# generated using pymatgen data_TaTi11Sn9Au _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.25977842 _cell_length_b 9.25977864 _cell_length_c 5.67386471 _cell_angle_alpha 90.41354985 _cell_angle_beta 89.58645282 _cell_angle_gamma 120.34006733 _symmetry_Int_Tables_number 1 _chemical_formula_structural TaTi11Sn9Au _chemical_formula_sum 'Ta1 Ti11 Sn9 Au1' _cell_volume 419.85307272 _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 Ta Ta0 1 0.50000000 0.50000000 0.00000000 1.0 Ti Ti1 1 0.84028724 0.68792207 0.76155527 1.0 Ti Ti2 1 0.15599465 0.84400535 0.24549308 1.0 Ti Ti3 1 0.68792207 0.84028724 0.23844473 1.0 Ti Ti4 1 0.31207793 0.15971276 0.76155527 1.0 Ti Ti5 1 0.84400535 0.15599465 0.75450692 1.0 Ti Ti6 1 0.15971276 0.31207793 0.23844473 1.0 Ti Ti7 1 0.50000000 0.00000000 0.50000000 1.0 Ti Ti8 1 0.00000000 0.50000000 0.00000000 1.0 Ti Ti9 1 0.00000000 0.50000000 0.50000000 1.0 Ti Ti10 1 0.50000000 0.00000000 0.00000000 1.0 Ti Ti11 1 0.50000000 0.50000000 0.50000000 1.0 Sn Sn12 1 0.19809374 0.40084191 0.74061595 1.0 Sn Sn13 1 0.80082036 0.19917964 0.25239855 1.0 Sn Sn14 1 0.40084191 0.19809374 0.25938405 1.0 Sn Sn15 1 0.59915809 0.80190626 0.74061595 1.0 Sn Sn16 1 0.19917964 0.80082036 0.74760145 1.0 Sn Sn17 1 0.80190626 0.59915809 0.25938405 1.0 Sn Sn18 1 0.66749450 0.33250550 0.75418113 1.0 Sn Sn19 1 0.33250550 0.66749450 0.24581887 1.0 Sn Sn20 1 0.00000000 0.00000000 0.00000000 1.0 Au Au21 1 0.00000000 0.00000000 0.50000000 1.0