# generated using pymatgen data_Ba10Ge3C3O26 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.87748821 _cell_length_b 10.36234821 _cell_length_c 10.34654143 _cell_angle_alpha 119.64878306 _cell_angle_beta 89.97526871 _cell_angle_gamma 90.02179020 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba10Ge3C3O26 _chemical_formula_sum 'Ba10 Ge3 C3 O26' _cell_volume 734.00308228 _cell_formula_units_Z 1 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 0.00247300 0.33404100 0.66658900 1.0 Ba Ba1 1 0.49465800 0.66633300 0.33287500 1.0 Ba Ba2 1 0.24788500 0.25216700 0.00856900 1.0 Ba Ba3 1 0.25063700 0.99190200 0.24384700 1.0 Ba Ba4 1 0.24664800 0.75710800 0.74756400 1.0 Ba Ba5 1 0.74579700 0.73938100 0.96976300 1.0 Ba Ba6 1 0.74456100 0.02520400 0.76387500 1.0 Ba Ba7 1 0.74631800 0.23377900 0.26042800 1.0 Ba Ba8 1 0.49341000 0.33427300 0.66477100 1.0 Ba Ba9 1 0.99997000 0.66774100 0.33663800 1.0 Ge Ge10 1 0.24387300 0.36716300 0.39376200 1.0 Ge Ge11 1 0.24285000 0.60677400 0.97407100 1.0 Ge Ge12 1 0.24367400 0.02664500 0.63274700 1.0 C C13 1 0.74504600 0.61779300 0.59153800 1.0 C C14 1 0.74507400 0.40686000 0.02851700 1.0 C C15 1 0.74371300 0.97236900 0.38100700 1.0 O O16 1 0.24579900 0.83116200 0.52229300 1.0 O O17 1 0.24490600 0.47739000 0.30720100 1.0 O O18 1 0.24403400 0.69194300 0.16977500 1.0 O O19 1 0.74308000 0.12314400 0.47613600 1.0 O O20 1 0.74372000 0.52235700 0.64814900 1.0 O O21 1 0.74335400 0.34850700 0.87615100 1.0 O O22 1 0.24928000 0.12386300 0.53136100 1.0 O O23 1 0.24868300 0.46933900 0.59128200 1.0 O O24 1 0.24990500 0.40958000 0.87660900 1.0 O O25 1 0.74761900 0.89462400 0.45763600 1.0 O O26 1 0.74733600 0.54149300 0.43838000 1.0 O O27 1 0.75074600 0.56031300 0.10603200 1.0 O O28 1 0.06275000 0.09070500 0.75080200 1.0 O O29 1 0.06387600 0.24858300 0.34098200 1.0 O O30 1 0.06216100 0.65968400 0.90814300 1.0 O O31 1 0.60759000 0.92679800 0.28192900 1.0 O O32 1 0.60904600 0.71744100 0.64632400 1.0 O O33 1 0.60379700 0.35471100 0.06835300 1.0 O O34 1 0.42619600 0.09084300 0.75036700 1.0 O O35 1 0.42755800 0.25129400 0.34226600 1.0 O O36 1 0.42556900 0.66210000 0.91102600 1.0 O O37 1 0.88332200 0.92942400 0.28558900 1.0 O O38 1 0.88225700 0.71675100 0.64465100 1.0 O O39 1 0.88694000 0.35853400 0.07243300 1.0 O O40 1 0.33908900 0.99845900 0.99966700 1.0 O O41 1 0.79880000 0.00142400 0.99990100 1.0