# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.98226234
_cell_length_b   23.41160709
_cell_length_c   52.51317771
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni5
_chemical_formula_sum   'Al72 Ni120'
_cell_volume   4895.8645347
_cell_formula_units_Z   24
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  1.002210  0.709125  0.336499  1
  Al  Al2  1  1.002210  0.119648  0.372991  1
  Al  Al3  1  1.002210  0.295496  0.298852  1
  Al  Al4  1  0.502210  0.647739  0.306018  1
  Al  Al5  1  0.502210  0.059533  0.344811  1
  Al  Al6  1  0.502210  0.470182  0.380718  1
  Al  Al7  1  0.502210  0.768649  0.364000  1
  Al  Al8  1  0.502210  0.951305  0.290369  1
  Al  Al9  1  0.502210  0.358210  0.328109  1
  Al  Al10  1  1.002210  0.914765  0.354524  1
  Al  Al11  1  1.002210  0.087717  0.281239  1
  Al  Al12  1  1.002210  0.502152  0.316543  1
  Al  Al13  1  0.502210  0.852755  0.323871  1
  Al  Al14  1  0.502210  0.264706  0.362201  1
  Al  Al15  1  0.502210  0.446839  0.288069  1
  Al  Al16  1  0.502210  0.974219  0.382905  1
  Al  Al17  1  0.502210  0.152609  0.309409  1
  Al  Al18  1  0.502210  0.563688  0.346421  1
  Al  Al19  1  1.002210  0.941466  0.447068  1
  Al  Al20  1  1.002210  0.352244  0.484119  1
  Al  Al21  1  1.002210  0.530429  0.409778  1
  Al  Al22  1  0.502210  0.880892  0.417783  1
  Al  Al23  1  0.502210  0.291929  0.455252  1
  Al  Al24  1  0.502210  0.702712  0.492337  1
  Al  Al25  1  0.502210  0.001546  0.475907  1
  Al  Al26  1  0.502210  0.180064  0.401864  1
  Al  Al27  1  0.502210  0.590823  0.438866  1
  Al  Al28  1  1.002210  0.146753  0.465707  1
  Al  Al29  1  1.002210  0.325048  0.391336  1
  Al  Al30  1  1.002210  0.736114  0.428505  1
  Al  Al31  1  0.502210  0.086441  0.436951  1
  Al  Al32  1  0.502210  0.497328  0.473779  1
  Al  Al33  1  0.502210  0.675547  0.399381  1
  Al  Al34  1  0.502210  0.207116  0.494561  1
  Al  Al35  1  0.502210  0.385523  0.420202  1
  Al  Al36  1  0.502210  0.796197  0.457194  1
  Al  Al37  1  1.002210  0.173842  0.558327  1
  Al  Al38  1  1.002210  0.584774  0.595695  1
  Al  Al39  1  1.002210  0.763111  0.521219  1
  Al  Al40  1  0.502210  0.113586  0.529613  1
  Al  Al41  1  0.502210  0.524375  0.566659  1
  Al  Al42  1  0.502210  0.935156  0.603605  1
  Al  Al43  1  0.502210  0.234328  0.587479  1
  Al  Al44  1  0.502210  0.412549  0.512978  1
  Al  Al45  1  0.502210  0.823348  0.550088  1
  Al  Al46  1  1.002210  0.379328  0.576811  1
  Al  Al47  1  1.002210  0.557623  0.502744  1
  Al  Al48  1  1.002210  0.968491  0.539911  1
  Al  Al49  1  0.502210  0.319061  0.548076  1
  Al  Al50  1  0.502210  0.729719  0.585094  1
  Al  Al51  1  0.502210  0.908131  0.510862  1
  Al  Al52  1  0.502210  0.439569  0.605843  1
  Al  Al53  1  0.502210  0.617920  0.531651  1
  Al  Al54  1  0.502210  0.028758  0.568791  1
  Al  Al55  1  1.002210  0.406904  0.668654  1
  Al  Al56  1  1.002210  0.818743  0.706458  1
  Al  Al57  1  1.002210  0.995672  0.633203  1
  Al  Al58  1  0.502210  0.346460  0.641091  1
  Al  Al59  1  0.502210  0.756604  0.677144  1
  Al  Al60  1  0.502210  0.163881  0.713822  1
  Al  Al61  1  0.502210  0.465131  0.698489  1
  Al  Al62  1  0.502210  0.644845  0.624587  1
  Al  Al63  1  0.502210  0.055982  0.661297  1
  Al  Al64  1  1.002210  0.614386  0.688328  1
  Al  Al65  1  1.002210  0.790325  0.614015  1
  Al  Al66  1  1.002210  0.200709  0.650694  1
  Al  Al67  1  0.502210  0.550925  0.659144  1
  Al  Al68  1  0.502210  0.961090  0.695664  1
  Al  Al69  1  0.502210  0.140741  0.622336  1
  Al  Al70  1  0.502210  0.668091  0.716840  1
  Al  Al71  1  0.502210  0.850580  0.643120  1
  Al  Al72  1  0.502210  0.262206  0.681255  1
  Ni  Ni73  1  1.002210  0.800558  0.300597  1
  Ni  Ni74  1  1.002210  0.208748  0.336234  1
  Ni  Ni75  1  1.002210  0.619990  0.373196  1
  Ni  Ni76  1  1.002210  0.903227  0.309058  1
  Ni  Ni77  1  1.002210  0.311436  0.345031  1
  Ni  Ni78  1  1.002210  0.723029  0.382275  1
  Ni  Ni79  1  1.002210  0.016907  0.363428  1
  Ni  Ni80  1  1.002210  0.193844  0.290813  1
  Ni  Ni81  1  1.002210  0.606158  0.327652  1
  Ni  Ni82  1  0.502210  0.076245  0.391266  1
  Ni  Ni83  1  0.502210  0.253891  0.316452  1
  Ni  Ni84  1  0.502210  0.664959  0.353301  1
  Ni  Ni85  1  0.502210  0.749614  0.317001  1
  Ni  Ni86  1  0.502210  0.163027  0.355113  1
  Ni  Ni87  1  0.502210  0.343727  0.282749  1
  Ni  Ni88  1  1.002210  0.592109  0.283105  1
  Ni  Ni89  1  1.002210  0.003796  0.316521  1
  Ni  Ni90  1  1.002210  0.414125  0.353698  1
  Ni  Ni91  1  1.002210  0.698174  0.291114  1
  Ni  Ni92  1  1.002210  0.105881  0.327038  1
  Ni  Ni93  1  1.002210  0.516786  0.363127  1
  Ni  Ni94  1  1.002210  0.812612  0.345693  1
  Ni  Ni95  1  1.002210  0.222477  0.382190  1
  Ni  Ni96  1  1.002210  0.398919  0.307308  1
  Ni  Ni97  1  0.502210  0.870225  0.371470  1
  Ni  Ni98  1  0.502210  0.050571  0.300479  1
  Ni  Ni99  1  0.502210  0.460150  0.334895  1
  Ni  Ni100  1  0.502210  0.957436  0.336130  1
  Ni  Ni101  1  0.502210  0.368417  0.373463  1
  Ni  Ni102  1  0.502210  0.546977  0.300717  1
  Ni  Ni103  1  1.002210  0.030569  0.409964  1
  Ni  Ni104  1  1.002210  0.441403  0.446892  1
  Ni  Ni105  1  1.002210  0.852290  0.484101  1
  Ni  Ni106  1  1.002210  0.133190  0.419358  1
  Ni  Ni107  1  1.002210  0.544056  0.456284  1
  Ni  Ni108  1  1.002210  0.954961  0.493469  1
  Ni  Ni109  1  1.002210  0.249505  0.474901  1
  Ni  Ni110  1  1.002210  0.427787  0.400364  1
  Ni  Ni111  1  1.002210  0.838903  0.437713  1
  Ni  Ni112  1  0.502210  0.308902  0.502199  1
  Ni  Ni113  1  0.502210  0.487258  0.427836  1
  Ni  Ni114  1  0.502210  0.897895  0.464919  1
  Ni  Ni115  1  0.502210  0.984599  0.428849  1
  Ni  Ni116  1  0.502210  0.395590  0.466043  1
  Ni  Ni117  1  0.502210  0.573763  0.392066  1
  Ni  Ni118  1  1.002210  0.825725  0.391499  1
  Ni  Ni119  1  1.002210  0.235977  0.428538  1
  Ni  Ni120  1  1.002210  0.646809  0.465643  1
  Ni  Ni121  1  1.002210  0.928192  0.400760  1
  Ni  Ni122  1  1.002210  0.338691  0.437740  1
  Ni  Ni123  1  1.002210  0.749577  0.474841  1
  Ni  Ni124  1  1.002210  0.044051  0.456430  1
  Ni  Ni125  1  1.002210  0.454960  0.493381  1
  Ni  Ni126  1  1.002210  0.633296  0.419301  1
  Ni  Ni127  1  0.502210  0.103368  0.483790  1
  Ni  Ni128  1  0.502210  0.281797  0.409345  1
  Ni  Ni129  1  0.502210  0.692554  0.446437  1
  Ni  Ni130  1  0.502210  0.190144  0.447679  1
  Ni  Ni131  1  0.502210  0.600936  0.484711  1
  Ni  Ni132  1  0.502210  0.779062  0.410109  1
  Ni  Ni133  1  1.002210  0.263035  0.521269  1
  Ni  Ni134  1  1.002210  0.673923  0.558476  1
  Ni  Ni135  1  1.002210  0.084578  0.595609  1
  Ni  Ni136  1  1.002210  0.365787  0.530489  1
  Ni  Ni137  1  1.002210  0.776661  0.567610  1
  Ni  Ni138  1  1.002210  0.187104  0.604555  1
  Ni  Ni139  1  1.002210  0.482089  0.586406  1
  Ni  Ni140  1  1.002210  0.660356  0.512036  1
  Ni  Ni141  1  1.002210  0.071127  0.549196  1
  Ni  Ni142  1  0.502210  0.541109  0.613540  1
  Ni  Ni143  1  0.502210  0.719699  0.539262  1
  Ni  Ni144  1  0.502210  0.130639  0.576519  1
  Ni  Ni145  1  0.502210  0.217330  0.540432  1
  Ni  Ni146  1  0.502210  0.627949  0.577546  1
  Ni  Ni147  1  0.502210  0.806372  0.503104  1
  Ni  Ni148  1  1.002210  0.057589  0.502812  1
  Ni  Ni149  1  1.002210  0.468526  0.539873  1
  Ni  Ni150  1  1.002210  0.879388  0.576910  1
  Ni  Ni151  1  1.002210  0.160290  0.512030  1
  Ni  Ni152  1  1.002210  0.571228  0.549200  1
  Ni  Ni153  1  1.002210  0.982100  0.586449  1
  Ni  Ni154  1  1.002210  0.276487  0.567622  1
  Ni  Ni155  1  1.002210  0.687500  0.604950  1
  Ni  Ni156  1  1.002210  0.865830  0.530509  1
  Ni  Ni157  1  0.502210  0.336102  0.595063  1
  Ni  Ni158  1  0.502210  0.514270  0.520776  1
  Ni  Ni159  1  0.502210  0.925087  0.557801  1
  Ni  Ni160  1  0.502210  0.422694  0.558836  1
  Ni  Ni161  1  0.502210  0.833455  0.595987  1
  Ni  Ni162  1  0.502210  0.011775  0.521818  1
  Ni  Ni163  1  1.002210  0.495539  0.633174  1
  Ni  Ni164  1  1.002210  0.906961  0.669066  1
  Ni  Ni165  1  1.002210  0.314533  0.704778  1
  Ni  Ni166  1  1.002210  0.598482  0.642198  1
  Ni  Ni167  1  1.002210  0.010020  0.679913  1
  Ni  Ni168  1  1.002210  0.416580  0.713868  1
  Ni  Ni169  1  1.002210  0.716301  0.697966  1
  Ni  Ni170  1  1.002210  0.893010  0.623274  1
  Ni  Ni171  1  1.002210  0.303008  0.659654  1
  Ni  Ni172  1  0.502210  0.771055  0.722602  1
  Ni  Ni173  1  0.502210  0.952135  0.650156  1
  Ni  Ni174  1  0.502210  0.364462  0.687775  1
  Ni  Ni175  1  0.502210  0.449849  0.651618  1
  Ni  Ni176  1  0.502210  0.860190  0.688718  1
  Ni  Ni177  1  0.502210  0.038660  0.614705  1
  Ni  Ni178  1  1.002210  0.289694  0.613830  1
  Ni  Ni179  1  1.002210  0.701329  0.651543  1
  Ni  Ni180  1  1.002210  0.112819  0.688073  1
  Ni  Ni181  1  1.002210  0.392582  0.623021  1
  Ni  Ni182  1  1.002210  0.803986  0.660316  1
  Ni  Ni183  1  1.002210  0.212451  0.696102  1
  Ni  Ni184  1  1.002210  0.510173  0.680082  1
  Ni  Ni185  1  1.002210  0.919651  0.714120  1
  Ni  Ni186  1  1.002210  0.098282  0.641948  1
  Ni  Ni187  1  0.502210  0.566213  0.704875  1
  Ni  Ni188  1  0.502210  0.746756  0.631788  1
  Ni  Ni189  1  0.502210  0.158457  0.668513  1
  Ni  Ni190  1  0.502210  0.655030  0.670107  1
  Ni  Ni191  1  0.502210  0.062313  0.706232  1
  Ni  Ni192  1  0.502210  0.244907  0.633687  1
