1 1   27    1   28 o   14.779   6.7385   8.9402   17.951   2.7038   25.163   15.403   25.616   14.774   7.1077   16.269   7.6335 -1.494881 10.43022 
1 1 1   27    1   29 o   11.794   5.9040 -30.3769   23.970   0.0000   0.0000 -30.3769   23.970  ?   ?    11.794   5.9040 0.000000 5.903989 
1 1 1   27    1   30 o   13.806   6.7503  -7.0256   25.232   0.0000   0.0000  -7.0256   25.232  ?   ?    13.806   6.7503 0.000000 6.750296 
1 1 1   27    1   31 o   12.420   6.1816 -22.9923   24.689   0.0000   0.0000 -22.9923   24.689  ?   ?    12.420   6.1816 0.000000 6.181609 
1 1 1   27    1   32 o   13.864   6.7546  -4.8277   24.624   0.0000   0.0000  -4.8277   24.624  ?   ?    13.864   6.7546 0.000000 6.754625 
1 1 1   27    1   33 o   13.555   6.6325  -7.9072   24.493   0.0000   0.0000  -7.9072   24.493  ?   ?    13.555   6.6325 0.000000 6.632492 
1 1 1   27    1   34 o   16.612   7.1649   18.560   17.656   21.217   24.634   15.754   25.317   16.912   7.7788   16.172   7.5882 0.7395096 10.86693 
1 1 1   27    1   35 o   9.5467   4.8048 -34.0345   16.981 -35.0766   23.889 -32.9704   24.141   11.435   5.7477   11.622   5.8330 -0.1870680 8.188996 
1 1 1   27    1   36 o   12.836   6.0949  -1.9992   17.249  -3.8180   23.829   0.0030   25.002   13.842   6.7209   14.380   6.9590 -0.5381241 9.674576 
1 1 1   27    1   37 o   15.169   6.8186   11.705   17.615   11.539   24.346   11.888   25.517   15.602   7.3582   15.711   7.4463 -0.1087255 10.46852 
1 1 1   27    1   38 o   16.827   7.2447   19.423   17.990   22.172   25.364   16.640   25.520   17.072   7.8674   16.326   7.6471 0.7458744 10.97148 
1 1 1   27    2  -28 o   16.334   6.8874   17.216   15.674   17.700   21.765   16.693   22.591   16.362   7.4446   16.212   7.4541 0.1507339 10.53498 
1 1 1   27    2  -27 f   11.455   5.5101  -7.6376   15.109   19.554   21.049 -36.5373   21.700   16.662   7.4746   10.780   5.4265 5.882109 9.236710 
1 1 1   27    2  -26 o   14.234   6.4427   8.0327   16.045  -4.7560   21.478   24.183   24.136   13.305   6.4415   17.290   7.8561 -3.985197 10.15926 
1 1 1   27    2  -25 o   12.007   5.7259  -4.5244   15.560 -15.8599   21.493   7.9602   22.556   12.231   6.0299   14.934   7.0550 -2.703131 9.280811 
1 1 1   27    2  -24 o   26.209   6.1307   40.298   12.863   37.258   18.089   43.408   18.295   21.583   7.8906   23.544   7.9916 -1.960768 11.23065 
1 1 1   27    2  -23 o   9.5922   4.6811 -12.7732   11.968  -5.0236   16.648 -21.0607   17.216   12.229   5.8564   10.630   5.2689 1.598594 7.877718 
1 1 1   27    2  -22 o   13.834   5.9812   8.5738   12.364   7.4220   17.209   9.8027   17.775   14.268   6.5400   14.760   6.7202 -0.4920864 9.377251 
1 1 1   27    2  -21 o   13.010   5.8045   5.2340   12.510   16.578   17.418  -6.8508   17.978   16.093   7.0269   12.328   5.9500 3.764873 9.207630 
1 1 1   27    2  -20 o   12.909   5.9892   1.9327   15.070 -19.2235   28.119   10.458   17.850   13.204   6.5762   14.880   6.7590 -1.675476 9.430328 
1 1 1   27    2  -19 o   11.032   5.3450 -10.1143   14.856 -11.8804   27.486  -9.3854   17.657   13.620   6.7338   11.945   5.7967 1.674367 8.885131 
1 1 1   27    2  -18 o   14.557   6.4422   10.177   15.097   22.988   27.497   4.6488   18.063   16.971   7.9453   13.920   6.4917 3.050282 10.26011 
1 1 1   27    2  -17 o   12.919   5.9938   1.9145   15.092   17.804   28.673  -4.1747   17.750   16.391   7.8042   12.614   6.0423 3.777492 9.869967 
1 1 1   27    2  -16 o   12.919   5.7979   4.6164   12.680   3.6499   17.664   5.6440   18.214   13.724   6.4065   14.125   6.5642 -0.4017258 9.172318 
1 1 1   27    2  -15 o   12.706   5.7381   3.6788   12.643   2.9923   17.351   4.4560   18.460   13.576   6.3415   13.989   6.5364 -0.4122295 9.107110 
1 1 1   27    2  -14 o   11.113   5.3679  -9.2927   14.699 -29.6005   17.038   49.825   29.070   9.8823   4.9514   20.789   9.0777 -10.90648 10.34026 
1 1 1   27    2  -13 o   15.100   6.5444   12.317   14.874   18.326   17.479  -3.4543   28.319   16.557   7.1348   14.448   7.0824 2.108426 10.05314 
1 1 1   27    2  -12 o   11.986   5.6678  -3.1692   14.626 -10.1826   17.171   15.376   27.921   11.766   5.7114   16.202   7.7106 -4.435908 9.595464 
1 1 1   27    2  -11 o   11.807   5.4749  -0.6340   12.567   1.0106   17.502  -2.3843   18.056   13.332   6.2724   12.966   6.1791 0.3656521 8.804776 
1 1 1   27    2  -10 o   11.586   5.3019   0.3857   11.247   5.6499   17.509  -3.3123   14.675   14.076   6.5043   11.986   5.6706 2.090090 8.629091 
1 1 1   27    2   -9 o   11.922   5.4116   1.6110   11.418 -16.4389   17.558   14.839   15.031   11.216   5.5140   15.770   6.7013 -4.553510 8.678217 
1 1 1   27    2   -8 o   9.2517   4.5193 -13.0490   11.232   7.5562   17.188 -28.4081   14.840   14.372   6.5684   9.2001   4.6112 5.171844 8.025351 
1 1 1   27    2   -7 o   13.476   5.8163   7.4643   11.650   31.823   18.420  -8.7747   15.040   19.961   7.8065   11.319   5.4579 8.642635 9.525200 
1 1 1   27    2   -6 o   14.092   5.9519   9.5303   11.736   20.367   18.415   2.1185   15.230   17.031   7.3312   13.052   6.0437 3.978650 9.501139 
1 1 1   27    2   -5 o   12.016   5.4429   1.9007   11.477  -9.2333   17.851   9.7450   14.984   12.084   5.8557   14.546   6.4285 -2.461919 8.695711 
1 1 1   27    2   -4 o   13.275   5.6394   7.4011   10.640   12.875   14.867   1.6550   15.232   15.284   6.5833   12.976   6.0206 2.308554 8.921209 
1 1 1   27    2   -3 o   15.871   6.0602   14.755   10.908   25.367   15.546   4.4640   15.309   18.819   7.2226   13.507   6.1828 5.312387 9.507560 
1 1 1   27    2   -2 o   12.594   5.5092   4.9884   10.749   15.014   15.208  -5.0182   15.194   15.843   6.7369   11.898   5.6694 3.945578 8.804996 
1 1 1   27    2   -1 o   11.880   5.3238   2.4052   10.649   7.8179   14.767  -3.4581   15.370   14.097   6.2969   12.181   5.7748 1.916480 8.543954 
1 1 1   27    2    0 o   9.8958   4.7060  -6.3170   10.363 -15.7763   14.426   3.7695   14.897   10.257   5.0335   13.294   6.0905 -3.037222 7.901247 
1 1 1   27    2    1 o   13.923   5.9258   8.9033   11.786   3.8288   15.296   16.320   18.492   13.388   6.1475   16.177   7.1459 -2.789488 9.426320 
1 1 1   27    2    2 o   18.179   6.7078   21.755   13.121   30.496   15.251  -3.1385   25.739   20.705   7.2836   14.221   6.9232 6.484241 10.04895 
1 1 1   27    2    3 o   15.328   6.1482   13.359   11.698   21.571   15.441   2.2946   17.924   17.654   7.0695   13.636   6.3938 4.018527 9.531995 
1 1 1   27    2    4 o   13.568   5.8239   7.8180   11.560   16.294   15.319  -3.3909   17.616   16.172   6.8135   12.758   6.0862 3.414471 9.135940 
1 1 1   27    2    5 o   11.330   5.3060  -2.7145   12.276 -29.4929   16.589   29.706   18.253   9.7590   4.8890   19.419   7.7161 -9.660167 9.134621 
1 1 1   27    2    6 o   20.349   6.7087   27.004   12.905   27.650   18.151   26.344   18.352   18.871   7.6270   18.485   7.5940 0.3859577 10.76289 
1 1 1   27    2    7 o   13.976   6.0199   8.8046   12.432   19.674   17.466  -2.3589   17.701   16.922   7.2084   12.909   6.1422 4.012727 9.470352 
1 1 1   27    2    8 o   11.178   5.2598  -3.5986   12.316 -15.1991   17.083   8.9558   17.772   11.203   5.4934   14.696   6.7021 -3.493162 8.665782 
1 1 1   27    2    9 o   19.981   7.1666   28.165   14.830   21.015   18.200   42.291   25.582   17.175   7.3385   20.419   8.7118 -3.243788 11.39075 
1 1 1   27    2   10 o   12.709   5.7436   3.5094   12.693  -2.6601   17.586   10.219   18.339   12.830   6.1096   14.969   6.8194 -2.138444 9.155936 
1 1 1   27    2   11 o   15.715   6.3734   14.655   12.725   12.226   17.887   17.145   18.106   15.296   6.8737   16.300   7.1399 -1.004339 9.910885 
1 1 1   27    2   12 o   9.1373   4.5198 -18.4544   12.437  -9.7680   17.250 -27.8588   17.949   11.837   5.7406   10.321   5.1580 1.515377 7.717522 
1 1 1   27    2   13 o   11.815   5.4582  -0.1455   12.317  -5.3282   16.881   5.7535   18.010   12.286   5.8871   14.148   6.5582 -1.862061 8.812961 
1 1 1   27    2   14 o   17.053   6.5720   18.742   12.909   41.493   17.941  -5.6776   18.588   23.178   7.9131   12.646   6.0903 10.53200 9.985441 
1 1 1   27    2   15 o   19.472   7.1269   26.893   14.763   51.272   24.530   13.047   18.486   22.634   8.9605   15.445   6.9603 7.188452 11.34621 
1 1 1   27    2   16 o   11.719   5.4415  -0.7952   12.477   5.8473   17.384  -7.8523   17.919   14.037   6.4846   12.209   5.9044 1.828056 8.769922 
1 1 1   27    2   17 o   12.238   5.7539  -1.4874   14.686  -6.2694   25.154   0.9856   18.089   13.751   6.7268   13.388   6.3226 0.3626013 9.231761 
1 1 1   27    2   18 o   16.853   6.8699   19.094   14.874   20.347   25.650   18.459   18.256   16.665   7.7597   16.480   7.1950 0.1856880 10.58211 
1 1 1   27    2   19 o   15.595   6.9733   14.151   18.160 -23.8666   24.978   56.785   26.451   12.340   6.1542   22.948   9.2309 -10.60779 11.09433 
1 1 1   27    2   20 o   22.251   8.0840   40.659   18.944   67.697   27.648   16.730   26.010   24.883   9.6105   16.210   7.6327 8.672518 12.27270 
1 1 1   27    2   21 o   14.776   6.7524   9.7019   18.160 -12.1098   24.887   34.542   26.558   13.205   6.5057   18.672   8.3844 -5.467005 10.61236 
1 1 1   27    2   22 o   17.755   7.4542   23.952   18.234   25.691   26.217   22.322   25.378   17.390   8.0082   16.953   7.8327 0.4371109 11.20186 
1 1 1   27    2   23 o   11.705   5.6899 -10.4776   17.210 -15.0605   24.422  -5.9563   24.257   12.889   6.3679   13.639   6.6579 -0.7503119 9.212872 
1 1 1   27    2   24 o   17.580   7.4067   23.171   18.102   0.5655   25.078   47.764   26.157   14.372   6.9586   21.145   8.9057 -6.773134 11.30189 
1 1 1   27    2   25 o   14.109   6.5527   5.7493   18.113  -3.4978   25.213   15.611   26.037   14.002   6.8244   16.082   7.5919 -2.080298 10.20833 
1 1 1   27    2   26 o   11.503   5.6324 -13.7731   17.760 -12.3159   25.286 -15.1917   24.949   13.264   6.5392   12.979   6.4169 0.2845001 9.161772 
1 1 1   27    2   27 f   15.152   6.8704   11.558   18.342  -7.4071   25.841   30.815   26.039   13.770   6.7531   18.202   8.2263 -4.432439 10.64313 
1 1 1   27    3   -7 o   13.836   6.8101  -8.0655   27.044   0.0000   0.0000  -8.0655   27.044  ?   ?    13.836   6.8101 0.000000 6.810055 
1 1 1   27    3   -6 o   10.228   5.0986 -25.0175   17.063 -51.3856   23.938   2.2150   24.327   10.514   5.3384   14.429   6.9534 -3.914325 8.766353 
1 1 1   27    3   -5 o   17.571   7.3338   22.961   17.495   30.496   23.698   13.935   25.936   18.339   8.0956   15.845   7.5090 2.493810 11.04189 
1 1 1   27    3   -4 o   13.390   6.2727   2.3278   17.181   11.544   23.439  -8.3757   25.259   15.429   7.2587   13.550   6.6518 1.878246 9.845605 
1 1 1   27    3   -3 o   16.324   7.0165   17.684   16.822   38.373   24.185  -1.7059   23.413   19.739   8.4474   13.897   6.7274 5.842002 10.79889 
1 1 1   27    3   -2 o   17.266   7.2860   21.814   17.562   33.687   23.805   7.6378   26.013   18.900   8.2346   15.144   7.2702 3.756797 10.98468 
1 1 1   27    3   -1 o   10.648   5.4005 -49.1161   24.054   0.0000   0.0000 -49.1161   24.054  ?   ?    10.648   5.4005 0.000000 5.400501 
1 1 1   27    3    0 o   18.400   7.4631   26.114   17.450   37.550   23.684   12.533   25.809   19.686   8.3903   15.666   7.4435 4.019759 11.21619 
1 1 1   27    3    1 o   15.982   7.0409   16.236   17.841   23.632   23.945   7.0063   26.749   17.148   7.8046   15.133   7.2923 2.015357 10.68126 
1 1 1   27    3    2 o   16.254   7.0961   17.499   17.756   10.228   23.676   26.845   26.842   15.272   7.2185   17.456   8.0619 -2.184822 10.82131 
1 1 1   27    3    3 o   12.351   5.9216  -4.8590   17.130   0.7048   23.509 -11.1563   25.011   14.161   6.8272   13.278   6.5379 0.8831987 9.452744 
1 1 1   27    3    4 o   12.613   6.0110  -2.8410   17.089  -5.1021   23.249  -0.1839   25.203   13.536   6.5875   14.283   6.9297 -0.7469578 9.561135 
1 1 1   27    3    5 o   13.105   6.4575 -12.3689   24.544 -12.3689   24.544   0.0000   0.0000   13.105   6.4575  ?   ?  0.000000 6.457491 
1 1 1   27    3    6 o   10.574   5.2661 -24.5105   18.028 -14.1979   24.350 -37.0191   26.818   12.926   6.3811   11.893   5.9925 1.033020 8.753716 
1 1 1   27    3    7 o   15.417   6.9893   13.093   18.971   37.876   26.351 -13.5734   27.335   19.212   8.5062   13.460   6.6657 5.752057 10.80680 
1 1 1   28    0  -29 o   20.888   10.732   44.050   23.268   44.050   23.268   44.050   23.268   20.888   10.732   20.888   10.732 0.000000 0.000000 
1 1 1   28    0  -28 o   15.420   9.4189   25.057   22.449   25.057   22.449   25.057   22.449   15.420   9.4189   15.420   9.4189 0.000000 0.000000 
1 1 1   28    0  -27 o   9.5944   6.7913 -11.9055   21.886 -11.9055   21.886 -11.9055   21.886   9.5944   6.7913   9.5944   6.7913 0.000000 0.000000 
1 1 1   28    0  -26 o   18.691   9.5108   31.989   18.167   31.989   18.167   31.989   18.167   18.691   9.5108   18.691   9.5108 0.000000 0.000000 
1 1 1   28    0  -25 o   10.129   6.8904   0.1833   17.334   0.1833   17.334   0.1833   17.334   10.129   6.8904   10.129   6.8904 0.000000 0.000000 
1 1 1   28    0  -24 o   14.861   8.7153   21.021   17.757   21.021   17.757   21.021   17.757   14.861   8.7153   14.861   8.7153 0.000000 0.000000 
1 1 1   28    0  -23 o   11.962   7.7130   9.9679   17.422   9.9679   17.422   9.9679   17.422   11.962   7.7130   11.962   7.7130 0.000000 0.000000 
1 1 1   28    0  -22 o   9.3614   6.5146  -5.8229   17.720  -5.8229   17.720  -5.8229   17.720   9.3614   6.5146   9.3614   6.5146 0.000000 0.000000 
1 1 1   28    0  -21 o   7.3411   5.3091 -23.0930   16.655 -23.0930   16.655 -23.0930   16.655   7.3411   5.3091   7.3411   5.3091 0.000000 0.000000 
1 1 1   28    0  -20 o   7.2459   5.2663 -27.5681   17.496 -27.5681   17.496 -27.5681   17.496   7.2459   5.2663   7.2459   5.2663 0.000000 0.000000 
1 1 1   28    0  -19 o   8.9862   6.3190  -9.4612   17.965  -9.4612   17.965  -9.4612   17.965   8.9862   6.3190   8.9862   6.3190 0.000000 0.000000 
1 1 1   28    0  -18 o   10.316   7.0223   0.4052   18.071   0.4052   18.071   0.4052   18.071   10.316   7.0223   10.316   7.0223 0.000000 0.000000 
1 1 1   28    0  -17 o   9.4920   6.6011  -5.6167   18.115  -5.6167   18.115  -5.6167   18.115   9.4920   6.6011   9.4920   6.6011 0.000000 0.000000 
1 1 1   28    0  -16 o   10.543   7.5143 -14.6039   28.493 -14.6039   28.493 -14.6039   28.493   10.543   7.5143   10.543   7.5143 0.000000 0.000000 
1 1 1   28    0  -15 o   13.647   9.1175   15.847   27.847   15.847   27.847   15.847   27.847   13.647   9.1175   13.647   9.1175 0.000000 0.000000 
1 1 1   28    0  -14 o   10.193   7.2920 -18.0738   27.838 -18.0738   27.838 -18.0738   27.838   10.193   7.2920   10.193   7.2920 0.000000 0.000000 
1 1 1   28    0  -13 o   8.3789   5.9688 -15.2923   17.888 -15.2923   17.888 -15.2923   17.888   8.3789   5.9688   8.3789   5.9688 0.000000 0.000000 
1 1 1   28    0  -12 o   13.480   8.3527   15.985   18.254   15.985   18.254   15.985   18.254   13.480   8.3527   13.480   8.3527 0.000000 0.000000 
1 1 1   28    0  -11 o   11.458   7.5778   6.6171   18.437   6.6171   18.437   6.6171   18.437   11.458   7.5778   11.458   7.5778 0.000000 0.000000 
1 1 1   28    0  -10 o   9.1691   6.4033  -7.3066   17.540  -7.3066   17.540  -7.3066   17.540   9.1691   6.4033   9.1691   6.4033 0.000000 0.000000 
1 1 1   28    0   -9 o   12.639   8.0193   12.505   17.924   12.505   17.924   12.505   17.924   12.639   8.0193   12.639   8.0193 0.000000 0.000000 
1 1 1   28    0   -8 o   6.7176   4.8673 -22.3389   14.335 -22.3389   14.335 -22.3389   14.335   6.7176   4.8673   6.7176   4.8673 0.000000 0.000000 
1 1 1   28    0   -7 o   16.880   8.6717   24.499   15.191   24.499   15.191   24.499   15.191   16.880   8.6717   16.880   8.6717 0.000000 0.000000 
1 1 1   28    0   -6 o   10.891   7.0685   6.2283   14.959   6.2283   14.959   6.2283   14.959   10.891   7.0685   10.891   7.0685 0.000000 0.000000 
1 1 1   28    0   -5 o   10.611   6.9285   5.1802   14.683   5.1802   14.683   5.1802   14.683   10.611   6.9285   10.611   6.9285 0.000000 0.000000 
1 1 1   28    0   -4 o   9.6573   6.5207   0.1187   14.956   0.1187   14.956   0.1187   14.956   9.6573   6.5207   9.6573   6.5207 0.000000 0.000000 
1 1 1   28    0   -3 o   11.926   7.4346   10.449   14.682   10.449   14.682   10.449   14.682   11.926   7.4346   11.926   7.4346 0.000000 0.000000 
1 1 1   28    0   -2 o   9.5595   6.4786  -0.5526   15.035  -0.5526   15.035  -0.5526   15.035   9.5595   6.4786   9.5595   6.4786 0.000000 0.000000 
1 1 1   28    0   -1 o   9.9775   6.9146  -4.3459   19.431  -4.3459   19.431  -4.3459   19.431   9.9775   6.9146   9.9775   6.9146 0.000000 0.000000 
1 1 1   28    0    0 o   9.5712   6.4781  -0.3531   14.936  -0.3531   14.936  -0.3531   14.936   9.5712   6.4781   9.5712   6.4781 0.000000 0.000000 
1 1 1   28    0    1 o   9.0838   6.2547  -3.8702   15.281  -3.8702   15.281  -3.8702   15.281   9.0838   6.2547   9.0838   6.2547 0.000000 0.000000 
1 1 1   28    0    2 o   10.925   7.1088   6.1362   15.265   6.1362   15.265   6.1362   15.265   10.925   7.1088   10.925   7.1088 0.000000 0.000000 
1 1 1   28    0    3 o   6.9948   5.0925 -28.5899   16.762 -28.5899   16.762 -28.5899   16.762   6.9948   5.0925   6.9948   5.0925 0.000000 0.000000 
1 1 1   28    0    4 o   17.736   9.3994   29.270   18.255   29.270   18.255   29.270   18.255   17.736   9.3994   17.736   9.3994 0.000000 0.000000 
1 1 1   28    0    5 o   12.686   8.0445   12.621   18.005   12.621   18.005   12.621   18.005   12.686   8.0445   12.686   8.0445 0.000000 0.000000 
1 1 1   28    0    6 o   6.8615   5.0022 -29.4172   16.503 -29.4172   16.503 -29.4172   16.503   6.8615   5.0022   6.8615   5.0022 0.000000 0.000000 
1 1 1   28    0    7 o   23.961   9.5615   43.020   18.078   43.020   18.078   43.020   18.078   23.961   9.5615   23.961   9.5615 0.000000 0.000000 
1 1 1   28    0    8 o   11.788   7.6291   8.9310   17.258   8.9310   17.258   8.9310   17.258   11.788   7.6291   11.788   7.6291 0.000000 0.000000 
1 1 1   28    0    9 o   8.1114   5.7948 -16.6288   17.332 -16.6288   17.332 -16.6288   17.332   8.1114   5.7948   8.1114   5.7948 0.000000 0.000000 
1 1 1   28    0   10 o   14.290   8.5477   18.829   17.702   18.829   17.702   18.829   17.702   14.290   8.5477   14.290   8.5477 0.000000 0.000000 
1 1 1   28    0   11 o   13.257   8.2382   15.088   17.883   15.088   17.883   15.088   17.883   13.257   8.2382   13.257   8.2382 0.000000 0.000000 
1 1 1   28    0   12 o   12.349   8.3259   8.1626   24.211   8.1626   24.211   8.1626   24.211   12.349   8.3259   12.349   8.3259 0.000000 0.000000 
1 1 1   28    0   13 o   9.3044   6.4875  -6.6672   17.806  -6.6672   17.806  -6.6672   17.806   9.3044   6.4875   9.3044   6.4875 0.000000 0.000000 
1 1 1   28    0   14 o   10.168   6.9404  -0.5051   17.910  -0.5051   17.910  -0.5051   17.910   10.168   6.9404   10.168   6.9404 0.000000 0.000000 
1 1 1   28    0   15 o   8.3716   5.9559 -14.5492   17.600 -14.5492   17.600 -14.5492   17.600   8.3716   5.9559   8.3716   5.9559 0.000000 0.000000 
1 1 1   28    0   16 o   10.119   6.9261  -1.0339   18.103  -1.0339   18.103  -1.0339   18.103   10.119   6.9261   10.119   6.9261 0.000000 0.000000 
1 1 1   28    0   17 o   8.1006   5.7862 -16.3345   17.255 -16.3345   17.255 -16.3345   17.255   8.1006   5.7862   8.1006   5.7862 0.000000 0.000000 
1 1 1   28    0   18 o   9.5594   6.6187  -4.3398   17.698  -4.3398   17.698  -4.3398   17.698   9.5594   6.6187   9.5594   6.6187 0.000000 0.000000 
1 1 1   28    0   19 o   10.886   7.6564  -6.5096   26.412  -6.5096   26.412  -6.5096   26.412   10.886   7.6564   10.886   7.6564 0.000000 0.000000 
1 1 1   28    0   20 o   8.3260   6.0801 -39.2340   25.029 -39.2340   25.029 -39.2340   25.029   8.3260   6.0801   8.3260   6.0801 0.000000 0.000000 
1 1 1   28    0   21 o   16.686   10.323   33.951   27.775   33.951   27.775   33.951   27.775   16.686   10.323   16.686   10.323 0.000000 0.000000 
1 1 1   28    0   22 o   10.086   7.1712 -13.6438   25.372 -13.6438   25.372 -13.6438   25.372   10.086   7.1712   10.086   7.1712 0.000000 0.000000 
1 1 1   28    0   23 o   9.3138   6.7087 -23.8145   25.337 -23.8145   25.337 -23.8145   25.337   9.3138   6.7087   9.3138   6.7087 0.000000 0.000000 
1 1 1   28    0   24 o   18.975   10.972   43.482   27.510   43.482   27.510   43.482   27.510   18.975   10.972   18.975   10.972 0.000000 0.000000 
1 1 1   28    0   25 o   12.357   8.4253   7.3154   26.238   7.3154   26.238   7.3154   26.238   12.357   8.4253   12.357   8.4253 0.000000 0.000000 
1 1 1   28    0   26 o   10.355   7.3214 -10.1890   25.189 -10.1890   25.189 -10.1890   25.189   10.355   7.3214   10.355   7.3214 0.000000 0.000000 
1 1 1   28    0   27 o   13.344   8.8786   14.636   25.951   14.636   25.951   14.636   25.951   13.344   8.8786   13.344   8.8786 0.000000 0.000000 
1 1 1   28    0   28 o   17.858   10.627   38.445   27.093   38.445   27.093   38.445   27.093   17.858   10.627   17.858   10.627 0.000000 0.000000 
1 1 1   28    1  -13 o   8.8907   4.4977 -38.3392   16.016 -48.7888   22.124 -26.8329   23.216   10.185   5.1670   11.763   5.8765 -1.577882 7.825080 
1 1 1   28    1  -12 o   12.586   5.9768  -2.2490   16.594  -8.1241   23.055   4.0659   23.903   13.223   6.4625   14.583   6.9925 -1.359643 9.521502 
1 1 1   28    1  -11 o   14.928   6.6997   11.239   16.932   17.051   24.088   5.5621   23.806   16.188   7.5316   14.732   7.0410 1.456274 10.31028 
1 1 1   28    1  -10 o   10.062   4.9982 -22.0756   15.821 -34.6687   22.490  -9.7369   22.261   11.066   5.5640   12.916   6.3206 -1.850742 8.420720 
1 1 1   28    1   -9 o   18.863   7.4478   27.330   16.905   44.433   23.738   9.7307   24.081   21.152   8.6574   15.228   7.2222 5.923896 11.27429 
1 1 1   28    1   -8 o   18.320   7.3797   25.501   16.931   12.572   23.200   40.232   24.765   15.528   7.2790   19.933   8.5397 -4.405097 11.22101 
1 1 1   28    1   -7 o   13.458   6.2772   3.1976   16.901 -29.0387   23.298   39.002   24.554   11.608   5.8121   19.733   8.4794 -8.124927 10.28009 
1 1 1   28    1   -6 o   16.461   6.6022   17.515   13.489   31.833   18.980   2.9019   19.175   19.539   7.8334   13.791   6.5120 5.747949 10.18666 
1 1 1   28    1   -5 o   10.859   5.1855  -6.2583   12.853 -20.0943   17.993   8.1576   18.366   10.924   5.4095   14.477   6.6799 -3.553461 8.595555 
1 1 1   28    1   -4 o   12.890   5.8336   4.2417   13.150 -11.6299   18.290   21.222   18.919   11.830   5.7763   16.972   7.3683 -5.142255 9.362506 
1 1 1   28    1   -3 o   10.990   5.1998  -4.3235   12.341   14.059   18.007 -20.6016   16.945   15.514   6.9398   10.559   5.2324 4.954933 8.691317 
1 1 1   28    1   -2 o   9.8723   4.8203 -12.9517   12.739   5.0422   18.560 -28.9783   17.516   14.008   6.5482   10.045   5.0310 3.962905 8.257677 
1 1 1   28    1   -1 o   11.674   5.5128  -3.0443   13.750 -44.7990   22.880   20.559   17.203   10.568   5.3495   16.959   7.1863 -6.391087 8.958761 
1 1 1   28    1    0 o   13.921   6.1878   8.1073   14.080   14.141   22.724   4.3477   17.939   15.706   7.3100   13.808   6.4493 1.897888 9.748261 
1 1 1   28    1    1 o   18.598   7.1740   25.263   15.392   8.4788   27.146   33.216   18.686   15.275   7.3570   20.008   7.8514 -4.733437 10.75968 
1 1 1   28    1    2 o   11.328   5.3135  -2.5248   12.397  -5.4658   17.848   0.2173   17.234   12.426   5.9802   13.057   6.1678 -0.6306543 8.590934 
1 1 1   28    1    3 o   13.731   6.2011   6.7522   14.765   8.7803   17.979   2.5512   25.876   14.540   6.6723   14.587   7.0640 -0.4669952E-01 9.716975 
1 1 1   28    1    4 o   20.887   6.6882   28.689   12.878   18.996   17.901   39.086   18.540   16.546   7.1754   21.843   7.9880 -5.296913 10.73750 
1 1 1   28    1    5 o   12.547   5.6860   3.3312   12.544   4.0165   17.597   2.6229   17.888   13.702   6.3956   13.537   6.3601 0.1649694 9.019708 
1 1 1   28    1    6 o   11.682   5.4360  -0.9167   12.559   3.8852   17.997  -5.4755   17.535   13.749   6.4341   12.354   5.9406 1.395699 8.757172 
1 1 1   28    1    7 o   9.3756   4.6103 -15.5194   12.299  -2.2273   17.385 -28.8369   17.401   12.748   6.0718   10.022   5.0188 2.726554 7.877507 
1 1 1   28    1    8 o   11.656   5.5391  -4.2698   14.308 -11.0438   17.436   9.6952   25.035   11.675   5.6871   15.282   7.2807 -3.607073 9.238582 
1 1 1   28    1    9 o   12.684   5.7272   3.8534   12.587   9.0372   17.596  -1.5781   18.012   14.562   6.6517   12.979   6.1811 1.583625 9.080305 
1 1 1   28    1   10 o   18.424   6.6027   22.413   12.585   22.453   17.458   22.369   18.160   17.435   7.3050   17.333   7.3657 0.1015205 10.37384 
1 1 1   28    1   11 o   11.497   5.4178  -3.0689   13.150   1.7708   18.769  -7.7356   18.430   13.592   6.4252   12.315   5.9634 1.276542 8.766152 
1 1 1   28    1   12 o   15.386   7.3149   10.334   25.002   0.0000   0.0000   10.334   25.002  ?   ?    15.386   7.3149 0.000000 7.314919 
1 1 1   28    1   13 o   18.012   8.1700   29.971   25.964   0.0000   0.0000   29.971   25.964  ?   ?    18.012   8.1700 0.000000 8.169959 
#END OF REFLECTIONS
