0  B23R2.352051  CC(C)(C#N)C1=CC(=CC(=C1)C(C)(C)C#N)CN2C=NC=N2 MCULE-3029589501 [0,0,0,0,0,0|0,0,0]=0
1  B23R2.352051  CC(C)(C#N)C1=CC(=CC(=C1)C(C)(C)C#N)CN2C=NN=C2 MCULE-5665558006 [0,0,0,0,0,0|2,0,0]=2