0  B12R1.77  COC1=C(C(=O)NN)C=CC=C1 27387 [1,0,0,0,0,0|3,0,0]=4
1  B12R1.261  O=C(O)C1=C(C(=O)O)C=CC=C1 32017 [1,0,0,0,0,0|3,0,0]=4
2  B12R1.261  O=C(O)C1=C([N+](=O)[O-])C=CC=C1 02237 [1,0,0,0,0,0|2,0,1]=4
3  B12R1.261  O=C(O)C1=C([N+](=O)[O-])C=CC=C1 02337 [1,0,0,0,0,0|2,0,1]=4
4  B12R1.261  O=C([O-])C1=CC=CC=C1C(=O)O 01969 [1,0,0,0,0,0|3,0,0]=4
5  B14R1.707  COC(=O)C1=CC(C)=CC=C1[N+](=O)[O-] 23260 [0,1,0,0,0,0|2,0,1]=4
6  B14R1.707  COC(=O)C1=CC(Cl)=CC=C1[N+](=O)[O-] 28307 [0,1,0,0,0,0|2,0,1]=4
7  B14R1.1153  COC(=O)C1=CC=CC(C)=C1[N+](=O)[O-] 28457 [0,1,0,0,0,0|2,0,1]=4
8  B14R1.3302  COC(=O)CC1=C([N+](=O)[O-])C=CC=C1 19430 [0,0,0,0,0,1|2,0,1]=4
9  B11R1.53  COC1=C(C(=O)O)C=CC=C1 24458 [2,0,0,0,0,0|1,0,0]=3
10  B11R1.53  O=C(O)C1=C(CBr)C=CC=C1 27898 [2,0,0,0,0,0|2,0,0]=4
11  B11R1.222  CC1=C(C(=O)NN)C=CC=C1 27388 [2,0,0,0,0,0|2,0,0]=4
12  B11R1.222  CC1=CC=CC=C1C(=O)C#N 19477 [2,0,0,0,0,0|2,0,0]=4
13  B11R1.222  COC(=O)C1=C(I)C=CC=C1 30029 [2,0,0,0,0,0|1,0,0]=3
14  B11R1.222  COC(=O)C1=C(N)C=NC=C1 17257 [2,0,0,0,0,0|1,0,0]=3
15  B11R1.222  COC(=O)C1=CC=CN=C1N 17330 [2,0,0,0,0,0|1,0,0]=3
16  B11R1.222  COC(=O)C1=NC=CN=C1N 24553 [2,0,0,0,0,0|2,0,0]=4
17  B13R1.107  COC(=O)C1=C(CBr)C(Br)=CC=C1 20764 [1,1,0,0,0,0|2,0,0]=4
18  B13R1.107  COC(=O)C1=CC=CC(Cl)=C1CBr 19433 [1,1,0,0,0,0|2,0,0]=4
19  B13R1.107  COC(=O)C1=CC=CC(N)=C1OC 29185 [1,1,0,0,0,0|1,0,0]=3
20  B13R1.2065  COC(=O)C1=C(OC)C=C(Br)C=C1 28991 [1,1,0,0,0,0|1,0,0]=3
21  B13R1.2065  COC(=O)C1=C(OC)C=C(N)C=C1 27441 [1,1,0,0,0,0|1,0,0]=3
22  B13R1.2209  COC(=O)C1=C(CBr)C=CC(Cl)=C1 20755 [1,1,0,0,0,0|2,0,0]=4
23  B13R1.2209  COC(=O)C1=C(OC)C=CC(N)=C1 29115 [1,1,0,0,0,0|1,0,0]=3
24  B13R1.2209  COC(=O)C1=CC(Cl)=CC=C1OC 29909 [1,1,0,0,0,0|1,0,0]=3
25  B13R1.2209  COC(=O)C1=CC(F)=CC=C1CBr 20756 [1,1,0,0,0,0|2,0,0]=4
26  B13R1.2357  COC(=O)C1=C(Cl)C=CC=C1CBr 19434 [1,1,0,0,0,0|2,0,0]=4
27  B13R2.5252  O=C1CCCOC2=C1C=CC=C2 25880 [1,0,0,1,0,0|2,0,0]=4
28  B13R2.5252  O=C1NCCCC2=C1C=CC=C2 17962 [1,0,0,1,0,0|2,0,0]=4
29  B13R1.91  COC(=O)CC1=CC=CC=C1C#N 17819 [1,0,0,0,0,1|2,0,0]=4
30  B15R1.3845  COC(=O)CC1=CC=CC=C1NC(C)=O 26406 [0,0,0,0,0,2|2,0,0]=4