0  B10R0.71  C=CCCCCCCCCC SBB009051 [0,0,0,0,0,0|3,0,1]=4
1  B10R0.71  CCCCCCCCCC=O SBB058676 [0,0,0,0,0,0|2,1,1]=4
2  B10R0.71  CCCCCCCCCCBr SBB008838 [0,0,0,0,0,0|3,0,1]=4
3  B10R0.71  CCCCCCCCCCCl SBB059957 [0,0,0,0,0,0|3,0,1]=4
4  B10R0.71  CCCCCCCCCCF SBB087464 [0,0,0,0,0,0|3,0,1]=4
5  B10R0.71  CCCCCCCCCCO SBB059908 [0,0,0,0,0,0|2,1,1]=4
6  B10R0.71  CCCCCCCCCNC SBB059836 [0,0,0,0,0,0|3,0,1]=4
7  B10R0.71  CCCCCCCCN=C=O SBB068604 [0,0,0,0,0,0|1,1,0]=2
8  B10R0.71  CCCCCCCCN=C=S SBB058874 [0,0,0,0,0,0|1,0,0]=1
9  B10R0.71  CCCCCCCCNC=O SBB061176 [0,0,0,0,0,0|1,1,2]=4
10  B10R0.71  CCCCCCCCOCC SBB061155 [0,0,0,0,0,0|3,0,1]=4
11  B9R0.45  C#CCCCCCCCC SBB008883 [1,0,0,0,0,0|2,0,1]=4
12  B9R0.45  C=CCCCCCCCC SBB058674 [1,0,0,0,0,0|2,0,1]=4
13  B9R0.45  CCCCCCCCC=O SBB059872 [1,0,0,0,0,0|1,1,1]=4
14  B9R0.45  CCCCCCCCCBr SBB059939 [1,0,0,0,0,0|2,0,1]=4
15  B9R0.45  CCCCCCCCCCl SBB059956 [1,0,0,0,0,0|2,0,1]=4
16  B9R0.45  CCCCCCCCCN SBB059987 [1,0,0,0,0,0|2,0,1]=4
17  B9R0.45  CCCCCCCCCO SBB059907 [1,0,0,0,0,0|1,1,1]=4
18  B9R0.45  CCCCCCCCOC SBB061156 [1,0,0,0,0,0|1,1,1]=4
19  B9R0.45  CCCCCCCOC=O SBB060303 [1,0,0,0,0,0|1,1,1]=4
20  B11R0.3  CCSCCCCCCSCC SBB057107 [0,1,0,0,0,0|2,0,1]=4
21  B11R0.3  O=C=NCCCCCCN=C=O SBB069499 [0,1,0,0,0,0|1,1,1]=4
22  B8R0.4  C=CCCCCCCC SBB060474 [2,0,0,0,0,0|1,0,1]=4
23  B8R0.4  CCCCCCCC#N SBB060053 [2,0,0,0,0,0|1,0,1]=4
24  B8R0.4  CCCCCCCC=O SBB059871 [2,0,0,0,0,0|0,1,1]=4
25  B8R0.4  CCCCCCCCBr SBB059937 [2,0,0,0,0,0|1,0,1]=4
26  B8R0.4  CCCCCCCCCl SBB059955 [2,0,0,0,0,0|1,0,1]=4
27  B8R0.4  CCCCCCCCN SBB059986 [2,0,0,0,0,0|1,0,1]=4
28  B8R0.4  CCCCCCCCO SBB059902 [2,0,0,0,0,0|0,1,1]=4
29  B8R0.4  CCCCCCCNC SBB059820 [2,0,0,0,0,0|0,0,2]=4
30  B8R0.4  CCCCCCN=C=O SBB058614 [2,0,0,0,0,0|0,1,0]=3
31  B8R0.4  CCCCCCN=C=S SBB061289 [2,0,0,0,0,0|0,0,0]=2
32  B8R0.4  CCOCCCN=C=S SBB030512 [2,0,0,0,0,0|1,0,0]=3
33  B10R0.4  CCCCCCCNC(N)=S SBB017692 [1,1,0,0,0,0|0,0,2]=4