data_[Cs12Bi4Sb4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Bi  2.0200  1.6000  1.0350
  Sb  2.0500  1.4500  0.8300
]
_symmetry_space_group_name_H-M [P2/c]
_cell_length_a [7.6659]
_cell_length_b [7.1919]
_cell_length_c [19.5496]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.3547]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [13]
_chemical_formula_structural [Cs3BiSb]
_chemical_formula_sum '[Cs12 Bi4 Sb4]'
_cell_volume [1039.3387]
_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  4  0.0065  0.1579  0.3760  1.0
  Cs  Cs1  4  0.2918  0.4485  0.7848  1.0
  Cs  Cs2  4  0.3269  0.2494  0.9963  1.0
  Bi  Bi3  4  0.2398  0.2774  0.5886  1.0
  Sb  Sb4  4  0.4963  0.0154  0.1765  1.0
]