0  B6R0.6  CCCSCCN BB53-1582 [0,0,0,0,0,0|2,0,0]=2
1  B5R0.2  CCSCCN BB53-1545 [1,0,0,0,0,0|1,0,0]=2
2  B5R0.2  [C-]#[N+]CCCC BB56-0718 [1,0,0,0,0,0|3,0,0]=4
3  B7R0.1  CCCCOCCN BB53-1642 [0,1,0,0,0,0|2,0,0]=3
4  B7R0.1  [C-]#[N+]CCCCCC BB56-1203 [0,1,0,0,0,0|2,0,1]=4
5  B7R0.3  CCC(=O)NCCN BB12-2323 [0,1,0,0,0,0|1,0,1]=3
6  B7R0.3  CCCCC(N)CO BB56-2048 [0,1,0,0,0,0|3,0,0]=4
7  B7R0.3  CCN(C)CCCN BB12-1555 [0,1,0,0,0,0|3,0,0]=4
8  B7R0.4  CC(C)CCCCO BB12-2305 [0,1,0,0,0,0|3,0,0]=4
9  B7R0.4  NC(=O)CSCCO BB53-1357 [0,1,0,0,0,0|2,0,1]=4
10  B7R1.1  ClCC1=NCCN1 BB12-2991 [0,0,0,1,0,0|1,0,2]=4
11  B7R1.3  NC1CCCOC1 BB12-2177 [0,0,0,1,0,0|2,0,0]=3
12  B7R1.24  C1CNCCNC1 BB12-2760 [0,0,0,1,0,0|1,0,0]=2
13  B4R0.2  CSCCCl BB53-1396 [2,0,0,0,0,0|2,0,0]=4
14  B4R0.2  CSCCN BB12-0970 [2,0,0,0,0,0|1,0,0]=3
15  B6R0.1  CC(CN)CCN BB12-1906 [1,1,0,0,0,0|0,0,0]=2
16  B6R0.1  CCNC(=S)NN BB12-3098 [1,1,0,0,0,0|1,0,1]=4
17  B6R0.1  CCNC(C)CO BB12-1659 [1,1,0,0,0,0|1,0,0]=3
18  B6R0.1  CNC(=O)CCN BB12-1715 [1,1,0,0,0,0|2,0,0]=4
19  B6R0.1  COC(=O)CCN BB12-2761 [1,1,0,0,0,0|2,0,0]=4
20  B6R0.4  C=CCNC(C)C BB12-1319 [1,1,0,0,0,0|1,0,1]=4
21  B6R0.4  CC(C)SCCCl BB53-1373 [1,1,0,0,0,0|2,0,0]=4
22  B6R0.4  CC(C)SCCN BB53-1544 [1,1,0,0,0,0|1,0,0]=3
23  B6R0.4  CC(C)SCCO BB53-1392 [1,1,0,0,0,0|2,0,0]=4
24  B6R0.4  CCNCC(C)O BB12-1676 [1,1,0,0,0,0|1,0,0]=3
25  B6R1.2  OC1CNOC1 BB12-1709 [1,0,0,1,0,0|2,0,0]=4
26  B6R1.2  O[C@@H]1CCNC1 BB12-3487 [1,0,0,1,0,0|1,0,0]=3
27  B6R1.6  NCC1CCC1 BB12-1679 [1,0,0,1,0,0|1,0,0]=3
28  B8R1.2  CNC1CCCCC1 BB53-1677 [0,1,0,1,0,0|2,0,0]=4
29  B8R1.2  COC1CCCNC1 BB12-3161 [0,1,0,1,0,0|2,0,0]=4
30  B8R1.2  NCC1COCCO1 BB01-4608 [0,1,0,1,0,0|2,0,0]=4
31  B8R1.2  OCC1CCCCN1 BB56-1322 [0,1,0,1,0,0|2,0,0]=4
32  B8R1.8  CCCC1CCCN1 BB56-1742 [0,1,0,1,0,0|2,0,0]=4
33  B8R1.8  CNCC1CCCC1 BB12-1620 [0,1,0,1,0,0|2,0,0]=4
34  B8R1.8  COCC1CCCN1 BB56-0037 [0,1,0,1,0,0|2,0,0]=4
35  B8R1.8  CSCC1CCCN1 BB56-0633 [0,1,0,1,0,0|2,0,0]=4
36  B8R1.8  NCCC1CCCC1 BB12-2130 [0,1,0,1,0,0|2,0,0]=4
37  B8R1.8  NCCC1CCCN1 BB20-3166 [0,1,0,1,0,0|1,0,0]=3
38  B8R1.11  CN1CCCC1CBr BB12-3093 [0,1,0,1,0,0|2,0,0]=4
39  B8R1.11  CN1CCCC1CO BB12-1660 [0,1,0,1,0,0|2,0,0]=4
40  B8R1.22  CC1CCCCCN1 BB12-3099 [0,1,0,1,0,0|2,0,0]=4
41  B8R1.22  CC1CCCNCC1 BB12-1445 [0,1,0,1,0,0|2,0,0]=4
42  B8R1.22  O=C1CCOCCN1 BB20-4217 [0,1,0,1,0,0|2,0,0]=4
43  B8R1.4  CC1CNCC(C)N1 BB20-4583 [0,1,0,1,0,0|1,0,0]=3
44  B8R1.7  CC(C)C1CCCN1 BB56-0522 [0,1,0,1,0,0|2,0,0]=4
45  B8R1.7  NC(=O)[C@@H]1CCCN1 BB12-3488 [0,1,0,1,0,0|1,0,1]=4
46  B8R1.72  CC1(C)CCCNC1 BB12-1606 [0,1,0,1,0,0|2,0,0]=4