# generated using pymatgen data_Hf6Zn23Fe _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.63363106 _cell_length_b 8.63363169 _cell_length_c 8.63363220 _cell_angle_alpha 60.00000911 _cell_angle_beta 60.00000671 _cell_angle_gamma 60.00000475 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Zn23Fe _chemical_formula_sum 'Hf6 Zn23 Fe1' _cell_volume 455.05680902 _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 0.69811779 0.30188221 0.30188221 1.0 Hf Hf1 1 0.30188221 0.69811779 0.69811779 1.0 Hf Hf2 1 0.30188221 0.69811779 0.30188221 1.0 Hf Hf3 1 0.69811779 0.30188221 0.69811779 1.0 Hf Hf4 1 0.30188221 0.30188221 0.69811779 1.0 Hf Hf5 1 0.69811779 0.69811779 0.30188221 1.0 Zn Zn6 1 0.12264229 0.12264229 0.12264229 1.0 Zn Zn7 1 0.87735771 0.87735771 0.87735771 1.0 Zn Zn8 1 0.12264229 0.12264229 0.63207113 1.0 Zn Zn9 1 0.12264229 0.63207113 0.12264229 1.0 Zn Zn10 1 0.87735771 0.87735771 0.36792887 1.0 Zn Zn11 1 0.87735771 0.36792887 0.87735771 1.0 Zn Zn12 1 0.63207113 0.12264229 0.12264229 1.0 Zn Zn13 1 0.36792887 0.87735771 0.87735771 1.0 Zn Zn14 1 0.50000000 0.00000000 0.00000000 1.0 Zn Zn15 1 0.00000000 0.50000000 0.50000000 1.0 Zn Zn16 1 0.00000000 0.50000000 0.00000000 1.0 Zn Zn17 1 0.50000000 0.00000000 0.50000000 1.0 Zn Zn18 1 0.00000000 0.00000000 0.50000000 1.0 Zn Zn19 1 0.50000000 0.50000000 0.00000000 1.0 Zn Zn20 1 0.33183144 0.33183144 0.33183144 1.0 Zn Zn21 1 0.66816856 0.66816856 0.66816856 1.0 Zn Zn22 1 0.33183144 0.33183144 0.00450668 1.0 Zn Zn23 1 0.33183144 0.00450668 0.33183144 1.0 Zn Zn24 1 0.66816856 0.66816856 0.99549332 1.0 Zn Zn25 1 0.66816856 0.99549332 0.66816856 1.0 Zn Zn26 1 0.00450668 0.33183144 0.33183144 1.0 Zn Zn27 1 0.99549332 0.66816856 0.66816856 1.0 Zn Zn28 1 0.00000000 0.00000000 0.00000000 1.0 Fe Fe29 1 0.50000000 0.50000000 0.50000000 1.0