# generated using pymatgen data_Nd20Ir3Ru8Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 11.16447039 _cell_length_b 11.16446936 _cell_length_c 6.61853212 _cell_angle_alpha 89.87218027 _cell_angle_beta 89.87217723 _cell_angle_gamma 89.90879562 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd20Ir3Ru8Au _chemical_formula_sum 'Nd20 Ir3 Ru8 Au1' _cell_volume 824.96435732 _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 0.08643121 0.28851015 0.11222412 1.0 Nd Nd1 1 0.79283838 0.41135437 0.11419143 1.0 Nd Nd2 1 0.20592478 0.57651891 0.11766687 1.0 Nd Nd3 1 0.90382561 0.70383345 0.11362322 1.0 Nd Nd4 1 0.42348109 0.79407522 0.38233313 1.0 Nd Nd5 1 0.58864563 0.20716162 0.38580857 1.0 Nd Nd6 1 0.29616655 0.09617439 0.38637678 1.0 Nd Nd7 1 0.71148985 0.91356879 0.38777588 1.0 Nd Nd8 1 0.41024359 0.20957417 0.88841249 1.0 Nd Nd9 1 0.70373336 0.08958299 0.88516296 1.0 Nd Nd10 1 0.30087759 0.91582001 0.86768947 1.0 Nd Nd11 1 0.59178433 0.79346754 0.88800092 1.0 Nd Nd12 1 0.08417999 0.69912241 0.63231053 1.0 Nd Nd13 1 0.91041701 0.29626664 0.61483704 1.0 Nd Nd14 1 0.20653246 0.40821567 0.61199908 1.0 Nd Nd15 1 0.79042583 0.58975641 0.61158751 1.0 Nd Nd16 1 0.99591368 0.00073767 0.99627707 1.0 Nd Nd17 1 0.49975781 0.50146725 0.99988776 1.0 Nd Nd18 1 0.49853275 0.50024219 0.50011224 1.0 Nd Nd19 1 0.99926233 0.00408632 0.50372293 1.0 Ir Ir20 1 0.84501261 0.15498739 0.25000000 1.0 Ir Ir21 1 0.34431888 0.65568112 0.75000000 1.0 Ir Ir22 1 0.65328929 0.34671071 0.75000000 1.0 Ru Ru23 1 0.35006452 0.35079415 0.24961605 1.0 Ru Ru24 1 0.64920585 0.64993548 0.25038395 1.0 Ru Ru25 1 0.14753903 0.14692467 0.74938376 1.0 Ru Ru26 1 0.85307533 0.85246097 0.75061624 1.0 Ru Ru27 1 0.99925263 0.50016943 0.37336170 1.0 Ru Ru28 1 0.49983057 0.00074737 0.12663830 1.0 Ru Ru29 1 0.50059647 0.00110837 0.62452047 1.0 Ru Ru30 1 0.99889163 0.49940353 0.87547953 1.0 Au Au31 1 0.15846532 0.84153468 0.25000000 1.0