0  B8R0.23  CC(=O)NC(C)C(=O)N AIFCHEM-94535599646 [0,0,1,0,0,0|1,0,0]=2
1  B8R0.23  CC(=O)N[C@@H](C)C(=O)N AIFCHEM-5693016542 [0,0,1,0,0,0|1,0,0]=2
2  B8R0.23  CC(=O)N[C@H](C)C(=O)N AIFCHEM-94605355705 [0,0,1,0,0,0|1,0,0]=2
3  B8R0.28  CC(=O)NCCC(=O)N AIFCHEM-94535598360 [0,0,1,0,0,0|2,0,0]=3
4  B10R1.113  CC(=O)N1CCOC(=O)C1 AIFCHEM-94605353273 [0,0,0,0,0,1|3,0,0]=4
5  B7R0.5  CCNC(C)C(=O)N AIFCHEM-94537421902 [1,0,1,0,0,0|1,0,1]=4
6  B7R0.5  CCNC(C)C(=O)O AIFCHEM-94537419943 [1,0,1,0,0,0|0,0,1]=3
7  B7R0.5  CCN[C@@H](C)C(=O)N AIFCHEM-94537424903 [1,0,1,0,0,0|1,0,1]=4
8  B7R0.5  CCN[C@@H](C)C(=O)O AIFCHEM-94576654329 [1,0,1,0,0,0|0,0,1]=3
9  B7R0.5  CCN[C@H](C)C(=O)N AIFCHEM-94537424731 [1,0,1,0,0,0|1,0,1]=4
10  B7R0.5  CCN[C@H](C)C(=O)O AIFCHEM-94537420413 [1,0,1,0,0,0|0,0,1]=3
11  B7R0.2  C#CC(C)NC(=O)C AIFCHEM-94535596408 [1,0,1,0,0,0|1,0,1]=4
12  B7R0.2  C#C[C@H](C)NC(=O)C AIFCHEM-6073028223 [1,0,1,0,0,0|1,0,1]=4
13  B9R0.24  CCC(=O)NCC(=O)NC AIFCHEM-94562554628 [0,1,1,0,0,0|1,0,0]=3
14  B9R0.48  C#CCC(=O)NCC(=O)C AIFCHEM-6058057148 [0,1,1,0,0,0|1,0,1]=4
15  B9R0.48  CC(=O)CNC(=O)CC#N AIFCHEM-94559920944 [0,1,1,0,0,0|1,0,1]=4
16  B9R0.12  CCNC(CC)C(=O)OC AIFCHEM-94537425270 [0,1,1,0,0,0|1,0,1]=4
17  B9R0.12  CCN[C@@H](CC)C(=O)OC AIFCHEM-94537422943 [0,1,1,0,0,0|1,0,1]=4
18  B9R0.12  CCN[C@H](CC)C(=O)OC AIFCHEM-94537426061 [0,1,1,0,0,0|1,0,1]=4
19  B9R0.15  CCNC(CSC)C(=O)O AIFCHEM-94537425325 [0,1,1,0,0,0|1,0,1]=4
20  B9R0.15  CCN[C@@H](CSC)C(=O)O AIFCHEM-94537412877 [0,1,1,0,0,0|1,0,1]=4
21  B9R0.1  C#CC(=O)NCCC(=O)N AIFCHEM-94525200835 [0,1,1,0,0,0|2,0,0]=4
22  B9R0.1  COC(=O)CCNC(=O)C AIFCHEM-94535595323 [0,1,1,0,0,0|2,0,0]=4
23  B11R1.39  O=C1CC(CN1)NC(=O)CO AIFCHEM-94532678536 [0,1,0,0,0,1|2,0,0]=4
24  B11R1.39  O=C1C[C@H](CN1)NC(=O)CO AIFCHEM-94532678893 [0,1,0,0,0,1|2,0,0]=4
25  B11R1.23  O=C1CN(CCO1)C(=O)CO AIFCHEM-94532682702 [0,1,0,0,0,1|2,0,0]=4
26  B11R1.225  C[C@@H]1CC(=O)CN1C(=O)CO AIFCHEM-94532680944 [0,2,0,0,0,0|2,0,0]=4
27  B9R0.14  CCNC(CC)CC(=O)O AIFCHEM-94537417368 [0,0,1,0,0,1|1,0,1]=4
28  B9R0.14  CCN[C@@H](CC)CC(=O)O AIFCHEM-94537417981 [0,0,1,0,0,1|1,0,1]=4
29  B11R1.20  CC(=O)NC1CCC(=O)NC1 AIFCHEM-94535590061 [0,0,0,0,0,2|1,0,0]=3
30  B11R1.20  CC(=O)N[C@H]1CCC(=O)NC1 AIFCHEM-94605335380 [0,0,0,0,0,2|1,0,0]=3
31  B11R1.157  CC(=O)NC1CCNC(=O)C1 AIFCHEM-94535591877 [0,0,0,0,0,2|2,0,0]=4