# generated using pymatgen data_Hf4Ta3Ti3Ge8 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.77535670 _cell_length_b 6.88915595 _cell_length_c 13.04243256 _cell_angle_alpha 89.95509209 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf4Ta3Ti3Ge8 _chemical_formula_sum 'Hf8 Ta6 Ti6 Ge16' _cell_volume 608.77477186 _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 Hf Hf0 1 0.48992173 0.67551764 0.59384869 1.0 Hf Hf1 1 0.98992173 0.82448236 0.90615131 1.0 Hf Hf2 1 0.50972367 0.32427601 0.09466438 1.0 Hf Hf3 1 0.00972367 0.17572399 0.40533562 1.0 Hf Hf4 1 0.51132958 0.32362506 0.40624574 1.0 Hf Hf5 1 0.01132958 0.17637494 0.09375426 1.0 Hf Hf6 1 0.48652608 0.67256123 0.90597442 1.0 Hf Hf7 1 0.98652608 0.82743877 0.59402558 1.0 Ta Ta8 1 0.65644791 0.16950617 0.62366155 1.0 Ta Ta9 1 0.15644791 0.33049383 0.87633845 1.0 Ta Ta10 1 0.82977600 0.49245146 0.75023853 1.0 Ta Ta11 1 0.32977600 0.00754854 0.74976147 1.0 Ta Ta12 1 0.17136110 0.50541183 0.25053019 1.0 Ta Ta13 1 0.67136110 0.99458817 0.24946981 1.0 Ti Ti14 1 0.34400018 0.83085221 0.12509847 1.0 Ti Ti15 1 0.84400018 0.66914779 0.37490153 1.0 Ti Ti16 1 0.34226832 0.82957532 0.37535008 1.0 Ti Ti17 1 0.84226832 0.67042468 0.12464992 1.0 Ti Ti18 1 0.65787682 0.16990252 0.87592147 1.0 Ti Ti19 1 0.15787682 0.33009748 0.62407853 1.0 Ge Ge20 1 0.68348563 0.95749323 0.45918393 1.0 Ge Ge21 1 0.18348563 0.54250677 0.04081607 1.0 Ge Ge22 1 0.31926421 0.03530647 0.96302181 1.0 Ge Ge23 1 0.81926421 0.46469353 0.53697819 1.0 Ge Ge24 1 0.31303035 0.03794372 0.53700383 1.0 Ge Ge25 1 0.81303035 0.46205628 0.96299617 1.0 Ge Ge26 1 0.68482545 0.96127441 0.03840183 1.0 Ge Ge27 1 0.18482545 0.53872559 0.46159817 1.0 Ge Ge28 1 0.45662270 0.38376108 0.75039141 1.0 Ge Ge29 1 0.95662270 0.11623892 0.74960859 1.0 Ge Ge30 1 0.54410980 0.61912305 0.25026368 1.0 Ge Ge31 1 0.04410980 0.88087695 0.24973632 1.0 Ge Ge32 1 0.69047620 0.85552788 0.75211567 1.0 Ge Ge33 1 0.19047620 0.64447212 0.74788433 1.0 Ge Ge34 1 0.30895627 0.14139533 0.25018239 1.0 Ge Ge35 1 0.80895627 0.35860467 0.24981761 1.0