# generated using pymatgen data_Li5Ti8O16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.32074900 _cell_length_b 7.66095755 _cell_length_c 7.87470303 _cell_angle_alpha 93.60168005 _cell_angle_beta 105.75671368 _cell_angle_gamma 108.82967811 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li5Ti8O16 _chemical_formula_sum 'Li5 Ti8 O16' _cell_volume 288.37764001 _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 Li Li0 1 0.46047100 0.33148000 0.45929600 1.0 Li Li1 1 0.54717000 0.17891600 0.04168900 1.0 Li Li2 1 0.02089200 0.65961600 0.04251300 1.0 Li Li3 1 0.47403600 0.82478500 0.94810900 1.0 Li Li4 1 0.96673100 0.83164900 0.45821600 1.0 Ti Ti5 1 0.01990500 0.05815800 0.17904600 1.0 Ti Ti6 1 0.52370700 0.05806300 0.67959300 1.0 Ti Ti7 1 0.46975500 0.44252800 0.80816500 1.0 Ti Ti8 1 0.01153900 0.55052200 0.68021800 1.0 Ti Ti9 1 0.99637200 0.44352700 0.33170200 1.0 Ti Ti10 1 0.50568500 0.55355800 0.18288100 1.0 Ti Ti11 1 0.50225300 0.94447800 0.33042100 1.0 Ti Ti12 1 0.97871500 0.94628100 0.80722900 1.0 O O13 1 0.28518000 0.17438900 0.80598700 1.0 O O14 1 0.26727100 0.05186400 0.42604800 1.0 O O15 1 0.76381700 0.05034700 0.93219200 1.0 O O16 1 0.76857600 0.17513000 0.29155400 1.0 O O17 1 0.23719700 0.44089400 0.56735000 1.0 O O18 1 0.26917200 0.56080100 0.93381400 1.0 O O19 1 0.71560700 0.32543800 0.69169500 1.0 O O20 1 0.23442700 0.32370400 0.20887500 1.0 O O21 1 0.77669600 0.67645200 0.80858400 1.0 O O22 1 0.26443000 0.67541700 0.29291400 1.0 O O23 1 0.76461800 0.55531400 0.42752100 1.0 O O24 1 0.72153900 0.44950700 0.07549800 1.0 O O25 1 0.22538400 0.82451900 0.69925400 1.0 O O26 1 0.23694900 0.94625500 0.06992400 1.0 O O27 1 0.74407500 0.94344300 0.56611700 1.0 O O28 1 0.72973000 0.82451300 0.20014500 1.0