data_[Ba8Cd12Bi16]
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 [Cmce]
_cell_length_a [6.9209]
_cell_length_b [17.8721]
_cell_length_c [9.6150]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [64]
_chemical_formula_structural [Ba2Cd3Bi4]
_chemical_formula_sum '[Ba8 Cd12 Bi16]'
_cell_volume [1189.2923]
_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  8  0.0000  0.1180  0.5775  1.0
  Cd  Cd1  8  0.2500  0.2210  0.2500  1.0
  Cd  Cd2  4  0.0000  0.0000  0.0000  1.0
  Bi  Bi3  8  0.0000  0.1865  0.9461  1.0
  Bi  Bi4  8  0.2500  0.0521  0.2500  1.0
]