0  B8R0.1  CCC#CC(=O)OCC X3933 [1,0,0,0,0,0|0,0,2]=3
1  B8R0.6  CCCCCC(=O)SC U833 [1,0,0,0,0,0|0,1,2]=4
2  B8R0.6  C\C=C\C=C\C(=O)OC 8249AL [1,0,0,0,0,0|0,0,2]=3
3  B10R0.2  CCCC(=O)CC(=O)CCC 7298AJ [0,1,0,0,0,0|1,0,1]=3
4  B10R0.91  C=CCOC(=O)\C=C\C=C\C 8104AF [0,1,0,0,0,0|0,0,3]=4
5  B10R0.108  C=CC(=O)CCC(=O)OCC X3763 [0,1,0,0,0,0|0,0,3]=4
6  B10R0.108  CCOC(=O)CNC(C)CC Q883 [0,1,0,0,0,0|1,0,1]=3
7  B10R1.11  CCOC(=O)C1CCNC1 1325AC [0,0,0,1,0,0|1,0,1]=3
8  B10R1.11  CCOC(=O)C1CSCN1 U951 [0,0,0,1,0,0|2,0,1]=4
9  B10R1.135  CCOC(=O)[C@H]1C[C@@H]1CO 2720AE [0,0,0,1,0,0|1,0,2]=4
10  B7R0.3  CCC(=O)\C=C\C=O Z6191 [2,0,0,0,0,0|1,0,1]=4
11  B7R0.3  CC\C=C\C(=O)OC Y2122 [2,0,0,0,0,0|0,0,0]=2
12  B7R0.3  COC(=O)CCCO 3568AL [2,0,0,0,0,0|1,0,1]=4
13  B7R0.3  COC(=O)\C=C\C=O 1381AC [2,0,0,0,0,0|1,0,1]=4
14  B7R0.7  CCCC(=S)OCC R545 [2,0,0,0,0,0|0,1,0]=3
15  B7R0.7  CCCS(=O)CCC 7566AF [2,0,0,0,0,0|2,0,0]=4
16  B7R0.7  CCNC(=O)OCC 7331AF [2,0,0,0,0,0|1,0,0]=3
17  B7R0.7  CCOC(=O)CCN 5625AC [2,0,0,0,0,0|1,0,0]=3
18  B9R0.18  CCCOC(=O)OCCC 7800AF [1,1,0,0,0,0|1,0,1]=4
19  B9R0.35  CCCC(O)C(=O)OCC 7801AF [1,1,0,0,0,0|0,0,1]=3
20  B9R0.35  CCOC(=O)C(C)NC=O Z3188 [1,1,0,0,0,0|2,0,0]=4
21  B9R0.35  CCOC(=O)\C([O-])=C\C#N 4495AJ [1,1,0,0,0,0|1,0,1]=4
22  B9R0.48  CCOC(=O)\C=C\C(=O)Cl V0861 [1,1,0,0,0,0|1,0,1]=4
23  B11R0.5  CCCCC(N)CC(=O)OCC X2051 [0,2,0,0,0,0|0,0,2]=4
24  B9R1.73  CCOC(=O)C1CNC1 2387AC [1,0,0,1,0,0|1,0,1]=4
25  B9R1.183  CCOC(=O)[C@@H]1O[C@@H]1C O019 [1,0,0,1,0,0|1,0,0]=3
26  B9R1.11  COC(=O)C1CCNC1 W9847 [1,0,0,1,0,0|1,0,1]=4
27  B9R1.11  COC(=O)C1CSC=N1 B236 [1,0,0,1,0,0|2,0,0]=4
28  B9R1.11  COC(=O)[C@H]1CCCN1 5950AB [1,0,0,1,0,0|1,0,1]=4
29  B11R1.16  CCOC(=O)C1CNCCN1 Y4613 [0,1,0,1,0,0|1,0,1]=4
30  B11R1.199  CCOC(=O)C1CNCC1=O 5664AB [0,1,0,1,0,0|1,0,1]=4
31  B11R1.199  CCOC(=O)[C@@H]1CCC[C@@H]1N 6807AJ [0,1,0,1,0,0|0,0,2]=4
32  B11R1.289  CCOC(=O)CCN1CCC1 2070AC [0,1,0,1,0,0|0,0,2]=4