data_[Ba4Cd12Pb8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ba  0.8900  2.1500  1.4900
  Cd  1.6900  1.5500  1.0900
  Pb  2.3300  1.8000  1.1225
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [18.8565]
_cell_length_b [5.1649]
_cell_length_c [7.9004]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.8149]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [BaCd3Pb2]
_chemical_formula_sum '[Ba4 Cd12 Pb8]'
_cell_volume [740.3097]
_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  0.1180  0.0000  0.1718  1.0
  Cd  Cd1  4  0.0644  0.0000  0.6560  1.0
  Cd  Cd2  4  0.1278  0.5000  0.5111  1.0
  Cd  Cd3  4  0.1987  0.5000  0.9149  1.0
  Pb  Pb4  4  0.0214  0.5000  0.8176  1.0
  Pb  Pb5  4  0.2322  0.0000  0.6670  1.0
]