data_[Sb4Au8Br24]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Sb  2.0500  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
  Br  2.9600  1.1500  0.8825
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [13.0322]
_cell_length_b [14.2717]
_cell_length_c [8.1781]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.7168]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [Sb(AuBr3)2]
_chemical_formula_sum '[Sb4 Au8 Br24]'
_cell_volume [1464.1993]
_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
[
  Sb  Sb0  4  0.0000  0.0974  0.2500  1.0
  Au  Au1  8  0.2277  0.4618  0.2220  1.0
  Br  Br2  8  0.1036  0.1124  0.6114  1.0
  Br  Br3  8  0.1105  0.4864  0.4515  1.0
  Br  Br4  8  0.1317  0.2120  0.1814  1.0
]