# generated using pymatgen
data_AlNi3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.99078752
_cell_length_b   8.11751765
_cell_length_c   56.25567153
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNi3
_chemical_formula_sum   'Al24 Ni72'
_cell_volume   2279.07509586
_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  1.055272  0.107799  0.235196  1
  Al  Al2  1  0.555272  0.357799  0.286310  1
  Al  Al3  1  0.555272  0.857799  0.286310  1
  Al  Al4  1  1.055272  0.607799  0.235196  1
  Al  Al5  1  1.055272  0.607799  0.311795  1
  Al  Al6  1  0.555272  0.857799  0.363328  1
  Al  Al7  1  0.555272  0.357799  0.363328  1
  Al  Al8  1  1.055272  0.107799  0.311795  1
  Al  Al9  1  1.055272  0.107799  0.388567  1
  Al  Al10  1  0.555272  0.357799  0.440226  1
  Al  Al11  1  0.555272  0.857799  0.440226  1
  Al  Al12  1  1.055272  0.607799  0.388567  1
  Al  Al13  1  1.055272  0.607799  0.465437  1
  Al  Al14  1  0.555272  0.857799  0.517095  1
  Al  Al15  1  0.555272  0.357799  0.517095  1
  Al  Al16  1  1.055272  0.107799  0.465437  1
  Al  Al17  1  1.055272  0.107799  0.542335  1
  Al  Al18  1  0.555272  0.357799  0.593868  1
  Al  Al19  1  0.555272  0.857799  0.593868  1
  Al  Al20  1  1.055272  0.607799  0.542335  1
  Al  Al21  1  1.055272  0.607799  0.619353  1
  Al  Al22  1  0.555272  0.857799  0.670467  1
  Al  Al23  1  0.555272  0.357799  0.670467  1
  Al  Al24  1  1.055272  0.107799  0.619353  1
  Ni  Ni25  1  0.304986  0.357799  0.247597  1
  Ni  Ni26  1  0.555272  0.107799  0.235505  1
  Ni  Ni27  1  0.305029  0.107799  0.273909  1
  Ni  Ni28  1  0.805515  0.607799  0.273909  1
  Ni  Ni29  1  1.055272  0.357799  0.286152  1
  Ni  Ni30  1  0.805558  0.857799  0.247597  1
  Ni  Ni31  1  0.805515  0.107799  0.273909  1
  Ni  Ni32  1  1.055272  0.857799  0.286152  1
  Ni  Ni33  1  0.805558  0.357799  0.247597  1
  Ni  Ni34  1  0.304986  0.857799  0.247597  1
  Ni  Ni35  1  0.555272  0.607799  0.235505  1
  Ni  Ni36  1  0.305029  0.607799  0.273909  1
  Ni  Ni37  1  0.305774  0.857799  0.324584  1
  Ni  Ni38  1  0.555272  0.607799  0.312140  1
  Ni  Ni39  1  0.304897  0.607799  0.350444  1
  Ni  Ni40  1  0.805646  0.107799  0.350444  1
  Ni  Ni41  1  0.055272  0.857799  0.362987  1
  Ni  Ni42  1  0.804770  0.357799  0.324584  1
  Ni  Ni43  1  0.805646  0.607799  0.350444  1
  Ni  Ni44  1  1.055272  0.357799  0.362987  1
  Ni  Ni45  1  0.804770  0.857799  0.324584  1
  Ni  Ni46  1  0.305774  0.357799  0.324584  1
  Ni  Ni47  1  0.555272  0.107799  0.312140  1
  Ni  Ni48  1  0.304897  0.107799  0.350444  1
  Ni  Ni49  1  0.305651  0.357799  0.401493  1
  Ni  Ni50  1  0.555272  0.107799  0.388914  1
  Ni  Ni51  1  0.304894  0.107799  0.427286  1
  Ni  Ni52  1  0.805649  0.607799  0.427286  1
  Ni  Ni53  1  1.055272  0.357799  0.439879  1
  Ni  Ni54  1  0.804892  0.857799  0.401493  1
  Ni  Ni55  1  0.805649  0.107799  0.427286  1
  Ni  Ni56  1  1.055272  0.857799  0.439879  1
  Ni  Ni57  1  0.804892  0.357799  0.401493  1
  Ni  Ni58  1  0.305651  0.857799  0.401493  1
  Ni  Ni59  1  0.555272  0.607799  0.388914  1
  Ni  Ni60  1  0.304894  0.607799  0.427286  1
  Ni  Ni61  1  0.305649  0.857799  0.478377  1
  Ni  Ni62  1  0.555272  0.607799  0.465784  1
  Ni  Ni63  1  0.304892  0.607799  0.504170  1
  Ni  Ni64  1  0.805651  0.107799  0.504170  1
  Ni  Ni65  1  1.055272  0.857799  0.516749  1
  Ni  Ni66  1  0.804894  0.357799  0.478377  1
  Ni  Ni67  1  0.805651  0.607799  0.504170  1
  Ni  Ni68  1  1.055272  0.357799  0.516749  1
  Ni  Ni69  1  0.804894  0.857799  0.478377  1
  Ni  Ni70  1  0.305649  0.357799  0.478377  1
  Ni  Ni71  1  0.555272  0.107799  0.465784  1
  Ni  Ni72  1  0.304892  0.107799  0.504170  1
  Ni  Ni73  1  0.305646  0.357799  0.555219  1
  Ni  Ni74  1  0.555272  0.107799  0.542676  1
  Ni  Ni75  1  0.304770  0.107799  0.581079  1
  Ni  Ni76  1  0.805774  0.607799  0.581079  1
  Ni  Ni77  1  1.055272  0.357799  0.593523  1
  Ni  Ni78  1  0.804897  0.857799  0.555219  1
  Ni  Ni79  1  0.805774  0.107799  0.581079  1
  Ni  Ni80  1  1.055272  0.857799  0.593523  1
  Ni  Ni81  1  0.804897  0.357799  0.555219  1
  Ni  Ni82  1  0.305646  0.857799  0.555219  1
  Ni  Ni83  1  0.555272  0.607799  0.542676  1
  Ni  Ni84  1  0.304770  0.607799  0.581079  1
  Ni  Ni85  1  0.305515  0.857799  0.631754  1
  Ni  Ni86  1  0.555272  0.607799  0.619511  1
  Ni  Ni87  1  0.305558  0.607799  0.658066  1
  Ni  Ni88  1  0.804986  0.107799  0.658066  1
  Ni  Ni89  1  1.055272  0.857799  0.670158  1
  Ni  Ni90  1  0.805029  0.357799  0.631754  1
  Ni  Ni91  1  0.804986  0.607799  0.658066  1
  Ni  Ni92  1  1.055272  0.357799  0.670158  1
  Ni  Ni93  1  0.805029  0.857799  0.631754  1
  Ni  Ni94  1  0.305515  0.357799  0.631754  1
  Ni  Ni95  1  0.555272  0.107799  0.619511  1
  Ni  Ni96  1  0.305558  0.107799  0.658066  1
