# generated using pymatgen data_Zr8TaTi11Ge16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.80282397 _cell_length_b 6.91609835 _cell_length_c 13.06762096 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.02458569 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr8TaTi11Ge16 _chemical_formula_sum 'Zr8 Ta1 Ti11 Ge16' _cell_volume 614.81843707 _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 0.49123635 0.67506644 0.59477511 1.0 Zr Zr1 1 0.99166745 0.82453589 0.90516145 1.0 Zr Zr2 1 0.51008816 0.32352487 0.09533677 1.0 Zr Zr3 1 0.00862141 0.17442872 0.40441723 1.0 Zr Zr4 1 0.51008816 0.32352487 0.40466323 1.0 Zr Zr5 1 0.00862141 0.17442872 0.09558277 1.0 Zr Zr6 1 0.49123635 0.67506644 0.90522489 1.0 Zr Zr7 1 0.99166745 0.82453589 0.59483855 1.0 Ta Ta8 1 0.67072244 0.99539263 0.25000000 1.0 Ti Ti9 1 0.65716994 0.16735002 0.62642123 1.0 Ti Ti10 1 0.15688321 0.33321936 0.87409064 1.0 Ti Ti11 1 0.34333085 0.83344957 0.12501527 1.0 Ti Ti12 1 0.84125884 0.66828956 0.37489099 1.0 Ti Ti13 1 0.34333085 0.83344957 0.37498473 1.0 Ti Ti14 1 0.84125884 0.66828956 0.12510901 1.0 Ti Ti15 1 0.65716994 0.16735002 0.87357877 1.0 Ti Ti16 1 0.15688321 0.33321936 0.62590936 1.0 Ti Ti17 1 0.82911277 0.49661189 0.75000000 1.0 Ti Ti18 1 0.32959376 0.00279411 0.75000000 1.0 Ti Ti19 1 0.17052733 0.50458863 0.25000000 1.0 Ge Ge20 1 0.68237789 0.95854775 0.46097392 1.0 Ge Ge21 1 0.18217106 0.54088227 0.04071503 1.0 Ge Ge22 1 0.31782858 0.04191072 0.95888652 1.0 Ge Ge23 1 0.81815157 0.45808282 0.54082523 1.0 Ge Ge24 1 0.31782858 0.04191072 0.54111348 1.0 Ge Ge25 1 0.81815157 0.45808282 0.95917477 1.0 Ge Ge26 1 0.68237789 0.95854775 0.03902608 1.0 Ge Ge27 1 0.18217106 0.54088227 0.45928497 1.0 Ge Ge28 1 0.45821260 0.37723699 0.75000000 1.0 Ge Ge29 1 0.95916814 0.12282829 0.75000000 1.0 Ge Ge30 1 0.53955096 0.62108375 0.25000000 1.0 Ge Ge31 1 0.04428605 0.87499276 0.25000000 1.0 Ge Ge32 1 0.68971199 0.85834345 0.75000000 1.0 Ge Ge33 1 0.18955962 0.64127617 0.75000000 1.0 Ge Ge34 1 0.30612447 0.14325753 0.25000000 1.0 Ge Ge35 1 0.81186322 0.36302583 0.25000000 1.0