data_[Ag36Sn3Au18]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Ag  1.9300  1.6000  1.0867
  Sn  1.9600  1.4500  0.8300
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [R-3m]
_cell_length_a [11.4574]
_cell_length_b [11.4574]
_cell_length_c [9.5303]
_cell_angle_alpha [90.0000]
_cell_angle_beta [90.0000]
_cell_angle_gamma [120.0000]
_symmetry_Int_Tables_number [166]
_chemical_formula_structural [Ag12SnAu6]
_chemical_formula_sum '[Ag36 Sn3 Au18]'
_cell_volume [1083.4599]
_cell_formula_units_Z [3]
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  18  0.0000  0.2646  0.0000  1.0
  Ag  Ag1  18  0.0695  0.5347  0.1214  1.0
  Sn  Sn2  3  0.0000  0.0000  0.0000  1.0
  Au  Au3  18  0.0849  0.1697  0.7472  1.0
]