0  B7R0.4  CCCCNC(C)C c04045 [0,0,0,0,0,0|2,0,1]=3
1  B6R0.4  CNCCC(N)=O c07376 [1,0,0,0,0,0|2,0,0]=3
2  B6R0.4  NCCCC(=O)O e00886 [1,0,0,0,0,0|2,0,0]=3
3  B8R0.5  CCOC(=O)CC(=O)[O-] c02712 [0,1,0,0,0,0|2,0,1]=4
4  B8R0.6  CCCCCC(=O)NN c00917 [0,1,0,0,0,0|1,0,0]=2
5  B8R0.6  CCOCCC(=O)NN c01871 [0,1,0,0,0,0|2,0,0]=3
6  B8R0.6  COCCNC(=O)CBr c03476 [0,1,0,0,0,0|2,0,0]=3
7  B8R0.7  C=CCNCCC(N)=O e00847 [0,1,0,0,0,0|1,0,2]=4
8  B8R0.7  CCCNCCC(N)=O e00857 [0,1,0,0,0,0|1,0,0]=2
9  B8R0.7  NC(=O)CCNCCO e00858 [0,1,0,0,0,0|2,0,0]=3
10  B8R0.7  O=C(O)CCCCCBr c03080 [0,1,0,0,0,0|1,0,0]=2
11  B8R0.8  CCCCC(N)C(=O)O e00693 [0,1,0,0,0,0|1,0,0]=2
12  B8R0.9  COC(=O)CCC(=O)O a07404 [0,1,0,0,0,0|2,0,1]=4
13  B8R0.28  CC(C)COCC(N)=O c04303 [0,1,0,0,0,0|2,0,0]=3
14  B8R1.35  CC(C)NCC1CC1 c07378 [0,0,0,1,0,0|2,0,1]=4
15  B5R0.1  CCOC(C)=N e00765 [2,0,0,0,0,0|2,0,0]=4
16  B5R0.1  CCOC(N)=O e00601 [2,0,0,0,0,0|2,0,0]=4
17  B5R0.1  O=C(O)CCCl c08426 [2,0,0,0,0,0|2,0,0]=4
18  B7R0.3  CCOCC(=O)NN c03849 [1,1,0,0,0,0|2,0,0]=4
19  B7R0.3  CNCCC(=O)NC c07614 [1,1,0,0,0,0|1,0,0]=3
20  B9R0.1  CCC(C)NCCC(N)=O e00846 [0,2,0,0,0,0|1,0,0]=3
21  B9R0.2  COCCNCCC(N)=O e00856 [0,2,0,0,0,0|1,0,0]=3
22  B9R0.13  CCCOC(CC)C(N)=O c04299 [0,2,0,0,0,0|2,0,0]=4
23  B9R0.56  CC(=O)SCC[N+](C)(C)C e00780 [0,2,0,0,0,0|2,0,0]=4
24  B9R0.56  CC(C)(C)NCCC(N)=O e00841 [0,2,0,0,0,0|2,0,0]=4
25  B7R1.3  O=C1CNCCN1 M06540 [1,0,0,1,0,0|2,0,0]=4
26  B9R1.7  CCCC1=NNC(=O)C1 m09217 [0,1,0,1,0,0|1,0,1]=4