# generated using pymatgen data_Hf18Mo8IrAu _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.75669079 _cell_length_b 8.75669479 _cell_length_c 8.47048276 _cell_angle_alpha 90.00000608 _cell_angle_beta 90.00002689 _cell_angle_gamma 120.00019743 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf18Mo8IrAu _chemical_formula_sum 'Hf18 Mo8 Ir1 Au1' _cell_volume 562.49434177 _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 Hf Hf0 1 0.54217489 0.08435503 0.25000053 1.0 Hf Hf1 1 0.45728111 0.91455572 0.75000014 1.0 Hf Hf2 1 0.91564503 0.45782441 0.25000053 1.0 Hf Hf3 1 0.08544552 0.54271990 0.74999844 1.0 Hf Hf4 1 0.54217731 0.45782193 0.25000011 1.0 Hf Hf5 1 0.45727855 0.54272162 0.75000033 1.0 Hf Hf6 1 0.19852376 0.39704591 0.05455083 1.0 Hf Hf7 1 0.80593398 0.61187378 0.94868953 1.0 Hf Hf8 1 0.60295253 0.80147466 0.05455050 1.0 Hf Hf9 1 0.80593583 0.61187418 0.55130932 1.0 Hf Hf10 1 0.38812576 0.19406466 0.94869002 1.0 Hf Hf11 1 0.19852444 0.39704650 0.44544954 1.0 Hf Hf12 1 0.19852115 0.80147960 0.05455488 1.0 Hf Hf13 1 0.38812651 0.19406544 0.55130944 1.0 Hf Hf14 1 0.80593686 0.19406057 0.94868640 1.0 Hf Hf15 1 0.60295338 0.80147610 0.44544996 1.0 Hf Hf16 1 0.80593843 0.19406255 0.55131331 1.0 Hf Hf17 1 0.19852117 0.80147911 0.44544538 1.0 Mo Mo18 1 0.00000010 0.00000014 0.00237911 1.0 Mo Mo19 1 0.99999964 0.99999979 0.49762101 1.0 Mo Mo20 1 0.88895430 0.77790576 0.25000044 1.0 Mo Mo21 1 0.11107284 0.22214774 0.74999909 1.0 Mo Mo22 1 0.22209450 0.11104597 0.24999973 1.0 Mo Mo23 1 0.77785147 0.88892697 0.75000095 1.0 Mo Mo24 1 0.88895433 0.11104534 0.25000005 1.0 Mo Mo25 1 0.11107050 0.88893011 0.75000000 1.0 Ir Ir26 1 0.33333471 0.66666562 0.25000005 1.0 Au Au27 1 0.66666639 0.33333388 0.75000039 1.0