0  B7R0.1  NCCCCCCO AC511691 [0,0,0,0,0,0|2,1,1]=4
1  B7R0.1  OCCCCCC#C AC510906 [0,0,0,0,0,0|3,0,1]=4
2  B6R0.6  BrCCCCC#N AC130360 [1,0,0,0,0,0|2,0,1]=4
3  B6R0.6  ClCCCCC=O AC511901 [1,0,0,0,0,0|1,1,1]=4
4  B6R0.6  OCCCCC#N AC130361 [1,0,0,0,0,0|2,0,1]=4
5  B6R0.6  OCCCCC=O AC511239 [1,0,0,0,0,0|1,1,1]=4
6  B6R0.6  OCCCCCBr AC500312 [1,0,0,0,0,0|1,1,1]=4
7  B8R0.4  C=CCCCCCCI LN01331461 [0,1,0,0,0,0|2,0,1]=4
8  B8R0.7  CC(C)CCCCCBr AC250009 [0,1,0,0,0,0|2,0,1]=4
9  B8R0.7  CCCCCCB(O)O AC090081 [0,1,0,0,0,0|2,1,0]=4
10  B8R0.7  CS(=O)CCCN=C=S HY-101413 [0,1,0,0,0,0|1,0,0]=2
11  B8R1.2  BrCC1CCCCC1 AC500277 [0,0,0,1,0,0|2,0,1]=4
12  B8R1.2  CNC1CCCCC1 AC500155 [0,0,0,1,0,0|3,0,0]=4
13  B8R1.2  NNC1CCCCC1 AC510702 [0,0,0,1,0,0|3,0,0]=4
14  B8R1.2  [C-]#[N+]C1CCCCC1 AC190311 [0,0,0,1,0,0|3,0,0]=4
15  B8R1.22  C1CNCCN=C1O LN00119415 [0,0,0,1,0,0|1,1,1]=4
16  B8R1.22  CC1CCCCCN1 LN00112400 [0,0,0,1,0,0|1,0,2]=4
17  B8R1.22  CC1CCCCNC1 LN00001181 [0,0,0,1,0,0|3,0,0]=4
18  B5R0.2  C(CCI)CCl LN00199790 [2,0,0,0,0,0|2,0,0]=4
19  B5R0.2  CNCCCO AC510766 [2,0,0,0,0,0|1,1,0]=4
20  B5R0.2  NCCCCBr AC511924 [2,0,0,0,0,0|1,0,1]=4
21  B5R0.2  NCCCCO AC180225 [2,0,0,0,0,0|1,0,1]=4
22  B5R0.2  OCCCCBr AC030135 [2,0,0,0,0,0|1,1,0]=4
23  B7R0.4  CCCCCC(C)N HY-B0952 [1,1,0,0,0,0|1,0,1]=4
24  B7R0.7  CCCC(O)COC AC010185 [1,1,0,0,0,0|1,0,1]=4
25  B7R1.1  BrCC1CCCC1 AC511868 [1,0,0,1,0,0|1,0,1]=4
26  B7R1.1  C1CCC(C1)C=O LN00189003 [1,0,0,1,0,0|0,1,1]=4
27  B7R1.1  NCC1CCCC1 AC050593 [1,0,0,1,0,0|1,0,1]=4
28  B7R1.1  NNC1CCCC1 AC050475 [1,0,0,1,0,0|1,0,1]=4
29  B7R1.1  NNC1CCCC1 AC050611 [1,0,0,1,0,0|1,0,1]=4
30  B7R1.1  O=CC1CCCC1 AC020554 [1,0,0,1,0,0|0,1,1]=4
31  B7R1.1  OCC1CCCC1 AC180018 [1,0,0,1,0,0|0,1,1]=4
32  B7R1.3  NN1CCCCC1 AC160501 [1,0,0,1,0,0|1,0,1]=4
33  B7R1.3  NN1CCCCC1 AC510696 [1,0,0,1,0,0|1,0,1]=4
34  B7R1.4  C[C@H]1CCC[C@@H]1O LN00004654 [1,0,0,1,0,0|0,1,1]=4
35  B7R1.4  C[C@H]1CCC[C@H]1O LN00004778 [1,0,0,1,0,0|0,1,1]=4