0  B17R2.41893  CN1CCCN=C1/C=C/C2=CC(=CC=C2)O MCULE-1919364520 [0,0,0,0,0,0|0,0,0]=0
1  B17R2.41893  CN1CCCN=C1C=CC2=CC(=CC=C2)O MCULE-9518134140 [0,0,0,0,0,0|0,0,0]=0
2  B16R2.71  CN1CCCN=C1SCC2=CC=CC=C2 MCULE-2777094255 [1,0,0,0,0,0|1,0,1]=3
3  B16R2.71  CN1CCCN=C1SCC2=CC=CC=C2 MCULE-4155064942 [1,0,0,0,0,0|1,0,1]=3
4  B16R2.2966  CC1=C(SC=C1)/C=C/C2=NCCCN2C MCULE-2937891094 [0,0,0,0,1,0|2,0,0]=3
5  B16R2.2966  CC1=C(SC=C1)/C=C/C2=NCCCN2C MCULE-5146808407 [0,0,0,0,1,0|2,0,0]=3
6  B16R2.2966  CC1=C(SC=C1)/C=C/C2=NCCCN2C MCULE-6405558595 [0,0,0,0,1,0|2,0,0]=3
7  B16R2.2966  CC1=C(SC=C1)/C=C/C2=NCCCN2C MCULE-8752521800 [0,0,0,0,1,0|2,0,0]=3
8  B16R2.2966  CC1=C(SC=C1)C=CC2=NCCCN2C MCULE-6031042599 [0,0,0,0,1,0|2,0,0]=3
9  B16R2.2966  CC1=C(SC=C1)C=CC2=NCCCN2C MCULE-7025679344 [0,0,0,0,1,0|2,0,0]=3
10  B16R2.2966  CC1=C(SC=C1)C=CC2=NCCCN2C MCULE-8017668169 [0,0,0,0,1,0|2,0,0]=3
11  B16R2.2966  CC1=C(SC=C1)C=CC2=NCCCN2C MCULE-9517669615 [0,0,0,0,1,0|2,0,0]=3
12  B16R2.11414  CN1CCCN=C1C=CC2=CC=C(S2)Cl MCULE-6729745389 [0,0,0,0,1,0|2,0,0]=3
13  B15R2.2195  C1=CC=C(C=C1)CSC2=NCCCN2 MCULE-1685047950 [2,0,0,0,0,0|1,0,1]=4
14  B15R2.2195  C1=CC=C(C=C1)CSC2=NCCCN2 MCULE-2088389162 [2,0,0,0,0,0|1,0,1]=4
15  B15R2.2195  C1=CC=C(C=C1)CSC2=NCCCN2 MCULE-7054891575 [2,0,0,0,0,0|1,0,1]=4
16  B17R2.5293  CC1=CC(=CC=C1)NC(=O)C2=NCCCN2 MCULE-6980117604 [1,1,0,0,0,0|2,0,0]=4
17  B17R2.5293  O=C(NC1=CC=CC(=C1)Cl)C2=NCCCN2 MCULE-2423536183 [1,1,0,0,0,0|2,0,0]=4
18  B17R2.5293  O=C(NC1=CC=CC(=C1)F)C2=NCCCN2 MCULE-8230602106 [1,1,0,0,0,0|2,0,0]=4
19  B17R2.5287  O=C(C=CC1=CC=CC(=C1)Cl)N2CCCC2 MCULE-7958999033 [0,0,1,1,0,0|2,0,0]=4
20  B17R3.8708  C1=CC=C(C=C1)C2=CN3CCCCC3=C2 MCULE-9106641944 [1,0,0,1,0,0|1,0,1]=4
21  B15R2.562  CN1CCCN=C1/C=C/C2=CC=CS2 MCULE-6056017984 [1,0,0,0,1,0|1,0,0]=3
22  B15R2.562  CN1CCCN=C1/C=C/C2=CC=CS2 MCULE-8725889722 [1,0,0,0,1,0|1,0,0]=3
23  B15R2.562  CN1CCCN=C1C=CC2=CC=CS2 MCULE-5728234189 [1,0,0,0,1,0|1,0,0]=3
24  B15R2.562  CN1CCCN=C1C=CC2=CC=CS2 MCULE-9766138074 [1,0,0,0,1,0|1,0,0]=3
25  B15R2.31  OC1=CC(=CC=C1)NC2=NCCCS2 MCULE-9227881638 [1,0,0,0,1,0|2,0,0]=4
26  B15R2.1117  ClC1=CC(=CC=C1)C=CC2=NCCS2 MCULE-5297231471 [1,0,0,0,1,0|2,0,0]=4