data_[Zn8Pd14Au2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Zn  1.6500  1.3500  0.8800
  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 [10.9904]
_cell_length_b [5.2071]
_cell_length_c [8.0702]
_cell_angle_alpha [90.0000]
_cell_angle_beta [121.5012]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Zn4Pd7Au]
_chemical_formula_sum '[Zn8 Pd14 Au2]'
_cell_volume [393.7835]
_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  4  0.0128  0.5000  0.6839  1
  Zn  Zn1  4  0.2462  0.0000  0.6863  1
  Pd  Pd2  4  0.0100  0.0000  0.3442  1
  Pd  Pd3  4  0.2287  0.5000  0.6238  1
  Pd  Pd4  4  0.2479  0.0000  0.0090  1
  Pd  Pd5  2  0.0000  0.5000  0.0000  1
  Au  Au6  2  0.0000  0.0000  0.0000  1
]