0  B13R0.54  CCCCCCCCCCCC(C)=O T9502 [1,0,0,0,0,0|1,0,2]=4
1  B13R0.336  CCCCCCCCCCCCCC TN6959 [1,0,0,0,0,0|1,0,1]=3
2  B13R0.336  NCCCCCCCCCCCCN T20478 [1,0,0,0,0,0|2,0,1]=4
3  B15R0.81  CCCCCCCCCCCCC(O)CO T20378 [0,1,0,0,0,0|2,0,1]=4
4  B15R0.222  CS(=O)CCCCCCCCCCS(C)=O T31316 [0,1,0,0,0,0|3,0,0]=4
5  B15R0.222  OC(=O)CCCCCCCCCCC(O)=O T22312 [0,1,0,0,0,0|2,0,1]=4
6  B15R0.222  OC(=O)CCCCCCCCCCC(O)=O T5258 [0,1,0,0,0,0|2,0,1]=4
7  B15R0.252  CCCCCCCCCCCC[N+](C)(C)[O-] T20936 [0,1,0,0,0,0|2,0,1]=4
8  B12R0.5  CCCCCCCCC/C=C/C=O TN6927 [2,0,0,0,0,0|0,0,2]=4
9  B12R0.5  CCCCCCCCCCCCO T9514 [2,0,0,0,0,0|0,0,1]=3
10  B12R0.5  CCCCCCCCCCOC=C T31314 [2,0,0,0,0,0|1,0,1]=4
11  B12R0.234  CCCCCCCCCCS(C)=O T29297 [2,0,0,0,0,0|2,0,0]=4
12  B14R0.392  CCCCCCCCCCCCCC#N T20275 [1,1,0,0,0,0|1,0,1]=4
13  B14R0.392  CCCCCCCCCCCCCC=C TN6906 [1,1,0,0,0,0|1,0,0]=3
14  B14R0.392  CCCCCCCCCCCCCCC TN6759 [1,1,0,0,0,0|1,0,1]=4
15  B14R0.392  CCCCCCCCCCCCCCO TN6991 [1,1,0,0,0,0|0,0,2]=4
16  B16R0.3288  CC(C)CCCCCCCCCCCC(O)=O T27807 [0,2,0,0,0,0|0,0,0]=2