# generated using pymatgen data_Nd3U2P12Ru19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.55228128 _cell_length_b 12.51996925 _cell_length_c 3.97869253 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.98495704 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3U2P12Ru19 _chemical_formula_sum 'Nd3 U2 P12 Ru19' _cell_volume 541.58016037 _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 Nd Nd0 1 0.81155028 0.81106941 0.50000000 1.0 Nd Nd1 1 0.18873350 0.99995102 0.50000000 1.0 Nd Nd2 1 0.33102251 0.66375793 0.00000000 1.0 U U3 1 0.99963245 0.17619775 0.50000000 1.0 U U4 1 0.67047434 0.33628897 0.00000000 1.0 P P5 1 0.99993557 0.81553763 0.00000000 1.0 P P6 1 0.19089209 0.18595233 0.00000000 1.0 P P7 1 0.81037607 0.99736266 0.00000000 1.0 P P8 1 0.69469134 0.17123519 0.50000000 1.0 P P9 1 0.82889601 0.52492710 0.50000000 1.0 P P10 1 0.47681672 0.30511099 0.50000000 1.0 P P11 1 0.17053957 0.69457102 0.50000000 1.0 P P12 1 0.52266921 0.82907427 0.50000000 1.0 P P13 1 0.30454176 0.47623684 0.50000000 1.0 P P14 1 0.00265519 0.37504789 0.00000000 1.0 P P15 1 0.62336819 0.62730015 0.00000000 1.0 P P16 1 0.37455007 0.99823246 0.00000000 1.0 Ru Ru17 1 0.99674211 0.55226572 0.00000000 1.0 Ru Ru18 1 0.44455301 0.44557740 0.00000000 1.0 Ru Ru19 1 0.55903468 0.00757848 0.00000000 1.0 Ru Ru20 1 0.99911225 0.71578759 0.50000000 1.0 Ru Ru21 1 0.28438783 0.28511900 0.50000000 1.0 Ru Ru22 1 0.71752138 0.00315806 0.50000000 1.0 Ru Ru23 1 0.81298049 0.18642184 0.00000000 1.0 Ru Ru24 1 0.81337374 0.61803831 0.00000000 1.0 Ru Ru25 1 0.38359278 0.19720692 0.00000000 1.0 Ru Ru26 1 0.18309806 0.80411619 0.00000000 1.0 Ru Ru27 1 0.61941893 0.81765338 0.00000000 1.0 Ru Ru28 1 0.18851974 0.37031164 0.00000000 1.0 Ru Ru29 1 0.86852623 0.36525400 0.50000000 1.0 Ru Ru30 1 0.63186118 0.50318577 0.50000000 1.0 Ru Ru31 1 0.49778247 0.13117444 0.50000000 1.0 Ru Ru32 1 0.36833480 0.87898089 0.50000000 1.0 Ru Ru33 1 0.50842698 0.63300062 0.50000000 1.0 Ru Ru34 1 0.12112029 0.48741048 0.50000000 1.0 Ru Ru35 1 0.00026817 0.00990567 0.00000000 1.0