0  B16R2.451686  COC(=O)C1=CC2=C(Br)C=C(F)C=C2S1 CS-M0999 [0,0,0,0,0,0|3,0,0]=3
1  B15R2.1590  COC(=O)C1=CC2=C(C=CC(Br)=C2)N1 CS-0036684 [1,0,0,0,0,0|1,0,0]=2
2  B15R2.1590  COC(=O)C1=CC2=CC(N)=CC=C2O1 CS-M2650 [1,0,0,0,0,0|2,0,0]=3
3  B15R2.1590  COC(=O)C1=CC2=CC=C(Br)C=C2N1 CS-W022873 [1,0,0,0,0,0|3,0,0]=4
4  B15R2.1590  COC(=O)C1=CC2=CC=C(F)C=C2S1 CS-0102226 [1,0,0,0,0,0|3,0,0]=4
5  B15R2.1590  COC(=O)C1=NC2=CC(Br)=CC=C2S1 CS-0063868 [1,0,0,0,0,0|3,0,0]=4
6  B15R2.15633  O=C(O)C1=CC2=C(Br)C=C(F)C=C2S1 CS-M1000 [1,0,0,0,0,0|3,0,0]=4
7  B17R2.428972  COC(=O)C1=CC2=C(C=C(C#N)C=C2Br)S1 CS-B0211 [0,1,0,0,0,0|2,0,1]=4
8  B17R2.1055464  CCOC(=O)C1=CC2=C(N1)C(F)=CC(Cl)=C2 CS-B0976 [0,1,0,0,0,0|1,1,0]=3
9  B14R1.820  COC(=O)\C=C\C1=CC(F)=CC=C1F CS-0047110 [1,0,1,0,0,0|2,0,0]=4
10  B14R1.825  COC(=O)\C=C\C1=CC(F)=CC(F)=C1 CS-0037423 [1,0,1,0,0,0|1,1,0]=4
11  B14R2.972  COC(=O)C1=NC2=CC=CC=C2N1 CS-W022774 [2,0,0,0,0,0|1,0,0]=3
12  B14R2.4529  CC1=CC2=C(C=C1)C=C(C(=O)O)N2 CS-0018975 [2,0,0,0,0,0|2,0,0]=4
13  B14R2.4529  CC1=CC=C2C=C(C(=O)O)SC2=C1 CS-0043148 [2,0,0,0,0,0|2,0,0]=4
14  B14R2.4529  CC1=NC2=C(C=C1)OC(C(=O)O)=C2 CS-0047107 [2,0,0,0,0,0|2,0,0]=4
15  B14R2.4529  NC1=CC=C2OC(C(=O)O)=CC2=C1 CS-M1933 [2,0,0,0,0,0|2,0,0]=4
16  B14R2.4529  O=C(O)C1=CC2=C(C=NC(Br)=C2)N1 CS-W022300 [2,0,0,0,0,0|2,0,0]=4
17  B14R2.4529  O=C(O)C1=CC2=CC(Cl)=CN=C2N1 CS-0002367 [2,0,0,0,0,0|2,0,0]=4
18  B14R2.4529  O=C(O)C1=CC2=CC(F)=CN=C2N1 CS-0004680 [2,0,0,0,0,0|2,0,0]=4
19  B14R2.4529  O=C(O)C1=CC2=CC(O)=CC=C2N1 CS-W017375 [2,0,0,0,0,0|1,0,0]=3
20  B14R2.7969  O=C(O)C1=CC2=C(Br)C=CC=C2S1 CS-0041386 [2,0,0,0,0,0|2,0,0]=4
21  B14R2.7969  O=C(O)C1=CC2=C(N1)C(Br)=CC=C2 CS-W008408 [2,0,0,0,0,0|0,0,0]=2
22  B14R2.7969  O=C(O)C1=CC2=CC=CC(Br)=C2O1 CS-0039517 [2,0,0,0,0,0|1,0,0]=3
23  B14R2.7969  O=C(O)C1=CC2=CC=CC(Br)=C2S1 CS-B0212 [2,0,0,0,0,0|1,0,0]=3
24  B14R2.7969  O=C(O)C1=CC2=CC=CC(Cl)=C2S1 CS-M1618 [2,0,0,0,0,0|1,1,0]=4
25  B16R2.755  CCOC(=O)C1=CC2=CC(C)=CN=C2N1 CS-B0497 [1,1,0,0,0,0|1,0,0]=3
26  B16R2.755  CCOC(=O)C1=CC2=CC(I)=CC=C2N1 CS-0047152 [1,1,0,0,0,0|1,0,0]=3
27  B16R2.33944  COC(=O)C1=CC2=C(C=CC(Br)=C2C)N1 CS-0039196 [1,1,0,0,0,0|1,0,0]=3