# generated using pymatgen
data_Al3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.46106921
_cell_length_b   15.32927545
_cell_length_c   48.46146290
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.55176917
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni2
_chemical_formula_sum   'Al216 Ni144'
_cell_volume   10564.7012324
_cell_formula_units_Z   72
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
  Al  Al1  1  0.496461  0.502892  0.266724  1
  Al  Al2  1  0.829794  0.169559  0.266724  1
  Al  Al3  1  0.762170  0.486268  0.283584  1
  Al  Al4  1  0.163127  0.836225  0.266724  1
  Al  Al5  1  0.095503  0.152935  0.283584  1
  Al  Al6  1  0.037815  0.502112  0.304014  1
  Al  Al7  1  0.428836  0.819601  0.283584  1
  Al  Al8  1  0.371148  0.168779  0.304014  1
  Al  Al9  1  0.704481  0.835445  0.304014  1
  Al  Al10  1  0.575036  0.687596  0.311774  1
  Al  Al11  1  0.908369  0.354263  0.311774  1
  Al  Al12  1  0.031544  0.698872  0.279588  1
  Al  Al13  1  0.241703  0.020930  0.311774  1
  Al  Al14  1  0.364878  0.365539  0.279588  1
  Al  Al15  1  0.305837  0.700024  0.291412  1
  Al  Al16  1  0.698211  0.032206  0.279588  1
  Al  Al17  1  0.639170  0.366691  0.291412  1
  Al  Al18  1  0.972503  0.033358  0.291412  1
  Al  Al19  1  0.439809  0.584665  0.319297  1
  Al  Al20  1  0.773143  0.251332  0.319297  1
  Al  Al21  1  0.877566  0.612341  0.280118  1
  Al  Al22  1  0.106476  0.917998  0.319297  1
  Al  Al23  1  0.210899  0.279008  0.280118  1
  Al  Al24  1  0.179850  0.597586  0.301927  1
  Al  Al25  1  0.544232  0.945675  0.280118  1
  Al  Al26  1  0.513183  0.264253  0.301927  1
  Al  Al27  1  0.846517  0.930920  0.301927  1
  Al  Al28  1  0.312428  0.464135  0.326521  1
  Al  Al29  1  0.645761  0.130802  0.326521  1
  Al  Al30  1  0.583663  0.448813  0.344895  1
  Al  Al31  1  0.979094  0.797469  0.326521  1
  Al  Al32  1  0.916996  0.115480  0.344895  1
  Al  Al33  1  0.855100  0.439501  0.363305  1
  Al  Al34  1  0.250330  0.782146  0.344895  1
  Al  Al35  1  0.188433  0.106167  0.363305  1
  Al  Al36  1  0.521767  0.772834  0.363305  1
  Al  Al37  1  0.390286  0.654691  0.370054  1
  Al  Al38  1  0.723620  0.321358  0.370054  1
  Al  Al39  1  0.848401  0.678059  0.331110  1
  Al  Al40  1  0.056953  0.988024  0.370054  1
  Al  Al41  1  0.181734  0.344725  0.331110  1
  Al  Al42  1  0.117093  0.666325  0.350725  1
  Al  Al43  1  0.515067  0.011392  0.331110  1
  Al  Al44  1  0.450426  0.332992  0.350725  1
  Al  Al45  1  0.783760  0.999659  0.350725  1
  Al  Al46  1  0.256235  0.548461  0.377659  1
  Al  Al47  1  0.589568  0.215128  0.377659  1
  Al  Al48  1  0.714375  0.573548  0.337570  1
  Al  Al49  1  0.922902  0.881795  0.377659  1
  Al  Al50  1  0.047708  0.240215  0.337570  1
  Al  Al51  1  0.982084  0.561294  0.357550  1
  Al  Al52  1  0.381041  0.906882  0.337570  1
  Al  Al53  1  0.315417  0.227961  0.357550  1
  Al  Al54  1  0.648751  0.894627  0.357550  1
  Al  Al55  1  0.124089  0.428157  0.383747  1
  Al  Al56  1  0.457422  0.094824  0.383747  1
  Al  Al57  1  0.396913  0.416779  0.403912  1
  Al  Al58  1  0.790756  0.761491  0.383747  1
  Al  Al59  1  0.730247  0.083445  0.403912  1
  Al  Al60  1  0.669334  0.404400  0.423062  1
  Al  Al61  1  0.063580  0.750112  0.403912  1
  Al  Al62  1  0.002668  0.071066  0.423062  1
  Al  Al63  1  0.336001  0.737733  0.423062  1
  Al  Al64  1  0.204558  0.617585  0.429724  1
  Al  Al65  1  0.537892  0.284252  0.429724  1
  Al  Al66  1  0.662443  0.643391  0.388845  1
  Al  Al67  1  0.871225  0.950918  0.429724  1
  Al  Al68  1  0.995776  0.310058  0.388845  1
  Al  Al69  1  0.932844  0.629700  0.410043  1
  Al  Al70  1  0.329109  0.976725  0.388845  1
  Al  Al71  1  0.266177  0.296367  0.410043  1
  Al  Al72  1  0.599511  0.963033  0.410043  1
  Al  Al73  1  0.069912  0.511915  0.436627  1
  Al  Al74  1  0.403245  0.178582  0.436627  1
  Al  Al75  1  0.529390  0.536319  0.397343  1
  Al  Al76  1  0.736579  0.845249  0.436627  1
  Al  Al77  1  0.862723  0.202986  0.397343  1
  Al  Al78  1  0.798425  0.524266  0.416856  1
  Al  Al79  1  0.196056  0.869653  0.397343  1
  Al  Al80  1  0.131759  0.190933  0.416856  1
  Al  Al81  1  0.465092  0.857600  0.416856  1
  Al  Al82  1  0.939774  0.392182  0.442702  1
  Al  Al83  1  0.273107  0.058849  0.442702  1
  Al  Al84  1  0.211134  0.380214  0.462613  1
  Al  Al85  1  0.606440  0.725516  0.442702  1
  Al  Al86  1  0.544468  0.046880  0.462613  1
  Al  Al87  1  0.483314  0.368120  0.482359  1
  Al  Al88  1  0.877801  0.713547  0.462613  1
  Al  Al89  1  0.816648  0.034787  0.482359  1
  Al  Al90  1  0.149981  0.701453  0.482359  1
  Al  Al91  1  0.019111  0.581515  0.488604  1
  Al  Al92  1  0.352444  0.248182  0.488604  1
  Al  Al93  1  0.476453  0.606037  0.448849  1
  Al  Al94  1  0.685777  0.914848  0.488604  1
  Al  Al95  1  0.809787  0.272704  0.448849  1
  Al  Al96  1  0.747667  0.593778  0.468716  1
  Al  Al97  1  0.143120  0.939371  0.448849  1
  Al  Al98  1  0.081001  0.260445  0.468716  1
  Al  Al99  1  0.414334  0.927111  0.468716  1
  Al  Al100  1  0.884746  0.475661  0.495840  1
  Al  Al101  1  0.218079  0.142327  0.495840  1
  Al  Al102  1  0.342298  0.499854  0.456423  1
  Al  Al103  1  0.551412  0.808994  0.495840  1
  Al  Al104  1  0.675631  0.166520  0.456423  1
  Al  Al105  1  0.613682  0.487797  0.476164  1
  Al  Al106  1  0.008964  0.833187  0.456423  1
  Al  Al107  1  0.947015  0.154463  0.476164  1
  Al  Al108  1  0.280349  0.821130  0.476164  1
  Al  Al109  1  0.754555  0.355927  0.502033  1
  Al  Al110  1  0.087888  0.022594  0.502033  1
  Al  Al111  1  0.025634  0.343770  0.521602  1
  Al  Al112  1  0.421221  0.689261  0.502033  1
  Al  Al113  1  0.358967  0.010437  0.521602  1
  Al  Al114  1  0.297926  0.331616  0.541377  1
  Al  Al115  1  0.692301  0.677104  0.521602  1
  Al  Al116  1  0.631259  0.998283  0.541377  1
  Al  Al117  1  0.964592  0.664949  0.541377  1
  Al  Al118  1  0.833377  0.545310  0.547582  1
  Al  Al119  1  0.166711  0.211977  0.547582  1
  Al  Al120  1  0.291042  0.569507  0.508231  1
  Al  Al121  1  0.500044  0.878644  0.547582  1
  Al  Al122  1  0.624375  0.236174  0.508231  1
  Al  Al123  1  0.561960  0.557411  0.527796  1
  Al  Al124  1  0.957708  0.902841  0.508231  1
  Al  Al125  1  0.895293  0.224078  0.527796  1
  Al  Al126  1  0.228627  0.890744  0.527796  1
  Al  Al127  1  0.699213  0.439159  0.555135  1
  Al  Al128  1  0.032546  0.105826  0.555135  1
  Al  Al129  1  0.156547  0.463756  0.515318  1
  Al  Al130  1  0.365880  0.772492  0.555135  1
  Al  Al131  1  0.489881  0.130423  0.515318  1
  Al  Al132  1  0.428040  0.451442  0.535305  1
  Al  Al133  1  0.823214  0.797089  0.515318  1
  Al  Al134  1  0.761373  0.118108  0.535305  1
  Al  Al135  1  0.094706  0.784775  0.535305  1
  Al  Al136  1  0.569259  0.319838  0.561249  1
  Al  Al137  1  0.902593  0.986504  0.561249  1
  Al  Al138  1  0.839770  0.307502  0.581115  1
  Al  Al139  1  0.235926  0.653171  0.561249  1
  Al  Al140  1  0.173103  0.974168  0.581115  1
  Al  Al141  1  0.111977  0.295207  0.599932  1
  Al  Al142  1  0.506436  0.640835  0.581115  1
  Al  Al143  1  0.445310  0.961874  0.599932  1
  Al  Al144  1  0.778644  0.628540  0.599932  1
  Al  Al145  1  0.645777  0.508800  0.606607  1
  Al  Al146  1  0.979110  0.175467  0.606607  1
  Al  Al147  1  0.105623  0.533345  0.567272  1
  Al  Al148  1  0.312443  0.842133  0.606607  1
  Al  Al149  1  0.438956  0.200011  0.567272  1
  Al  Al150  1  0.377521  0.520932  0.587254  1
  Al  Al151  1  0.772289  0.866678  0.567272  1
  Al  Al152  1  0.710854  0.187598  0.587254  1
  Al  Al153  1  0.044188  0.854265  0.587254  1
  Al  Al154  1  0.513120  0.401697  0.615361  1
  Al  Al155  1  0.846453  0.068364  0.615361  1
  Al  Al156  1  0.971169  0.427430  0.574374  1
  Al  Al157  1  0.179787  0.735030  0.615361  1
  Al  Al158  1  0.304502  0.094096  0.574374  1
  Al  Al159  1  0.242801  0.415487  0.593795  1
  Al  Al160  1  0.637836  0.760763  0.574374  1
  Al  Al161  1  0.576134  0.082154  0.593795  1
  Al  Al162  1  0.909467  0.748821  0.593795  1
  Al  Al163  1  0.384832  0.284070  0.620252  1
  Al  Al164  1  0.718165  0.950737  0.620252  1
  Al  Al165  1  0.653336  0.272651  0.640599  1
  Al  Al166  1  0.051499  0.617403  0.620252  1
  Al  Al167  1  0.986669  0.939318  0.640599  1
  Al  Al168  1  0.925631  0.262815  0.659356  1
  Al  Al169  1  0.320003  0.605984  0.640599  1
  Al  Al170  1  0.258964  0.929482  0.659356  1
  Al  Al171  1  0.592298  0.596148  0.659356  1
  Al  Al172  1  0.462132  0.471272  0.666845  1
  Al  Al173  1  0.795465  0.137938  0.666845  1
  Al  Al174  1  0.919660  0.496290  0.626362  1
  Al  Al175  1  0.128799  0.804605  0.666845  1
  Al  Al176  1  0.252993  0.162956  0.626362  1
  Al  Al177  1  0.193529  0.484020  0.646055  1
  Al  Al178  1  0.586327  0.829623  0.626362  1
  Al  Al179  1  0.526862  0.150687  0.646055  1
  Al  Al180  1  0.860196  0.817354  0.646055  1
  Al  Al181  1  0.325142  0.367141  0.672822  1
  Al  Al182  1  0.658476  0.033808  0.672822  1
  Al  Al183  1  0.785580  0.390550  0.634008  1
  Al  Al184  1  0.991809  0.700475  0.672822  1
  Al  Al185  1  0.118913  0.057217  0.634008  1
  Al  Al186  1  0.059403  0.378123  0.654020  1
  Al  Al187  1  0.452246  0.723884  0.634008  1
  Al  Al188  1  0.392736  0.044790  0.654020  1
  Al  Al189  1  0.726070  0.711457  0.654020  1
  Al  Al190  1  0.196573  0.245108  0.676929  1
  Al  Al191  1  0.529906  0.911774  0.676929  1
  Al  Al192  1  0.472480  0.205222  0.699620  1
  Al  Al193  1  0.863239  0.578441  0.676929  1
  Al  Al194  1  0.805814  0.871888  0.699620  1
  Al  Al195  1  0.746536  0.226156  0.719802  1
  Al  Al196  1  0.139147  0.538555  0.699620  1
  Al  Al197  1  0.079870  0.892823  0.719802  1
  Al  Al198  1  0.413203  0.559489  0.719802  1
  Al  Al199  1  0.306890  0.430819  0.723762  1
  Al  Al200  1  0.640223  0.097486  0.723762  1
  Al  Al201  1  0.735259  0.460597  0.684232  1
  Al  Al202  1  0.973557  0.764152  0.723762  1
  Al  Al203  1  0.068593  0.127263  0.684232  1
  Al  Al204  1  0.990681  0.448335  0.701547  1
  Al  Al205  1  0.401926  0.793930  0.684232  1
  Al  Al206  1  0.324015  0.115002  0.701547  1
  Al  Al207  1  0.657348  0.781668  0.701547  1
  Al  Al208  1  0.150137  0.355492  0.719486  1
  Al  Al209  1  0.483470  0.022159  0.719486  1
  Al  Al210  1  0.600506  0.357325  0.692326  1
  Al  Al211  1  0.816804  0.688826  0.719486  1
  Al  Al212  1  0.933840  0.023991  0.692326  1
  Al  Al213  1  0.867846  0.347333  0.711439  1
  Al  Al214  1  0.267173  0.690658  0.692326  1
  Al  Al215  1  0.201179  0.014000  0.711439  1
  Al  Al216  1  0.534512  0.680666  0.711439  1
  Ni  Ni217  1  0.604384  0.527479  0.303237  1
  Ni  Ni218  1  0.937717  0.194146  0.303237  1
  Ni  Ni219  1  0.875515  0.515879  0.320622  1
  Ni  Ni220  1  0.271051  0.860813  0.303237  1
  Ni  Ni221  1  0.208848  0.182545  0.320622  1
  Ni  Ni222  1  0.335137  0.533397  0.283196  1
  Ni  Ni223  1  0.542181  0.849212  0.320622  1
  Ni  Ni224  1  0.668470  0.200064  0.283196  1
  Ni  Ni225  1  1.001804  0.866730  0.283196  1
  Ni  Ni226  1  0.598287  0.780162  0.272692  1
  Ni  Ni227  1  0.931620  0.446828  0.272692  1
  Ni  Ni228  1  0.868478  0.771886  0.290631  1
  Ni  Ni229  1  0.264953  0.113495  0.272692  1
  Ni  Ni230  1  0.201811  0.438553  0.290631  1
  Ni  Ni231  1  0.141338  0.758608  0.309578  1
  Ni  Ni232  1  0.535145  0.105220  0.290631  1
  Ni  Ni233  1  0.474671  0.425274  0.309578  1
  Ni  Ni234  1  0.808005  0.091941  0.309578  1
  Ni  Ni235  1  0.422250  0.493819  0.361281  1
  Ni  Ni236  1  0.755584  0.160486  0.361281  1
  Ni  Ni237  1  0.693379  0.482300  0.379914  1
  Ni  Ni238  1  0.088917  0.827153  0.361281  1
  Ni  Ni239  1  0.026712  0.148967  0.379914  1
  Ni  Ni240  1  0.148888  0.505093  0.341658  1
  Ni  Ni241  1  0.360046  0.815634  0.379914  1
  Ni  Ni242  1  0.482222  0.171760  0.341658  1
  Ni  Ni243  1  0.815555  0.838426  0.341658  1
  Ni  Ni244  1  0.410748  0.746227  0.327833  1
  Ni  Ni245  1  0.744082  0.412893  0.327833  1
  Ni  Ni246  1  0.683849  0.736736  0.345937  1
  Ni  Ni247  1  0.077415  0.079560  0.327833  1
  Ni  Ni248  1  0.017182  0.403403  0.345937  1
  Ni  Ni249  1  0.953415  0.720359  0.368412  1
  Ni  Ni250  1  0.350515  0.070070  0.345937  1
  Ni  Ni251  1  0.286749  0.387026  0.368412  1
  Ni  Ni252  1  0.620082  0.053693  0.368412  1
  Ni  Ni253  1  0.234436  0.457251  0.419689  1
  Ni  Ni254  1  0.567770  0.123918  0.419689  1
  Ni  Ni255  1  0.507317  0.445275  0.439441  1
  Ni  Ni256  1  0.901103  0.790584  0.419689  1
  Ni  Ni257  1  0.840650  0.111942  0.439441  1
  Ni  Ni258  1  0.962534  0.469890  0.399720  1
  Ni  Ni259  1  0.173983  0.778609  0.439441  1
  Ni  Ni260  1  0.295868  0.136556  0.399720  1
  Ni  Ni261  1  0.629201  0.803223  0.399720  1
  Ni  Ni262  1  0.225415  0.708200  0.387791  1
  Ni  Ni263  1  0.558748  0.374867  0.387791  1
  Ni  Ni264  1  0.497887  0.697044  0.406563  1
  Ni  Ni265  1  0.892081  0.041534  0.387791  1
  Ni  Ni266  1  0.831220  0.363711  0.406563  1
  Ni  Ni267  1  0.767952  0.684562  0.426604  1
  Ni  Ni268  1  0.164553  0.030377  0.406563  1
  Ni  Ni269  1  0.101285  0.351228  0.426604  1
  Ni  Ni270  1  0.434618  0.017895  0.426604  1
  Ni  Ni271  1  0.049110  0.421115  0.478700  1
  Ni  Ni272  1  0.382443  0.087782  0.478700  1
  Ni  Ni273  1  0.321227  0.408961  0.498457  1
  Ni  Ni274  1  0.715776  0.754449  0.478700  1
  Ni  Ni275  1  0.654560  0.075627  0.498457  1
  Ni  Ni276  1  0.778157  0.433266  0.459073  1
  Ni  Ni277  1  0.987894  0.742294  0.498457  1
  Ni  Ni278  1  0.111490  0.099933  0.459073  1
  Ni  Ni279  1  0.444824  0.766599  0.459073  1
  Ni  Ni280  1  0.039986  0.672357  0.446654  1
  Ni  Ni281  1  0.373319  0.339024  0.446654  1
  Ni  Ni282  1  0.312059  0.660504  0.466084  1
  Ni  Ni283  1  0.706652  0.005691  0.446654  1
  Ni  Ni284  1  0.645393  0.327170  0.466084  1
  Ni  Ni285  1  0.582950  0.648399  0.485698  1
  Ni  Ni286  1  0.978726  0.993837  0.466084  1
  Ni  Ni287  1  0.916283  0.315065  0.485698  1
  Ni  Ni288  1  0.249617  0.981732  0.485698  1
  Ni  Ni289  1  0.863685  0.384596  0.538014  1
  Ni  Ni290  1  0.197019  0.051263  0.538014  1
  Ni  Ni291  1  0.135631  0.372908  0.557236  1
  Ni  Ni292  1  0.530352  0.717929  0.538014  1
  Ni  Ni293  1  0.468964  0.039574  0.557236  1
  Ni  Ni294  1  0.592722  0.396837  0.518255  1
  Ni  Ni295  1  0.802297  0.706241  0.557236  1
  Ni  Ni296  1  0.926056  0.063503  0.518255  1
  Ni  Ni297  1  0.259389  0.730170  0.518255  1
  Ni  Ni298  1  0.854475  0.636251  0.505548  1
  Ni  Ni299  1  0.187808  0.302918  0.505548  1
  Ni  Ni300  1  0.126559  0.624150  0.525245  1
  Ni  Ni301  1  0.521141  0.969585  0.505548  1
  Ni  Ni302  1  0.459892  0.290817  0.525245  1
  Ni  Ni303  1  0.397698  0.611910  0.545019  1
  Ni  Ni304  1  0.793226  0.957484  0.525245  1
  Ni  Ni305  1  0.731031  0.278577  0.545019  1
  Ni  Ni306  1  0.064365  0.945244  0.545019  1
  Ni  Ni307  1  0.677711  0.348230  0.597422  1
  Ni  Ni308  1  0.011044  0.014897  0.597422  1
  Ni  Ni309  1  0.950673  0.336751  0.616482  1
  Ni  Ni310  1  0.344377  0.681563  0.597422  1
  Ni  Ni311  1  0.284006  0.003418  0.616482  1
  Ni  Ni312  1  0.407845  0.360684  0.577401  1
  Ni  Ni313  1  0.617340  0.670085  0.616482  1
  Ni  Ni314  1  0.741179  0.027351  0.577401  1
  Ni  Ni315  1  0.074512  0.694018  0.577401  1
  Ni  Ni316  1  0.668188  0.599874  0.564505  1
  Ni  Ni317  1  1.001521  0.266540  0.564505  1
  Ni  Ni318  1  0.941279  0.587833  0.584310  1
  Ni  Ni319  1  0.334854  0.933207  0.564505  1
  Ni  Ni320  1  0.274612  0.254500  0.584310  1
  Ni  Ni321  1  0.213007  0.575411  0.604104  1
  Ni  Ni322  1  0.607945  0.921166  0.584310  1
  Ni  Ni323  1  0.546340  0.242077  0.604104  1
  Ni  Ni324  1  0.879674  0.908744  0.604104  1
  Ni  Ni325  1  0.491204  0.308163  0.658397  1
  Ni  Ni326  1  0.824538  0.974829  0.658397  1
  Ni  Ni327  1  0.764445  0.298713  0.675718  1
  Ni  Ni328  1  0.157871  0.641496  0.658397  1
  Ni  Ni329  1  0.097778  0.965380  0.675718  1
  Ni  Ni330  1  0.221786  0.324596  0.635426  1
  Ni  Ni331  1  0.431111  0.632046  0.675718  1
  Ni  Ni332  1  0.555119  0.991263  0.635426  1
  Ni  Ni333  1  0.888452  0.657930  0.635426  1
  Ni  Ni334  1  0.482301  0.562762  0.624367  1
  Ni  Ni335  1  0.815634  0.229428  0.624367  1
  Ni  Ni336  1  0.752911  0.551481  0.642334  1
  Ni  Ni337  1  0.148967  0.896095  0.624367  1
  Ni  Ni338  1  0.086244  0.218147  0.642334  1
  Ni  Ni339  1  0.026844  0.539881  0.662200  1
  Ni  Ni340  1  0.419577  0.884814  0.642334  1
  Ni  Ni341  1  0.360177  0.206547  0.662200  1
  Ni  Ni342  1  0.693510  0.873214  0.662200  1
  Ni  Ni343  1  0.309454  0.271733  0.712910  1
  Ni  Ni344  1  0.642787  0.938400  0.712910  1
  Ni  Ni345  1  0.577503  0.261557  0.730918  1
  Ni  Ni346  1  0.976120  0.605067  0.712910  1
  Ni  Ni347  1  0.910836  0.928224  0.730918  1
  Ni  Ni348  1  0.033306  0.285899  0.695475  1
  Ni  Ni349  1  0.244169  0.594891  0.730918  1
  Ni  Ni350  1  0.366639  0.952566  0.695475  1
  Ni  Ni351  1  0.699973  0.619233  0.695475  1
  Ni  Ni352  1  0.300604  0.529112  0.683128  1
  Ni  Ni353  1  0.633937  0.195779  0.683128  1
  Ni  Ni354  1  0.573383  0.518675  0.701772  1
  Ni  Ni355  1  0.967271  0.862446  0.683128  1
  Ni  Ni356  1  0.906716  0.185341  0.701772  1
  Ni  Ni357  1  0.834527  0.517161  0.720962  1
  Ni  Ni358  1  0.240050  0.852008  0.701772  1
  Ni  Ni359  1  0.167860  0.183827  0.720962  1
  Ni  Ni360  1  0.501193  0.850494  0.720962  1
