data_[Cs4Li4Bi4Cl20]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Li  0.9800  1.4500  0.9000
  Bi  2.0200  1.6000  1.0350
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [9.3307]
_cell_length_b [12.5291]
_cell_length_c [10.3297]
_cell_angle_alpha [90.0000]
_cell_angle_beta [114.0264]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsLiBiCl5]
_chemical_formula_sum '[Cs4 Li4 Bi4 Cl20]'
_cell_volume [1102.9604]
_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  0.0000  0.3448  0.2500  1.0
  Li  Li1  4  0.0000  0.3045  0.7500  1.0
  Bi  Bi2  4  0.0000  0.0000  0.0000  1.0
  Cl  Cl3  8  0.0965  0.2007  0.6042  1.0
  Cl  Cl4  8  0.1989  0.4281  0.9157  1.0
  Cl  Cl5  4  0.0000  0.0715  0.2500  1.0
]