# generated using pymatgen
data_Al3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97297149
_cell_length_b   16.35291178
_cell_length_c   47.28792484
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni2
_chemical_formula_sum   'Al63 Ni42'
_cell_volume   3072.28003546
_cell_formula_units_Z   21
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  0.488665  0.278384  0.289277  1
  Al  Al2  1  0.988665  0.654725  0.270855  1
  Al  Al3  1  0.988665  0.907995  0.312933  1
  Al  Al4  1  0.488665  0.519575  0.274644  1
  Al  Al5  1  0.488665  0.786801  0.316686  1
  Al  Al6  1  0.988665  0.151652  0.295846  1
  Al  Al7  1  0.988665  0.400707  0.284766  1
  Al  Al8  1  0.988665  0.669537  0.329677  1
  Al  Al9  1  0.488665  0.037544  0.307004  1
  Al  Al10  1  0.988665  0.181902  0.355803  1
  Al  Al11  1  0.488665  0.542345  0.334598  1
  Al  Al12  1  0.488665  0.818430  0.378149  1
  Al  Al13  1  0.988665  0.423378  0.341753  1
  Al  Al14  1  0.988665  0.695966  0.386692  1
  Al  Al15  1  0.488665  0.060008  0.363641  1
  Al  Al16  1  0.488665  0.307205  0.349617  1
  Al  Al17  1  0.488665  0.579197  0.394320  1
  Al  Al18  1  0.988665  0.942641  0.371520  1
  Al  Al19  1  0.488665  0.093390  0.423258  1
  Al  Al20  1  0.988665  0.456035  0.401513  1
  Al  Al21  1  0.988665  0.730457  0.446009  1
  Al  Al22  1  0.488665  0.332446  0.408234  1
  Al  Al23  1  0.488665  0.606299  0.452642  1
  Al  Al24  1  0.988665  0.969800  0.429990  1
  Al  Al25  1  0.988665  0.215876  0.416137  1
  Al  Al26  1  0.988665  0.489074  0.461311  1
  Al  Al27  1  0.488665  0.852950  0.438536  1
  Al  Al28  1  0.988665  0.001955  0.490218  1
  Al  Al29  1  0.488665  0.365786  0.468171  1
  Al  Al30  1  0.488665  0.638544  0.512773  1
  Al  Al31  1  0.988665  0.242214  0.474742  1
  Al  Al32  1  0.988665  0.515240  0.519579  1
  Al  Al33  1  0.488665  0.878813  0.497032  1
  Al  Al34  1  0.488665  0.125260  0.483373  1
  Al  Al35  1  0.488665  0.398202  0.528233  1
  Al  Al36  1  0.988665  0.761806  0.506095  1
  Al  Al37  1  0.488665  0.910788  0.557249  1
  Al  Al38  1  0.988665  0.274667  0.534817  1
  Al  Al39  1  0.988665  0.547065  0.579622  1
  Al  Al40  1  0.488665  0.151422  0.541649  1
  Al  Al41  1  0.488665  0.424524  0.586763  1
  Al  Al42  1  0.988665  0.787917  0.564533  1
  Al  Al43  1  0.988665  0.034351  0.550387  1
  Al  Al44  1  0.988665  0.307855  0.594722  1
  Al  Al45  1  0.488665  0.670968  0.572910  1
  Al  Al46  1  0.988665  0.821757  0.624836  1
  Al  Al47  1  0.488665  0.183708  0.601509  1
  Al  Al48  1  0.488665  0.458799  0.646970  1
  Al  Al49  1  0.988665  0.061051  0.608715  1
  Al  Al50  1  0.988665  0.333103  0.653280  1
  Al  Al51  1  0.488665  0.697964  0.631291  1
  Al  Al52  1  0.488665  0.944475  0.617059  1
  Al  Al53  1  0.488665  0.216937  0.661078  1
  Al  Al54  1  0.988665  0.580528  0.639112  1
  Al  Al55  1  0.488665  0.731715  0.689679  1
  Al  Al56  1  0.988665  0.097650  0.667945  1
  Al  Al57  1  0.988665  0.362766  0.713550  1
  Al  Al58  1  0.488665  0.970763  0.674750  1
  Al  Al59  1  0.488665  0.241981  0.717842  1
  Al  Al60  1  0.988665  0.602403  0.695753  1
  Al  Al61  1  0.988665  0.853170  0.685621  1
  Al  Al62  1  0.988665  0.125171  0.726913  1
  Al  Al63  1  0.488665  0.488841  0.706970  1
  Ni  Ni64  1  0.988665  0.284151  0.319056  1
  Ni  Ni65  1  0.488665  0.645309  0.299768  1
  Ni  Ni66  1  0.988665  0.007017  0.277842  1
  Ni  Ni67  1  0.988665  0.541596  0.304728  1
  Ni  Ni68  1  0.488665  0.910910  0.284395  1
  Ni  Ni69  1  0.488665  0.176998  0.326506  1
  Ni  Ni70  1  0.488665  0.193861  0.385062  1
  Ni  Ni71  1  0.988665  0.556202  0.363714  1
  Ni  Ni72  1  0.488665  0.919587  0.340443  1
  Ni  Ni73  1  0.488665  0.444838  0.372769  1
  Ni  Ni74  1  0.988665  0.808151  0.349638  1
  Ni  Ni75  1  0.988665  0.082455  0.394057  1
  Ni  Ni76  1  0.988665  0.102838  0.452371  1
  Ni  Ni77  1  0.488665  0.466267  0.430397  1
  Ni  Ni78  1  0.988665  0.830309  0.407563  1
  Ni  Ni79  1  0.988665  0.355304  0.439128  1
  Ni  Ni80  1  0.488665  0.719439  0.416797  1
  Ni  Ni81  1  0.488665  0.992235  0.461031  1
  Ni  Ni82  1  0.488665  0.011797  0.519399  1
  Ni  Ni83  1  0.988665  0.375576  0.497171  1
  Ni  Ni84  1  0.488665  0.739516  0.474965  1
  Ni  Ni85  1  0.488665  0.264868  0.505803  1
  Ni  Ni86  1  0.988665  0.628817  0.483618  1
  Ni  Ni87  1  0.988665  0.901184  0.528156  1
  Ni  Ni88  1  0.988665  0.921288  0.586492  1
  Ni  Ni89  1  0.488665  0.284921  0.563918  1
  Ni  Ni90  1  0.988665  0.648375  0.541949  1
  Ni  Ni91  1  0.988665  0.174126  0.572601  1
  Ni  Ni92  1  0.488665  0.537708  0.550580  1
  Ni  Ni93  1  0.488665  0.810719  0.595491  1
  Ni  Ni94  1  0.488665  0.832598  0.653365  1
  Ni  Ni95  1  0.988665  0.195631  0.630130  1
  Ni  Ni96  1  0.488665  0.558155  0.608736  1
  Ni  Ni97  1  0.488665  0.083317  0.639591  1
  Ni  Ni98  1  0.988665  0.446490  0.617800  1
  Ni  Ni99  1  0.988665  0.720286  0.662346  1
  Ni  Ni100  1  0.988665  0.728999  0.718035  1
  Ni  Ni101  1  0.488665  0.100250  0.697754  1
  Ni  Ni102  1  0.988665  0.463484  0.676198  1
  Ni  Ni103  1  0.988665  0.996809  0.703652  1
  Ni  Ni104  1  0.488665  0.356755  0.683619  1
  Ni  Ni105  1  0.488665  0.633366  0.724929  1
