# generated using pymatgen data_Hf6TiZn22Si _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.65171519 _cell_length_b 8.65171564 _cell_length_c 8.65171606 _cell_angle_alpha 60.00000574 _cell_angle_beta 60.00000403 _cell_angle_gamma 59.99999803 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6TiZn22Si _chemical_formula_sum 'Hf6 Ti1 Zn22 Si1' _cell_volume 457.92224037 _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 0.71168259 0.28831741 0.28831741 1.0 Hf Hf1 1 0.28831741 0.71168259 0.71168259 1.0 Hf Hf2 1 0.28831741 0.71168259 0.28831741 1.0 Hf Hf3 1 0.71168259 0.28831741 0.71168259 1.0 Hf Hf4 1 0.28831741 0.28831741 0.71168259 1.0 Hf Hf5 1 0.71168259 0.71168259 0.28831741 1.0 Ti Ti6 1 0.00000000 0.00000000 0.00000000 1.0 Zn Zn7 1 0.12336460 0.12336460 0.12336460 1.0 Zn Zn8 1 0.87663540 0.87663540 0.87663540 1.0 Zn Zn9 1 0.12336460 0.12336460 0.62990821 1.0 Zn Zn10 1 0.12336460 0.62990821 0.12336460 1.0 Zn Zn11 1 0.87663540 0.87663540 0.37009179 1.0 Zn Zn12 1 0.87663540 0.37009179 0.87663540 1.0 Zn Zn13 1 0.62990821 0.12336460 0.12336460 1.0 Zn Zn14 1 0.37009179 0.87663540 0.87663540 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 0.33662875 0.33662875 0.33662875 1.0 Zn Zn22 1 0.66337125 0.66337125 0.66337125 1.0 Zn Zn23 1 0.33662875 0.33662875 0.99011574 1.0 Zn Zn24 1 0.33662875 0.99011574 0.33662875 1.0 Zn Zn25 1 0.66337125 0.66337125 0.00988426 1.0 Zn Zn26 1 0.66337125 0.00988426 0.66337125 1.0 Zn Zn27 1 0.99011574 0.33662875 0.33662875 1.0 Zn Zn28 1 0.00988426 0.66337125 0.66337125 1.0 Si Si29 1 0.50000000 0.50000000 0.50000000 1.0