# generated using pymatgen data_Ti9Sn9Mo3Pd _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.21305376 _cell_length_b 9.21305347 _cell_length_c 5.54369758 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000457 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti9Sn9Mo3Pd _chemical_formula_sum 'Ti9 Sn9 Mo3 Pd1' _cell_volume 407.50912649 _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 0.84384724 0.68769449 0.73964853 1.0 Ti Ti1 1 0.15615276 0.84384724 0.26035147 1.0 Ti Ti2 1 0.68769449 0.84384724 0.26035147 1.0 Ti Ti3 1 0.31230551 0.15615276 0.73964853 1.0 Ti Ti4 1 0.84384724 0.15615276 0.73964853 1.0 Ti Ti5 1 0.15615276 0.31230551 0.26035147 1.0 Ti Ti6 1 0.50000000 0.50000000 0.00000000 1.0 Ti Ti7 1 0.00000000 0.50000000 0.00000000 1.0 Ti Ti8 1 0.50000000 0.00000000 0.00000000 1.0 Sn Sn9 1 0.20109138 0.40218377 0.75542375 1.0 Sn Sn10 1 0.79890862 0.20109138 0.24457625 1.0 Sn Sn11 1 0.40218377 0.20109138 0.24457625 1.0 Sn Sn12 1 0.59781623 0.79890862 0.75542375 1.0 Sn Sn13 1 0.20109138 0.79890862 0.75542375 1.0 Sn Sn14 1 0.79890862 0.59781623 0.24457625 1.0 Sn Sn15 1 0.66666700 0.33333300 0.73020916 1.0 Sn Sn16 1 0.33333300 0.66666700 0.26979084 1.0 Sn Sn17 1 0.00000000 0.00000000 0.00000000 1.0 Mo Mo18 1 0.50000000 0.00000000 0.50000000 1.0 Mo Mo19 1 0.00000000 0.50000000 0.50000000 1.0 Mo Mo20 1 0.50000000 0.50000000 0.50000000 1.0 Pd Pd21 1 0.00000000 0.00000000 0.50000000 1.0