data_[Ag8Pd20Au16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [Fmmm]
_cell_length_a [5.3055]
_cell_length_b [8.7328]
_cell_length_c [18.5113]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [69]
_chemical_formula_structural [Ag2Pd5Au4]
_chemical_formula_sum '[Ag8 Pd20 Au16]'
_cell_volume [857.6688]
_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
[
  Ag  Ag0  8  0.0000  0.0000  0.1700  1
  Pd  Pd1  8  0.2500  0.2500  0.0000  1
  Pd  Pd2  8  0.2500  0.2500  0.2500  1
  Pd  Pd3  4  0.0000  0.0000  0.5000  1
  Au  Au4  16  0.0000  0.1678  0.3732  1
]