# generated using pymatgen data_Ba3YPd2O9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.89623376 _cell_length_b 5.89623262 _cell_length_c 14.75311858 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00001184 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ba3YPd2O9 _chemical_formula_sum 'Ba6 Y2 Pd4 O18' _cell_volume 444.18482309 _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 0.59051355 1.0 Ba Ba1 1 0.66666700 0.33333300 0.09051355 1.0 Ba Ba2 1 0.66666700 0.33333300 0.40948645 1.0 Ba Ba3 1 0.33333300 0.66666700 0.90948645 1.0 Ba Ba4 1 0.00000000 0.00000000 0.75000000 1.0 Ba Ba5 1 0.00000000 0.00000000 0.25000000 1.0 Y Y6 1 0.00000000 0.00000000 0.00000000 1.0 Y Y7 1 0.00000000 0.00000000 0.50000000 1.0 Pd Pd8 1 0.66666700 0.33333300 0.65968979 1.0 Pd Pd9 1 0.33333300 0.66666700 0.15968979 1.0 Pd Pd10 1 0.66666700 0.33333300 0.84031021 1.0 Pd Pd11 1 0.33333300 0.66666700 0.34031021 1.0 O O12 1 0.17476958 0.82523042 0.08556488 1.0 O O13 1 0.17476958 0.34954116 0.08556488 1.0 O O14 1 0.65045884 0.82523042 0.08556488 1.0 O O15 1 0.34954116 0.17476958 0.58556488 1.0 O O16 1 0.82523042 0.65045884 0.91443512 1.0 O O17 1 0.82523042 0.17476958 0.58556488 1.0 O O18 1 0.82523042 0.65045884 0.58556488 1.0 O O19 1 0.17476958 0.82523042 0.41443512 1.0 O O20 1 0.65045884 0.82523042 0.41443512 1.0 O O21 1 0.34954116 0.17476958 0.91443512 1.0 O O22 1 0.82523042 0.17476958 0.91443512 1.0 O O23 1 0.17476958 0.34954116 0.41443512 1.0 O O24 1 0.48292160 0.96584219 0.25000000 1.0 O O25 1 0.51707840 0.48292160 0.75000000 1.0 O O26 1 0.96584219 0.48292160 0.75000000 1.0 O O27 1 0.03415781 0.51707840 0.25000000 1.0 O O28 1 0.48292160 0.51707840 0.25000000 1.0 O O29 1 0.51707840 0.03415781 0.75000000 1.0