# generated using pymatgen data_Nb6Al8Cu3Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.77714694 _cell_length_b 8.85081278 _cell_length_c 8.22650758 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 121.04448504 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nb6Al8Cu3Au _chemical_formula_sum 'Nb12 Al16 Cu6 Au2' _cell_volume 547.53872192 _cell_formula_units_Z 2 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 Nb Nb0 1 0.33274974 0.99069357 0.06545909 1.0 Nb Nb1 1 0.66725026 0.00930643 0.93454091 1.0 Nb Nb2 1 0.99704600 0.33294557 0.06812670 1.0 Nb Nb3 1 0.66725026 0.00930643 0.56545909 1.0 Nb Nb4 1 0.99704600 0.33294557 0.43187330 1.0 Nb Nb5 1 0.00295400 0.66705443 0.93187330 1.0 Nb Nb6 1 0.33274974 0.99069357 0.43454091 1.0 Nb Nb7 1 0.00295400 0.66705443 0.56812670 1.0 Nb Nb8 1 0.66242854 0.65788346 0.06527870 1.0 Nb Nb9 1 0.33757146 0.34211654 0.93472130 1.0 Nb Nb10 1 0.33757146 0.34211654 0.56527870 1.0 Nb Nb11 1 0.66242854 0.65788346 0.43472130 1.0 Al Al12 1 0.34449353 0.84649002 0.75000000 1.0 Al Al13 1 0.65487756 0.50464408 0.75000000 1.0 Al Al14 1 0.65550647 0.15350998 0.25000000 1.0 Al Al15 1 0.34512244 0.49535592 0.25000000 1.0 Al Al16 1 0.84404527 0.34283379 0.75000000 1.0 Al Al17 1 0.15595473 0.65716621 0.25000000 1.0 Al Al18 1 0.34049096 0.66549413 0.50555661 1.0 Al Al19 1 0.65950904 0.33450587 0.49444339 1.0 Al Al20 1 0.65950904 0.33450587 0.00555661 1.0 Al Al21 1 0.34049096 0.66549413 0.99444339 1.0 Al Al22 1 0.18603667 0.01232298 0.75000000 1.0 Al Al23 1 0.81396333 0.98767702 0.25000000 1.0 Al Al24 1 0.01205841 0.18762097 0.75000000 1.0 Al Al25 1 0.98794159 0.81237903 0.25000000 1.0 Al Al26 1 0.81794982 0.83126657 0.75000000 1.0 Al Al27 1 0.18205018 0.16873343 0.25000000 1.0 Cu Cu28 1 0.16769804 0.50398485 0.75000000 1.0 Cu Cu29 1 0.83230196 0.49601515 0.25000000 1.0 Cu Cu30 1 0.50302370 0.67039919 0.75000000 1.0 Cu Cu31 1 0.50519670 0.17176222 0.75000000 1.0 Cu Cu32 1 0.49697630 0.32960081 0.25000000 1.0 Cu Cu33 1 0.49480330 0.82823778 0.25000000 1.0 Au Au34 1 0.00000000 0.00000000 0.50000000 1.0 Au Au35 1 0.00000000 0.00000000 0.00000000 1.0