data_Rh3Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.95
_cell_length_b   4.2
_cell_length_c   5.25
_cell_angle_alpha   90.0
_cell_angle_beta   104.73
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Rh3Br
_chemical_formula_sum   'Rh3 Br1'
_cell_volume   62.73
_cell_formula_units_Z   1
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  Rh1  1  0.88  0.1  0.82  1.0
  Rh  Rh2  1  0.33  0.0  0.54  1.0
  Rh  Rh3  1  0.73  0.1  0.25  1.0
  Br  Br0  1  0.0  0.0  0.0  1.0

data_Rh3Br
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.95
_cell_length_b   4.2
_cell_length_c   5.25
_cell_angle_alpha   90.0
_cell_angle_beta   104.73
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Rh3Br
_chemical_formula_sum   'Rh3 Br1'
_cell_volume   62.73
_cell_formula_units_Z   1
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  1  0.33  0.0  0.54  1.0
  Rh  Rh1  1  0.73  0.1  0.25  1.0
  Rh  Rh2  1  0.88  0.1  0.82  1.0
  Br  Br3  1  0.0  0.0  0.0  1.0

Rh Rh Rh Br