# generated using pymatgen data_Ti20(Ge3Sb)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.25063200 _cell_length_b 7.67401000 _cell_length_c 13.40997008 _cell_angle_alpha 89.99358679 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti20(Ge3Sb)3 _chemical_formula_sum 'Ti20 Ge9 Sb3' _cell_volume 540.33331838 _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 0.74384600 0.00677200 0.33338700 1.0 Ti Ti1 1 0.74682500 0.50248900 0.82883300 1.0 Ti Ti2 1 0.74364700 0.49444600 0.16929800 1.0 Ti Ti3 1 0.74660900 0.00272600 0.67067200 1.0 Ti Ti4 1 0.25635300 0.49444600 0.16929800 1.0 Ti Ti5 1 0.25339100 0.00272600 0.67067200 1.0 Ti Ti6 1 0.25615400 0.00677200 0.33338700 1.0 Ti Ti7 1 0.25317500 0.50248900 0.82883300 1.0 Ti Ti8 1 0.00000000 0.26248600 0.50010800 1.0 Ti Ti9 1 0.00000000 0.76045000 0.99356500 1.0 Ti Ti10 1 0.00000000 0.61299000 0.37528800 1.0 Ti Ti11 1 0.00000000 0.11893100 0.86799300 1.0 Ti Ti12 1 0.00000000 0.13002700 0.12996900 1.0 Ti Ti13 1 0.00000000 0.61867700 0.63132600 1.0 Ti Ti14 1 0.50000000 0.74453100 0.50039900 1.0 Ti Ti15 1 0.50000000 0.24387800 0.00016500 1.0 Ti Ti16 1 0.50000000 0.87512400 0.12489100 1.0 Ti Ti17 1 0.50000000 0.37381200 0.62821600 1.0 Ti Ti18 1 0.50000000 0.37229100 0.37222300 1.0 Ti Ti19 1 0.50000000 0.87309200 0.87155000 1.0 Ge Ge20 1 0.00000000 0.30331900 0.69466900 1.0 Ge Ge21 1 0.00000000 0.30309200 0.30573500 1.0 Ge Ge22 1 0.00000000 0.80344200 0.80307500 1.0 Ge Ge23 1 0.50000000 0.61316300 0.99922800 1.0 Ge Ge24 1 0.50000000 0.11478400 0.50165600 1.0 Ge Ge25 1 0.50000000 0.69457700 0.30746500 1.0 Ge Ge26 1 0.50000000 0.19579200 0.80664000 1.0 Ge Ge27 1 0.50000000 0.19335900 0.19367400 1.0 Ge Ge28 1 0.50000000 0.69605900 0.69348600 1.0 Sb Sb29 1 0.00000000 0.88938200 0.50128000 1.0 Sb Sb30 1 0.00000000 0.39121100 0.99781100 1.0 Sb Sb31 1 0.00000000 0.80259100 0.19519500 1.0