# generated using pymatgen data_Ba3Ru2O9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.43291683 _cell_length_b 7.43291752 _cell_length_c 7.43291651 _cell_angle_alpha 85.12828837 _cell_angle_beta 85.12828983 _cell_angle_gamma 85.12829617 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3Ru2O9 _chemical_formula_sum 'Ba6 Ru4 O18' _cell_volume 406.44298108 _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 Ba Ba0 1 0.58368737 0.91631263 0.25000000 1.0 Ba Ba1 1 0.91631263 0.25000000 0.58368737 1.0 Ba Ba2 1 0.25000000 0.58368737 0.91631263 1.0 Ba Ba3 1 0.41631263 0.08368737 0.75000000 1.0 Ba Ba4 1 0.75000000 0.41631263 0.08368737 1.0 Ba Ba5 1 0.08368737 0.75000000 0.41631263 1.0 Ru Ru6 1 0.14763785 0.14763785 0.14763785 1.0 Ru Ru7 1 0.35236215 0.35236215 0.35236215 1.0 Ru Ru8 1 0.85236215 0.85236215 0.85236215 1.0 Ru Ru9 1 0.64763785 0.64763785 0.64763785 1.0 O O10 1 0.24835936 0.92657142 0.08706426 1.0 O O11 1 0.08706426 0.24835936 0.92657142 1.0 O O12 1 0.92657142 0.08706426 0.24835936 1.0 O O13 1 0.25164064 0.41293574 0.57342858 1.0 O O14 1 0.57342858 0.25164064 0.41293574 1.0 O O15 1 0.41293574 0.57342858 0.25164064 1.0 O O16 1 0.75164064 0.07342858 0.91293574 1.0 O O17 1 0.91293574 0.75164064 0.07342858 1.0 O O18 1 0.07342858 0.91293574 0.75164064 1.0 O O19 1 0.74835936 0.58706426 0.42657142 1.0 O O20 1 0.10351418 0.39648582 0.25000000 1.0 O O21 1 0.39648582 0.25000000 0.10351418 1.0 O O22 1 0.25000000 0.10351418 0.39648582 1.0 O O23 1 0.89648582 0.60351418 0.75000000 1.0 O O24 1 0.60351418 0.75000000 0.89648582 1.0 O O25 1 0.75000000 0.89648582 0.60351418 1.0 O O26 1 0.58706426 0.42657142 0.74835936 1.0 O O27 1 0.42657142 0.74835936 0.58706426 1.0