0  B8R0.28  CC(C)COCC(N)=O c04303 [0,0,0,0,0,0|2,0,0]=2
1  B7R0.4  CCCCNC(C)C c04045 [1,0,0,0,0,0|2,0,1]=4
2  B9R0.1  CCC(C)NCCC(N)=O e00846 [0,1,0,0,0,0|2,0,0]=3
3  B9R0.7  NC(CCC(=O)O)C(=O)O c07909 [0,1,0,0,0,0|2,0,1]=4
4  B9R0.56  CC(=O)SCC[N+](C)(C)C e00780 [0,1,0,0,0,0|3,0,0]=4
5  B9R0.56  CC(C)(C)NCCC(N)=O e00841 [0,1,0,0,0,0|2,0,0]=3
6  B6R0.4  CNCCC(N)=O c07376 [2,0,0,0,0,0|2,0,0]=4
7  B6R0.4  NCCCC(=O)O e00886 [2,0,0,0,0,0|1,0,0]=3
8  B8R0.6  CCCCCC(=O)NN c00917 [1,1,0,0,0,0|1,0,0]=3
9  B8R0.6  CCOCCC(=O)NN c01871 [1,1,0,0,0,0|2,0,0]=4
10  B8R0.7  CCCNCCC(N)=O e00857 [1,1,0,0,0,0|1,0,0]=3
11  B8R0.7  NC(=O)CCNCCO e00858 [1,1,0,0,0,0|2,0,0]=4
12  B8R0.7  O=C(O)CCCCCBr c03080 [1,1,0,0,0,0|0,0,0]=2
13  B8R0.8  CCCCC(N)C(=O)O e00693 [1,1,0,0,0,0|0,0,0]=2
14  B8R0.9  COC(=O)CCC(=O)O a07404 [1,1,0,0,0,0|1,0,1]=4
15  B8R0.23  CC(C)OC(C)C(=O)[O-] c02096 [0,1,0,0,1,0|1,0,1]=4
16  B8R0.29  CC(C)(C)\C=C\C(=O)O c06015 [0,1,0,0,1,0|0,0,2]=4
17  B10R0.60  COC(=O)CCNC(C)(C)C e01113 [0,2,0,0,0,0|1,0,0]=3
18  B10R1.113  CC1CCCC(C(=O)O)N1 c07875 [0,0,0,1,0,1|1,0,0]=3