0  B6R0.6  O=CCCCC=O D01120 [0,0,0,0,0,0|2,0,0]=2
1  B7R0.4  CC(C)CCON=O D00517 [0,1,0,0,0,0|3,0,0]=4
2  B7R0.4  CCCCCC(C)N D07371 [0,1,0,0,0,0|2,0,1]=4
3  B7R0.4  [*]C(=O)OCCOC D02748 [0,1,0,0,0,0|1,1,0]=3
4  B4R0.2  CCCCO D03200 [2,0,0,0,0,0|0,0,1]=3
5  B4R0.2  CCOCC D01772 [2,0,0,0,0,0|1,0,1]=4
6  B4R0.2  COCCO D05554 [2,0,0,0,0,0|0,1,1]=4
7  B6R0.4  NCCCC(=O)O D00058 [1,1,0,0,0,0|1,0,0]=3
8  B6R0.4  O=C([O-])CCCO D05866 [1,1,0,0,0,0|0,1,0]=3
9  B8R0.7  NCCCCCC(=O)O D00160 [0,2,0,0,0,0|1,0,0]=3
10  B8R0.8  CSCCC(N)C(=O)O D04983 [0,2,0,0,0,0|0,0,0]=2
11  B8R0.8  CSCC[C@H](N)C(=O)O D00019 [0,2,0,0,0,0|0,0,0]=2
12  B8R0.8  CSCC[C@H](N)[11C](=O)O D04984 [0,2,0,0,0,0|0,0,0]=2
13  B8R0.8  C[75Se]CC[C@H](N)C(=O)O D05816 [0,2,0,0,0,0|0,1,0]=3
14  B8R0.8  NCCC[C@H](N)C(=O)O D08302 [0,2,0,0,0,0|2,0,0]=4
15  B8R0.8  NCCC[C@H](N)C(=O)O D08303 [0,2,0,0,0,0|2,0,0]=4
16  B8R0.9  C=CC(N)CCC(=O)O D00535 [0,2,0,0,0,0|1,0,1]=4
17  B8R1.22  O=C1CCCCCO1 D05540 [0,1,0,1,0,0|1,0,0]=3
18  B8R1.7  O=C(O)C1CSCN1 D08601 [0,1,0,1,0,0|1,0,0]=3
19  B8R1.7  O=C(O)[C@@H]1CCCN1 D00035 [0,1,0,1,0,0|2,0,0]=4