0  B11R0.3  ICCCCCCCCCCI 3585885 [0,0,0,0,0,0|2,0,2]=4
1  B11R0.3  OCCCCCCCCCCO 2847231 [0,0,0,0,0,0|1,0,2]=3
2  B10R0.71  CCCCCCCCCCN 2821858 [1,0,0,0,0,0|1,0,1]=3
3  B10R0.71  CCCCCCNCCCC 1868677 [1,0,0,0,0,0|1,0,2]=4
4  B12R0.5  CCCCCCCCCCCCO 2929790 [0,1,0,0,0,0|0,0,2]=3
5  B9R0.45  CCCCCCCCCCl 2832692 [2,0,0,0,0,0|1,0,0]=3
6  B9R0.45  CCCCCNCCCC 1366728 [2,0,0,0,0,0|1,0,1]=4
7  B9R0.45  NCCCCCCCCN 22430526 [2,0,0,0,0,0|2,0,0]=4
8  B11R0.4  CCCCCCCC(=O)OCC 2845347 [1,1,0,0,0,0|2,0,0]=4
9  B13R0.54  CCCCCCCCCCCC(=O)O 3033876 [0,2,0,0,0,0|0,0,2]=4
10  B13R1.279  OC1CCCCCCCCCCC1 2927054 [0,1,0,1,0,0|0,0,2]=4