"molecule_id","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","FCFP4_1024b167","FCFP4_1024b168","pXC50"
{1 1,103 8.071}
{0 CHEMBL1812662,1 1,103 5.295}
{0 CHEMBL2326084,1 1,2 1,103 6.409}
{0 CHEMBL2326085,1 1,2 1,103 6.569}
{0 CHEMBL2326086,1 1,2 1,103 6.495}
{0 CHEMBL2326087,1 1,52 1,103 6.721}
{0 CHEMBL2326088,1 1,103 5.717}
{0 CHEMBL2326089,1 1,2 1,103 6.293}
{0 CHEMBL2326090,1 1,2 1,36 1,103 7.174}
{0 CHEMBL2326092,1 1,2 1,103 5.592}
{0 CHEMBL2326093,1 1,2 1,103 6.377}
{0 CHEMBL2326094,1 1,2 1,70 1,103 5.963}
{0 CHEMBL2326095,1 1,2 1,103 6.509}
{0 CHEMBL2326096,1 1,2 1,26 1,103 6.222}
{0 CHEMBL2326097,1 1,2 1,103 6.469}
{0 CHEMBL2326098,1 1,2 1,103 5.767}
{0 CHEMBL2326099,1 1,2 1,103 6.26}
{0 CHEMBL2348486,1 1,2 1,103 6.208}
{0 CHEMBL2348487,1 1,2 1,103 6.009}
{0 CHEMBL2348488,1 1,2 1,103 6.03}
{0 CHEMBL2348489,1 1,2 1,103 5.396}
{0 CHEMBL2348490,1 1,103 5.87}
{0 CHEMBL2348491,1 1,31 1,48 1,103 5.223}
{0 CHEMBL2348492,1 1,65 1,103 5.429}
{0 CHEMBL2348493,1 1,103 5.191}
{0 CHEMBL2348494,1 1,103 4.244}
{0 CHEMBL2348495,1 1,103 5.347}
{0 CHEMBL2348496,1 1,103 5.369}
{0 CHEMBL2348497,1 1,28 1,103 4.77}
{0 CHEMBL2348498,1 1,103 5.337}
{0 CHEMBL2348499,1 1,103 4.81}
{0 CHEMBL2348500,1 1,103 5.717}