0  B9R0.45  CCCCCCCCCI M10191776P [0,0,0,0,0,0|4,0,0]=4
1  B9R0.45  ClCCOCCOCCCl M10003884P [0,0,0,0,0,0|4,0,0]=4
2  B9R0.45  ClCCOCCOCCO M10069568P [0,0,0,0,0,0|4,0,0]=4
3  B9R0.45  NCCOCCOCCO M10090455P [0,0,0,0,0,0|3,0,0]=3
4  B9R0.45  OCCCCCCCCBr M10256068P [0,0,0,0,0,0|4,0,0]=4
5  B9R0.45  OCCNCCNCCO M10063304P [0,0,0,0,0,0|2,0,0]=2
6  B9R0.45  SCCOCCOCCS M10134235P [0,0,0,0,0,0|4,0,0]=4
7  B8R0.4  BrCCCCCCCBr M10064364P [1,0,0,0,0,0|3,0,0]=4
8  B8R0.4  CCCCCCCCI M10017037P [1,0,0,0,0,0|3,0,0]=4
9  B8R0.4  NCCCNCCCN M10000337P [1,0,0,0,0,0|2,0,0]=3
10  B8R0.4  OCCCCCCCO M10017038P [1,0,0,0,0,0|3,0,0]=4
11  B10R0.71  COCCOCCOCCN M10456700P [0,1,0,0,0,0|3,0,0]=4
12  B10R1.5  NCC1N(CC=C)CCC1 M10419681P [0,0,0,1,0,0|2,0,1]=4
13  B10R1.85  ClCCN1CCCCCC1 M10194120P [0,0,0,1,0,0|3,0,0]=4
14  B10R1.85  OCCN1CCCCCC1 M10166574P [0,0,0,1,0,0|3,0,0]=4
15  B7R0.1  CCCCCCCI M10061657P [2,0,0,0,0,0|2,0,0]=4
16  B7R0.1  CCCCOCCCl M10115661P [2,0,0,0,0,0|2,0,0]=4
17  B7R0.1  CCOCCOCC M10017029P [2,0,0,0,0,0|2,0,0]=4
18  B7R0.1  COCCOCCN M11203897P [2,0,0,0,0,0|2,0,0]=4
19  B7R0.1  ICCCCCCI M10017025P [2,0,0,0,0,0|2,0,0]=4
20  B7R0.1  NCCCCCCN M10083288P [2,0,0,0,0,0|0,0,0]=2
21  B7R0.1  NCCCNCCBr M10180506P [2,0,0,0,0,0|1,0,0]=3
22  B11R0.3  NCCCNCCNCCCN M10116254P [0,2,0,0,0,0|0,0,0]=2
23  B9R1.8  BrCCN1CCOCC1 M10249639P [1,0,0,1,0,0|2,0,0]=4
24  B9R1.8  BrCCN1CCOCC1 M10575421P [1,0,0,1,0,0|2,0,0]=4
25  B9R1.8  FCCN1CCNCC1 M11100270P [1,0,0,1,0,0|1,0,0]=3
26  B9R1.8  NCCC1CCCCC1 M10076838P [1,0,0,1,0,0|2,0,0]=4
27  B9R1.8  OCCC1CCNCC1 M10599588P [1,0,0,1,0,0|2,0,0]=4
28  B9R1.8  OCCC1CNCCC1 M10145092P [1,0,0,1,0,0|2,0,0]=4
29  B9R1.8  OCCC1NCCNC1 M10053975P [1,0,0,1,0,0|1,0,0]=3
30  B9R1.8  OCCC1NCCOC1 M10873035P [1,0,0,1,0,0|2,0,0]=4
31  B9R1.8  OCC[C@@H]1NCCNC1 M11121589P [1,0,0,1,0,0|1,0,0]=3
32  B9R1.14  CCN1[C@@H](CN)CCC1 M10176853P [1,0,0,1,0,0|1,0,0]=3
33  B9R1.33  O=C1NCCN1CCN M10086764P [1,0,0,1,0,0|1,0,1]=4
34  B9R1.103  N1CCCCCCCC1 M10078823P [1,0,0,1,0,0|2,0,0]=4
35  B9R1.103  N1CCNCCNCC1 M10304468P [1,0,0,1,0,0|0,0,0]=2
36  B11R1.16  NCCN(C1CCCCC1)C M10844339P [0,1,0,1,0,0|2,0,0]=4
37  B11R1.28  NCCCNC1CCCCC1 M10053236P [0,1,0,1,0,0|2,0,0]=4