0  B8R0.5  C(CC(=O)C)(=O)OCC ACS015689 [1,0,0,0,0,0|2,0,1]=4
1  B8R0.5  C(OCCl)(OC(C)C)=O ACS012188 [1,0,0,0,0,0|3,0,0]=4
2  B8R0.5  O[C@@H](CC(=O)OCC)C ACS011594 [1,0,0,0,0,0|2,0,0]=3
3  B8R0.28  CC(C)NC=NC(C)C ACS024506 [1,0,0,0,0,0|2,0,0]=3
4  B10R0.165  P(=O)(OC(C)C)(OC(C)C)Cl ACS015681 [0,1,0,0,0,0|3,0,0]=4
5  B8R0.23  CC(C(CC(C)=O)=O)C ACS015722 [0,0,0,0,1,0|1,0,1]=3
6  B7R0.7  C(C)OC(CNC)=O ACS011391 [2,0,0,0,0,0|2,0,0]=4
7  B7R0.7  ClCCC(CCCl)=O ACS010355 [2,0,0,0,0,0|2,0,0]=4
8  B9R0.6  CCOC(=O)C(=O)C(C)C ACS015698 [1,1,0,0,0,0|1,0,1]=4
9  B9R0.23  COC(C(CC(C)C)=O)=O ACS023857 [1,1,0,0,0,0|1,0,1]=4
10  B9R0.42  COC(CC(C(C)C)=O)=O ACS024434 [0,1,0,0,1,0|1,0,1]=4
11  B9R1.34  CC1CC(CC(C1)=O)=O ACS011622 [1,0,0,1,0,0|1,0,1]=4
12  B9R1.48  C1(CC(CCCC1)=O)=O ACS011955 [1,0,0,1,0,0|1,0,1]=4
13  B9R1.66  CC1(OCCC(C1)=O)C ACS023913 [1,0,0,1,0,0|1,0,0]=3
14  B9R1.66  FC1(CC(CCC1)=O)F ACF021886 [1,0,0,1,0,0|2,0,0]=4
15  B11R1.166  C(C)(C)C1C(CC(CC1)C)O ACS015622 [0,1,0,1,0,0|0,0,2]=4
16  B11R1.166  C[C@@H]1CC[C@H]([C@@H](C1)O)C(C)C ACS015596 [0,1,0,1,0,0|0,0,2]=4
17  B11R1.166  C[C@H]1CC[C@@H]([C@H](C1)O)C(C)C ACS015595 [0,1,0,1,0,0|0,0,2]=4
18  B7R0.5  CC(C(CC#N)=O)C ACS015725 [1,0,0,0,1,0|1,0,1]=4
19  B7R0.5  O[C@@H](C(=O)OCC)C ACS011707 [1,0,0,0,1,0|2,0,0]=4
20  B7R0.16  CN(C(=O)N(C)C)C ACS015739 [0,0,0,0,2,0|2,0,0]=4
21  B7R0.16  CN(C(C(C)C)=O)C ACS015751 [0,0,0,0,2,0|1,0,0]=3
22  B9R0.48  C(C)OC(CCC(C)Cl)=O ACS024478 [1,0,0,0,0,1|2,0,0]=4