0  B8R0.4  CCCCC\C=C\C=O M10045247P [0,0,0,0,0,0|0,0,4]=4
1  B9R0.5  O=C(OCC)\C=C\OCC M10082130P [0,1,0,0,0,0|3,0,0]=4
2  B9R0.45  CCCC\C=C\C=C\C=O M10081789P [0,1,0,0,0,0|0,0,2]=3
3  B9R1.8  CCNC1=CC=CN=C1 M10217063P [0,0,0,1,0,0|3,0,0]=4
4  B9R1.8  CCOC1=NN=CC=C1 M10375586P [0,0,0,1,0,0|3,0,0]=4
5  B9R1.8  COCC1=CC=CC=C1 M10013562P [0,0,0,1,0,0|2,0,1]=4
6  B9R1.8  NCCC1=CC=CC=C1 M10005773P [0,0,0,1,0,0|2,0,1]=4
7  B9R1.8  SCCC1=CC=CC=C1 M10062928P [0,0,0,1,0,0|2,0,1]=4
8  B9R1.12  CCCCC1=CC=CS1 M10031024P [0,0,0,1,0,0|0,1,2]=4
9  B9R1.15  CC1=CC=CC=C1CBr M10001945P [0,0,0,1,0,0|1,0,2]=4
10  B9R1.15  OC1=CC=CC=C1CBr M10300898P [0,0,0,1,0,0|1,0,2]=4
11  B6R0.6  C\C=C\C=C\C=O M10005449P [2,0,0,0,0,0|0,0,2]=4
12  B6R0.6  C\C=C\C=C\CO M10147270P [2,0,0,0,0,0|0,0,0]=2
13  B8R0.1  O=C(OCC)\C=C\C=O M10049575P [1,1,0,0,0,0|1,0,1]=4
14  B8R0.1  O=C(OCC)\C=C\CBr M10234278P [1,1,0,0,0,0|2,0,0]=4
15  B8R0.6  C\C=C\C=C\C(OC)=O M10018450P [1,1,0,0,0,0|1,0,1]=4
16  B8R0.6  O=C(OCCCC)CO M10104696P [1,1,0,0,0,0|1,0,1]=4
17  B8R0.7  CCCC\C=C\C(O)=O M10158440P [1,1,0,0,0,0|0,0,1]=3
18  B8R1.2  OCC1=CCCCO1 M12277756P [1,0,0,1,0,0|1,0,1]=4
19  B8R1.2  OCC1CC=CCC1 M10034671P [1,0,0,1,0,0|0,0,2]=4
20  B8R1.5  CC1=CC=CC=C1O M10205472P [1,0,0,1,0,0|0,0,2]=4
21  B8R1.8  BrCCC1=CC=CS1 M10194071P [1,0,0,1,0,0|1,1,0]=4
22  B8R1.8  CCCN1N=CC=C1 M10217397P [1,0,0,1,0,0|2,0,0]=4
23  B10R1.10  OC1=CC=CC(OCC)=C1 M10196808P [0,1,0,1,0,0|1,0,1]=4
24  B10R1.18  CC(O)CC1=CC=CC=C1 M10018807P [0,1,0,1,0,0|1,0,1]=4
25  B10R1.18  CC(O)CC1=CC=CC=C1 M10133834P [0,1,0,1,0,0|1,0,1]=4
26  B10R1.18  C[C@@H](O)CC1=CC=CC=C1 M10032962P [0,1,0,1,0,0|1,0,1]=4
27  B10R1.18  C[C@H](O)CC1=CC=CC=C1 M10032105P [0,1,0,1,0,0|1,0,1]=4
28  B10R1.11  O=C(C1=CC=CO1)OCC M10030401P [0,1,0,1,0,0|1,0,1]=4
29  B10R1.25  OCC1=CC=C(C)C=C1C M10142035P [0,1,0,1,0,0|0,0,2]=4
30  B10R1.4  CC1=CC=CC=C1CCO M10162794P [0,1,0,1,0,0|0,0,2]=4
31  B10R1.17  CNCCC1=CC=CC=C1 M10060073P [0,1,0,1,0,0|1,0,1]=4
32  B10R1.17  CNCCC1=NC=CC=C1 M10024739P [0,1,0,1,0,0|1,0,1]=4
33  B10R1.20  CCC1=CC=CC=C1CC M10005067P [0,1,0,1,0,0|1,0,1]=4
34  B10R1.20  OCC1=NC=CC=C1CO M10877017P [0,1,0,1,0,0|1,0,1]=4
35  B10R1.15  NC(CC)C1=CC=CC=C1 M10388570P [0,1,0,1,0,0|1,0,1]=4
36  B10R1.172  CCC1=CC=CC(CC)=N1 M10023609P [0,1,0,1,0,0|1,0,1]=4
37  B10R1.172  OCC1=CC=CC(CBr)=C1 M10485908P [0,1,0,1,0,0|1,0,1]=4