# generated using pymatgen
data_Al3Ni2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   14.38853019
_cell_length_b   6.35179972
_cell_length_c   45.29533495
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   64.06351302
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al3Ni2
_chemical_formula_sum   'Al72 Ni48'
_cell_volume   3722.72850724
_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  0.284376  0.728377  0.278459  1
  Al  Al2  1  0.567476  0.652741  0.294739  1
  Al  Al3  1  0.854693  0.539813  0.312933  1
  Al  Al4  1  0.478089  0.312338  0.289985  1
  Al  Al5  1  0.764130  0.240322  0.307275  1
  Al  Al6  1  0.051930  0.144817  0.324177  1
  Al  Al7  1  0.369298  0.036849  0.287406  1
  Al  Al8  1  0.668450  0.942268  0.304068  1
  Al  Al9  1  0.953724  0.860148  0.324108  1
  Al  Al10  1  0.145382  0.445577  0.332510  1
  Al  Al11  1  0.429316  0.369380  0.351053  1
  Al  Al12  1  0.713709  0.283927  0.368806  1
  Al  Al13  1  0.334919  0.059731  0.344918  1
  Al  Al14  1  0.618589  0.981207  0.362034  1
  Al  Al15  1  0.904584  0.889503  0.380800  1
  Al  Al16  1  0.234701  0.775589  0.340445  1
  Al  Al17  1  0.519506  0.692979  0.358680  1
  Al  Al18  1  0.804716  0.609311  0.376219  1
  Al  Al19  1  0.998617  0.202129  0.387875  1
  Al  Al20  1  0.283366  0.121637  0.407117  1
  Al  Al21  1  0.569127  0.036473  0.425627  1
  Al  Al22  1  0.190857  0.803472  0.400023  1
  Al  Al23  1  0.476460  0.720407  0.418570  1
  Al  Al24  1  0.761775  0.635546  0.436669  1
  Al  Al25  1  0.089651  0.521933  0.394580  1
  Al  Al26  1  0.376540  0.436818  0.414081  1
  Al  Al27  1  0.662236  0.350978  0.432552  1
  Al  Al28  1  0.854149  0.951381  0.443852  1
  Al  Al29  1  0.139741  0.865707  0.462568  1
  Al  Al30  1  0.425551  0.780690  0.481444  1
  Al  Al31  1  0.047510  0.549751  0.455375  1
  Al  Al32  1  0.333214  0.464669  0.474270  1
  Al  Al33  1  0.618311  0.379848  0.492720  1
  Al  Al34  1  0.946701  0.265931  0.450842  1
  Al  Al35  1  0.232300  0.181012  0.469759  1
  Al  Al36  1  0.518356  0.095151  0.488575  1
  Al  Al37  1  0.710955  0.695009  0.499846  1
  Al  Al38  1  0.996378  0.609564  0.518220  1
  Al  Al39  1  0.282268  0.524414  0.537107  1
  Al  Al40  1  0.903508  0.294924  0.511091  1
  Al  Al41  1  0.189672  0.209288  0.529915  1
  Al  Al42  1  0.475298  0.124001  0.548818  1
  Al  Al43  1  0.803642  0.010137  0.506964  1
  Al  Al44  1  0.088741  0.925753  0.525369  1
  Al  Al45  1  0.374457  0.840143  0.544314  1
  Al  Al46  1  0.567799  0.438528  0.555857  1
  Al  Al47  1  0.852838  0.353434  0.574049  1
  Al  Al48  1  0.138450  0.269346  0.592448  1
  Al  Al49  1  0.759651  0.039007  0.567158  1
  Al  Al50  1  0.045379  0.953631  0.585580  1
  Al  Al51  1  0.332538  0.867419  0.605038  1
  Al  Al52  1  0.660152  0.754351  0.563014  1
  Al  Al53  1  0.945502  0.670049  0.581102  1
  Al  Al54  1  0.231060  0.586583  0.599730  1
  Al  Al55  1  0.423249  0.187673  0.611889  1
  Al  Al56  1  0.708146  0.106531  0.630909  1
  Al  Al57  1  0.993106  0.020828  0.648252  1
  Al  Al58  1  0.617132  0.780261  0.623498  1
  Al  Al59  1  0.903868  0.696864  0.641212  1
  Al  Al60  1  0.186550  0.614366  0.658787  1
  Al  Al61  1  0.517423  0.499885  0.618937  1
  Al  Al62  1  0.804185  0.408238  0.637739  1
  Al  Al63  1  0.085940  0.332092  0.654506  1
  Al  Al64  1  0.276313  0.943399  0.666942  1
  Al  Al65  1  0.567373  0.849287  0.686699  1
  Al  Al66  1  0.857810  0.726421  0.703996  1
  Al  Al67  1  0.466650  0.528554  0.675463  1
  Al  Al68  1  0.750763  0.449272  0.695191  1
  Al  Al69  1  0.066638  0.356146  0.711417  1
  Al  Al70  1  0.369951  0.244099  0.675228  1
  Al  Al71  1  0.658218  0.147269  0.692545  1
  Al  Al72  1  0.941965  0.103383  0.707804  1
  Ni  Ni73  1  0.406944  0.684625  0.317913  1
  Ni  Ni74  1  0.843713  0.859813  0.282431  1
  Ni  Ni75  1  0.121975  0.758880  0.298868  1
  Ni  Ni76  1  0.306504  0.410766  0.312478  1
  Ni  Ni77  1  0.592300  0.327851  0.329586  1
  Ni  Ni78  1  0.021325  0.501872  0.293743  1
  Ni  Ni79  1  0.262510  0.432412  0.372268  1
  Ni  Ni80  1  0.688875  0.605549  0.335778  1
  Ni  Ni81  1  0.975976  0.512981  0.353012  1
  Ni  Ni82  1  0.163232  0.145450  0.367740  1
  Ni  Ni83  1  0.449036  0.064333  0.386340  1
  Ni  Ni84  1  0.878501  0.237456  0.348998  1
  Ni  Ni85  1  0.117952  0.178069  0.427641  1
  Ni  Ni86  1  0.548059  0.348378  0.390788  1
  Ni  Ni87  1  0.832513  0.263298  0.408727  1
  Ni  Ni88  1  0.019305  0.892475  0.422902  1
  Ni  Ni89  1  0.305254  0.808628  0.441843  1
  Ni  Ni90  1  0.733673  0.979322  0.404342  1
  Ni  Ni91  1  0.974525  0.922276  0.483413  1
  Ni  Ni92  1  0.404025  0.092605  0.446586  1
  Ni  Ni93  1  0.689512  0.007079  0.465043  1
  Ni  Ni94  1  0.875930  0.638541  0.478653  1
  Ni  Ni95  1  0.161741  0.553262  0.497454  1
  Ni  Ni96  1  0.590797  0.723479  0.460352  1
  Ni  Ni97  1  0.831141  0.666572  0.539327  1
  Ni  Ni98  1  0.260240  0.836979  0.502223  1
  Ni  Ni99  1  0.546001  0.751375  0.521028  1
  Ni  Ni100  1  0.732414  0.382847  0.534648  1
  Ni  Ni101  1  0.017807  0.297801  0.553050  1
  Ni  Ni102  1  0.447455  0.467795  0.516253  1
  Ni  Ni103  1  0.688361  0.410640  0.595369  1
  Ni  Ni104  1  0.116696  0.582062  0.557797  1
  Ni  Ni105  1  0.402700  0.497030  0.576801  1
  Ni  Ni106  1  0.589366  0.126414  0.590979  1
  Ni  Ni107  1  0.873820  0.041521  0.608925  1
  Ni  Ni108  1  0.304103  0.211968  0.572036  1
  Ni  Ni109  1  0.543518  0.151801  0.650729  1
  Ni  Ni110  1  0.972848  0.326739  0.613267  1
  Ni  Ni111  1  0.258564  0.243422  0.631787  1
  Ni  Ni112  1  0.445839  0.875908  0.646715  1
  Ni  Ni113  1  0.733407  0.784309  0.663722  1
  Ni  Ni114  1  0.159525  0.959095  0.627209  1
  Ni  Ni115  1  0.401071  0.885752  0.705511  1
  Ni  Ni116  1  0.829519  0.061436  0.670023  1
  Ni  Ni117  1  0.115956  0.976413  0.687456  1
  Ni  Ni118  1  0.295606  0.632643  0.700832  1
  Ni  Ni119  1  0.576411  0.529354  0.717062  1
  Ni  Ni120  1  0.016788  0.712957  0.682572  1
