# generated using pymatgen data_Sc5Ti3(V3Si4)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.54511761 _cell_length_b 6.54747949 _cell_length_c 12.10787948 _cell_angle_alpha 90.11366865 _cell_angle_beta 89.95511811 _cell_angle_gamma 89.93476479 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc5Ti3(V3Si4)4 _chemical_formula_sum 'Sc5 Ti3 V12 Si16' _cell_volume 518.86983243 _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 Sc Sc0 1 0.50173257 0.83595721 0.72163736 1.0 Sc Sc1 1 0.49985568 0.16345798 0.21907863 1.0 Sc Sc2 1 0.99916759 0.33721650 0.52938853 1.0 Sc Sc3 1 0.66369868 0.00046282 0.97031427 1.0 Sc Sc4 1 0.33805657 0.99849538 0.46891910 1.0 Ti Ti5 1 0.00745630 0.65818295 0.03004944 1.0 Ti Ti6 1 0.84094749 0.50820804 0.28072223 1.0 Ti Ti7 1 0.15821425 0.49156009 0.78130176 1.0 V V8 1 0.32928051 0.33653926 0.00014029 1.0 V V9 1 0.16365652 0.82876342 0.24884715 1.0 V V10 1 0.83657683 0.16957210 0.75122587 1.0 V V11 1 0.66861472 0.66623397 0.50020833 1.0 V V12 1 0.00277666 0.15580654 0.12616506 1.0 V V13 1 0.34175304 0.50568881 0.37551810 1.0 V V14 1 0.65731449 0.49747930 0.87849651 1.0 V V15 1 0.51032982 0.34651801 0.62402471 1.0 V V16 1 0.48777069 0.65439848 0.12267496 1.0 V V17 1 0.99541033 0.84376009 0.62833706 1.0 V V18 1 0.15505201 0.01087586 0.87421489 1.0 V V19 1 0.84278861 0.98936121 0.37143013 1.0 Si Si20 1 0.29015706 0.95817988 0.06351419 1.0 Si Si21 1 0.54125006 0.79002866 0.31287142 1.0 Si Si22 1 0.46028138 0.21044352 0.81477226 1.0 Si Si23 1 0.79929233 0.54079408 0.68722853 1.0 Si Si24 1 0.19874036 0.45957385 0.18500154 1.0 Si Si25 1 0.70701515 0.03981329 0.56370740 1.0 Si Si26 1 0.95947970 0.30018229 0.93595352 1.0 Si Si27 1 0.03926033 0.70408104 0.43517534 1.0 Si Si28 1 0.70980305 0.37627046 0.07336845 1.0 Si Si29 1 0.12474738 0.20670056 0.31935597 1.0 Si Si30 1 0.87661484 0.79037194 0.82394920 1.0 Si Si31 1 0.20693625 0.13344095 0.68045791 1.0 Si Si32 1 0.79628417 0.86156372 0.17637274 1.0 Si Si33 1 0.29422412 0.62906838 0.57235184 1.0 Si Si34 1 0.36192247 0.70296195 0.92683544 1.0 Si Si35 1 0.63353800 0.29798942 0.42639190 1.0