data_[Pd4Au2Cl12]
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 [C2/m]
_cell_length_a [7.6877]
_cell_length_b [12.3731]
_cell_length_c [6.3205]
_cell_angle_alpha [90.0000]
_cell_angle_beta [119.5119]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pd2AuCl6]
_chemical_formula_sum '[Pd4 Au2 Cl12]'
_cell_volume [523.2064]
_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  4  0.2500  0.2500  0.5000  1
  Au  Au1  2  0.0000  0.0000  0.0000  1
  Cl  Cl2  8  0.2399  0.3616  0.7916  1
  Cl  Cl3  4  0.0000  0.1438  0.5000  1
]