# generated using pymatgen data_IrWO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.33909700 _cell_length_b 5.23590300 _cell_length_c 9.14744930 _cell_angle_alpha 55.05923353 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural IrWO6 _chemical_formula_sum 'Ir2 W2 O12' _cell_volume 209.62253527 _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 Ir Ir0 1 0.50000000 0.50000000 0.50000000 1.0 Ir Ir1 1 0.00000000 0.50000000 0.00000000 1.0 W W2 1 0.50000000 0.00000000 0.00000000 1.0 W W3 1 0.00000000 0.00000000 0.50000000 1.0 O O4 1 0.48902500 0.67266600 0.25140800 1.0 O O5 1 0.20650400 0.83119300 0.96180400 1.0 O O6 1 0.20923100 0.25732300 0.53815400 1.0 O O7 1 0.70923100 0.74267700 0.96184600 1.0 O O8 1 0.70650400 0.16880700 0.53819600 1.0 O O9 1 0.98902500 0.32733400 0.24859200 1.0 O O10 1 0.01097500 0.67266600 0.75140800 1.0 O O11 1 0.29349600 0.83119300 0.46180400 1.0 O O12 1 0.29076900 0.25732300 0.03815400 1.0 O O13 1 0.79349600 0.16880700 0.03819600 1.0 O O14 1 0.79076900 0.74267700 0.46184600 1.0 O O15 1 0.51097500 0.32733400 0.74859200 1.0