0  B13R2.328  O=C1C=C(O)C2=C(C=CC=C2)O1 BBL027616 [0,0,0,0,0,0|2,0,2]=4
1  B13R2.328  O=C1C=C(O)N=C2C=CC=CN12 BBL028642 [0,0,0,0,0,0|4,0,0]=4
2  B13R2.328  O=C1N=C(S)SC2=CC=CC=C12 BBL030462 [0,0,0,0,0,0|2,2,0]=4
3  B13R2.328  O=C1NC2=CC=CC=C2C(=O)O1 BBL009904 [0,0,0,0,0,0|2,0,1]=3
4  B13R2.328  OC1=NC2=CC=CC=C2C(O)=N1 BBL025915 [0,0,0,0,0,0|3,0,1]=4
5  B12R2.1081  O=C1CCCC2=CC=CC=C12 BBL027352 [1,0,0,0,0,0|3,0,0]=4
6  B12R2.1081  O=C1NN=CC2=CC=CC=C12 BBL023000 [1,0,0,0,0,0|3,0,0]=4
7  B14R2.7724  O=C1C=C(O)C(=O)C2=C1C=CC=C2 BBL027350 [0,1,0,0,0,0|3,0,0]=4
8  B14R2.8045  CC1=C2NC(=O)OC(=O)C2=CC=C1 BBL104237 [0,1,0,0,0,0|2,0,1]=4
9  B14R2.8045  O=C1NC2=C(Cl)C=CC=C2C(=O)O1 BBL030701 [0,1,0,0,0,0|2,0,1]=4
10  B14R2.8235  O=C1NC2=C(C=C(Br)C=C2)C(=O)O1 BBL011748 [0,1,0,0,0,0|2,0,1]=4
11  B14R2.8235  O=C1NC2=CC=C(Cl)C=C2C(=O)O1 BBL009787 [0,1,0,0,0,0|2,0,1]=4
12  B12R1.75  CC(C)OC1=C(C=O)C=CC=C1 BBL023174 [0,0,1,0,0,0|3,0,0]=4
13  B12R1.283  CCOC1=NC=CC=C1C(=O)O BBL000650 [0,0,1,0,0,0|3,0,0]=4
14  B12R1.283  CCSC1=C(C(=O)O)C=CC=C1 BBL000357 [0,0,1,0,0,0|2,1,0]=4
15  B12R1.283  O=CNC1=C(C(=O)O)C=CC=C1 BBL023279 [0,0,1,0,0,0|2,0,1]=4
16  B12R1.308  CCOC(=O)C1=CC=CC=C1N BBL027654 [0,0,1,0,0,0|3,0,0]=4
17  B12R2.2028  O=C1NC(=O)C2=C1C=CC=C2 BBL037023 [0,0,0,0,1,0|2,0,1]=4
18  B12R2.2028  O=C1OC(=O)C2=C1C=CC=N2 BBL011094 [0,0,0,0,1,0|2,0,1]=4
19  B11R1.16  CCOC(=O)C1=CC=CC=C1 BBL010500 [1,0,1,0,0,0|2,0,0]=4
20  B11R1.53  COC1=C(C(=O)O)C=CC=C1 BBL036896 [1,0,1,0,0,0|1,0,0]=3
21  B11R1.53  COC1=NC=CC=C1C(=O)O BBL011167 [1,0,1,0,0,0|2,0,0]=4
22  B11R1.53  NNC1=CC=CC=C1C(=O)O BBL019027 [1,0,1,0,0,0|2,0,0]=4
23  B11R1.53  O=C(O)C1=C(CO)C=CC=C1 BBL018811 [1,0,1,0,0,0|1,0,0]=3
24  B11R1.53  O=CC1=CC=CC=C1C(=O)O BBL013693 [1,0,1,0,0,0|1,0,1]=4
25  B11R1.222  CCC(=O)C1=CC=CC=C1O BBL011846 [1,0,1,0,0,0|2,0,0]=4
26  B11R1.222  CNC(=O)C1=CC=CC=C1O BBL010949 [1,0,1,0,0,0|2,0,0]=4
27  B11R1.222  COC(=O)C1=CC=CC=C1O BBL010504 [1,0,1,0,0,0|1,0,0]=3
28  B11R1.222  C\C(=N\O)C1=C(O)C=CC=C1 BBL023001 [1,0,1,0,0,0|2,0,0]=4
29  B11R1.222  NNC(=O)C1=C(O)C=CC=C1 BBL008416 [1,0,1,0,0,0|2,0,0]=4
30  B13R1.141  CCOC1=CC=C(Br)C=C1C(=O)O BBL014094 [0,1,1,0,0,0|2,0,0]=4
31  B13R1.141  CCOC1=CC=C(Cl)C=C1C(=O)O BBL014096 [0,1,1,0,0,0|2,0,0]=4
32  B13R1.446  CCOC(=O)C1=CC(Br)=CC=C1O BBL023338 [0,1,1,0,0,0|2,0,0]=4
33  B13R2.3085  O=C1C2=C(C=CC=C2)C(=O)N1O BBL009697 [0,1,0,0,1,0|2,0,0]=4
34  B13R2.4857  O=C1OC(=O)C2=C1C=CC=C2O BBL036792 [0,1,0,0,1,0|1,0,1]=4
35  B13R2.5187  O=C1OC(=O)C2=C1C=CC(Cl)=C2 BBL028284 [0,1,0,0,1,0|1,0,1]=4
36  B15R2.14951  O=C(O)C1=CC(=O)C2=CC=CC=C2O1 BBL011801 [0,2,0,0,0,0|2,0,0]=4
37  B13R1.90  C(=O)C1=CC=CC=C1OCC(=O)O BBL009148 [0,0,1,0,0,1|1,0,1]=4