0  B4R0.1  CSC(=N)N KM00619 [1,0,0,0,0,0|3,0,0]=4
1  B4R0.1  NC(=O)CS GK00437 [1,0,0,0,0,0|2,0,0]=3
2  B4R0.2  CSCCN CD06838 [1,0,0,0,0,0|2,0,0]=3
3  B6R0.1  CCC\C(N)=N\O MO07267 [0,1,0,0,0,0|1,0,1]=3
4  B6R0.2  CC(C)CC(N)=O BTB12988 [0,1,0,0,0,0|1,0,0]=2
5  B6R0.4  C#CCNC(N)=O CD11100 [0,1,0,0,0,0|1,0,2]=4
6  B6R1.2  IC1CCOC1 CC76011 [0,0,0,1,0,0|2,0,1]=4
7  B6R1.2  O=C1CCOC1 MO08444 [0,0,0,1,0,0|1,0,0]=2
8  B6R1.11  OB(O)C1CC1 MAY00065 [0,0,0,1,0,0|2,0,1]=4
9  B5R0.3  C#CC(=O)OC SB01817 [1,1,0,0,0,0|0,0,2]=4
10  B5R0.3  CCC(C)CN SB01376 [1,1,0,0,0,0|1,0,1]=4
11  B5R0.3  C\C(C=O)=C/N RH01431 [1,1,0,0,0,0|1,0,1]=4
12  B5R0.5  CC(C)C(=N)N RF02291 [1,1,0,0,0,0|2,0,0]=4
13  B5R0.2  CCCN=C=S TL01934 [1,1,0,0,0,0|0,1,1]=4
14  B7R0.2  COC(=O)C[C@@H](C)O SB01506 [0,2,0,0,0,0|0,0,0]=2
15  B7R0.5  C=CC[C@H](N)C(=O)O MAY00253 [0,2,0,0,0,0|1,0,1]=4
16  B7R0.4  CCO\C=C\C(=O)O RH00924 [0,2,0,0,0,0|1,0,1]=4
17  B7R1.1  CSC1=NCCN1 DP01481 [0,1,0,1,0,0|2,0,0]=4
18  B7R1.1  N#CN1CCCC1 SB00582 [0,1,0,1,0,0|2,0,0]=4
19  B7R1.3  IC1CCOCC1 CC29911 [0,1,0,1,0,0|1,0,1]=4
20  B7R1.3  IC1CCSCC1 CC61911 [0,1,0,1,0,0|1,0,1]=4
21  B7R1.3  O=C1CCOCC1 SB01650 [0,1,0,1,0,0|0,0,0]=2
22  B7R1.3  OC1CCSCC1 CC61915 [0,1,0,1,0,0|0,0,2]=4
23  B7R1.4  CC1OCCC1=O SB01113 [0,1,0,1,0,0|1,0,0]=3
24  B7R1.10  C=C1CC(C#N)C1 SB02040 [0,1,0,1,0,0|1,0,1]=4
25  B7R1.22  N\C(=N/O)C1CC1 MO01104 [0,1,0,1,0,0|1,0,1]=4
26  B7R1.18  O=C(Cl)C1CCC1 SB01065 [0,1,0,1,0,0|1,0,0]=3