0  B7R1.2  CC1CCC(=O)O1 HY-W015938 [1,0,0,0,0,0|2,0,1]=4
1  B9R1.133  CC1(C)OC[C@H](C=O)O1 HY-I0606B [0,1,0,0,0,0|0,0,1]=2
2  B9R1.133  CC1(C)OC[C@H](CO)O1 HY-W012699 [0,1,0,0,0,0|0,0,0]=1
3  B7R0.2  CCC(C)CC(C)N HY-W015593 [0,0,1,0,0,0|3,0,0]=4
4  B7R0.2  CCC(C)OC(C)=O HY-158759 [0,0,1,0,0,0|2,0,1]=4
5  B7R0.2  [C@H](N)(CO)CC(C)C HY-W012888 [0,0,1,0,0,0|2,0,0]=3
6  B7R0.6  CC(C)CCC(=O)O HY-W015882 [0,0,1,0,0,0|2,0,1]=4
7  B7R0.6  CC(C)CCC(=O)O HY-W015882R [0,0,1,0,0,0|2,0,1]=4
8  B7R0.8  CC(C)(C)OCCN HY-W154207 [0,0,1,0,0,0|2,0,0]=3
9  B7R0.8  CCCCC(C)(C)O HY-W111893 [0,0,1,0,0,0|1,0,0]=2
10  B7R0.9  CC(O)CC(C)(C)O HY-B0903 [0,0,1,0,0,0|2,0,0]=3
11  B7R0.9  CC(O)CC(C)(C)O HY-B0903R [0,0,1,0,0,0|2,0,0]=3
12  B6R0.4  CC(C)CCCO HY-W007511 [1,0,1,0,0,0|1,0,0]=3
13  B6R0.4  CCOCC(=O)O HY-W027555 [1,0,1,0,0,0|1,0,1]=4
14  B6R0.5  CC(C)(C)CCO HY-W012977 [1,0,1,0,0,0|2,0,0]=4
15  B6R0.5  CCC[N+](C)(C)C HY-W099930 [1,0,1,0,0,0|2,0,0]=4
16  B6R1.2  O[C@H]1CCOC1 HY-76476 [2,0,0,0,0,0|2,0,0]=4
17  B8R0.5  COCC(C)OC(C)=O HY-W133953 [0,1,1,0,0,0|1,0,1]=4
18  B8R0.33  CC(C)(C)CC(C)(C)C HY-W134422 [0,1,1,0,0,0|2,0,0]=4
19  B10R1.329  CC1(C)OC(=O)CC(=O)O1 HY-Y0232 [0,1,0,0,0,1|1,0,1]=4
20  B8R1.4  CC1CCCC(C)N1 HY-B1191 [0,0,1,1,0,0|2,0,0]=4
21  B8R1.3  CN1CCC(O)CC1 HY-W018626 [0,0,1,1,0,0|2,0,0]=4
22  B8R1.3  C[C@H]1CC[C@H](N)CC1 HY-W010538 [0,0,1,1,0,0|2,0,0]=4
23  B8R1.3  N[C@H]1CC[C@H](O)CC1 HY-79722 [0,0,1,1,0,0|2,0,0]=4
24  B8R1.3  OC1COC(O)CO1 HY-W004661 [0,0,1,1,0,0|2,0,0]=4
25  B6R0.3  CC(C)[C@H](N)CO HY-30167A [0,0,1,0,1,0|1,0,0]=3
26  B8R0.28  CC(C)CCCC(C)N HY-B1233 [0,0,1,0,0,1|2,0,0]=4
27  B8R0.28  CC(C)CCCC(C)N HY-B1233A [0,0,1,0,0,1|2,0,0]=4