0  B16R0.303  CCCCCCCC[SnH4+2]CCCCCCCC A11784 [0,0,0,0,0,0|2,0,0]=2
1  B15R0.70  CCCCCCCCCCCCCC[13CH2]Br D97991 [1,0,0,0,0,0|1,0,0]=2
2  B15R0.70  CCCCNCCCCCCNCCCC P19987 [1,0,0,0,0,0|2,0,0]=3
3  B15R0.70  CNCCCCCCCCCCCCNC A10216 [1,0,0,0,0,0|2,0,0]=3
4  B17R0.43  CCCCCCCCCCCCCC[13CH2]C(=O)O D98230 [0,1,0,0,0,0|0,0,1]=2
5  B17R0.43  CCCCCCCCCCCCCC[13CH2][13C](=O)O D98229 [0,1,0,0,0,0|0,0,1]=2
6  B17R0.104  CCCCCCCCC(N)CCCCCCCC T72292 [0,1,0,0,0,0|1,0,0]=2
7  B17R0.195  CCCCCCCCCCCCCC[C@H](C)CBr T71345 [0,1,0,0,0,0|1,0,0]=2
8  B17R0.250  CCCCCCCCCCCCNC(=O)CCC W15993 [0,1,0,0,0,0|2,0,1]=4
9  B17R1.29093  CCCCCCCCCCCCOC[C@H]1CO1 T72150 [0,0,0,1,0,0|1,0,0]=2
10  B18R0.2  [2H][C@@H](CCCC)CCCCCCCCCCC(=O)O D98616 [0,2,0,0,0,0|0,0,1]=3
11  B18R0.176  C=CCCCCCCCCCCCCCCC(=O)O A10392 [0,2,0,0,0,0|0,0,2]=4
12  B18R0.182  CCCCCCCCCCCCCCCS(=O)(=O)[O-] T72668 [0,2,0,0,0,0|1,0,1]=4
13  B18R0.20608  CCCCCCCC[Si](Cl)(Cl)CCCCCCCC T70468 [0,2,0,0,0,0|1,1,0]=4
14  B18R0.221  C=CCCCCCCCCCCCCCCCCBr T70422 [0,2,0,0,0,0|1,0,0]=3
15  B18R0.221  CCCCCCCCCCCCOCCOCCO T70739 [0,2,0,0,0,0|0,0,0]=2
16  B18R0.221  CCCCCCCCCNCCCCCCCCC T70537 [0,2,0,0,0,0|1,0,0]=3
17  B18R0.221  CCCCCCCC\C=C\CCCCCCCCO T72539 [0,2,0,0,0,0|0,0,0]=2
18  B16R1.310  CCS[C@H]1CCCCCCCCCC[C@@H]1O C11010 [1,0,0,1,0,0|1,0,0]=3
19  B18R1.1261  CCCCCCCCCCCCC1CCCCC1 D89818 [0,1,0,1,0,0|1,0,0]=3
20  B18R1.1261  CCCCCCCCCCCCN1CCOCC1 S11857 [0,1,0,1,0,0|2,0,0]=4