0  B9R0.45  ICCOCCOCCI M26870 [0,0,0,0,0,0|4,0,0]=4
1  B9R0.45  NCCCCNCCCN M19710 [0,0,0,0,0,0|3,0,0]=3
2  B9R0.45  NCCCCNCCCN M19880 [0,0,0,0,0,0|3,0,0]=3
3  B9R0.45  NCCNCCNCCN M24342 [0,0,0,0,0,0|0,0,0]=0
4  B8R0.4  NCCCCCCCN M21554 [1,0,0,0,0,0|1,0,0]=2
5  B8R0.4  NCCCNCCCN M19708 [1,0,0,0,0,0|2,0,0]=3
6  B7R0.1  NCCCNCCS M29602 [2,0,0,0,0,0|1,0,0]=3
7  B7R0.1  NCCSSCCN M24550 [2,0,0,0,0,0|2,0,0]=4
8  B9R0.2  CC(=O)NCCCCCN M19992 [1,1,0,0,0,0|1,0,1]=4
9  B9R0.2  CCCCCNCC(N)=O M28420 [1,1,0,0,0,0|1,0,1]=4
10  B9R1.8  CCCC1CCCCN1 M23697 [1,0,0,1,0,0|2,0,0]=4
11  B9R1.8  OCCN1CCSCC1 M28627 [1,0,0,1,0,0|2,0,0]=4
12  B11R1.28  NCCCNC1CCCCC1 M28059 [0,1,0,1,0,0|2,0,0]=4