0  B7R0.4  NCCCCC(=O)O HY-W015878R [0,0,0,0,0,0|1,0,0]=1
1  B8R0.5  CCOC(=O)CC(=O)O HY-Y1031R [0,1,0,0,0,0|1,0,1]=3
2  B8R0.5  CCOC(=O)CC(C)=O HY-Y1093R [0,1,0,0,0,0|2,0,1]=4
3  B8R0.5  CCOC(=O)C[13C](C)=O HY-Y1093S3 [0,1,0,0,0,0|2,0,1]=4
4  B8R0.7  N#CCCNCC(=O)O HY-W141891 [0,1,0,0,0,0|1,0,1]=3
5  B8R0.8  CSCCC(N)C(=O)O HY-N0325R [0,1,0,0,0,0|1,0,0]=2
6  B8R0.8  CSCC[C@@H](N)C(=O)O HY-13694R [0,1,0,0,0,0|1,0,0]=2
7  B8R0.9  C=CC(N)CCC(=O)O HY-15399R [0,1,0,0,0,0|0,0,2]=3
8  B8R0.9  COC(=O)CCC(C)=O HY-N3272R [0,1,0,0,0,0|2,0,1]=4
9  B8R0.28  CC(=O)CCC=C(C)C HY-W010435R [0,1,0,0,0,0|1,0,2]=4
10  B8R0.28  NC(=O)NCCC(=O)O HY-113285R [0,1,0,0,0,0|2,0,1]=4
11  B8R1.7  O=C(O)C1CSCN1 HY-B1169R [0,0,0,1,0,0|2,0,0]=3
12  B8R1.22  O=C1CCCCCO1 HY-W392100C [0,0,0,1,0,0|0,0,0]=1
13  B7R0.3  C\C=C\CC(=O)OC HY-W127411 [1,1,0,0,0,0|0,0,2]=4
14  B7R0.5  CCCC(=O)C(=O)O HY-113098R [1,1,0,0,0,0|0,0,1]=3
15  B7R0.5  NCC[C@H](N)C(=O)O HY-101414R [1,1,0,0,0,0|1,0,0]=3
16  B7R0.6  O=C(O)[13CH2][13CH2]C(=O)O HY-N0420S4 [1,1,0,0,0,0|1,0,1]=4
17  B9R0.4  COCCN(C)CC(=O)O HY-W033132 [0,2,0,0,0,0|1,0,0]=3
18  B9R0.53  CC(CC(=O)O)CC(=O)O HY-113410R [0,2,0,0,0,0|1,0,1]=4
19  B9R0.1  O=C(O)CCNC(=O)CBr HY-141379 [0,2,0,0,0,0|1,0,1]=4
20  B9R0.46  COC(=O)CCOCCO HY-141239 [0,2,0,0,0,0|1,0,0]=3
21  B9R0.47  C=CCSC[C@H](N)C(=O)O HY-W013573R [0,2,0,0,0,0|0,0,2]=4
22  B9R0.7  CC(CCC(=O)O)C(=O)O HY-W017524R [0,2,0,0,0,0|1,0,1]=4
23  B7R1.1  OC[C@@H]1CCCN1 HY-Y1126R [1,0,0,1,0,0|1,0,1]=4
24  B9R1.41  N[C@H]1CCC[C@H]1C(=O)O HY-W089091 [0,1,0,1,0,0|0,0,0]=2
25  B9R1.66  CC1(O)CCOC(=O)C1 HY-107855R [0,1,0,1,0,0|2,0,0]=4
26  B9R1.35  O=C1CC[C@H](C(=O)O)N1 HY-W002304R [0,1,0,1,0,0|1,0,1]=4