0  B16R2.71  c1ccc(c(c1)CCc2ccccn2)N MIX-0015 [0,1,0,0,0,1|2,0,0]=4
1  B12R2.2  c1ccc(cc1)c2cscn2 THI-0001 [0,0,0,0,2,0|1,0,0]=3