0  B12R0.5  CCCCCCCCC\C=C\C=O D89988 [0,0,0,0,0,0|0,0,2]=2
1  B12R0.5  CCCCCCCCC\C=C\CO D89949 [0,0,0,0,0,0|0,0,4]=4
2  B12R0.5  CCCCCCC\C=C\C=C\CO D90034 [0,0,0,0,0,0|0,0,2]=2
3  B11R0.3  C=CCOCCCCCCCC D88370 [1,0,0,0,0,0|1,0,2]=4
4  B11R0.3  CCCCCCCC\C=C\CO F14361 [1,0,0,0,0,0|0,0,3]=4
5  B11R0.3  CCCCCC\C=C/C=C\CO D92768 [1,0,0,0,0,0|0,0,2]=3
6  B13R0.2  CCCCCCC\C=C\C(=O)OCC D90112 [0,1,0,0,0,0|2,0,1]=4
7  B13R1.28  CCCCCCCC1=CC=CC=C1 F21475 [0,0,0,1,0,0|1,0,0]=2
8  B13R1.119  CCCCCCCCN1C=CC=C1 D91841 [0,0,0,1,0,0|2,0,1]=4
9  B10R0.71  C=CCCCCCCCCC D92764 [2,0,0,0,0,0|0,0,2]=4
10  B10R0.71  C=C\C=C\C=C\CCCCC D92769 [2,0,0,0,0,0|0,0,1]=3
11  B10R0.71  CCCCC\C=C\C=C\CO D89948 [2,0,0,0,0,0|0,0,2]=4
12  B12R0.234  O=C(O)\C=C\CCCCCCCO O10366 [1,1,0,0,0,0|1,0,1]=4
13  B14R0.394  CCCCCCCCCC\C=C/C(=O)O D92390 [0,2,0,0,0,0|0,0,2]=4
14  B12R1.8  CCCCOCC1=CC=CC=C1 D88615 [1,0,0,1,0,0|1,0,1]=4
15  B12R1.37  CCCCCCCN1C=CN=C1 AC6315 [1,0,0,1,0,0|2,0,0]=4
16  B14R1.123  OCCCCCNCC1=CC=CC=C1 D89016 [0,1,0,1,0,0|2,0,0]=4
17  B14R1.14  CCCCCCCC1=CC=C(N)C=C1 D90911 [0,1,0,1,0,0|1,0,0]=3
18  B14R1.14  CCCCCCOC1=CC=C(I)C=C1 E10185 [0,1,0,1,0,0|2,0,0]=4
19  B14R2.6  C1=CC=C(C[C@H]2CCCNC2)C=C1 AR1511 [0,0,0,2,0,0|2,0,0]=4
20  B14R2.6  C1=CN=C(CN2CCCCC2)C=C1 D77833 [0,0,0,2,0,0|2,0,0]=4
21  B14R2.101  C1=CC=C(CNC2CCCC2)C=C1 C77921 [0,0,0,2,0,0|2,0,0]=4
22  B14R2.1253  C1=CC=C([C@@H]2CCCCCN2)C=C1 N12399 [0,0,0,2,0,0|2,0,0]=4