data_ReRh2Cl
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.73
_cell_length_b   8.73
_cell_length_c   8.73
_cell_angle_alpha   18.72
_cell_angle_beta   18.72
_cell_angle_gamma   18.72
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReRh2Cl
_chemical_formula_sum   'Re1 Rh2 Cl1'
_cell_volume   59.85
_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
  Re  Re1  1  0.0  0.0  0.86  1.0
  Rh  Rh2  1  0.0  0.0  0.4  1.0
  Rh  Rh3  1  0.0  0.0  0.32  1.0
  Cl  Cl0  1  0.0  0.0  0.0  1.0

data_ReRh2Cl
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.92
_cell_length_b   2.84
_cell_length_c   8.73
_cell_angle_alpha   90.0
_cell_angle_beta   100.82
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ReRh2Cl
_chemical_formula_sum   'Re2 Rh4 Cl2'
_cell_volume   119.69
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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
  Re  Re0  2  0.0  0.0  0.14  1.0
  Rh  Rh1  2  0.0  0.0  0.6  1.0
  Rh  Rh2  2  0.0  0.0  0.68  1.0
  Cl  Cl3  2  0.0  0.0  0.0  1.0

Re Rh Rh Cl