# generated using pymatgen data_Hf8Ti11Ge16Mo _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.73943427 _cell_length_b 6.85706788 _cell_length_c 12.98188166 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.02586826 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf8Ti11Ge16Mo _chemical_formula_sum 'Hf8 Ti11 Ge16 Mo1' _cell_volume 599.92849766 _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 Hf Hf0 1 0.49018274 0.67584730 0.59330051 1.0 Hf Hf1 1 0.99064342 0.82395262 0.90668096 1.0 Hf Hf2 1 0.51130257 0.32332544 0.09388956 1.0 Hf Hf3 1 0.01057731 0.17393161 0.40546488 1.0 Hf Hf4 1 0.51130257 0.32332544 0.40611044 1.0 Hf Hf5 1 0.01057731 0.17393161 0.09453512 1.0 Hf Hf6 1 0.49018274 0.67584730 0.90669949 1.0 Hf Hf7 1 0.99064342 0.82395262 0.59331904 1.0 Ti Ti8 1 0.65721566 0.16730337 0.62614337 1.0 Ti Ti9 1 0.15624965 0.33339208 0.87442824 1.0 Ti Ti10 1 0.34482165 0.83426680 0.12566145 1.0 Ti Ti11 1 0.84104868 0.66759663 0.37467929 1.0 Ti Ti12 1 0.34482165 0.83426680 0.37433855 1.0 Ti Ti13 1 0.84104868 0.66759663 0.12532071 1.0 Ti Ti14 1 0.65721566 0.16730337 0.87385663 1.0 Ti Ti15 1 0.15624965 0.33339208 0.62557176 1.0 Ti Ti16 1 0.82927344 0.49561635 0.75000000 1.0 Ti Ti17 1 0.32971954 0.00326580 0.75000000 1.0 Ti Ti18 1 0.17031390 0.50601912 0.25000000 1.0 Ge Ge19 1 0.68399478 0.95926531 0.46081848 1.0 Ge Ge20 1 0.18398651 0.53998887 0.04074745 1.0 Ge Ge21 1 0.31629084 0.04094268 0.95945546 1.0 Ge Ge22 1 0.81614780 0.45923692 0.54037953 1.0 Ge Ge23 1 0.31629084 0.04094268 0.54054454 1.0 Ge Ge24 1 0.81614780 0.45923692 0.95962047 1.0 Ge Ge25 1 0.68399478 0.95926531 0.03918152 1.0 Ge Ge26 1 0.18398651 0.53998887 0.45925255 1.0 Ge Ge27 1 0.45828179 0.38069901 0.75000000 1.0 Ge Ge28 1 0.95909041 0.11962803 0.75000000 1.0 Ge Ge29 1 0.53991725 0.61769716 0.25000000 1.0 Ge Ge30 1 0.04120096 0.87975844 0.25000000 1.0 Ge Ge31 1 0.68900394 0.85510583 0.75000000 1.0 Ge Ge32 1 0.18813931 0.64464668 0.75000000 1.0 Ge Ge33 1 0.30819183 0.14703234 0.25000000 1.0 Ge Ge34 1 0.81266875 0.35780154 0.25000000 1.0 Mo Mo35 1 0.66927564 0.99463642 0.25000000 1.0