0  B9R0.7  CC(Cl)C(=O)NCC(=O)O SC-73815 [0,0,0,0,0,0|1,0,2]=3
1  B9R0.7  CC(S)C(=O)NCC(=O)O SC-26620 [0,0,0,0,0,0|0,0,2]=2
2  B8R0.9  CCC(=O)CCC(=O)O SC-58454 [1,0,0,0,0,0|1,0,1]=3
3  B8R0.9  COC(=O)NCC(=O)O SC-01599 [1,0,0,0,0,0|1,0,2]=4
4  B8R0.9  NCC(=O)CCC(=O)O SC-15622 [1,0,0,0,0,0|2,0,1]=4
5  B8R0.9  NCC(=O)CCC(=O)O SC-18502 [1,0,0,0,0,0|2,0,1]=4
6  B10R0.57  NC(CS)C(=O)NCC(=O)O SC-B1610 [0,1,0,0,0,0|1,0,2]=4
7  B10R0.93  C[C@@H](N)C(=O)N[C@H](C)C(=O)O SC-90279 [0,1,0,0,0,0|1,0,2]=4
8  B10R1.58  CC1=C(C)SC(C(=O)O)=N1 SC-72107 [0,0,0,1,0,0|1,0,2]=4
9  B8R0.23  CC(=O)CC(O)[C@H](C)N SC-76554 [0,0,0,0,1,0|2,0,1]=4
10  B7R0.4  CCCNCC(=O)O SC-97541 [2,0,0,0,0,0|0,0,2]=4
11  B7R0.4  CCCSCC(=O)O SC-45283 [2,0,0,0,0,0|1,0,1]=4
12  B7R0.4  C\C=C\CCC(=O)O SC-21245 [2,0,0,0,0,0|1,0,1]=4
13  B7R0.6  O=C(O)CCC(=O)O SC-47173 [2,0,0,0,0,0|1,1,0]=4
14  B9R0.48  CCOC(=O)CCC(=O)O SC-48671 [1,1,0,0,0,0|1,0,1]=4
15  B9R0.79  CC(C)C(O)C(N)C(=O)O SC-48909 [0,1,0,0,1,0|1,0,1]=4
16  B7R0.2  CCC(C)CC(=O)O SC-19132 [1,0,0,0,1,0|1,0,1]=4
17  B7R0.2  CCC(N)CC(=O)O SC-59260 [1,0,0,0,1,0|1,0,1]=4
18  B7R0.2  CCC(O)CC(C)=O SC-92943 [1,0,0,0,1,0|1,0,1]=4
19  B7R0.2  COC(=O)CC(=O)O SC-21351 [1,0,0,0,1,0|1,0,1]=4
20  B7R0.2  NCC(O)CC(=O)O SC-50844 [1,0,0,0,1,0|1,0,1]=4
21  B7R0.16  CC(C)C(=O)C(=O)O SC-27422 [0,0,0,0,2,0|1,0,1]=4
22  B7R0.16  CC(C)C(O)C(=O)O SC-A2103 [0,0,0,0,2,0|1,0,1]=4
23  B7R0.16  CC(C)[C@@H](O)C(=O)O SC-01716 [0,0,0,0,2,0|1,0,1]=4