0  B11R0.3  CCCC\C=C\CCCCCC 100547 [0,0,0,0,0,0|1,0,3]=4
1  B11R0.3  C\C=C\CCCCCCCCO 102450 [0,0,0,0,0,0|2,0,1]=3
2  B10R0.71  CCCCCCCC#CCO 19498 [1,0,0,0,0,0|0,0,3]=4
3  B10R0.71  CCCCCC\C=C\CCO 102648 [1,0,0,0,0,0|0,0,3]=4
4  B10R0.71  COCOCCCCCCCl 102441 [1,0,0,0,0,0|3,0,0]=4
5  B10R0.71  N#CCCCCCCCCO 102452 [1,0,0,0,0,0|1,0,2]=4
6  B12R0.5  C\C=C\C=C\CCCCCCCC 103199 [0,1,0,0,0,0|1,0,2]=4
7  B12R0.234  CC#CCCCCCCCC(=O)O 102853 [0,1,0,0,0,0|0,0,2]=3
8  B12R0.234  N#CCCCCCCCCC(=O)O 102134 [0,1,0,0,0,0|1,0,1]=3
9  B12R1.8  CCCC\C=C\C1C=CCCC1 100797 [0,0,0,1,0,0|1,0,2]=4
10  B9R0.45  CCCC\C=C/CCCC 102626 [2,0,0,0,0,0|0,0,2]=4
11  B9R0.45  FCCCCCCCCF 102291 [2,0,0,0,0,0|2,0,0]=4
12  B9R0.45  OCCCCCCCCBr 102270 [2,0,0,0,0,0|1,0,1]=4
13  B11R0.148  C=CCCCCCCCC(=O)O 102318 [1,1,0,0,0,0|0,0,2]=4
14  B11R0.148  CCCCCCC\C=C\C(=O)O 16791 [1,1,0,0,0,0|0,0,2]=4
15  B13R0.54  C=CCCCCCCCCOC(C)=O 102451 [0,2,0,0,0,0|0,0,2]=4
16  B13R0.54  N#CCCCCCCCCCC(=O)O 102145 [0,2,0,0,0,0|0,0,1]=3
17  B13R0.147  CC#CCCCCCCCC(=O)OC 102445 [0,2,0,0,0,0|0,0,2]=4
18  B13R0.147  C\C=C\CCCCCCCC(=O)OC 102442 [0,2,0,0,0,0|0,0,2]=4
19  B13R0.336  CCCCCCCCCCCCCC 20252 [0,2,0,0,0,0|1,0,1]=4
20  B13R0.202  O=C(O)CCCCCCCC(F)CBr 102124 [0,2,0,0,0,0|1,0,0]=3
21  B11R1.180  CCCCCC1=CCCC1=O 16119 [1,0,0,1,0,0|0,0,2]=4
22  B11R1.180  CCCCCC1CC=CC1=O 16120 [1,0,0,1,0,0|0,0,2]=4