# generated using pymatgen data_Sc8Ta11Si16Tc _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.84873477 _cell_length_b 6.84846343 _cell_length_c 12.63907726 _cell_angle_alpha 90.22203480 _cell_angle_beta 89.93202391 _cell_angle_gamma 89.96134987 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc8Ta11Si16Tc _chemical_formula_sum 'Sc8 Ta11 Si16 Tc1' _cell_volume 592.80954882 _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 0.00076683 0.66126656 0.03266184 1.0 Sc Sc1 1 0.83954354 0.50360704 0.28130483 1.0 Sc Sc2 1 0.16042024 0.49994006 0.78112023 1.0 Sc Sc3 1 0.50139625 0.84023130 0.71741554 1.0 Sc Sc4 1 0.49792413 0.15945466 0.21973923 1.0 Sc Sc5 1 0.99954469 0.34161521 0.52981642 1.0 Sc Sc6 1 0.65984467 0.00135452 0.96924431 1.0 Sc Sc7 1 0.34028281 0.99966131 0.46904304 1.0 Ta Ta8 1 0.32914884 0.32933318 0.00007311 1.0 Ta Ta9 1 0.17250896 0.82995140 0.25035517 1.0 Ta Ta10 1 0.82950217 0.17163865 0.74918001 1.0 Ta Ta11 1 0.67220322 0.66761176 0.50001893 1.0 Ta Ta12 1 0.00538571 0.15024074 0.12650962 1.0 Ta Ta13 1 0.34862277 0.50490655 0.37670104 1.0 Ta Ta14 1 0.65093476 0.49353334 0.87674914 1.0 Ta Ta15 1 0.50954911 0.34639985 0.62178528 1.0 Ta Ta16 1 0.49436055 0.65321430 0.12498471 1.0 Ta Ta17 1 0.99516829 0.84867611 0.62695200 1.0 Ta Ta18 1 0.15079118 0.00649272 0.87325115 1.0 Si Si19 1 0.30102440 0.95614624 0.06313222 1.0 Si Si20 1 0.54780970 0.80136692 0.31536429 1.0 Si Si21 1 0.45591550 0.19835505 0.81285446 1.0 Si Si22 1 0.80126251 0.54475403 0.68694511 1.0 Si Si23 1 0.19916703 0.45514442 0.18757666 1.0 Si Si24 1 0.70178178 0.04072419 0.56056928 1.0 Si Si25 1 0.95575195 0.30223127 0.93703507 1.0 Si Si26 1 0.04163859 0.70571150 0.43648017 1.0 Si Si27 1 0.70457569 0.36075689 0.07228303 1.0 Si Si28 1 0.13127434 0.20165891 0.32159444 1.0 Si Si29 1 0.86028437 0.79481381 0.82142362 1.0 Si Si30 1 0.20603822 0.14031102 0.67778462 1.0 Si Si31 1 0.79569896 0.86339435 0.18107949 1.0 Si Si32 1 0.29388495 0.63666551 0.57045735 1.0 Si Si33 1 0.36124479 0.70631612 0.92912543 1.0 Si Si34 1 0.64004247 0.28875264 0.42649950 1.0 Tc Tc35 1 0.84470503 0.99376588 0.37288865 1.0