data_SbRh2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.72
_cell_length_b   4.72
_cell_length_c   3.15
_cell_angle_alpha   91.83
_cell_angle_beta   91.83
_cell_angle_gamma   105.98
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbRh2Au
_chemical_formula_sum   'Sb1 Rh2 Au1'
_cell_volume   67.43
_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
  Sb  Sb3  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.34  0.88  0.57  1.0
  Rh  Rh2  1  0.34  0.12  0.57  1.0
  Au  Au0  1  0.84  0.0  0.0  1.0

data_SbRh2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.15
_cell_length_b   4.72
_cell_length_c   4.72
_cell_angle_alpha   105.98
_cell_angle_beta   91.83
_cell_angle_gamma   91.83
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SbRh2Au
_chemical_formula_sum   'Sb1 Rh2 Au1'
_cell_volume   67.43
_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
  Sb  Sb0  1  0.0  0.0  0.0  1.0
  Rh  Rh1  1  0.57  0.34  0.12  1.0
  Rh  Rh2  1  0.57  0.34  0.88  1.0
  Au  Au3  1  -0.0  0.84  0.0  1.0

Sb Rh Rh Au
Sb Rh Rh Au 0 3 - o o 1 2 o + o 