0  B5R0.2  NCC#CCCl CP27461 [0,0,0,0,0,0|2,0,2]=4
1  B6R0.1  CCOC(=O)CN CP00918 [0,1,0,0,0,0|2,0,1]=4
2  B6R0.1  COC(=O)CCN CP02305 [0,1,0,0,0,0|2,0,1]=4
3  B5R0.1  CNCC(=O)O CP09001 [1,1,0,0,0,0|1,0,1]=4
4  B5R0.1  NCCC(=O)O CP02301 [1,1,0,0,0,0|1,0,1]=4
5  B5R0.1  O=C(O)CCS CP25144 [1,1,0,0,0,0|1,0,1]=4
6  B7R0.2  CC(C)C[C@H](N)CO CP27433 [0,2,0,0,0,0|0,0,0]=2
7  B7R0.2  NCC(N)CC(=O)O CP05401 [0,2,0,0,0,0|1,0,1]=4
8  B7R0.2  NC[C@@H](N)CC(=O)O CP05403 [0,2,0,0,0,0|1,0,1]=4
9  B7R0.2  NC[C@H](N)CC(=O)O CP05402 [0,2,0,0,0,0|1,0,1]=4
10  B7R0.2  N[C@@H](CO)CC(=O)O CP25431 [0,2,0,0,0,0|1,0,1]=4
11  B7R0.2  N[C@H](CO)CC(=O)O CP25432 [0,2,0,0,0,0|1,0,1]=4
12  B7R0.3  CSCC[C@H](N)CO CP26964 [0,2,0,0,0,0|0,0,0]=2
13  B7R0.5  CCC[C@@H](N)C(=O)O CP25568 [0,2,0,0,0,0|0,0,1]=3
14  B7R0.5  CCC[C@H](N)C(=O)O CP08602 [0,2,0,0,0,0|0,0,1]=3
15  B7R0.5  CCC[C@H](N)C(N)=O CP26135 [0,2,0,0,0,0|0,0,2]=4
16  B7R0.5  CSC[C@H](N)C(=O)O CP08101 [0,2,0,0,0,0|1,0,1]=4
17  B7R0.5  NC(CCO)C(=O)O CP06601 [0,2,0,0,0,0|1,0,1]=4
18  B7R0.5  NCCC(N)C(=O)O CP05302 [0,2,0,0,0,0|1,0,1]=4
19  B7R0.5  NCC[C@@H](N)C(=O)O CP05301 [0,2,0,0,0,0|1,0,1]=4
20  B7R0.5  NCC[C@@H](N)C(=O)O CP05304 [0,2,0,0,0,0|1,0,1]=4
21  B7R0.5  N[C@@H](CCO)C(=O)O CP06602 [0,2,0,0,0,0|1,0,1]=4
22  B7R0.5  N[C@@H](CCS)C(=O)O CP06302 [0,2,0,0,0,0|1,0,1]=4
23  B7R0.5  N[C@H](CCO)C(=O)O CP25926 [0,2,0,0,0,0|1,0,1]=4
24  B7R0.7  CCOC(=O)CCN CP02304 [0,2,0,0,0,0|1,0,1]=4
25  B7R0.10  CC[C@H](C)[C@H](N)CO CP26323 [0,2,0,0,0,0|0,0,0]=2
26  B7R0.10  COC(=O)[C@@H](N)CO CP01842 [0,2,0,0,0,0|1,0,1]=4
27  B7R0.10  COC(=O)[C@H](N)CO CP25918 [0,2,0,0,0,0|1,0,1]=4
28  B7R0.10  O[C@H](CS)[C@@H](O)CS CP27365 [0,2,0,0,0,0|1,1,0]=4
29  B7R0.4  NCCCCC(=O)O CP04601 [0,2,0,0,0,0|0,0,1]=3
30  B7R0.4  NCCNCC(=O)O CP26849 [0,2,0,0,0,0|1,0,1]=4
31  B7R1.3  O=C1CCSCC1 HB00136 [0,1,0,1,0,0|0,0,2]=4
32  B7R1.4  N[C@H]1CCOC1=O CP25620 [0,1,0,1,0,0|1,0,1]=4
33  B7R1.18  O=C(O)C1CNC1 CP20401 [0,1,0,1,0,0|1,0,1]=4
34  B7R1.18  O=C(O)[C@@H]1CCN1 CP20301 [0,1,0,1,0,0|1,0,1]=4