# generated using pymatgen data_WCl3O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.24912700 _cell_length_b 12.24912700 _cell_length_c 3.82752600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural WCl3O _chemical_formula_sum 'W4 Cl12 O4' _cell_volume 574.28625825 _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 W W0 1 0.10893500 0.10893500 0.00000000 1.0 W W1 1 0.60893500 0.39106500 0.50000000 1.0 W W2 1 0.89106500 0.89106500 0.00000000 1.0 W W3 1 0.39106500 0.60893500 0.50000000 1.0 Cl Cl4 1 0.90000400 0.70230500 0.00000000 1.0 Cl Cl5 1 0.59821200 0.59821200 0.50000000 1.0 Cl Cl6 1 0.79769500 0.40000400 0.50000000 1.0 Cl Cl7 1 0.09821200 0.90178800 0.00000000 1.0 Cl Cl8 1 0.40178800 0.40178800 0.50000000 1.0 Cl Cl9 1 0.29769500 0.09999600 0.00000000 1.0 Cl Cl10 1 0.09999600 0.29769500 0.00000000 1.0 Cl Cl11 1 0.40000400 0.79769500 0.50000000 1.0 Cl Cl12 1 0.20230500 0.59999600 0.50000000 1.0 Cl Cl13 1 0.59999600 0.20230500 0.50000000 1.0 Cl Cl14 1 0.70230500 0.90000400 0.00000000 1.0 Cl Cl15 1 0.90178800 0.09821200 0.00000000 1.0 O O16 1 0.59899700 0.40100300 0.00000000 1.0 O O17 1 0.09899700 0.09899700 0.50000000 1.0 O O18 1 0.90100300 0.90100300 0.50000000 1.0 O O19 1 0.40100300 0.59899700 0.00000000 1.0