0  B8R1.18  CC1=CC(=O)C(C)O1 HY-W010553 [0,0,0,0,0,0|2,0,1]=3
1  B8R1.18  CC1=CC(C)=NN1C HY-N7086 [0,0,0,0,0,0|2,0,2]=4
2  B8R1.18  CC1=NC(C)=C(C)S1 HY-W100945 [0,0,0,0,0,0|0,1,2]=3
3  B7R1.2  CC1=NN(C)C=C1 HY-W002168 [1,0,0,0,0,0|2,0,1]=4
4  B7R1.2  CC1CCC(=O)O1 HY-W015938 [1,0,0,0,0,0|3,0,0]=4
5  B7R1.4  CC1=CNN=C1C HY-W019334 [1,0,0,0,0,0|2,0,1]=4
6  B9R1.37  CC1=C(O)C(=O)C(C)O1 HY-N7093 [0,1,0,0,0,0|2,0,1]=4
7  B7R0.2  CCC(C)CC(C)N HY-W015593 [0,0,1,0,0,0|1,0,2]=4
8  B7R0.2  CCC(C)OC(C)=O HY-158759 [0,0,1,0,0,0|1,0,2]=4
9  B7R0.2  [C@@H](C)(O)CC(=O)OC HY-W012885 [0,0,1,0,0,0|3,0,0]=4
10  B7R0.2  [C@H](C)(O)CC(=O)OC HY-W010507 [0,0,1,0,0,0|3,0,0]=4
11  B7R0.5  CCCC(C)C(=O)O HY-W010516 [0,0,1,0,0,0|3,0,0]=4
12  B7R0.5  CCOC(=O)C(C)=O HY-Y1362 [0,0,1,0,0,0|2,0,1]=4
13  B7R0.5  CCOC(=O)[C@@H](C)N HY-W017350 [0,0,1,0,0,0|3,0,0]=4
14  B7R0.5  CCOC(=O)[C@H](C)N HY-I0517 [0,0,1,0,0,0|3,0,0]=4
15  B7R0.5  CC\C=C(/C)C(=O)O HY-W010533 [0,0,1,0,0,0|2,0,1]=4
16  B9R1.69  CC1=CN=C(C)C(C)=N1 HY-W010476 [0,0,0,0,0,1|1,0,2]=4
17  B6R0.4  CCOCC(=O)O HY-W027555 [1,0,1,0,0,0|2,0,0]=4
18  B6R0.3  CON(C)C(C)=O HY-W001095 [1,0,1,0,0,0|2,0,0]=4
19  B6R1.2  O=C1CCOC1 HY-33900 [2,0,0,0,0,0|2,0,0]=4
20  B8R0.5  CCOC(=O)CC(C)O HY-W012701 [0,1,1,0,0,0|2,0,0]=4
21  B8R0.5  CCOC(=O)C[C@H](C)O HY-W076441 [0,1,1,0,0,0|2,0,0]=4
22  B8R0.3  CCOC(=O)C(O)CC HY-W127500 [0,1,1,0,0,0|2,0,0]=4
23  B8R1.5  CC1CCCCC1=O HY-W010549 [0,0,1,1,0,0|2,0,0]=4
24  B8R1.7  O=C(O)[C@H]1CCCO1 HY-W005223 [0,0,1,1,0,0|2,0,0]=4