0  B13R2.4825  c1cc2c(c(c1)Br)NC(=O)C2=O CM14323 [0,0,0,0,0,0|2,0,1]=3
1  B13R2.4825  c1cc2c(c(c1)Cl)NC(=O)C2=O CM14312 [0,0,0,0,0,0|2,0,1]=3
2  B12R2.18  Cn1c2ccccc2oc1=O CM14408 [1,0,0,0,0,0|2,0,0]=3
3  B12R2.196  Cn1cnc2c1cccc2Br CM13870 [1,0,0,0,0,0|2,0,1]=4
4  B12R2.202  c1cc2c(c(c1)Br)CC(=O)N2 CM14303 [1,0,0,0,0,0|2,0,0]=3
5  B12R2.202  c1cc2c(c(c1)Br)NC(=O)C2 CM14308 [1,0,0,0,0,0|2,0,0]=3
6  B12R2.202  c1cc2c(c(c1)Cl)NC(=O)C2 CM14306 [1,0,0,0,0,0|2,0,0]=3
7  B12R2.202  c1cc2c(c(c1)F)NC(=O)C2 CM14365 [1,0,0,0,0,0|2,0,0]=3
8  B14R2.8737  Cc1ccc2c(c1F)NC(=O)C2=O CM13628 [0,1,0,0,0,0|2,0,1]=4
9  B14R2.11645  CCc1cccc2c1NC(=O)C2=O CM10216 [0,1,0,0,0,0|1,0,1]=3
10  B14R2.11645  c1cc(c2c(c1)C(=O)C(=O)N2)CF CM14375 [0,1,0,0,0,0|1,0,1]=3
11  B12R1.24  c1cc(c(c(c1)F)N)C(=O)C=O CM13865 [0,0,1,0,0,0|2,0,1]=4
12  B11R1.159  Cc1cccc(c1Br)C(=O)O CM12530 [1,0,1,0,0,0|2,0,0]=4
13  B11R1.159  Cc1cccc(c1F)C(=O)O CM12758 [1,0,1,0,0,0|2,0,0]=4
14  B11R1.159  Cc1cccc(c1I)C(=O)O CM12822 [1,0,1,0,0,0|2,0,0]=4
15  B11R1.159  Cc1cccc(c1N)[N+](=O)[O-] CM11505 [1,0,1,0,0,0|0,0,2]=4
16  B11R1.159  c1cc(c(c(c1)Br)N)C(=O)O CM12347 [1,0,1,0,0,0|2,0,0]=4
17  B11R1.159  c1cc(c(c(c1)Cl)N)C(=O)O CM12358 [1,0,1,0,0,0|2,0,0]=4
18  B11R1.159  c1cc(c(c(c1)F)N)C(=O)O CM12394 [1,0,1,0,0,0|2,0,0]=4
19  B11R1.157  Cc1cccc(c1)CC(=O)O CM13725 [1,0,1,0,0,0|2,0,0]=4
20  B11R2.106  Cc1cccc2c1ccs2 CM10545 [2,0,0,0,0,0|2,0,0]=4
21  B11R2.106  Cc1cccc2c1occ2 CM10746 [2,0,0,0,0,0|2,0,0]=4
22  B11R2.106  c1cc2c(cc[nH]2)c(c1)F CM13604 [2,0,0,0,0,0|2,0,0]=4
23  B11R2.106  c1cc2cc[nH]c2c(c1)F CM13609 [2,0,0,0,0,0|2,0,0]=4
24  B13R2.3028  c1cc2c(cc1F)C(=O)C(=O)N2 CM13627 [1,1,0,0,0,0|1,0,1]=4
25  B13R2.4856  c1cc2c(c(c1)Br)C(=O)C(=O)N2 CM14355 [1,1,0,0,0,0|1,0,1]=4
26  B13R2.5190  c1cc2c(cc1Br)NC(=O)C2=O CM14357 [1,1,0,0,0,0|1,0,1]=4
27  B13R2.162  c1cc2c(c(c1)F)NC(=O)CO2 CM10140 [0,0,1,1,0,0|2,0,0]=4