0  B12R1.17  CCOC(=O)c1cccc(c1)N CHEBI:131331 [1,0,0,0,0,0|2,0,0]=3
1  B12R1.17  CCOC(=O)c1cccc(c1)N CHEBI:81494 [1,0,0,0,0,0|2,0,0]=3
2  B12R1.17  CCOC(=O)c1cccc(c1)[NH3+] CHEBI:131337 [1,0,0,0,0,0|2,0,0]=3
3  B14R1.6821  CCOC(=O)c1cc(c(c(c1)O)O)O CHEBI:87247 [0,1,0,0,0,0|3,0,0]=4
4  B11R1.23  c1cc(cc(c1)Cl)C(=O)OO CHEBI:52091 [2,0,0,0,0,0|2,0,0]=4
5  B11R1.74  c1c(cc(nc1Cl)Cl)C(=O)O CHEBI:73179 [2,0,0,0,0,0|0,0,0]=2
6  B13R1.466  CCOC(=O)c1ccc(c(c1)O)O CHEBI:132364 [1,1,0,0,0,0|2,0,0]=4
7  B13R1.1511  CCOC(=O)c1cnc(nc1O)N CHEBI:39721 [0,0,0,0,1,1|2,0,0]=4