# generated using pymatgen data_Li2TiO3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 4.99356197 _cell_length_b 4.99356197 _cell_length_c 5.03409089 _cell_angle_alpha 78.91254110 _cell_angle_beta 78.91254110 _cell_angle_gamma 118.02225005 _symmetry_Int_Tables_number 1 _chemical_formula_structural Li2TiO3 _chemical_formula_sum 'Li4 Ti2 O6' _cell_volume 102.79241310 _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 0.91941185 0.08058815 0.75000000 1.0 Li Li1 1 0.24372551 0.75627449 0.75000000 1.0 Li Li2 1 0.08058815 0.91941185 0.25000000 1.0 Li Li3 1 0.75627449 0.24372551 0.25000000 1.0 Ti Ti4 1 0.58960210 0.41039790 0.75000000 1.0 Ti Ti5 1 0.41039790 0.58960210 0.25000000 1.0 O O6 1 0.64938459 0.79833046 0.48880712 1.0 O O7 1 0.35061541 0.20166954 0.51119288 1.0 O O8 1 0.20166954 0.35061541 0.01119288 1.0 O O9 1 -0.00000000 0.50000000 0.50000000 1.0 O O10 1 0.79833046 0.64938459 0.98880712 1.0 O O11 1 0.50000000 -0.00000000 0.00000000 1.0