# generated using pymatgen data_Ti13Al9(TcIr3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.71165897 _cell_length_b 8.71174291 _cell_length_c 8.71171093 _cell_angle_alpha 59.69549432 _cell_angle_beta 59.69446897 _cell_angle_gamma 59.69495750 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti13Al9(TcIr3)2 _chemical_formula_sum 'Ti13 Al9 Tc2 Ir6' _cell_volume 464.27439982 _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 0.21480408 0.21481531 0.78841296 1.0 Ti Ti1 1 0.78841742 0.21479837 0.21480042 1.0 Ti Ti2 1 0.21480364 0.78841724 0.21481648 1.0 Ti Ti3 1 0.79537778 0.79539024 0.18605814 1.0 Ti Ti4 1 0.18604517 0.79538263 0.79538360 1.0 Ti Ti5 1 0.79538280 0.18604982 0.79539711 1.0 Ti Ti6 1 0.37890418 0.37889800 0.37889383 1.0 Ti Ti7 1 0.38016520 0.86616653 0.38015245 1.0 Ti Ti8 1 0.86614867 0.38016783 0.38016651 1.0 Ti Ti9 1 0.38017277 0.38015848 0.86615449 1.0 Ti Ti10 1 0.84675340 0.46014841 0.84675989 1.0 Ti Ti11 1 0.46018591 0.84674395 0.84674235 1.0 Ti Ti12 1 0.84674659 0.84675196 0.46016925 1.0 Al Al13 1 0.15139646 0.15140060 0.15139534 1.0 Al Al14 1 0.15427478 0.54491032 0.15426860 1.0 Al Al15 1 0.54489696 0.15428389 0.15427667 1.0 Al Al16 1 0.15427933 0.15426703 0.54491497 1.0 Al Al17 1 0.61882974 0.61881432 0.61881904 1.0 Al Al18 1 0.61924412 0.14377923 0.61922724 1.0 Al Al19 1 0.14376030 0.61923730 0.61922267 1.0 Al Al20 1 0.61923416 0.61922839 0.14377738 1.0 Al Al21 1 0.82910119 0.82908362 0.82909915 1.0 Tc Tc22 1 0.50008330 0.50013119 0.50013353 1.0 Tc Tc23 1 0.00301723 0.00297501 0.00297359 1.0 Ir Ir24 1 0.00376569 0.00377458 0.49865910 1.0 Ir Ir25 1 0.49866103 0.00376855 0.00377120 1.0 Ir Ir26 1 0.00375957 0.49866842 0.00377156 1.0 Ir Ir27 1 0.50007760 0.50006619 0.00164380 1.0 Ir Ir28 1 0.00163355 0.50007729 0.50007424 1.0 Ir Ir29 1 0.50007738 0.00164231 0.50006443 1.0