0  B6R0.1  CCC\C(N)=N\O MO07267 [0,0,0,0,0,0|2,0,2]=4
1  B5R0.3  CCC(C)CN SB01376 [1,0,0,0,0,0|1,0,2]=4
2  B5R0.3  C\C(C=O)=C/N RH01431 [1,0,0,0,0,0|1,0,0]=2
3  B7R1.1  O=CC1=CC=CN1 CC08704 [0,0,0,1,0,0|1,0,2]=4
4  B7R1.1  O=CC1=CNC=N1 CC08804 [0,0,0,1,0,0|2,0,1]=4
5  B7R1.1  O=CC1=CSN=N1 SP01373 [0,0,0,1,0,0|3,0,0]=4
6  B7R1.2  CC1=CC(C)=NO1 TL00573 [0,0,0,1,0,0|1,0,2]=4
7  B7R1.4  CC1OCCC1=O SB01113 [0,0,0,1,0,0|1,0,1]=3
8  B4R0.1  NC(=O)CS GK00437 [2,0,0,0,0,0|2,0,0]=4
9  B6R0.2  CC(C)CC(N)=O BTB12988 [1,1,0,0,0,0|1,0,1]=4
10  B6R1.2  O=C1CCOC1 MO08444 [1,0,0,1,0,0|1,0,1]=4
11  B8R1.1  CC1=CC=C(CN)S1 CC65063 [0,1,0,1,0,0|2,0,0]=4
12  B8R1.1  CC1=CSC(C=O)=N1 NP42935 [0,1,0,1,0,0|1,0,1]=4
13  B8R1.1  CC1=CSC(CN)=C1 CC30613 [0,1,0,1,0,0|0,1,1]=4
14  B8R1.1  CC1=NC(C=O)=CN1 SB01361 [0,1,0,1,0,0|1,0,1]=4
15  B8R1.1  CC1=NC(C=O)=CO1 CC57904 [0,1,0,1,0,0|1,0,1]=4
16  B8R1.1  CC1=NC(C=O)=CS1 CC05704 [0,1,0,1,0,0|1,0,1]=4
17  B8R1.1  CN1C=NC(C=O)=C1 CC03604 [0,1,0,1,0,0|1,0,1]=4
18  B8R1.2  O=CC1=COCCC1 KM03842 [0,1,0,1,0,0|0,0,0]=2
19  B8R1.5  CC1=CC=CNC1=O CD09405 [0,1,0,1,0,0|0,0,2]=4
20  B8R1.11  CC1=C(C=O)C=CO1 CC55404 [0,1,0,1,0,0|1,0,1]=4
21  B8R1.11  CC1=C(CN)OC=C1 CC55513 [0,1,0,1,0,0|1,0,1]=4
22  B8R1.11  CC1=C(CO)C=CO1 CD10514 [0,1,0,1,0,0|2,0,0]=4
23  B8R1.11  CN1C=NC=C1C=O CC23604 [0,1,0,1,0,0|1,0,1]=4
24  B8R1.11  CN1N=CC=C1C=O CC62304 [0,1,0,1,0,0|1,0,1]=4