# generated using pymatgen data_Hf6Zn23Si _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.62814928 _cell_length_b 8.62814974 _cell_length_c 8.62815020 _cell_angle_alpha 60.00000563 _cell_angle_beta 60.00000387 _cell_angle_gamma 60.00000434 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf6Zn23Si _chemical_formula_sum 'Hf6 Zn23 Si1' _cell_volume 454.19052350 _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 0.70955962 0.29044038 0.29044038 1.0 Hf Hf1 1 0.29044038 0.70955962 0.70955962 1.0 Hf Hf2 1 0.29044038 0.70955962 0.29044038 1.0 Hf Hf3 1 0.70955962 0.29044038 0.70955962 1.0 Hf Hf4 1 0.29044038 0.29044038 0.70955962 1.0 Hf Hf5 1 0.70955962 0.70955962 0.29044038 1.0 Zn Zn6 1 0.12272559 0.12272559 0.12272559 1.0 Zn Zn7 1 0.87727441 0.87727441 0.87727441 1.0 Zn Zn8 1 0.12272559 0.12272559 0.63182223 1.0 Zn Zn9 1 0.12272559 0.63182223 0.12272559 1.0 Zn Zn10 1 0.87727441 0.87727441 0.36817777 1.0 Zn Zn11 1 0.87727441 0.36817777 0.87727441 1.0 Zn Zn12 1 0.63182223 0.12272559 0.12272559 1.0 Zn Zn13 1 0.36817777 0.87727441 0.87727441 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 0.33496875 0.33496875 0.33496875 1.0 Zn Zn21 1 0.66503125 0.66503125 0.66503125 1.0 Zn Zn22 1 0.33496875 0.33496875 0.99509376 1.0 Zn Zn23 1 0.33496875 0.99509376 0.33496875 1.0 Zn Zn24 1 0.66503125 0.66503125 0.00490624 1.0 Zn Zn25 1 0.66503125 0.00490624 0.66503125 1.0 Zn Zn26 1 0.99509376 0.33496875 0.33496875 1.0 Zn Zn27 1 0.00490624 0.66503125 0.66503125 1.0 Zn Zn28 1 0.00000000 0.00000000 0.00000000 1.0 Si Si29 1 0.50000000 0.50000000 0.50000000 1.0