0  B15R0.149  CCCCCCCOC(=O)CCCCCC S10717 [0,0,0,0,0,0|0,0,0]=0
1  B14R0.145  CCCCCCC[C@@H](O)CCCCCC T72428 [1,0,0,0,0,0|0,0,2]=3
2  B13R0.165  C=C(CCCCCC)CCCCCC AC9111 [2,0,0,0,0,0|1,0,0]=3
3  B13R0.165  CCCCCCC(N)CCCCCC T72111 [2,0,0,0,0,0|1,0,1]=4
4  B13R0.336  CCCCCCC#CCCCCCC T72347 [2,0,0,0,0,0|0,0,2]=4
5  B15R0.133  CCCCCCCC(N)CCCCCCC T71990 [1,1,0,0,0,0|1,0,1]=4
6  B15R0.70  CCCCCCCCCCCCCC[13CH2]Br D97991 [1,1,0,0,0,0|1,0,1]=4