0  B10R0.3  CCOC(=O)CCCC(C)=C      AK103346 [0,1,0,0,0,0|3,0,0]=4
1  B10R0.3  O=C(O)CCCC(OCC)=O      AK486985 [0,1,0,0,0,0|3,0,0]=4
2  B10R0.22  CS(=O)(OCCCCCC)=O      AK160846 [0,1,0,0,0,0|1,0,2]=4
3  B10R0.55  COC(=O)CCCCC(C)=O      AK102293 [0,1,0,0,0,0|2,0,1]=4
4  B10R1.18  CC(=O)NC1CCNCC1      AK-51631 [0,0,0,1,0,0|2,0,1]=4
5  B10R1.66  CC(=O)OCC1=CC=CO1      AK-96694 [0,0,0,1,0,0|1,0,2]=4
6  B10R1.348  CC(=O)N1CCCNCC1      AK-24088 [0,0,0,1,0,0|2,0,1]=4
7  B7R0.4  CC(OCCCCl)=O      AK167628 [2,0,0,0,0,0|1,0,0]=3
8  B7R0.4  NC(OCCCC)=O      AK116656 [2,0,0,0,0,0|1,0,0]=3
9  B9R0.48  CC(CCC(OCC)=O)=O      AK109266 [1,1,0,0,0,0|1,0,0]=3
10  B9R0.48  O=C(O)CCC(OCC)=O      AK130461 [1,1,0,0,0,0|2,0,0]=4
11  B9R1.2  O=C1NCCN(CC)C1      AK480961 [1,0,0,1,0,0|2,0,0]=4
12  B9R1.6  CC(=O)N1CCOCC1      AK-59803 [1,0,0,1,0,0|2,0,0]=4
13  B9R1.6  CC(C1CCCCC1)=O      AK110444 [1,0,0,1,0,0|0,0,2]=4
14  B9R1.6  CC(C1CCNCC1)=O      AK-76366 [1,0,0,1,0,0|1,0,1]=4
15  B9R1.6  CC(C1CCOCC1)=O      AK-58675 [1,0,0,1,0,0|1,0,1]=4
16  B9R1.6  O=C(N1CCNCC1)C      AK-44435 [1,0,0,1,0,0|2,0,0]=4
17  B9R1.6  O=C([C@@H]1CC=CCC1)O      AK130960 [1,0,0,1,0,0|1,0,0]=3
18  B9R1.6  O=C([C@H]1CC=CCC1)O      AK-77496 [1,0,0,1,0,0|1,0,0]=3
19  B9R1.6  OC(=O)C1CCC=CC1      AK-33140 [1,0,0,1,0,0|1,0,0]=3
20  B9R1.7  O=C1OC[C@H](CCC)C1      AK543520 [1,0,0,1,0,0|0,0,1]=3
21  B9R1.13  CC(N[C@@H]1CNCC1)=O      AK-87500 [1,0,0,1,0,0|2,0,0]=4
22  B9R1.13  CC(N[C@H]1CNCC1)=O      AK-57730 [1,0,0,1,0,0|2,0,0]=4
23  B11R1.15  O=C(C1CC(CC1)=O)OCC      AK-86296 [0,1,0,1,0,0|2,0,0]=4
24  B11R1.15  O=C(C1CC(NC1)=O)OCC      AK-35807 [0,1,0,1,0,0|2,0,0]=4
25  B11R1.27  O=C1OC(CCCCC)CC1      AK551064 [0,1,0,1,0,0|0,0,2]=4
26  B11R1.20  CC(OC1CCC(CC1)=O)=O      AK112287 [0,1,0,1,0,0|0,0,1]=3
27  B11R1.20  O=C1CCC(CC1)NC(C)=O      AK-23921 [0,1,0,1,0,0|1,0,1]=4
28  B11R2.845  O=C(C1C2CC(C1)C=C2)O      AK-72985 [0,0,0,2,0,0|2,0,0]=4