data_[Cs4Cd4Bi4]
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 [Imm2]
_cell_length_a [5.6879]
_cell_length_b [9.4230]
_cell_length_c [8.8578]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [44]
_chemical_formula_structural [CsCdBi]
_chemical_formula_sum '[Cs4 Cd4 Bi4]'
_cell_volume [474.7558]
_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  2  0.0000  0.0000  0.3372  1.0
  Cs  Cs1  2  0.0000  0.5000  0.1778  1.0
  Cd  Cd2  4  0.0000  0.1543  0.9130  1.0
  Bi  Bi3  4  0.0000  0.3325  0.6047  1.0
]