0  B7R1.3  IC1CCOCC1 CC29911 [0,0,0,0,0,0|2,0,0]=2
1  B7R1.3  IC1CCSCC1 CC61911 [0,0,0,0,0,0|2,0,0]=2
2  B7R1.3  O=C1CCOCC1 SB01650 [0,0,0,0,0,0|2,0,1]=3
3  B7R1.3  OC1CCSCC1 CC61915 [0,0,0,0,0,0|2,0,0]=2
4  B8R1.2  BrCC1CCOCC1 CC29908 [0,1,0,0,0,0|2,0,0]=3
5  B8R1.2  ICC1CCOCC1 CC29940 [0,1,0,0,0,0|2,0,0]=3
6  B8R1.2  N#CC1CCSCC1 CC61916 [0,1,0,0,0,0|1,0,1]=3
7  B8R1.2  NCC1CCCCO1 CC41213 [0,1,0,0,0,0|1,0,0]=2
8  B8R1.2  NCC1CCOCC1 CC29913 [0,1,0,0,0,0|1,0,0]=2
9  B8R1.2  NCC1CCSCC1 CC61963 [0,1,0,0,0,0|1,0,0]=2
10  B8R1.2  OCC1CCOCC1 CC29909 [0,1,0,0,0,0|2,0,0]=3
11  B8R1.2  OCC1CCSCC1 CC61909 [0,1,0,0,0,0|2,0,0]=3
12  B8R1.3  CN1CCN(N)CC1 AC10403 [0,1,0,0,0,0|2,0,0]=3
13  B8R1.72  CC1(C)CCCNC1 MAY00227 [0,1,0,0,0,0|2,0,0]=3
14  B6R0.1  CCC\C(N)=N\O MO07267 [0,0,1,0,0,0|2,0,1]=4
15  B6R0.6  NCCSCCO SB01634 [0,0,1,0,0,0|2,0,0]=3
16  B6R1.2  IC1CCOC1 CC76011 [0,0,0,0,1,0|2,0,0]=3
17  B6R1.2  O=C1CCOC1 MO08444 [0,0,0,0,1,0|2,0,1]=4
18  B5R0.3  CCC(C)CN SB01376 [1,0,1,0,0,0|2,0,0]=4
19  B7R0.1  CCCCCN=C=S TL04631 [0,1,1,0,0,0|1,0,1]=4
20  B7R1.1  N#CN1CCCC1 SB00582 [0,1,0,0,1,0|1,0,1]=4
21  B9R1.89  COC1=NCCCCC1 TL00603 [0,1,0,0,0,1|1,0,1]=4
22  B9R1.89  O\N=C1/CCCCCN1 CD11194 [0,1,0,0,0,1|0,0,2]=4
23  B9R1.1  CN1CCC(CN)CC1 MO01153 [0,2,0,0,0,0|1,0,0]=3
24  B9R1.2  CN1CCCC(CN)C1 CC66113 [0,2,0,0,0,0|1,0,0]=3
25  B9R1.2  CN1CCCC(CO)C1 NP16384 [0,2,0,0,0,0|2,0,0]=4
26  B9R1.6  N=C(N)N1CCCCC1 KM00642 [0,2,0,0,0,0|1,0,0]=3
27  B9R1.6  N=C(N)N1CCOCC1 KM00640 [0,2,0,0,0,0|2,0,0]=4
28  B9R1.6  NC(=S)C1CCOCC1 CC29918 [0,2,0,0,0,0|1,0,0]=3
29  B9R1.6  NC(=S)N1CCOCC1 RB00140 [0,2,0,0,0,0|2,0,0]=4
30  B9R1.6  O=C(Cl)C1CCOCC1 CC29902 [0,2,0,0,0,0|2,0,0]=4
31  B9R1.6  O=C(Cl)C1CCSCC1 CC61902 [0,2,0,0,0,0|2,0,0]=4
32  B9R1.6  O=C(O)C1CCCCO1 CC41201 [0,2,0,0,0,0|2,0,0]=4
33  B9R1.6  O=C(O)C1CCCNC1 AC19919 [0,2,0,0,0,0|2,0,0]=4
34  B9R1.6  O=C(O)C1CCOCC1 CC29901 [0,2,0,0,0,0|2,0,0]=4
35  B9R1.6  O=C(O)C1CCSCC1 CC61901 [0,2,0,0,0,0|2,0,0]=4
36  B9R1.8  BrCCC1CCOCC1 CC67408 [0,2,0,0,0,0|2,0,0]=4
37  B9R1.8  CNCC1CCOCC1 CC29946 [0,2,0,0,0,0|1,0,0]=3
38  B9R1.8  CNCC1CCSCC1 CC61946 [0,2,0,0,0,0|1,0,0]=3
39  B9R1.8  N#CCN1CCCCC1 CD05168 [0,2,0,0,0,0|1,0,1]=4
40  B9R1.8  OCCC1CCOCC1 CC67409 [0,2,0,0,0,0|2,0,0]=4
41  B9R1.15  CN1CCCCC1CN MO01154 [0,2,0,0,0,0|1,0,0]=3
42  B9R1.10  CC1(C)CCC(O)CC1 BTBG00026 [0,2,0,0,0,0|1,0,0]=3
43  B9R1.10  O=C1CCC(F)(F)CC1 MAY00226 [0,2,0,0,0,0|1,0,1]=4