0  B11R2.1  CC1=NNC2=CC=CC=C21 4088223 [0,0,0,0,0,0|2,0,0]=2
1  B11R2.1  NC1=NN=C2C=CC=CN12 4087829 [0,0,0,0,0,0|3,0,0]=3
2  B11R2.1  NC1=NOC2=CC=CC=C21 3020311 [0,0,0,0,0,0|1,0,0]=1
3  B11R2.1  NC1COC2=CC=CC=C21 4088614 [0,0,0,0,0,0|2,0,1]=3
4  B12R2.1  N#CC1=CNC2=CC=CC=C12 3020059 [0,1,0,0,0,0|3,0,0]=4
5  B12R2.1  NCC1=NN=C2C=CC=CN21 4090945 [0,1,0,0,0,0|3,0,0]=4
6  B12R2.132  NC1=CC2=C(C=C1)NN=C2O 4088362 [0,1,0,0,0,0|1,0,0]=2
7  B12R2.196  CC1=NN=C2C(N)=CC=CN12 4041114 [0,1,0,0,0,0|3,0,0]=4
8  B12R2.203  CC1=NOC2=C1C(Cl)=NC=N2 4043747 [0,1,0,0,0,0|3,0,0]=4
9  B10R1.15  O[C@@H](CBr)C1=CC=CC=C1 4053875 [0,0,1,0,0,0|2,0,1]=4
10  B10R1.15  O[C@H](CBr)C1=CC=CC=C1 4068902 [0,0,1,0,0,0|2,0,1]=4
11  B10R1.61  CC(N)C1=C(O)C=CC=C1 4088363 [0,0,1,0,0,0|1,0,2]=4
12  B12R2.24  NC1COC2=CC=CC=C2C1 4089584 [0,0,0,0,0,1|2,0,1]=4
13  B12R2.24  N[C@@H]1COC2=C(C=CC=C2)C1 4093276 [0,0,0,0,0,1|2,0,1]=4
14  B12R2.24  N[C@H]1COC2=CC=CC=C2C1 4092002 [0,0,0,0,0,1|2,0,1]=4
15  B11R1.17  C=CCOC1=CC=CC=C1N 4090105 [0,1,1,0,0,0|2,0,0]=4
16  B11R1.53  NCC1=CC=CC=C1C(=O)O 4090789 [0,1,1,0,0,0|1,0,1]=4
17  B11R2.36  BrC1=CC2=C(C=C1)OC=N2 4002139 [1,1,0,0,0,0|2,0,0]=4
18  B11R2.36  ClC1=CC2=C(C=C1)NC=C2 3020104 [1,1,0,0,0,0|2,0,0]=4
19  B11R2.36  ClC1=CC2=C(C=CN2)C=C1 3020088 [1,1,0,0,0,0|2,0,0]=4
20  B11R2.106  BrC1=C2C=COC2=CC=C1 4018336 [1,1,0,0,0,0|1,0,0]=3
21  B11R2.106  CC1=C2N=NNC2=CC=C1 3002703 [1,1,0,0,0,0|2,0,0]=4
22  B11R2.106  ClC1=CC=CC2=C1C=CN2 3020086 [1,1,0,0,0,0|2,0,0]=4
23  B11R2.106  ClC1=CC=CC2=C1NN=N2 4035307 [1,1,0,0,0,0|2,0,0]=4
24  B11R2.106  OC1=C2ON=CC2=CC=C1 4041159 [1,1,0,0,0,0|0,0,0]=2
25  B13R2.155  NC1=CC2=C(C=C1)OCC(=O)N2 4027629 [0,1,0,0,0,1|1,0,1]=4
26  B13R2.72  O=C(O)C1=CSC2=C1C=CC=C2 3001896 [0,2,0,0,0,0|1,1,0]=4
27  B13R2.662  NCC1=NNC2=CC(Br)=CC=C21 4060730 [0,2,0,0,0,0|2,0,0]=4
28  B13R2.2136  CC1=CC=C2NN=C(CN)C2=C1 4091064 [0,2,0,0,0,0|2,0,0]=4
29  B9R1.11  N\C(=N/O)C1=CC=CO1 4088090 [0,0,1,0,1,0|2,0,0]=4