# generated using pymatgen data_Zr8Nb12CuSi15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.89856111 _cell_length_b 6.88387658 _cell_length_c 12.70758054 _cell_angle_alpha 90.02718103 _cell_angle_beta 90.05283124 _cell_angle_gamma 89.96425536 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr8Nb12CuSi15 _chemical_formula_sum 'Zr8 Nb12 Cu1 Si15' _cell_volume 603.46785879 _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 0.00150659 0.65874777 0.03157306 1.0 Zr Zr1 1 0.99802740 0.33994963 0.53162202 1.0 Zr Zr2 1 0.65890155 0.00112631 0.96853490 1.0 Zr Zr3 1 0.15898546 0.49772890 0.78234067 1.0 Zr Zr4 1 0.84002714 0.50235532 0.28187828 1.0 Zr Zr5 1 0.49840837 0.15902486 0.21780150 1.0 Zr Zr6 1 0.49959042 0.83976303 0.71715211 1.0 Zr Zr7 1 0.34363874 0.00021612 0.46832392 1.0 Nb Nb8 1 0.35309266 0.50279933 0.37549821 1.0 Nb Nb9 1 0.84719431 0.99588365 0.37287513 1.0 Nb Nb10 1 0.00396929 0.15220902 0.12681508 1.0 Nb Nb11 1 0.99504402 0.84749614 0.62907071 1.0 Nb Nb12 1 0.65191349 0.49539234 0.87659977 1.0 Nb Nb13 1 0.50238020 0.34975235 0.62349340 1.0 Nb Nb14 1 0.49587098 0.65211341 0.12332179 1.0 Nb Nb15 1 0.15239792 0.00350884 0.87325452 1.0 Nb Nb16 1 0.66827487 0.67104151 0.50089950 1.0 Nb Nb17 1 0.82976735 0.16992345 0.75001553 1.0 Nb Nb18 1 0.17098343 0.83064967 0.24947720 1.0 Nb Nb19 1 0.32928609 0.32960948 0.00026469 1.0 Cu Cu20 1 0.04694195 0.70036650 0.43815130 1.0 Si Si21 1 0.95452650 0.29717479 0.93725608 1.0 Si Si22 1 0.70463001 0.04592161 0.56259879 1.0 Si Si23 1 0.20125063 0.45527454 0.18861790 1.0 Si Si24 1 0.79853254 0.54509107 0.68626120 1.0 Si Si25 1 0.45425833 0.20153345 0.81255621 1.0 Si Si26 1 0.54566268 0.79808803 0.31348523 1.0 Si Si27 1 0.29738589 0.95449125 0.06299388 1.0 Si Si28 1 0.86370050 0.79103180 0.82228737 1.0 Si Si29 1 0.13513485 0.20888976 0.32429082 1.0 Si Si30 1 0.79221273 0.86376123 0.17830388 1.0 Si Si31 1 0.28687705 0.63761422 0.56815593 1.0 Si Si32 1 0.70876027 0.36495294 0.07272972 1.0 Si Si33 1 0.63826548 0.29265975 0.42731688 1.0 Si Si34 1 0.36448477 0.70823366 0.92742150 1.0 Si Si35 1 0.20811748 0.13562226 0.67676034 1.0