data_[Ba8Cd4Bi8]
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 [P2_1/c]
_cell_length_a [10.4461]
_cell_length_b [8.8823]
_cell_length_c [8.8042]
_cell_angle_alpha [90.0000]
_cell_angle_beta [92.1048]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ba2CdBi2]
_chemical_formula_sum '[Ba8 Cd4 Bi8]'
_cell_volume [816.3450]
_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  0.0937  0.7484  0.5037  1
  Ba  Ba1  4  0.3539  0.2088  0.4850  1
  Cd  Cd2  4  0.3778  0.5872  0.3210  1
  Bi  Bi3  4  0.1320  0.0701  0.7515  1
  Bi  Bi4  4  0.3764  0.5936  0.7031  1
]