data_[Ba4Rh8Pb12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Rh  2.2800  1.3500  0.7450
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [Cmcm]
_cell_length_a [11.2446]
_cell_length_b [8.9810]
_cell_length_c [6.1666]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [63]
_chemical_formula_structural [BaRh2Pb3]
_chemical_formula_sum '[Ba4 Rh8 Pb12]'
_cell_volume [622.7444]
_cell_formula_units_Z [4]
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
[
  Ba  Ba0  4  0.0000  0.3615  0.2500  1
  Rh  Rh1  8  0.2152  0.0000  0.0000  1
  Pb  Pb2  8  0.1823  0.2810  0.7500  1
  Pb  Pb3  4  0.0000  0.0223  0.7500  1
]