data_[Ir2Pb6Cl4O12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ir  2.2000  1.3500  0.7650
  Pb  2.3300  1.8000  1.1225
  Cl  3.1600  1.0000  0.7800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.3264]
_cell_length_b [6.7501]
_cell_length_c [6.0885]
_cell_angle_alpha [90.0000]
_cell_angle_beta [102.3521]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [IrPb3(ClO3)2]
_chemical_formula_sum '[Ir2 Pb6 Cl4 O12]'
_cell_volume [454.7185]
_cell_formula_units_Z [2]
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  2  0.0000  0.0000  0.5000  1
  Pb  Pb1  4  0.2500  0.2500  0.5000  1
  Pb  Pb2  2  0.0000  0.5000  0.0000  1
  Cl  Cl3  4  0.2166  0.5000  0.8424  1
  O  O4  8  0.0569  0.2136  0.3224  1
  O  O5  4  0.1698  0.0000  0.6732  1
]