# generated using pymatgen data_La3Ru3O11 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.54353200 _cell_length_b 9.54353200 _cell_length_c 9.54353200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural La3Ru3O11 _chemical_formula_sum 'La12 Ru12 O44' _cell_volume 869.21537999 _cell_formula_units_Z 4 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 La La0 1 0.63611800 0.36388200 0.63611800 1.0 La La1 1 0.36388200 0.63611800 0.63611800 1.0 La La2 1 0.63611800 0.63611800 0.36388200 1.0 La La3 1 0.36388200 0.36388200 0.36388200 1.0 La La4 1 0.86388200 0.13611800 0.86388200 1.0 La La5 1 0.13611800 0.86388200 0.86388200 1.0 La La6 1 0.86388200 0.86388200 0.13611800 1.0 La La7 1 0.13611800 0.13611800 0.13611800 1.0 La La8 1 0.25000000 0.75000000 0.25000000 1.0 La La9 1 0.75000000 0.25000000 0.25000000 1.0 La La10 1 0.25000000 0.25000000 0.75000000 1.0 La La11 1 0.75000000 0.75000000 0.75000000 1.0 Ru Ru12 1 0.66128600 0.00000000 0.50000000 1.0 Ru Ru13 1 0.00000000 0.50000000 0.66128600 1.0 Ru Ru14 1 0.50000000 0.66128600 0.00000000 1.0 Ru Ru15 1 0.00000000 0.50000000 0.33871400 1.0 Ru Ru16 1 0.50000000 0.33871400 0.00000000 1.0 Ru Ru17 1 0.33871400 0.00000000 0.50000000 1.0 Ru Ru18 1 0.83871400 0.50000000 0.00000000 1.0 Ru Ru19 1 0.50000000 0.00000000 0.83871400 1.0 Ru Ru20 1 0.00000000 0.83871400 0.50000000 1.0 Ru Ru21 1 0.50000000 0.00000000 0.16128600 1.0 Ru Ru22 1 0.00000000 0.16128600 0.50000000 1.0 Ru Ru23 1 0.16128600 0.50000000 0.00000000 1.0 O O24 1 0.83030200 0.50273500 0.21211000 1.0 O O25 1 0.83030200 0.49726500 0.78789000 1.0 O O26 1 0.16969800 0.50273500 0.78789000 1.0 O O27 1 0.49726500 0.78789000 0.83030200 1.0 O O28 1 0.78789000 0.16969800 0.50273500 1.0 O O29 1 0.78789000 0.83030200 0.49726500 1.0 O O30 1 0.50273500 0.21211000 0.83030200 1.0 O O31 1 0.21211000 0.83030200 0.50273500 1.0 O O32 1 0.50273500 0.78789000 0.16969800 1.0 O O33 1 0.49726500 0.21211000 0.16969800 1.0 O O34 1 0.21211000 0.16969800 0.49726500 1.0 O O35 1 0.16969800 0.49726500 0.21211000 1.0 O O36 1 0.66969800 0.99726500 0.28789000 1.0 O O37 1 0.66969800 0.00273500 0.71211000 1.0 O O38 1 0.33030200 0.99726500 0.71211000 1.0 O O39 1 0.00273500 0.71211000 0.66969800 1.0 O O40 1 0.39499100 0.60500900 0.39499100 1.0 O O41 1 0.71211000 0.33030200 0.99726500 1.0 O O42 1 0.99726500 0.28789000 0.66969800 1.0 O O43 1 0.28789000 0.66969800 0.99726500 1.0 O O44 1 0.99726500 0.71211000 0.33030200 1.0 O O45 1 0.00273500 0.28789000 0.33030200 1.0 O O46 1 0.28789000 0.33030200 0.00273500 1.0 O O47 1 0.33030200 0.00273500 0.28789000 1.0 O O48 1 0.37360700 0.00000000 0.00000000 1.0 O O49 1 0.00000000 0.37360700 0.00000000 1.0 O O50 1 0.00000000 0.00000000 0.37360700 1.0 O O51 1 0.00000000 0.62639300 0.00000000 1.0 O O52 1 0.00000000 0.00000000 0.62639300 1.0 O O53 1 0.62639300 0.00000000 0.00000000 1.0 O O54 1 0.12639300 0.50000000 0.50000000 1.0 O O55 1 0.50000000 0.12639300 0.50000000 1.0 O O56 1 0.50000000 0.50000000 0.12639300 1.0 O O57 1 0.50000000 0.87360700 0.50000000 1.0 O O58 1 0.50000000 0.50000000 0.87360700 1.0 O O59 1 0.87360700 0.50000000 0.50000000 1.0 O O60 1 0.89499100 0.89499100 0.89499100 1.0 O O61 1 0.10500900 0.10500900 0.89499100 1.0 O O62 1 0.89499100 0.10500900 0.10500900 1.0 O O63 1 0.10500900 0.89499100 0.10500900 1.0 O O64 1 0.60500900 0.60500900 0.60500900 1.0 O O65 1 0.39499100 0.39499100 0.60500900 1.0 O O66 1 0.60500900 0.39499100 0.39499100 1.0 O O67 1 0.71211000 0.66969800 0.00273500 1.0