0  B10R1.13  NC1=NC=C(B(O)O)C=C1 HY-W005558 [0,0,0,0,0,0|2,0,1]=3
1  B9R1.6  O=C(O)[13C]1=[13CH][13CH]=[13CH][13CH]=[13CH]1 HY-N0216S1 [1,0,0,0,0,0|0,0,0]=1
2  B9R1.6  O=[13C](O)C1=CC=CC=C1 HY-N0216S2 [1,0,0,0,0,0|0,0,0]=1
3  B9R1.6  O=[13C](O)[13C]1=[13CH][13CH]=[13CH]N=[13CH]1 HY-B0143S3 [1,0,0,0,0,0|1,0,0]=2
4  B11R1.19  CP(C)(=O)C1=CC=C(Br)C=C1 HY-W068193 [0,1,0,0,0,0|3,0,0]=4
5  B11R1.22  COC(=O)[13C]1=[13CH][13CH]=[13C](O)[13CH]=[13CH]1 HY-N0349S1 [0,1,0,0,0,0|1,0,0]=2
6  B11R1.20  CC(=O)N=C1C=CC(=O)C=C1 HY-W017464 [0,0,0,0,0,1|2,0,0]=3
7  B8R0.28  N=C(N)S\C=C/C(=O)O HY-100799 [1,0,1,0,0,0|2,0,0]=4
8  B8R1.3  N[13C]1=[13CH][13CH]=[13C](I)[13CH]=[13CH]1 HY-I0210S [2,0,0,0,0,0|1,0,0]=3
9  B10R1.61  O=C(O)[13C]1=[13C](O)[13CH]=[13CH][13CH]=[13CH]1 HY-B0167S1 [1,1,0,0,0,0|0,0,0]=2
10  B10R1.14  COC(=O)C1=CC=C(Br)N1 HY-W006646 [0,1,0,0,1,0|2,0,0]=4
11  B12R1.20  O=C(O)C(=O)C1=CC=C(O)C=C1 HY-W104819 [0,1,0,0,0,1|1,0,0]=3
12  B12R1.20  O=C(O)C(O)C1=CC=C(O)C=C1 HY-113027 [0,1,0,0,0,1|1,0,0]=3
13  B12R1.16  O=C(CCO)C1=CC=C(O)C=C1 HY-W268155 [0,2,0,0,0,0|1,0,0]=3
14  B12R1.16  [13CH]1=[13CH][13C](C(=O)OCC)=[13CH][13CH]=[13C]1O HY-W653994 [0,2,0,0,0,0|1,0,0]=3
15  B12R2.612  OC1=NNC2=CC(F)=CC=C21 HY-111412 [0,1,0,1,0,0|2,0,0]=4
16  B12R1.21  O=[13C](O)\[13CH]=[13CH]\C1=CC=C(O)C=C1 HY-N0351S [0,0,0,0,0,2|1,0,0]=3