0  B8R0.7  CC(=O)OCCCCCl 22585 [0,0,0,0,0,0|1,0,1]=2
1  B8R0.7  CCCCCCC(=O)O 30743 [0,0,0,0,0,0|2,0,2]=4
2  B8R0.7  NCCCCCC(=O)O 02556 [0,0,0,0,0,0|3,0,1]=4
3  B8R0.7  O=C(Cl)CCCCCBr 26761 [0,0,0,0,0,0|3,0,1]=4
4  B8R0.7  O=C(O)CCCCCBr 24477 [0,0,0,0,0,0|3,0,1]=4
5  B8R0.7  O=C(O)CCCCCS 29135 [0,0,0,0,0,0|3,0,1]=4
6  B7R0.1  CCCCCCC=O 30760 [1,0,0,0,0,0|1,0,2]=4
7  B7R0.1  O=CCCCCCCl 26394 [1,0,0,0,0,0|2,0,1]=4
8  B7R0.4  CC(=O)NCCCN 23890 [1,0,0,0,0,0|2,0,0]=3
9  B7R0.4  CN(C)CCCC=O 18994 [1,0,0,0,0,0|3,0,0]=4
10  B7R0.4  CNCCCC(=O)O 06613 [1,0,0,0,0,0|2,0,1]=4
11  B7R0.4  NCCCCC(=O)O 06917 [1,0,0,0,0,0|2,0,1]=4
12  B7R0.4  NCCCCC(=O)O 21636 [1,0,0,0,0,0|2,0,1]=4
13  B7R0.4  O=C(Cl)CCCCBr 27364 [1,0,0,0,0,0|2,0,1]=4
14  B7R0.4  O=C(O)CCCCBr 22022 [1,0,0,0,0,0|2,0,1]=4
15  B7R0.4  O=C(O)CCCCCl 26912 [1,0,0,0,0,0|2,0,1]=4
16  B9R0.46  CCCCCCC(=O)OC 30763 [0,1,0,0,0,0|1,0,2]=4
17  B9R0.46  COC(=O)CCCCCBr 28157 [0,1,0,0,0,0|2,0,1]=4
18  B9R0.55  CC(=O)NCCCC(=O)O 11793 [0,1,0,0,0,0|2,0,0]=3
19  B9R0.55  O=C(O)CCCCC(=O)O 30373 [0,1,0,0,0,0|3,0,0]=4
20  B9R1.6  CC(=O)C1CCCCN1 18531 [0,0,0,1,0,0|2,0,1]=4
21  B6R0.6  CCCCCC=O 24524 [2,0,0,0,0,0|0,0,2]=4
22  B6R0.4  NCCCC(=O)O 04887 [2,0,0,0,0,0|2,0,0]=4
23  B6R0.4  O=C(O)CCCBr 26847 [2,0,0,0,0,0|2,0,0]=4
24  B6R0.4  O=C(O)CCCS 22299 [2,0,0,0,0,0|2,0,0]=4
25  B8R0.6  C=CC(O)CCCCC 31191 [1,1,0,0,0,0|1,0,1]=4
26  B8R0.5  C=CC[C@@H](N)CC(=O)O 15491 [1,1,0,0,0,0|1,0,0]=3
27  B8R0.5  C=CC[C@H](N)CC(=O)O 15399 [1,1,0,0,0,0|1,0,0]=3
28  B8R0.28  CC(=O)NCCC(=O)O 01739 [1,1,0,0,0,0|2,0,0]=4
29  B10R0.98  CC(=O)NCC[C@H](N)C(=O)O 30484 [0,2,0,0,0,0|2,0,0]=4
30  B10R0.97  CC(=O)NCSCCC(=O)O 09910 [0,2,0,0,0,0|2,0,0]=4
31  B10R0.122  CC(=O)OC(C)(C)CCC=O 19284 [0,2,0,0,0,0|1,0,0]=3
32  B8R1.2  O=CC1CCOCC1 17391 [1,0,0,1,0,0|1,0,1]=4
33  B8R1.5  O=C1CCCCC1=O 02296 [1,0,0,1,0,0|2,0,0]=4
34  B8R1.11  C=CN1CCCC1=O 26863 [1,0,0,1,0,0|2,0,0]=4
35  B8R1.4  CC1=CC(=O)CCC1 26783 [1,0,0,1,0,0|0,0,2]=4
36  B8R1.4  O=C1CCCC(=O)C1 24452 [1,0,0,1,0,0|1,0,0]=3
37  B8R1.7  CC(=O)C1CCNC1 26376 [1,0,0,1,0,0|1,0,1]=4
38  B8R1.7  NC(=O)[C@@H]1C=CCN1 07037 [1,0,0,1,0,0|2,0,0]=4
39  B8R1.7  O=C(O)C1C=CCN1 07036 [1,0,0,1,0,0|2,0,0]=4
40  B8R1.7  O=C(O)[C@@H]1C=CCN1 02563 [1,0,0,1,0,0|2,0,0]=4
41  B10R1.1  C=CCC1C=CC(=O)CC1 24303 [0,1,0,1,0,0|1,0,1]=4