# generated using pymatgen data_Lu8TaTi11Si16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.95751612 _cell_length_b 6.95751665 _cell_length_c 12.78390741 _cell_angle_alpha 89.98308445 _cell_angle_beta 90.01691344 _cell_angle_gamma 90.05936518 _symmetry_Int_Tables_number 1 _chemical_formula_structural Lu8TaTi11Si16 _chemical_formula_sum 'Lu8 Ta1 Ti11 Si16' _cell_volume 618.83065744 _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 Lu Lu0 1 0.34051717 0.00182314 0.46671922 1.0 Lu Lu1 1 0.49820563 0.83974509 0.71658850 1.0 Lu Lu2 1 0.50073801 0.15940099 0.21618427 1.0 Lu Lu3 1 0.83974509 0.49820563 0.28341150 1.0 Lu Lu4 1 0.15940099 0.50073801 0.78381573 1.0 Lu Lu5 1 0.65891896 0.99854685 0.96634094 1.0 Lu Lu6 1 0.00182314 0.34051717 0.53328078 1.0 Lu Lu7 1 0.99854685 0.65891896 0.03365906 1.0 Ta Ta8 1 0.32701416 0.32701416 0.00000000 1.0 Ti Ti9 1 0.17255132 0.82781655 0.24995289 1.0 Ti Ti10 1 0.82781655 0.17255132 0.75004711 1.0 Ti Ti11 1 0.67252820 0.67252820 0.50000000 1.0 Ti Ti12 1 0.15214910 0.00816561 0.87635529 1.0 Ti Ti13 1 0.49225453 0.65019218 0.12508478 1.0 Ti Ti14 1 0.50703757 0.35024153 0.62567769 1.0 Ti Ti15 1 0.65019218 0.49225453 0.87491522 1.0 Ti Ti16 1 0.35024153 0.50703757 0.37432231 1.0 Ti Ti17 1 0.84946100 0.99282012 0.37620540 1.0 Ti Ti18 1 0.00816561 0.15214910 0.12364471 1.0 Ti Ti19 1 0.99282012 0.84946100 0.62379460 1.0 Si Si20 1 0.20363633 0.13295731 0.68251342 1.0 Si Si21 1 0.36647993 0.70341485 0.93268492 1.0 Si Si22 1 0.63357429 0.29644322 0.43286403 1.0 Si Si23 1 0.70341485 0.36647993 0.06731508 1.0 Si Si24 1 0.29644322 0.63357429 0.56713597 1.0 Si Si25 1 0.79662885 0.86701279 0.18323281 1.0 Si Si26 1 0.13295731 0.20363633 0.31748658 1.0 Si Si27 1 0.86701279 0.79662885 0.81676719 1.0 Si Si28 1 0.29347857 0.95308646 0.06418031 1.0 Si Si29 1 0.54639031 0.79379684 0.31415356 1.0 Si Si30 1 0.45438304 0.20557639 0.81308794 1.0 Si Si31 1 0.79379684 0.54639031 0.68584644 1.0 Si Si32 1 0.20557639 0.45438304 0.18691206 1.0 Si Si33 1 0.70643348 0.04657560 0.56426327 1.0 Si Si34 1 0.95308646 0.29347857 0.93581969 1.0 Si Si35 1 0.04657560 0.70643348 0.43573673 1.0