data_Al2RhAu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.42
_cell_length_b   8.42
_cell_length_c   8.42
_cell_angle_alpha   20.28
_cell_angle_beta   20.28
_cell_angle_gamma   20.28
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Al2RhAu
_chemical_formula_sum   'Al2 Rh1 Au1'
_cell_volume   62.83
_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  0.0  0.36  1.0
  Al  Al1  1  0.0  0.0  0.38  1.0
  Rh  Rh3  1  0.0  0.0  0.0  1.0
  Au  Au2  1  0.0  0.0  0.37  1.0

data_Al2RhAu
_symmetry_space_group_name_H-M   Cm
_cell_length_a   5.14
_cell_length_b   2.97
_cell_length_c   8.42
_cell_angle_alpha   90.0
_cell_angle_beta   101.73
_cell_angle_gamma   90.0
_symmetry_Int_Tables_number   8
_chemical_formula_structural   Al2RhAu
_chemical_formula_sum   'Al4 Rh2 Au2'
_cell_volume   125.65
_cell_formula_units_Z   2
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
  2  'x, -y, z'
  3  'x+1/2, y+1/2, z'
  4  'x+1/2, -y+1/2, 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  2  -0.0  0.0  0.62  1.0
  Al  Al1  2  -0.0  0.0  0.64  1.0
  Rh  Rh2  2  0.0  0.0  0.0  1.0
  Au  Au3  2  -0.0  0.0  0.63  1.0

Al Al Rh Au