0  B6R1.1  C1CNCCN1 D00807 [0,0,0,0,0,0|1,0,0]=1
1  B6R1.1  C1CNCCN1 D01393 [0,0,0,0,0,0|1,0,0]=1
2  B6R1.1  C1CNCCN1 D08381 [0,0,0,0,0,0|1,0,0]=1
3  B6R1.1  C1CNCCN1 D09653 [0,0,0,0,0,0|1,0,0]=1
4  B4R0.2  CCCCO D03200 [1,0,1,0,0,0|0,0,0]=2
5  B4R0.2  CCOCC D01772 [1,0,1,0,0,0|0,0,0]=2
6  B4R0.2  COCCO D05554 [1,0,1,0,0,0|1,0,0]=3
7  B6R0.6  OCCNCCO D02337 [0,1,1,0,0,0|0,0,0]=2
8  B8R1.22  O=C1CCCCCO1 D05540 [0,1,0,0,0,1|1,0,0]=3
9  B8R1.5  N[C@@H]1CCCC[C@H]1N D01790 [0,2,0,0,0,0|2,0,0]=4
10  B8R1.5  N[C@@H]1CCCC[C@H]1N D03723 [0,2,0,0,0,0|2,0,0]=4
11  B8R1.5  N[C@@H]1CCCC[C@H]1N D05272 [0,2,0,0,0,0|2,0,0]=4