data_[Pt2Cl6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pt  2.2800  1.3500  0.8050
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [6.2480]
_cell_length_b [6.2489]
_cell_length_c [7.2011]
_cell_angle_alpha [115.2395]
_cell_angle_beta [90.7397]
_cell_angle_gamma [116.2194]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [PtCl3]
_chemical_formula_sum '[Pt2 Cl6]'
_cell_volume [221.0168]
_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
[
  Pt  Pt0  2  0.3352  0.6653  0.0003  1.0
  Cl  Cl1  2  0.0993  0.8061  0.2153  1.0
  Cl  Cl2  2  0.2652  0.8291  0.7847  1.0
  Cl  Cl3  2  0.4319  0.5018  0.2127  1.0
]