data_[Cs4In4Sn8Br24]
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
  Sn  1.9600  1.4500  0.8300
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [17.8789]
_cell_length_b [10.1332]
_cell_length_c [11.6387]
_cell_angle_alpha [90.0000]
_cell_angle_beta [127.0017]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [CsIn(SnBr3)2]
_chemical_formula_sum '[Cs4 In4 Sn8 Br24]'
_cell_volume [1683.9497]
_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  0.1573  0.7500  1
  In  In1  4  0.0000  0.3249  0.2500  1
  Sn  Sn2  8  0.2213  0.5003  0.2107  1
  Br  Br3  8  0.1129  0.1213  0.1831  1
  Br  Br4  8  0.1272  0.7379  0.1006  1
  Br  Br5  8  0.1753  0.4340  0.9434  1
]