data_ZnReRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.66
_cell_length_b   4.66
_cell_length_c   4.77
_cell_angle_alpha   98.24
_cell_angle_beta   98.24
_cell_angle_gamma   33.87
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnReRh2
_chemical_formula_sum   'Zn1 Re1 Rh2'
_cell_volume   57.06
_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  0.1  0.0  0.36  1.0
  Rh  Rh1  1  0.51  0.0  0.2  1.0
  Rh  Rh2  1  0.69  0.0  0.52  1.0

data_ZnReRh2
_symmetry_space_group_name_H-M   P1
_cell_length_a   2.71
_cell_length_b   4.66
_cell_length_c   4.77
_cell_angle_alpha   98.24
_cell_angle_beta   90.0
_cell_angle_gamma   106.93
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnReRh2
_chemical_formula_sum   'Zn1 Re1 Rh2'
_cell_volume   57.06
_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  Zn0  1  0.0  0.0  0.0  1.0
  Re  Re1  1  0.0  0.9  0.64  1.0
  Rh  Rh2  1  0.0  0.31  0.48  1.0
  Rh  Rh3  1  0.0  0.49  0.8  1.0

Zn Re Rh Rh
Zn Re Rh Rh 0 1 o o o 2 3 o o o 