# generated using pymatgen data_Ti10Ga3As3O _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.52279909 _cell_length_b 7.52280020 _cell_length_c 5.17277281 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000378 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti10Ga3As3O _chemical_formula_sum 'Ti10 Ga3 As3 O1' _cell_volume 253.52045756 _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 0.00000000 0.76126357 0.25547908 1.0 Ti Ti1 1 0.23873643 0.23873643 0.25547908 1.0 Ti Ti2 1 0.76126357 1.00000000 0.25547908 1.0 Ti Ti3 1 1.00000000 0.23940550 0.74602412 1.0 Ti Ti4 1 0.76059450 0.76059450 0.74602412 1.0 Ti Ti5 1 0.23940550 0.00000000 0.74602412 1.0 Ti Ti6 1 0.33333300 0.66666700 0.50034968 1.0 Ti Ti7 1 0.66666700 0.33333300 0.50034968 1.0 Ti Ti8 1 0.66666700 0.33333300 0.99993777 1.0 Ti Ti9 1 0.33333300 0.66666700 0.99993777 1.0 Ga Ga10 1 0.00000000 0.60401255 0.75422625 1.0 Ga Ga11 1 0.39598745 0.39598745 0.75422625 1.0 Ga Ga12 1 0.60401255 1.00000000 0.75422625 1.0 As As13 1 0.00000000 0.39766436 0.24413210 1.0 As As14 1 0.60233564 0.60233564 0.24413210 1.0 As As15 1 0.39766436 0.00000000 0.24413210 1.0 O O16 1 0.00000000 0.00000000 0.49983842 1.0