# generated using pymatgen data_La2Nd3P12Ru19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.59282053 _cell_length_b 12.57698273 _cell_length_c 4.01518495 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.04166502 _symmetry_Int_Tables_number 1 _chemical_formula_structural La2Nd3P12Ru19 _chemical_formula_sum 'La2 Nd3 P12 Ru19' _cell_volume 550.49474242 _cell_formula_units_Z 1 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 0.00027528 0.18328006 0.50000000 1.0 La La1 1 0.81699422 0.81671994 0.50000000 1.0 Nd Nd2 1 0.18455741 0.00000000 0.50000000 1.0 Nd Nd3 1 0.66655903 0.33400998 0.00000000 1.0 Nd Nd4 1 0.33254805 0.66599002 0.00000000 1.0 P P5 1 0.00234398 0.81220714 0.00000000 1.0 P P6 1 0.19013683 0.18779286 0.00000000 1.0 P P7 1 0.80913621 0.00000000 0.00000000 1.0 P P8 1 0.69580231 0.17241844 0.50000000 1.0 P P9 1 0.82864483 0.52513902 0.50000000 1.0 P P10 1 0.47610102 0.30414353 0.50000000 1.0 P P11 1 0.17195748 0.69585647 0.50000000 1.0 P P12 1 0.52338387 0.82758156 0.50000000 1.0 P P13 1 0.30350582 0.47486098 0.50000000 1.0 P P14 1 0.00011520 0.37678589 0.00000000 1.0 P P15 1 0.62332932 0.62321411 0.00000000 1.0 P P16 1 0.37546054 0.00000000 0.00000000 1.0 Ru Ru17 1 0.00080293 0.55566933 0.00000000 1.0 Ru Ru18 1 0.44513360 0.44433067 0.00000000 1.0 Ru Ru19 1 0.55404230 0.00000000 0.00000000 1.0 Ru Ru20 1 0.00126308 0.71472513 0.50000000 1.0 Ru Ru21 1 0.28653795 0.28527487 0.50000000 1.0 Ru Ru22 1 0.71254150 0.00000000 0.50000000 1.0 Ru Ru23 1 0.80492797 0.18551783 0.00000000 1.0 Ru Ru24 1 0.81579191 0.62118928 0.00000000 1.0 Ru Ru25 1 0.37943242 0.19366194 0.00000000 1.0 Ru Ru26 1 0.18577248 0.80633806 0.00000000 1.0 Ru Ru27 1 0.61941115 0.81448217 0.00000000 1.0 Ru Ru28 1 0.19460363 0.37881072 0.00000000 1.0 Ru Ru29 1 0.87541705 0.36860924 0.50000000 1.0 Ru Ru30 1 0.63229774 0.50794498 0.50000000 1.0 Ru Ru31 1 0.49236811 0.12454879 0.50000000 1.0 Ru Ru32 1 0.36781833 0.87545121 0.50000000 1.0 Ru Ru33 1 0.50680681 0.63139076 0.50000000 1.0 Ru Ru34 1 0.12435277 0.49205502 0.50000000 1.0 Ru Ru35 1 0.99982485 0.00000000 0.00000000 1.0