# generated using pymatgen data_LiTi8O16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.79155869 _cell_length_b 7.79155869 _cell_length_c 9.62083900 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 99.87169906 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiTi8O16 _chemical_formula_sum 'Li2 Ti16 O32' _cell_volume 575.41801553 _cell_formula_units_Z 2 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 Li Li0 1 0.15838800 0.15838800 0.54361700 1.0 Li Li1 1 0.84161200 0.84161200 0.04361700 1.0 Ti Ti2 1 0.27187900 0.52493800 0.63471300 1.0 Ti Ti3 1 0.01650000 0.76549200 0.64367900 1.0 Ti Ti4 1 0.36783300 0.36783300 0.35583900 1.0 Ti Ti5 1 0.10151600 0.60349500 0.36365400 1.0 Ti Ti6 1 0.14778600 0.14778600 0.86432500 1.0 Ti Ti7 1 0.39650500 0.89848400 0.86365400 1.0 Ti Ti8 1 0.89848400 0.39650500 0.86365400 1.0 Ti Ti9 1 0.63216700 0.63216700 0.85583900 1.0 Ti Ti10 1 0.23450800 0.98350000 0.14367900 1.0 Ti Ti11 1 0.72812100 0.47506200 0.13471300 1.0 Ti Ti12 1 0.47506200 0.72812100 0.13471300 1.0 Ti Ti13 1 0.98350000 0.23450800 0.14367900 1.0 Ti Ti14 1 0.76549200 0.01650000 0.64367900 1.0 Ti Ti15 1 0.52493800 0.27187900 0.63471300 1.0 Ti Ti16 1 0.85221400 0.85221400 0.36432500 1.0 Ti Ti17 1 0.60349500 0.10151600 0.36365400 1.0 O O18 1 0.41158600 0.66441500 0.77414700 1.0 O O19 1 0.27857800 0.77921100 0.03503400 1.0 O O20 1 0.22078900 0.72142200 0.53503400 1.0 O O21 1 0.33558500 0.58841400 0.27414700 1.0 O O22 1 0.28175600 0.28175600 0.71659600 1.0 O O23 1 0.04082300 0.53981300 0.72784900 1.0 O O24 1 0.78757000 0.78757000 0.72831700 1.0 O O25 1 0.90057000 0.65171300 0.46532000 1.0 O O26 1 0.39665600 0.15383300 0.46471300 1.0 O O27 1 0.15383300 0.39665600 0.46471300 1.0 O O28 1 0.09943000 0.34828700 0.96532000 1.0 O O29 1 0.84616700 0.60334400 0.96471300 1.0 O O30 1 0.34828700 0.09943000 0.96532000 1.0 O O31 1 0.21243000 0.21243000 0.22831700 1.0 O O32 1 0.95917700 0.46018700 0.22784900 1.0 O O33 1 0.71824400 0.71824400 0.21659600 1.0 O O34 1 0.16601500 0.91605200 0.77158500 1.0 O O35 1 0.66441500 0.41158600 0.77414700 1.0 O O36 1 0.91605200 0.16601500 0.77158500 1.0 O O37 1 0.77921100 0.27857800 0.03503400 1.0 O O38 1 0.52353100 0.52353100 0.03514100 1.0 O O39 1 0.02682000 0.02682000 0.03637000 1.0 O O40 1 0.72142200 0.22078900 0.53503400 1.0 O O41 1 0.47646900 0.47646900 0.53514100 1.0 O O42 1 0.97318000 0.97318000 0.53637000 1.0 O O43 1 0.83398500 0.08394800 0.27158500 1.0 O O44 1 0.58841400 0.33558500 0.27414700 1.0 O O45 1 0.08394800 0.83398500 0.27158500 1.0 O O46 1 0.53981300 0.04082300 0.72784900 1.0 O O47 1 0.65171300 0.90057000 0.46532000 1.0 O O48 1 0.60334400 0.84616700 0.96471300 1.0 O O49 1 0.46018700 0.95917700 0.22784900 1.0