data_ZnGeRh2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.28
_cell_length_b   4.28
_cell_length_c   3.02
_cell_angle_alpha   90.85
_cell_angle_beta   90.85
_cell_angle_gamma   92.07
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ZnGeRh2
_chemical_formula_sum   'Zn1 Ge1 Rh2'
_cell_volume   55.29
_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
  Ge  Ge0  1  0.97  0.0  0.0  1.0
  Rh  Rh1  1  0.45  0.46  0.51  1.0
  Rh  Rh2  1  0.45  0.54  0.51  1.0

data_ZnGeRh2
_symmetry_space_group_name_H-M   Pmm2
_cell_length_a   3.02
_cell_length_b   4.28
_cell_length_c   4.28
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   25
_chemical_formula_structural   ZnGeRh2
_chemical_formula_sum   'Zn1 Ge1 Rh2'
_cell_volume   55.33
_cell_formula_units_Z   1
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-x, -y, z'
  3  '-x, y, z'
  4  '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
  Ge  Ge1  1  0.0  0.0  0.03  1.0
  Rh  Rh2  2  0.5  0.46  0.55  1.0

Zn Ge Rh Rh