0  B14R2.20  CC1=CC=C(C2=CSC(N)=N2)C=C1 26080 [0,0,0,0,0,0|1,1,2]=4
1  B14R2.20  CC1=CC=C(C2=NOC(N)=C2)C=C1 25526 [0,0,0,0,0,0|3,0,1]=4
2  B14R2.20  ClC1=CC=C(C2=CSC(Cl)=N2)C=C1 25679 [0,0,0,0,0,0|1,1,2]=4
3  B14R2.20  NC1=CC(C2=CC=C(Br)C=C2)=NO1 24710 [0,0,0,0,0,0|2,1,1]=4
4  B14R2.20  NC1=CC(C2=CC=C(Cl)C=C2)=NN1 24762 [0,0,0,0,0,0|3,0,1]=4
5  B14R2.20  NC1=CC(C2=CC=C(Cl)C=C2)=NO1 23321 [0,0,0,0,0,0|2,0,1]=3
6  B14R2.20  NC1=CC(C2=CC=C(F)C=C2)=NO1 25527 [0,0,0,0,0,0|2,1,1]=4
7  B14R2.20  NC1=NC(C2=CC=C(Br)C=C2)=CS1 26081 [0,0,0,0,0,0|0,2,2]=4
8  B14R2.20  NC1=NC(C2=CC=C(F)C=C2)=CS1 28474 [0,0,0,0,0,0|0,2,2]=4
9  B14R2.20  NC1=NN=C(C2=CC=C(Cl)C=C2)S1 26042 [0,0,0,0,0,0|3,0,1]=4
10  B14R2.20  OC1=NC(C2=CC=C(Cl)C=C2)=CS1 25660 [0,0,0,0,0,0|1,1,2]=4
11  B13R2.10  NC1=CC(C2=CC=CC=C2)=NO1 23286 [1,0,0,0,0,0|2,0,1]=4
12  B13R2.10  O=C1N[C@@H](C2=CC=CC=C2)CO1 16615 [1,0,0,0,0,0|1,0,1]=3
13  B13R2.10  O=C1N[C@H](C2=CC=CC=C2)CO1 16578 [1,0,0,0,0,0|1,0,1]=3
14  B13R2.12  ClC1=CC=C(C2CCCN2)C=C1 17053 [1,0,0,0,0,0|1,0,2]=4
15  B13R2.12  ClC1=CC=C(C2CCNC2)C=C1 23725 [1,0,0,0,0,0|2,0,1]=4
16  B15R2.309  CC1=C(C2=CC=C(Cl)C=C2)N=C(N)S1 24943 [0,1,0,0,0,0|0,1,2]=4
17  B13R1.14  COC(=O)CCC1=CC=C(O)C=C1 10593 [0,0,1,0,0,0|3,0,0]=4
18  B13R1.132  N[C@@H](CC(=O)O)C1=CC=C(Cl)C=C1 15208 [0,0,1,0,0,0|3,0,0]=4
19  B13R1.132  N[C@H](CC(=O)O)C1=CC=C(Cl)C=C1 15209 [0,0,1,0,0,0|3,0,0]=4
20  B15R2.28  NC1=NC=CC(C2=CC=C(Cl)C=C2)=N1 25566 [0,0,0,0,0,1|1,0,2]=4
21  B12R1.21  N=C(N)SCC1=CC=C(Cl)C=C1 23238 [1,0,1,0,0,0|2,0,0]=4
22  B14R1.134  COC(=O)C(N)CC1=CC=C(Cl)C=C1 03322 [0,1,1,0,0,0|2,0,0]=4
23  B14R1.134  COC(=O)[C@@H](N)CC1=CC=C(Cl)C=C1 24191 [0,1,1,0,0,0|2,0,0]=4
24  B14R1.134  COC(=O)[C@H](N)CC1=CC=C(Cl)C=C1 06168 [0,1,1,0,0,0|2,0,0]=4
25  B14R2.8  CNC1=NC(C2=CC=CC=C2)=NO1 20795 [1,1,0,0,0,0|1,0,1]=4
26  B12R1.20  O=C(O)C(O)C1=CC=C(Cl)C=C1 27619 [0,0,1,0,1,0|2,0,0]=4
27  B14R2.19  O=C1N[C@@H](CC2=CC=CC=C2)CO1 16606 [1,0,0,0,0,1|1,0,1]=4
28  B14R2.19  O=C1N[C@H](CC2=CC=CC=C2)CO1 16513 [1,0,0,0,0,1|1,0,1]=4