# generated using pymatgen data_Zr13Ta7Si16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.96372652 _cell_length_b 6.96263537 _cell_length_c 12.82312632 _cell_angle_alpha 90.12138792 _cell_angle_beta 90.13564877 _cell_angle_gamma 90.02078722 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr13Ta7Si16 _chemical_formula_sum 'Zr13 Ta7 Si16' _cell_volume 621.73749430 _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 Zr Zr0 1 0.99845694 0.85261480 0.62486344 1.0 Zr Zr1 1 0.64824663 0.49563820 0.87807070 1.0 Zr Zr2 1 0.50239186 0.35117669 0.62165877 1.0 Zr Zr3 1 0.49992655 0.64702321 0.12483716 1.0 Zr Zr4 1 0.14594125 0.00089976 0.87411317 1.0 Zr Zr5 1 0.00184131 0.65458016 0.03617098 1.0 Zr Zr6 1 0.99865429 0.34494601 0.52912214 1.0 Zr Zr7 1 0.65523511 0.00095240 0.96955965 1.0 Zr Zr8 1 0.15251729 0.49727561 0.78406295 1.0 Zr Zr9 1 0.84484145 0.49968758 0.28158792 1.0 Zr Zr10 1 0.50023547 0.15635679 0.22045431 1.0 Zr Zr11 1 0.50108853 0.84572919 0.71430784 1.0 Zr Zr12 1 0.34353258 0.00043227 0.46467873 1.0 Ta Ta13 1 0.35148263 0.50531134 0.37479349 1.0 Ta Ta14 1 0.85252686 0.99526963 0.37379969 1.0 Ta Ta15 1 0.00854935 0.14911092 0.12767887 1.0 Ta Ta16 1 0.67384284 0.67291129 0.49688832 1.0 Ta Ta17 1 0.82548225 0.17329833 0.74963819 1.0 Ta Ta18 1 0.17235646 0.82997649 0.25134384 1.0 Ta Ta19 1 0.32566942 0.32351680 0.00269121 1.0 Si Si20 1 0.04859432 0.70145904 0.43382931 1.0 Si Si21 1 0.95368582 0.29877671 0.93903354 1.0 Si Si22 1 0.70043494 0.04718032 0.56079340 1.0 Si Si23 1 0.20174418 0.45014522 0.18792553 1.0 Si Si24 1 0.80078084 0.54642579 0.68514669 1.0 Si Si25 1 0.45252365 0.19777496 0.81429613 1.0 Si Si26 1 0.54973213 0.79870871 0.31460553 1.0 Si Si27 1 0.29895969 0.95405648 0.06606717 1.0 Si Si28 1 0.85232882 0.79606892 0.82036767 1.0 Si Si29 1 0.13705580 0.20848097 0.32278385 1.0 Si Si30 1 0.79820482 0.86492904 0.17987084 1.0 Si Si31 1 0.29634568 0.64345987 0.56671531 1.0 Si Si32 1 0.71120301 0.35360664 0.07487446 1.0 Si Si33 1 0.63905889 0.29280922 0.42422624 1.0 Si Si34 1 0.35436654 0.70270742 0.93019296 1.0 Si Si35 1 0.20216082 0.14670121 0.67895101 1.0