0  B8R1.4  CC1CCCC(C)N1 T1007 [1,0,0,0,0,0|2,0,1]=4
1  B8R1.4  C[C@@H]1CCN=C(N)S1 T22569 [1,0,0,0,0,0|3,0,0]=4
2  B8R0.2  CCC(C)C(=O)C(=O)O T8264 [0,0,1,0,0,0|1,0,0]=2
3  B8R0.2  CC[C@@H](C)[C@H](N)C(=O)O T5219 [0,0,1,0,0,0|2,0,1]=4
4  B8R0.2  CC[C@H](C)[C@H](N)C(=O)O T0063 [0,0,1,0,0,0|2,0,1]=4
5  B8R1.50  N[C@H]1CCN(O)C1=O T23298 [0,0,0,0,1,0|2,0,1]=4
6  B7R0.5  CCCC(=O)C(=O)O T13484 [1,0,1,0,0,0|1,0,0]=3
7  B7R0.5  CCCC(C)C(=O)O T5685 [1,0,1,0,0,0|0,0,1]=3
8  B7R0.5  CCCC(N)C(=O)O T11054 [1,0,1,0,0,0|1,0,1]=4
9  B7R0.5  CCC[C@H](N)C(=O)O T4788 [1,0,1,0,0,0|1,0,1]=4
10  B7R0.16  CC(C)C(=O)C(=O)O T5232 [1,0,1,0,0,0|1,0,0]=3
11  B7R0.4  NCCCCC(=O)O T5089 [1,0,1,0,0,0|1,0,1]=4
12  B7R1.3  O=C1CCCCO1 T4821 [2,0,0,0,0,0|1,0,0]=3
13  B9R1.66  CC1(O)CCOC(=O)C1 T1353 [1,1,0,0,0,0|1,0,1]=4
14  B11R1.424  CC1=C(C=O)C(C)(C)CCC1 T7921 [0,2,0,0,0,0|1,0,0]=3
15  B7R1.4  NC1CCSC1=O T5968 [1,0,0,0,1,0|2,0,0]=4
16  B7R1.4  N[C@H]1CCSC1=O T19393 [1,0,0,0,1,0|2,0,0]=4