data_BMo2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.02
_cell_length_b   7.02
_cell_length_c   7.02
_cell_angle_alpha   24.96
_cell_angle_beta   24.96
_cell_angle_gamma   24.96
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BMo2Rh
_chemical_formula_sum   'B1 Mo2 Rh1'
_cell_volume   54.1
_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
  B  B0  1  0.0  0.0  0.0  1.0
  Mo  Mo1  1  0.0  0.0  0.57  1.0
  Mo  Mo2  1  0.0  0.0  0.81  1.0
  Rh  Rh3  1  0.0  0.0  0.19  1.0

data_BMo2Rh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.25
_cell_length_b   3.03
_cell_length_c   7.02
_cell_angle_alpha   90.0
_cell_angle_beta   104.45
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   BMo2Rh
_chemical_formula_sum   'B2 Mo4 Rh2'
_cell_volume   108.2
_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
  B  B0  2  0.0  0.0  0.0  1.0
  Mo  Mo1  2  0.0  0.0  0.19  1.0
  Mo  Mo2  2  0.0  0.0  0.43  1.0
  Rh  Rh3  2  0.0  0.0  0.81  1.0

B Mo Mo Rh
B Mo Mo Rh 0 2 o o - 0 3 o o o 1 2 o o o 