# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.87032770
_cell_length_b   9.82245038
_cell_length_c   53.02731815
_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   'Al30 Ni50'
_cell_volume   2015.89192161
_cell_formula_units_Z   10
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  -0.005954  0.017209  0.335418  1
  Al  Al2  1  0.494046  0.807052  0.310574  1
  Al  Al3  1  0.494046  0.174820  0.359631  1
  Al  Al4  1  0.994046  0.517209  0.335418  1
  Al  Al5  1  0.494046  0.307052  0.310574  1
  Al  Al6  1  0.494046  0.674820  0.359631  1
  Al  Al7  1  0.994046  0.612830  0.426108  1
  Al  Al8  1  0.494046  0.446980  0.400168  1
  Al  Al9  1  0.494046  0.777582  0.451190  1
  Al  Al10  1  0.994046  0.112830  0.426108  1
  Al  Al11  1  0.494046  0.946980  0.400168  1
  Al  Al12  1  0.494046  0.277582  0.451190  1
  Al  Al13  1  0.994046  0.213077  0.517458  1
  Al  Al14  1  0.494046  0.047536  0.492184  1
  Al  Al15  1  0.494046  0.378314  0.542701  1
  Al  Al16  1  0.994046  0.713077  0.517458  1
  Al  Al17  1  0.494046  0.547536  0.492184  1
  Al  Al18  1  0.494046  0.878314  0.542701  1
  Al  Al19  1  0.994046  0.815396  0.608750  1
  Al  Al20  1  0.494046  0.648510  0.583697  1
  Al  Al21  1  0.494046  0.979149  0.634543  1
  Al  Al22  1  0.994046  0.315396  0.608750  1
  Al  Al23  1  0.494046  0.148510  0.583697  1
  Al  Al24  1  0.494046  0.479149  0.634543  1
  Al  Al25  1  0.994046  0.426850  0.698680  1
  Al  Al26  1  0.494046  0.251205  0.674249  1
  Al  Al27  1  0.494046  0.583524  0.723691  1
  Al  Al28  1  -0.005954  0.926850  0.698680  1
  Al  Al29  1  0.494046  0.751205  0.674249  1
  Al  Al30  1  0.494046  0.083524  0.723691  1
  Ni  Ni31  1  -0.005954  0.169055  0.296723  1
  Ni  Ni32  1  0.994046  0.426151  0.294512  1
  Ni  Ni33  1  -0.005954  0.770023  0.336309  1
  Ni  Ni34  1  0.494046  0.916915  0.354309  1
  Ni  Ni35  1  0.494046  0.056716  0.309530  1
  Ni  Ni36  1  -0.005954  0.669055  0.296723  1
  Ni  Ni37  1  -0.005954  0.926151  0.294512  1
  Ni  Ni38  1  0.994046  0.270023  0.336309  1
  Ni  Ni39  1  0.494046  0.416915  0.354309  1
  Ni  Ni40  1  0.494046  0.556716  0.309530  1
  Ni  Ni41  1  0.994046  0.813719  0.380433  1
  Ni  Ni42  1  0.994046  0.065077  0.380707  1
  Ni  Ni43  1  -0.005954  0.363272  0.425966  1
  Ni  Ni44  1  0.494046  0.520052  0.446952  1
  Ni  Ni45  1  0.494046  0.703941  0.404725  1
  Ni  Ni46  1  -0.005954  0.313719  0.380433  1
  Ni  Ni47  1  -0.005954  0.565077  0.380707  1
  Ni  Ni48  1  0.994046  0.863272  0.425966  1
  Ni  Ni49  1  0.494046  0.020052  0.446952  1
  Ni  Ni50  1  0.494046  0.203941  0.404725  1
  Ni  Ni51  1  -0.005954  0.412688  0.471722  1
  Ni  Ni52  1  0.994046  0.662801  0.471786  1
  Ni  Ni53  1  -0.005954  0.963143  0.517511  1
  Ni  Ni54  1  0.494046  0.121046  0.538562  1
  Ni  Ni55  1  0.494046  0.304743  0.496339  1
  Ni  Ni56  1  0.994046  0.912688  0.471722  1
  Ni  Ni57  1  -0.005954  0.162801  0.471786  1
  Ni  Ni58  1  0.994046  0.463143  0.517511  1
  Ni  Ni59  1  0.494046  0.621046  0.538562  1
  Ni  Ni60  1  0.494046  0.804743  0.496339  1
  Ni  Ni61  1  0.994046  0.013132  0.563396  1
  Ni  Ni62  1  0.994046  0.263239  0.563164  1
  Ni  Ni63  1  0.994046  0.565302  0.609383  1
  Ni  Ni64  1  0.494046  0.721346  0.629609  1
  Ni  Ni65  1  0.494046  0.906025  0.587835  1
  Ni  Ni66  1  0.994046  0.513132  0.563396  1
  Ni  Ni67  1  -0.005954  0.763239  0.563164  1
  Ni  Ni68  1  0.994046  0.065302  0.609383  1
  Ni  Ni69  1  0.494046  0.221346  0.629609  1
  Ni  Ni70  1  0.494046  0.406025  0.587835  1
  Ni  Ni71  1  0.994046  0.611397  0.655992  1
  Ni  Ni72  1  0.994046  0.862159  0.654496  1
  Ni  Ni73  1  -0.005954  0.178379  0.700358  1
  Ni  Ni74  1  0.494046  0.325198  0.717432  1
  Ni  Ni75  1  0.494046  0.510313  0.679435  1
  Ni  Ni76  1  0.994046  0.111397  0.655992  1
  Ni  Ni77  1  -0.005954  0.362159  0.654496  1
  Ni  Ni78  1  0.994046  0.678379  0.700358  1
  Ni  Ni79  1  0.494046  0.825198  0.717432  1
  Ni  Ni80  1  0.494046  0.010313  0.679435  1
