0  B4R0.1  C(C(=O)O)F NPA003759 [1,0,0,0,0,0|1,0,1]=3
1  B4R0.1  C=CC(=C)C NPA031266 [1,0,0,0,0,0|1,0,0]=2
2  B4R0.1  C=CC(=N)N NPA016478 [1,0,0,0,0,0|2,0,0]=3
3  B4R0.1  CC(=O)C=O NPA018043 [1,0,0,0,0,0|1,0,0]=2
4  B6R0.1  CCCC(=O)CC NPA012016 [0,1,0,0,0,0|1,0,2]=4
5  B6R1.12  C=C1C(C1=O)O NPA015715 [0,0,0,1,0,0|2,0,0]=3
6  B5R0.1  C(CO)C(=O)O NPA014979 [1,1,0,0,0,0|0,0,2]=4
7  B5R0.1  C=C(C)CCO NPA031414 [1,1,0,0,0,0|2,0,0]=4
8  B5R0.1  CC(=CCO)C NPA031413 [1,1,0,0,0,0|1,0,1]=4
9  B5R0.5  CC(C(=O)C)O NPA007460 [1,1,0,0,0,0|0,0,2]=4
10  B7R0.5  CCOC(=O)C(C)C NPA012370 [0,2,0,0,0,0|0,0,2]=4
11  B7R0.10  CCC(C)C(=O)OC NPA003841 [0,2,0,0,0,0|0,0,2]=4
12  B7R0.16  CC(C)C(=O)C(=O)O NPA002663 [0,2,0,0,0,0|2,0,0]=4
13  B7R1.1  CCC1=CC=CO1 NPA014078 [0,1,0,1,0,0|1,0,1]=4
14  B7R1.2  CC1=CC=C(O1)C NPA006894 [0,1,0,1,0,0|1,0,0]=3
15  B7R1.4  C1[C@H](C(=O)NO1)N NPA001237 [0,1,0,1,0,0|1,0,1]=4
16  B7R1.4  CC1=NCNC1=O NPA003654 [0,1,0,1,0,0|1,0,1]=4
17  B7R1.15  O=C1C=C(C1=O)O NPA028987 [0,1,0,1,0,0|2,0,0]=4