0  B9R0.39  CC(C)C[C@@H](CN)C(=O)O 5356AA [0,0,0,0,0,0|3,0,1]=4
1  B9R0.39  CC(C)C[C@H](CN)C(=O)O 5990AA [0,0,0,0,0,0|3,0,1]=4
2  B9R0.39  CN[C@H](CC(N)=O)C(=O)O 0546AP [0,0,0,0,0,0|4,0,0]=4
3  B8R0.23  CC(=O)CC(N)C(=O)O 6118AB [1,0,0,0,0,0|2,0,0]=3
4  B10R0.23  C#CCC(NC(C)=O)C(=O)O 3694AL [0,1,0,0,0,0|1,0,0]=2
5  B8R0.18  CC(C)[C@@H](CN)C(=O)O 5651AC [0,0,0,0,1,0|2,0,1]=4
6  B8R0.18  CC(C)[C@H](CN)C(=O)O 5355AA [0,0,0,0,1,0|2,0,1]=4
7  B8R0.18  CCC(C(C)=O)C(C)=O 4805AD [0,0,0,0,1,0|2,0,0]=3
8  B7R0.15  CCC(NC)C(N)=O 1348AD [2,0,0,0,0,0|2,0,0]=4
9  B7R0.15  CNC(CS)C(=O)O 4317AD [2,0,0,0,0,0|0,0,0]=2
10  B9R0.42  C=CC(=O)NC(O)C(=O)O 0275AB [1,1,0,0,0,0|0,1,1]=4
11  B9R0.42  COC(=O)CC(O)C(=O)O W1885 [1,1,0,0,0,0|1,1,0]=4
12  B9R0.42  COC(=O)C[C@@H](C)C(=O)O 2589AC [1,1,0,0,0,0|1,0,0]=3
13  B9R0.79  C[C@H](C(=O)O)[C@@H](C)C(=O)O X7354 [1,1,0,0,0,0|2,0,0]=4
14  B9R0.79  C[C@H](C(=O)O)[C@H](N)C(=O)O 9056AB [1,1,0,0,0,0|2,0,0]=4
15  B11R0.39  COC(=O)C(CCBr)OC(C)=O 6938AJ [0,2,0,0,0,0|2,0,0]=4
16  B11R0.160  CCCCC(NC(C)=O)C(C)=O 3108AB [0,2,0,0,0,0|2,0,0]=4
17  B9R1.6  NC(=O)C1CSCCN1 0892AA [1,0,0,1,0,0|1,0,1]=4
18  B9R1.6  O=C(O)C1CSCCN1 Z5417 [1,0,0,1,0,0|0,0,1]=3
19  B9R1.22  CCC1NC(=O)NC1=O 9537AJ [1,0,0,1,0,0|2,0,0]=4
20  B9R1.35  O=C1NCC(C(=O)O)N1 5596AJ [1,0,0,1,0,0|1,0,0]=3
21  B11R1.178  CC(=O)N1CCCC1C(N)=O W5256 [0,1,0,1,0,0|2,0,0]=4
22  B7R0.16  CC(=O)C(F)C(C)=O 1795AC [1,0,0,0,1,0|2,0,0]=4
23  B7R0.16  CC(=O)C(N)C(=O)O 0001AC [1,0,0,0,1,0|1,0,0]=3
24  B9R0.7  CC(CCC(=O)O)C(=O)O 5731AL [1,0,0,0,0,1|2,0,0]=4
25  B9R0.7  C\C(=N/NC(N)=O)C(=O)O 8890AD [1,0,0,0,0,1|1,0,1]=4
26  B9R0.53  CC(=O)NC(C)CC(=O)O 4009AD [1,0,0,0,0,1|0,0,0]=2
27  B11R0.143  CC(=O)NCC(CCl)OC(C)=O Z3395 [0,0,0,0,0,2|2,0,0]=4