0  B9R0.2  C=C(C)\C=C\C=C\CCC 102643 [0,0,0,0,0,0|2,0,1]=3
1  B9R0.2  CCC#CCCOC(C)=O 102447 [0,0,0,0,0,0|0,0,3]=3
2  B9R0.2  CCCCCC\C=C(\C)I 102863 [0,0,0,0,0,0|2,0,2]=4
3  B8R0.4  C=C\C=C\C=C\CCC 102625 [1,0,0,0,0,0|1,0,2]=4
4  B8R0.4  CCC\C=C\CCCC 102651 [1,0,0,0,0,0|1,0,1]=3
5  B8R0.7  C=C(C)COCCCC 102301 [1,0,0,0,0,0|2,0,1]=4
6  B8R0.7  C=CCCCOC(C)=O 102329 [1,0,0,0,0,0|0,0,3]=4
7  B8R0.7  CCCC\C=C\C(=O)O 16793 [1,0,0,0,0,0|1,0,2]=4
8  B8R0.7  CCCC\C=C\C(=O)[O-] 12809 [1,0,0,0,0,0|1,0,2]=4
9  B10R0.4  CCC\C=C\C=C/C=C(C)C 100532 [0,1,0,0,0,0|2,0,1]=4
10  B10R0.55  CC(=O)OCCCC(F)CBr 102334 [0,1,0,0,0,0|1,0,2]=4
11  B7R0.1  CCO\C=C/OCC 103144 [2,0,0,0,0,0|1,0,1]=4
12  B7R0.1  CCO\C=C\OCC 103128 [2,0,0,0,0,0|1,0,1]=4
13  B7R0.1  C\C=C/CCCCC 102713 [2,0,0,0,0,0|1,0,1]=4
14  B7R0.4  CC(=O)OC\C=C/Br 103141 [2,0,0,0,0,0|1,0,0]=3
15  B7R0.4  CCO\C=C\C(=O)O 103160 [2,0,0,0,0,0|2,0,0]=4
16  B9R0.18  CCCCC(=O)COCC 103118 [1,1,0,0,0,0|0,0,2]=4
17  B9R0.45  CCCC\C=C/CCCC 102626 [1,1,0,0,0,0|1,0,1]=4
18  B9R0.45  C\C=C\C=C/C=C/CCC 102629 [1,1,0,0,0,0|1,0,1]=4
19  B11R0.59  CCOC(=O)\C(C)=C\OC(C)=O 16752 [0,2,0,0,0,0|1,0,1]=4
20  B11R0.111  CC(=O)OCCCCC(F)CBr 102309 [0,2,0,0,0,0|0,0,2]=4
21  B11R1.157  CC(=O)NC1=CC(=O)CCC1 13499 [0,1,0,1,0,0|1,0,1]=4
22  B11R1.157  CC(=O)OC1=CC(=O)CCC1 19982 [0,1,0,1,0,0|0,0,1]=3
23  B11R1.86  CC(=O)O[C@@H]1CCCC[C@H]1O 19438 [0,1,0,1,0,0|0,0,2]=4
24  B11R1.706  O=C(O)C1CCC=CCCC1 18361 [0,1,0,1,0,0|2,0,0]=4