0  B6R0.1  C#CC(=O)OCC B051748 [0,0,0,0,0,0|0,0,2]=2
1  B6R0.1  COCC(=O)NN B015437 [0,0,0,0,0,0|4,0,0]=4
2  B5R0.3  CCC(=O)NN B015434 [1,0,0,0,0,0|2,0,0]=3
3  B5R0.3  CC\C(N)=N\O B030359 [1,0,0,0,0,0|3,0,0]=4
4  B7R0.3  CNCCC(=O)NC B039605 [0,1,0,0,0,0|2,0,1]=4
5  B7R0.5  CCOC(=O)C(F)F B020251 [0,1,0,0,0,0|1,0,1]=3
6  B7R0.7  CCOC(=O)CNN B020270 [0,1,0,0,0,0|1,0,1]=3
7  B7R1.2  CC1=NN(C)C=C1 B006757 [0,0,0,1,0,0|3,0,0]=4
8  B7R1.2  CN1C=CC(Br)=N1 B047103 [0,0,0,1,0,0|3,0,0]=4
9  B7R1.2  CN1C=CC(I)=N1 B050971 [0,0,0,1,0,0|3,0,0]=4
10  B7R1.2  CN1C=CC(N)=N1 B014443 [0,0,0,1,0,0|3,0,0]=4
11  B7R1.22  NNC(=O)C1CC1 B014982 [0,0,0,1,0,0|3,0,0]=4
12  B8R1.1  CC1=CC=C(C=O)S1 B015983 [0,1,0,1,0,0|0,1,1]=4
13  B8R1.1  CCN1C=CC(Br)=N1 B050957 [0,1,0,1,0,0|2,0,0]=4
14  B8R1.1  CCN1C=CC(C)=N1 B006751 [0,1,0,1,0,0|2,0,0]=4
15  B8R1.1  CCN1C=CC(I)=N1 B050972 [0,1,0,1,0,0|2,0,0]=4
16  B8R1.1  CCN1C=CC(N)=N1 B014445 [0,1,0,1,0,0|2,0,0]=4
17  B8R1.1  CCN1C=CC(N)=N1 B051587 [0,1,0,1,0,0|2,0,0]=4
18  B8R1.1  CN1C=CC(C=O)=N1 B007390 [0,1,0,1,0,0|2,0,0]=4
19  B8R1.8  CCCC1=CC=CS1 B046363 [0,1,0,1,0,0|1,1,0]=4
20  B8R1.11  CCN1C=NC=C1C B051962 [0,1,0,1,0,0|2,0,0]=4
21  B8R1.11  CCN1N=CC=C1Br B060135 [0,1,0,1,0,0|2,0,0]=4
22  B8R1.11  CCN1N=CC=C1C B006759 [0,1,0,1,0,0|2,0,0]=4
23  B8R1.11  CCN1N=CC=C1F B051209 [0,1,0,1,0,0|2,0,0]=4
24  B8R1.11  CCN1N=CC=C1I B051207 [0,1,0,1,0,0|2,0,0]=4
25  B8R1.11  CCN1N=CC=C1N B024267 [0,1,0,1,0,0|2,0,0]=4