# generated using pymatgen data_Sc6Al6Pd5Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.26850743 _cell_length_b 7.26850635 _cell_length_c 6.96062088 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999599 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc6Al6Pd5Au _chemical_formula_sum 'Sc6 Al6 Pd5 Au1' _cell_volume 318.47037719 _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 Sc Sc0 1 0.59943344 0.00503171 0.74717180 1.0 Sc Sc1 1 0.99496829 0.59440273 0.74717180 1.0 Sc Sc2 1 0.40559727 0.40056656 0.74717180 1.0 Sc Sc3 1 0.99423975 0.59407569 0.25286601 1.0 Sc Sc4 1 0.59983594 0.00576025 0.25286601 1.0 Sc Sc5 1 0.40592431 0.40016406 0.25286601 1.0 Al Al6 1 0.74194317 0.73888139 0.00000505 1.0 Al Al7 1 0.26111861 0.00306178 0.00000505 1.0 Al Al8 1 0.99693822 0.25805683 0.00000505 1.0 Al Al9 1 0.73886724 0.74230034 0.49998487 1.0 Al Al10 1 0.25769966 0.99656790 0.49998487 1.0 Al Al11 1 0.00343210 0.26113276 0.49998487 1.0 Pd Pd12 1 0.00000000 0.00000000 0.75110063 1.0 Pd Pd13 1 0.00000000 0.00000000 0.24894069 1.0 Pd Pd14 1 0.66666700 0.33333300 0.99958079 1.0 Pd Pd15 1 0.66666700 0.33333300 0.50049647 1.0 Pd Pd16 1 0.33333300 0.66666700 0.49951398 1.0 Au Au17 1 0.33333300 0.66666700 0.00028224 1.0