# generated using pymatgen data_Ti4VO8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.84170109 _cell_length_b 5.84170109 _cell_length_c 5.84109160 _cell_angle_alpha 61.10493272 _cell_angle_beta 61.10493272 _cell_angle_gamma 60.97085204 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti4VO8 _chemical_formula_sum 'Ti4 V1 O8' _cell_volume 144.31178949 _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 0.00000000 0.00000000 0.00000000 1.0 Ti Ti2 1 0.00000000 0.50000000 0.50000000 1.0 Ti Ti3 1 0.50000000 0.00000000 0.50000000 1.0 V V4 1 0.50000000 0.50000000 0.00000000 1.0 O O5 1 0.26156500 0.26156500 0.27271800 1.0 O O6 1 0.25958100 0.75139300 0.74902100 1.0 O O7 1 0.75139300 0.25958100 0.74902100 1.0 O O8 1 0.74914100 0.74914100 0.26099900 1.0 O O9 1 0.25085900 0.25085900 0.73900100 1.0 O O10 1 0.24860700 0.74041900 0.25097900 1.0 O O11 1 0.74041900 0.24860700 0.25097900 1.0 O O12 1 0.73843500 0.73843500 0.72728200 1.0