# generated using pymatgen data_Ti8C4O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.01672270 _cell_length_b 6.01672289 _cell_length_c 6.01672395 _cell_angle_alpha 61.09303218 _cell_angle_beta 61.09303074 _cell_angle_gamma 61.09302800 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti8C4O _chemical_formula_sum 'Ti8 C4 O1' _cell_volume 157.80526531 _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 0.75325582 0.75325582 0.75325582 1.0 Ti Ti1 1 0.74820582 0.24015769 0.74820582 1.0 Ti Ti2 1 0.25179418 0.75984231 0.25179418 1.0 Ti Ti3 1 0.24015769 0.74820582 0.74820582 1.0 Ti Ti4 1 0.75984231 0.25179418 0.25179418 1.0 Ti Ti5 1 0.24674418 0.24674418 0.24674418 1.0 Ti Ti6 1 0.25179418 0.25179418 0.75984231 1.0 Ti Ti7 1 0.74820582 0.74820582 0.24015769 1.0 C C8 1 0.00000000 0.00000000 0.50000000 1.0 C C9 1 0.00000000 0.50000000 0.00000000 1.0 C C10 1 0.50000000 0.00000000 0.00000000 1.0 C C11 1 0.50000000 0.50000000 0.50000000 1.0 O O12 1 0.00000000 0.00000000 0.00000000 1.0