data_[Cs12Cd4Bi4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cd  1.6900  1.5500  1.0900
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [Ima2]
_cell_length_a [12.3221]
_cell_length_b [11.6926]
_cell_length_c [9.9380]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [46]
_chemical_formula_structural [Cs3CdBi]
_chemical_formula_sum '[Cs12 Cd4 Bi4]'
_cell_volume [1431.8456]
_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
[
  Cs  Cs0  8  0.0586  0.8120  0.6714  1.0
  Cs  Cs1  4  0.2500  0.1099  0.0311  1.0
  Cd  Cd2  4  0.2500  0.5496  0.8881  1.0
  Bi  Bi3  4  0.2500  0.0751  0.6463  1.0
]