data_[Cd12In4Bi4]
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 [P2_1/c]
_cell_length_a [7.5390]
_cell_length_b [7.0843]
_cell_length_c [11.2087]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.2479]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Cd3InBi]
_chemical_formula_sum '[Cd12 In4 Bi4]'
_cell_volume [522.3270]
_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
[
  Cd  Cd0  4  0.0128  0.1057  0.2443  1
  Cd  Cd1  4  0.2097  0.1197  0.0594  1
  Cd  Cd2  4  0.3940  0.6431  0.8403  1
  In  In3  4  0.3786  0.1211  0.8509  1
  Bi  Bi4  4  0.2117  0.6318  0.0472  1
]