# generated using pymatgen
data_Lu2NiIr3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.31945166
_cell_length_b   5.07771865
_cell_length_c   5.31945109
_cell_angle_alpha   58.41228629
_cell_angle_beta   60.00000357
_cell_angle_gamma   58.41227767
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Lu2NiIr3
_chemical_formula_sum   'Lu2 Ni1 Ir3'
_cell_volume   99.09163395
_cell_formula_units_Z   1
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
  Lu  Lu0  1  0.75098535  0.74704395  0.75098535  1.0
  Lu  Lu1  1  0.49901465  0.50295605  0.49901465  1.0
  Ni  Ni2  1  0.12500000  0.62500000  0.12500000  1.0
  Ir  Ir3  1  0.12500000  0.12500000  0.12500000  1.0
  Ir  Ir4  1  0.62500000  0.12500000  0.12500000  1.0
  Ir  Ir5  1  0.12500000  0.12500000  0.62500000  1.0