# generated using pymatgen data_Li7Ti16O32 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.36601034 _cell_length_b 10.36601034 _cell_length_c 10.36601034 _cell_angle_alpha 131.81132000 _cell_angle_beta 131.81132000 _cell_angle_gamma 70.52719016 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li7Ti16O32 _chemical_formula_sum 'Li7 Ti16 O32' _cell_volume 606.29676029 _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 0.25000000 0.75000000 0.50000000 1.0 Li Li1 1 0.12625500 0.62469600 0.00000000 1.0 Li Li2 1 0.37530400 0.37530400 0.50155900 1.0 Li Li3 1 0.75000000 0.25000000 0.50000000 1.0 Li Li4 1 0.62469600 0.12625500 0.00000000 1.0 Li Li5 1 0.00000000 0.00000000 0.00000000 1.0 Li Li6 1 0.87374500 0.87374500 0.49844100 1.0 Ti Ti7 1 0.43846700 0.43846700 0.24964900 1.0 Ti Ti8 1 0.56194500 0.81004400 0.49620600 1.0 Ti Ti9 1 0.43805500 0.93426100 0.24809900 1.0 Ti Ti10 1 0.31383800 0.06573900 0.50379400 1.0 Ti Ti11 1 0.93759500 0.93759500 0.24937600 1.0 Ti Ti12 1 0.06573900 0.31383800 0.50379400 1.0 Ti Ti13 1 0.93426100 0.43805500 0.24809900 1.0 Ti Ti14 1 0.18995600 0.68616200 0.75190100 1.0 Ti Ti15 1 0.81004400 0.56194500 0.49620600 1.0 Ti Ti16 1 0.31178100 0.06240500 0.00000000 1.0 Ti Ti17 1 0.18881900 0.18881900 0.75035100 1.0 Ti Ti18 1 0.06240500 0.31178100 0.00000000 1.0 Ti Ti19 1 0.68616200 0.18995600 0.75190100 1.0 Ti Ti20 1 0.81118100 0.56153300 0.00000000 1.0 Ti Ti21 1 0.68821900 0.68821900 0.75062400 1.0 Ti Ti22 1 0.56153300 0.81118100 0.00000000 1.0 O O23 1 0.54351500 0.04430300 0.22508300 1.0 O O24 1 0.41815500 0.19350600 0.00000000 1.0 O O25 1 0.30609200 0.30609200 0.22453700 1.0 O O26 1 0.45648500 0.68156800 0.50078800 1.0 O O27 1 0.19350600 0.41815500 0.00000000 1.0 O O28 1 0.04430300 0.54351500 0.22508300 1.0 O O29 1 0.33162500 0.83195700 0.27590400 1.0 O O30 1 0.55605200 0.05572000 0.72409600 1.0 O O31 1 0.44394800 0.16804300 0.49966800 1.0 O O32 1 0.18078000 0.95569700 0.49921200 1.0 O O33 1 0.91844600 0.69390800 0.00000000 1.0 O O34 1 0.28810100 0.28810100 0.71751000 1.0 O O35 1 0.80649400 0.80649400 0.22464900 1.0 O O36 1 0.06838500 0.06838500 0.27441000 1.0 O O37 1 0.95569700 0.18078000 0.49921200 1.0 O O38 1 0.69390800 0.91844600 0.00000000 1.0 O O39 1 0.42940900 0.71189900 0.00000000 1.0 O O40 1 0.16804300 0.44394800 0.49966800 1.0 O O41 1 0.83195700 0.33162500 0.27590400 1.0 O O42 1 0.05572000 0.55605200 0.72409600 1.0 O O43 1 0.31843200 0.81922000 0.77491700 1.0 O O44 1 0.20602500 0.93161500 0.00000000 1.0 O O45 1 0.94428000 0.66837500 0.50033200 1.0 O O46 1 0.68156800 0.45648500 0.50078800 1.0 O O47 1 0.79397500 0.79397500 0.72559000 1.0 O O48 1 0.57059100 0.57059100 0.28249000 1.0 O O49 1 0.08155400 0.08155400 0.77546300 1.0 O O50 1 0.66837500 0.94428000 0.50033200 1.0 O O51 1 0.93161500 0.20602500 0.00000000 1.0 O O52 1 0.81922000 0.31843200 0.77491700 1.0 O O53 1 0.71189900 0.42940900 0.00000000 1.0 O O54 1 0.58184500 0.58184500 0.77535100 1.0