data_[Zn12Ag6Au2]
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 [7.6016]
_cell_length_b [4.5322]
_cell_length_c [9.9209]
_cell_angle_alpha [90.0000]
_cell_angle_beta [110.6159]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [11]
_chemical_formula_structural [Zn6Ag3Au]
_chemical_formula_sum '[Zn12 Ag6 Au2]'
_cell_volume [319.9105]
_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  0.0002  0.7500  0.8337  1
  Zn  Zn1  2  0.0019  0.2500  0.6765  1
  Zn  Zn2  2  0.1970  0.7500  0.1347  1
  Zn  Zn3  2  0.2113  0.2500  0.4722  1
  Zn  Zn4  2  0.3959  0.7500  0.9320  1
  Zn  Zn5  2  0.4134  0.2500  0.2735  1
  Ag  Ag6  2  0.1757  0.7500  0.6279  1
  Ag  Ag7  2  0.2015  0.2500  0.9774  1
  Ag  Ag8  2  0.4045  0.2500  0.7743  1
  Au  Au9  2  0.3835  0.7500  0.4247  1
]