# generated using pymatgen
data_Al3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.40266801
_cell_length_b   15.29208992
_cell_length_c   48.27083846
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   79.55138430
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni2
_chemical_formula_sum   'Al216 Ni144'
_cell_volume   10455.2101111
_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  0.492686  0.518406  0.267760  1
  Al  Al2  1  0.826019  0.185073  0.267760  1
  Al  Al3  1  0.753329  0.504761  0.284543  1
  Al  Al4  1  0.159352  0.851739  0.267760  1
  Al  Al5  1  0.086663  0.171427  0.284543  1
  Al  Al6  1  0.041467  0.479700  0.303658  1
  Al  Al7  1  0.419996  0.838094  0.284543  1
  Al  Al8  1  0.374801  0.146367  0.303658  1
  Al  Al9  1  0.708134  0.813033  0.303658  1
  Al  Al10  1  0.573446  0.689641  0.310555  1
  Al  Al11  1  0.906780  0.356308  0.310555  1
  Al  Al12  1  0.034842  0.719594  0.274125  1
  Al  Al13  1  0.240113  0.022974  0.310555  1
  Al  Al14  1  0.368175  0.386261  0.274125  1
  Al  Al15  1  0.304013  0.705754  0.290831  1
  Al  Al16  1  0.701509  0.052928  0.274125  1
  Al  Al17  1  0.637346  0.372421  0.290831  1
  Al  Al18  1  0.970679  0.039087  0.290831  1
  Al  Al19  1  0.438178  0.585388  0.320890  1
  Al  Al20  1  0.771511  0.252055  0.320890  1
  Al  Al21  1  0.893081  0.615895  0.280218  1
  Al  Al22  1  0.104844  0.918721  0.320890  1
  Al  Al23  1  0.226414  0.282562  0.280218  1
  Al  Al24  1  0.172622  0.598293  0.300733  1
  Al  Al25  1  0.559748  0.949229  0.280218  1
  Al  Al26  1  0.505955  0.264960  0.300733  1
  Al  Al27  1  0.839289  0.931627  0.300733  1
  Al  Al28  1  0.314096  0.463183  0.327133  1
  Al  Al29  1  0.647429  0.129850  0.327133  1
  Al  Al30  1  0.583768  0.447112  0.345398  1
  Al  Al31  1  0.980763  0.796517  0.327133  1
  Al  Al32  1  0.917102  0.113778  0.345398  1
  Al  Al33  1  0.853360  0.440104  0.363014  1
  Al  Al34  1  0.250435  0.780445  0.345398  1
  Al  Al35  1  0.186693  0.106770  0.363014  1
  Al  Al36  1  0.520027  0.773437  0.363014  1
  Al  Al37  1  0.389838  0.656742  0.371415  1
  Al  Al38  1  0.723171  0.323409  0.371415  1
  Al  Al39  1  0.845612  0.680666  0.331805  1
  Al  Al40  1  0.056504  0.990076  0.371415  1
  Al  Al41  1  0.178945  0.347333  0.331805  1
  Al  Al42  1  0.117458  0.668034  0.351661  1
  Al  Al43  1  0.512278  0.014000  0.331805  1
  Al  Al44  1  0.450791  0.334701  0.351661  1
  Al  Al45  1  0.784124  1.001367  0.351661  1
  Al  Al46  1  0.256536  0.546164  0.377764  1
  Al  Al47  1  0.589869  0.212831  0.377764  1
  Al  Al48  1  0.712698  0.571519  0.338575  1
  Al  Al49  1  0.923202  0.879497  0.377764  1
  Al  Al50  1  0.046031  0.238186  0.338575  1
  Al  Al51  1  0.983491  0.558270  0.356669  1
  Al  Al52  1  0.379365  0.904852  0.338575  1
  Al  Al53  1  0.316824  0.224937  0.356669  1
  Al  Al54  1  0.650157  0.891604  0.356669  1
  Al  Al55  1  0.123294  0.430029  0.383434  1
  Al  Al56  1  0.456628  0.096696  0.383434  1
  Al  Al57  1  0.396497  0.416476  0.404112  1
  Al  Al58  1  0.789961  0.763363  0.383434  1
  Al  Al59  1  0.729831  0.083142  0.404112  1
  Al  Al60  1  0.669251  0.404063  0.423504  1
  Al  Al61  1  0.063164  0.749809  0.404112  1
  Al  Al62  1  0.002584  0.070730  0.423504  1
  Al  Al63  1  0.335917  0.737396  0.423504  1
  Al  Al64  1  0.203989  0.618834  0.429987  1
  Al  Al65  1  0.537322  0.285501  0.429987  1
  Al  Al66  1  0.661222  0.645310  0.389681  1
  Al  Al67  1  0.870655  0.952168  0.429987  1
  Al  Al68  1  0.994555  0.311977  0.389681  1
  Al  Al69  1  0.932226  0.631191  0.409734  1
  Al  Al70  1  0.327889  0.978644  0.389681  1
  Al  Al71  1  0.265560  0.297857  0.409734  1
  Al  Al72  1  0.598893  0.964524  0.409734  1
  Al  Al73  1  0.070014  0.509661  0.436470  1
  Al  Al74  1  0.403347  0.176328  0.436470  1
  Al  Al75  1  0.529895  0.534150  0.397567  1
  Al  Al76  1  0.736680  0.842995  0.436470  1
  Al  Al77  1  0.863228  0.200816  0.397567  1
  Al  Al78  1  0.798834  0.522337  0.416688  1
  Al  Al79  1  0.196562  0.867483  0.397567  1
  Al  Al80  1  0.132168  0.189004  0.416688  1
  Al  Al81  1  0.465501  0.855670  0.416688  1
  Al  Al82  1  0.940185  0.392043  0.442714  1
  Al  Al83  1  0.273518  0.058710  0.442714  1
  Al  Al84  1  0.211299  0.379645  0.462584  1
  Al  Al85  1  0.606852  0.725376  0.442714  1
  Al  Al86  1  0.544632  0.046312  0.462584  1
  Al  Al87  1  0.483149  0.367440  0.482479  1
  Al  Al88  1  0.877965  0.712979  0.462584  1
  Al  Al89  1  0.816483  0.034107  0.482479  1
  Al  Al90  1  0.149816  0.700773  0.482479  1
  Al  Al91  1  0.019080  0.582601  0.488678  1
  Al  Al92  1  0.352414  0.249267  0.488678  1
  Al  Al93  1  0.475939  0.607358  0.449235  1
  Al  Al94  1  0.685747  0.915934  0.488678  1
  Al  Al95  1  0.809272  0.274025  0.449235  1
  Al  Al96  1  0.747470  0.595144  0.468761  1
  Al  Al97  1  0.142605  0.940692  0.449235  1
  Al  Al98  1  0.080803  0.261811  0.468761  1
  Al  Al99  1  0.414137  0.928478  0.468761  1
  Al  Al100  1  0.885722  0.473048  0.495673  1
  Al  Al101  1  0.219055  0.139715  0.495673  1
  Al  Al102  1  0.342601  0.497207  0.456425  1
  Al  Al103  1  0.552389  0.806381  0.495673  1
  Al  Al104  1  0.675935  0.163874  0.456425  1
  Al  Al105  1  0.614407  0.485194  0.476121  1
  Al  Al106  1  0.009268  0.830540  0.456425  1
  Al  Al107  1  0.947741  0.151860  0.476121  1
  Al  Al108  1  0.281074  0.818527  0.476121  1
  Al  Al109  1  0.754795  0.355017  0.502044  1
  Al  Al110  1  0.088128  0.021683  0.502044  1
  Al  Al111  1  0.026395  0.342516  0.521596  1
  Al  Al112  1  0.421462  0.688350  0.502044  1
  Al  Al113  1  0.359728  0.009182  0.521596  1
  Al  Al114  1  0.298242  0.330249  0.541431  1
  Al  Al115  1  0.693062  0.675849  0.521596  1
  Al  Al116  1  0.631576  0.996916  0.541431  1
  Al  Al117  1  0.964909  0.663583  0.541431  1
  Al  Al118  1  0.833545  0.546043  0.547645  1
  Al  Al119  1  0.166878  0.212710  0.547645  1
  Al  Al120  1  0.290554  0.570272  0.508413  1
  Al  Al121  1  0.500212  0.879376  0.547645  1
  Al  Al122  1  0.623888  0.236939  0.508413  1
  Al  Al123  1  0.561804  0.558142  0.527982  1
  Al  Al124  1  0.957221  0.903605  0.508413  1
  Al  Al125  1  0.895137  0.224809  0.527982  1
  Al  Al126  1  0.228470  0.891475  0.527982  1
  Al  Al127  1  0.700257  0.435970  0.554862  1
  Al  Al128  1  0.033591  0.102636  0.554862  1
  Al  Al129  1  0.157193  0.460661  0.515376  1
  Al  Al130  1  0.366924  0.769303  0.554862  1
  Al  Al131  1  0.490526  0.127327  0.515376  1
  Al  Al132  1  0.428751  0.448195  0.535267  1
  Al  Al133  1  0.823859  0.793994  0.515376  1
  Al  Al134  1  0.762084  0.114861  0.535267  1
  Al  Al135  1  0.095417  0.781528  0.535267  1
  Al  Al136  1  0.569540  0.318013  0.561362  1
  Al  Al137  1  0.902874  0.984680  0.561362  1
  Al  Al138  1  0.840260  0.306228  0.580680  1
  Al  Al139  1  0.236207  0.651347  0.561362  1
  Al  Al140  1  0.173593  0.972895  0.580680  1
  Al  Al141  1  0.112704  0.293325  0.600009  1
  Al  Al142  1  0.506927  0.639561  0.580680  1
  Al  Al143  1  0.446037  0.959992  0.600009  1
  Al  Al144  1  0.779370  0.626658  0.600009  1
  Al  Al145  1  0.646466  0.509010  0.606577  1
  Al  Al146  1  0.979799  0.175677  0.606577  1
  Al  Al147  1  0.106040  0.533696  0.567522  1
  Al  Al148  1  0.313133  0.842343  0.606577  1
  Al  Al149  1  0.439374  0.200363  0.567522  1
  Al  Al150  1  0.377686  0.521019  0.587371  1
  Al  Al151  1  0.772707  0.867030  0.567522  1
  Al  Al152  1  0.711019  0.187685  0.587371  1
  Al  Al153  1  0.044352  0.854352  0.587371  1
  Al  Al154  1  0.515036  0.398053  0.614476  1
  Al  Al155  1  0.848369  0.064719  0.614476  1
  Al  Al156  1  0.972242  0.424350  0.574138  1
  Al  Al157  1  0.181703  0.731386  0.614476  1
  Al  Al158  1  0.305575  0.091017  0.574138  1
  Al  Al159  1  0.244069  0.412241  0.594124  1
  Al  Al160  1  0.638908  0.757684  0.574138  1
  Al  Al161  1  0.577402  0.078908  0.594124  1
  Al  Al162  1  0.910735  0.745575  0.594124  1
  Al  Al163  1  0.386295  0.279951  0.620406  1
  Al  Al164  1  0.719628  0.946618  0.620406  1
  Al  Al165  1  0.656362  0.269270  0.640955  1
  Al  Al166  1  0.052962  0.613284  0.620406  1
  Al  Al167  1  0.989695  0.935937  0.640955  1
  Al  Al168  1  0.925959  0.261854  0.658857  1
  Al  Al169  1  0.323029  0.602603  0.640955  1
  Al  Al170  1  0.259292  0.928521  0.658857  1
  Al  Al171  1  0.592626  0.595188  0.658857  1
  Al  Al172  1  0.464568  0.472181  0.665677  1
  Al  Al173  1  0.797901  0.138848  0.665677  1
  Al  Al174  1  0.919289  0.497071  0.626231  1
  Al  Al175  1  0.131234  0.805514  0.665677  1
  Al  Al176  1  0.252622  0.163738  0.626231  1
  Al  Al177  1  0.192623  0.484859  0.647170  1
  Al  Al178  1  0.585955  0.830404  0.626231  1
  Al  Al179  1  0.525956  0.151526  0.647170  1
  Al  Al180  1  0.859289  0.818193  0.647170  1
  Al  Al181  1  0.331017  0.362960  0.671984  1
  Al  Al182  1  0.664350  0.029627  0.671984  1
  Al  Al183  1  0.786110  0.386578  0.633174  1
  Al  Al184  1  0.997683  0.696293  0.671984  1
  Al  Al185  1  0.119443  0.053244  0.633174  1
  Al  Al186  1  0.058562  0.375232  0.652270  1
  Al  Al187  1  0.452777  0.719911  0.633174  1
  Al  Al188  1  0.391895  0.041898  0.652270  1
  Al  Al189  1  0.725228  0.708565  0.652270  1
  Al  Al190  1  0.195804  0.247415  0.676508  1
  Al  Al191  1  0.529137  0.914081  0.676508  1
  Al  Al192  1  0.468383  0.228855  0.700138  1
  Al  Al193  1  0.862470  0.580748  0.676508  1
  Al  Al194  1  0.801717  0.895522  0.700138  1
  Al  Al195  1  0.755573  0.207033  0.719017  1
  Al  Al196  1  0.135050  0.562188  0.700138  1
  Al  Al197  1  0.088907  0.873700  0.719017  1
  Al  Al198  1  0.422240  0.540367  0.719017  1
  Al  Al199  1  0.286876  0.427050  0.723832  1
  Al  Al200  1  0.620210  0.093716  0.723832  1
  Al  Al201  1  0.737551  0.458553  0.683937  1
  Al  Al202  1  0.953543  0.760383  0.723832  1
  Al  Al203  1  0.070884  0.125219  0.683937  1
  Al  Al204  1  1.002054  0.446354  0.702738  1
  Al  Al205  1  0.404217  0.791886  0.683937  1
  Al  Al206  1  0.335387  0.113021  0.702738  1
  Al  Al207  1  0.668720  0.779688  0.702738  1
  Al  Al208  1  0.142526  0.327606  0.728724  1
  Al  Al209  1  0.475859  0.994273  0.728724  1
  Al  Al210  1  0.602485  0.353144  0.693095  1
  Al  Al211  1  0.809192  0.660939  0.728724  1
  Al  Al212  1  0.935819  0.019811  0.693095  1
  Al  Al213  1  0.873119  0.338466  0.712581  1
  Al  Al214  1  0.269152  0.686477  0.693095  1
  Al  Al215  1  0.206452  0.005133  0.712581  1
  Al  Al216  1  0.539785  0.671800  0.712581  1
  Ni  Ni217  1  0.599699  0.527221  0.304967  1
  Ni  Ni218  1  0.933032  0.193888  0.304967  1
  Ni  Ni219  1  0.875642  0.515051  0.319310  1
  Ni  Ni220  1  0.266366  0.860554  0.304967  1
  Ni  Ni221  1  0.208976  0.181718  0.319310  1
  Ni  Ni222  1  0.332872  0.540426  0.285578  1
  Ni  Ni223  1  0.542309  0.848384  0.319310  1
  Ni  Ni224  1  0.666206  0.207093  0.285578  1
  Ni  Ni225  1  0.999539  0.873760  0.285578  1
  Ni  Ni226  1  0.582883  0.790595  0.273759  1
  Ni  Ni227  1  0.916216  0.457262  0.273759  1
  Ni  Ni228  1  0.875574  0.774958  0.291517  1
  Ni  Ni229  1  0.249550  0.123929  0.273759  1
  Ni  Ni230  1  0.208908  0.441625  0.291517  1
  Ni  Ni231  1  0.140718  0.763740  0.308670  1
  Ni  Ni232  1  0.542241  0.108292  0.291517  1
  Ni  Ni233  1  0.474052  0.430407  0.308670  1
  Ni  Ni234  1  0.807385  0.097074  0.308670  1
  Ni  Ni235  1  0.423495  0.492334  0.361840  1
  Ni  Ni236  1  0.756829  0.159000  0.361840  1
  Ni  Ni237  1  0.693069  0.480821  0.380378  1
  Ni  Ni238  1  0.090162  0.825667  0.361840  1
  Ni  Ni239  1  0.026402  0.147488  0.380378  1
  Ni  Ni240  1  0.149243  0.504463  0.340334  1
  Ni  Ni241  1  0.359735  0.814154  0.380378  1
  Ni  Ni242  1  0.482576  0.171130  0.340334  1
  Ni  Ni243  1  0.815910  0.837797  0.340334  1
  Ni  Ni244  1  0.410068  0.750341  0.326471  1
  Ni  Ni245  1  0.743401  0.417008  0.326471  1
  Ni  Ni246  1  0.680974  0.735835  0.346347  1
  Ni  Ni247  1  0.076735  0.083675  0.326471  1
  Ni  Ni248  1  0.014308  0.402501  0.346347  1
  Ni  Ni249  1  0.952536  0.720862  0.368744  1
  Ni  Ni250  1  0.347641  0.069168  0.346347  1
  Ni  Ni251  1  0.285869  0.387529  0.368744  1
  Ni  Ni252  1  0.619203  0.054195  0.368744  1
  Ni  Ni253  1  0.233980  0.455302  0.419546  1
  Ni  Ni254  1  0.567313  0.121969  0.419546  1
  Ni  Ni255  1  0.507401  0.443298  0.439541  1
  Ni  Ni256  1  0.900647  0.788636  0.419546  1
  Ni  Ni257  1  0.840735  0.109965  0.439541  1
  Ni  Ni258  1  0.961740  0.468786  0.399402  1
  Ni  Ni259  1  0.174068  0.776632  0.439541  1
  Ni  Ni260  1  0.295073  0.135452  0.399402  1
  Ni  Ni261  1  0.628406  0.802119  0.399402  1
  Ni  Ni262  1  0.224776  0.709140  0.388417  1
  Ni  Ni263  1  0.558109  0.375807  0.388417  1
  Ni  Ni264  1  0.497827  0.698716  0.406806  1
  Ni  Ni265  1  0.891442  0.042474  0.388417  1
  Ni  Ni266  1  0.831161  0.365383  0.406806  1
  Ni  Ni267  1  0.768486  0.685984  0.426517  1
  Ni  Ni268  1  0.164494  0.032050  0.406806  1
  Ni  Ni269  1  0.101819  0.352651  0.426517  1
  Ni  Ni270  1  0.435153  0.019317  0.426517  1
  Ni  Ni271  1  0.049718  0.419084  0.478695  1
  Ni  Ni272  1  0.383052  0.085751  0.478695  1
  Ni  Ni273  1  0.321329  0.406600  0.498485  1
  Ni  Ni274  1  0.716385  0.752417  0.478695  1
  Ni  Ni275  1  0.654663  0.073266  0.498485  1
  Ni  Ni276  1  0.778961  0.431501  0.459128  1
  Ni  Ni277  1  0.987996  0.739933  0.498485  1
  Ni  Ni278  1  0.112295  0.098167  0.459128  1
  Ni  Ni279  1  0.445628  0.764834  0.459128  1
  Ni  Ni280  1  0.039565  0.672929  0.446722  1
  Ni  Ni281  1  0.372898  0.339595  0.446722  1
  Ni  Ni282  1  0.311563  0.660998  0.466323  1
  Ni  Ni283  1  0.706231  0.006262  0.446722  1
  Ni  Ni284  1  0.644896  0.327665  0.466323  1
  Ni  Ni285  1  0.583160  0.649102  0.485763  1
  Ni  Ni286  1  0.978229  0.994332  0.466323  1
  Ni  Ni287  1  0.916493  0.315769  0.485763  1
  Ni  Ni288  1  0.249826  0.982435  0.485763  1
  Ni  Ni289  1  0.864667  0.382284  0.537782  1
  Ni  Ni290  1  0.198000  0.048950  0.537782  1
  Ni  Ni291  1  0.136589  0.370255  0.557362  1
  Ni  Ni292  1  0.531333  0.715617  0.537782  1
  Ni  Ni293  1  0.469922  0.036922  0.557362  1
  Ni  Ni294  1  0.593082  0.394232  0.518305  1
  Ni  Ni295  1  0.803255  0.703589  0.557362  1
  Ni  Ni296  1  0.926416  0.060898  0.518305  1
  Ni  Ni297  1  0.259749  0.727565  0.518305  1
  Ni  Ni298  1  0.854845  0.636685  0.505551  1
  Ni  Ni299  1  0.188179  0.303351  0.505551  1
  Ni  Ni300  1  0.126591  0.624240  0.525377  1
  Ni  Ni301  1  0.521512  0.970018  0.505551  1
  Ni  Ni302  1  0.459924  0.290907  0.525377  1
  Ni  Ni303  1  0.397441  0.611858  0.544968  1
  Ni  Ni304  1  0.793257  0.957573  0.525377  1
  Ni  Ni305  1  0.730774  0.278525  0.544968  1
  Ni  Ni306  1  0.064107  0.945192  0.544968  1
  Ni  Ni307  1  0.678580  0.344662  0.597353  1
  Ni  Ni308  1  0.011914  0.011328  0.597353  1
  Ni  Ni309  1  0.950991  0.333915  0.615853  1
  Ni  Ni310  1  0.345247  0.677995  0.597353  1
  Ni  Ni311  1  0.284325  1.000582  0.615853  1
  Ni  Ni312  1  0.407925  0.357470  0.577450  1
  Ni  Ni313  1  0.617658  0.667249  0.615853  1
  Ni  Ni314  1  0.741258  0.024137  0.577450  1
  Ni  Ni315  1  0.074591  0.690804  0.577450  1
  Ni  Ni316  1  0.668668  0.599941  0.564543  1
  Ni  Ni317  1  1.002001  0.266608  0.564543  1
  Ni  Ni318  1  0.941885  0.588011  0.584466  1
  Ni  Ni319  1  0.335335  0.933275  0.564543  1
  Ni  Ni320  1  0.275219  0.254678  0.584466  1
  Ni  Ni321  1  0.214569  0.574579  0.604564  1
  Ni  Ni322  1  0.608552  0.921344  0.584466  1
  Ni  Ni323  1  0.547902  0.241246  0.604564  1
  Ni  Ni324  1  0.881235  0.907913  0.604564  1
  Ni  Ni325  1  0.495209  0.307279  0.657564  1
  Ni  Ni326  1  0.828542  0.973946  0.657564  1
  Ni  Ni327  1  0.766234  0.293760  0.677307  1
  Ni  Ni328  1  0.161876  0.640613  0.657564  1
  Ni  Ni329  1  0.099567  0.960427  0.677307  1
  Ni  Ni330  1  0.223869  0.322697  0.635033  1
  Ni  Ni331  1  0.432901  0.627094  0.677307  1
  Ni  Ni332  1  0.557202  0.989364  0.635033  1
  Ni  Ni333  1  0.890535  0.656030  0.635033  1
  Ni  Ni334  1  0.483372  0.562676  0.623765  1
  Ni  Ni335  1  0.816705  0.229342  0.623765  1
  Ni  Ni336  1  0.752345  0.550625  0.642443  1
  Ni  Ni337  1  0.150039  0.896009  0.623765  1
  Ni  Ni338  1  0.085678  0.217291  0.642443  1
  Ni  Ni339  1  0.027085  0.539169  0.663375  1
  Ni  Ni340  1  0.419011  0.883958  0.642443  1
  Ni  Ni341  1  0.360418  0.205836  0.663375  1
  Ni  Ni342  1  0.693752  0.872503  0.663375  1
  Ni  Ni343  1  0.301135  0.268930  0.712106  1
  Ni  Ni344  1  0.634468  0.935596  0.712106  1
  Ni  Ni345  1  0.592756  0.252294  0.729960  1
  Ni  Ni346  1  0.967802  0.602263  0.712106  1
  Ni  Ni347  1  0.926089  0.918960  0.729960  1
  Ni  Ni348  1  0.035989  0.279664  0.695479  1
  Ni  Ni349  1  0.259422  0.585627  0.729960  1
  Ni  Ni350  1  0.369322  0.946331  0.695479  1
  Ni  Ni351  1  0.702655  0.612997  0.695479  1
  Ni  Ni352  1  0.300717  0.527886  0.684513  1
  Ni  Ni353  1  0.634050  0.194552  0.684513  1
  Ni  Ni354  1  0.578980  0.516619  0.700220  1
  Ni  Ni355  1  0.967384  0.861219  0.684513  1
  Ni  Ni356  1  0.912313  0.183286  0.700220  1
  Ni  Ni357  1  0.841887  0.505874  0.718215  1
  Ni  Ni358  1  0.245646  0.849953  0.700220  1
  Ni  Ni359  1  0.175220  0.172541  0.718215  1
  Ni  Ni360  1  0.508554  0.839207  0.718215  1
