# generated using pymatgen data_Ti3O7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.76268300 _cell_length_b 8.47112690 _cell_length_c 9.32410209 _cell_angle_alpha 101.01723671 _cell_angle_beta 90.00000000 _cell_angle_gamma 102.83174512 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti3O7 _chemical_formula_sum 'Ti6 O14' _cell_volume 284.15541242 _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 Ti Ti0 1 0.11645900 0.23291800 0.32456000 1.0 Ti Ti1 1 0.88354100 0.76708200 0.67544000 1.0 Ti Ti2 1 0.22041600 0.44083200 0.72071300 1.0 Ti Ti3 1 0.77958400 0.55916800 0.27928700 1.0 Ti Ti4 1 0.17241000 0.34482000 0.02062500 1.0 Ti Ti5 1 0.82759000 0.65518000 0.97937500 1.0 O O6 1 0.16979000 0.33958100 0.52649000 1.0 O O7 1 0.83021000 0.66041900 0.47351000 1.0 O O8 1 0.13514100 0.27028100 0.82224900 1.0 O O9 1 0.86485900 0.72971900 0.17775100 1.0 O O10 1 0.08621600 0.17243100 0.11714600 1.0 O O11 1 0.91378400 0.82756900 0.88285400 1.0 O O12 1 0.01593100 0.03186300 0.37480400 1.0 O O13 1 0.98406900 0.96813700 0.62519600 1.0 O O14 1 0.65442100 0.30884200 0.32235300 1.0 O O15 1 0.34557900 0.69115800 0.67764700 1.0 O O16 1 0.70752000 0.41504100 0.04866900 1.0 O O17 1 0.29248000 0.58495900 0.95133100 1.0 O O18 1 0.24800500 0.49601000 0.25047300 1.0 O O19 1 0.75199500 0.50399000 0.74952700 1.0