0  B5R0.1  C#CCC(=O)O B050921 [1,0,0,0,0,0|2,0,1]=4
1  B7R0.2  CC(CO)CN(C)C B039565 [0,1,0,0,0,0|1,0,2]=4
2  B7R0.16  CC(C(=O)O)N(C)C B039606 [0,1,0,0,0,0|1,0,0]=2
3  B7R1.2  CN1C=C(N)C=N1 B022860 [0,0,0,1,0,0|2,0,1]=4
4  B7R1.2  CN1C=C(N)C=N1 B037105 [0,0,0,1,0,0|2,0,1]=4
5  B7R1.2  CN1C=CC(N)=N1 B014443 [0,0,0,1,0,0|2,0,1]=4
6  B7R1.2  CN1C=NC(N)=N1 B046208 [0,0,0,1,0,0|2,0,1]=4
7  B7R1.2  CN1N=NC(N)=N1 B048635 [0,0,0,1,0,0|3,0,0]=4
8  B4R0.1  CSC(=N)N B022644 [2,0,0,0,0,0|2,0,0]=4
9  B6R0.1  COCC(=O)NN B015437 [1,1,0,0,0,0|1,0,0]=3
10  B6R0.3  CC(CN)N(C)C B039581 [1,1,0,0,0,0|0,0,1]=3
11  B6R0.3  N#CC(N)C(N)=O B048693 [1,1,0,0,0,0|2,0,0]=4
12  B6R0.7  CC(=O)C(C)(C)N B049721 [0,1,0,0,1,0|2,0,0]=4
13  B8R0.9  CCN(C)CCC(=O)O B039614 [0,1,0,0,0,1|1,0,0]=3
14  B8R0.23  CC(CN(C)C)C(=O)O B039611 [0,1,0,0,0,1|1,0,0]=3
15  B8R0.16  CCN(CC)CC(C)N B006616 [0,2,0,0,0,0|1,0,1]=4
16  B8R0.19  CCN(C)CC(C)CN B039547 [0,2,0,0,0,0|1,0,1]=4
17  B8R0.24  CC(C)(C)CC(=O)NN B014978 [0,2,0,0,0,0|1,0,0]=3
18  B6R1.2  NC1=CCNN1 B029440 [1,0,0,1,0,0|2,0,0]=4
19  B8R1.3  CN1CCC(N)CC1 B016064 [0,0,0,1,0,1|1,0,1]=4
20  B8R1.3  CN1CCC(N)CC1 B036196 [0,0,0,1,0,1|1,0,1]=4
21  B8R1.18  CC1=CC(N)=NN1C B020972 [0,1,0,1,0,0|2,0,0]=4
22  B8R1.18  CC1=CC(N)=NN1C B039190 [0,1,0,1,0,0|2,0,0]=4
23  B8R1.18  CC1=CC(N)=NN1C B047156 [0,1,0,1,0,0|2,0,0]=4