# generated using pymatgen data_Hf6TiZn22Ge _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.66620001 _cell_length_b 8.66620033 _cell_length_c 8.66620013 _cell_angle_alpha 60.00000444 _cell_angle_beta 60.00000321 _cell_angle_gamma 59.99999699 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6TiZn22Ge _chemical_formula_sum 'Hf6 Ti1 Zn22 Ge1' _cell_volume 460.22601409 _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 0.71450114 0.28549886 0.28549886 1.0 Hf Hf1 1 0.28549886 0.71450114 0.71450114 1.0 Hf Hf2 1 0.28549886 0.71450114 0.28549886 1.0 Hf Hf3 1 0.71450114 0.28549886 0.71450114 1.0 Hf Hf4 1 0.28549886 0.28549886 0.71450114 1.0 Hf Hf5 1 0.71450114 0.71450114 0.28549886 1.0 Ti Ti6 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn7 1 0.12381158 0.12381158 0.12381158 1.0 Zn Zn8 1 0.87618842 0.87618842 0.87618842 1.0 Zn Zn9 1 0.12381158 0.12381158 0.62856725 1.0 Zn Zn10 1 0.12381158 0.62856725 0.12381158 1.0 Zn Zn11 1 0.87618842 0.87618842 0.37143275 1.0 Zn Zn12 1 0.87618842 0.37143275 0.87618842 1.0 Zn Zn13 1 0.62856725 0.12381158 0.12381158 1.0 Zn Zn14 1 0.37143275 0.87618842 0.87618842 1.0 Zn Zn15 1 0.50000000 0.00000000 0.00000000 1.0 Zn Zn16 1 0.00000000 0.50000000 0.50000000 1.0 Zn Zn17 1 0.00000000 0.50000000 0.00000000 1.0 Zn Zn18 1 0.50000000 0.00000000 0.50000000 1.0 Zn Zn19 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn20 1 0.50000000 0.50000000 0.00000000 1.0 Zn Zn21 1 0.33667888 0.33667888 0.33667888 1.0 Zn Zn22 1 0.66332112 0.66332112 0.66332112 1.0 Zn Zn23 1 0.33667888 0.33667888 0.98996536 1.0 Zn Zn24 1 0.33667888 0.98996536 0.33667888 1.0 Zn Zn25 1 0.66332112 0.66332112 0.01003464 1.0 Zn Zn26 1 0.66332112 0.01003464 0.66332112 1.0 Zn Zn27 1 0.98996536 0.33667888 0.33667888 1.0 Zn Zn28 1 0.01003464 0.66332112 0.66332112 1.0 Ge Ge29 1 0.50000000 0.50000000 0.50000000 1.0