# generated using pymatgen data_Hf3Zr5(NbSi4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.02020871 _cell_length_b 7.02100064 _cell_length_c 12.86746860 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.99293533 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf3Zr5(NbSi4)2 _chemical_formula_sum 'Hf6 Zr10 Nb4 Si16' _cell_volume 634.22323725 _cell_formula_units_Z 2 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 0.85488089 0.00387128 0.87660366 1.0 Hf Hf1 1 0.14511911 0.99612872 0.37660366 1.0 Hf Hf2 1 0.64593281 0.50454903 0.37334873 1.0 Hf Hf3 1 0.35406719 0.49545097 0.87334873 1.0 Hf Hf4 1 0.00437454 0.85434888 0.12323344 1.0 Hf Hf5 1 0.99562546 0.14565112 0.62323344 1.0 Zr Zr6 1 0.49965044 0.15296834 0.53302495 1.0 Zr Zr7 1 0.50034956 0.84703166 0.03302495 1.0 Zr Zr8 1 0.65417258 0.00009923 0.28308851 1.0 Zr Zr9 1 0.34582742 0.99990077 0.78308851 1.0 Zr Zr10 1 0.84685180 0.50001666 0.96690665 1.0 Zr Zr11 1 0.15314820 0.49998334 0.46690665 1.0 Zr Zr12 1 0.99964264 0.65391170 0.71711434 1.0 Zr Zr13 1 0.00035736 0.34608830 0.21711434 1.0 Zr Zr14 1 0.49652695 0.35410928 0.12679394 1.0 Zr Zr15 1 0.50347305 0.64589072 0.62679394 1.0 Nb Nb16 1 0.67529785 0.32484431 0.75012187 1.0 Nb Nb17 1 0.32470215 0.67515569 0.25012187 1.0 Nb Nb18 1 0.82514901 0.82566799 0.49976109 1.0 Nb Nb19 1 0.17485099 0.17433201 0.99976109 1.0 Si Si20 1 0.79615299 0.14443794 0.07114010 1.0 Si Si21 1 0.20384701 0.85556206 0.57114010 1.0 Si Si22 1 0.64454823 0.70578562 0.82265505 1.0 Si Si23 1 0.35545177 0.29421438 0.32265505 1.0 Si Si24 1 0.85520279 0.20574807 0.42826947 1.0 Si Si25 1 0.14479721 0.79425193 0.92826947 1.0 Si Si26 1 0.70615216 0.64595909 0.17865445 1.0 Si Si27 1 0.29384784 0.35404091 0.67865445 1.0 Si Si28 1 0.54989697 0.19970294 0.93571645 1.0 Si Si29 1 0.45010303 0.80029706 0.43571645 1.0 Si Si30 1 0.70040191 0.95147825 0.68676764 1.0 Si Si31 1 0.29959809 0.04852175 0.18676764 1.0 Si Si32 1 0.80041449 0.45014615 0.56332841 1.0 Si Si33 1 0.19958551 0.54985385 0.06332841 1.0 Si Si34 1 0.95053927 0.70040799 0.31347026 1.0 Si Si35 1 0.04946073 0.29959201 0.81347026 1.0