# generated using pymatgen
data_Al3Ni5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.51906276
_cell_length_b   3.76402627
_cell_length_c   52.00614237
_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   'Al24 Ni40'
_cell_volume   1471.87522817
_cell_formula_units_Z   8
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  0.507896  1.007999  0.252624  1
  Al  Al2  1  0.792997  0.507999  0.254555  1
  Al  Al3  1  0.222796  0.507999  0.254555  1
  Al  Al4  1  1.007896  1.007999  0.314599  1
  Al  Al5  1  0.286072  0.507999  0.315102  1
  Al  Al6  1  0.729721  0.507999  0.315102  1
  Al  Al7  1  0.507896  1.007999  0.377711  1
  Al  Al8  1  0.786009  0.507999  0.377772  1
  Al  Al9  1  0.229784  0.507999  0.377772  1
  Al  Al10  1  1.007896  1.007999  0.440793  1
  Al  Al11  1  0.285822  0.507999  0.440809  1
  Al  Al12  1  0.729971  0.507999  0.440809  1
  Al  Al13  1  0.507896  1.007999  0.503785  1
  Al  Al14  1  0.785766  0.507999  0.503760  1
  Al  Al15  1  0.230027  0.507999  0.503760  1
  Al  Al16  1  1.007896  1.007999  0.566837  1
  Al  Al17  1  0.285689  0.507999  0.566729  1
  Al  Al18  1  0.730104  0.507999  0.566729  1
  Al  Al19  1  0.507896  1.007999  0.629823  1
  Al  Al20  1  0.784602  0.507999  0.629713  1
  Al  Al21  1  0.231191  0.507999  0.629713  1
  Al  Al22  1  1.007896  1.007999  0.690483  1
  Al  Al23  1  0.281639  0.507999  0.690414  1
  Al  Al24  1  0.734154  0.507999  0.690414  1
  Ni  Ni25  1  0.507896  1.007999  0.315231  1
  Ni  Ni26  1  0.256791  1.007999  0.346332  1
  Ni  Ni27  1  0.759002  1.007999  0.346332  1
  Ni  Ni28  1  0.507896  0.507999  0.348649  1
  Ni  Ni29  1  0.507896  0.507999  0.281391  1
  Ni  Ni30  1  1.007896  1.007999  0.260262  1
  Ni  Ni31  1  0.748253  1.007999  0.284419  1
  Ni  Ni32  1  0.267540  1.007999  0.284419  1
  Ni  Ni33  1  1.007896  0.507999  0.287505  1
  Ni  Ni34  1  1.007896  0.507999  0.343895  1
  Ni  Ni35  1  0.507896  1.007999  0.440829  1
  Ni  Ni36  1  0.257913  1.007999  0.472288  1
  Ni  Ni37  1  0.757880  1.007999  0.472288  1
  Ni  Ni38  1  0.507896  0.507999  0.474557  1
  Ni  Ni39  1  0.507896  0.507999  0.407021  1
  Ni  Ni40  1  1.007896  1.007999  0.378041  1
  Ni  Ni41  1  0.757518  1.007999  0.409320  1
  Ni  Ni42  1  0.258275  1.007999  0.409320  1
  Ni  Ni43  1  1.007896  0.507999  0.411588  1
  Ni  Ni44  1  1.007896  0.507999  0.470021  1
  Ni  Ni45  1  0.507896  1.007999  0.566596  1
  Ni  Ni46  1  0.258576  1.007999  0.598232  1
  Ni  Ni47  1  0.757217  1.007999  0.598232  1
  Ni  Ni48  1  0.507896  0.507999  0.600470  1
  Ni  Ni49  1  0.507896  0.507999  0.532987  1
  Ni  Ni50  1  1.007896  1.007999  0.503746  1
  Ni  Ni51  1  0.758241  1.007999  0.535236  1
  Ni  Ni52  1  0.257552  1.007999  0.535236  1
  Ni  Ni53  1  1.007896  0.507999  0.537516  1
  Ni  Ni54  1  1.007896  0.507999  0.596131  1
  Ni  Ni55  1  0.507896  1.007999  0.691380  1
  Ni  Ni56  1  0.262844  1.007999  0.719853  1
  Ni  Ni57  1  0.752949  1.007999  0.719853  1
  Ni  Ni58  1  0.507896  0.507999  0.722016  1
  Ni  Ni59  1  0.507896  0.507999  0.658691  1
  Ni  Ni60  1  1.007896  1.007999  0.629561  1
  Ni  Ni61  1  0.756056  1.007999  0.660775  1
  Ni  Ni62  1  0.259737  1.007999  0.660775  1
  Ni  Ni63  1  1.007896  0.507999  0.662793  1
  Ni  Ni64  1  1.007896  0.507999  0.718810  1
