# generated using pymatgen
data_IrPbCl6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.80062362
_cell_length_b   6.80062308
_cell_length_c   6.80062505
_cell_angle_alpha   59.65952214
_cell_angle_beta   59.65951055
_cell_angle_gamma   59.65951062
_symmetry_Int_Tables_number   1
_chemical_formula_structural   IrPbCl6
_chemical_formula_sum   'Ir1 Pb1 Cl6'
_cell_volume   220.67772826
_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
  Ir  Ir0  1  0.66410553  0.66410553  0.66410553  1.0
  Pb  Pb1  1  0.35175899  0.35175899  0.35175899  1.0
  Cl  Cl2  1  0.99799196  0.44259430  0.79331441  1.0
  Cl  Cl3  1  0.32451296  0.88596269  0.53975816  1.0
  Cl  Cl4  1  0.44259430  0.79331441  0.99799196  1.0
  Cl  Cl5  1  0.53975816  0.32451296  0.88596269  1.0
  Cl  Cl6  1  0.79331441  0.99799196  0.44259430  1.0
  Cl  Cl7  1  0.88596269  0.53975816  0.32451296  1.0