data_[Rh4Br4F4]
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
  F  3.9800  0.5000  0.7050
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [11.4409]
_cell_length_b [3.6436]
_cell_length_c [6.0090]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.2117]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [RhBrF]
_chemical_formula_sum '[Rh4 Br4 F4]'
_cell_volume [235.0646]
_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  0.2473  0.5000  0.7489  1
  Br  Br1  4  0.1194  0.0000  0.8214  1
  F  F2  4  0.1631  0.5000  0.3580  1
]