data_[Rh4Br4Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Rh  2.2800  1.3500  0.7450
  Br  2.9600  1.1500  0.8825
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [Amm2]
_cell_length_a [6.1911]
_cell_length_b [11.3325]
_cell_length_c [6.4620]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [38]
_chemical_formula_structural [RhBrCl2]
_chemical_formula_sum '[Rh4 Br4 Cl8]'
_cell_volume [453.3795]
_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
[
  Rh  Rh0  4  0.2531  0.0000  0.9973  1
  Br  Br1  4  0.0000  0.1469  0.1503  1
  Cl  Cl2  4  0.5000  0.1386  0.8538  1
  Cl  Cl3  2  0.0000  0.0000  0.7222  1
  Cl  Cl4  2  0.5000  0.0000  0.2750  1
]