0  B13R2.162  CC1=NC2=C(C=CC=C2Cl)C=C1 8225 [1,0,0,0,0,0|2,0,1]=4
1  B13R2.162  CC1=NC2=C(C=CC=C2O)C=C1 6749 [1,0,0,0,0,0|2,0,1]=4
2  B13R2.5179  C1=CC2=C(C=CC(=C2)O)C(=C1)O 9616 [1,0,0,0,0,0|2,0,0]=3
3  B13R2.4825  C1=CC2=C(C(=C1)F)NC(=O)C2=O 8910 [0,0,0,0,1,0|1,0,1]=3
4  B13R2.4856  C1=CC2=C(C(=C1)Br)C(=O)C(=O)N2 9454 [0,0,0,0,1,0|2,0,1]=4
5  B12R1.226  C1=CC(=CC(=C1)F)\C=C\C(=O)O 6032 [1,0,1,0,0,0|2,0,0]=4
6  B12R2.24  C1=CC=C2C(=C1)C=C(C=N2)Br 6528 [2,0,0,0,0,0|1,0,1]=4
7  B12R2.24  C1=CC=C2C=C(C=CC2=C1)Br 8120 [2,0,0,0,0,0|2,0,0]=4
8  B12R2.24  C1=CC=C2C=C(C=CC2=C1)O 5805 [2,0,0,0,0,0|1,0,0]=3
9  B12R2.24  c1cc2ccc(cc2nc1)O 5993 [2,0,0,0,0,0|2,0,0]=4
10  B12R2.1081  C1=CC2=C(C(=C1)N)N=CC=C2 6838 [2,0,0,0,0,0|1,0,1]=4
11  B12R2.1081  C1=CC2=C(C(=C1)O)N=CC=C2 6840 [2,0,0,0,0,0|1,0,1]=4
12  B12R2.1081  C1=CC=C2C(=C1)C=CC=C2F 5357 [2,0,0,0,0,0|2,0,0]=4
13  B12R2.1081  C1=CC=C2C(=C1)C=CC=C2N 10679 [2,0,0,0,0,0|2,0,0]=4
14  B12R2.1081  CC1=C2C(=CC=C1)N=CC=N2 10554 [2,0,0,0,0,0|1,0,1]=4
15  B12R2.1081  CC1=CC=CC2=C1N=CC=C2 8385 [2,0,0,0,0,0|0,0,1]=3
16  B12R2.1081  CC1=CC=NC2=CC=CC=C12 9629 [2,0,0,0,0,0|2,0,0]=4
17  B12R2.18  CC1=C(NC2=CC=CC=C12)C 8616 [1,0,0,0,1,0|2,0,0]=4
18  B12R2.18  Cc1c([nH]c2c1cccc2)C D0124 [1,0,0,0,1,0|2,0,0]=4