data_[W8Cl24O8]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  W  2.3600  1.3500  0.7667
  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 [13.4813]
_cell_length_b [17.3611]
_cell_length_c [6.4004]
_cell_angle_alpha [90.0000]
_cell_angle_beta [115.6188]
_cell_angle_gamma [90.0000]
_symmetry_Int_Tables_number [15]
_chemical_formula_structural [WCl3O]
_chemical_formula_sum '[W8 Cl24 O8]'
_cell_volume [1350.7400]
_cell_formula_units_Z [8]
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
[
  W  W0  4  0.0000  0.0589  0.7500  1
  W  W1  4  0.0000  0.3240  0.2500  1
  Cl  Cl2  8  0.0906  0.3964  0.0909  1
  Cl  Cl3  8  0.1065  0.0505  0.5106  1
  Cl  Cl4  8  0.1276  0.1454  0.9985  1
  O  O5  8  0.0938  0.2650  0.4629  1
]