data_[Pd4Pt2Cl12]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pd  2.2000  1.4000  0.8462
  Pt  2.2800  1.3500  0.8050
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [7.8369]
_cell_length_b [11.9569]
_cell_length_c [6.3931]
_cell_angle_alpha [90.0000]
_cell_angle_beta [122.0440]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pd2PtCl6]
_chemical_formula_sum '[Pd4 Pt2 Cl12]'
_cell_volume [507.7925]
_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  1.0
  Pt  Pt1  2  0.0000  0.0000  0.0000  1.0
  Cl  Cl2  8  0.2456  0.1357  0.1976  1.0
  Cl  Cl3  4  0.0000  0.1444  0.5000  1.0
]