data_Sn2B2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.69
_cell_length_b   4.69
_cell_length_c   4.69
_cell_angle_alpha   113.22
_cell_angle_beta   113.22
_cell_angle_gamma   102.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sn2B2Rh
_chemical_formula_sum   'Sn2 B2 Rh1'
_cell_volume   78.35
_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
  Sn  Sn3  1  0.0  0.58  0.47  1.0
  Sn  Sn4  1  0.58  0.0  0.47  1.0
  B  B0  1  0.0  0.0  0.75  1.0
  B  B1  1  0.0  0.0  0.13  1.0
  Rh  Rh2  1  0.0  0.0  0.0  1.0

data_Sn2B2Rh
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.89
_cell_length_b   7.3
_cell_length_c   4.69
_cell_angle_alpha   90.0
_cell_angle_beta   128.89
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Sn2B2Rh
_chemical_formula_sum   'Sn4 B4 Rh2'
_cell_volume   156.69
_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
  Sn  Sn0  4  0.32  0.21  0.53  1.0
  B  B1  2  0.25  0.0  0.25  1.0
  B  B2  2  0.37  0.5  0.87  1.0
  Rh  Rh3  2  0.0  0.0  0.0  1.0

Sn Sn B B Rh