data_[Pd2Au2Cl8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pd  2.2000  1.4000  0.8462
  Au  2.5400  1.3500  1.0700
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [4.5268]
_cell_length_b [6.0367]
_cell_length_c [12.8238]
_cell_angle_alpha [96.9908]
_cell_angle_beta [91.0712]
_cell_angle_gamma [94.8917]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [PdAuCl4]
_chemical_formula_sum '[Pd2 Au2 Cl8]'
_cell_volume [346.4108]
_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
[
  Pd  Pd0  1  0.0000  0.0000  0.0000  1.0
  Pd  Pd1  1  0.5000  0.5000  0.5000  1.0
  Au  Au2  2  0.4753  0.7578  0.7599  1.0
  Cl  Cl3  2  0.1513  0.6781  0.9049  1.0
  Cl  Cl4  2  0.2624  0.9059  0.1440  1.0
  Cl  Cl5  2  0.2736  0.1785  0.4055  1.0
  Cl  Cl6  2  0.2854  0.4052  0.6525  1.0
]