# generated using pymatgen data_Ce5P12Ir10Ru9 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.59059947 _cell_length_b 12.59059970 _cell_length_c 3.98737138 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999682 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ce5P12Ir10Ru9 _chemical_formula_sum 'Ce5 P12 Ir10 Ru9' _cell_volume 547.40676228 _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 Ce Ce0 1 0.00000000 0.18328463 0.50000000 1.0 Ce Ce1 1 0.81671537 0.81671537 0.50000000 1.0 Ce Ce2 1 0.18328463 0.00000000 0.50000000 1.0 Ce Ce3 1 0.66666700 0.33333300 0.00000000 1.0 Ce Ce4 1 0.33333300 0.66666700 0.00000000 1.0 P P5 1 0.00000000 0.81606512 0.00000000 1.0 P P6 1 0.18393488 0.18393488 0.00000000 1.0 P P7 1 0.81606512 0.00000000 0.00000000 1.0 P P8 1 0.69204828 0.17356118 0.50000000 1.0 P P9 1 0.82643882 0.51848710 0.50000000 1.0 P P10 1 0.48151290 0.30795172 0.50000000 1.0 P P11 1 0.17356118 0.69204828 0.50000000 1.0 P P12 1 0.51848710 0.82643882 0.50000000 1.0 P P13 1 0.30795172 0.48151290 0.50000000 1.0 P P14 1 1.00000000 0.36687000 0.00000000 1.0 P P15 1 0.63313000 0.63313000 0.00000000 1.0 P P16 1 0.36687000 1.00000000 0.00000000 1.0 Ir Ir17 1 0.00000000 0.54693253 0.00000000 1.0 Ir Ir18 1 0.45306747 0.45306747 0.00000000 1.0 Ir Ir19 1 0.54693253 0.00000000 0.00000000 1.0 Ir Ir20 1 0.80557294 0.18251066 0.00000000 1.0 Ir Ir21 1 0.81748934 0.62306228 0.00000000 1.0 Ir Ir22 1 0.37693772 0.19442706 0.00000000 1.0 Ir Ir23 1 0.18251066 0.80557294 0.00000000 1.0 Ir Ir24 1 0.62306228 0.81748934 0.00000000 1.0 Ir Ir25 1 0.19442706 0.37693772 0.00000000 1.0 Ir Ir26 1 0.00000000 0.00000000 0.00000000 1.0 Ru Ru27 1 0.00000000 0.71153821 0.50000000 1.0 Ru Ru28 1 0.28846179 0.28846179 0.50000000 1.0 Ru Ru29 1 0.71153821 0.00000000 0.50000000 1.0 Ru Ru30 1 0.87350998 0.36484051 0.50000000 1.0 Ru Ru31 1 0.63515949 0.50866747 0.50000000 1.0 Ru Ru32 1 0.49133253 0.12649002 0.50000000 1.0 Ru Ru33 1 0.36484051 0.87350998 0.50000000 1.0 Ru Ru34 1 0.50866747 0.63515949 0.50000000 1.0 Ru Ru35 1 0.12649002 0.49133253 0.50000000 1.0