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{1 1,2 1,3 1,8 1,17 1,18 1,20 1,25 1,27 1,37 1,54 1,65 1,69 1,71 1,78 1,79 1,85 1,114 1,123 1,137 1,151 1,156 1,170 1,198 1,199 1,235 1,237 1,262 1,265 1,298 1,305 1,360 1,362 1,363 1,365 1,374 1,376 1,387 1,394 1,396 1,412 1,461 1,468 1,482 1,496 1,513 1,521 1,524 1,541 1,553 1,565 1,574 1,579 1,591 1,597 1,606 1,608 1,612 1,627 1,653 1,669 1,678 1,695 1,698 1,731 1,733 1,738 1,745 1,747 1,752 1,759 1,778 1,781 1,787 1,819 1,820 1,826 1,838 1,847 1,851 1,857 1,872 1,875 1,883 1,884 1,900 1,903 1,904 1,908 1,917 1,925 1,926 1,933 1,942 1,947 1,953 1,957 1,961 1,971 1,978 1,983 1,986 1,993 1,1020 1,1025 6.423} {0 CHEMBL2017831,1 1,2 1,8 1,17 1,18 1,20 1,25 1,26 1,27 1,37 1,65 1,69 1,71 1,73 1,78 1,85 1,120 1,137 1,170 1,171 1,173 1,178 1,198 1,208 1,223 1,231 1,235 1,262 1,284 1,298 1,321 1,360 1,362 1,363 1,376 1,387 1,388 1,407 1,412 1,461 1,468 1,482 1,496 1,524 1,541 1,547 1,553 1,565 1,579 1,597 1,606 1,608 1,609 1,616 1,632 1,663 1,669 1,678 1,698 1,701 1,731 1,733 1,738 1,745 1,759 1,781 1,787 1,804 1,817 1,819 1,835 1,844 1,847 1,883 1,895 1,904 1,908 1,922 1,925 1,926 1,942 1,944 1,947 1,957 1,961 1,962 1,963 1,983 1,986 1,993 1,1000 1,1025 6.42} {0 CHEMBL2017832,1 1,2 1,8 1,17 1,18 1,20 1,27 1,37 1,65 1,69 1,71 1,73 1,78 1,79 1,85 1,120 1,137 1,138 1,170 1,178 1,198 1,208 1,223 1,227 1,235 1,262 1,284 1,287 1,298 1,319 1,321 1,325 1,360 1,362 1,363 1,376 1,387 1,388 1,396 1,412 1,420 1,461 1,468 1,482 1,496 1,524 1,541 1,547 1,553 1,565 1,574 1,579 1,597 1,606 1,608 1,616 1,632 1,653 1,663 1,669 1,695 1,698 1,731 1,733 1,738 1,745 1,759 1,781 1,787 1,800 1,808 1,817 1,819 1,820 1,826 1,835 1,844 1,847 1,872 1,883 1,895 1,903 1,904 1,908 1,925 1,926 1,942 1,944 1,947 1,957 1,961 1,962 1,963 1,981 1,983 1,986 1,993 1,1000 1,1025 8.287} {0 CHEMBL2017833,1 1,2 1,8 1,17 1,18 1,20 1,25 1,27 1,37 1,65 1,69 1,71 1,73 1,78 1,79 1,85 1,120 1,137 1,145 1,170 1,171 1,178 1,195 1,198 1,208 1,223 1,235 1,262 1,284 1,298 1,321 1,360 1,362 1,363 1,365 1,376 1,387 1,388 1,394 1,396 1,412 1,461 1,468 1,482 1,496 1,513 1,524 1,541 1,547 1,553 1,565 1,574 1,579 1,591 1,597 1,606 1,608 1,616 1,632 1,653 1,663 1,669 1,695 1,698 1,731 1,733 1,738 1,745 1,759 1,781 1,787 1,804 1,817 1,819 1,820 1,826 1,835 1,844 1,847 1,851 1,872 1,883 1,895 1,903 1,904 1,908 1,925 1,926 1,942 1,944 1,947 1,957 1,961 1,962 1,963 1,978 1,983 1,986 1,993 1,1000 1,1020 1,1025 7.667} {0 CHEMBL2017834,1 1,2 1,8 1,17 1,18 1,20 1,25 1,27 1,37 1,65 1,69 1,71 1,73 1,78 1,79 1,85 1,120 1,137 1,170 1,178 1,195 1,198 1,208 1,223 1,235 1,262 1,284 1,298 1,321 1,351 1,360 1,362 1,363 1,365 1,376 1,387 1,388 1,394 1,396 1,412 1,461 1,468 1,482 1,496 1,513 1,514 1,524 1,541 1,547 1,553 1,565 1,574 1,579 1,591 1,597 1,606 1,608 1,616 1,627 1,632 1,653 1,663 1,669 1,695 1,698 1,731 1,733 1,738 1,745 1,759 1,781 1,787 1,804 1,817 1,819 1,820 1,826 1,835 1,844 1,847 1,851 1,872 1,883 1,895 1,903 1,904 1,908 1,925 1,926 1,942 1,944 1,947 1,954 1,957 1,961 1,962 1,963 1,978 1,983 1,986 1,993 1,1000 1,1019 1,1020 1,1025 6.175} {0 CHEMBL2017835,1 1,2 1,8 1,17 1,18 1,20 1,25 1,27 1,37 1,65 1,69 1,71 1,73 1,78 1,79 1,85 1,120 1,137 1,170 1,178 1,198 1,208 1,223 1,235 1,262 1,284 1,298 1,321 1,351 1,360 1,362 1,363 1,365 1,376 1,387 1,388 1,394 1,396 1,412 1,461 1,468 1,482 1,496 1,513 1,524 1,541 1,547 1,553 1,565 1,574 1,579 1,591 1,597 1,606 1,608 1,616 1,627 1,632 1,653 1,663 1,669 1,695 1,698 1,731 1,733 1,738 1,745 1,759 1,781 1,787 1,817 1,819 1,820 1,826 1,835 1,844 1,847 1,851 1,866 1,872 1,883 1,895 1,903 1,904 1,908 1,915 1,925 1,926 1,942 1,944 1,947 1,957 1,961 1,962 1,963 1,978 1,983 1,986 1,993 1,1000 1,1019 1,1020 1,1025 7.644} {0 CHEMBL1269260,1 1,2 1,4 1,8 1,17 1,18 1,25 1,26 1,27 1,37 1,54 1,60 1,65 1,69 1,71 1,107 1,137 1,170 1,171 1,173 1,198 1,212 1,218 1,231 1,235 1,263 1,283 1,298 1,300 1,360 1,362 1,363 1,376 1,387 1,407 1,411 1,412 1,429 1,434 1,447 1,453 1,461 1,466 1,468 1,509 1,524 1,541 1,546 1,553 1,606 1,608 1,609 1,634 1,668 1,669 1,678 1,683 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{0 CHEMBL320624,1 1,2 1,4 1,5 1,17 1,27 1,33 1,41 1,54 1,57 1,61 1,65 1,107 1,137 1,139 1,164 1,170 1,172 1,190 1,192 1,198 1,250 1,253 1,266 1,278 1,283 1,284 1,319 1,352 1,372 1,376 1,402 1,408 1,412 1,429 1,453 1,461 1,468 1,483 1,498 1,520 1,532 1,541 1,574 1,580 1,603 1,615 1,635 1,649 1,669 1,696 1,714 1,715 1,716 1,718 1,723 1,733 1,745 1,771 1,807 1,809 1,821 1,841 1,884 1,902 1,904 1,908 1,925 1,940 1,947 1,986 1,998 1,1025 8} {0 CHEMBL421575,1 1,2 1,4 1,5 1,17 1,27 1,33 1,41 1,54 1,57 1,65 1,107 1,137 1,139 1,170 1,172 1,190 1,192 1,198 1,247 1,253 1,254 1,266 1,278 1,283 1,319 1,352 1,372 1,376 1,412 1,453 1,461 1,468 1,483 1,498 1,520 1,532 1,541 1,574 1,580 1,603 1,615 1,635 1,649 1,669 1,695 1,696 1,714 1,715 1,716 1,723 1,733 1,745 1,771 1,807 1,809 1,811 1,821 1,841 1,872 1,884 1,902 1,904 1,908 1,925 1,940 1,947 1,986 1,998 1,1025 7.3} {0 CHEMBL95200,1 1,2 1,4 1,5 1,17 1,18 1,27 1,33 1,54 1,57 1,65 1,107 1,117 1,137 1,139 1,142 1,157 1,170 1,172 1,192 1,198 1,247 1,254 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