0  B11R0.148  CCCCCCCCCC(=O)O T3379 [0,0,0,0,0,0|0,0,0]=0
1  B11R0.148  CCCCCCCCCC(=O)[O-] T21240 [0,0,0,0,0,0|0,0,1]=1
2  B11R0.148  CCCCCCCCCC(C)=O T8017 [0,0,0,0,0,0|1,0,0]=1
3  B11R0.148  CCCCCCCCOC(C)=O T5667 [0,0,0,0,0,0|2,0,0]=2
4  B11R0.148  CCCCCCC\C=C/C(=O)O TQ0251 [0,0,0,0,0,0|0,0,2]=2
5  B11R0.148  CCCCCCC\C=C\C(=O)O T7332 [0,0,0,0,0,0|0,0,2]=2
6  B11R0.148  N=C(N)NCCCCCCCN T11372 [0,0,0,0,0,0|4,0,0]=4
7  B10R0.4  CCCCCCCCC(=O)O T3947 [1,0,0,0,0,0|0,0,0]=1
8  B10R0.4  NCCCCCCCC(=O)O T8102 [1,0,0,0,0,0|1,0,0]=2
9  B10R0.71  CCCCCCCCCC=O T8086 [1,0,0,0,0,0|0,0,0]=1
10  B10R0.71  CCCCCCCCCCF T21116 [1,0,0,0,0,0|1,0,1]=3
11  B12R0.4  CCCCCCCC(O)CC(=O)O T7565 [0,1,0,0,0,0|0,0,0]=1
12  B12R0.234  C=CCCCCCCCCC(=O)O T0306 [0,1,0,0,0,0|0,0,1]=2
13  B12R0.234  C=CCCCCCCCCC(=O)[O-] T0744 [0,1,0,0,0,0|0,0,2]=3
14  B12R0.234  CC(=O)NCCCCNCCCN T19466 [0,1,0,0,0,0|3,0,0]=4
15  B12R0.234  CCCCCCCCCCC(=O)O T3948 [0,1,0,0,0,0|0,0,0]=1
16  B12R0.234  CCCCCCCC\C=C\C(=O)O T19589 [0,1,0,0,0,0|0,0,1]=2
17  B12R0.234  O=C(O)CCCCCCCCCO TMO2685 [0,1,0,0,0,0|0,0,0]=1
18  B12R0.234  O=C(O)\C=C\CCCCCCCO T3250 [0,1,0,0,0,0|0,0,2]=3
19  B12R0.268  O=C(O)CCCCCCCC(=O)O T0926 [0,1,0,0,0,0|1,0,1]=3
20  B12R1.255  NC(=O)CCCCC1CCSS1 T0823 [0,0,0,1,0,0|3,0,0]=4
21  B12R1.255  O=C(O)CCCCC1CCSS1 T0200 [0,0,0,1,0,0|2,0,0]=3
22  B9R0.2  CCCCCCCC(=O)O T3946 [2,0,0,0,0,0|0,0,0]=2
23  B9R0.2  CCCCC\C=C\C(=O)O T5261 [2,0,0,0,0,0|0,0,2]=4
24  B11R0.30  CC(=O)NCCCCCC(=O)O T0436 [1,1,0,0,0,0|1,0,1]=4
25  B11R0.30  O=C(O)CCCCCCC(=O)O T4734 [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|1,0,0]=3
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|1,0,0]=3
29  B13R0.54  CCCCCCCCCCCC(=O)O T6873 [0,2,0,0,0,0|0,0,0]=2
30  B13R0.54  CCCCCC\C=C/CCCC(=O)O T8240 [0,2,0,0,0,0|0,0,0]=2
31  B13R0.179  O=C(O)CCCCCCCCC(=O)O T3732 [0,2,0,0,0,0|0,0,1]=3