data_[Cs4Li2Bi2Br12]
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
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [P2_1/c]
_cell_length_a [8.0165]
_cell_length_b [7.9992]
_cell_length_c [13.9072]
_cell_angle_alpha [90.0000]
_cell_angle_beta [125.2393]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Cs2LiBiBr6]
_chemical_formula_sum '[Cs4 Li2 Bi2 Br12]'
_cell_volume [728.3908]
_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  0.2493  0.0071  0.2502  1.0
  Li  Li1  2  0.5000  0.0000  0.0000  1.0
  Bi  Bi2  2  0.0000  0.0000  0.5000  1.0
  Br  Br3  4  0.2291  0.2317  0.9899  1.0
  Br  Br4  4  0.2570  0.7394  0.9891  1.0
  Br  Br5  4  0.2738  0.5007  0.2532  1.0
]