0  B9R0.35  CCNC(=O)[C@H](C)NCC AIFCHEM-94595326854 [0,0,0,0,0,0|2,0,2]=4
1  B10R0.19  CCCNC(C)C(=O)OCC AIFCHEM-94569020664 [0,1,0,0,0,0|0,0,2]=3
2  B10R0.19  CCCN[C@@H](C)C(=O)NCC AIFCHEM-94569021810 [0,1,0,0,0,0|1,0,2]=4
3  B10R0.19  CCCN[C@@H](C)C(=O)OCC AIFCHEM-94569009310 [0,1,0,0,0,0|0,0,2]=3
4  B10R0.19  CCCN[C@H](C)C(=O)OCC AIFCHEM-94569020921 [0,1,0,0,0,0|0,0,2]=3
5  B10R0.19  CCCOC(=O)[C@H](C)NCC AIFCHEM-94537423256 [0,1,0,0,0,0|1,0,2]=4
6  B10R0.32  CCOC(=O)C(C)NC(=O)C AIFCHEM-94605354772 [0,1,0,0,0,0|1,0,1]=3
7  B10R0.32  CCOC(=O)[C@@H](C)NC(=O)C AIFCHEM-94605354974 [0,1,0,0,0,0|1,0,1]=3
8  B10R0.32  CCOC(=O)[C@H](C)NC(=O)C AIFCHEM-5824852203 [0,1,0,0,0,0|1,0,1]=3
9  B10R0.33  CCNC(CO)C(=O)OCC AIFCHEM-94537421127 [0,1,0,0,0,0|1,0,2]=4
10  B10R0.33  CCN[C@@H](CO)C(=O)OCC AIFCHEM-94537419414 [0,1,0,0,0,0|1,0,2]=4
11  B10R0.33  CCN[C@H](CO)C(=O)OCC AIFCHEM-94537411702 [0,1,0,0,0,0|1,0,2]=4
12  B10R1.11  CC#CC(=O)N1CC=CC1 AIFCHEM-94544854448 [0,0,0,1,0,0|2,0,1]=4
13  B10R0.2  CCNC(C)CC(=O)OCC AIFCHEM-94537422484 [0,0,0,0,0,1|1,0,2]=4
14  B10R0.2  CCN[C@@H](C)CC(=O)OCC AIFCHEM-94537417390 [0,0,0,0,0,1|1,0,2]=4
15  B9R0.5  CCNCCC(=O)OCC AIFCHEM-94537421553 [1,1,0,0,0,0|0,0,2]=4
16  B9R0.48  CCOC(=O)CNC(=O)C AIFCHEM-94605354824 [1,1,0,0,0,0|1,0,1]=4
17  B9R0.23  CCC(C)C(=O)NC(C)C AIFCHEM-94520543685 [1,1,0,0,0,0|1,0,1]=4
18  B9R0.23  CC[C@@H](C)C(=O)NC(C)C AIFCHEM-94520548085 [1,1,0,0,0,0|1,0,1]=4
19  B9R0.23  CC[C@H](C)C(=O)NC(C)C AIFCHEM-94520545874 [1,1,0,0,0,0|1,0,1]=4
20  B9R0.23  COC(=O)C(C)NC(=O)C AIFCHEM-94605343939 [1,1,0,0,0,0|1,0,1]=4
21  B9R0.23  COC(=O)[C@@H](C)NC(=O)C AIFCHEM-94605345110 [1,1,0,0,0,0|1,0,1]=4
22  B9R0.23  COC(=O)[C@H](C)NC(=O)C AIFCHEM-94535594545 [1,1,0,0,0,0|1,0,1]=4
23  B11R0.43  CCOC(=O)C(C)CN(C)CC AIFCHEM-94563257774 [0,2,0,0,0,0|0,0,2]=4
24  B11R0.68  CCCOC(=O)[C@H](C)NC(=O)C AIFCHEM-94605354515 [0,2,0,0,0,0|1,0,1]=4
25  B11R0.155  CCCNCC(C)C(=O)OCC AIFCHEM-94521368687 [0,2,0,0,0,0|0,0,2]=4
26  B11R0.247  CCNCC(C)(C)C(=O)OCC AIFCHEM-94537425576 [0,2,0,0,0,0|0,0,2]=4
27  B11R0.56  CCOC(=O)C(CC)NC(=O)C AIFCHEM-94605354175 [0,2,0,0,0,0|1,0,1]=4
28  B11R0.56  CCOC(=O)[C@H](CC)NC(=O)C AIFCHEM-5871708794 [0,2,0,0,0,0|1,0,1]=4
29  B11R0.240  CCOC(=O)C(C)(C)NC(=O)C AIFCHEM-5966794738 [0,2,0,0,0,0|1,0,1]=4
30  B11R1.30  CSCC(=O)NC1CC=CC1 AIFCHEM-5665994489 [0,0,0,1,0,1|2,0,0]=4
31  B11R1.29  C#CCNC(=O)C1CC=CC1 AIFCHEM-6236658431 [0,1,0,1,0,0|1,0,1]=4
32  B11R1.287  CCCNC(=O)C1CC(=O)C1 AIFCHEM-5791280012 [0,1,0,1,0,0|2,0,0]=4
33  B11R1.31  CCN(C)C(=O)C1CC=CC1 AIFCHEM-94563269557 [0,1,0,1,0,0|1,0,0]=3