data_[Cd4Bi4Sb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cd  1.6900  1.5500  1.0900
  Bi  2.0200  1.6000  1.0350
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [4.7768]
_cell_length_b [12.5328]
_cell_length_c [6.5471]
_cell_angle_alpha [90.0000]
_cell_angle_beta [96.5992]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [CdBiSb]
_chemical_formula_sum '[Cd4 Bi4 Sb4]'
_cell_volume [389.3580]
_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  0.0036  0.5739  0.7529  1.0
  Bi  Bi1  4  0.0620  0.9074  0.2377  1.0
  Sb  Sb2  4  0.0443  0.2212  0.7269  1.0
]