data_ZnReRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.64
_cell_length_b   4.64
_cell_length_c   4.64
_cell_angle_alpha   130.16
_cell_angle_beta   130.16
_cell_angle_gamma   73.15
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnReRh2
_chemical_formula_sum   'Zn1 Re1 Rh2'
_cell_volume   56.88
_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
  Zn  Zn3  1  0.0  0.0  0.0  1.0
  Re  Re0  1  0.0  0.0  0.72  1.0
  Rh  Rh1  1  0.0  0.95  0.86  1.0
  Rh  Rh2  1  0.95  0.0  0.86  1.0

data_ZnReRh2
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.53
_cell_length_b   5.53
_cell_length_c   4.64
_cell_angle_alpha   90.0
_cell_angle_beta   126.58
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   ZnReRh2
_chemical_formula_sum   'Zn2 Re2 Rh4'
_cell_volume   113.76
_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
  Zn  Zn0  2  0.0  0.0  0.0  1.0
  Re  Re1  2  0.28  0.0  0.28  1.0
  Rh  Rh2  4  0.11  0.02  0.09  1.0

Zn Re Rh Rh