data_Sb2MoRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.35
_cell_length_b   3.35
_cell_length_c   6.48
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb2MoRh
_chemical_formula_sum   'Sb2 Mo1 Rh1'
_cell_volume   72.85
_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
  Sb  Sb2  1  0.68  0.68  0.88  1.0
  Sb  Sb3  1  0.68  0.68  0.59  1.0
  Mo  Mo0  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.0  0.0  0.24  1.0

data_Sb2MoRh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   4.74
_cell_length_b   4.74
_cell_length_c   6.48
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Sb2MoRh
_chemical_formula_sum   'Sb4 Mo2 Rh2'
_cell_volume   145.69
_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
  Sb  Sb0  2  0.18  0.5  0.59  1.0
  Sb  Sb1  2  0.18  0.5  0.88  1.0
  Mo  Mo2  2  0.0  0.0  0.0  1.0
  Rh  Rh3  2  0.0  0.0  0.24  1.0

Sb Sb Mo Rh
Sb Sb Mo Rh 0 1 o o o 0 2 + + + 2 3 o o o 