0  B11R0.148  CCCCCCCCCC(=O)O T3379 [0,0,0,0,0,0|1,0,0]=1
1  B11R0.148  CCCCCCCCCC(=O)[O-] T21240 [0,0,0,0,0,0|1,0,0]=1
2  B11R0.148  CCCCCCCCCC(C)=O T8017 [0,0,0,0,0,0|0,0,0]=0
3  B11R0.148  CCCCCCCCOC(C)=O T5667 [0,0,0,0,0,0|1,0,0]=1
4  B11R0.148  CCCCCCC\C=C/C(=O)O TQ0251 [0,0,0,0,0,0|1,0,2]=3
5  B11R0.148  CCCCCCC\C=C\C(=O)O T7332 [0,0,0,0,0,0|1,0,2]=3
6  B11R0.148  CS(=O)CCCCCCN=C=S T15474 [0,0,0,0,0,0|3,0,1]=4
7  B11R0.148  N=C(N)NCCCCCCCN T11372 [0,0,0,0,0,0|4,0,0]=4
8  B10R0.4  CCCCCCCCC(=O)O T3947 [1,0,0,0,0,0|1,0,0]=2
9  B10R0.4  NCCCCCCCC(=O)O T8102 [1,0,0,0,0,0|2,0,0]=3
10  B10R0.71  CCCCCCCCCC=O T8086 [1,0,0,0,0,0|0,0,0]=1
11  B10R0.71  CCCCCCCCCCF T21116 [1,0,0,0,0,0|1,0,1]=3
12  B12R0.4  CCCCCCCC(O)CC(=O)O T7565 [0,1,0,0,0,0|1,0,0]=2
13  B12R0.234  C=CCCCCCCCCC(=O)O T0306 [0,1,0,0,0,0|1,0,1]=3
14  B12R0.234  C=CCCCCCCCCC(=O)[O-] T0744 [0,1,0,0,0,0|1,0,1]=3
15  B12R0.234  CC(=O)NCCCCNCCCN T19466 [0,1,0,0,0,0|2,0,0]=3
16  B12R0.234  CCCCCCCCCCC(=O)O T3948 [0,1,0,0,0,0|1,0,0]=2
17  B12R0.234  CCCCCCCC\C=C\C(=O)O T19589 [0,1,0,0,0,0|1,0,1]=3
18  B12R0.234  O=C(O)CCCCCCCCCO TMO2685 [0,1,0,0,0,0|1,0,0]=2
19  B12R0.234  O=C(O)\C=C\CCCCCCCO T3250 [0,1,0,0,0,0|1,0,2]=4
20  B12R0.268  O=C(O)CCCCCCCC(=O)O T0926 [0,1,0,0,0,0|2,0,1]=4
21  B12R1.255  NC(=O)CCCCC1CCSS1 T0823 [0,0,0,1,0,0|3,0,0]=4
22  B12R1.255  O=C(O)CCCCC1CCSS1 T0200 [0,0,0,1,0,0|3,0,0]=4
23  B9R0.2  CC(=O)NCCCCCN T5222 [2,0,0,0,0,0|2,0,0]=4
24  B9R0.2  CCCCCCCC(=O)O T3946 [2,0,0,0,0,0|1,0,0]=3
25  B11R0.40  CCCCCCCCC(C)C#N T21189 [1,1,0,0,0,0|1,0,1]=4
26  B11R0.176  O=C(O)CCCCC(S)CCS T21233 [1,1,0,0,0,0|2,0,0]=4
27  B11R0.3  CCCCCCCCCCCO T7480 [1,1,0,0,0,0|0,0,1]=3
28  B13R0.280  CCCCCCCCCCP(=O)(O)O T21191 [0,2,0,0,0,0|2,0,0]=4
29  B13R0.54  CCCCCCCCCCCC(=O)O T6873 [0,2,0,0,0,0|1,0,0]=3
30  B13R0.54  CCCCCC\C=C/CCCC(=O)O T8240 [0,2,0,0,0,0|1,0,0]=3
31  B13R0.179  CC(=O)NCCCCCCNC(C)=O T7863 [0,2,0,0,0,0|1,0,1]=4
32  B13R0.179  O=C(O)CCCCCCCCC(=O)O T3732 [0,2,0,0,0,0|1,0,1]=4
33  B13R2.1287  CC(=O)OC1CN2CCC1CC2 T22544 [0,0,0,2,0,0|2,0,0]=4