0  B6R0.2  C[C@@H](N)CC(=O)O BD703-1 [0,0,0,0,0,0|1,0,0]=1
1  B6R0.2  C[C@H](Br)CC(=O)O RC400-1 [0,0,0,0,0,0|1,0,0]=1
2  B6R0.2  C[C@H](N)CC(=O)O BL702-1 [0,0,0,0,0,0|1,0,0]=1
3  B7R0.2  CC(C)C[C@@H](N)CBr RC754-1 [0,1,0,0,0,0|2,0,1]=4
4  B7R0.2  CC(C)C[C@H](N)CBr RC753-1 [0,1,0,0,0,0|2,0,1]=4
5  B7R0.2  NC[C@@H](N)CC(=O)O RC107-1 [0,1,0,0,0,0|1,0,0]=2
6  B7R0.2  NC[C@H](N)CC(=O)O RC108-1 [0,1,0,0,0,0|1,0,0]=2
7  B7R0.2  N[C@@H](CO)CC(=O)O BL792-1 [0,1,0,0,0,0|1,0,0]=2
8  B7R0.2  N[C@H](CO)CC(=O)O BD793-1 [0,1,0,0,0,0|1,0,0]=2
9  B7R0.16  C[C@@H](N)[C@@H](N)C(=O)O RC219-1 [0,1,0,0,0,0|1,0,0]=2
10  B7R0.16  C[C@H](N)[C@@H](N)C(=O)O RC221-1 [0,1,0,0,0,0|1,0,0]=2
11  B7R0.16  C[C@H](N)[C@H](N)C(=O)O RC220-1 [0,1,0,0,0,0|1,0,0]=2
12  B6R0.1  OCC[C@H](O)CBr RC600-1 [1,1,0,0,0,0|1,0,1]=4
13  B6R0.3  C=C[C@@H](N)C(=O)O AD641-1 [1,1,0,0,0,0|0,0,2]=4
14  B6R0.3  C[C@@H](CN)C(=O)O AD1201-1 [1,1,0,0,0,0|1,0,0]=3
15  B6R0.3  C[C@H](CN)C(=O)O AL1200-1 [1,1,0,0,0,0|1,0,0]=3
16  B8R0.23  CC(C)C[C@H](Br)C(=O)O RC406-1 [0,1,0,0,0,1|0,0,0]=2
17  B8R0.23  CC(C)[C@@H](N)CC(=O)O BD823-1 [0,1,0,0,0,1|0,0,0]=2
18  B8R0.23  CC(C)[C@H](N)CC(=O)O BL822-1 [0,1,0,0,0,1|0,0,0]=2
19  B8R0.23  C[C@@H](O)[C@H](N)CC(=O)O BL742-1 [0,1,0,0,0,1|1,0,0]=3
20  B8R0.23  C[C@H](Cl)C[C@H](N)C(=O)O RC228-1 [0,1,0,0,0,1|1,0,0]=3
21  B8R0.23  N[C@@H](CC(Cl)Cl)C(=O)O RC104-1 [0,1,0,0,0,1|2,0,0]=4
22  B8R0.5  C#CC[C@@H](N)CC(=O)O HD1025-1 [0,2,0,0,0,0|1,0,0]=3
23  B8R0.5  C#CC[C@H](N)CC(=O)O HL1020-1 [0,2,0,0,0,0|1,0,0]=3
24  B8R0.5  C=CC[C@@H](N)CC(=O)O HD935-1 [0,2,0,0,0,0|1,0,0]=3
25  B8R0.5  C=CC[C@H](N)CC(=O)O HL930-1 [0,2,0,0,0,0|1,0,0]=3
26  B8R0.18  CC(C)[C@@H](CN)C(=O)O AD1221-1 [0,2,0,0,0,0|0,0,0]=2
27  B8R0.18  CC(C)[C@H](CN)C(=O)O AL1220-1 [0,2,0,0,0,0|0,0,0]=2
28  B8R1.54  N[C@@H](C(=O)O)C1CC1 AD571-1 [0,1,0,1,0,0|0,0,0]=2
29  B8R1.54  N[C@H](C(=O)O)C1CC1 AL570-1 [0,1,0,1,0,0|0,0,0]=2