data_[Al2Cd2Au4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Cd  1.6900  1.5500  1.0900
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cm]
_cell_length_a [9.5081]
_cell_length_b [3.4682]
_cell_length_c [4.6442]
_cell_angle_alpha [90.0000]
_cell_angle_beta [104.5840]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [8]
_chemical_formula_structural [AlCdAu2]
_chemical_formula_sum '[Al2 Cd2 Au4]'
_cell_volume [148.2160]
_cell_formula_units_Z [2]
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  2  0.2418  0.5000  0.1922  1.0
  Cd  Cd1  2  0.4983  0.0000  0.5296  1.0
  Au  Au2  2  0.0117  0.0000  0.0490  1.0
  Au  Au3  2  0.2481  0.0000  0.7292  1.0
]