# generated using pymatgen data_Ba3TbIrRuO9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.96101215 _cell_length_b 5.96101215 _cell_length_c 14.77572400 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000169 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3TbIrRuO9 _chemical_formula_sum 'Ba6 Tb2 Ir2 Ru2 O18' _cell_volume 454.69419416 _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 0.59454700 1.0 Ba Ba1 1 0.66666700 0.33333300 0.40438000 1.0 Ba Ba2 1 0.66666700 0.33333300 0.09454700 1.0 Ba Ba3 1 0.33333300 0.66666700 0.90438000 1.0 Ba Ba4 1 0.00000000 0.00000000 0.25014400 1.0 Ba Ba5 1 0.00000000 0.00000000 0.75014400 1.0 Tb Tb6 1 0.00000000 0.00000000 0.49864000 1.0 Tb Tb7 1 0.00000000 0.00000000 0.99864000 1.0 Ir Ir8 1 0.33333300 0.66666700 0.33524400 1.0 Ir Ir9 1 0.66666700 0.33333300 0.83524400 1.0 Ru Ru10 1 0.66666700 0.33333300 0.66369600 1.0 Ru Ru11 1 0.33333300 0.66666700 0.16369600 1.0 O O12 1 0.49004200 0.50995800 0.24929800 1.0 O O13 1 0.49004200 0.98008400 0.24929800 1.0 O O14 1 0.01991600 0.50995800 0.24929800 1.0 O O15 1 0.50995800 0.49004200 0.74929800 1.0 O O16 1 0.50995800 0.01991600 0.74929800 1.0 O O17 1 0.98008400 0.49004200 0.74929800 1.0 O O18 1 0.17630900 0.82369100 0.08927400 1.0 O O19 1 0.17630900 0.35261800 0.08927400 1.0 O O20 1 0.64738200 0.82369100 0.08927400 1.0 O O21 1 0.82444100 0.17555900 0.91257100 1.0 O O22 1 0.82444100 0.64888300 0.91257100 1.0 O O23 1 0.35111700 0.17555900 0.91257100 1.0 O O24 1 0.82369100 0.17630900 0.58927400 1.0 O O25 1 0.82369100 0.64738200 0.58927400 1.0 O O26 1 0.35261800 0.17630900 0.58927400 1.0 O O27 1 0.17555900 0.82444100 0.41257100 1.0 O O28 1 0.17555900 0.35111700 0.41257100 1.0 O O29 1 0.64888300 0.82444100 0.41257100 1.0