0  B8R0.8  C=CCSC(C)C(=O)O BB12-3266 [1,0,0,0,0,0|1,0,0]=2
1  B8R0.8  CCCCC(N)C(C)=O BB54-3218 [1,0,0,0,0,0|1,0,2]=4
2  B8R0.8  CCCC[C@H](N)C(=O)O BB12-2277 [1,0,0,0,0,0|0,0,2]=3
3  B10R0.82  NCC(O)CCC(N)C(=O)O BB57-4923 [0,1,0,0,0,0|2,0,1]=4
4  B10R0.83  COC(=O)C(N)CCCCN BB57-6122 [0,1,0,0,0,0|2,0,1]=4
5  B10R1.23  NC(C(=O)O)C1=CC=CS1 BB56-0352 [0,0,0,1,0,0|0,0,2]=3
6  B10R1.113  CC1CCCC(C(=O)O)N1 BB57-2043 [0,0,0,1,0,0|1,0,2]=4
7  B10R1.113  O=C1CSCC(C(=O)O)N1 BB01-5725 [0,0,0,1,0,0|1,0,0]=2
8  B10R1.348  O=C(O)C1CCCCCN1 BB58-3124 [0,0,0,1,0,0|1,0,2]=4
9  B10R1.363  NC1(C(=O)O)CCCCC1 BB56-0254 [0,0,0,1,0,0|1,0,2]=4
10  B7R0.4  C=CCSCC(=O)O BB12-3265 [2,0,0,0,0,0|0,0,0]=2
11  B7R0.4  CCCSCC(=O)O BB12-3263 [2,0,0,0,0,0|0,0,2]=4
12  B7R0.4  CCSCCC(=O)O BB12-3270 [2,0,0,0,0,0|0,0,1]=3
13  B7R0.5  CCSC(C)C(=O)O BB12-3261 [2,0,0,0,0,0|1,0,1]=4
14  B7R0.5  CNCC(C)C(=O)O BB12-1637 [2,0,0,0,0,0|2,0,0]=4
15  B9R0.2  CCCCSCCC(=O)O BB54-0237 [1,1,0,0,0,0|0,0,2]=4
16  B9R0.7  CC(C)=CC[C@H](N)C(=O)O BB32-0842 [1,1,0,0,0,0|0,0,2]=4
17  B9R0.7  C[S+](C)CC[C@H](N)C(=O)O BB12-2279 [1,1,0,0,0,0|1,0,1]=4
18  B9R0.7  N=C(N)NCC(N)C(=O)O BB57-4807 [1,1,0,0,0,0|2,0,0]=4
19  B9R1.41  CN1CSCC1C(=O)O BB12-1635 [1,0,0,1,0,0|1,0,1]=4
20  B9R1.35  C=C1CCC(C(=O)O)C1 BB58-5288 [1,0,0,1,0,0|1,0,0]=3
21  B9R1.35  CC1=NC(C(=O)O)CC1 BB58-2824 [1,0,0,1,0,0|0,0,2]=4
22  B9R1.35  O=C1CC(C(=O)O)CS1 BB01-0509 [1,0,0,1,0,0|2,0,0]=4
23  B9R1.163  NC1(C(=O)O)CCCC1 BB56-0255 [1,0,0,1,0,0|0,0,2]=4
24  B11R1.77  NC(CC(=O)O)C1=CC=CS1 BB01-4064 [0,0,0,1,0,1|0,0,2]=4
25  B11R1.35  NC(CC1=CC=CS1)C(=O)O BB57-4844 [0,1,0,1,0,0|0,0,1]=3
26  B11R1.89  CC1=C(C(N)C(=O)O)SC=C1 BB31-7607 [0,1,0,1,0,0|0,0,2]=4
27  B11R1.497  O=C1CCCCC(C(=O)O)N1 BB20-3012 [0,1,0,1,0,0|1,0,1]=4
28  B11R1.314  CC1=CC=C(C(N)C(=O)O)S1 BB31-8491 [0,1,0,1,0,0|0,0,2]=4