data_Sn2OsRh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.18
_cell_length_b   5.18
_cell_length_c   4.57
_cell_angle_alpha   102.05
_cell_angle_beta   102.05
_cell_angle_gamma   36.28
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sn2OsRh
_chemical_formula_sum   'Sn2 Os1 Rh1'
_cell_volume   70.77
_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  Sn2  1  0.9  0.0  0.12  1.0
  Sn  Sn3  1  0.09  0.0  0.46  1.0
  Os  Os0  1  0.37  0.0  0.87  1.0
  Rh  Rh1  1  0.74  0.0  0.69  1.0

data_Sn2OsRh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.23
_cell_length_b   4.57
_cell_length_c   5.18
_cell_angle_alpha   102.05
_cell_angle_beta   108.14
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sn2OsRh
_chemical_formula_sum   'Sn2 Os1 Rh1'
_cell_volume   70.77
_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  Sn0  1  0.0  0.12  0.9  1.0
  Sn  Sn1  1  0.0  0.46  0.09  1.0
  Os  Os2  1  0.0  0.87  0.37  1.0
  Rh  Rh3  1  0.0  0.69  0.74  1.0

Sn Sn Os Rh
Sn Sn Os Rh 0 3 o o - 0 1 + o o 1 2 o o o 1 3 - o o 2 3 o o o 