0  B12R2.2  c1ccc(cc1)c2cscn2 THI-0001 [0,0,0,1,0,0|1,1,1]=4
1  B12R2.2  c1ccc(cc1)n2cccc2 PYR-0077 [0,0,0,1,0,0|2,0,1]=4
2  B11R1.22  COC(=O)c1ccc(cn1)O MIX-0153 [1,1,0,0,0,0|2,0,0]=4
3  B13R2.10  c1ccc(cc1)c2cnc([nH]2)N AIM-0001 [0,1,0,1,0,0|2,0,0]=4
4  B13R2.10  c1ccc(cc1)c2csc(n2)N ATI-0035 [0,1,0,1,0,0|1,1,0]=4
5  B13R2.15  c1ccc(cc1)c2c[nH]nc2N AP3-0001 [0,1,0,1,0,0|2,0,0]=4
6  B13R2.72  c1ccc2c(c1)c(n[nH]2)C(=O)O IZA-0002 [0,1,0,1,0,0|2,0,0]=4