0  B7R1.3  NN1CCCCC1 T0533 [1,0,0,0,0,0|3,0,0]=4
1  B7R1.3  O=C1CCCCO1 T4821 [1,0,0,0,0,0|0,0,2]=3
2  B9R1.6  O=C(O)C1CCCCC1 T5563 [0,1,0,0,0,0|1,0,1]=3
3  B9R1.6  O=C(O)C1CCCCN1 T4819 [0,1,0,0,0,0|1,0,1]=3
4  B9R1.6  O=C(O)C1CCNCC1 T22348 [0,1,0,0,0,0|2,0,1]=4
5  B9R1.6  O=C(O)[C@@H]1CCCCN1 T4762 [0,1,0,0,0,0|1,0,1]=3
6  B9R1.6  O=C(O)[C@@H]1CCCNC1 T22482 [0,1,0,0,0,0|2,0,1]=4
7  B9R1.6  O=C(O)[C@H]1CCCCN1 T13634 [0,1,0,0,0,0|1,0,1]=3
8  B7R0.1  NCCCNCCS TQ0133 [0,0,1,0,0,0|2,1,0]=4
9  B6R0.6  CC\C=C/CCO T22295 [1,0,1,0,0,0|0,0,2]=4
10  B6R0.6  COCCCCO T7022 [1,0,1,0,0,0|1,0,0]=3
11  B6R0.6  NCCCCCN T4895 [1,0,1,0,0,0|2,0,0]=4
12  B8R0.4  CCCCCCCCO T10024 [0,1,1,0,0,0|1,0,0]=3
13  B8R0.4  NCCCCCCCN T7998 [0,1,1,0,0,0|2,0,0]=4
14  B8R0.6  CCCCCC(O)CC TN1267 [0,1,1,0,0,0|2,0,0]=4
15  B8R0.7  NCCCCCC(=O)O T0881 [0,1,1,0,0,0|1,0,1]=4
16  B8R0.3  O=CC[C@H](O)[C@H](O)CO T4818 [0,1,1,0,0,0|1,0,1]=4
17  B8R0.8  CCCCC(O)C(=O)O T5224 [0,1,1,0,0,0|0,0,1]=3
18  B8R0.8  CCCC[C@H](N)C(=O)O T4765 [0,1,1,0,0,0|1,0,1]=4
19  B8R1.3  OC1COC(O)CO1 T4748 [1,1,0,0,0,0|1,0,0]=3
20  B8R1.4  CC1CCCC(C)N1 T1007 [1,1,0,0,0,0|1,0,0]=3
21  B8R1.5  N[C@@H]1CCCC[C@H]1N T0164 [1,1,0,0,0,0|2,0,0]=4
22  B8R1.5  O[C@@H]1CCCC[C@H]1O T4763 [1,1,0,0,0,0|1,0,0]=3
23  B8R1.7  O=C(O)[C@@H]1CCCN1 T2O2683 [0,1,0,0,1,0|1,0,1]=4
24  B8R1.7  O=C(O)[C@@H]1CCCN1 TN1593 [0,1,0,0,1,0|1,0,1]=4
25  B8R1.7  O=C(O)[C@H]1CCCN1 T5302 [0,1,0,0,1,0|1,0,1]=4
26  B10R1.13  O=C(O)[C@H]1CC[C@H](O)CC1 T8091 [0,2,0,0,0,0|1,0,1]=4
27  B10R1.2  OC[C@H]1NCC[C@@H](O)C1O TQ0298 [0,2,0,0,0,0|1,0,0]=3
28  B10R1.15  COC(=O)C1CCCCC1 T22366 [0,2,0,0,0,0|1,0,1]=4
29  B10R1.61  O=C(O)C1CCCCN1O T19458 [0,2,0,0,0,0|1,0,1]=4
30  B10R2.71  OC1C[C@@H]2CC[C@H](C1)N2 T1341 [0,1,0,1,0,0|2,0,0]=4