0  B7R1.3  IC1CCOCC1 CC29911 [1,0,0,0,0,0|2,0,1]=4
1  B7R1.3  IC1CCSCC1 CC61911 [1,0,0,0,0,0|2,0,1]=4
2  B7R1.3  O=C1CCOCC1 SB01650 [1,0,0,0,0,0|1,0,0]=2
3  B7R1.3  OC1CCSCC1 CC61915 [1,0,0,0,0,0|1,0,2]=4
4  B9R1.2  CN1CCCC(CN)C1 CC66113 [0,1,0,0,0,0|2,0,0]=3
5  B9R1.2  CN1CCCC(CO)C1 NP16384 [0,1,0,0,0,0|2,0,0]=3
6  B7R0.2  COC(=O)C[C@@H](C)O SB01506 [0,0,1,0,0,0|2,0,0]=3
7  B7R0.4  CC(C)=CCOC=O RDP00092 [0,0,1,0,0,0|1,0,2]=4
8  B7R1.4  CC1OCCC1=O SB01113 [0,0,0,0,1,0|1,0,0]=2
9  B6R0.2  CC(C)CC(N)=O BTB12988 [1,0,1,0,0,0|1,0,0]=3
10  B8R1.2  BrCC1CCOCC1 CC29908 [1,1,0,0,0,0|1,0,1]=4
11  B8R1.2  ICC1CCOCC1 CC29940 [1,1,0,0,0,0|1,0,1]=4
12  B8R1.2  NCC1CCCCO1 CC41213 [1,1,0,0,0,0|1,0,1]=4
13  B8R1.2  NCC1CCOCC1 CC29913 [1,1,0,0,0,0|1,0,1]=4
14  B8R1.2  NCC1CCSCC1 CC61963 [1,1,0,0,0,0|1,0,1]=4
15  B8R1.2  O=CC1=COCCC1 KM03842 [1,1,0,0,0,0|1,0,1]=4
16  B8R1.2  OCC1CCOCC1 CC29909 [1,1,0,0,0,0|1,0,1]=4
17  B8R1.2  OCC1CCSCC1 CC61909 [1,1,0,0,0,0|1,0,1]=4
18  B8R1.72  CC1(C)CCCNC1 MAY00227 [1,1,0,0,0,0|1,0,0]=3
19  B8R1.51  NC1CCS(=O)(=O)C1 RJC02399 [0,1,0,0,1,0|2,0,0]=4
20  B10R1.10  CNCC1CCCN(C)C1 CC66146 [0,2,0,0,0,0|2,0,0]=4
21  B6R1.2  IC1CCOC1 CC76011 [1,0,0,0,1,0|2,0,0]=4
22  B6R1.2  O=C1CCOC1 MO08444 [1,0,0,0,1,0|1,0,0]=3