0  B9R0.7  CC(CNC(=O)N)C(=O)O A2Z00049561 [0,0,0,0,0,0|2,0,0]=2
1  B8R0.8  CC(C(=O)O)OCCN A2Z00070299 [1,0,0,0,0,0|2,0,1]=4
2  B8R0.8  CSCCC(C(=O)O)N A2Z00093547 [1,0,0,0,0,0|2,0,0]=3
3  B8R0.28  CC(=O)NCCC(=O)O A2Z00046392 [1,0,0,0,0,0|2,0,0]=3
4  B10R1.13  C1CC(=O)NN=C1C(=O)O A2Z00083466 [0,0,0,1,0,0|0,0,2]=3
5  B10R1.13  C1CC(NCC1O)C(=O)O A2Z00049742 [0,0,0,1,0,0|1,0,2]=4
6  B10R1.359  C1CS(=O)(=O)CC1C(=O)O A2Z00083335 [0,0,0,1,0,0|3,0,0]=4
7  B10R1.470  CC1(CC(=O)NC1)C(=O)O A2Z00096322 [0,0,0,1,0,0|3,0,0]=4
8  B8R0.23  CC(=O)CC(C(=O)O)N A2Z00050345 [0,0,0,0,1,0|1,0,0]=2
9  B10R0.98  C(CC(C(=O)O)N)CC(=O)O A2Z00096299 [0,0,0,0,0,1|1,0,0]=2
10  B7R0.4  C(CCS)CC(=O)O A2Z00070146 [2,0,0,0,0,0|0,1,1]=4
11  B7R0.4  C(CSCC(=O)O)N A2Z00070138 [2,0,0,0,0,0|1,0,1]=4
12  B7R0.4  C=CCSCC(=O)O A2Z00097871 [2,0,0,0,0,0|2,0,0]=4
13  B7R0.4  CSCCCC(=O)O A2Z00070144 [2,0,0,0,0,0|2,0,0]=4
14  B9R0.1  C(CC(=O)CN)CC(=O)O A2Z00050332 [1,1,0,0,0,0|0,0,0]=2
15  B9R0.1  COC(=O)CCCC(=O)Cl A2Z00094387 [1,1,0,0,0,0|1,0,0]=3
16  B9R0.1  COC(=O)CCC[N+](=O)[O-] A2Z00096316 [1,1,0,0,0,0|2,0,0]=4
17  B9R0.1  COC(=O)CCNC(=O)N A2Z00050193 [1,1,0,0,0,0|1,0,0]=3
18  B9R0.53  C(C(=O)O)N(CC(=O)O)N A2Z00049600 [1,1,0,0,0,0|2,0,0]=4
19  B9R0.56  CS(=O)(=O)CCCC(=O)O A2Z00070145 [1,1,0,0,0,0|2,0,0]=4
20  B9R0.39  C(C(CN)C(=O)O)C(=O)O A2Z00096527 [0,1,0,0,1,0|1,0,0]=3
21  B9R0.79  CC(C(C(=O)O)O)C(=O)O A2Z00049599 [0,1,0,0,1,0|2,0,0]=4
22  B9R1.161  C1[C@@H]([C@H]1C(=O)O)C(=O)O A2Z00096513 [1,0,0,1,0,0|1,0,0]=3