0  B9R0.7  CC(=O)N(C)CCC(=O)O BB32-3040 [0,0,0,0,0,0|3,0,0]=3
1  B9R0.7  C[S+](C)CC[C@H](N)C(=O)O BB55-8164 [0,0,0,0,0,0|3,0,0]=3
2  B9R0.7  NC(=O)SC[C@H](N)C(=O)O BB58-4371 [0,0,0,0,0,0|2,0,0]=2
3  B8R0.8  CCCCC(C)C(=O)O BB58-4619 [1,0,0,0,0,0|2,0,1]=4
4  B8R0.8  NCCCC(N)C(=O)O BB57-0193 [1,0,0,0,0,0|1,0,1]=3
5  B8R0.28  O=C(O)CSCC(=O)O BB01-8012 [1,0,0,0,0,0|1,0,0]=2
6  B10R0.82  CNC(=O)CCC(N)C(=O)O BB58-4683 [0,1,0,0,0,0|1,0,0]=2
7  B10R0.82  COC(=O)CCC(N)C(=O)O BB17-2988 [0,1,0,0,0,0|0,0,0]=1
8  B10R0.93  O=C(O)C(Br)CC(Br)C(=O)O BB17-1995 [0,1,0,0,0,0|1,0,0]=2
9  B8R0.23  CC(C)C(N)CC(=O)O BB01-4066 [0,0,0,0,1,0|2,0,1]=4
10  B10R0.98  NC(CCCC(=O)O)C(=O)O BB57-6646 [0,0,0,0,0,1|0,0,0]=1
11  B7R0.4  CNCCCC(=O)O BB58-0143 [2,0,0,0,0,0|2,0,0]=4
12  B7R0.5  NCCC(N)C(=O)O BB57-6108 [2,0,0,0,0,0|1,0,0]=3
13  B9R0.1  COC(=O)CCCC(C)=O BB58-1963 [1,1,0,0,0,0|1,0,0]=3
14  B9R1.35  O=C1CCC(C(=O)O)C1 BB01-6440 [1,0,0,1,0,0|1,0,0]=3
15  B9R0.4  CCCCC(N)CC(=O)O BB57-0288 [1,0,0,0,0,1|1,0,1]=4
16  B11R0.29  CC(=O)NCSC[C@H](N)C(=O)O BB58-1495 [0,0,0,0,0,2|1,0,0]=3
17  B11R0.29  N=C(N)NOCCC(N)C(=O)O BB57-4931 [0,0,0,0,0,2|2,0,0]=4