data_[S4Cl8O4]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  S  2.5800  1.0000  0.8800
  Cl  3.1600  1.0000  0.7800
  O  3.4400  0.6000  1.2600
]
_symmetry_space_group_name_H-M [C2/c]
_cell_length_a [12.9674]
_cell_length_b [4.8641]
_cell_length_c [6.9443]
_cell_angle_alpha [90.0000]
_cell_angle_beta [105.4349]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [SCl2O]
_chemical_formula_sum '[S4 Cl8 O4]'
_cell_volume [422.2146]
_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
[
  S  S0  4  0.0000  0.1015  0.2500  1
  Cl  Cl1  8  0.1360  0.0001  0.0676  1
  O  O2  4  0.0000  0.3966  0.2500  1
]