0  B10R1.3  C1=CC(=CC=C1CO)[N+]#N NPA009452 [1,0,0,0,0,0|3,0,0]=4
1  B10R1.3  COC1=CC=C(C=C1)OC NPA013417 [1,0,0,0,0,0|3,0,0]=4
2  B10R1.13  CC(C)[C@H]1CCC(=C)C=C1 NPA005834 [1,0,0,0,0,0|0,0,3]=4
3  B12R1.5  CCC1=CC=C(C=C1)C(CO)O NPA006054 [0,1,0,0,0,0|2,0,1]=4
4  B12R1.5  COC1=CC=C(C=C1)C(CO)O NPA004620 [0,1,0,0,0,0|3,0,0]=4
5  B12R1.5  COC1=CC=C(C=C1)[C@@H](O)CO NPA031787 [0,1,0,0,0,0|3,0,0]=4
6  B12R1.256  CC(C)C1=NC=C(N=C1)C(=C)C NPA007113 [0,1,0,0,0,0|3,0,0]=4
7  B9R1.1  O=CC1=CC=C(C=C1)O NPA032546 [2,0,0,0,0,0|1,0,0]=3
8  B11R1.279  COC1=C(C=C(C=C1)C=O)Br NPA014244 [1,1,0,0,0,0|1,0,0]=3
9  B11R1.279  COC1=C(C=C(C=C1)C=O)Cl NPA003786 [1,1,0,0,0,0|1,0,0]=3
10  B11R1.22  OC[C@H](O)C1=CC=C(C=C1)O NPA027819 [1,1,0,0,0,0|1,0,1]=4
11  B13R1.653  CC(C)OC1=C(C=C(C=C1)CO)O NPA028028 [0,1,0,0,0,1|0,0,2]=4
12  B13R1.537  CC(=O)C1=CC=C(C=C1)[C@@H](CO)O NPA016997 [0,2,0,0,0,0|1,0,0]=3
13  B13R1.120  CC(=O)C1=C(C=C(C=C1)C(=O)O)O NPA026040 [0,2,0,0,0,0|1,0,1]=4
14  B9R1.21  C1=C(OC(=C1)C=O)CO NPA000322 [1,0,0,0,1,0|2,0,0]=4
15  B9R1.21  CCC1=CNC(=C1)C=O NPA002721 [1,0,0,0,1,0|1,0,0]=3
16  B9R1.35  CC(C)[C@H]1C=CC(=O)N1 NPA036371 [1,0,0,0,1,0|1,0,1]=4
17  B11R1.266  CC(=O)C1=CC=CC(=C1)C=O NPA006924 [0,0,0,0,1,1|1,0,1]=4