data_[Cs6Ga8Bi8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Ga  1.8100  1.3000  0.7600
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [31.4415]
_cell_length_b [4.8007]
_cell_length_c [5.8711]
_cell_angle_alpha [90.0000]
_cell_angle_beta [100.4922]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs3(GaBi)4]
_chemical_formula_sum '[Cs6 Ga8 Bi8]'
_cell_volume [871.3805]
_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  0.1520  0.5000  0.6403  1.0
  Cs  Cs1  2  0.0000  0.0000  0.5000  1.0
  Ga  Ga2  4  0.1094  0.0000  0.0793  1.0
  Ga  Ga3  4  0.2424  0.0000  0.7627  1.0
  Bi  Bi4  4  0.0631  0.5000  0.0535  1.0
  Bi  Bi5  4  0.2035  0.0000  0.2113  1.0
]