data_[Pd2S4Cl16]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pd  2.2000  1.4000  0.8462
  S  2.5800  1.0000  0.8800
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [C2/m]
_cell_length_a [13.4361]
_cell_length_b [7.4616]
_cell_length_c [7.0931]
_cell_angle_alpha [90.0000]
_cell_angle_beta [106.3360]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pd(SCl4)2]
_chemical_formula_sum '[Pd2 S4 Cl16]'
_cell_volume [682.3999]
_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  2  0.0000  0.0000  0.0000  1.0
  S  S1  4  0.2196  0.5000  0.2456  1.0
  Cl  Cl2  8  0.1106  0.2158  0.9415  1.0
  Cl  Cl3  4  0.0972  0.5000  0.3523  1.0
  Cl  Cl4  4  0.1611  0.0000  0.5070  1.0
]