0  B9R0.7  CC(=O)CCC(C)C(=O)O F2147-8545 [0,0,0,0,0,0|2,0,1]=3
1  B9R0.7  CC(=O)CCC(F)C(=O)O F2147-8556 [0,0,0,0,0,0|2,0,1]=3
2  B9R0.7  O=C(O)CCC(F)C(=O)O F2147-5786 [0,0,0,0,0,0|1,0,1]=2
3  B8R0.8  C=CCCC(F)C(=O)O F2147-5991 [1,0,0,0,0,0|2,0,1]=4
4  B8R0.8  C=CCCC(N)C(=O)O F8880-1233 [1,0,0,0,0,0|2,0,1]=4
5  B10R0.43  CC(=O)CCC(F)(F)C(=O)O F2147-8679 [0,1,0,0,0,0|2,0,1]=4
6  B10R0.43  O=C(O)CCC(F)(F)C(=O)O F1913-7046 [0,1,0,0,0,0|1,0,1]=3
7  B10R0.57  CON(C)C(=O)CCC(C)=O F1903-0254 [0,1,0,0,0,0|3,0,0]=4
8  B10R0.84  CCC(CCC(C)=O)C(=O)O F2147-8546 [0,1,0,0,0,0|2,0,1]=4
9  B10R0.93  CN(C)C(=O)CC(F)C(=O)O F2147-5592 [0,1,0,0,0,0|3,0,0]=4
10  B10R0.93  CN(C)C(=O)CC(N)C(=O)O F2147-6527 [0,1,0,0,0,0|3,0,0]=4
11  B10R1.58  CN1CC(C(=O)O)OC1=O F1913-7692 [0,0,0,1,0,0|2,0,0]=3
12  B10R1.81  NC(C(=O)O)C1CC(=O)C1 F2147-4771 [0,0,0,1,0,0|2,0,1]=4
13  B8R0.23  O=C(O)CC(F)C(=O)O F2147-5754 [0,0,0,0,1,0|1,0,1]=3
14  B7R0.5  O=C(O)\C(Br)=C\CO F1913-6627 [2,0,0,0,0,0|1,0,1]=4
15  B7R0.5  O=C(O)\C(F)=C\CO F1913-6626 [2,0,0,0,0,0|1,0,1]=4
16  B9R0.48  N#CNC(=O)CCC(=O)O F1202-0160 [1,1,0,0,0,0|1,0,1]=4
17  B11R0.169  C=C(CC(F)(F)C(=O)O)C(=O)O F1913-1897 [0,2,0,0,0,0|1,0,0]=3
18  B11R0.169  CC(C)(CC(F)C(=O)O)C(=O)O F1913-3713 [0,2,0,0,0,0|1,0,1]=4
19  B11R0.169  CC(CC(F)(F)C(=O)O)C(=O)O F1913-7081 [0,2,0,0,0,0|1,0,1]=4
20  B11R0.201  COC(=O)CCC(C)(C)C(=O)O F8880-0380 [0,2,0,0,0,0|1,0,1]=4
21  B9R1.23  CN1CC(C=O)OC1=O F2147-3309 [1,0,0,1,0,0|2,0,0]=4
22  B11R1.20  O=C(O)C=C1CCC(=O)CC1 F2167-8189 [0,0,0,1,0,1|2,0,0]=4
23  B11R1.743  O=C(O)C=C1CC(C(=O)O)C1 F2167-8188 [0,0,0,1,0,1|1,0,0]=3
24  B11R1.743  O=C(O)CC1CC(C(=O)O)C1 F2167-8195 [0,0,0,1,0,1|1,0,1]=4
25  B11R1.48  CCN1CC(C(=O)O)OC1=O F1913-7772 [0,1,0,1,0,0|2,0,0]=4