0  B6R1.2  O=C1CCOC1 HY-33900R [1,0,0,0,0,0|2,0,0]=3
1  B8R1.1  C=C[C@H]1CNC(=S)O1 HY-N0224A [0,1,0,0,0,0|1,1,1]=4
2  B8R1.50  O=C1CCC(=O)N1Br HY-Y0775R [0,1,0,0,0,0|2,0,1]=4
3  B6R0.1  CCOC(=O)CN HY-148666 [0,0,1,0,0,0|1,0,0]=2
4  B6R0.1  CCOC(=O)[13CH2]N HY-76204S [0,0,1,0,0,0|1,0,0]=2
5  B6R0.2  CC(=O)NC(C)=O HY-W130303 [0,0,1,0,0,0|2,0,1]=4
6  B6R0.2  CC(C)CC(C)N HY-W114255 [0,0,1,0,0,0|2,0,1]=4
7  B6R0.2  C[C@@H](O)CC(=O)O HY-W051723R [0,0,1,0,0,0|3,0,0]=4
8  B5R0.3  CCC(=O)O[Na] HY-B1773AR [1,0,1,0,0,0|1,0,0]=3
9  B5R0.3  O=C(CO)CO HY-Y0335R [1,0,1,0,0,0|2,0,0]=4
10  B5R0.3  O=C[C@H](O)CO HY-W008507 [1,0,1,0,0,0|2,0,0]=4
11  B5R0.3  O=[13CH][13CH](O)[13CH2]O HY-128748S4 [1,0,1,0,0,0|2,0,0]=4
12  B7R0.5  CCOC(=O)C(C)=O HY-Y1362R [0,1,1,0,0,0|0,0,1]=3
13  B7R0.9  CC(=O)CC(C)(C)N HY-N3739 [0,1,1,0,0,0|1,0,0]=3
14  B7R0.16  CC(C)C(O)C(=O)O HY-W008150R [0,1,1,0,0,0|2,0,0]=4
15  B7R0.16  CC(C)[C@H]([15NH2])[13C](=O)O HY-N0717S7 [0,1,1,0,0,0|2,0,0]=4
16  B7R0.4  NCCCCC(=O)O HY-W015878R [0,1,1,0,0,0|0,0,0]=2
17  B7R0.6  O=C(O)[13CH2][13CH2]C(=O)O HY-N0420S4 [0,1,1,0,0,0|1,0,1]=4
18  B7R1.1  OC[C@@H]1CCCN1 HY-Y1126R [1,1,0,0,0,0|1,0,1]=4
19  B7R1.4  N[C@H]1CONC1=O HY-B1122R [1,1,0,0,0,0|2,0,0]=4
20  B9R1.69  CC1CNC(=O)NC1=O HY-N6787R [0,1,0,0,0,1|2,0,0]=4
21  B9R1.3  O=C1NCCC(O)C1Cl HY-N1815 [0,1,0,0,0,1|2,0,0]=4
22  B9R1.66  CC1(O)CCOC(=O)C1 HY-107855R [0,1,0,0,0,1|1,0,0]=3
23  B9R1.35  O=C1CC[C@H](C(=O)O)N1 HY-W002304R [0,2,0,0,0,0|1,0,1]=4
24  B9R1.38  CC1(C)OC(=O)NC1=O HY-B1348R [0,2,0,0,0,0|1,0,1]=4
25  B5R0.5  CC(=O)N(C)C HY-W042416R [0,0,1,0,1,0|1,0,0]=3
26  B5R0.5  C[13C@H](O)C(=O)O HY-Y0479S3 [0,0,1,0,1,0|2,0,0]=4