0  B6R0.3  CCC(C(=O)N)N CM11025 [0,0,0,0,0,0|2,0,2]=4
1  B5R0.1  C(C#N)C(=O)O CM10060 [1,0,0,0,0,0|1,0,2]=4
2  B5R0.1  CC#CC(=O)O CM10024 [1,0,0,0,0,0|0,0,2]=3
3  B5R0.5  CC(C(=O)O)F CM13749 [1,0,0,0,0,0|1,0,1]=3
4  B7R0.13  C[C@@](CS)(C(=O)O)N CM11024 [0,1,0,0,0,0|1,0,2]=4
5  B7R1.4  Cc1cscc1Br CM10703 [0,0,0,1,0,0|3,0,0]=4
6  B7R1.18  C1C(CN1)C(=O)O CM14218 [0,0,0,1,0,0|1,0,2]=4
7  B7R1.18  C1CC(C1)C(=O)O CM11089 [0,0,0,1,0,0|0,0,2]=3
8  B4R0.1  CC=C(C)Br CM14455 [2,0,0,0,0,0|1,0,0]=3
9  B6R0.4  CC(=O)C=COC CM11079 [1,1,0,0,0,0|1,0,0]=3
10  B6R1.2  c1co[nH]c1=O CM10160 [1,0,0,1,0,0|2,0,0]=4
11  B8R1.7  c1c(nc[nH]1)C(=O)O CM14067 [0,1,0,1,0,0|1,0,1]=4
12  B8R1.7  c1cn[nH]c1C(=O)O CM11038 [0,1,0,1,0,0|1,0,1]=4
13  B8R1.23  C1C(CC1=O)C(=O)O CM10018 [0,1,0,1,0,0|1,0,1]=4
14  B8R1.23  C1C(CC1N)C(=O)O CM14276 [0,1,0,1,0,0|0,0,2]=4
15  B8R1.25  c1(c(c(=O)c1=O)O)O CM14389 [0,1,0,1,0,0|2,0,0]=4