0  B9R0.56  NC(OCC[N+](C)(C)C)=O C0306 [0,1,0,0,0,0|2,0,0]=3
1  B9R1.66  C[C@@]1(O)CCOC(=O)C1 M0662 [0,0,0,1,0,0|1,0,0]=2
2  B6R0.4  OC(CCCN)=O G0043 [2,0,0,0,0,0|2,0,0]=4
3  B6R0.6  CCCC/C=C/I I0047 [2,0,0,0,0,0|2,0,0]=4
4  B8R1.19  CC1(C)CCCC1=O D0333 [1,0,0,1,0,0|1,0,0]=3
5  B6R0.2  CC(O)CC([O-])=O H0080 [0,0,0,0,2,0|2,0,0]=4