0  B13R1.713  [C-]#[N+]\C(=C/N(C)C)C1=CC=NC=C1 BB56-1682 [0,0,0,0,0,0|4,0,0]=4
1  B12R1.107  CC(=O)CC(=O)C1=CC=CC=C1 BB12-2875 [1,0,0,0,0,0|1,0,2]=4
2  B12R1.107  CC(C)CC(N)C1=CC=CC=C1 BB58-0616 [1,0,0,0,0,0|1,0,2]=4
3  B12R1.107  CC(C)NC(=S)C1=CC=CN=C1 BB20-3355 [1,0,0,0,0,0|2,1,0]=4
4  B14R2.598  CC1=NN(C2=CC=CC=C2)C(=O)C1 BB20-3092 [0,0,0,1,0,0|2,0,1]=4
5  B14R2.598  NC1CC(=O)N(C2=CC=CC=C2)C1 BB57-2294 [0,0,0,1,0,0|2,0,1]=4
6  B11R1.12  O=C\C(=C/O)C1=CC=NC=C1 BB54-1669 [2,0,0,0,0,0|2,0,0]=4
7  B11R1.16  CCOC(=O)C1=CC=NC=C1 BB12-2749 [2,0,0,0,0,0|2,0,0]=4
8  B11R1.91  CC(N)\C=C\C1=CC=CC=C1 BB12-1707 [2,0,0,0,0,0|1,0,0]=3
9  B13R1.132  CC(C)NC(=O)C1=CC=C(N)C=C1 BB55-1690 [1,1,0,0,0,0|1,0,0]=3
10  B13R1.132  CC(C)OC(=O)C1=CC=C(N)C=C1 BB05-1927 [1,1,0,0,0,0|1,0,0]=3
11  B13R1.147  CC(C)NC(=O)C1=CC=CC(N)=C1 BB57-1186 [1,1,0,0,0,0|1,0,0]=3
12  B13R1.201  CC(C)NC(=O)C1=CC=CC=C1N BB54-2440 [1,1,0,0,0,0|1,0,0]=3
13  B13R2.2931  CN1C=C(C=O)C2=CC=CN=C21 BB57-0388 [1,0,0,1,0,0|2,0,0]=4
14  B13R2.72  CC(N)C1=CNC2=CC=CC=C21 BB53-1665 [0,0,0,1,1,0|2,0,0]=4
15  B15R2.16  CN1C=C(C=O)C(C2=CC=CC=C2)=N1 BB05-4608 [0,0,0,1,0,1|2,0,0]=4
16  B15R2.629  CN(C)\C=C1\CC2=C(C=CC=C2)C1=O BB12-4454 [0,0,0,1,0,1|1,0,0]=3
17  B15R2.315  CC1(C)N=C(C2=CC=CC=C2)C(=O)N1 BB10-0863 [0,1,0,1,0,0|1,0,0]=3
18  B15R2.1255  CC(Br)C(=O)C1=CNC2=CC=CC=C21 BB55-8094 [0,1,0,1,0,0|2,0,0]=4
19  B15R2.21211  CN1C(=O)C=C(C=O)C2=C1C=CC=C2 BB54-1305 [0,1,0,1,0,0|1,0,1]=4
20  B15R2.988  CC1=NC2=C(C=CC=C2)C(C(=O)O)=C1 BB54-0437 [0,1,0,1,0,0|1,0,1]=4
21  B15R2.988  CC1=NC2=CC=CC=C2C(C(N)=O)=C1 BB12-3717 [0,1,0,1,0,0|1,0,1]=4
22  B11R1.36  CC(C)C(N)C1=CC=CC=C1 BB58-0614 [1,0,0,0,1,0|1,0,1]=4
23  B13R1.45  CN(C)\C=C\C(=O)C1=CC=CC=C1 BB12-4188 [1,0,0,0,0,1|1,0,0]=3