0  B22R2.520190  c1cc(cc(c1)N(=O)=O)N=Nc2ccc(c(c2)C(=O)[O-])O TS76312 [1,0,0,0,0,0|1,0,2]=4
1  B22R2.533654  CC(=O)c1cc(ccc1O)Cc2ccc(c(c2)C(=O)C)O TS34745 [0,0,0,0,1,0|3,0,0]=4
2  B22R2.533654  c1cc(c(cc1Cc2ccc(c(c2)C(=O)O)N)C(=O)O)N TS54914 [0,0,0,0,1,0|3,0,0]=4
3  B22R2.533654  c1cc(c(cc1Cc2ccc(c(c2)C(=O)O)O)C(=O)O)O TS35123 [0,0,0,0,1,0|1,0,0]=2
4  B22R2.533654  c1cc(c(cc1Sc2ccc(c(c2)C(=O)O)O)C(=O)O)O TS76083 [0,0,0,0,1,0|1,0,0]=2
5  B21R2.254925  c1cc(cc(c1)N=Nc2cccc(c2)C(=O)O)C(=O)O TS30795 [2,0,0,0,0,0|0,0,0]=2
6  B21R2.254925  c1cc(cc(c1)SSc2cccc(c2)C(=O)O)C(=O)O TS60592 [2,0,0,0,0,0|2,0,0]=4
7  B23R2.25826  CC(=C1C=CC(=O)C(=C1)C(=O)O)c2ccc(c(c2)C(=O)O)O TS74597 [0,1,0,0,1,0|1,0,1]=4
8  B21R2.19728  c1cc(c(cc1c2ccc(c(c2)C(=O)O)N)C(=O)O)N TS74225 [0,0,0,0,2,0|2,0,0]=4