0  B9R1.69  CC1=CC(C)=NC=C1N HY-W004883 [0,0,0,0,0,0|4,0,0]=4
1  B9R1.69  CC1=NC=C(F)C=C1N HY-23946 [0,0,0,0,0,0|3,0,0]=3
2  B9R1.69  NC1=C(F)C=[15N][13C](=O)[15NH]1 HY-B0139S [0,0,0,0,0,0|2,0,1]=3
3  B9R1.69  O=C1[15NH][13C](=O)[15NH]C=C1F HY-90006S1 [0,0,0,0,0,0|3,0,1]=4
4  B8R1.3  N[13C]1=[13CH][13CH]=[13C](I)[13CH]=[13CH]1 HY-I0210S [1,0,0,0,0,0|1,1,0]=3
5  B8R1.4  NC1=CC=CC(F)=N1 HY-W003162 [1,0,0,0,0,0|2,0,0]=3
6  B8R1.5  N[13C]1=[13C](Cl)[13CH]=[13CH][13CH]=[13CH]1 HY-W104010S [1,0,0,0,0,0|0,1,0]=2
7  B10R1.30  CC1=CC=C(O)C(CN)=C1 HY-139373 [0,1,0,0,0,0|2,0,0]=3
8  B10R1.30  O=CC1=CC(O)=CC=C1O HY-N1673 [0,1,0,0,0,0|2,0,0]=3
9  B10R1.30  O=CC1=NC(Br)=CC=C1F HY-W058423 [0,1,0,0,0,0|3,0,0]=4
10  B10R1.119  NC1=CC=C(Br)C(Br)=C1F HY-Z5174 [0,1,0,0,0,0|2,1,0]=4
11  B7R0.4  [13CH](=C/C=C/C)[13C](=O)O HY-W747751 [1,0,1,0,0,0|2,0,0]=4
12  B11R1.279  COC1=CC=C(C=O)C(O)=C1 HY-N0445 [0,2,0,0,0,0|2,0,0]=4
13  B11R2.36  OC1=CC=C2CCOC2=C1 HY-Z0528 [0,1,0,1,0,0|2,0,0]=4