data_[Cs16Rb4Bi2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Rb  0.8200  2.3500  1.6600
  Bi  2.0200  1.6000  1.0350
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [28.6266]
_cell_length_b [7.2646]
_cell_length_c [10.2612]
_cell_angle_alpha [90.0000]
_cell_angle_beta [103.8005]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Cs8Rb2Bi]
_chemical_formula_sum '[Cs16 Rb4 Bi2]'
_cell_volume [2072.3051]
_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  0.0068  0.0000  0.2102  1
  Cs  Cs1  4  0.0938  0.5000  0.7831  1
  Cs  Cs2  4  0.1132  0.5000  0.2863  1
  Cs  Cs3  4  0.2058  0.0000  0.1045  1
  Rb  Rb4  4  0.1952  0.0000  0.5963  1
  Bi  Bi5  2  0.0000  0.5000  0.0000  1
]