0  B7R1.4  CC1=NCNC1=O NPA003654 [0,0,0,0,0,0|2,1,1]=4
1  B8R1.18  CC1=CC(=C(O1)C)C NPA002957 [0,1,0,0,0,0|1,0,0]=2
2  B8R1.4  C1=COC(=O)OC1=O NPA009602 [0,0,0,0,0,1|1,1,0]=3
3  B8R1.4  CC1=CC(=O)C=CN1 NPA011826 [0,0,0,0,0,1|1,1,0]=3
4  B8R1.4  CC1=CC(=O)C=CO1 NPA012777 [0,0,0,0,0,1|0,1,0]=2
5  B8R1.4  CC1=CC(=O)CCO1 NPA016314 [0,0,0,0,0,1|0,1,2]=4
6  B8R1.4  OC1=CC=CC(=C1)O NPA032541 [0,0,0,0,0,1|2,1,0]=4
7  B8R1.5  CC1=C(C=CC=N1)O NPA031163 [0,0,0,0,0,1|1,1,0]=3
8  B8R1.5  CC1=CC=CC=C1O NPA000242 [0,0,0,0,0,1|1,1,0]=3
9  B5R0.1  CC(=CCO)C NPA031413 [1,0,1,0,0,0|1,0,1]=4
10  B7R0.1  C/C=C/C/C=C/C=C NPA015312 [0,1,1,0,0,0|2,0,0]=4
11  B7R1.1  CCC1=CC=CO1 NPA014078 [1,1,0,0,0,0|0,0,0]=2
12  B7R1.2  CC1=CC=C(O1)C NPA006894 [1,1,0,0,0,0|0,0,0]=2
13  B7R1.15  O=C1C=C(C1=O)O NPA028987 [0,1,0,0,1,0|1,1,0]=4
14  B9R1.2  CC1=CC(=CC=C1)OC NPA008038 [0,1,0,0,0,1|1,1,0]=4
15  B9R1.2  COC1=CC(=O)OC=C1 NPA036051 [0,1,0,0,0,1|1,1,0]=4
16  B9R1.2  OCC1=CC(=CC=C1)O NPA032542 [0,1,0,0,0,1|1,1,0]=4
17  B9R1.34  CC1=CC(=CC(=C1)O)O NPA032537 [0,1,0,0,0,1|1,1,0]=4
18  B9R1.15  CC1=NC=CN=C1OC NPA008729 [0,1,0,0,0,1|1,1,0]=4
19  B9R1.15  CCC1=CC=CC=C1C NPA019124 [0,1,0,0,0,1|2,0,0]=4
20  B9R1.33  CC1=C(N=CO1)CCO NPA009201 [0,2,0,0,0,0|1,1,0]=4
21  B9R1.37  CC1C(=O)C(=C(O1)C)O NPA015223 [0,2,0,0,0,0|0,1,1]=4