# generated using pymatgen data_Ba3ZnRu2O9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.86141723 _cell_length_b 5.86141723 _cell_length_c 14.43185600 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999130 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3ZnRu2O9 _chemical_formula_sum 'Ba6 Zn2 Ru4 O18' _cell_volume 429.39613373 _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 0.33333300 0.66666700 0.59001700 1.0 Ba Ba1 1 0.66666700 0.33333300 0.09001700 1.0 Ba Ba2 1 0.66666700 0.33333300 0.40998300 1.0 Ba Ba3 1 0.33333300 0.66666700 0.90998300 1.0 Ba Ba4 1 0.00000000 0.00000000 0.75000000 1.0 Ba Ba5 1 0.00000000 0.00000000 0.25000000 1.0 Zn Zn6 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn7 1 0.00000000 0.00000000 0.50000000 1.0 Ru Ru8 1 0.66666700 0.33333300 0.65409400 1.0 Ru Ru9 1 0.33333300 0.66666700 0.15409400 1.0 Ru Ru10 1 0.66666700 0.33333300 0.84590600 1.0 Ru Ru11 1 0.33333300 0.66666700 0.34590600 1.0 O O12 1 0.17103500 0.82896500 0.08433500 1.0 O O13 1 0.17103500 0.34207000 0.08433500 1.0 O O14 1 0.65793000 0.82896500 0.08433500 1.0 O O15 1 0.34207000 0.17103500 0.58433500 1.0 O O16 1 0.82896500 0.65793000 0.91566500 1.0 O O17 1 0.82896500 0.17103500 0.58433500 1.0 O O18 1 0.82896500 0.65793000 0.58433500 1.0 O O19 1 0.17103500 0.82896500 0.41566500 1.0 O O20 1 0.65793000 0.82896500 0.41566500 1.0 O O21 1 0.34207000 0.17103500 0.91566500 1.0 O O22 1 0.82896500 0.17103500 0.91566500 1.0 O O23 1 0.17103500 0.34207000 0.41566500 1.0 O O24 1 0.48413400 0.96826800 0.25000000 1.0 O O25 1 0.51586600 0.48413400 0.75000000 1.0 O O26 1 0.96826800 0.48413400 0.75000000 1.0 O O27 1 0.03173200 0.51586600 0.25000000 1.0 O O28 1 0.48413400 0.51586600 0.25000000 1.0 O O29 1 0.51586600 0.03173200 0.75000000 1.0