# generated using pymatgen data_Ti9O13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.11948101 _cell_length_b 5.11948101 _cell_length_c 17.75140936 _cell_angle_alpha 81.87911015 _cell_angle_beta 81.87911015 _cell_angle_gamma 33.12801681 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti9O13 _chemical_formula_sum 'Ti9 O13' _cell_volume 251.48701080 _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 0.50000000 0.50000000 0.50000000 1.0 Ti Ti1 1 0.34405400 0.34405400 0.03704900 1.0 Ti Ti2 1 0.65594600 0.65594600 0.96295100 1.0 Ti Ti3 1 0.24282700 0.24282700 0.42345700 1.0 Ti Ti4 1 0.75717300 0.75717300 0.57654300 1.0 Ti Ti5 1 0.06818900 0.06818900 0.12786000 1.0 Ti Ti6 1 0.93181100 0.93181100 0.87214000 1.0 Ti Ti7 1 0.01831000 0.01831000 0.32495200 1.0 Ti Ti8 1 0.98169000 0.98169000 0.67504800 1.0 O O9 1 0.00000000 0.00000000 0.00000000 1.0 O O10 1 0.09812800 0.09812800 0.22807100 1.0 O O11 1 0.90187200 0.90187200 0.77192900 1.0 O O12 1 0.70220700 0.70220700 0.08007400 1.0 O O13 1 0.29779300 0.29779300 0.91992600 1.0 O O14 1 0.43403900 0.43403900 0.13074900 1.0 O O15 1 0.56596100 0.56596100 0.86925100 1.0 O O16 1 0.38136500 0.38136500 0.33042600 1.0 O O17 1 0.61863500 0.61863500 0.66957400 1.0 O O18 1 0.61487400 0.61487400 0.38378700 1.0 O O19 1 0.38512600 0.38512600 0.61621300 1.0 O O20 1 0.87027900 0.87027900 0.46428400 1.0 O O21 1 0.12972100 0.12972100 0.53571600 1.0