data_[Cs6In8Bi8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  In  1.7800  1.5500  0.9400
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [Immm]
_cell_length_a [5.1046]
_cell_length_b [5.7786]
_cell_length_c [31.9108]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [71]
_chemical_formula_structural [Cs3(InBi)4]
_chemical_formula_sum '[Cs6 In8 Bi8]'
_cell_volume [941.2906]
_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
[
  Cs  Cs0  4  0.0000  0.0000  0.1476  1
  Cs  Cs1  2  0.0000  0.5000  0.5000  1
  In  In2  4  0.0000  0.0000  0.3044  1
  In  In3  4  0.0000  0.5000  0.0463  1
  Bi  Bi4  4  0.0000  0.0000  0.4047  1
  Bi  Bi5  4  0.0000  0.5000  0.2510  1
]