0  B21R1.17805  CCCCCCCC[C@H]1O[C@H]1CCCCCCCC(=O)O HY-129554 [0,0,0,0,0,0|1,0,0]=1
1  B20R0.68  CCCCCCCCC(O)CCCCCCCCC(=O)O HY-W128156 [0,0,1,0,0,0|1,0,0]=2
2  B20R0.31940  CCCCCCCCCCCCCCCCCCC(=O)O HY-W004261 [0,0,1,0,0,0|0,0,0]=1
3  B20R0.31940  CCCCCCCC\C=C/CCCCCCCCC(=O)O HY-113450 [0,0,1,0,0,0|0,0,2]=3
4  B20R0.31940  CCCCCCCC\C=C\CCCCCCCCC(=O)O HY-W718357 [0,0,1,0,0,0|0,0,2]=3
5  B20R0.31940  [N-]=[N+]=NCCCCCCCCCCCCCCCC(=O)O HY-147309 [0,0,1,0,0,0|3,0,0]=4
6  B19R0.149  CCCCCCCCC#CCCCCCCCC(=O)O HY-W341997 [1,0,1,0,0,0|0,0,2]=4
7  B19R0.149  CCCCCCCCCCCCCCCCCC(=O)O HY-B2219 [1,0,1,0,0,0|0,0,0]=2
8  B19R0.149  CCCCCCCCCCCCCCCCCC(=O)O HY-B2219R [1,0,1,0,0,0|0,0,0]=2
9  B19R0.149  CCCCCCCCCCCCCCCCCC(=O)O HY-W133900 [1,0,1,0,0,0|0,0,0]=2
10  B19R0.149  CCCCCCCCCCCCCCCCCC(=O)[O-] HY-W099569 [1,0,1,0,0,0|0,0,1]=3
11  B19R0.149  CCCCCCCCCCCCCCCCCC(=O)[O-] HY-Y1054 [1,0,1,0,0,0|0,0,1]=3
12  B19R0.149  CCCCCCCCCCCCCCCCCC(N)=O HY-W130610 [1,0,1,0,0,0|1,0,0]=3
13  B19R0.149  CCCCCCCCCCCCCCCCCC(N)=O HY-W130610R [1,0,1,0,0,0|1,0,0]=3
14  B19R0.149  CCCCCCCCCCC\C=C/CCCCC(=O)O HY-113362 [1,0,1,0,0,0|0,0,2]=4
15  B19R0.149  CCCCCCCCCCC\C=C\CCCCC(=O)O HY-W342979 [1,0,1,0,0,0|0,0,2]=4
16  B19R0.149  CCCCCCCC\C=C/CCCCCCCC(=O)O HY-W763560 [1,0,1,0,0,0|0,0,2]=4
17  B19R0.149  CCCCCCCC\C=C/CCCCCCC[13C](=O)O HY-N1446S [1,0,1,0,0,0|0,0,2]=4
18  B19R0.149  CCCCCCCC\C=C\CCCCCCCC(=O)O HY-113016 [1,0,1,0,0,0|0,0,2]=4
19  B19R0.149  CCCCCC\C=C/CCCCCCCCCC(=O)O HY-113427A [1,0,1,0,0,0|0,0,2]=4
20  B19R0.149  O=C(O)CCCCCCCCCCCCCCCCO HY-124282 [1,0,1,0,0,0|1,0,0]=3
21  B19R0.36  CCCCCCCCCCCCCCCCCCCC HY-W094847 [1,0,1,0,0,0|1,0,1]=4
22  B19R0.36  CCCCCCCCCCCCCCCCOCCO HY-W250466 [1,0,1,0,0,0|1,0,1]=4
23  B21R0.9111  CCCCCCCCC(O)C(O)CCCCCCCC(=O)O HY-N8522 [0,1,1,0,0,0|1,0,0]=3
24  B21R0.9111  CCCCCCCC[C@@H](O)[C@H](O)CCCCCCCC(=O)O HY-W700437 [0,1,1,0,0,0|1,0,0]=3
25  B21R0.81  CCCCCCCCCCCCCCCCCCCC(=O)O HY-W004260 [0,1,1,0,0,0|0,0,0]=2
26  B21R0.81  CCCCCCCCCCCCCCCCCCCC(=O)O HY-W004260R [0,1,1,0,0,0|0,0,0]=2
27  B21R0.81  CCCCCCCC\C=C/CCCCCCCCCC(=O)O HY-W013242 [0,1,1,0,0,0|0,0,1]=3
28  B21R0.81  CCCCCCCC\C=C\CCCCCCCCCC(=O)O HY-109589A [0,1,1,0,0,0|0,0,1]=3
29  B21R0.9014  O=C(O)CCCCCCCCCCCCCCCCC(=O)O HY-W005178 [0,1,1,0,0,0|1,0,1]=4
30  B21R0.36766  CCCCCCCCCCCCCCCCCCC(=O)OC HY-W004262 [0,1,1,0,0,0|0,0,0]=2
31  B21R0.36773  CCCCCCCCCCCCCCCC(=O)NCC(=O)O HY-W074890 [0,1,1,0,0,0|1,0,1]=4
32  B23R2.9057477  CCCCCC1CC1CC2CC2CCCCCCCC(=O)O HY-108599 [0,1,0,1,0,0|0,0,0]=2