data_[Zn2Pd8Au2]
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 [P-1]
_cell_length_a [4.8891]
_cell_length_b [6.3486]
_cell_length_c [6.8903]
_cell_angle_alpha [113.0444]
_cell_angle_beta [90.9740]
_cell_angle_gamma [105.6866]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [ZnPd4Au]
_chemical_formula_sum '[Zn2 Pd8 Au2]'
_cell_volume [187.6433]
_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  0.3705  0.3698  0.1297  1.0
  Pd  Pd1  2  0.0632  0.3843  0.8024  1.0
  Pd  Pd2  2  0.2066  0.8765  0.9562  1.0
  Pd  Pd3  2  0.2921  0.6252  0.5386  1.0
  Pd  Pd4  2  0.4709  0.1423  0.7224  1.0
  Au  Au5  2  0.1258  0.1238  0.3752  1.0
]