0  B9R1.35  O=C1CC[C@H](C(=O)O)N1 HY-W002304R [0,0,0,0,0,0|0,0,0]=0
1  B8R1.7  O=C(O)C1=CC=CN1 HY-W001963R [1,0,0,0,0,0|0,0,3]=4
2  B8R1.7  O=C(O)C1CSCN1 HY-B1169R [1,0,0,0,0,0|1,0,1]=3
3  B10R1.14  COC(=O)[C@@H]1CC[C@H](O)C1 HY-W394612 [0,1,0,0,0,0|1,0,2]=4
4  B8R0.8  CSCCC(N)C(=O)O HY-N0325R [0,0,1,0,0,0|2,0,0]=3
5  B8R0.8  CSCC[C@@H](N)C(=O)O HY-13694R [0,0,1,0,0,0|2,0,0]=3
6  B8R0.9  COC(=O)CCC(C)=O HY-N3272R [0,0,1,0,0,0|3,0,0]=4
7  B8R0.23  NC(CC(=O)O)C(=O)O HY-W015824R [0,0,1,0,0,0|3,0,0]=4
8  B8R0.23  N[13C](=O)[13CH2][13C@H](N)[13C](=O)O HY-N0667S3 [0,0,1,0,0,0|3,0,0]=4
9  B8R0.23  N[C@@H]([13CH2]C(=O)O)C(=O)O HY-N0666S10 [0,0,1,0,0,0|3,0,0]=4
10  B8R0.23  N[C@H](CC(=O)O)C(=O)O HY-42068R [0,0,1,0,0,0|3,0,0]=4
11  B8R0.28  NC(=O)NCCC(=O)O HY-113285R [0,0,1,0,0,0|1,0,0]=2
12  B8R1.23  O=C1C[C@H](C(=O)O)N1 HY-W061629 [0,0,0,0,1,0|0,0,0]=1
13  B7R0.4  NCCCCC(=O)O HY-W015878R [1,0,1,0,0,0|0,0,1]=3
14  B7R0.5  NCC[C@H](N)C(=O)O HY-101414R [1,0,1,0,0,0|1,0,0]=3
15  B7R0.6  O=C(O)[13CH2][13CH2]C(=O)O HY-N0420S4 [1,0,1,0,0,0|2,0,0]=4
16  B7R0.15  CCC(CC)C(=O)O HY-W004154R [1,0,1,0,0,0|1,0,1]=4
17  B7R1.1  OC[C@@H]1CCCN1 HY-Y1126R [2,0,0,0,0,0|0,0,2]=4
18  B9R0.7  CC(CCC(=O)O)C(=O)O HY-W017524R [0,1,1,0,0,0|1,0,0]=3
19  B9R0.47  C=CCSC[C@H](N)C(=O)O HY-W013573R [0,1,1,0,0,0|1,0,0]=3
20  B9R0.39  CC(=O)N[C@H](CS)C(=O)O HY-136386R [0,1,1,0,0,0|1,0,0]=3
21  B9R0.1  O=C(O)CCNC(=O)CBr HY-141379 [0,1,1,0,0,0|2,0,0]=4
22  B9R0.53  CC(CC(=O)O)CC(=O)O HY-113410R [0,1,1,0,0,0|1,0,0]=3
23  B9R1.41  N[C@H]1CCC[C@H]1C(=O)O HY-W089091 [1,1,0,0,0,0|1,0,1]=4
24  B11R1.39  COC(=O)C[C@H]1CCC(=O)C1 HY-W094155 [0,1,0,0,0,1|1,0,0]=3
25  B7R0.16  [13CH3][13CH]([13C](=O)O)[13C](=O)O HY-103395S1 [0,0,1,0,1,0|1,0,0]=3