data_Sn2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.95
_cell_length_b   8.95
_cell_length_c   8.95
_cell_angle_alpha   60.0
_cell_angle_beta   60.0
_cell_angle_gamma   60.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sn2Rh
_chemical_formula_sum   'Sn16 Rh8'
_cell_volume   506.33
_cell_formula_units_Z   8
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  Sn8  1  0.58  0.58  0.58  1.0
  Sn  Sn9  1  0.74  0.74  0.58  1.0
  Sn  Sn10  1  0.74  0.58  0.74  1.0
  Sn  Sn11  1  0.58  0.74  0.74  1.0
  Sn  Sn12  1  0.33  0.33  0.84  1.0
  Sn  Sn13  1  0.33  0.84  0.33  1.0
  Sn  Sn14  1  0.81  0.33  0.33  1.0
  Sn  Sn15  1  0.84  0.33  0.33  1.0
  Sn  Sn16  1  0.33  0.81  0.33  1.0
  Sn  Sn17  1  0.33  0.33  0.81  1.0
  Sn  Sn18  1  0.49  0.49  0.98  1.0
  Sn  Sn19  1  0.49  0.98  0.49  1.0
  Sn  Sn20  1  0.0  0.49  0.49  1.0
  Sn  Sn21  1  0.98  0.49  0.49  1.0
  Sn  Sn22  1  0.49  0.0  0.49  1.0
  Sn  Sn23  1  0.49  0.49  0.0  1.0
  Rh  Rh0  1  0.48  0.5  0.5  1.0
  Rh  Rh1  1  0.5  0.48  0.5  1.0
  Rh  Rh2  1  0.5  0.5  0.48  1.0
  Rh  Rh3  1  0.48  0.48  0.48  1.0
  Rh  Rh4  1  0.33  0.32  0.32  1.0
  Rh  Rh5  1  0.32  0.33  0.32  1.0
  Rh  Rh6  1  0.32  0.32  0.33  1.0
  Rh  Rh7  1  0.33  0.33  0.33  1.0

data_Sn2Rh
_symmetry_space_group_name_H-M   R3m
_cell_length_a   8.95
_cell_length_b   8.95
_cell_length_c   21.91
_cell_angle_alpha   90.0
_cell_angle_beta   90.0
_cell_angle_gamma   120.0
_symmetry_Int_Tables_number   160
_chemical_formula_structural   Sn2Rh
_chemical_formula_sum   'Sn48 Rh24'
_cell_volume   1518.98
_cell_formula_units_Z   24
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  '-y, x-y, z'
  3  '-x+y, -x, z'
  4  '-y, -x, z'
  5  '-x+y, y, z'
  6  'x, x-y, z'
  7  'x+1/3, y+2/3, z+2/3'
  8  '-y+1/3, x-y+2/3, z+2/3'
  9  '-x+y+1/3, -x+2/3, z+2/3'
  10  '-y+1/3, -x+2/3, z+2/3'
  11  '-x+y+1/3, y+2/3, z+2/3'
  12  'x+1/3, x-y+2/3, z+2/3'
  13  'x+2/3, y+1/3, z+1/3'
  14  '-y+2/3, x-y+1/3, z+1/3'
  15  '-x+y+2/3, -x+1/3, z+1/3'
  16  '-y+2/3, -x+1/3, z+1/3'
  17  '-x+y+2/3, y+1/3, z+1/3'
  18  'x+2/3, x-y+1/3, z+1/3'
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  9  0.01  0.5  0.02  1.0
  Sn  Sn1  9  0.01  0.5  0.18  1.0
  Sn  Sn2  9  0.11  0.05  0.31  1.0
  Sn  Sn3  9  0.17  0.34  0.34  1.0
  Sn  Sn4  9  0.17  0.34  0.5  1.0
  Sn  Sn5  3  0.0  0.0  0.42  1.0
  Rh  Rh6  9  0.01  0.01  0.68  1.0
  Rh  Rh7  9  0.01  0.01  0.51  1.0
  Rh  Rh8  3  0.0  0.0  0.52  1.0
  Rh  Rh9  3  0.0  0.0  0.67  1.0

Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Sn Rh Rh Rh Rh Rh Rh Rh Rh