0  B6R0.6  CCCSCCN BB53-1582 [0,0,0,0,0,0|3,0,1]=4
1  B6R0.6  CCSCCNC BB12-0971 [0,0,0,0,0,0|3,0,1]=4
2  B6R0.6  COCCN=C=S BB53-1315 [0,0,0,0,0,0|1,0,0]=1
3  B6R0.6  [C-]#[N+]CCCOC BB56-1464 [0,0,0,0,0,0|4,0,0]=4
4  B5R0.2  CCSCCN BB53-1545 [1,0,0,0,0,0|2,0,1]=4
5  B5R0.2  CSCCC#N BB12-3714 [1,0,0,0,0,0|2,0,1]=4
6  B5R0.2  [C-]#[N+]CCCC BB56-0718 [1,0,0,0,0,0|0,0,2]=3
7  B5R0.2  [C-]#[N+]CCOC BB56-1837 [1,0,0,0,0,0|1,0,2]=4
8  B7R0.1  CCCCOCCN BB53-1642 [0,1,0,0,0,0|2,0,1]=4
9  B7R0.1  [C-]#[N+]CCCCCC BB56-1203 [0,1,0,0,0,0|2,0,1]=4
10  B7R0.3  CCCCC(=O)NN BB12-2550 [0,1,0,0,0,0|3,0,0]=4
11  B7R0.3  CCCCC(N)CO BB56-2048 [0,1,0,0,0,0|1,1,1]=4
12  B7R0.4  CC(C)CCCCO BB12-2305 [0,1,0,0,0,0|1,1,1]=4
13  B7R1.1  CNC1CCCC1 BB53-1678 [0,0,0,1,0,0|3,0,0]=4
14  B7R1.6  CNCC1CCC1 BB12-1623 [0,0,0,1,0,0|3,0,0]=4
15  B4R0.2  CSCCCl BB53-1396 [2,0,0,0,0,0|2,0,0]=4
16  B4R0.2  CSCCN BB12-0970 [2,0,0,0,0,0|1,0,1]=4
17  B6R0.1  CCC\C(N)=N\O BB10-0037 [1,1,0,0,0,0|0,1,1]=4
18  B6R0.1  CC[C@H](N)COC BB20-3253 [1,1,0,0,0,0|1,0,1]=4
19  B6R0.4  CC(C)CN=C=O BB01-8145 [1,1,0,0,0,0|0,1,0]=3
20  B6R1.3  S=C=NC1CC1 BB53-1314 [1,0,0,1,0,0|0,0,0]=2
21  B6R1.6  NCC1CCC1 BB12-1679 [1,0,0,1,0,0|1,0,1]=4
22  B8R1.8  S=C=NC1CCCC1 BB53-1313 [0,1,0,1,0,0|0,0,0]=2