"molecule_id","FCFP4_1024b108","FCFP4_1024b171","FCFP4_1024b900","FCFP4_1024b957","FCFP4_1024b197","FCFP4_1024b456","FCFP4_1024b726","FCFP4_1024b537","FCFP4_1024b879","FCFP4_1024b1","FCFP4_1024b10","FCFP4_1024b100","FCFP4_1024b1000","FCFP4_1024b1001","FCFP4_1024b1002","FCFP4_1024b1003","FCFP4_1024b1004","FCFP4_1024b1005","FCFP4_1024b1006","FCFP4_1024b1007","FCFP4_1024b1008","FCFP4_1024b1009","FCFP4_1024b101","FCFP4_1024b1010","FCFP4_1024b1011","FCFP4_1024b1012","FCFP4_1024b1013","FCFP4_1024b1014","FCFP4_1024b1015","FCFP4_1024b1016","FCFP4_1024b1017","FCFP4_1024b1018","FCFP4_1024b1019","FCFP4_1024b102","FCFP4_1024b1020","FCFP4_1024b1021","FCFP4_1024b1022","FCFP4_1024b1023","FCFP4_1024b1024","FCFP4_1024b103","FCFP4_1024b104","FCFP4_1024b105","FCFP4_1024b106","FCFP4_1024b107","FCFP4_1024b109","FCFP4_1024b11","FCFP4_1024b110","FCFP4_1024b111","FCFP4_1024b112","FCFP4_1024b113","FCFP4_1024b114","FCFP4_1024b115","FCFP4_1024b116","FCFP4_1024b117","FCFP4_1024b118","FCFP4_1024b119","FCFP4_1024b12","FCFP4_1024b120","FCFP4_1024b121","FCFP4_1024b122","FCFP4_1024b123","FCFP4_1024b124","FCFP4_1024b125","FCFP4_1024b126","FCFP4_1024b127","FCFP4_1024b128","FCFP4_1024b129","FCFP4_1024b13","FCFP4_1024b130","FCFP4_1024b131","FCFP4_1024b132","FCFP4_1024b133","FCFP4_1024b134","FCFP4_1024b135","FCFP4_1024b136","FCFP4_1024b137","FCFP4_1024b138","FCFP4_1024b139","FCFP4_1024b14","FCFP4_1024b140","FCFP4_1024b141","FCFP4_1024b142","FCFP4_1024b143","FCFP4_1024b144","FCFP4_1024b145","FCFP4_1024b146","FCFP4_1024b147","FCFP4_1024b148","FCFP4_1024b149","FCFP4_1024b15","FCFP4_1024b150","FCFP4_1024b151","FCFP4_1024b152","FCFP4_1024b153","FCFP4_1024b154","FCFP4_1024b155","FCFP4_1024b156","FCFP4_1024b157","FCFP4_1024b158","FCFP4_1024b159","FCFP4_1024b16","FCFP4_1024b160","FCFP4_1024b161","FCFP4_1024b162","FCFP4_1024b163","FCFP4_1024b164","FCFP4_1024b165","FCFP4_1024b166","FCFP4_1024b167","FCFP4_1024b168","FCFP4_1024b169","FCFP4_1024b17","FCFP4_1024b170","FCFP4_1024b172","FCFP4_1024b173","FCFP4_1024b174","FCFP4_1024b175","FCFP4_1024b176","FCFP4_1024b177","FCFP4_1024b178","FCFP4_1024b179","FCFP4_1024b18","FCFP4_1024b180","FCFP4_1024b181","FCFP4_1024b182","FCFP4_1024b183","FCFP4_1024b184","FCFP4_1024b185","FCFP4_1024b186","FCFP4_1024b187","FCFP4_1024b188","FCFP4_1024b189","FCFP4_1024b19","FCFP4_1024b190","FCFP4_1024b191","FCFP4_1024b192","FCFP4_1024b193","FCFP4_1024b194","FCFP4_1024b195","FCFP4_1024b196","FCFP4_1024b198","FCFP4_1024b199","FCFP4_1024b2","FCFP4_1024b20","FCFP4_1024b200","FCFP4_1024b201","FCFP4_1024b202","FCFP4_1024b203","FCFP4_1024b204","FCFP4_1024b205","FCFP4_1024b206","FCFP4_1024b207","FCFP4_1024b208","FCFP4_1024b209","pXC50"
{10 1,11 1,112 1,113 1,122 1,125 1,155 6.959}
{0 CHEMBL308538,10 1,60 1,112 1,113 1,122 1,143 1,155 6.745}
{0 CHEMBL449437,10 1,60 1,112 1,113 1,122 1,143 1,155 6.742}
{0 CHEMBL476140,4 1,10 1,11 1,15 1,29 1,88 1,112 1,113 1,122 1,125 1,144 1,155 9.18}
{0 CHEMBL478029,4 1,10 1,11 1,15 1,29 1,88 1,112 1,113 1,122 1,125 1,144 1,155 9.292}
{0 CHEMBL478447,4 1,10 1,11 1,15 1,29 1,112 1,113 1,122 1,125 1,144 1,155 8.108}
{0 CHEMBL514372,4 1,10 1,11 1,15 1,25 1,29 1,88 1,112 1,113 1,122 1,125 1,144 1,155 9.076}
{0 CHEMBL551062,5 1,6 1,7 1,8 1,9 1,10 1,11 1,112 1,113 1,115 1,122 1,124 1,125 1,143 1,144 1,155 7.658}
{0 CHEMBL552408,5 1,6 1,7 1,8 1,9 1,10 1,11 1,25 1,112 1,113 1,122 1,125 1,143 1,144 1,155 7.569}
{0 CHEMBL558513,4 1,8 1,9 1,10 1,60 1,112 1,113 1,122 1,124 1,143 1,155 8.387}
{0 CHEMBL560788,1 1,2 1,3 1,8 1,9 1,10 1,60 1,112 1,113 1,115 1,122 1,124 1,143 1,155 8.086}
{0 CHEMBL563479,1 1,2 1,3 1,5 1,6 1,7 1,8 1,9 1,10 1,11 1,112 1,113 1,115 1,122 1,124 1,125 1,143 1,144 1,155 7.959}
{0 CHEMBL563831,5 1,6 1,7 1,8 1,9 1,10 1,11 1,112 1,113 1,115 1,122 1,124 1,125 1,143 1,144 1,155 7.854}
{0 CHEMBL6623,4 1,10 1,112 1,113 1,118 1,122 1,155 10.312}