data_[Pt1S6Cl2]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  Pt  2.2800  1.3500  0.8050
  S  2.5800  1.0000  0.8800
  Cl  3.1600  1.0000  0.7800
]
_symmetry_space_group_name_H-M [P-1]
_cell_length_a [5.0453]
_cell_length_b [7.3945]
_cell_length_c [7.8367]
_cell_angle_alpha [63.1023]
_cell_angle_beta [77.4608]
_cell_angle_gamma [85.2282]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [Pt(S3Cl)2]
_chemical_formula_sum '[Pt1 S6 Cl2]'
_cell_volume [254.4810]
_cell_formula_units_Z [1]
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  1  0.0000  0.0000  0.0000  1.0
  S  S1  2  0.0390  0.5158  0.7299  1.0
  S  S2  2  0.1262  0.2517  0.4789  1.0
  S  S3  2  0.1299  0.7419  0.2678  1.0
  Cl  Cl4  2  0.3267  0.8854  0.8141  1.0
]