0  B6R0.6  OCCNCCO D02337 [1,0,0,0,0,0|2,1,0]=4
1  B8R0.4  CCOCCOCCO D08904 [0,1,0,0,0,0|1,1,0]=3
2  B8R0.7  NCCCCCC(=O)O D00160 [0,1,0,0,0,0|1,1,1]=4
3  B8R1.5  N[C@@H]1CCCC[C@H]1N D01790 [0,0,0,1,0,0|2,0,0]=3
4  B8R1.5  N[C@@H]1CCCC[C@H]1N D03723 [0,0,0,1,0,0|2,0,0]=3
5  B8R1.5  N[C@@H]1CCCC[C@H]1N D05272 [0,0,0,1,0,0|2,0,0]=3
6  B8R1.22  O=C1CCCCCO1 D05540 [0,0,0,1,0,0|1,1,1]=4
7  B7R0.4  CCCCCC(C)N D07371 [1,1,0,0,0,0|0,0,0]=2
8  B9R0.2  CCCCCCCC(=O)O D05220 [0,2,0,0,0,0|0,1,0]=3
9  B9R0.2  CCCCCCCC(=O)[O-] D08999 [0,2,0,0,0,0|0,1,0]=3
10  B9R0.2  CCCCCNCC(N)=O D05033 [0,2,0,0,0,0|0,1,1]=4
11  B9R0.45  NCCNCCNCCN D00736 [0,2,0,0,0,0|2,0,0]=4