0  B9R0.7  NC(CCC(=O)O)C(=O)O CS-W022635 [0,0,0,0,0,0|1,0,0]=1
1  B8R0.8  CCCCC(N)C(=O)O CS-W013425 [1,0,0,0,0,0|1,0,1]=3
2  B8R0.28  CN(C)CCCC(=O)O CS-W007989 [1,0,0,0,0,0|3,0,0]=4
3  B10R1.13  O=C1CCC(C(=O)O)CC1 CS-W004786 [0,0,0,1,0,0|2,0,0]=3
4  B8R0.23  CC(=O)N[C@H](C)C(=O)O CS-W013429 [0,0,0,0,1,0|3,0,0]=4
5  B8R0.23  NC(CC(=O)O)C(=O)O CS-W016540 [0,0,0,0,1,0|1,0,0]=2
6  B8R0.23  O=C(O)CC(S)C(=O)O CS-W010986 [0,0,0,0,1,0|2,0,0]=3
7  B7R0.5  C#CC[C@H](N)C(=O)O CS-0101207 [2,0,0,0,0,0|0,0,2]=4
8  B7R0.5  NC(CCO)C(=O)O CS-W013586 [2,0,0,0,0,0|0,0,1]=3
9  B7R0.5  [C@H](N)(CC=C)C(=O)O CS-W013622 [2,0,0,0,0,0|0,0,1]=3
10  B7R0.6  NC(=O)CCC(=O)O CS-0094544 [2,0,0,0,0,0|1,0,1]=4
11  B9R0.53  CN(CC(=O)O)CC(=O)O CS-W007872 [1,1,0,0,0,0|2,0,0]=4
12  B9R0.11  CC(C)(CC(=O)O)C(=O)O CS-W016357 [0,1,0,0,1,0|2,0,0]=4
13  B9R1.35  O=C(O)C1CCC(O)=N1 CS-W013454 [1,0,0,1,0,0|0,0,2]=4
14  B9R1.35  O=C1CC[C@H](C(=O)O)O1 CS-W021140 [1,0,0,1,0,0|1,0,0]=3
15  B9R1.163  C[C@@]1(C(=O)O)CCCN1 CS-M1378 [1,0,0,1,0,0|1,0,1]=4