data_GeMoRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.85
_cell_length_b   5.85
_cell_length_c   5.85
_cell_angle_alpha   151.72
_cell_angle_beta   151.72
_cell_angle_gamma   40.43
_symmetry_Int_Tables_number   1
_chemical_formula_structural   GeMoRh
_chemical_formula_sum   'Ge1 Mo1 Rh1'
_cell_volume   44.88
_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
  Ge  Ge0  1  0.0  0.0  0.05  1.0
  Mo  Mo1  1  0.0  0.0  0.64  1.0
  Rh  Rh2  1  0.0  0.0  0.29  1.0

data_GeMoRh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.04
_cell_length_b   4.04
_cell_length_c   5.85
_cell_angle_alpha   90.0
_cell_angle_beta   110.21
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   GeMoRh
_chemical_formula_sum   'Ge2 Mo2 Rh2'
_cell_volume   89.76
_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
  Ge  Ge0  2  0.05  0.0  0.05  1.0
  Mo  Mo1  2  0.14  0.5  0.64  1.0
  Rh  Rh2  2  0.29  0.0  0.29  1.0

Ge Mo Rh
Ge Mo Rh 0 2 o o o 0 1 o o - 1 2 o o o 