# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.59436046
_cell_length_b   13.04306022
_cell_length_c   49.78046500
_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   4930.93928671
_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  0.502861  0.393882  0.282470  1
  Al  Al2  1  0.502861  0.655381  0.313630  1
  Al  Al3  1  0.502861  0.902805  0.363811  1
  Al  Al4  1  0.788783  0.521778  0.300934  1
  Al  Al5  1  0.782048  0.784687  0.340397  1
  Al  Al6  1  0.779114  0.043653  0.376717  1
  Al  Al7  1  0.216939  0.521778  0.300934  1
  Al  Al8  1  0.223673  0.784687  0.340397  1
  Al  Al9  1  0.226607  0.043653  0.376717  1
  Al  Al10  1  1.002861  0.290718  0.337898  1
  Al  Al11  1  1.002861  0.552136  0.372308  1
  Al  Al12  1  1.002861  0.013563  0.307985  1
  Al  Al13  1  0.279702  0.414797  0.356398  1
  Al  Al14  1  0.285826  0.893012  0.287243  1
  Al  Al15  1  0.274395  0.151576  0.322540  1
  Al  Al16  1  0.726020  0.414797  0.356398  1
  Al  Al17  1  0.719895  0.893012  0.287243  1
  Al  Al18  1  0.731327  0.151576  0.322540  1
  Al  Al19  1  0.502861  0.180404  0.390589  1
  Al  Al20  1  0.502861  0.428304  0.431643  1
  Al  Al21  1  0.502861  0.675334  0.472627  1
  Al  Al22  1  0.781541  0.301039  0.413209  1
  Al  Al23  1  0.781693  0.555926  0.450144  1
  Al  Al24  1  0.778565  0.811833  0.486904  1
  Al  Al25  1  0.224181  0.301039  0.413209  1
  Al  Al26  1  0.224028  0.555926  0.450144  1
  Al  Al27  1  0.227156  0.811833  0.486904  1
  Al  Al28  1  1.002861  0.067811  0.445808  1
  Al  Al29  1  1.002861  0.306610  0.491294  1
  Al  Al30  1  1.002861  0.789874  0.418537  1
  Al  Al31  1  0.282219  0.184483  0.469776  1
  Al  Al32  1  0.284908  0.672249  0.393110  1
  Al  Al33  1  0.278806  0.928878  0.432176  1
  Al  Al34  1  0.723502  0.184483  0.469776  1
  Al  Al35  1  0.720814  0.672249  0.393110  1
  Al  Al36  1  0.726916  0.928878  0.432176  1
  Al  Al37  1  0.502861  0.950371  0.500881  1
  Al  Al38  1  0.502861  0.186968  0.549226  1
  Al  Al39  1  0.502861  0.451870  0.580775  1
  Al  Al40  1  0.781594  0.067926  0.525466  1
  Al  Al41  1  0.778858  0.322712  0.563660  1
  Al  Al42  1  0.778933  0.579408  0.599441  1
  Al  Al43  1  0.224127  0.067926  0.525466  1
  Al  Al44  1  0.226864  0.322712  0.563660  1
  Al  Al45  1  0.226789  0.579408  0.599441  1
  Al  Al46  1  1.002861  0.832281  0.557490  1
  Al  Al47  1  1.002861  0.068243  0.604858  1
  Al  Al48  1  1.002861  0.564420  0.527124  1
  Al  Al49  1  0.281736  0.950339  0.580429  1
  Al  Al50  1  0.280023  0.439592  0.507003  1
  Al  Al51  1  0.278571  0.696253  0.543083  1
  Al  Al52  1  0.723985  0.950339  0.580429  1
  Al  Al53  1  0.725698  0.439592  0.507003  1
  Al  Al54  1  0.727150  0.696253  0.543083  1
  Al  Al55  1  0.502861  0.712759  0.615040  1
  Al  Al56  1  0.502861  0.955926  0.658586  1
  Al  Al57  1  0.502861  0.243428  0.687870  1
  Al  Al58  1  0.784915  0.834617  0.638122  1
  Al  Al59  1  0.774766  0.091714  0.670989  1
  Al  Al60  1  0.787924  0.355405  0.709822  1
  Al  Al61  1  0.220807  0.834617  0.638122  1
  Al  Al62  1  0.230956  0.091714  0.670989  1
  Al  Al63  1  0.217797  0.355405  0.709822  1
  Al  Al64  1  1.002861  0.605301  0.668549  1
  Al  Al65  1  1.002861  0.860329  0.715743  1
  Al  Al66  1  1.002861  0.338963  0.635479  1
  Al  Al67  1  0.288403  0.723988  0.692541  1
  Al  Al68  1  0.277920  0.206013  0.619409  1
  Al  Al69  1  0.287391  0.462075  0.656337  1
  Al  Al70  1  0.717318  0.723988  0.692541  1
  Al  Al71  1  0.727801  0.206013  0.619409  1
  Al  Al72  1  0.718330  0.462075  0.656337  1
  Ni  Ni73  1  0.502861  0.279445  0.340719  1
  Ni  Ni74  1  0.502861  0.540162  0.375505  1
  Ni  Ni75  1  0.502861  0.026509  0.304196  1
  Ni  Ni76  1  0.236742  0.231008  0.366993  1
  Ni  Ni77  1  0.220129  0.711694  0.296236  1
  Ni  Ni78  1  0.275907  0.966049  0.331911  1
  Ni  Ni79  1  0.768979  0.231008  0.366993  1
  Ni  Ni80  1  0.785592  0.711694  0.296236  1
  Ni  Ni81  1  0.729815  0.966049  0.331911  1
  Ni  Ni82  1  0.502861  0.360117  0.387345  1
  Ni  Ni83  1  0.502861  0.840798  0.318501  1
  Ni  Ni84  1  0.502861  0.082020  0.349799  1
  Ni  Ni85  1  0.502861  0.472658  0.325674  1
  Ni  Ni86  1  0.502861  0.719245  0.359313  1
  Ni  Ni87  1  0.502861  0.219448  0.295879  1
  Ni  Ni88  1  1.002861  0.378538  0.291678  1
  Ni  Ni89  1  1.002861  0.650064  0.324826  1
  Ni  Ni90  1  1.002861  0.921082  0.354220  1
  Ni  Ni91  1  0.739066  0.335086  0.311456  1
  Ni  Ni92  1  0.734794  0.598682  0.344978  1
  Ni  Ni93  1  0.778571  0.857481  0.386429  1
  Ni  Ni94  1  0.266655  0.335086  0.311456  1
  Ni  Ni95  1  0.270927  0.598682  0.344978  1
  Ni  Ni96  1  0.227150  0.857481  0.386429  1
  Ni  Ni97  1  1.002861  0.466573  0.331604  1
  Ni  Ni98  1  1.002861  0.735176  0.371786  1
  Ni  Ni99  1  1.002861  0.203096  0.297321  1
  Ni  Ni100  1  1.002861  0.367468  0.382419  1
  Ni  Ni101  1  1.002861  0.830648  0.307711  1
  Ni  Ni102  1  1.002861  0.112586  0.347923  1
  Ni  Ni103  1  0.502861  0.050339  0.453991  1
  Ni  Ni104  1  0.502861  0.314170  0.486962  1
  Ni  Ni105  1  0.502861  0.806676  0.410111  1
  Ni  Ni106  1  0.228636  0.999951  0.478252  1
  Ni  Ni107  1  0.247552  0.486862  0.402858  1
  Ni  Ni108  1  0.276539  0.739752  0.440598  1
  Ni  Ni109  1  0.777085  0.999951  0.478252  1
  Ni  Ni110  1  0.758169  0.486862  0.402858  1
  Ni  Ni111  1  0.729183  0.739752  0.440598  1
  Ni  Ni112  1  0.502861  0.133341  0.502506  1
  Ni  Ni113  1  0.502861  0.613669  0.425547  1
  Ni  Ni114  1  0.502861  0.853669  0.459895  1
  Ni  Ni115  1  0.502861  0.242767  0.437638  1
  Ni  Ni116  1  0.502861  0.495631  0.475986  1
  Ni  Ni117  1  0.502861  0.002962  0.404101  1
  Ni  Ni118  1  1.002861  0.166488  0.397776  1
  Ni  Ni119  1  1.002861  0.428926  0.431691  1
  Ni  Ni120  1  1.002861  0.689567  0.465918  1
  Ni  Ni121  1  0.730163  0.116900  0.422714  1
  Ni  Ni122  1  0.758784  0.370331  0.460369  1
  Ni  Ni123  1  0.769199  0.624373  0.496785  1
  Ni  Ni124  1  0.275558  0.116900  0.422714  1
  Ni  Ni125  1  0.246937  0.370331  0.460369  1
  Ni  Ni126  1  0.236522  0.624373  0.496785  1
  Ni  Ni127  1  1.002861  0.249422  0.445515  1
  Ni  Ni128  1  1.002861  0.492141  0.481440  1
  Ni  Ni129  1  1.002861  0.969951  0.405020  1
  Ni  Ni130  1  1.002861  0.121880  0.493188  1
  Ni  Ni131  1  1.002861  0.608741  0.417899  1
  Ni  Ni132  1  1.002861  0.888197  0.459193  1
  Ni  Ni133  1  0.502861  0.817465  0.564555  1
  Ni  Ni134  1  0.502861  0.084743  0.596851  1
  Ni  Ni135  1  0.502861  0.571738  0.523264  1
  Ni  Ni136  1  0.234864  0.765718  0.589992  1
  Ni  Ni137  1  0.268952  0.253728  0.517230  1
  Ni  Ni138  1  0.257288  0.509300  0.553160  1
  Ni  Ni139  1  0.770858  0.765718  0.589992  1
  Ni  Ni140  1  0.736769  0.253728  0.517230  1
  Ni  Ni141  1  0.748433  0.509300  0.553160  1
  Ni  Ni142  1  0.502861  0.895232  0.612638  1
  Ni  Ni143  1  0.502861  0.370842  0.536865  1
  Ni  Ni144  1  0.502861  0.629880  0.572178  1
  Ni  Ni145  1  0.502861  0.002866  0.548057  1
  Ni  Ni146  1  0.502861  0.275442  0.591394  1
  Ni  Ni147  1  0.502861  0.768972  0.514281  1
  Ni  Ni148  1  1.002861  0.933513  0.509358  1
  Ni  Ni149  1  1.002861  0.200304  0.541886  1
  Ni  Ni150  1  1.002861  0.450819  0.581498  1
  Ni  Ni151  1  0.731282  0.882385  0.533145  1
  Ni  Ni152  1  0.774557  0.136087  0.573051  1
  Ni  Ni153  1  0.744122  0.393646  0.609943  1
  Ni  Ni154  1  0.274439  0.882385  0.533145  1
  Ni  Ni155  1  0.231164  0.136087  0.573051  1
  Ni  Ni156  1  0.261600  0.393646  0.609943  1
  Ni  Ni157  1  1.002861  0.015998  0.557783  1
  Ni  Ni158  1  1.002861  0.251349  0.592642  1
  Ni  Ni159  1  1.002861  0.741838  0.515515  1
  Ni  Ni160  1  1.002861  0.885243  0.604730  1
  Ni  Ni161  1  1.002861  0.386352  0.534115  1
  Ni  Ni162  1  1.002861  0.649917  0.570310  1
  Ni  Ni163  1  0.502861  0.594473  0.671722  1
  Ni  Ni164  1  0.502861  0.866262  0.701733  1
  Ni  Ni165  1  0.502861  0.329214  0.640055  1
  Ni  Ni166  1  0.229018  0.541401  0.699541  1
  Ni  Ni167  1  0.275590  0.017182  0.626945  1
  Ni  Ni168  1  0.232236  0.278590  0.665453  1
  Ni  Ni169  1  0.776703  0.541401  0.699541  1
  Ni  Ni170  1  0.730132  0.017182  0.626945  1
  Ni  Ni171  1  0.773485  0.278590  0.665453  1
  Ni  Ni172  1  0.502861  0.600866  0.715869  1
  Ni  Ni173  1  0.502861  0.137549  0.648106  1
  Ni  Ni174  1  0.502861  0.436681  0.693897  1
  Ni  Ni175  1  0.502861  0.775140  0.660270  1
  Ni  Ni176  1  0.502861  0.055268  0.698915  1
  Ni  Ni177  1  0.502861  0.528374  0.625053  1
  Ni  Ni178  1  1.002861  0.702510  0.620733  1
  Ni  Ni179  1  1.002861  0.969711  0.653468  1
  Ni  Ni180  1  1.002861  0.221565  0.692314  1
  Ni  Ni181  1  0.736676  0.649899  0.645628  1
  Ni  Ni182  1  0.774965  0.912934  0.684266  1
  Ni  Ni183  1  0.747045  0.165243  0.713227  1
  Ni  Ni184  1  0.269046  0.649899  0.645628  1
  Ni  Ni185  1  0.230757  0.912934  0.684266  1
  Ni  Ni186  1  0.258676  0.165243  0.713227  1
  Ni  Ni187  1  1.002861  0.788362  0.672176  1
  Ni  Ni188  1  1.002861  0.040310  0.701109  1
  Ni  Ni189  1  1.002861  0.514343  0.628577  1
  Ni  Ni190  1  1.002861  0.668894  0.712422  1
  Ni  Ni191  1  1.002861  0.163136  0.645713  1
  Ni  Ni192  1  1.002861  0.419923  0.679043  1
