0  B15R0.164  CCCCCCCCCCCCCC(=O)[O-] AMY14200 [0,0,0,0,0,0|0,0,3]=3
1  B15R0.164  CCCCCCCCCCC\C=C\C(=O)O AMY37908 [0,0,0,0,0,0|0,0,4]=4
2  B14R0.392  CCCCCCCCCCCCCC=O AMY6110 [1,0,0,0,0,0|0,0,2]=3
3  B14R0.394  CCCCCCCCCCCCC(=O)O AMY5937 [1,0,0,0,0,0|0,0,1]=2
4  B14R0.394  CCCCCCCCCCCC[S@](C)=O AMY202100068 [1,0,0,0,0,0|2,0,1]=4
5  B14R0.394  CCCCCCCCCCCOC(C)=O AMY037 [1,0,0,0,0,0|2,0,1]=4
6  B14R0.394  CCCCCCCCCCNCC(=O)O AMY7682 [1,0,0,0,0,0|1,0,1]=3
7  B14R0.394  O=C(O)CCCCCCCCCCCBr AMY25771 [1,0,0,0,0,0|1,0,1]=3
8  B16R0.274  CCCCCCCCCCCCCCC(=O)O AMY5935 [0,1,0,0,0,0|0,0,2]=3
9  B16R0.274  O=C(O)CCCCCCCCCCCCCBr AMY37959 [0,1,0,0,0,0|0,0,2]=3
10  B16R0.274  O=C(O)CCCCCCCCCCCCCO AMY37956 [0,1,0,0,0,0|0,0,2]=3
11  B16R0.274  O=C(O)CCCCCCCCCCCCCS AMY37960 [0,1,0,0,0,0|0,0,2]=3
12  B16R0.302  CCCCCCCCCCC[C@@H](O)CC(=O)O AMY25629 [0,1,0,0,0,0|0,0,2]=3
13  B16R0.3183  CCCCCCCCCCC(=O)NCC(=O)O AMY42002 [0,1,0,0,0,0|1,0,1]=3
14  B13R0.336  CCCCCCCCCCCCCO AMY5938 [2,0,0,0,0,0|0,0,2]=4
15  B13R0.54  CCCCCCCCCCOC(=O)Cl AMY4023 [2,0,0,0,0,0|2,0,0]=4
16  B13R0.54  CCCCCCCCC\C=C\C(=O)O AMY37907 [2,0,0,0,0,0|0,0,0]=2
17  B13R0.54  NCCCCCCCCCCC(=O)O AM82457 [2,0,0,0,0,0|1,0,0]=3
18  B13R0.54  O=C(O)CCCCCCCCCCBr AM84878 [2,0,0,0,0,0|1,0,0]=3
19  B15R0.70  CCCCCCCCCCCCCCC=O AM20120587 [1,1,0,0,0,0|0,0,2]=4
20  B17R0.43  C#CCCCCCCCCCCCCCC(=O)O AM806680 [0,2,0,0,0,0|0,0,2]=4
21  B17R0.43  CCCCCCCCCCCCC\C=C\C(=O)O AMY6908 [0,2,0,0,0,0|0,0,2]=4
22  B17R0.43  O=C(O)CCCCCCCCCCCCCCBr AMY10920 [0,2,0,0,0,0|0,0,2]=4
23  B17R0.192  CCCCCCCCCCCC(=O)NCC(=O)O AMY38450 [0,2,0,0,0,0|1,0,1]=4