0  B6R0.6  NCCCCCN T4895 [0,0,0,0,0,0|3,0,1]=4
1  B5R0.2  NCCCCN T4865 [1,0,0,0,0,0|2,0,1]=4
2  B7R0.4  CCCCCC(=O)O T3944 [0,1,0,0,0,0|1,1,1]=4
3  B4R0.2  CCCCO T7023 [2,0,0,0,0,0|0,1,0]=3
4  B4R0.2  NCCCN T4782 [2,0,0,0,0,0|1,0,1]=4
5  B6R0.4  CCCCC(=O)O T4792 [1,1,0,0,0,0|0,1,1]=4
6  B6R1.2  O=C1CCCC1 T4800 [1,0,0,1,0,0|0,1,1]=4