0  B8R0.7  CC(=O)NCCCCN T7508 [0,0,0,0,0,0|2,0,1]=3
1  B8R0.7  NCCCCCC(=O)O T0881 [0,0,0,0,0,0|2,0,2]=4
2  B7R0.4  CCCCCC(C)N T0359 [1,0,0,0,0,0|1,0,2]=4
3  B7R0.4  C\C=C\C=C\C(=O)O T8019 [1,0,0,0,0,0|1,0,2]=4
4  B7R0.4  C\C=C\C=C\C(=O)[O-] T4807 [1,0,0,0,0,0|1,0,2]=4
5  B7R0.4  NCCCCC(=O)O T5089 [1,0,0,0,0,0|2,0,1]=4
6  B9R0.2  CC(=O)NCCCCCN T5222 [0,1,0,0,0,0|1,0,1]=3
7  B9R0.2  CCCCCCCC(=O)O T3946 [0,1,0,0,0,0|1,0,2]=4
8  B9R0.2  CCCCC\C=C\C(=O)O T5261 [0,1,0,0,0,0|1,0,0]=2
9  B9R1.6  O=C(O)C1=CCCNC1 T7557 [0,0,0,1,0,0|2,0,0]=3
10  B9R1.6  O=C(O)C1=CCCNC1 TN1717 [0,0,0,1,0,0|2,0,0]=3
11  B9R1.6  O=C(O)C1=CCNCC1 T11684 [0,0,0,1,0,0|2,0,0]=3
12  B9R1.6  O=C(O)C1CCCCC1 T5563 [0,0,0,1,0,0|1,0,2]=4
13  B9R1.6  O=C(O)C1CCCCN1 T4819 [0,0,0,1,0,0|2,0,1]=4
14  B9R1.6  O=C(O)[C@@H]1CCCCN1 T4762 [0,0,0,1,0,0|2,0,1]=4
15  B9R1.6  O=C(O)[C@H]1CCCCN1 T13634 [0,0,0,1,0,0|2,0,1]=4
16  B6R0.6  CC\C=C/CCO T22295 [2,0,0,0,0,0|1,0,1]=4
17  B6R0.4  CSCCC(=O)O T5285 [2,0,0,0,0,0|2,0,0]=4
18  B6R0.4  NCCCC(=O)O T0508 [2,0,0,0,0,0|2,0,0]=4
19  B6R0.4  NC\C=C\C(=O)O T23414 [2,0,0,0,0,0|2,0,0]=4
20  B6R0.4  O=C(O)\C=C\CO T23473 [2,0,0,0,0,0|2,0,0]=4
21  B8R0.8  CCCCC(O)C(=O)O T5224 [1,1,0,0,0,0|1,0,1]=4
22  B8R0.8  CCCC[C@H](N)C(=O)O T4765 [1,1,0,0,0,0|1,0,1]=4
23  B10R0.3  CC(C)=CCCC(C)CCO T3240 [0,2,0,0,0,0|1,0,1]=4
24  B10R0.3  CC(C)=CCC[C@@H](C)CCO T8266 [0,2,0,0,0,0|1,0,1]=4
25  B10R1.28  C[P@@](=O)(O)C1=CCNCC1 T23467 [0,1,0,1,0,0|2,0,0]=4
26  B10R1.15  COC(=O)C1=CCCNC1 T5805 [0,1,0,1,0,0|1,0,0]=3
27  B10R1.15  COC(=O)C1CCCCC1 T22366 [0,1,0,1,0,0|0,0,2]=4
28  B10R1.113  CN1CCC=C(C(=O)O)C1 T5799 [0,1,0,1,0,0|2,0,0]=4
29  B10R1.113  CN1CCC=C(C(=O)O)C1 TN1398 [0,1,0,1,0,0|2,0,0]=4