# generated using pymatgen data_Ti12Zn3Ga5O4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.82154394 _cell_length_b 6.82154387 _cell_length_c 6.82154404 _cell_angle_alpha 90.13376118 _cell_angle_beta 89.86623961 _cell_angle_gamma 89.86623817 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti12Zn3Ga5O4 _chemical_formula_sum 'Ti12 Zn3 Ga5 O4' _cell_volume 317.42745615 _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 0.79159440 0.96056092 0.37405100 1.0 Ti Ti1 1 0.70756696 0.04164472 0.87503168 1.0 Ti Ti2 1 0.20972026 0.45910468 0.12435012 1.0 Ti Ti3 1 0.29158687 0.53990676 0.62582287 1.0 Ti Ti4 1 0.95835528 0.37503168 0.79243304 1.0 Ti Ti5 1 0.03943908 0.87405100 0.70840560 1.0 Ti Ti6 1 0.46009324 0.12582287 0.20841313 1.0 Ti Ti7 1 0.54089532 0.62435012 0.29027974 1.0 Ti Ti8 1 0.37564988 0.79027974 0.95910468 1.0 Ti Ti9 1 0.87417713 0.70841313 0.03990676 1.0 Ti Ti10 1 0.12594900 0.20840560 0.46056092 1.0 Ti Ti11 1 0.62496832 0.29243304 0.54164472 1.0 Zn Zn12 1 0.42860895 0.92943547 0.56966648 1.0 Zn Zn13 1 0.93033352 0.57139105 0.42943547 1.0 Zn Zn14 1 0.07056453 0.06966648 0.07139105 1.0 Ga Ga15 1 0.17749439 0.82250561 0.32250561 1.0 Ga Ga16 1 0.31794865 0.17359613 0.82167055 1.0 Ga Ga17 1 0.82640387 0.32167055 0.18205135 1.0 Ga Ga18 1 0.67832945 0.68205135 0.67359613 1.0 Ga Ga19 1 0.57148111 0.42851889 0.92851889 1.0 O O20 1 0.87467582 0.12532418 0.62532418 1.0 O O21 1 0.62555734 0.87534781 0.12604255 1.0 O O22 1 0.12465219 0.62604255 0.87444266 1.0 O O23 1 0.37395745 0.37444266 0.37534781 1.0