0  B9R1.15  CCC1=CC=CC=C1C NPA019124 [0,0,0,0,0,0|2,0,1]=3
1  B8R1.2  C=CC1=CC=CC=C1 NPA015288 [1,0,0,0,0,0|1,0,0]=2
2  B8R1.2  COC1=CC=CC=C1 NPA018776 [1,0,0,0,0,0|2,0,0]=3
3  B8R1.5  CC1=C(C=CC=N1)O NPA031163 [1,0,0,0,0,0|1,0,1]=3
4  B8R1.5  CC1=CC=CC=C1O NPA000242 [1,0,0,0,0,0|0,0,1]=2
5  B10R1.4  C1=CC=C(C(=C1)CCO)O NPA006680 [0,1,0,0,0,0|0,0,2]=3
6  B10R1.4  C=COC1=CC=CC=C1C NPA027432 [0,1,0,0,0,0|2,0,0]=3
7  B10R1.25  C=CC1=C(C=C(C=C1)O)O NPA017935 [0,1,0,0,0,0|1,0,0]=2
8  B10R1.30  C1=C(C(=COC1=O)O)CO NPA004068 [0,1,0,0,0,0|1,0,2]=4
9  B10R1.61  C1=CC=C(C(=C1)C(=O)N)O NPA022113 [0,1,0,0,0,0|0,0,0]=1
10  B10R1.61  CC(=O)C1=CC=CC=C1N NPA005121 [0,1,0,0,0,0|1,0,0]=2
11  B10R2.7  C1=CC=C2C(=C1)C=CN2 NPA011269 [0,0,0,1,0,0|2,0,0]=3
12  B7R0.1  C/C=C/C/C=C/C=C NPA015312 [1,0,1,0,0,0|1,0,1]=4
13  B9R1.1  C1=CC(=CC=C1[N+]#N)O NPA002101 [1,1,0,0,0,0|2,0,0]=4
14  B9R1.1  O=CC1=CC=C(C=C1)O NPA032546 [1,1,0,0,0,0|0,0,0]=2
15  B9R1.2  CC1=CC(=CC=C1)OC NPA008038 [1,1,0,0,0,0|2,0,0]=4
16  B9R1.2  OCC1=CC(=CC=C1)O NPA032542 [1,1,0,0,0,0|0,0,2]=4
17  B9R1.6  C1=CC=C(C=C1)C(=O)O NPA008069 [1,1,0,0,0,0|0,0,0]=2
18  B9R1.3  C1=CC(=C(C(=C1)O)O)O NPA005967 [1,1,0,0,0,0|0,0,1]=3
19  B9R1.69  OC1=CC(=C(C=C1)O)O NPA032540 [1,1,0,0,0,0|0,0,1]=3
20  B9R1.41  CC1=CNC=C1C(=O)C NPA004787 [0,1,0,0,1,0|2,0,0]=4
21  B11R1.8  C1=C(C=C(C(=C1Br)O)CO)O NPA022303 [0,2,0,0,0,0|0,0,2]=4
22  B11R1.8  C1=C(C=C(C(=C1Cl)O)CO)O NPA001765 [0,2,0,0,0,0|0,0,2]=4
23  B11R1.8  CC1=CC(=C(C(=C1)OC)O)O NPA016178 [0,2,0,0,0,0|2,0,0]=4
24  B11R1.159  C1=CC(=C(C(=C1)O)O)C(=O)O NPA015138 [0,2,0,0,0,0|0,0,0]=2
25  B11R1.86  C1=COC=C(C1=O)CC(=O)O NPA015331 [0,2,0,0,0,0|1,0,1]=4
26  B11R1.53  CC(=O)C1=CC=CC=C1NO NPA035405 [0,2,0,0,0,0|0,0,0]=2
27  B11R1.166  C1=CC(=C(C=C1Cl)Cl)C(=O)O NPA001349 [0,2,0,0,0,0|1,0,0]=3
28  B11R1.464  CC1=CC(=CC(=C1C=O)O)O NPA017284 [0,2,0,0,0,0|0,0,0]=2
29  B11R2.10  C1C2=CC=CC=C2NC1=O NPA002938 [0,1,0,1,0,0|1,0,0]=3