0  B15R2.22289  CCC1=CC2=C(C=CC2=C(C=C1)C)C MCULE-7913940687 [0,0,0,0,0,0|0,0,0]=0
1  B16R2.81676  CC1=C2C=CC(=C2C=C(C=C1)C(C)C)C MCULE-9349286347 [0,1,0,0,0,0|0,0,0]=1
2  B14R2.19613  COC1=NC(=C2NC=C(C2=C1)C)C MCULE-5482756943 [0,0,0,0,1,0|3,0,0]=4
3  B15R2.89223  CCC1=C2N=C(C=CC2=C(C=C1)C)C MCULE-9630544194 [0,0,1,1,0,0|1,0,0]=3
4  B15R2.89223  COC1=C2N=C(C=CC2=C(C=C1)C)C MCULE-3590599062 [0,0,1,1,0,0|2,0,0]=4
5  B13R2.611  CC1=C2NC=CC2=C(C=C1)CO MCULE-6415219768 [1,0,0,0,1,0|2,0,0]=4
6  B13R2.611  CC[N+]1=CC=C(C2=C1OC=C2)C MCULE-3857449838 [1,0,0,0,1,0|2,0,0]=4
7  B13R2.611  CC[N+]1=CC=C(C2=C1OC=C2)C MCULE-8823150045 [1,0,0,0,1,0|2,0,0]=4
8  B13R2.611  COC1=C2C=CNC2=C(C=C1)C MCULE-1924196012 [1,0,0,0,1,0|2,0,0]=4
9  B13R2.611  COC1=CC=C(C2=C1NC=C2)C MCULE-9339221495 [1,0,0,0,1,0|2,0,0]=4
10  B13R2.654  CC1=CC(=CC2=C1NC=C2)CN MCULE-9340742471 [1,0,0,0,1,0|2,0,0]=4
11  B13R2.654  COC1=CC2=C(C=CN2)C(=C1)C MCULE-9623587547 [1,0,0,0,1,0|2,0,0]=4
12  B13R2.654  COC1=CC2=C(C=CO2)C(=C1)C MCULE-4122844250 [1,0,0,0,1,0|2,0,0]=4
13  B13R2.654  COC1=CC2=C(NC=C2)C(=C1)C MCULE-3890072705 [1,0,0,0,1,0|2,0,0]=4
14  B13R2.582  CN1C=CC2=C1C(=CC=C2)CN MCULE-8953693932 [1,0,0,0,1,0|2,0,0]=4
15  B13R2.582  CN1C=CC2=C1C(=CC=C2)CO MCULE-1373299145 [1,0,0,0,1,0|2,0,0]=4
16  B13R2.669  CC1=CNC2=C1C=C(C=C2)CN MCULE-5331503314 [1,0,0,0,1,0|2,0,0]=4
17  B13R2.669  CN1C=CC2=C1C=C(C=C2)CN MCULE-7412208848 [1,0,0,0,1,0|2,0,0]=4
18  B13R2.669  CN1C=CC2=CC=C(C=C12)CO MCULE-3718569722 [1,0,0,0,1,0|2,0,0]=4
19  B13R2.669  COC1=CC2=C(C=C1)C=CN2C MCULE-7890172092 [1,0,0,0,1,0|2,0,0]=4
20  B13R2.669  COC1=CC2=C(C=C1)NC=C2C MCULE-2616975882 [1,0,0,0,1,0|2,0,0]=4
21  B13R2.669  COC1=CC2=C(C=C1)SC=C2C MCULE-1818064759 [1,0,0,0,1,0|2,0,0]=4
22  B13R2.669  COC1=CC=C2OC=C(C2=C1)C MCULE-8712927795 [1,0,0,0,1,0|2,0,0]=4
23  B13R2.3742  CC1=CC2=C(C=NN2C)C(=C1)C MCULE-1013970426 [1,0,0,0,1,0|2,0,0]=4
24  B13R2.3742  CC1=CC2=C(NC=C2C)C(=C1)Br MCULE-7108767073 [1,0,0,0,1,0|2,0,0]=4
25  B13R2.3742  CC1=CNC2=C(C=C(C=C12)F)C MCULE-8527401382 [1,0,0,0,1,0|2,0,0]=4
26  B13R2.5151  CC1=C2C=CN(C2=C(C=C1)C)C MCULE-7878322126 [1,0,0,0,1,0|1,0,0]=3
27  B13R2.5151  CC1=CNC2=C(C=CC(=C12)Br)C MCULE-6313088877 [1,0,0,0,1,0|2,0,0]=4
28  B15R2.2743  COC1=CC2=C(N=CC=C2Br)C(=C1)C MCULE-8311072778 [0,0,0,0,1,1|2,0,0]=4