# generated using pymatgen data_Zr8Ti7Si16Mo5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.77044573 _cell_length_b 6.76666620 _cell_length_c 12.47212765 _cell_angle_alpha 89.87336739 _cell_angle_beta 89.97447550 _cell_angle_gamma 89.98471806 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr8Ti7Si16Mo5 _chemical_formula_sum 'Zr8 Ti7 Si16 Mo5' _cell_volume 571.38842989 _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 0.33977573 0.99852240 0.46991660 1.0 Zr Zr1 1 0.50169325 0.83956852 0.71947707 1.0 Zr Zr2 1 0.49812200 0.16037988 0.21982961 1.0 Zr Zr3 1 0.83966386 0.50162417 0.28023094 1.0 Zr Zr4 1 0.16014611 0.49652919 0.78064012 1.0 Zr Zr5 1 0.65964866 0.00112269 0.96961816 1.0 Zr Zr6 1 0.99763927 0.33997595 0.53057879 1.0 Zr Zr7 1 0.00067342 0.65931280 0.03012712 1.0 Ti Ti8 1 0.49506784 0.65430025 0.12308263 1.0 Ti Ti9 1 0.50272506 0.34630739 0.62323388 1.0 Ti Ti10 1 0.65452362 0.49538544 0.87685890 1.0 Ti Ti11 1 0.34676581 0.50486424 0.37679135 1.0 Ti Ti12 1 0.84672408 0.99649200 0.37274077 1.0 Ti Ti13 1 0.00458209 0.15320251 0.12769130 1.0 Ti Ti14 1 0.99573515 0.84768709 0.62657520 1.0 Si Si15 1 0.20734794 0.13229480 0.67780607 1.0 Si Si16 1 0.36912748 0.70750979 0.92806964 1.0 Si Si17 1 0.63212126 0.29260161 0.42767287 1.0 Si Si18 1 0.70803542 0.36753025 0.07237048 1.0 Si Si19 1 0.29201891 0.63283846 0.57217395 1.0 Si Si20 1 0.79199482 0.86753746 0.17738208 1.0 Si Si21 1 0.13264793 0.20826838 0.32283071 1.0 Si Si22 1 0.86845929 0.79356211 0.82170484 1.0 Si Si23 1 0.29457906 0.95670086 0.06361589 1.0 Si Si24 1 0.54436927 0.79453971 0.31417455 1.0 Si Si25 1 0.45391276 0.20647812 0.81430855 1.0 Si Si26 1 0.79375244 0.54491336 0.68567151 1.0 Si Si27 1 0.20555946 0.45528361 0.18599759 1.0 Si Si28 1 0.70575403 0.04465886 0.56392774 1.0 Si Si29 1 0.95815838 0.29061039 0.93617726 1.0 Si Si30 1 0.04401603 0.70617541 0.43572538 1.0 Mo Mo31 1 0.33238682 0.33197928 0.00085950 1.0 Mo Mo32 1 0.16934094 0.83055679 0.24954072 1.0 Mo Mo33 1 0.82776692 0.17099881 0.74982935 1.0 Mo Mo34 1 0.66900428 0.66986856 0.50027181 1.0 Mo Mo35 1 0.15615762 0.99981986 0.87249706 1.0