# generated using pymatgen data_Sc8Ta11CrSi16 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.84937137 _cell_length_b 6.85344737 _cell_length_c 12.62699389 _cell_angle_alpha 90.21324320 _cell_angle_beta 89.93476009 _cell_angle_gamma 89.97809312 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc8Ta11CrSi16 _chemical_formula_sum 'Sc8 Ta11 Cr1 Si16' _cell_volume 592.72936597 _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 0.99996962 0.66093915 0.03279476 1.0 Sc Sc1 1 0.83991099 0.50327054 0.28122714 1.0 Sc Sc2 1 0.16038185 0.49993635 0.78120531 1.0 Sc Sc3 1 0.50140015 0.84059195 0.71747982 1.0 Sc Sc4 1 0.49615395 0.15915539 0.21917100 1.0 Sc Sc5 1 0.99974217 0.34239530 0.53051876 1.0 Sc Sc6 1 0.65956050 0.00132778 0.96912000 1.0 Sc Sc7 1 0.33948458 0.99941094 0.46918769 1.0 Ta Ta8 1 0.32841958 0.32913773 0.00017866 1.0 Ta Ta9 1 0.17214430 0.82980295 0.25073399 1.0 Ta Ta10 1 0.82887784 0.17151473 0.74895005 1.0 Ta Ta11 1 0.67346131 0.66868020 0.49965179 1.0 Ta Ta12 1 0.00535228 0.15037268 0.12666547 1.0 Ta Ta13 1 0.34964123 0.50433473 0.37691959 1.0 Ta Ta14 1 0.65031095 0.49394883 0.87672390 1.0 Ta Ta15 1 0.50936703 0.34632793 0.62154242 1.0 Ta Ta16 1 0.49389304 0.65245045 0.12454586 1.0 Ta Ta17 1 0.99539441 0.84767745 0.62755805 1.0 Ta Ta18 1 0.15050447 0.00677728 0.87325616 1.0 Cr Cr19 1 0.84551373 0.99326417 0.37220434 1.0 Si Si20 1 0.30097068 0.95544538 0.06355553 1.0 Si Si21 1 0.54933115 0.80309506 0.31598596 1.0 Si Si22 1 0.45546432 0.19860586 0.81283700 1.0 Si Si23 1 0.80132531 0.54462375 0.68663866 1.0 Si Si24 1 0.19901805 0.45468106 0.18784028 1.0 Si Si25 1 0.70360249 0.04136643 0.55923765 1.0 Si Si26 1 0.95454443 0.30227722 0.93680880 1.0 Si Si27 1 0.04238783 0.70720536 0.43569110 1.0 Si Si28 1 0.70494391 0.36096936 0.07242626 1.0 Si Si29 1 0.12965358 0.20141464 0.32273290 1.0 Si Si30 1 0.85993405 0.79472812 0.82157242 1.0 Si Si31 1 0.20636846 0.14022579 0.67758490 1.0 Si Si32 1 0.79559162 0.86350160 0.18209791 1.0 Si Si33 1 0.29462691 0.63705410 0.57052402 1.0 Si Si34 1 0.36045712 0.70639083 0.92905510 1.0 Si Si35 1 0.64229609 0.28709793 0.42577276 1.0