data_[Ag4Pd12Au4]
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 [C2/m]
_cell_length_a [9.9069]
_cell_length_b [4.7476]
_cell_length_c [7.5923]
_cell_angle_alpha [90.0000]
_cell_angle_beta [111.6295]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [AgPd3Au]
_chemical_formula_sum '[Ag4 Pd12 Au4]'
_cell_volume [331.9523]
_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  4  0.1516  0.0000  0.0526  1.0
  Pd  Pd1  4  0.0557  0.0000  0.3576  1.0
  Pd  Pd2  4  0.1487  0.5000  0.5478  1.0
  Pd  Pd3  4  0.2434  0.0000  0.7433  1.0
  Au  Au4  4  0.0456  0.5000  0.8440  1.0
]