data_[In4Ga8Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  In  1.7800  1.5500  0.9400
  Ga  1.8100  1.3000  0.7600
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [15.1380]
_cell_length_b [13.6234]
_cell_length_c [8.2281]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.5383]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [In(GaBr3)2]
_chemical_formula_sum '[In4 Ga8 Br24]'
_cell_volume [1578.3947]
_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
[
  In  In0  4  0.0000  0.1320  0.7500  1
  Ga  Ga1  8  0.2152  0.4144  0.7175  1
  Br  Br2  8  0.1143  0.0694  0.1723  1
  Br  Br3  8  0.1505  0.4983  0.9253  1
  Br  Br4  8  0.1756  0.2434  0.6870  1
]