0  B9R1.15  NC=1C=NC=CC1C=O AP00143 [0,0,0,0,0,0|4,0,0]=4
1  B8R1.5  IC1=C(C=NC=C1)N AP00218 [1,0,0,0,0,0|3,0,0]=4
2  B8R1.5  IC=1C(=NC=CC1)N AP00144 [1,0,0,0,0,0|3,0,0]=4
3  B10R1.20  COC1=CC=NC=C1C=O AP00236 [0,1,0,0,0,0|1,0,1]=3
4  B10R1.30  BrC=1C=C(C(=NC1)Cl)OC AP00152 [0,1,0,0,0,0|2,0,0]=3
5  B10R1.30  FC1=CC(=C(N)C=C1)OC AP10115 [0,1,0,0,0,0|1,0,0]=2
6  B9R1.2  NC=1C=C(C=CC1)C#C AP10031 [1,1,0,0,0,0|1,0,1]=4
7  B9R1.8  CNCC=1C=NC=CC1 AP00307 [1,1,0,0,0,0|2,0,0]=4
8  B9R1.69  FC=1C=C(C=CC1N)O AP00023 [1,1,0,0,0,0|2,0,0]=4
9  B9R1.69  NC1=C(C=C(C=C1)O)Cl AP10247 [1,1,0,0,0,0|2,0,0]=4
10  B11R1.267  ClCC1=NC=CC(=C1C)OC AP00119 [0,2,0,0,0,0|1,0,0]=3
11  B11R1.267  NC1=C(C#N)C=CC=C1OC AP00121 [0,2,0,0,0,0|1,0,0]=3
12  B11R1.37  BrC=1C=C(C(=NC1)OC)C=O AP00215 [0,2,0,0,0,0|1,0,1]=4
13  B11R2.1  C1(CCC2=CC=CC=C12)=O AP10202 [0,1,0,1,0,0|1,0,0]=3
14  B11R2.1  C1(CCC2=CC=CC=C12)N AP10201 [0,1,0,1,0,0|1,0,0]=3
15  B11R2.1  CN1C=CC2=CC=CC=C12 AP10164 [0,1,0,1,0,0|1,0,1]=4
16  B11R2.1  [C@H]1(CCC2=CC=CC=C12)N AP10203 [0,1,0,1,0,0|1,0,0]=3
17  B11R2.36  C1OCC2=CC(=CC=C12)N AP00269 [0,1,0,1,0,0|2,0,0]=4
18  B11R2.36  O1C=CC2=C1C=C(C=C2)O AP00485 [0,1,0,1,0,0|0,0,2]=4
19  B7R1.4  OC1=CC=NN1C AP10359 [1,0,0,0,1,0|2,0,0]=4