# generated using pymatgen data_Ti5Nb7Sn9Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.36078809 _cell_length_b 9.36356568 _cell_length_c 5.67300711 _cell_angle_alpha 90.08355657 _cell_angle_beta 90.00000001 _cell_angle_gamma 119.99019827 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti5Nb7Sn9Au _chemical_formula_sum 'Ti5 Nb7 Sn9 Au1' _cell_volume 430.66532441 _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 Ti Ti0 1 0.15565795 0.84340768 0.24695484 1.0 Ti Ti1 1 0.68774972 0.84340768 0.24695484 1.0 Ti Ti2 1 0.31350362 0.15652538 0.75265413 1.0 Ti Ti3 1 0.84302176 0.15652538 0.75265413 1.0 Ti Ti4 1 0.15725466 0.31450933 0.24650233 1.0 Nb Nb5 1 0.84449201 0.68898403 0.75596855 1.0 Nb Nb6 1 0.49977228 0.99954455 0.49917528 1.0 Nb Nb7 1 0.50027772 0.49979025 0.99998028 1.0 Nb Nb8 1 0.99951253 0.49979025 0.99998028 1.0 Nb Nb9 1 0.99987861 0.49946789 0.49989491 1.0 Nb Nb10 1 0.49975523 0.99951046 0.00101324 1.0 Nb Nb11 1 0.49958929 0.49946789 0.49989491 1.0 Sn Sn12 1 0.19910143 0.39820285 0.74739136 1.0 Sn Sn13 1 0.80066322 0.19829612 0.25227926 1.0 Sn Sn14 1 0.39763290 0.19829612 0.25227926 1.0 Sn Sn15 1 0.59872721 0.79975565 0.74764029 1.0 Sn Sn16 1 0.20102944 0.79975565 0.74764029 1.0 Sn Sn17 1 0.79946871 0.59893741 0.25465397 1.0 Sn Sn18 1 0.66513256 0.33026413 0.75312941 1.0 Sn Sn19 1 0.33333307 0.66666715 0.24671597 1.0 Sn Sn20 1 0.00141974 0.00283849 0.99980304 1.0 Au Au21 1 0.00302733 0.00605367 0.49684044 1.0