# generated using pymatgen data_Pr3Y2P12Ru19 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.52450049 _cell_length_b 12.52450155 _cell_length_c 4.00233086 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999981 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr3Y2P12Ru19 _chemical_formula_sum 'Pr3 Y2 P12 Ru19' _cell_volume 543.70644962 _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 Pr Pr0 1 0.18402228 0.18402228 0.50000000 1.0 Pr Pr1 1 0.81597772 0.00000000 0.50000000 1.0 Pr Pr2 1 1.00000000 0.81597772 0.50000000 1.0 Y Y3 1 0.33333300 0.66666700 0.00000000 1.0 Y Y4 1 0.66666700 0.33333300 0.00000000 1.0 P P5 1 0.81041837 0.81041837 0.00000000 1.0 P P6 1 0.18958163 0.00000000 0.00000000 1.0 P P7 1 1.00000000 0.18958163 0.00000000 1.0 P P8 1 0.17445869 0.47810154 0.50000000 1.0 P P9 1 0.52189846 0.69635715 0.50000000 1.0 P P10 1 0.30364285 0.82554131 0.50000000 1.0 P P11 1 0.69635715 0.52189846 0.50000000 1.0 P P12 1 0.82554131 0.30364285 0.50000000 1.0 P P13 1 0.47810154 0.17445869 0.50000000 1.0 P P14 1 0.37471993 0.37471993 0.00000000 1.0 P P15 1 0.62528007 1.00000000 0.00000000 1.0 P P16 1 0.00000000 0.62528007 0.00000000 1.0 Ru Ru17 1 0.55371260 0.55371260 0.00000000 1.0 Ru Ru18 1 0.44628740 0.00000000 0.00000000 1.0 Ru Ru19 1 1.00000000 0.44628740 0.00000000 1.0 Ru Ru20 1 0.71247608 0.71247608 0.50000000 1.0 Ru Ru21 1 0.28752392 0.00000000 0.50000000 1.0 Ru Ru22 1 1.00000000 0.28752392 0.50000000 1.0 Ru Ru23 1 0.18565461 0.38169248 0.00000000 1.0 Ru Ru24 1 0.61830752 0.80396313 0.00000000 1.0 Ru Ru25 1 0.19603687 0.81434539 0.00000000 1.0 Ru Ru26 1 0.80396313 0.61830752 0.00000000 1.0 Ru Ru27 1 0.81434539 0.19603687 0.00000000 1.0 Ru Ru28 1 0.38169248 0.18565461 0.00000000 1.0 Ru Ru29 1 0.36878145 0.49450275 0.50000000 1.0 Ru Ru30 1 0.50549725 0.87427871 0.50000000 1.0 Ru Ru31 1 0.12572129 0.63121855 0.50000000 1.0 Ru Ru32 1 0.87427871 0.50549725 0.50000000 1.0 Ru Ru33 1 0.63121855 0.12572129 0.50000000 1.0 Ru Ru34 1 0.49450275 0.36878145 0.50000000 1.0 Ru Ru35 1 0.00000000 0.00000000 0.00000000 1.0