0  B6R0.2  CC(=O)NC(C)=O HY-W130303 [0,0,0,0,0,0|1,0,0]=1
1  B6R0.2  C[C@@H](O)CC(=O)O HY-W051723R [0,0,0,0,0,0|2,0,2]=4
2  B6R0.2  O=C(O)C=C(Br)Br HY-133653 [0,0,0,0,0,0|4,0,0]=4
3  B7R0.9  CC(=O)CC(C)(C)N HY-N3739 [0,1,0,0,0,0|2,0,1]=4
4  B7R0.16  [13CH3][13CH]([13C](=O)O)[13C](=O)O HY-103395S1 [0,1,0,0,0,0|3,0,0]=4
5  B5R0.5  CC(=O)N(C)C HY-W042416R [0,0,0,0,1,0|2,0,0]=3
6  B5R0.5  C[13C@H](O)C(=O)O HY-Y0479S3 [0,0,0,0,1,0|1,0,2]=4
7  B7R0.6  O=C(O)[13CH2][13CH2]C(=O)O HY-N0420S4 [0,0,0,0,0,1|3,0,0]=4
8  B4R0.1  C=CC(=O)O HY-W243303J [2,0,0,0,0,0|1,0,1]=4
9  B4R0.1  C=CC(N)=O HY-W115727D [2,0,0,0,0,0|1,0,1]=4
10  B4R0.2  CCO[13CH]=O HY-W747621 [2,0,0,0,0,0|0,0,1]=3
11  B6R0.1  CCOC(=O)CN HY-148666 [1,1,0,0,0,0|0,0,1]=3
12  B6R0.1  CCOC(=O)[13CH2]N HY-76204S [1,1,0,0,0,0|0,0,1]=3
13  B6R0.1  COC(=O)N=C=O HY-W178414 [1,1,0,0,0,0|1,0,1]=4
14  B6R0.3  C\C=C(/C)C(=O)O HY-W012999R [1,1,0,0,0,0|2,0,0]=4
15  B8R0.9  COC(=O)CCC(C)=O HY-N3272R [0,1,0,0,0,1|1,0,0]=3
16  B8R0.5  CCOC(=O)CC(=O)O HY-Y1031R [0,2,0,0,0,0|2,0,0]=4
17  B8R0.5  CCOC(=O)CC(C)=O HY-Y1093R [0,2,0,0,0,0|1,0,0]=3
18  B8R0.5  CCOC(=O)C[13C](C)=O HY-Y1093S3 [0,2,0,0,0,0|1,0,0]=3
19  B6R1.2  O=C1CCOC1 HY-33900R [1,0,0,1,0,0|2,0,0]=4
20  B8R1.23  O=C1C[C@H](C(=O)O)N1 HY-W061629 [0,0,0,1,0,1|2,0,0]=4
21  B8R1.50  O=C1CCC(=O)N1Br HY-Y0775R [0,1,0,1,0,0|1,0,0]=3
22  B8R0.28  CC(=O)CCC=C(C)C HY-W010435R [0,0,0,0,0,2|2,0,0]=4