"molecule_id","FCFP4_1024b823","FCFP4_1024b766","FCFP4_1024b101","FCFP4_1024b197","FCFP4_1024b366","FCFP4_1024b36","FCFP4_1024b527","FCFP4_1024b868","FCFP4_1024b702","FCFP4_1024b375","FCFP4_1024b829","FCFP4_1024b948","FCFP4_1024b322","FCFP4_1024b244","FCFP4_1024b403","FCFP4_1024b825","FCFP4_1024b222","FCFP4_1024b95","FCFP4_1024b1005","FCFP4_1024b557","FCFP4_1024b325","FCFP4_1024b61","FCFP4_1024b891","FCFP4_1024b714","FCFP4_1024b524","FCFP4_1024b540","FCFP4_1024b945","FCFP4_1024b492","FCFP4_1024b44","FCFP4_1024b295","FCFP4_1024b170","FCFP4_1024b665","FCFP4_1024b1016","FCFP4_1024b387","FCFP4_1024b143","FCFP4_1024b248","FCFP4_1024b847","FCFP4_1024b17","FCFP4_1024b518","FCFP4_1024b450","FCFP4_1024b870","FCFP4_1024b574","FCFP4_1024b616","FCFP4_1024b316","FCFP4_1024b889","FCFP4_1024b22","FCFP4_1024b769","FCFP4_1024b135","FCFP4_1024b589","FCFP4_1024b482","FCFP4_1024b1","pXC50"
{31 1,38 1,51 1,52 4.686}
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{0 CHEMBL1200596,15 1,31 1,38 1,52 4.301}
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{0 CHEMBL124850,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,12 1,14 1,15 1,16 1,17 1,18 1,20 1,21 1,23 1,24 1,25 1,26 1,28 1,29 1,31 1,32 1,33 1,37 1,38 1,39 1,41 1,42 1,51 1,52 5.578}
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{0 CHEMBL127088,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,12 1,14 1,15 1,16 1,17 1,18 1,20 1,21 1,23 1,24 1,25 1,26 1,28 1,29 1,31 1,32 1,33 1,37 1,38 1,39 1,42 1,50 1,51 1,52 5.249}
{0 CHEMBL127158,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,12 1,14 1,15 1,16 1,17 1,18 1,20 1,21 1,23 1,24 1,25 1,26 1,28 1,29 1,31 1,32 1,33 1,37 1,38 1,39 1,42 1,51 1,52 5.461}
{0 CHEMBL127176,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,12 1,14 1,15 1,16 1,17 1,18 1,20 1,21 1,23 1,24 1,25 1,26 1,28 1,29 1,32 1,33 1,37 1,39 1,42 1,51 1,52 6}
{0 CHEMBL127177,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,12 1,14 1,15 1,16 1,17 1,18 1,20 1,21 1,23 1,24 1,25 1,26 1,28 1,29 1,31 1,32 1,33 1,37 1,38 1,39 1,42 1,51 1,52 5.549}
{0 CHEMBL127821,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,12 1,14 1,15 1,16 1,17 1,18 1,20 1,21 1,23 1,24 1,25 1,26 1,28 1,29 1,31 1,32 1,33 1,37 1,38 1,39 1,41 1,42 1,50 1,51 1,52 6.35}
{0 CHEMBL127839,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,12 1,14 1,15 1,16 1,17 1,18 1,20 1,21 1,23 1,24 1,25 1,26 1,28 1,29 1,31 1,32 1,33 1,37 1,38 1,39 1,42 1,50 1,51 1,52 6.35}
{0 CHEMBL127864,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,12 1,14 1,15 1,16 1,17 1,18 1,20 1,21 1,23 1,24 1,25 1,26 1,28 1,29 1,31 1,32 1,33 1,37 1,38 1,39 1,42 1,51 1,52 5.602}
{0 CHEMBL129334,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,12 1,14 1,15 1,16 1,17 1,18 1,20 1,21 1,23 1,24 1,25 1,26 1,28 1,29 1,31 1,32 1,33 1,37 1,38 1,39 1,42 1,51 1,52 6.373}
{0 CHEMBL1302564,31 1,38 1,47 1,51 1,52 4.301}
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{0 CHEMBL1488035,23 1,31 1,37 1,38 1,51 1,52 5.564}
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