data_MoRh3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.3
_cell_length_b   5.3
_cell_length_c   4.49
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.16
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MoRh3
_chemical_formula_sum   'Mo2 Rh6'
_cell_volume   126.18
_cell_formula_units_Z   2
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
  Mo  Mo0  1  0.74  0.67  0.12  1.0
  Mo  Mo1  1  0.74  0.33  0.37  1.0
  Rh  Rh2  1  0.74  0.86  0.37  1.0
  Rh  Rh3  1  0.74  0.14  0.12  1.0
  Rh  Rh4  1  0.48  0.84  0.37  1.0
  Rh  Rh5  1  0.0  0.16  0.12  1.0
  Rh  Rh6  1  0.0  0.84  0.37  1.0
  Rh  Rh7  1  0.48  0.16  0.12  1.0

data_MoRh3
_symmetry_space_group_name_H-M   P2/m
_cell_length_a   4.49
_cell_length_b   5.3
_cell_length_c   5.3
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   10
_chemical_formula_structural   MoRh3
_chemical_formula_sum   'Mo2 Rh6'
_cell_volume   126.18
_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, 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
  Mo  Mo0  2  0.12  0.5  0.33  1.0
  Rh  Rh1  4  0.12  0.24  0.84  1.0
  Rh  Rh2  2  0.12  0.5  0.86  1.0

Mo Mo Rh Rh Rh Rh Rh Rh