0  B9R1.33  CC1=C(CCN)N=CN1 1261 [0,0,0,0,1,0|3,0,0]=4
1  B10R1.113  NC(=O)C1=CC=CC(N)=C1 1496 [1,1,0,0,0,0|1,0,1]=4
2  B12R1.226  N=C(N)NCC1=CC(I)=CC=C1 1750 [0,2,0,0,0,0|0,1,1]=4