0  B6R0.2  C[C@@H](N)CC(=O)O BD703-1 [0,0,0,0,0,0|2,0,0]=2
1  B6R0.2  C[C@H](Br)CC(=O)O RC400-1 [0,0,0,0,0,0|2,0,0]=2
2  B6R0.2  C[C@H](N)CC(=O)O BL702-1 [0,0,0,0,0,0|2,0,0]=2
3  B7R0.2  CC(C)C[C@@H](N)CBr RC754-1 [0,1,0,0,0,0|1,0,1]=3
4  B7R0.2  CC(C)C[C@H](N)CBr RC753-1 [0,1,0,0,0,0|1,0,1]=3
5  B7R0.2  NC[C@@H](N)CC(=O)O RC107-1 [0,1,0,0,0,0|2,0,0]=3
6  B7R0.2  NC[C@H](N)CC(=O)O RC108-1 [0,1,0,0,0,0|2,0,0]=3
7  B7R0.2  N[C@@H](CO)CC(=O)O BL792-1 [0,1,0,0,0,0|2,0,0]=3
8  B7R0.2  N[C@H](CO)CC(=O)O BD793-1 [0,1,0,0,0,0|2,0,0]=3
9  B7R0.16  C[C@@H](N)[C@@H](N)C(=O)O RC219-1 [0,1,0,0,0,0|2,0,0]=3
10  B7R0.16  C[C@H](N)[C@@H](N)C(=O)O RC221-1 [0,1,0,0,0,0|2,0,0]=3
11  B7R0.16  C[C@H](N)[C@H](N)C(=O)O RC220-1 [0,1,0,0,0,0|2,0,0]=3
12  B5R0.5  C[C@@H](N)[C@@H](C)N RC887-1 [0,0,0,0,1,0|2,0,1]=4
13  B5R0.5  C[C@H](N)[C@H](C)N RC888-1 [0,0,0,0,1,0|2,0,1]=4
14  B6R0.3  C[C@@H](CN)C(=O)O AD1201-1 [1,1,0,0,0,0|2,0,0]=4
15  B6R0.3  C[C@H](CN)C(=O)O AL1200-1 [1,1,0,0,0,0|2,0,0]=4
16  B8R0.23  CC(C)C[C@H](Br)C(=O)O RC406-1 [0,1,0,0,0,1|1,0,0]=3
17  B8R0.23  CC(C)[C@@H](N)CC(=O)O BD823-1 [0,1,0,0,0,1|1,0,0]=3
18  B8R0.23  CC(C)[C@H](N)CC(=O)O BL822-1 [0,1,0,0,0,1|1,0,0]=3
19  B8R0.23  C[C@@H](O)[C@H](N)CC(=O)O BL742-1 [0,1,0,0,0,1|2,0,0]=4
20  B8R0.23  C[C@H](Cl)C[C@H](N)C(=O)O RC228-1 [0,1,0,0,0,1|2,0,0]=4
21  B8R0.5  C#CC[C@@H](N)CC(=O)O HD1025-1 [0,2,0,0,0,0|2,0,0]=4
22  B8R0.5  C#CC[C@H](N)CC(=O)O HL1020-1 [0,2,0,0,0,0|2,0,0]=4
23  B8R0.5  C=CC[C@@H](N)CC(=O)O HD935-1 [0,2,0,0,0,0|2,0,0]=4
24  B8R0.5  C=CC[C@H](N)CC(=O)O HL930-1 [0,2,0,0,0,0|2,0,0]=4
25  B8R0.24  CC[C@H](C)OS(C)(=O)=O RC601-1 [0,2,0,0,0,0|2,0,0]=4
26  B8R0.18  CC(C)[C@@H](CN)C(=O)O AD1221-1 [0,2,0,0,0,0|1,0,0]=3
27  B8R0.18  CC(C)[C@H](CN)C(=O)O AL1220-1 [0,2,0,0,0,0|1,0,0]=3
28  B6R1.2  Br[C@H]1CCNC1 RC764-1 [1,0,0,1,0,0|2,0,0]=4
29  B8R1.54  N[C@@H](C(=O)O)C1CC1 AD571-1 [0,1,0,1,0,0|1,0,0]=3
30  B8R1.54  N[C@H](C(=O)O)C1CC1 AL570-1 [0,1,0,1,0,0|1,0,0]=3