"molecule_id","FCFP4_1024b133","FCFP4_1024b983","FCFP4_1024b1019","FCFP4_1024b416","FCFP4_1024b458","FCFP4_1024b529","FCFP4_1024b680","FCFP4_1024b71","FCFP4_1024b801","FCFP4_1024b809","FCFP4_1024b63","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_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","pXC50"
{12 1,36 1,39 1,52 5.523}
{0 CHEMBL14249,12 1,36 1,39 1,52 4.766}
{0 CHEMBL1802094,12 1,20 1,36 1,39 1,52 4.886}
{0 CHEMBL1802096,12 1,20 1,36 1,39 1,52 4.398}
{0 CHEMBL2111533,12 1,36 1,52 4.763}
{0 CHEMBL223344,11 1,12 1,36 1,52 4}
{0 CHEMBL2333767,12 1,14 1,45 1,52 4.824}
{0 CHEMBL2333770,12 1,14 1,45 1,52 4.824}
{0 CHEMBL2333771,12 1,14 1,45 1,52 4.824}
{0 CHEMBL2333772,12 1,14 1,45 1,52 4.824}
{0 CHEMBL2333773,12 1,45 1,52 4.824}
{0 CHEMBL240681,1 1,2 1,11 1,12 1,20 1,29 1,52 5.89}
{0 CHEMBL265502,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,11 1,12 1,45 1,52 6.735}
{0 CHEMBL266646,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,11 1,12 1,45 1,52 6.52}
{0 CHEMBL276295,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,11 1,12 1,45 1,52 6}
{0 CHEMBL335206,12 1,36 1,39 1,52 4.523}
{0 CHEMBL335538,12 1,36 1,39 1,52 5.046}
{0 CHEMBL336208,12 1,36 1,39 1,52 4.301}
{0 CHEMBL336292,12 1,36 1,39 1,52 5.824}
{0 CHEMBL336296,12 1,52 4}
{0 CHEMBL339386,12 1,21 1,36 1,39 1,52 5.155}
{0 CHEMBL339873,12 1,20 1,45 1,46 1,52 4}
{0 CHEMBL394381,1 1,2 1,11 1,12 1,20 1,26 1,29 1,52 6.32}
{0 CHEMBL405500,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,11 1,12 1,45 1,52 6.35}
{0 CHEMBL409304,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,11 1,12 1,45 1,52 5.62}
{0 CHEMBL411554,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,11 1,12 1,45 1,52 5.12}
{0 CHEMBL413145,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,11 1,12 1,45 1,52 7.35}
{0 CHEMBL413180,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,11 1,12 1,45 1,52 6.97}
{0 CHEMBL413910,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,11 1,12 1,45 1,52 7.12}
{0 CHEMBL752,12 1,20 1,36 1,39 1,52 4.763}