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|0,1,1]=3
3  B5R0.1  CNCC(N)=O CP09005 [1,1,0,0,0,0|1,0,1]=4
4  B5R0.1  NCCC(=O)O CP02301 [1,1,0,0,0,0|0,1,1]=4
5  B5R0.1  NCCC(N)=O CP25964 [1,1,0,0,0,0|0,1,1]=4
6  B5R0.1  O=C(O)CCS CP25144 [1,1,0,0,0,0|1,0,1]=4
7  B5R0.3  CNC(=O)CN CP25861 [1,1,0,0,0,0|1,0,1]=4
8  B5R0.3  COC(=O)CN CP00920 [1,1,0,0,0,0|0,1,1]=4
9  B7R0.2  CC(C)C[C@H](N)CO CP27433 [0,2,0,0,0,0|2,0,0]=4
10  B7R0.2  NCC(N)CC(=O)O CP05401 [0,2,0,0,0,0|2,0,0]=4
11  B7R0.2  NC[C@@H](N)CC(=O)O CP05403 [0,2,0,0,0,0|2,0,0]=4
12  B7R0.2  NC[C@H](N)CC(=O)O CP05402 [0,2,0,0,0,0|2,0,0]=4
13  B7R0.3  CSCC[C@H](N)CO CP26964 [0,2,0,0,0,0|0,0,0]=2
14  B7R0.5  CCC[C@H](N)C(N)=O CP26135 [0,2,0,0,0,0|1,0,1]=4
15  B7R0.5  CSC[C@H](N)C(=O)O CP08101 [0,2,0,0,0,0|1,0,1]=4
16  B7R0.5  NCCC(N)C(=O)O CP05302 [0,2,0,0,0,0|2,0,0]=4
17  B7R0.5  NCC[C@@H](N)C(=O)O CP05301 [0,2,0,0,0,0|2,0,0]=4
18  B7R0.5  NCC[C@@H](N)C(=O)O CP05304 [0,2,0,0,0,0|2,0,0]=4
19  B7R0.7  CCOC(=O)CCN CP02304 [0,2,0,0,0,0|0,1,1]=4
20  B7R0.10  CC[C@H](C)[C@H](N)CO CP26323 [0,2,0,0,0,0|2,0,0]=4
21  B7R0.4  NCCCCC(=O)O CP04601 [0,2,0,0,0,0|1,0,1]=4
22  B7R0.4  NCCNCC(=O)O CP26849 [0,2,0,0,0,0|2,0,0]=4
23  B7R1.3  O=C1CCSCC1 HB00136 [0,1,0,1,0,0|1,0,1]=4
24  B7R1.4  N[C@H]1CCOC1=O CP25620 [0,1,0,1,0,0|0,1,1]=4
25  B7R1.18  O=C(O)[C@@H]1CCN1 CP20301 [0,1,0,1,0,0|2,0,0]=4