# generated using pymatgen data_Ba2WO6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.03042400 _cell_length_b 7.77702400 _cell_length_c 9.34948513 _cell_angle_alpha 60.90761928 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba2WO6 _chemical_formula_sum 'Ba8 W4 O24' _cell_volume 637.31009910 _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 Ba Ba0 1 0.85115400 0.32408500 0.55642300 1.0 Ba Ba1 1 0.64884600 0.32408500 0.05642300 1.0 Ba Ba2 1 0.14884600 0.67591500 0.44357700 1.0 Ba Ba3 1 0.35115400 0.67591500 0.94357700 1.0 Ba Ba4 1 0.79255300 0.85488800 0.03456400 1.0 Ba Ba5 1 0.70744700 0.85488800 0.53456400 1.0 Ba Ba6 1 0.20744700 0.14511200 0.96543600 1.0 Ba Ba7 1 0.29255300 0.14511200 0.46543600 1.0 W W8 1 0.98818900 0.30874900 0.18792000 1.0 W W9 1 0.51181100 0.30874900 0.68792000 1.0 W W10 1 0.01181100 0.69125100 0.81208000 1.0 W W11 1 0.48818900 0.69125100 0.31208000 1.0 O O12 1 0.11848900 0.46757600 0.98383400 1.0 O O13 1 0.38151100 0.46757600 0.48383400 1.0 O O14 1 0.88151100 0.53242400 0.01616600 1.0 O O15 1 0.61848900 0.53242400 0.51616600 1.0 O O16 1 0.83788800 0.21041500 0.32021700 1.0 O O17 1 0.66211200 0.21041500 0.82021700 1.0 O O18 1 0.16211200 0.78958500 0.67978300 1.0 O O19 1 0.33788800 0.78958500 0.17978300 1.0 O O20 1 0.10554500 0.08943900 0.26607400 1.0 O O21 1 0.39445500 0.08943900 0.76607400 1.0 O O22 1 0.89445500 0.91056100 0.73392600 1.0 O O23 1 0.60554500 0.91056100 0.23392600 1.0 O O24 1 0.93093500 0.16675600 0.05749100 1.0 O O25 1 0.56906500 0.16675600 0.55749100 1.0 O O26 1 0.06906500 0.83324400 0.94250900 1.0 O O27 1 0.43093500 0.83324400 0.44250900 1.0 O O28 1 0.06832400 0.41522500 0.30617600 1.0 O O29 1 0.43167600 0.41522500 0.80617600 1.0 O O30 1 0.93167600 0.58477500 0.69382400 1.0 O O31 1 0.56832400 0.58477500 0.19382400 1.0 O O32 1 0.90614900 0.69444000 0.32383400 1.0 O O33 1 0.59385100 0.69444000 0.82383400 1.0 O O34 1 0.09385100 0.30556000 0.67616600 1.0 O O35 1 0.40614900 0.30556000 0.17616600 1.0