# generated using pymatgen
data_AlNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.01982521
_cell_length_b   4.01982521
_cell_length_c   47.81775137
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   AlNi
_chemical_formula_sum   'Al13 Ni13'
_cell_volume   669.166392574
_cell_formula_units_Z   13
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  0.170949  0.586188  0.301424  1
  Al  Al2  1  0.504282  0.252855  0.337656  1
  Al  Al3  1  0.837615  0.919521  0.370382  1
  Al  Al4  1  0.170949  0.586188  0.404962  1
  Al  Al5  1  0.504282  0.252855  0.439948  1
  Al  Al6  1  0.837615  0.919521  0.474436  1
  Al  Al7  1  0.170949  0.586188  0.509033  1
  Al  Al8  1  0.504282  0.252855  0.543626  1
  Al  Al9  1  0.837615  0.919521  0.578331  1
  Al  Al10  1  0.170949  0.586188  0.613064  1
  Al  Al11  1  0.504282  0.252855  0.646946  1
  Al  Al12  1  0.837615  0.919521  0.681553  1
  Al  Al13  1  0.170949  0.586188  0.716381  1
  Ni  Ni14  1  0.504282  0.252855  0.289089  1
  Ni  Ni15  1  0.837615  0.919521  0.317498  1
  Ni  Ni16  1  0.170949  0.586188  0.352592  1
  Ni  Ni17  1  0.504282  0.252855  0.388580  1
  Ni  Ni18  1  0.837615  0.919521  0.422409  1
  Ni  Ni19  1  0.170949  0.586188  0.457013  1
  Ni  Ni20  1  0.504282  0.252855  0.491782  1
  Ni  Ni21  1  0.837615  0.919521  0.526380  1
  Ni  Ni22  1  0.170949  0.586188  0.561039  1
  Ni  Ni23  1  0.504282  0.252855  0.595354  1
  Ni  Ni24  1  0.837615  0.919521  0.630282  1
  Ni  Ni25  1  0.170949  0.586188  0.665475  1
  Ni  Ni26  1  0.504282  0.252855  0.697132  1
