0  B11R0.148  O=C(O)CCCCCCCCBr B18462 [0,0,0,0,0,0|1,0,2]=3
1  B10R0.4  CCCCCCCCC(=N)N N13879 [1,0,0,0,0,0|2,0,1]=4
2  B10R0.4  CCCCCCCNC(N)=S H8001 [1,0,0,0,0,0|2,1,0]=4
3  B10R0.4  O=C(O)CCCCCCCBr B3812 [1,0,0,0,0,0|1,0,1]=3
4  B12R0.234  C(CCCCCCCO)=CC(=O)O Q3294 [0,1,0,0,0,0|0,0,0]=1
5  B12R0.234  C(CCCCCCCO)=CC(=O)O Q3294 [0,1,0,0,0,0|0,0,0]=1
6  B12R0.234  O=C(O)CCCCCCCCCBr B5460 [0,1,0,0,0,0|0,0,2]=3
7  B12R0.248  CCCCCCCCOC(=O)CN G10061 [0,1,0,0,0,0|2,0,1]=4
8  B12R0.251  CCCCCCCCC(O)C(=O)O H15054 [0,1,0,0,0,0|0,0,2]=3
9  B12R1.252  O=C(O)CCCC1CCNCC1 P17612 [0,0,0,1,0,0|1,0,2]=4
10  B9R0.2  CCCCCCCC(=N)N O13890 [2,0,0,0,0,0|2,0,0]=4
11  B11R1.86  CC1CNCCC1CC(=O)O M4469 [1,0,0,1,0,0|1,0,1]=4
12  B11R1.91  N1CCC(CCC(=O)O)CC1 P11831 [1,0,0,1,0,0|1,0,1]=4
13  B11R1.91  O=C(O)CCC1CCCCN1 P14397 [1,0,0,1,0,0|1,0,1]=4
14  B11R1.91  O=C(O)CCC1CCC[NH2+]C1 P12684 [1,0,0,1,0,0|1,0,1]=4
15  B11R1.91  O=C(O)CCN1CCCCC1 P17611 [1,0,0,1,0,0|1,0,1]=4
16  B11R1.143  NC1CCCCCC1C(=O)O A12931 [1,0,0,1,0,0|1,0,1]=4
17  B13R2.72  [C@H]12CCCC[C@H]1C(C(=O)O)=NO2 H7807 [0,0,0,2,0,0|2,0,0]=4
18  B13R2.435  O=C(O)C1CC2CCCCC2N1 C4786 [0,0,0,2,0,0|1,0,1]=4
19  B13R2.435  O=C(O)C1CC2CCCCC2N1 C4786 [0,0,0,2,0,0|1,0,1]=4
20  B13R2.435  [C@@H]12CCCC[C@@H]1N[C@H](C(=O)O)C2 C7228 [0,0,0,2,0,0|1,0,1]=4
21  B13R2.435  [C@@H]12CCCC[C@@H]1N[C@H](C(=O)O)C2 C7228 [0,0,0,2,0,0|1,0,1]=4