# generated using pymatgen data_Sc7Ta(Si4Tc3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.58393820 _cell_length_b 6.58327170 _cell_length_c 12.32427902 _cell_angle_alpha 90.11495177 _cell_angle_beta 90.29247817 _cell_angle_gamma 90.22630983 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc7Ta(Si4Tc3)4 _chemical_formula_sum 'Sc7 Ta1 Si16 Tc12' _cell_volume 534.16952701 _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 0.83976499 0.50649763 0.28126027 1.0 Sc Sc1 1 0.15887388 0.49224943 0.78169320 1.0 Sc Sc2 1 0.50982226 0.84134457 0.72010084 1.0 Sc Sc3 1 0.49091437 0.15725723 0.21589794 1.0 Sc Sc4 1 0.99540605 0.34394414 0.53119208 1.0 Sc Sc5 1 0.65856265 0.99869416 0.96965561 1.0 Sc Sc6 1 0.34397321 0.99587085 0.46884760 1.0 Ta Ta7 1 0.01177641 0.65481181 0.03871376 1.0 Si Si8 1 0.26868764 0.97008535 0.05960531 1.0 Si Si9 1 0.52502804 0.77984633 0.31189817 1.0 Si Si10 1 0.47541775 0.21761390 0.81342662 1.0 Si Si11 1 0.78370490 0.52816346 0.68763057 1.0 Si Si12 1 0.21941173 0.47296666 0.18752549 1.0 Si Si13 1 0.72566332 0.02650455 0.56271805 1.0 Si Si14 1 0.97217645 0.27483286 0.93731257 1.0 Si Si15 1 0.02544685 0.72607969 0.43777225 1.0 Si Si16 1 0.69506106 0.38127282 0.06441945 1.0 Si Si17 1 0.12018387 0.19572441 0.31824252 1.0 Si Si18 1 0.88247099 0.80307313 0.82300749 1.0 Si Si19 1 0.19784578 0.12288709 0.68125173 1.0 Si Si20 1 0.80321233 0.87811635 0.17926271 1.0 Si Si21 1 0.30730247 0.62302413 0.56736819 1.0 Si Si22 1 0.37597857 0.69365945 0.93268454 1.0 Si Si23 1 0.62048670 0.30681897 0.43265844 1.0 Tc Tc24 1 0.32422167 0.33031293 0.99985244 1.0 Tc Tc25 1 0.16518330 0.83396001 0.25002089 1.0 Tc Tc26 1 0.83361728 0.16679867 0.75119629 1.0 Tc Tc27 1 0.66945654 0.67004687 0.49915288 1.0 Tc Tc28 1 0.97677464 0.18800454 0.13313209 1.0 Tc Tc29 1 0.31667683 0.48383218 0.38135950 1.0 Tc Tc30 1 0.67882937 0.51902852 0.87949805 1.0 Tc Tc31 1 0.48644370 0.32271200 0.61979173 1.0 Tc Tc32 1 0.51213197 0.67954977 0.11839380 1.0 Tc Tc33 1 0.02345943 0.81562302 0.63347599 1.0 Tc Tc34 1 0.19235814 0.97677943 0.86368316 1.0 Tc Tc35 1 0.81367386 0.02201509 0.36629677 1.0