0  B9R1.15  C#CC1=C(Cl)C=CC=C1 3106 [1,0,0,0,0,0|2,0,1]=4
1  B9R1.15  O=CC1=C(I)C=CC=C1 1830 [1,0,0,0,0,0|1,0,0]=2
2  B12R1.78  COC1=C(OC)C=C(CCl)C=C1 1788 [0,2,0,0,0,0|2,0,0]=4
3  B12R1.652  COC1=CC=C(F)C(F)=C1C#N 420 [0,2,0,0,0,0|1,0,1]=4
4  B12R1.76  COC1=C(S(C)(=N)=O)C=CC=C1 4825 [0,2,0,0,0,0|1,0,0]=3
5  B12R2.2403  N=S1(=O)CCC2=CC=CC=C21 4858 [0,1,0,1,0,0|2,0,0]=4