data_SnPd2Rh
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54
_cell_length_b   5.54
_cell_length_c   3.0
_cell_angle_alpha   105.18
_cell_angle_beta   105.18
_cell_angle_gamma   121.26
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnPd2Rh
_chemical_formula_sum   'Sn1 Pd2 Rh1'
_cell_volume   66.69
_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  0.72  0.0  0.0  1.0
  Pd  Pd0  1  0.56  0.58  0.27  1.0
  Pd  Pd1  1  0.56  0.42  0.27  1.0
  Rh  Rh2  1  0.0  0.0  0.0  1.0

data_SnPd2Rh
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.0
_cell_length_b   4.6
_cell_length_c   5.54
_cell_angle_alpha   114.15
_cell_angle_beta   105.18
_cell_angle_gamma   91.21
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SnPd2Rh
_chemical_formula_sum   'Sn1 Pd2 Rh1'
_cell_volume   66.69
_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  0.0  0.72  1.0
  Pd  Pd1  1  0.68  0.42  0.97  1.0
  Pd  Pd2  1  0.85  0.58  0.14  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0

Sn Pd Pd Rh
Sn Pd Pd Rh 0 3 + o o 1 2 o o o 