# generated using pymatgen
data_AlNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.78952242
_cell_length_b   6.31820830
_cell_length_c   46.15964054
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNi
_chemical_formula_sum   'Al16 Ni16'
_cell_volume   813.553681089
_cell_formula_units_Z   16
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  1.007612  0.388733  0.304000  1
  Al  Al2  1  1.007612  1.000200  0.277517  1
  Al  Al3  1  1.007612  0.189233  0.362138  1
  Al  Al4  1  1.007612  0.790525  0.335519  1
  Al  Al5  1  1.007612  0.983454  0.417883  1
  Al  Al6  1  1.007612  0.583204  0.389070  1
  Al  Al7  1  1.007612  0.777088  0.472849  1
  Al  Al8  1  1.007612  0.381301  0.445449  1
  Al  Al9  1  1.007612  0.573930  0.528913  1
  Al  Al10  1  1.007612  0.175283  0.500798  1
  Al  Al11  1  1.007612  0.367060  0.583642  1
  Al  Al12  1  1.007612  0.969650  0.556333  1
  Al  Al13  1  1.007612  0.162611  0.639653  1
  Al  Al14  1  1.007612  0.768284  0.612758  1
  Al  Al15  1  1.007612  0.964862  0.698002  1
  Al  Al16  1  1.007612  0.561674  0.665707  1
  Ni  Ni17  1  0.507612  0.088727  0.321070  1
  Ni  Ni18  1  0.507612  0.700337  0.294225  1
  Ni  Ni19  1  0.507612  0.888250  0.376613  1
  Ni  Ni20  1  0.507612  0.484648  0.346802  1
  Ni  Ni21  1  0.507612  0.680743  0.430952  1
  Ni  Ni22  1  0.507612  0.284295  0.403864  1
  Ni  Ni23  1  0.507612  0.477077  0.487204  1
  Ni  Ni24  1  0.507612  0.079545  0.459330  1
  Ni  Ni25  1  0.507612  0.270988  0.542236  1
  Ni  Ni26  1  0.507612  0.873905  0.514563  1
  Ni  Ni27  1  0.507612  0.066911  0.597948  1
  Ni  Ni28  1  0.507612  0.670376  0.570840  1
  Ni  Ni29  1  0.507612  0.867600  0.654989  1
  Ni  Ni30  1  0.507612  0.462609  0.624729  1
  Ni  Ni31  1  0.507612  0.638628  0.707201  1
  Ni  Ni32  1  0.507612  0.264516  0.681196  1
