data_[Cs4In4Br8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Cs  0.7900  2.6000  1.8100
  In  1.7800  1.5500  0.9400
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [10.1734]
_cell_length_b [10.3069]
_cell_length_c [8.4187]
_cell_angle_alpha [90.0000]
_cell_angle_beta [123.8832]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsInBr2]
_chemical_formula_sum '[Cs4 In4 Br8]'
_cell_volume [732.8388]
_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  0.1314  0.2500  1.0
  In  In1  4  0.0000  0.3871  0.7500  1.0
  Br  Br2  8  0.2116  0.4110  0.2341  1.0
]