# generated using pymatgen data_Hf2Zr4Zn23As _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.65277321 _cell_length_b 8.68526079 _cell_length_c 8.68526125 _cell_angle_alpha 59.75268289 _cell_angle_beta 60.12365924 _cell_angle_gamma 60.12365852 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf2Zr4Zn23As _chemical_formula_sum 'Hf2 Zr4 Zn23 As1' _cell_volume 461.52365664 _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 0.71022404 0.28977596 0.28977596 1.0 Hf Hf1 1 0.28977596 0.71022404 0.71022404 1.0 Zr Zr2 1 0.28581301 0.71418699 0.28581301 1.0 Zr Zr3 1 0.71418699 0.28581301 0.71418699 1.0 Zr Zr4 1 0.28581301 0.28581301 0.71418699 1.0 Zr Zr5 1 0.71418699 0.71418699 0.28581301 1.0 Zn Zn6 1 0.11924844 0.12520878 0.12520878 1.0 Zn Zn7 1 0.88075156 0.87479122 0.87479122 1.0 Zn Zn8 1 0.12520878 0.11924844 0.63033399 1.0 Zn Zn9 1 0.12520878 0.63033399 0.11924844 1.0 Zn Zn10 1 0.87479122 0.88075156 0.36966601 1.0 Zn Zn11 1 0.87479122 0.36966601 0.88075156 1.0 Zn Zn12 1 0.63033399 0.12520878 0.12520878 1.0 Zn Zn13 1 0.36966601 0.87479122 0.87479122 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 0.33272527 0.33394786 0.33394786 1.0 Zn Zn21 1 0.66727473 0.66605214 0.66605214 1.0 Zn Zn22 1 0.33394786 0.33272527 0.99938201 1.0 Zn Zn23 1 0.33394786 0.99938201 0.33272527 1.0 Zn Zn24 1 0.66605214 0.66727473 0.00061799 1.0 Zn Zn25 1 0.66605214 0.00061799 0.66727473 1.0 Zn Zn26 1 0.99938201 0.33394786 0.33394786 1.0 Zn Zn27 1 0.00061799 0.66605214 0.66605214 1.0 Zn Zn28 1 0.00000000 0.00000000 0.00000000 1.0 As As29 1 0.50000000 0.50000000 0.50000000 1.0