data_[Cd16In4Bi2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  In  1.7800  1.5500  0.9400
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8551]
_cell_length_b [16.6777]
_cell_length_c [5.6701]
_cell_angle_alpha [90.0000]
_cell_angle_beta [129.8974]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd8In2Bi]
_chemical_formula_sum '[Cd16 In4 Bi2]'
_cell_volume [569.8740]
_cell_formula_units_Z [2]
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
[
  Cd  Cd0  8  0.2395  0.1374  0.2569  1.0
  Cd  Cd1  4  0.0000  0.1923  0.5000  1.0
  Cd  Cd2  4  0.0217  0.5000  0.7723  1.0
  In  In3  4  0.0000  0.3161  0.0000  1.0
  Bi  Bi4  2  0.0000  0.0000  0.5000  1.0
]