# generated using pymatgen
data_Ni3H
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.72389014
_cell_length_b   18.31452802
_cell_length_c   48.28454990
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   102.24749214
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ni3H
_chemical_formula_sum   'Ni486 H162'
_cell_volume   12724.1241079
_cell_formula_units_Z   162
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Ni  Ni1  1  0.125486  0.802056  0.299934  1
  Ni  Ni2  1  0.458819  0.468723  0.299934  1
  Ni  Ni3  1  0.452482  0.795280  0.317523  1
  Ni  Ni4  1  0.792152  0.135390  0.299934  1
  Ni  Ni5  1  0.785815  0.461947  0.317523  1
  Ni  Ni6  1  0.794903  0.806161  0.285991  1
  Ni  Ni7  1  0.119148  0.128613  0.317523  1
  Ni  Ni8  1  0.128237  0.472828  0.285991  1
  Ni  Ni9  1  0.461570  0.139494  0.285991  1
  Ni  Ni10  1  0.183800  0.679425  0.297782  1
  Ni  Ni11  1  0.517133  0.346091  0.297782  1
  Ni  Ni12  1  0.502679  0.672064  0.312799  1
  Ni  Ni13  1  0.850466  0.012758  0.297782  1
  Ni  Ni14  1  0.836012  0.338731  0.312799  1
  Ni  Ni15  1  0.855754  0.685255  0.285115  1
  Ni  Ni16  1  0.169346  1.005397  0.312799  1
  Ni  Ni17  1  0.189087  0.351922  0.285115  1
  Ni  Ni18  1  0.522421  0.018588  0.285115  1
  Ni  Ni19  1  0.284455  0.798275  0.310228  1
  Ni  Ni20  1  0.617788  0.464942  0.310228  1
  Ni  Ni21  1  0.585485  0.778612  0.283586  1
  Ni  Ni22  1  0.951121  0.131609  0.310228  1
  Ni  Ni23  1  0.918818  0.445278  0.283586  1
  Ni  Ni24  1  0.959263  0.802328  0.294822  1
  Ni  Ni25  1  0.252152  0.111945  0.283586  1
  Ni  Ni26  1  0.292596  0.468995  0.294822  1
  Ni  Ni27  1  0.625929  0.135661  0.294822  1
  Ni  Ni28  1  0.405787  0.581684  0.281803  1
  Ni  Ni29  1  0.739120  0.248350  0.281803  1
  Ni  Ni30  1  0.738807  0.572344  0.296190  1
  Ni  Ni31  1  0.072454  0.915017  0.281803  1
  Ni  Ni32  1  0.072141  0.239011  0.296190  1
  Ni  Ni33  1  0.059958  0.563378  0.310678  1
  Ni  Ni34  1  0.405474  0.905677  0.296190  1
  Ni  Ni35  1  0.393291  0.230045  0.310678  1
  Ni  Ni36  1  0.726624  0.896712  0.310678  1
  Ni  Ni37  1  0.365476  0.704890  0.286390  1
  Ni  Ni38  1  0.698809  0.371557  0.286390  1
  Ni  Ni39  1  0.689293  0.694466  0.301794  1
  Ni  Ni40  1  0.032142  0.038224  0.286390  1
  Ni  Ni41  1  0.022626  0.361133  0.301794  1
  Ni  Ni42  1  0.012066  0.689640  0.314656  1
  Ni  Ni43  1  0.355959  0.027799  0.301794  1
  Ni  Ni44  1  0.345399  0.356307  0.314656  1
  Ni  Ni45  1  0.678733  0.022974  0.314656  1
  Ni  Ni46  1  0.230998  0.567792  0.316847  1
  Ni  Ni47  1  0.564331  0.234459  0.316847  1
  Ni  Ni48  1  0.575158  0.582237  0.288482  1
  Ni  Ni49  1  0.897664  0.901126  0.316847  1
  Ni  Ni50  1  0.908491  0.248904  0.288482  1
  Ni  Ni51  1  0.902385  0.570356  0.304348  1
  Ni  Ni52  1  0.241824  0.915570  0.288482  1
  Ni  Ni53  1  0.235718  0.237022  0.304348  1
  Ni  Ni54  1  0.569052  0.903689  0.304348  1
  Ni  Ni55  1  0.097987  0.779953  0.350313  1
  Ni  Ni56  1  0.431320  0.446620  0.350313  1
  Ni  Ni57  1  0.421845  0.773997  0.368426  1
  Ni  Ni58  1  0.764653  0.113287  0.350313  1
  Ni  Ni59  1  0.755178  0.440664  0.368426  1
  Ni  Ni60  1  0.776217  0.788094  0.334807  1
  Ni  Ni61  1  0.088511  0.107330  0.368426  1
  Ni  Ni62  1  0.109551  0.454761  0.334807  1
  Ni  Ni63  1  0.442884  0.121428  0.334807  1
  Ni  Ni64  1  0.148247  0.654703  0.345996  1
  Ni  Ni65  1  0.481581  0.321370  0.345996  1
  Ni  Ni66  1  0.474009  0.649312  0.363260  1
  Ni  Ni67  1  0.814914  0.988037  0.345996  1
  Ni  Ni68  1  0.807342  0.315978  0.363260  1
  Ni  Ni69  1  0.827919  0.662577  0.332205  1
  Ni  Ni70  1  0.140675  0.982645  0.363260  1
  Ni  Ni71  1  0.161252  0.329244  0.332205  1
  Ni  Ni72  1  0.494585  0.995910  0.332205  1
  Ni  Ni73  1  0.254460  0.771884  0.360559  1
  Ni  Ni74  1  0.587793  0.438550  0.360559  1
  Ni  Ni75  1  0.610111  0.785886  0.330980  1
  Ni  Ni76  1  0.921126  0.105217  0.360559  1
  Ni  Ni77  1  0.943444  0.452553  0.330980  1
  Ni  Ni78  1  0.932940  0.780099  0.343458  1
  Ni  Ni79  1  0.276778  0.119220  0.330980  1
  Ni  Ni80  1  0.266273  0.446765  0.343458  1
  Ni  Ni81  1  0.599607  0.113432  0.343458  1
  Ni  Ni82  1  0.385437  0.558684  0.329759  1
  Ni  Ni83  1  0.718770  0.225351  0.329759  1
  Ni  Ni84  1  0.709168  0.550553  0.345710  1
  Ni  Ni85  1  0.052103  0.892018  0.329759  1
  Ni  Ni86  1  0.042502  0.217220  0.345710  1
  Ni  Ni87  1  0.034047  0.544195  0.362306  1
  Ni  Ni88  1  0.375835  0.883886  0.345710  1
  Ni  Ni89  1  0.367380  0.210861  0.362306  1
  Ni  Ni90  1  0.700714  0.877528  0.362306  1
  Ni  Ni91  1  0.333142  0.683265  0.334453  1
  Ni  Ni92  1  0.666476  0.349931  0.334453  1
  Ni  Ni93  1  0.658467  0.673621  0.350755  1
  Ni  Ni94  1  0.999809  0.016598  0.334453  1
  Ni  Ni95  1  0.991801  0.340287  0.350755  1
  Ni  Ni96  1  0.982155  0.668706  0.365801  1
  Ni  Ni97  1  0.325134  1.006954  0.350755  1
  Ni  Ni98  1  0.315489  0.335373  0.365801  1
  Ni  Ni99  1  0.648822  1.002039  0.365801  1
  Ni  Ni100  1  0.201458  0.545437  0.368522  1
  Ni  Ni101  1  0.534791  0.212103  0.368522  1
  Ni  Ni102  1  0.549722  0.557830  0.337055  1
  Ni  Ni103  1  0.868125  0.878770  0.368522  1
  Ni  Ni104  1  0.883056  0.224496  0.337055  1
  Ni  Ni105  1  0.875334  0.550842  0.354128  1
  Ni  Ni106  1  0.216389  0.891163  0.337055  1
  Ni  Ni107  1  0.208668  0.217508  0.354128  1
  Ni  Ni108  1  0.542001  0.884175  0.354128  1
  Ni  Ni109  1  0.070076  0.758797  0.401448  1
  Ni  Ni110  1  0.403410  0.425463  0.401448  1
  Ni  Ni111  1  0.394026  0.751892  0.419463  1
  Ni  Ni112  1  0.736743  0.092130  0.401448  1
  Ni  Ni113  1  0.727360  0.418559  0.419463  1
  Ni  Ni114  1  0.745746  0.766767  0.385062  1
  Ni  Ni115  1  0.060693  0.085225  0.419463  1
  Ni  Ni116  1  0.079079  0.433434  0.385062  1
  Ni  Ni117  1  0.412413  0.100100  0.385062  1
  Ni  Ni118  1  0.121229  0.633887  0.396729  1
  Ni  Ni119  1  0.454562  0.300553  0.396729  1
  Ni  Ni120  1  0.445560  0.626820  0.413970  1
  Ni  Ni121  1  0.787896  0.967220  0.396729  1
  Ni  Ni122  1  0.778893  0.293486  0.413970  1
  Ni  Ni123  1  0.796119  0.640159  0.381474  1
  Ni  Ni124  1  0.112226  0.960153  0.413970  1
  Ni  Ni125  1  0.129452  0.306826  0.381474  1
  Ni  Ni126  1  0.462786  0.973493  0.381474  1
  Ni  Ni127  1  0.226863  0.750266  0.411805  1
  Ni  Ni128  1  0.560196  0.416932  0.411805  1
  Ni  Ni129  1  0.578349  0.764205  0.379637  1
  Ni  Ni130  1  0.893530  0.083599  0.411805  1
  Ni  Ni131  1  0.911683  0.430872  0.379637  1
  Ni  Ni132  1  0.903460  0.757972  0.394197  1
  Ni  Ni133  1  0.245016  0.097539  0.379637  1
  Ni  Ni134  1  0.236793  0.424639  0.394197  1
  Ni  Ni135  1  0.570127  0.091306  0.394197  1
  Ni  Ni136  1  0.357555  0.535788  0.379507  1
  Ni  Ni137  1  0.690889  0.202455  0.379507  1
  Ni  Ni138  1  0.680464  0.527732  0.396558  1
  Ni  Ni139  1  0.024222  0.869122  0.379507  1
  Ni  Ni140  1  0.013797  0.194398  0.396558  1
  Ni  Ni141  1  0.005269  0.521693  0.413282  1
  Ni  Ni142  1  0.347130  0.861065  0.396558  1
  Ni  Ni143  1  0.338602  0.188360  0.413282  1
  Ni  Ni144  1  0.671936  0.855027  0.413282  1
  Ni  Ni145  1  0.305932  0.661338  0.384857  1
  Ni  Ni146  1  0.639265  0.328005  0.384857  1
  Ni  Ni147  1  0.630287  0.653498  0.401765  1
  Ni  Ni148  1  0.972599  0.994672  0.384857  1
  Ni  Ni149  1  0.963620  0.320165  0.401765  1
  Ni  Ni150  1  0.954211  0.647215  0.417340  1
  Ni  Ni151  1  0.296954  0.986831  0.401765  1
  Ni  Ni152  1  0.287544  0.313882  0.417340  1
  Ni  Ni153  1  0.620877  0.980548  0.417340  1
  Ni  Ni154  1  0.172834  0.523332  0.419764  1
  Ni  Ni155  1  0.506168  0.189999  0.419764  1
  Ni  Ni156  1  0.523545  0.536645  0.387003  1
  Ni  Ni157  1  0.839501  0.856665  0.419764  1
  Ni  Ni158  1  0.856878  0.203312  0.387003  1
  Ni  Ni159  1  0.847311  0.529524  0.404661  1
  Ni  Ni160  1  0.190211  0.869978  0.387003  1
  Ni  Ni161  1  0.180645  0.196191  0.404661  1
  Ni  Ni162  1  0.513978  0.862857  0.404661  1
  Ni  Ni163  1  0.042710  0.737716  0.452447  1
  Ni  Ni164  1  0.376043  0.404383  0.452447  1
  Ni  Ni165  1  0.366411  0.730390  0.470275  1
  Ni  Ni166  1  0.709377  0.071049  0.452447  1
  Ni  Ni167  1  0.699745  0.397056  0.470275  1
  Ni  Ni168  1  0.718428  0.745170  0.435936  1
  Ni  Ni169  1  0.033078  0.063723  0.470275  1
  Ni  Ni170  1  0.051761  0.411837  0.435936  1
  Ni  Ni171  1  0.385095  0.078503  0.435936  1
  Ni  Ni172  1  0.093420  0.612342  0.447508  1
  Ni  Ni173  1  0.426753  0.279008  0.447508  1
  Ni  Ni174  1  0.417790  0.605206  0.464655  1
  Ni  Ni175  1  0.760086  0.945675  0.447508  1
  Ni  Ni176  1  0.751123  0.271872  0.464655  1
  Ni  Ni177  1  0.768537  0.618896  0.431718  1
  Ni  Ni178  1  0.084457  0.938539  0.464655  1
  Ni  Ni179  1  0.101870  0.285562  0.431718  1
  Ni  Ni180  1  0.435204  0.952229  0.431718  1
  Ni  Ni181  1  0.199343  0.728710  0.462729  1
  Ni  Ni182  1  0.532677  0.395377  0.462729  1
  Ni  Ni183  1  0.550911  0.742863  0.429725  1
  Ni  Ni184  1  0.866010  0.062043  0.462729  1
  Ni  Ni185  1  0.884244  0.409530  0.429725  1
  Ni  Ni186  1  0.875794  0.736375  0.445057  1
  Ni  Ni187  1  0.217577  0.076197  0.429725  1
  Ni  Ni188  1  0.209127  0.403041  0.445057  1
  Ni  Ni189  1  0.542461  0.069708  0.445057  1
  Ni  Ni190  1  0.329564  0.514116  0.429986  1
  Ni  Ni191  1  0.662898  0.180782  0.429986  1
  Ni  Ni192  1  0.653010  0.506505  0.447485  1
  Ni  Ni193  1  0.996231  0.847449  0.429986  1
  Ni  Ni194  1  0.986343  0.173172  0.447485  1
  Ni  Ni195  1  0.977580  0.499875  0.464120  1
  Ni  Ni196  1  0.319676  0.839839  0.447485  1
  Ni  Ni197  1  0.310913  0.166542  0.464120  1
  Ni  Ni198  1  0.644247  0.833208  0.464120  1
  Ni  Ni199  1  0.278232  0.639441  0.435584  1
  Ni  Ni200  1  0.611565  0.306108  0.435584  1
  Ni  Ni201  1  0.602586  0.632195  0.452582  1
  Ni  Ni202  1  0.944899  0.972774  0.435584  1
  Ni  Ni203  1  0.935919  0.298862  0.452582  1
  Ni  Ni204  1  0.926937  0.625640  0.468501  1
  Ni  Ni205  1  0.269253  0.965528  0.452582  1
  Ni  Ni206  1  0.260271  0.292306  0.468501  1
  Ni  Ni207  1  0.593604  0.958973  0.468501  1
  Ni  Ni208  1  0.145118  0.501775  0.470732  1
  Ni  Ni209  1  0.478451  0.168442  0.470732  1
  Ni  Ni210  1  0.496293  0.515569  0.437482  1
  Ni  Ni211  1  0.811784  0.835109  0.470732  1
  Ni  Ni212  1  0.829627  0.182236  0.437482  1
  Ni  Ni213  1  0.819938  0.508163  0.455219  1
  Ni  Ni214  1  0.162960  0.848902  0.437482  1
  Ni  Ni215  1  0.153271  0.174829  0.455219  1
  Ni  Ni216  1  0.486605  0.841496  0.455219  1
  Ni  Ni217  1  0.015403  0.716515  0.503356  1
  Ni  Ni218  1  0.348736  0.383182  0.503356  1
  Ni  Ni219  1  0.338997  0.709042  0.521037  1
  Ni  Ni220  1  0.682070  0.049848  0.503356  1
  Ni  Ni221  1  0.672330  0.375709  0.521037  1
  Ni  Ni222  1  0.690952  0.723529  0.486773  1
  Ni  Ni223  1  0.005664  0.042375  0.521037  1
  Ni  Ni224  1  0.024286  0.390195  0.486773  1
  Ni  Ni225  1  0.357619  0.056862  0.486773  1
  Ni  Ni226  1  0.065948  0.590937  0.498323  1
  Ni  Ni227  1  0.399281  0.257603  0.498323  1
  Ni  Ni228  1  0.390311  0.583798  0.515380  1
  Ni  Ni229  1  0.732614  0.924270  0.498323  1
  Ni  Ni230  1  0.723644  0.250464  0.515380  1
  Ni  Ni231  1  0.741376  0.597585  0.482340  1
  Ni  Ni232  1  0.056978  0.917131  0.515380  1
  Ni  Ni233  1  0.074709  0.264252  0.482340  1
  Ni  Ni234  1  0.408043  0.930919  0.482340  1
  Ni  Ni235  1  0.172024  0.707404  0.513539  1
  Ni  Ni236  1  0.505357  0.374070  0.513539  1
  Ni  Ni237  1  0.523430  0.721448  0.480224  1
  Ni  Ni238  1  0.838691  0.040737  0.513539  1
  Ni  Ni239  1  0.856763  0.388115  0.480224  1
  Ni  Ni240  1  0.848431  0.714982  0.495831  1
  Ni  Ni241  1  0.190096  0.054782  0.480224  1
  Ni  Ni242  1  0.181765  0.381649  0.495831  1
  Ni  Ni243  1  0.515098  0.048316  0.495831  1
  Ni  Ni244  1  0.302064  0.492730  0.480676  1
  Ni  Ni245  1  0.635398  0.159397  0.480676  1
  Ni  Ni246  1  0.625658  0.485257  0.498357  1
  Ni  Ni247  1  0.968731  0.826064  0.480676  1
  Ni  Ni248  1  0.958992  0.151924  0.498357  1
  Ni  Ni249  1  0.950109  0.478244  0.514939  1
  Ni  Ni250  1  0.292325  0.818590  0.498357  1
  Ni  Ni251  1  0.283442  0.144910  0.514939  1
  Ni  Ni252  1  0.616776  0.811577  0.514939  1
  Ni  Ni253  1  0.250750  0.617975  0.486332  1
  Ni  Ni254  1  0.584084  0.284641  0.486332  1
  Ni  Ni255  1  0.575114  0.610836  0.503390  1
  Ni  Ni256  1  0.917417  0.951308  0.486332  1
  Ni  Ni257  1  0.908447  0.277502  0.503390  1
  Ni  Ni258  1  0.899685  0.604187  0.519373  1
  Ni  Ni259  1  0.241780  0.944169  0.503390  1
  Ni  Ni260  1  0.233019  0.270853  0.519373  1
  Ni  Ni261  1  0.566352  0.937520  0.519373  1
  Ni  Ni262  1  0.117632  0.480324  0.521488  1
  Ni  Ni263  1  0.450965  0.146991  0.521488  1
  Ni  Ni264  1  0.469037  0.494369  0.488173  1
  Ni  Ni265  1  0.784298  0.813657  0.521488  1
  Ni  Ni266  1  0.802371  0.161035  0.488173  1
  Ni  Ni267  1  0.792630  0.486790  0.505882  1
  Ni  Ni268  1  0.135704  0.827702  0.488173  1
  Ni  Ni269  1  0.125963  0.153457  0.505882  1
  Ni  Ni270  1  0.459297  0.820123  0.505882  1
  Ni  Ni271  1  0.988052  0.695267  0.554228  1
  Ni  Ni272  1  0.321385  0.361933  0.554228  1
  Ni  Ni273  1  0.311497  0.687656  0.571727  1
  Ni  Ni274  1  0.654718  0.028600  0.554228  1
  Ni  Ni275  1  0.644830  0.354323  0.571727  1
  Ni  Ni276  1  0.663481  0.701897  0.537593  1
  Ni  Ni277  1  0.978164  0.020990  0.571727  1
  Ni  Ni278  1  0.996815  0.368564  0.537593  1
  Ni  Ni279  1  0.330148  0.035230  0.537593  1
  Ni  Ni280  1  0.038475  0.569577  0.549130  1
  Ni  Ni281  1  0.371809  0.236244  0.549130  1
  Ni  Ni282  1  0.362829  0.562331  0.566129  1
  Ni  Ni283  1  0.705142  0.902911  0.549130  1
  Ni  Ni284  1  0.696163  0.228998  0.566129  1
  Ni  Ni285  1  0.714124  0.576133  0.533211  1
  Ni  Ni286  1  0.029496  0.895665  0.566129  1
  Ni  Ni287  1  0.047457  0.242799  0.533211  1
  Ni  Ni288  1  0.380791  0.909466  0.533211  1
  Ni  Ni289  1  0.144768  0.686203  0.564231  1
  Ni  Ni290  1  0.478101  0.352870  0.564231  1
  Ni  Ni291  1  0.495944  0.699997  0.530980  1
  Ni  Ni292  1  0.811435  0.019536  0.564231  1
  Ni  Ni293  1  0.829277  0.366664  0.530980  1
  Ni  Ni294  1  0.821123  0.693610  0.546494  1
  Ni  Ni295  1  0.162610  0.033330  0.530980  1
  Ni  Ni296  1  0.154457  0.360276  0.546494  1
  Ni  Ni297  1  0.487790  0.026943  0.546494  1
  Ni  Ni298  1  0.274650  0.471383  0.531438  1
  Ni  Ni299  1  0.607983  0.138049  0.531438  1
  Ni  Ni300  1  0.598351  0.464056  0.549266  1
  Ni  Ni301  1  0.941317  0.804716  0.531438  1
  Ni  Ni302  1  0.931685  0.130723  0.549266  1
  Ni  Ni303  1  0.922633  0.456602  0.565776  1
  Ni  Ni304  1  0.265018  0.797390  0.549266  1
  Ni  Ni305  1  0.255967  0.123269  0.565776  1
  Ni  Ni306  1  0.589300  0.789936  0.565776  1
  Ni  Ni307  1  0.223271  0.596566  0.537057  1
  Ni  Ni308  1  0.556605  0.263233  0.537057  1
  Ni  Ni309  1  0.547642  0.589430  0.554205  1
  Ni  Ni310  1  0.889938  0.929900  0.537057  1
  Ni  Ni311  1  0.880975  0.256097  0.554205  1
  Ni  Ni312  1  0.872524  0.582877  0.569994  1
  Ni  Ni313  1  0.214308  0.922764  0.554205  1
  Ni  Ni314  1  0.205858  0.249543  0.569994  1
  Ni  Ni315  1  0.539191  0.916210  0.569994  1
  Ni  Ni316  1  0.090151  0.458909  0.571987  1
  Ni  Ni317  1  0.423484  0.125575  0.571987  1
  Ni  Ni318  1  0.441718  0.473062  0.538983  1
  Ni  Ni319  1  0.756817  0.792242  0.571987  1
  Ni  Ni320  1  0.775051  0.139729  0.538983  1
  Ni  Ni321  1  0.765267  0.465398  0.556656  1
  Ni  Ni322  1  0.108385  0.806396  0.538983  1
  Ni  Ni323  1  0.098601  0.132064  0.556656  1
  Ni  Ni324  1  0.431934  0.798731  0.556656  1
  Ni  Ni325  1  0.960598  0.674040  0.605154  1
  Ni  Ni326  1  0.293931  0.340707  0.605154  1
  Ni  Ni327  1  0.283506  0.665984  0.622205  1
  Ni  Ni328  1  0.627264  0.007374  0.605154  1
  Ni  Ni329  1  0.616839  0.332651  0.622205  1
  Ni  Ni330  1  0.635792  0.680079  0.588430  1
  Ni  Ni331  1  0.950173  0.999317  0.622205  1
  Ni  Ni332  1  0.969126  0.346746  0.588430  1
  Ni  Ni333  1  0.302459  0.013412  0.588430  1
  Ni  Ni334  1  0.010774  0.548274  0.599947  1
  Ni  Ni335  1  0.344108  0.214941  0.599947  1
  Ni  Ni336  1  0.335129  0.540434  0.616856  1
  Ni  Ni337  1  0.677441  0.881607  0.599947  1
  Ni  Ni338  1  0.668463  0.207101  0.616856  1
  Ni  Ni339  1  0.686851  0.554557  0.584373  1
  Ni  Ni340  1  1.001796  0.873767  0.616856  1
  Ni  Ni341  1  0.020184  0.221224  0.584373  1
  Ni  Ni342  1  0.353517  0.887891  0.584373  1
  Ni  Ni343  1  0.117517  0.665127  0.614710  1
  Ni  Ni344  1  0.450850  0.331794  0.614710  1
  Ni  Ni345  1  0.468227  0.678440  0.581948  1
  Ni  Ni346  1  0.784183  0.998461  0.614710  1
  Ni  Ni347  1  0.801560  0.345107  0.581948  1
  Ni  Ni348  1  0.793750  0.672248  0.597051  1
  Ni  Ni349  1  0.134894  0.011774  0.581948  1
  Ni  Ni350  1  0.127083  0.338915  0.597051  1
  Ni  Ni351  1  0.460417  1.005582  0.597051  1
  Ni  Ni352  1  0.247035  0.449880  0.582250  1
  Ni  Ni353  1  0.580368  0.116547  0.582250  1
  Ni  Ni354  1  0.570985  0.442975  0.600265  1
  Ni  Ni355  1  0.913702  0.783213  0.582250  1
  Ni  Ni356  1  0.904318  0.109642  0.600265  1
  Ni  Ni357  1  0.895316  0.435005  0.616650  1
  Ni  Ni358  1  0.237652  0.776309  0.600265  1
  Ni  Ni359  1  0.228649  0.101672  0.616650  1
  Ni  Ni360  1  0.561982  0.768339  0.616650  1
  Ni  Ni361  1  0.195502  0.574953  0.587742  1
  Ni  Ni362  1  0.528835  0.241619  0.587742  1
  Ni  Ni363  1  0.519832  0.567886  0.604983  1
  Ni  Ni364  1  0.862168  0.908286  0.587742  1
  Ni  Ni365  1  0.853166  0.234552  0.604983  1
  Ni  Ni366  1  0.844942  0.561613  0.620239  1
  Ni  Ni367  1  0.186499  0.901219  0.604983  1
  Ni  Ni368  1  0.178276  0.228279  0.620239  1
  Ni  Ni369  1  0.511609  0.894946  0.620239  1
  Ni  Ni370  1  0.062712  0.437567  0.622076  1
  Ni  Ni371  1  0.396046  0.104234  0.622076  1
  Ni  Ni372  1  0.414198  0.451507  0.589908  1
  Ni  Ni373  1  0.729379  0.770900  0.622076  1
  Ni  Ni374  1  0.747532  0.118173  0.589908  1
  Ni  Ni375  1  0.737601  0.443800  0.607516  1
  Ni  Ni376  1  0.080865  0.784840  0.589908  1
  Ni  Ni377  1  0.070935  0.110467  0.607516  1
  Ni  Ni378  1  0.404268  0.777133  0.607516  1
  Ni  Ni379  1  0.931893  0.651219  0.656002  1
  Ni  Ni380  1  0.265226  0.317886  0.656002  1
  Ni  Ni381  1  0.255625  0.643088  0.671954  1
  Ni  Ni382  1  0.598560  0.984553  0.656002  1
  Ni  Ni383  1  0.588958  0.309754  0.671954  1
  Ni  Ni384  1  0.607014  0.657578  0.639406  1
  Ni  Ni385  1  0.922291  0.976421  0.671954  1
  Ni  Ni386  1  0.940348  0.324244  0.639406  1
  Ni  Ni387  1  0.273681  0.990911  0.639406  1
  Ni  Ni388  1  0.982594  0.528152  0.650957  1
  Ni  Ni389  1  0.315927  0.194818  0.650957  1
  Ni  Ni390  1  0.307919  0.518507  0.667259  1
  Ni  Ni391  1  0.649261  0.861485  0.650957  1
  Ni  Ni392  1  0.641252  0.185174  0.667259  1
  Ni  Ni393  1  0.658906  0.533066  0.635911  1
  Ni  Ni394  1  0.974586  0.851841  0.667259  1
  Ni  Ni395  1  0.992239  0.199733  0.635911  1
  Ni  Ni396  1  0.325573  0.866399  0.635911  1
  Ni  Ni397  1  0.091339  0.643943  0.664657  1
  Ni  Ni398  1  0.424672  0.310609  0.664657  1
  Ni  Ni399  1  0.439603  0.656335  0.633190  1
  Ni  Ni400  1  0.758006  0.977276  0.664657  1
  Ni  Ni401  1  0.772937  0.323002  0.633190  1
  Ni  Ni402  1  0.765727  0.650931  0.647585  1
  Ni  Ni403  1  0.106270  0.989669  0.633190  1
  Ni  Ni404  1  0.099060  0.317597  0.647585  1
  Ni  Ni405  1  0.432394  0.984264  0.647585  1
  Ni  Ni406  1  0.219217  0.427775  0.633286  1
  Ni  Ni407  1  0.552550  0.094442  0.633286  1
  Ni  Ni408  1  0.543075  0.421819  0.651399  1
  Ni  Ni409  1  0.885883  0.761109  0.633286  1
  Ni  Ni410  1  0.876408  0.088486  0.651399  1
  Ni  Ni411  1  0.864844  0.413678  0.666905  1
  Ni  Ni412  1  0.209741  0.755152  0.651399  1
  Ni  Ni413  1  0.198177  0.080344  0.666905  1
  Ni  Ni414  1  0.531511  0.747011  0.666905  1
  Ni  Ni415  1  0.167053  0.552461  0.638453  1
  Ni  Ni416  1  0.500386  0.219127  0.638453  1
  Ni  Ni417  1  0.492814  0.547069  0.655716  1
  Ni  Ni418  1  0.833719  0.885794  0.638453  1
  Ni  Ni419  1  0.826147  0.213735  0.655716  1
  Ni  Ni420  1  0.813143  0.539195  0.669508  1
  Ni  Ni421  1  0.159481  0.880402  0.655716  1
  Ni  Ni422  1  0.146476  0.205862  0.669508  1
  Ni  Ni423  1  0.479809  0.872529  0.669508  1
  Ni  Ni424  1  0.030950  0.415886  0.670732  1
  Ni  Ni425  1  0.364284  0.082553  0.670732  1
  Ni  Ni426  1  0.386602  0.429888  0.641154  1
  Ni  Ni427  1  0.697617  0.749219  0.670732  1
  Ni  Ni428  1  0.719935  0.096555  0.641154  1
  Ni  Ni429  1  0.708121  0.421674  0.658255  1
  Ni  Ni430  1  0.053269  0.763222  0.641154  1
  Ni  Ni431  1  0.041455  0.088340  0.658255  1
  Ni  Ni432  1  0.374788  0.755007  0.658255  1
  Ni  Ni433  1  0.902254  0.629428  0.705522  1
  Ni  Ni434  1  0.235587  0.296095  0.705522  1
  Ni  Ni435  1  0.235274  0.620089  0.719910  1
  Ni  Ni436  1  0.568921  0.962761  0.705522  1
  Ni  Ni437  1  0.568608  0.286755  0.719910  1
  Ni  Ni438  1  0.581104  0.638394  0.691035  1
  Ni  Ni439  1  0.901941  0.953422  0.719910  1
  Ni  Ni440  1  0.914437  0.305060  0.691035  1
  Ni  Ni441  1  0.247770  0.971727  0.691035  1
  Ni  Ni442  1  0.951769  0.507306  0.699918  1
  Ni  Ni443  1  0.285102  0.173973  0.699918  1
  Ni  Ni444  1  0.275586  0.496882  0.715322  1
  Ni  Ni445  1  0.618435  0.840640  0.699918  1
  Ni  Ni446  1  0.608919  0.163549  0.715322  1
  Ni  Ni447  1  0.628995  0.512132  0.687056  1
  Ni  Ni448  1  0.942252  0.830215  0.715322  1
  Ni  Ni449  1  0.962329  0.178798  0.687056  1
  Ni  Ni450  1  0.295662  0.845465  0.687056  1
  Ni  Ni451  1  0.065904  0.619535  0.713230  1
  Ni  Ni452  1  0.399237  0.286202  0.713230  1
  Ni  Ni453  1  0.410064  0.633980  0.684866  1
  Ni  Ni454  1  0.732570  0.952869  0.713230  1
  Ni  Ni455  1  0.743397  0.300647  0.684866  1
  Ni  Ni456  1  0.738676  0.631417  0.697364  1
  Ni  Ni457  1  0.076730  0.967313  0.684866  1
  Ni  Ni458  1  0.072010  0.298083  0.697364  1
  Ni  Ni459  1  0.405343  0.964750  0.697364  1
  Ni  Ni460  1  0.188580  0.406492  0.684190  1
  Ni  Ni461  1  0.521913  0.073159  0.684190  1
  Ni  Ni462  1  0.515576  0.399716  0.701778  1
  Ni  Ni463  1  0.855246  0.739826  0.684190  1
  Ni  Ni464  1  0.848909  0.066382  0.701778  1
  Ni  Ni465  1  0.846158  0.395611  0.715722  1
  Ni  Ni466  1  0.182243  0.733049  0.701778  1
  Ni  Ni467  1  0.179491  0.062278  0.715722  1
  Ni  Ni468  1  0.512825  0.728944  0.715722  1
  Ni  Ni469  1  0.138382  0.529708  0.688913  1
  Ni  Ni470  1  0.471716  0.196375  0.688913  1
  Ni  Ni471  1  0.457262  0.522347  0.703931  1
  Ni  Ni472  1  0.805049  0.863042  0.688913  1
  Ni  Ni473  1  0.790595  0.189014  0.703931  1
  Ni  Ni474  1  0.785307  0.516517  0.716597  1
  Ni  Ni475  1  0.123929  0.855681  0.703931  1
  Ni  Ni476  1  0.118641  0.183184  0.716597  1
  Ni  Ni477  1  0.451974  0.849851  0.716597  1
  Ni  Ni478  1  0.055576  0.423161  0.718126  1
  Ni  Ni479  1  0.388910  0.089827  0.718126  1
  Ni  Ni480  1  0.356607  0.403497  0.691485  1
  Ni  Ni481  1  0.722243  0.756494  0.718126  1
  Ni  Ni482  1  0.689940  0.070163  0.691485  1
  Ni  Ni483  1  0.681799  0.399444  0.706890  1
  Ni  Ni484  1  0.023273  0.736830  0.691485  1
  Ni  Ni485  1  0.015132  0.066111  0.706890  1
  Ni  Ni486  1  0.348465  0.732778  0.706890  1
  H  H487  1  0.203814  0.759569  0.278964  1
  H  H488  1  0.537148  0.426235  0.278964  1
  H  H489  1  0.476301  0.741738  0.284970  1
  H  H490  1  0.870481  0.092902  0.278964  1
  H  H491  1  0.809634  0.408405  0.284970  1
  H  H492  1  0.839146  0.748743  0.306821  1
  H  H493  1  0.142968  0.075072  0.284970  1
  H  H494  1  0.172479  0.415410  0.306821  1
  H  H495  1  0.505813  0.082076  0.306821  1
  H  H496  1  0.351851  0.626074  0.302616  1
  H  H497  1  0.685184  0.292741  0.302616  1
  H  H498  1  0.651748  0.594396  0.315512  1
  H  H499  1  0.018517  0.959407  0.302616  1
  H  H500  1  0.985081  0.261062  0.315512  1
  H  H501  1  0.077333  0.641522  0.287836  1
  H  H502  1  0.318414  0.927729  0.315512  1
  H  H503  1  0.410666  0.308189  0.287836  1
  H  H504  1  0.744000  0.974855  0.287836  1
  H  H505  1  0.160938  0.737690  0.323537  1
  H  H506  1  0.494271  0.404357  0.323537  1
  H  H507  1  0.487516  0.732192  0.342708  1
  H  H508  1  0.827605  0.071023  0.323537  1
  H  H509  1  0.820849  0.398859  0.342708  1
  H  H510  1  0.815603  0.725948  0.360543  1
  H  H511  1  0.154183  0.065525  0.342708  1
  H  H512  1  0.148937  0.392615  0.360543  1
  H  H513  1  0.482270  0.059281  0.360543  1
  H  H514  1  0.317672  0.599955  0.353990  1
  H  H515  1  0.651006  0.266622  0.353990  1
  H  H516  1  0.641818  0.591136  0.371026  1
  H  H517  1  0.984339  0.933289  0.353990  1
  H  H518  1  0.975151  0.257803  0.371026  1
  H  H519  1  0.994615  0.605966  0.334950  1
  H  H520  1  0.308484  0.924470  0.371026  1
  H  H521  1  0.327949  0.272632  0.334950  1
  H  H522  1  0.661282  0.939299  0.334950  1
  H  H523  1  0.136305  0.717044  0.375968  1
  H  H524  1  0.469638  0.383711  0.375968  1
  H  H525  1  0.458480  0.709756  0.393821  1
  H  H526  1  0.802971  0.050377  0.375968  1
  H  H527  1  0.791813  0.376423  0.393821  1
  H  H528  1  0.784811  0.703274  0.410888  1
  H  H529  1  0.125147  0.043090  0.393821  1
  H  H530  1  0.118144  0.369941  0.410888  1
  H  H531  1  0.451478  0.036608  0.410888  1
  H  H532  1  0.291497  0.578133  0.404824  1
  H  H533  1  0.624830  0.244799  0.404824  1
  H  H534  1  0.615133  0.570290  0.422121  1
  H  H535  1  0.958163  0.911466  0.404824  1
  H  H536  1  0.948467  0.236957  0.422121  1
  H  H537  1  0.966845  0.585626  0.387480  1
  H  H538  1  0.281800  0.903624  0.422121  1
  H  H539  1  0.300178  0.252293  0.387480  1
  H  H540  1  0.633511  0.918960  0.387480  1
  H  H541  1  0.108230  0.695489  0.427034  1
  H  H542  1  0.441564  0.362156  0.427034  1
  H  H543  1  0.431965  0.688217  0.444650  1
  H  H544  1  0.774897  0.028823  0.427034  1
  H  H545  1  0.765298  0.354883  0.444650  1
  H  H546  1  0.757289  0.681471  0.461535  1
  H  H547  1  0.098631  0.021550  0.444650  1
  H  H548  1  0.090622  0.348137  0.461535  1
  H  H549  1  0.423955  0.014804  0.461535  1
  H  H550  1  0.263599  0.556331  0.455542  1
  H  H551  1  0.596932  0.222997  0.455542  1
  H  H552  1  0.587741  0.549055  0.472952  1
  H  H553  1  0.930265  0.889664  0.455542  1
  H  H554  1  0.921074  0.215721  0.472952  1
  H  H555  1  0.938823  0.563779  0.438567  1
  H  H556  1  0.254407  0.882388  0.472952  1
  H  H557  1  0.272156  0.230446  0.438567  1
  H  H558  1  0.605489  0.897112  0.438567  1
  H  H559  1  0.080630  0.674019  0.477916  1
  H  H560  1  0.413963  0.340686  0.477916  1
  H  H561  1  0.404793  0.666848  0.495405  1
  H  H562  1  0.747296  0.007352  0.477916  1
  H  H563  1  0.738127  0.333515  0.495405  1
  H  H564  1  0.729799  0.659767  0.512289  1
  H  H565  1  0.071460  1.000181  0.495405  1
  H  H566  1  0.063132  0.326433  0.512289  1
  H  H567  1  0.396466  0.993100  0.512289  1
  H  H568  1  0.236268  0.534924  0.506307  1
  H  H569  1  0.569601  0.201591  0.506307  1
  H  H570  1  0.560432  0.527753  0.523797  1
  H  H571  1  0.902935  0.868258  0.506307  1
  H  H572  1  0.893765  0.194420  0.523797  1
  H  H573  1  0.911262  0.542006  0.489423  1
  H  H574  1  0.227098  0.861087  0.523797  1
  H  H575  1  0.244596  0.208672  0.489423  1
  H  H576  1  0.577929  0.875339  0.489423  1
  H  H577  1  0.053321  0.652718  0.528761  1
  H  H578  1  0.386654  0.319384  0.528761  1
  H  H579  1  0.377463  0.645441  0.546171  1
  H  H580  1  0.719987  0.986051  0.528761  1
  H  H581  1  0.710796  0.312108  0.546171  1
  H  H582  1  0.702239  0.637993  0.563146  1
  H  H583  1  0.044129  0.978775  0.546171  1
  H  H584  1  0.035572  0.304660  0.563146  1
  H  H585  1  0.368905  0.971327  0.563146  1
  H  H586  1  0.209097  0.513556  0.557062  1
  H  H587  1  0.542430  0.180222  0.557062  1
  H  H588  1  0.532831  0.506283  0.574679  1
  H  H589  1  0.875763  0.846889  0.557062  1
  H  H590  1  0.866164  0.172950  0.574679  1
  H  H591  1  0.883773  0.520302  0.540178  1
  H  H592  1  0.199498  0.839616  0.574679  1
  H  H593  1  0.217106  0.186968  0.540178  1
  H  H594  1  0.550439  0.853635  0.540178  1
  H  H595  1  0.025928  0.631482  0.579592  1
  H  H596  1  0.359261  0.298148  0.579592  1
  H  H597  1  0.349565  0.623640  0.596889  1
  H  H598  1  0.692595  0.964815  0.579592  1
  H  H599  1  0.682898  0.290306  0.596889  1
  H  H600  1  0.674217  0.616146  0.614232  1
  H  H601  1  0.016231  0.956973  0.596889  1
  H  H602  1  0.007550  0.282813  0.614232  1
  H  H603  1  0.340884  0.949479  0.614232  1
  H  H604  1  0.182581  0.492016  0.607891  1
  H  H605  1  0.515915  0.158683  0.607891  1
  H  H606  1  0.504757  0.484728  0.625744  1
  H  H607  1  0.849248  0.825349  0.607891  1
  H  H608  1  0.838090  0.151395  0.625744  1
  H  H609  1  0.856250  0.498498  0.590825  1
  H  H610  1  0.171423  0.818062  0.625744  1
  H  H611  1  0.189584  0.165165  0.590825  1
  H  H612  1  0.522917  0.831831  0.590825  1
  H  H613  1  0.999244  0.610636  0.630687  1
  H  H614  1  0.332577  0.277302  0.630687  1
  H  H615  1  0.323389  0.601817  0.647722  1
  H  H616  1  0.665910  0.943969  0.630687  1
  H  H617  1  0.656722  0.268484  0.647722  1
  H  H618  1  0.646446  0.595806  0.666762  1
  H  H619  1  0.990056  0.935150  0.647722  1
  H  H620  1  0.979779  0.262473  0.666762  1
  H  H621  1  0.313113  0.929140  0.666762  1
  H  H622  1  0.153545  0.469580  0.659004  1
  H  H623  1  0.486879  0.136247  0.659004  1
  H  H624  1  0.480123  0.464082  0.678175  1
  H  H625  1  0.820212  0.802913  0.659004  1
  H  H626  1  0.813457  0.130749  0.678175  1
  H  H627  1  0.825458  0.475824  0.641170  1
  H  H628  1  0.146790  0.797416  0.678175  1
  H  H629  1  0.158791  0.142491  0.641170  1
  H  H630  1  0.492125  0.809158  0.641170  1
  H  H631  1  0.989314  0.607376  0.686200  1
  H  H632  1  0.322647  0.274043  0.686200  1
  H  H633  1  0.289211  0.575698  0.699096  1
  H  H634  1  0.655980  0.940710  0.686200  1
  H  H635  1  0.622544  0.242365  0.699096  1
  H  H636  1  0.563728  0.560250  0.713876  1
  H  H637  1  0.955877  0.909031  0.699096  1
  H  H638  1  0.897062  0.226917  0.713876  1
  H  H639  1  0.230395  0.893583  0.713876  1
  H  H640  1  0.164761  0.460034  0.716743  1
  H  H641  1  0.498094  0.126701  0.716743  1
  H  H642  1  0.437247  0.442204  0.722749  1
  H  H643  1  0.831427  0.793367  0.716743  1
  H  H644  1  0.770580  0.108870  0.722749  1
  H  H645  1  0.801915  0.453029  0.694891  1
  H  H646  1  0.103914  0.775537  0.722749  1
  H  H647  1  0.135249  0.119696  0.694891  1
  H  H648  1  0.468582  0.786363  0.694891  1
