data_[W2Cl2O6]
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 [P-1]
_cell_length_a [3.9418]
_cell_length_b [5.9196]
_cell_length_c [8.7989]
_cell_angle_alpha [81.5294]
_cell_angle_beta [88.5547]
_cell_angle_gamma [89.9492]
_symmetry_Int_Tables_number [2]
_chemical_formula_structural [WClO3]
_chemical_formula_sum '[W2 Cl2 O6]'
_cell_volume [203.0059]
_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
[
  W  W0  2  0.4431  0.7543  0.4809  1
  Cl  Cl1  2  0.0467  0.8354  0.0349  1
  O  O2  2  0.0164  0.2471  0.5134  1
  O  O3  2  0.4939  0.9585  0.6453  1
  O  O4  2  0.4941  0.4779  0.6454  1
]