data_Sb2Au
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.38
_cell_length_b   6.38
_cell_length_c   6.38
_cell_angle_alpha   150.05
_cell_angle_beta   142.6
_cell_angle_gamma   48.64
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb2Au
_chemical_formula_sum   'Sb2 Au1'
_cell_volume   78.46
_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  Sb1  1  0.0  0.0  0.3  1.0
  Sb  Sb2  1  0.0  0.0  0.33  1.0
  Au  Au0  1  0.0  0.0  0.0  1.0

data_Sb2Au
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.3
_cell_length_b   4.09
_cell_length_c   6.38
_cell_angle_alpha   108.7
_cell_angle_beta   104.98
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sb2Au
_chemical_formula_sum   'Sb2 Au1'
_cell_volume   78.46
_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  0.3  0.3  1.0
  Sb  Sb1  1  0.0  0.33  0.33  1.0
  Au  Au2  1  0.0  0.0  0.0  1.0

Sb Sb Au
Sb Sb Au 0 1 o o o 0 2 o o o 1 2 o o o 