data_[Al4Ag8Au8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Al  1.6100  1.2500  0.6750
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Cmc2_1]
_cell_length_a [4.6014]
_cell_length_b [14.7493]
_cell_length_c [5.2953]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [36]
_chemical_formula_structural [Al(AgAu)2]
_chemical_formula_sum '[Al4 Ag8 Au8]'
_cell_volume [359.3765]
_cell_formula_units_Z [4]
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  4  0.0000  0.4271  0.4686  1.0
  Ag  Ag1  4  0.0000  0.0363  0.6916  1.0
  Ag  Ag2  4  0.0000  0.2327  0.6130  1.0
  Au  Au3  4  0.0000  0.1540  0.1206  1.0
  Au  Au4  4  0.0000  0.3850  0.9717  1.0
]