data_[Cd2In16Bi4]
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 [10.7922]
_cell_length_b [8.5933]
_cell_length_c [7.3402]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.1909]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cd(In4Bi)2]
_chemical_formula_sum '[Cd2 In16 Bi4]'
_cell_volume [669.9974]
_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  2  0.0000  0.0000  0.0000  1.0
  In  In1  8  0.1133  0.2310  0.7084  1.0
  In  In2  4  0.0748  0.5000  0.3224  1.0
  In  In3  4  0.2166  0.5000  0.0013  1.0
  Bi  Bi4  4  0.1687  0.0000  0.4004  1.0
]