0  B17R3.1910  C1=CC2=C(CCC2)C(=C1)NC3=NCCN3 MCULE-8958939682 [0,0,0,0,0,0|0,0,0]=0
1  B18R3.4227  ClC1=C(C2=NSN=C2C=C1)NC3=NCCN3 MCULE-2342327042 [0,1,0,0,0,0|3,0,0]=4
2  B18R3.6952  CN1C=C2C(=CC=CC2=N1)NC3=NCCN3 MCULE-3299084027 [0,1,0,0,0,0|2,0,1]=4
3  B16R2.2304  CCOC1=C(C=CC=C1)NC2=NCCS2 MCULE-7535908536 [0,0,1,0,0,0|2,0,0]=3
4  B18R3.11  C1=CC2=C(CCCC2)C(=C1)NC3=NCCN3 MCULE-2539140170 [0,0,0,0,0,1|0,0,0]=1
5  B18R3.12721  C1=CC(=C2CCCC2=C1)OCC3CCCN3 MCULE-4936199190 [0,0,0,0,0,1|2,0,1]=4
6  B18R3.12721  C1=CC(=C2CCCC2=C1)OCC3CCCN3 MCULE-6327962986 [0,0,0,0,0,1|2,0,1]=4
7  B15R2.1109  CC1=C(C=CC=C1Cl)NC2=NCCS2 MCULE-5296629079 [1,0,1,0,0,0|2,0,0]=4
8  B15R2.123  COC1=C(C=CC=C1)NC2=NCCS2 MCULE-2389957159 [1,0,1,0,0,0|2,0,0]=4
9  B15R2.4278  NCCCOC1=C2CCCC2=CC=C1 MCULE-1304126919 [1,0,1,0,0,0|1,0,1]=4
10  B15R2.4278  NCCCOC1=C2CCCC2=CC=C1 MCULE-7238999597 [1,0,1,0,0,0|1,0,1]=4
11  B15R1.3880  CCNC(=S)NC1=C(C=CC=C1)OCC MCULE-4567511386 [0,0,2,0,0,0|2,0,0]=4
12  B17R3.2679  C1=CC2=C(C=C1)C(CCC2)C3=NCCN3 MCULE-1878887684 [0,0,1,1,0,0|1,0,0]=3
13  B17R3.2679  C1=CC2=C(C=C1)C(CCC2)C3=NCCN3 MCULE-6434802156 [0,0,1,1,0,0|1,0,0]=3
14  B17R3.2679  C1=CC2=C(C=C1)C(OCC2)C3=NCCN3 MCULE-3520612936 [0,0,1,1,0,0|2,0,0]=4
15  B17R3.2679  C1=CC2=C(C=C1)C(OCC2)C3=NCCN3 MCULE-6560799375 [0,0,1,1,0,0|2,0,0]=4
16  B15R2.43  CCOC1=C(C=CC=C1)C2=NCCN2 MCULE-7627323433 [0,0,1,0,1,0|1,0,0]=3
17  B17R2.322318  CCCC(=O)NC1=CC=CC2=C1CCCC2 MCULE-1426409901 [0,0,1,0,0,1|2,0,0]=4