data_Al2SnAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.56
_cell_length_b   5.56
_cell_length_c   5.56
_cell_angle_alpha   144.47
_cell_angle_beta   123.53
_cell_angle_gamma   68.52
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2SnAu
_chemical_formula_sum   'Al2 Sn1 Au1'
_cell_volume   82.21
_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
  Al  Al0  1  0.0  0.63  0.08  1.0
  Al  Al1  1  0.7  0.0  0.52  1.0
  Sn  Sn3  1  0.0  0.0  0.0  1.0
  Au  Au2  1  0.0  0.0  0.6  1.0

data_Al2SnAu
_symmetry_space_group_name_H-M   P1
_cell_length_a   3.4
_cell_length_b   5.26
_cell_length_c   5.56
_cell_angle_alpha   118.24
_cell_angle_beta   107.77
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2SnAu
_chemical_formula_sum   'Al2 Sn1 Au1'
_cell_volume   82.21
_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
  Al  Al0  1  0.0  0.52  0.82  1.0
  Al  Al1  1  0.37  0.44  0.44  1.0
  Sn  Sn2  1  0.0  0.0  0.0  1.0
  Au  Au3  1  0.0  0.6  0.6  1.0

Al Al Sn Au