data_[Ba4Cd8Bi8]
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
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [Pnma]
_cell_length_a [10.1810]
_cell_length_b [4.9584]
_cell_length_c [13.1221]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [62]
_chemical_formula_structural [Ba(CdBi)2]
_chemical_formula_sum '[Ba4 Cd8 Bi8]'
_cell_volume [662.4181]
_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  0.2070  0.2500  0.1656  1
  Cd  Cd1  4  0.0795  0.2500  0.4503  1
  Cd  Cd2  4  0.2116  0.2500  0.8638  1
  Bi  Bi3  4  0.0122  0.2500  0.6822  1
  Bi  Bi4  4  0.1203  0.7500  0.9635  1
]