data_[Zn2Ag12Au6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  Ag  1.9300  1.6000  1.0867
  Au  2.5400  1.3500  1.0700
]
_symmetry_space_group_name_H-M [P2_1/m]
_cell_length_a [8.7880]
_cell_length_b [4.0536]
_cell_length_c [11.6611]
_cell_angle_alpha [90.0000]
_cell_angle_beta [112.0889]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Zn(Ag2Au)3]
_chemical_formula_sum '[Zn2 Ag12 Au6]'
_cell_volume [384.9124]
_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
[
  Zn  Zn0  2  0.3354  0.7500  0.0014  1
  Ag  Ag1  2  0.1152  0.2500  0.0056  1
  Ag  Ag2  2  0.1263  0.2500  0.4603  1
  Ag  Ag3  2  0.2114  0.7500  0.2075  1
  Ag  Ag4  2  0.2918  0.2500  0.8424  1
  Ag  Ag5  2  0.3659  0.7500  0.4777  1
  Ag  Ag6  2  0.4544  0.2500  0.1556  1
  Au  Au7  2  0.0278  0.7500  0.8056  1
  Au  Au8  2  0.2086  0.7500  0.6527  1
  Au  Au9  2  0.4465  0.2500  0.6639  1
]