0  B7R0.16  CC(C)C(O)C(=O)O HY-W008150R [0,0,0,0,0,0|0,0,2]=2
1  B7R0.16  CC(C)[C@H]([15NH2])[13C](=O)O HY-N0717S7 [0,0,0,0,0,0|1,0,1]=2
2  B7R0.16  C[C@@H](O)[C@H](N)C(=O)O HY-N0658AR [0,0,0,0,0,0|2,0,1]=3
3  B6R0.2  C[C@@H](O)CC(=O)O HY-W051723R [1,0,0,0,0,0|1,0,1]=3
4  B6R0.2  O=C(O)C=C(Br)Br HY-133653 [1,0,0,0,0,0|2,0,1]=4
5  B6R0.3  CCC(Br)C(=O)O HY-W015333R [1,0,0,0,0,0|1,0,1]=3
6  B6R0.3  CCC(N)C(=O)O HY-W010590R [1,0,0,0,0,0|1,0,1]=3
7  B6R0.3  COC(=O)C(C)C HY-172377A [1,0,0,0,0,0|2,0,0]=3
8  B6R0.3  C[C@@H](CN)C(=O)O HY-113380R [1,0,0,0,0,0|2,0,1]=4
9  B6R0.3  C\C=C(/C)C(=O)O HY-W012999R [1,0,0,0,0,0|1,0,1]=3
10  B6R0.3  N[13C@@H](CO)C(=O)O HY-N0650S4 [1,0,0,0,0,0|2,0,1]=4
11  B6R0.3  N[C@H](CS)C(=O)O HY-W018555R [1,0,0,0,0,0|2,0,1]=4
12  B8R0.2  CCC(O)C(N)C(=O)O HY-W142133 [0,1,0,0,0,0|2,0,1]=4
13  B8R0.2  CC[C@@H](C)[C@H](N)C(=O)O HY-I1060R [0,1,0,0,0,0|1,0,1]=3
14  B8R0.2  COC(=O)[C@@H](N)C(C)C HY-W037443 [0,1,0,0,0,0|1,0,1]=3
15  B8R0.27  CC(C)(S)C(N)C(=O)O HY-W017457R [0,1,0,0,0,0|1,0,1]=3
16  B8R0.27  CC(C)[C@H](N)P(=O)(O)O HY-W795259 [0,1,0,0,0,0|2,0,1]=4
17  B8R0.23  CC(C)CC(N)C(=O)O HY-B1674R [0,0,0,0,0,1|1,0,1]=3
18  B8R0.23  CC(C)C[C@@H](N)C(=O)O HY-Y0378R [0,0,0,0,0,1|1,0,1]=3
19  B8R0.23  CN(C)C(=N)NC(N)=O HY-W738465 [0,0,0,0,0,1|3,0,0]=4
20  B5R0.3  CCC(=O)O[Na] HY-B1773AR [2,0,0,0,0,0|2,0,0]=4
21  B5R0.3  O=C(CO)CO HY-Y0335R [2,0,0,0,0,0|1,0,1]=4
22  B5R0.5  CC(=O)N(C)C HY-W042416R [2,0,0,0,0,0|1,0,1]=4
23  B5R0.5  C[13C@H](O)C(=O)O HY-Y0479S3 [2,0,0,0,0,0|1,0,0]=3
24  B7R0.2  C[C@@H](O)CC(=O)O[Na] HY-W015851R [1,1,0,0,0,0|1,0,1]=4
25  B7R0.9  CC(=O)CC(C)(C)N HY-N3739 [1,1,0,0,0,0|1,0,1]=4
26  B7R0.5  CCCC(=O)C(=O)O HY-113098R [1,1,0,0,0,0|0,0,0]=2
27  B7R0.5  CCOC(=O)C(C)=O HY-Y1362R [1,1,0,0,0,0|1,0,0]=3
28  B7R0.5  NCC[C@H](N)C(=O)O HY-101414R [1,1,0,0,0,0|1,0,1]=4
29  B7R0.15  CCC(CC)C(=O)O HY-W004154R [1,1,0,0,0,0|1,0,1]=4
30  B9R0.23  COC(=O)C(O)CC(C)C HY-22167R [0,1,0,0,0,1|0,0,2]=4
31  B9R0.28  [2H][C@@](N)(C(=O)O)[C@@H](C)CC HY-N0771S8 [0,2,0,0,0,0|1,0,1]=4
32  B7R1.4  N[C@H]1CONC1=O HY-B1122R [1,0,0,1,0,0|2,0,0]=4
33  B9R1.38  CC1(C)OC(=O)NC1=O HY-B1348R [0,0,0,1,0,1|0,0,0]=2
34  B9R1.69  CC1CNC(=O)NC1=O HY-N6787R [0,0,0,1,0,1|1,0,0]=3