0  B14R0.88  CCCCCCCCCCCS([O-])(=O)=O Amb22052665 [0,0,0,0,0,0|1,0,3]=4
1  B14R0.88  CCCCCCCCCCOS(=O)(=O)[O-] Amb10789214 [0,0,0,0,0,0|0,0,3]=3
2  B14R0.88  CCCCCCCCCCSS(=O)(=O)C Amb17611641 [0,0,0,0,0,0|1,1,2]=4
3  B13R0.54  CCCCCC\C=C/CCCC(O)=O Amb20672025 [1,0,0,0,0,0|2,0,0]=3
4  B13R0.280  CCCCCCCCCCS(O)(=O)=O Amb22348234 [1,0,0,0,0,0|0,0,2]=3
5  B13R0.280  CCCCCCCCCOS(C)(=O)=O Amb24664290 [1,0,0,0,0,0|1,0,1]=3
6  B13R0.280  CCCCCCCCCOS([O-])(=O)=O Amb22045176 [1,0,0,0,0,0|0,0,2]=3
7  B15R0.252  CCCCCCCCCCCOS(O)(=O)=O Amb22731675 [0,1,0,0,0,0|0,0,2]=3
8  B15R0.252  CCCCCCCCCCCOS([O-])(=O)=O Amb22043316 [0,1,0,0,0,0|0,0,3]=4
9  B15R1.3890  OS(=O)(=O)CCCCNC1CCCCC1 Amb22264863 [0,0,0,1,0,0|2,0,1]=4
10  B12R0.5  CCCCCC\C=C/CCCCO Amb22740006 [2,0,0,0,0,0|2,0,0]=4
11  B12R0.5  CCCCCC\C=C\CCCCO Amb22740007 [2,0,0,0,0,0|2,0,0]=4
12  B12R0.234  CCCCCC\C=C\COC(C)=O Amb22231667 [2,0,0,0,0,0|2,0,0]=4
13  B12R0.119  CCCCCCCCCS(=O)(=O)Cl Amb22387375 [2,0,0,0,0,0|1,0,1]=4
14  B12R0.119  CCCCCCCCOS(C)(=O)=O Amb25311967 [2,0,0,0,0,0|1,0,0]=3
15  B12R0.119  CCCCCCCCOS([O-])(=O)=O Amb22047379 [2,0,0,0,0,0|0,0,1]=3
16  B12R0.119  CCCCCCCCSS(=O)(=O)C Amb17618843 [2,0,0,0,0,0|1,1,0]=4
17  B14R0.94  CCCCCCCCC(OS(=O)(=O)C)C Amb17611622 [1,1,0,0,0,0|1,0,1]=4
18  B16R0.1188  CCCCCCCCCCCCOS(O)(=O)=O Amb20663577 [0,2,0,0,0,0|0,0,2]=4
19  B16R0.1188  CCCCCCCCCCCCOS(O)(=O)=O Amb22337025 [0,2,0,0,0,0|0,0,2]=4
20  B16R0.1188  CCCCCCCCCCCCOS(O)(=O)=O Amb22348217 [0,2,0,0,0,0|0,0,2]=4
21  B14R1.93  CCC1CCCCC1COS(C)(=O)=O Amb25243912 [1,0,0,1,0,0|1,0,1]=4
22  B14R1.334  N[C@@H]1CCCCCC[C@H]1OS(O)(=O)=O Amb25175887 [1,0,0,1,0,0|1,0,1]=4
23  B14R1.3331  CS(=O)(=O)OCCCC1CCCCC1 Amb24552713 [1,0,0,1,0,0|1,0,1]=4
24  B14R1.10310  CS(=O)(=O)CC\C=C/1\CCCNCC1 Amb24667358 [1,0,0,1,0,0|2,0,0]=4
25  B14R1.10310  CS(=O)(=O)OCCC1CCCCCC1 Amb24576231 [1,0,0,1,0,0|1,0,1]=4
26  B14R1.10310  CS(=O)(=O)OCCN1CCCCCC1 Amb24396942 [1,0,0,1,0,0|2,0,0]=4