0  B11R1.36  C[C@@H](O)[C@@H](N)C1=CC=CC=C1 CS-0747750 [0,1,0,0,0,0|1,0,0]=2
1  B11R1.36  O=C(O)[C@@H](O)C1=CC=CC=C1 CS-0229548 [0,1,0,0,0,0|2,0,1]=4
2  B9R1.6  C=C(F)C1=CC=CC=C1 CS-0454967 [0,0,0,0,1,0|1,0,2]=4
3  B9R1.6  CC(O)C1=CN=CN=C1 CS-0054425 [0,0,0,0,1,0|3,0,0]=4
4  B9R1.6  CN(N)C1=NC=CC=N1 CS-0653203 [0,0,0,0,1,0|3,0,0]=4
5  B9R1.6  C[C@H](N)C1=CC=CC=C1 CS-0434925 [0,0,0,0,1,0|0,0,0]=1
6  B9R1.6  O=C([O-])C1=CC=CC=C1 CS-0902642 [0,0,0,0,1,0|2,0,1]=4
7  B11R1.91  CC(=O)\C=C/C1=CC=CC=C1 CS-0906300 [0,0,0,0,0,1|1,0,2]=4
8  B11R1.91  CC(O)\C=C\C1=CC=CC=C1 CS-0643629 [0,0,0,0,0,1|1,0,1]=3
9  B8R1.2  NCC1=CN=CN=C1 CS-W022426 [2,0,0,0,0,0|2,0,0]=4
10  B10R1.10  C=CCC1=CC=CC(C)=C1 CS-0267266 [1,1,0,0,0,0|0,0,2]=4
11  B10R1.10  COCC1=CC(N)=NC=C1 CS-0532525 [1,1,0,0,0,0|2,0,0]=4
12  B10R1.10  NCCC1=CC=NC(F)=C1 CS-0835645 [1,1,0,0,0,0|1,0,0]=3
13  B10R1.15  OCC(O)C1=CN=CC=C1 CS-0269321 [1,1,0,0,0,0|2,0,0]=4
14  B10R1.17  NOCCC1=CC=CC=C1 CS-0337620 [1,1,0,0,0,0|0,0,0]=2
15  B10R1.61  CC1=CC=CN=C1[C@@H](C)O CS-0266895 [0,1,0,0,1,0|2,0,0]=4
16  B10R1.113  CC(N)C1=CC(F)=CN=C1 CS-0233082 [0,1,0,0,1,0|1,0,0]=3
17  B10R1.113  CC1=CC(C(C)O)=NC=C1 CS-0378124 [0,1,0,0,1,0|2,0,0]=4
18  B10R1.113  C[C@@H](O)C1=NC(Br)=CC=C1 CS-0266892 [0,1,0,0,1,0|2,0,0]=4
19  B10R1.113  C[C@H](N)C1=CC(I)=CC=C1 CS-1198131 [0,1,0,0,1,0|0,0,0]=2
20  B12R1.226  CC(=O)CCC1=CC=CC(O)=C1 CS-0254016 [0,1,0,0,0,1|1,0,1]=4
21  B12R1.20  CC(C)[C@@H](N)C1=CC=C(Cl)C=C1 CS-1196877 [0,2,0,0,0,0|1,0,0]=3
22  B12R1.127  CN(C)CC1=CC(N)=CC=C1Cl CS-0238532 [0,2,0,0,0,0|2,0,0]=4
23  B12R2.606  NC1CC2=CC(Br)=CN=C2C1 CS-0093550 [0,1,0,1,0,0|1,0,0]=3
24  B12R2.18  CC1=C(I)C2=CC=CC=C2N1 CS-0556954 [0,1,0,1,0,0|0,0,2]=4
25  B12R2.202  O=C1CC2=C(N1)C(O)=CC=C2 CS-0569647 [0,1,0,1,0,0|1,0,1]=4
26  B8R1.7  C[C@@H](N)C1=COC=C1 CS-0648698 [0,0,0,0,2,0|1,0,0]=3
27  B8R1.7  C[C@H](N)C1=CSC=C1 CS-0266725 [0,0,0,0,2,0|1,0,0]=3