data_ReRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.75
_cell_length_b   4.75
_cell_length_c   4.38
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   60.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ReRh2
_chemical_formula_sum   'Re2 Rh4'
_cell_volume   85.79
_cell_formula_units_Z   2
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  Re0  1  0.11  0.42  0.1  1.0
  Re  Re1  1  0.11  0.58  0.29  1.0
  Rh  Rh2  1  0.74  0.8  0.1  1.0
  Rh  Rh3  1  0.48  0.2  0.29  1.0
  Rh  Rh4  1  0.48  0.8  0.1  1.0
  Rh  Rh5  1  0.74  0.2  0.29  1.0

data_ReRh2
_symmetry_space_group_name_H-M   P-1
_cell_length_a   4.38
_cell_length_b   4.75
_cell_length_c   4.75
_cell_angle_alpha   119.79
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   2
_chemical_formula_structural   ReRh2
_chemical_formula_sum   'Re2 Rh4'
_cell_volume   85.79
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-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  Re0  2  0.4  0.0  0.42  1.0
  Rh  Rh1  2  0.4  0.37  0.8  1.0
  Rh  Rh2  2  0.4  0.63  0.8  1.0

Re Re Rh Rh Rh Rh
Re Re Rh Rh Rh Rh 0 1 o o o 2 4 o o o 3 5 o o o 