data_[Cs2Cr2Bi2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  Cr  1.6600  1.4000  0.9400
  Bi  2.0200  1.6000  1.0350
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2]
_cell_length_a [7.1401]
_cell_length_b [11.8220]
_cell_length_c [7.7186]
_cell_angle_alpha [90.0000]
_cell_angle_beta [93.1548]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [5]
_chemical_formula_structural [CsCrBiCl6]
_chemical_formula_sum '[Cs2 Cr2 Bi2 Cl12]'
_cell_volume [650.5377]
_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  2  0.0000  0.0155  0.0000  1.0
  Cr  Cr1  2  0.0000  0.3368  0.5000  1.0
  Bi  Bi2  2  0.0000  0.6744  0.5000  1.0
  Cl  Cl3  4  0.1208  0.4803  0.6923  1.0
  Cl  Cl4  4  0.1696  0.1953  0.6716  1.0
  Cl  Cl5  4  0.1821  0.8112  0.7212  1.0
]