data_Sb2PtAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.02
_cell_length_b   5.02
_cell_length_c   5.02
_cell_angle_alpha   124.47
_cell_angle_beta   122.77
_cell_angle_gamma   83.84
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb2PtAu
_chemical_formula_sum   'Sb2 Pt1 Au1'
_cell_volume   84.01
_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  Sb2  1  0.0  0.4  0.91  1.0
  Sb  Sb3  1  0.34  0.0  0.83  1.0
  Pt  Pt1  1  0.0  0.0  0.0  1.0
  Au  Au0  1  0.0  0.0  0.74  1.0

data_Sb2PtAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   4.68
_cell_length_b   4.81
_cell_length_c   5.02
_cell_angle_alpha   118.61
_cell_angle_beta   117.76
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb2PtAu
_chemical_formula_sum   'Sb2 Pt1 Au1'
_cell_volume   84.01
_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  0.83  0.49  1.0
  Sb  Sb1  1  0.6  0.51  0.51  1.0
  Pt  Pt2  1  0.0  0.0  0.0  1.0
  Au  Au3  1  0.0  0.74  0.74  1.0

Sb Sb Pt Au
Sb Sb Pt Au 0 3 o o o 1 3 o o o 2 3 o o - 