"molecule_id","FCFP4_1024b970","FCFP4_1024b461","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_1024b108","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","pXC50"
{2 1,3 1,4 1,6 1,37 1,52 1,72 1,77 1,87 1,103 5}
{0 CHEMBL418906,3 1,15 1,103 4}
{0 CHEMBL418907,3 1,17 1,60 1,103 4.398}
{0 CHEMBL445698,3 1,28 1,31 1,37 1,77 1,100 1,101 1,103 4.699}
{0 CHEMBL449093,3 1,17 1,97 1,103 4.523}
{0 CHEMBL452973,3 1,28 1,31 1,37 1,44 1,77 1,87 1,100 1,101 1,103 4}
{0 CHEMBL453502,3 1,28 1,31 1,60 1,77 1,100 1,103 4}
{0 CHEMBL483234,3 1,87 1,103 4}
{0 CHEMBL484659,2 1,3 1,28 1,31 1,37 1,77 1,100 1,103 4.699}
{0 CHEMBL485064,2 1,3 1,28 1,31 1,77 1,100 1,101 1,103 5}
{0 CHEMBL485065,3 1,15 1,103 5.301}
{0 CHEMBL485853,1 1,2 1,3 1,28 1,31 1,77 1,100 1,103 4.301}
{0 CHEMBL488101,3 1,15 1,87 1,103 4.699}
{0 CHEMBL488527,3 1,28 1,31 1,37 1,60 1,77 1,100 1,101 1,103 4.046}
{0 CHEMBL489352,3 1,28 1,31 1,77 1,100 1,103 4}
{0 CHEMBL490775,3 1,87 1,103 4.398}
{0 CHEMBL490987,3 1,103 4}
{0 CHEMBL505705,3 1,28 1,31 1,77 1,100 1,103 4}
{0 CHEMBL508477,3 1,28 1,31 1,44 1,77 1,87 1,100 1,103 4}
{0 CHEMBL509039,3 1,28 1,31 1,37 1,44 1,77 1,87 1,100 1,101 1,103 4.398}
{0 CHEMBL519230,1 1,2 1,3 1,28 1,31 1,54 1,77 1,100 1,103 4.222}
{0 CHEMBL520484,3 1,28 1,31 1,77 1,100 1,103 4.222}
{0 CHEMBL520671,3 1,15 1,28 1,31 1,44 1,77 1,87 1,100 1,101 1,103 4.523}
{0 CHEMBL521515,1 1,2 1,3 1,28 1,31 1,77 1,100 1,103 4.301}
{0 CHEMBL604416,3 1,15 1,28 1,31 1,44 1,77 1,87 1,100 1,101 1,103 4.602}
{0 CHEMBL605865,1 1,2 1,3 1,28 1,31 1,54 1,77 1,100 1,103 4.252}
{0 CHEMBL607702,2 1,3 1,28 1,31 1,37 1,77 1,100 1,103 4.721}
{0 CHEMBL607989,2 1,3 1,28 1,31 1,77 1,100 1,101 1,103 4.886}
{0 CHEMBL607992,2 1,3 1,28 1,31 1,77 1,100 1,101 1,103 4.387}
{0 CHEMBL608279,3 1,28 1,31 1,60 1,77 1,100 1,101 1,103 4.046}
{0 CHEMBL608280,3 1,28 1,31 1,37 1,77 1,100 1,101 1,103 4.796}
{0 CHEMBL608281,3 1,28 1,31 1,77 1,100 1,103 4.201}
{0 CHEMBL608881,3 1,28 1,31 1,37 1,44 1,77 1,87 1,100 1,101 1,103 4.357}
{0 CHEMBL609480,1 1,2 1,3 1,28 1,31 1,77 1,100 1,103 4.301}
{0 CHEMBL609481,1 1,2 1,3 1,28 1,31 1,77 1,100 1,103 4.347}
{0 CHEMBL74432,3 1,38 1,79 1,103 4.398}
{0 CHEMBL76929,3 1,103 4}
{0 CHEMBL76958,3 1,17 1,103 4}
{0 CHEMBL77100,3 1,54 1,103 4}
{0 CHEMBL77401,3 1,103 4}
{0 CHEMBL77688,3 1,17 1,103 4}