0  B8R0.9  C(CC(=O)O)C(=O)CN A2Z00096158 [0,0,0,0,0,0|2,0,2]=4
1  B7R0.4  C(CCS)CC(=O)O A2Z00070146 [1,0,0,0,0,0|1,0,1]=3
2  B7R0.4  C(CSCC(=O)O)N A2Z00070138 [1,0,0,0,0,0|2,0,1]=4
3  B7R0.4  C=CCSCC(=O)O A2Z00097871 [1,0,0,0,0,0|1,0,0]=2
4  B7R0.4  CC(=O)CCCC#N A2Z00097349 [1,0,0,0,0,0|2,0,1]=4
5  B7R0.4  CSCCCC(=O)O A2Z00070144 [1,0,0,0,0,0|1,0,1]=3
6  B7R0.6  CC(C)SCC(=O)O A2Z00055812 [1,0,0,0,0,0|2,0,1]=4
7  B7R0.6  CN(C)CCC(=O)O A2Z00094718 [1,0,0,0,0,0|2,0,1]=4
8  B7R0.2  CCC(CC(=O)O)N A2Z00050458 [0,0,0,0,1,0|0,0,2]=3
9  B6R0.4  C(CC(=O)N)CCl A2Z00070345 [2,0,0,0,0,0|2,0,0]=4
10  B6R0.4  C=CCOC(=O)Cl A2Z00093512 [2,0,0,0,0,0|2,0,0]=4
11  B6R0.4  CC(=O)CCCCl A2Z00094593 [2,0,0,0,0,0|2,0,0]=4
12  B8R0.7  CCCCCCC(=O)O A2Z00093531 [1,1,0,0,0,0|0,0,2]=4
13  B8R0.7  CCCNCCC(=O)O A2Z00070008 [1,1,0,0,0,0|0,0,2]=4
14  B8R0.7  CCCNCCC(=O)O A2Z00070304 [1,1,0,0,0,0|0,0,2]=4
15  B8R0.28  CC(=O)NCCC(=O)O A2Z00046392 [1,1,0,0,0,0|1,0,1]=4
16  B8R0.23  CC(C)C(CC(=O)O)O A2Z00049174 [1,1,0,0,0,0|1,0,1]=4
17  B8R0.16  C(C(CN)CO)C(=O)O A2Z00050494 [0,1,0,0,1,0|1,0,1]=4
18  B10R0.98  C(CC(C(=O)O)N)CC(=O)O A2Z00096299 [0,1,0,0,0,1|1,0,0]=3
19  B8R1.7  C1CNCC1C(=O)O A2Z00096244 [1,0,0,1,0,0|1,0,1]=4
20  B8R1.34  C1C(CO1)CC(=O)O A2Z00096243 [1,0,0,1,0,0|1,0,1]=4
21  B10R1.66  c1cc([nH]c1)CCC(=O)O A2Z00094982 [0,1,0,1,0,0|0,0,1]=3
22  B10R1.66  c1cc(oc1)CCC(=O)O A2Z00095303 [0,1,0,1,0,0|1,0,1]=4
23  B10R1.66  c1cc(sc1)CCC(=O)O A2Z00095188 [0,1,0,1,0,0|1,0,1]=4
24  B6R0.3  C(C(C(=O)O)N)O A2Z00096658 [0,0,0,0,2,0|1,0,1]=4