0  B6R0.1  C=CC(C)CCO 102710 [0,0,0,0,0,0|2,0,0]=2
1  B5R0.1  CC(F)CCO 9969 [1,0,0,0,0,0|2,0,0]=3
2  B5R0.2  C#CCCCO 102448 [1,0,0,0,0,0|2,0,1]=4
3  B7R0.2  C\C(=C\Cl)CC(C)C 103075 [0,1,0,0,0,0|1,0,1]=3
4  B7R0.2  C\C=C(\C)CC(C)C 103077 [0,1,0,0,0,0|1,0,1]=3
5  B7R0.3  C=CC(C)CCCC 102712 [0,1,0,0,0,0|1,0,0]=2
6  B7R0.3  C=CC(C)CCCO 102711 [0,1,0,0,0,0|1,0,0]=2
7  B7R0.5  CO\C=C(/C)C(=O)O 101484 [0,1,0,0,0,0|1,0,2]=4
8  B7R0.7  CC\C=C(/C)CCC 102642 [0,1,0,0,0,0|1,0,1]=3
9  B7R0.10  CCC(=O)\C(C)=C/N 13495 [0,1,0,0,0,0|1,0,2]=4
10  B7R1.3  FC1CCCCC1 102292 [0,0,0,1,0,0|2,0,1]=4
11  B7R1.3  O=C1C=CCCC1 19980 [0,0,0,1,0,0|2,0,1]=4
12  B7R1.4  CC1=CCCC1=O 16116 [0,0,0,1,0,0|0,0,2]=3
13  B7R1.4  CC1CC=CC1=O 16115 [0,0,0,1,0,0|0,0,2]=3
14  B4R0.1  CC(F)CO 9967 [2,0,0,0,0,0|2,0,0]=4
15  B4R0.2  NCCCN 21368 [2,0,0,0,0,0|2,0,0]=4
16  B4R0.2  NCCCN 21721 [2,0,0,0,0,0|2,0,0]=4
17  B4R0.2  NCCCN 21741 [2,0,0,0,0,0|2,0,0]=4
18  B4R0.2  NCCCN 22243 [2,0,0,0,0,0|2,0,0]=4
19  B6R0.3  CC(Br)C(Br)CO 103140 [1,1,0,0,0,0|2,0,0]=4
20  B6R0.4  CCCN[N+](=O)[O-] 22283 [1,1,0,0,0,0|2,0,0]=4
21  B6R0.6  C\C=C/CCCO 102707 [1,1,0,0,0,0|1,0,1]=4
22  B8R0.2  CCC(=O)C(C)C(C)=O 16753 [0,2,0,0,0,0|0,0,1]=3
23  B8R0.5  C=CCC(O)CC(C)O 19502 [0,2,0,0,0,0|2,0,0]=4
24  B8R0.8  CN(CCC#N)C(N)=O 20516 [0,2,0,0,0,0|1,0,1]=4
25  B8R0.9  CN(C)CCN(C)C=O 102652 [0,2,0,0,0,0|1,0,0]=3
26  B8R1.4  CC1=CC(=O)CCC1 19984 [0,1,0,1,0,0|0,0,1]=3
27  B8R1.4  O=C1C=C(O)CCC1 19981 [0,1,0,1,0,0|1,0,1]=4
28  B8R1.50  CC1=CCC(C)C1=O 16114 [0,1,0,1,0,0|0,0,1]=3
29  B8R1.50  CC1C(=O)CCC1=O 13753 [0,1,0,1,0,0|0,0,1]=3
30  B8R1.11  CCC1=CCCC1=O 16118 [0,1,0,1,0,0|0,0,2]=4
31  B8R1.11  CCC1CC=CC1=O 16117 [0,1,0,1,0,0|0,0,2]=4