0  B16R2.25684  CC1=CC=CC(C)=C1[C@@H](O)C2=CNC=N2 D55863 [0,1,0,0,0,0|2,0,1]=4
1  B13R2.64  C1=CC=C(CC2=NC=CN2)C=C1 B38260 [2,0,0,0,0,0|0,0,2]=4
2  B13R2.18  CC1=C(C2=NN=NN2)C=CC=C1 T48861 [1,0,0,0,1,0|2,0,0]=4