data_[Pd8S4Cl8]
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 [18.3168]
_cell_length_b [3.4805]
_cell_length_c [7.4396]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.6773]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [12]
_chemical_formula_structural [Pd2SCl2]
_chemical_formula_sum '[Pd8 S4 Cl8]'
_cell_volume [456.6462]
_cell_formula_units_Z [4]
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  0.1683  0.5000  0.8490  1.0
  Pd  Pd1  4  0.1943  0.0000  0.4663  1.0
  S  S2  4  0.2433  0.0000  0.7872  1.0
  Cl  Cl3  4  0.0879  0.0000  0.9099  1.0
  Cl  Cl4  4  0.0977  0.5000  0.4012  1.0
]