# generated using pymatgen data_Hf8Nb12ZnSi15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.65961457 _cell_length_b 6.85965065 _cell_length_c 13.02220817 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.91009940 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf8Nb12ZnSi15 _chemical_formula_sum 'Hf8 Nb12 Zn1 Si15' _cell_volume 594.88797807 _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 0.49712975 0.67336809 0.59443865 1.0 Hf Hf1 1 0.99729724 0.82666106 0.90615842 1.0 Hf Hf2 1 0.50071818 0.32681490 0.09291092 1.0 Hf Hf3 1 0.00347391 0.17176548 0.40630942 1.0 Hf Hf4 1 0.50071818 0.32681490 0.40708908 1.0 Hf Hf5 1 0.00347391 0.17176548 0.09369058 1.0 Hf Hf6 1 0.49712975 0.67336809 0.90556135 1.0 Hf Hf7 1 0.99729724 0.82666106 0.59384158 1.0 Nb Nb8 1 0.66275687 0.17315076 0.62340335 1.0 Nb Nb9 1 0.16285975 0.32741243 0.87683937 1.0 Nb Nb10 1 0.33704038 0.82609963 0.12376851 1.0 Nb Nb11 1 0.83771941 0.67667316 0.37741840 1.0 Nb Nb12 1 0.33704038 0.82609963 0.37623149 1.0 Nb Nb13 1 0.83771941 0.67667316 0.12258160 1.0 Nb Nb14 1 0.66275687 0.17315076 0.87659665 1.0 Nb Nb15 1 0.16285975 0.32741243 0.62316063 1.0 Nb Nb16 1 0.83672177 0.49822604 0.75000000 1.0 Nb Nb17 1 0.33702639 0.00243030 0.75000000 1.0 Nb Nb18 1 0.16668379 0.50700021 0.25000000 1.0 Nb Nb19 1 0.66046108 0.99126784 0.25000000 1.0 Zn Zn20 1 0.79569732 0.35679014 0.25000000 1.0 Si Si21 1 0.67094570 0.96633419 0.46152441 1.0 Si Si22 1 0.17026271 0.53482398 0.03880402 1.0 Si Si23 1 0.32890543 0.03503361 0.96197294 1.0 Si Si24 1 0.82811123 0.46413319 0.53709321 1.0 Si Si25 1 0.32890543 0.03503361 0.53802706 1.0 Si Si26 1 0.82811123 0.46413319 0.96290679 1.0 Si Si27 1 0.67094570 0.96633419 0.03847559 1.0 Si Si28 1 0.17026271 0.53482398 0.46119598 1.0 Si Si29 1 0.46008244 0.38823956 0.75000000 1.0 Si Si30 1 0.96034697 0.11249980 0.75000000 1.0 Si Si31 1 0.54413271 0.60900747 0.25000000 1.0 Si Si32 1 0.03900050 0.88989411 0.25000000 1.0 Si Si33 1 0.70488183 0.86203986 0.75000000 1.0 Si Si34 1 0.20387950 0.63808600 0.75000000 1.0 Si Si35 1 0.29664258 0.13997875 0.25000000 1.0