0  B9R1.6  O=C(O)[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 HY-N0216S1 [0,0,0,0,0,0|0,0,0]=0
1  B9R1.6  O=[13C](O)C1=CC=CC=C1 HY-N0216S2 [0,0,0,0,0,0|0,0,0]=0
2  B9R1.6  O=[13C](O)[13C]1=[13CH][13CH]=[13CH]N=[13CH]1 HY-B0143S3 [0,0,0,0,0,0|1,0,0]=1
3  B10R1.13  NC1=NC=C(B(O)O)C=C1 HY-W005558 [0,1,0,0,0,0|2,0,1]=4
4  B10R1.61  O=C(O)[13C]1=[13C](O)[13CH]=[13CH][13CH]=[13CH]1 HY-B0167S1 [0,1,0,0,0,0|0,0,0]=1
5  B10R1.113  CC1=CC([N+](=O)[O-])=CN=C1 HY-W015796 [0,1,0,0,0,0|2,0,1]=4
6  B7R0.4  [13CH](=C/C=C/C)[13C](=O)O HY-W747751 [1,0,1,0,0,0|0,0,1]=3
7  B11R1.20  CC(=O)N=C1C=CC(=O)C=C1 HY-W017464 [0,1,0,0,0,1|1,0,0]=3
8  B11R1.19  CP(C)(=O)C1=CC=C(Br)C=C1 HY-W068193 [0,2,0,0,0,0|2,0,0]=4
9  B11R1.22  COC(=O)[13C]1=[13CH][13CH]=[13C](O)[13CH]=[13CH]1 HY-N0349S1 [0,2,0,0,0,0|0,0,0]=2
10  B11R1.23  CNC(=O)C1=NC=CC(Br)=C1 HY-W107225 [0,2,0,0,0,0|2,0,0]=4
11  B11R1.87  CP(C)(=O)C1=CC=CC=C1N HY-W005746 [0,2,0,0,0,0|2,0,0]=4
12  B11R1.167  CN1C=CC(=O)C(C(N)=O)=C1 HY-113472 [0,2,0,0,0,0|2,0,0]=4
13  B11R1.167  NC1=CC(C(=O)O)=C(O)C=C1 HY-15027 [0,2,0,0,0,0|0,0,0]=2
14  B11R1.167  N[13C]1=[13CH][13C](C(=O)O)=[13C](O)[13CH]=[13CH]1 HY-143704S [0,2,0,0,0,0|0,0,0]=2
15  B11R1.74  O=C1C=C(C(=O)O)[15NH]C(=O)[15NH]1 HY-W016812S [0,2,0,0,0,0|2,0,0]=4
16  B11R1.74  O=C1C=C(C(=O)O)[15NH][13C](=O)[15NH]1 HY-N0157S1 [0,2,0,0,0,0|2,0,0]=4
17  B11R1.266  NN[13C]1=[13CH][13CH]=[13CH][13C]([N+](=O)[O-])=[13CH]1 HY-133689AS [0,2,0,0,0,0|1,0,1]=4
18  B11R2.10  O=C1C=C2C=COC=C2O1 HY-W187279 [0,0,0,1,0,1|1,0,0]=3
19  B11R2.1  O=C1NS[13C]2=[13CH][13CH]=[13CH][13CH]=[13C]12 HY-W017401S [0,1,0,1,0,0|0,1,0]=3
20  B11R1.91  O=[13C](O)\[13CH]=[13CH]\C1=CC=CC=C1 HY-N0610AS2 [0,0,0,0,0,2|0,0,0]=2