data_[Ag6Sn2Au12]
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 [P2_1/c]
_cell_length_a [6.8063]
_cell_length_b [7.4978]
_cell_length_c [10.3112]
_cell_angle_alpha [90.0000]
_cell_angle_beta [131.3796]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [14]
_chemical_formula_structural [Ag3SnAu6]
_chemical_formula_sum '[Ag6 Sn2 Au12]'
_cell_volume [394.8349]
_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
[
  Ag  Ag0  4  0.3526  0.1935  0.5976  1.0
  Ag  Ag1  2  0.5000  0.0000  0.0000  1.0
  Sn  Sn2  2  0.0000  0.0000  0.0000  1.0
  Au  Au3  4  0.0526  0.6481  0.8039  1.0
  Au  Au4  4  0.1835  0.6288  0.1461  1.0
  Au  Au5  4  0.4032  0.1356  0.3582  1.0
]