0  B11R1.189  COC1=CC(CNN)=CC=C1 SPC-n836 [1,0,0,0,0,0|2,0,0]=3
1  B11R1.280  COC1=CC(C=O)=CN=C1F SPC-u826 [1,0,0,0,0,0|3,0,0]=4
2  B13R2.599  COC1=C(Br)C=C2C=CNC2=N1 SPC-t898 [0,0,0,1,0,0|3,0,0]=4
3  B13R2.599  COC1=C(C)C=C2C=CNC2=C1 SPC-p815 [0,0,0,1,0,0|2,0,0]=3
4  B13R2.599  COC1=C(F)C=C2NC=CC2=C1 SPC-p807 [0,0,0,1,0,0|2,0,1]=4
5  B10R1.172  COC1=CC(C=O)=CN=C1 SPC-g844 [2,0,0,0,0,0|2,0,0]=4
6  B10R1.172  COC1=CN=CC(CN)=C1 SPC-n799 [2,0,0,0,0,0|2,0,0]=4
7  B10R1.172  COC1=NC=CC(C=O)=C1 SPC-h062 [2,0,0,0,0,0|2,0,0]=4
8  B10R1.172  COC1=NC=CC(CCl)=C1 SPC-s960 [2,0,0,0,0,0|2,0,0]=4
9  B10R1.172  COC1=NC=CC(CN)=C1 SPC-j640 [2,0,0,0,0,0|2,0,0]=4
10  B12R1.300  COC1=C(O)C(C)=CC(C#N)=C1 SPC-p575 [1,1,0,0,0,0|1,0,1]=4
11  B12R2.44  COC1=CC2=C(C=CN2)C=C1 SPC-p812 [1,0,0,1,0,0|1,0,0]=3
12  B12R2.44  COC1=NC2=C(C=CN2)C=C1 SPC-m534 [1,0,0,1,0,0|2,0,0]=4
13  B12R2.315  COC1=C2C=CNC2=NC=C1 SPC-h088 [1,0,0,1,0,0|2,0,0]=4
14  B12R2.315  COC1=NC=CC2=C1C=CN2 SPC-p581 [1,0,0,1,0,0|2,0,0]=4
15  B12R2.82  CC1=C(Br)C=CC2=C1C=CN2 SPC-p666 [1,0,0,1,0,0|2,0,0]=4
16  B12R2.100  CC1=C(Br)C=C2C=CNC2=C1 SPC-k696 [1,0,0,1,0,0|2,0,0]=4
17  B14R2.82  COC1=C(OC)C=C2NC=CC2=C1 SPC-t521 [0,1,0,1,0,0|1,0,0]=3