# generated using pymatgen data_Ti5GaAs2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 5.07987504 _cell_length_b 7.48178963 _cell_length_c 7.48178952 _cell_angle_alpha 83.35718060 _cell_angle_beta 70.13308662 _cell_angle_gamma 70.13308595 _symmetry_Int_Tables_number 1 _chemical_formula_structural Ti5GaAs2 _chemical_formula_sum 'Ti10 Ga2 As4' _cell_volume 251.51697909 _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 0.72207271 0.85752673 0.69885824 1.0 Ti Ti1 1 0.27792729 0.14247327 0.30114176 1.0 Ti Ti2 1 0.77792729 0.30114176 0.14247327 1.0 Ti Ti3 1 0.22207271 0.69885824 0.85752673 1.0 Ti Ti4 1 0.57950754 0.69883106 0.14242458 1.0 Ti Ti5 1 0.42049246 0.30116894 0.85757542 1.0 Ti Ti6 1 0.07950754 0.14242458 0.69883106 1.0 Ti Ti7 1 0.92049246 0.85757542 0.30116894 1.0 Ti Ti8 1 0.75000000 0.49993898 0.50006102 1.0 Ti Ti9 1 0.25000000 0.50006102 0.49993898 1.0 Ga Ga10 1 0.25000000 0.99998276 0.00001724 1.0 Ga Ga11 1 0.75000000 0.00001724 0.99998276 1.0 As As12 1 0.16080031 0.50004928 0.17811586 1.0 As As13 1 0.83919969 0.49995072 0.82188414 1.0 As As14 1 0.33919969 0.82188414 0.49995072 1.0 As As15 1 0.66080031 0.17811586 0.50004928 1.0