0  B5R0.2  CSCSSC NPA000854 [1,0,0,0,0,0|3,0,0]=4
1  B7R0.3  CCC(C)CCCO NPA009905 [0,1,0,0,0,0|0,0,0]=1
2  B7R0.3  CCCCC(C)C=C NPA006261 [0,1,0,0,0,0|1,0,1]=3
3  B7R0.3  CC[C@@H](C#CCO)O NPA000240 [0,1,0,0,0,0|0,0,2]=3
4  B7R0.4  CC(C)CCNC=O NPA028555 [0,1,0,0,0,0|1,0,2]=4
5  B7R0.4  NCCNCC(=O)O NPA027411 [0,1,0,0,0,0|2,0,1]=4
6  B6R0.1  CCCC(=O)CC NPA012016 [1,1,0,0,0,0|0,0,1]=3
7  B6R0.4  CC(=O)CCSC NPA010578 [1,1,0,0,0,0|1,0,1]=4
8  B6R0.4  C[C@H](CCSC)O NPA014443 [1,1,0,0,0,0|1,0,0]=3
9  B8R0.4  C(CSSSCCO)O NPA018087 [0,2,0,0,0,0|2,0,0]=4
10  B8R0.4  CCCCC/C=C\CO NPA008349 [0,2,0,0,0,0|0,0,0]=2
11  B8R0.4  CCCCCCCCO NPA007602 [0,2,0,0,0,0|0,0,0]=2
12  B8R0.4  NCCCNCCCN NPA028979 [0,2,0,0,0,0|1,0,0]=3
13  B8R0.6  CCCCC[C@@H](CC)O NPA002709 [0,2,0,0,0,0|0,0,0]=2
14  B8R0.8  C(CC(C(=O)O)N)CO NPA002021 [0,2,0,0,0,0|1,0,1]=4
15  B8R0.9  CCC(C)CCC(=O)C NPA008166 [0,2,0,0,0,0|0,0,2]=4
16  B8R0.28  CC(=CCCC(C)O)C NPA031443 [0,2,0,0,0,0|0,0,2]=4
17  B8R0.28  CC(C)CCCC(=O)C NPA012789 [0,2,0,0,0,0|0,0,2]=4
18  B6R1.1  C1CSCCS1 NPA010361 [1,0,0,1,0,0|1,1,0]=4
19  B6R1.8  C1C(C1=O)CO NPA020911 [1,0,0,1,0,0|1,0,1]=4
20  B8R1.2  C1CC=CC(C1)CO NPA024427 [0,1,0,1,0,0|0,0,1]=3
21  B8R1.49  C1CCC/C=C\CC1 NPA012658 [0,1,0,1,0,0|1,0,0]=3
22  B8R1.52  C1C[C@@](OC1)(CO)O NPA010903 [0,1,0,1,0,0|1,0,0]=3