0  B16R0.1188  CCCCCCCCCCCCOS(=O)(=O)O CS-0152176 [0,0,0,0,0,0|0,0,0]=0
1  B15R0.164  CCCCCCCCCCCCCC(=O)O CS-0018531 [1,0,0,0,0,0|2,0,0]=3
2  B15R0.164  CCCCCCCCCCCCCC(=O)[O-] CS-0198234 [1,0,0,0,0,0|2,0,1]=4
3  B15R0.164  CCCCCCCCCCCCCC(C)=O CS-0187603 [1,0,0,0,0,0|3,0,0]=4
4  B15R0.164  CCCCCCCCCCCCCC(N)=O CS-0152225 [1,0,0,0,0,0|3,0,0]=4
5  B15R0.164  O=C(O)CCCCCCCCCCCCBr CS-0254699 [1,0,0,0,0,0|3,0,0]=4
6  B15R0.164  O=C(O)CCCCCCCCCCCCO CS-0523206 [1,0,0,0,0,0|3,0,0]=4
7  B15R0.252  CCCCCCCCCCCCP(=O)(O)O CS-0152175 [1,0,0,0,0,0|1,0,1]=3
8  B17R0.197  CCCCCCCCCCCCCCS(=O)(=O)[O-] CS-0148402 [0,1,0,0,0,0|1,0,1]=3
9  B17R0.14367  CCCCCCCCCCCCOS(=O)(=O)O[Na] CS-0182093 [0,1,0,0,0,0|0,0,0]=1
10  B17R0.14367  [Li]OS(=O)(=O)OCCCCCCCCCCCC CS-0152177 [0,1,0,0,0,0|0,0,0]=1
11  B14R0.392  CCCCCCCCCCCCCCO CS-W004294 [2,0,0,0,0,0|2,0,0]=4
12  B14R0.394  CCCCCCCCCCCCB(O)O CS-0175075 [2,0,0,0,0,0|1,0,1]=4
13  B14R0.394  CCCCCCCCCCCCC(=O)O CS-D1510 [2,0,0,0,0,0|1,0,0]=3
14  B14R0.394  CCCCCCCCCCCCC(C)=O CS-0149221 [2,0,0,0,0,0|2,0,0]=4
15  B14R0.394  CCCCCCCCCCCCS(C)=O CS-W010351 [2,0,0,0,0,0|1,0,1]=4
16  B14R0.394  O=C(O)CCCCCCCCCCCBr CS-0158383 [2,0,0,0,0,0|2,0,0]=4
17  B16R0.221  CCCCCCCCCCCCCC(=O)OC CS-W004288 [1,1,0,0,0,0|2,0,0]=4
18  B16R0.221  CCCCCCCCCCCCCC(=O)O[K] CS-0198057 [1,1,0,0,0,0|2,0,0]=4
19  B16R0.221  CCCCCCCCCCCCCC(=O)O[Na] CS-0185812 [1,1,0,0,0,0|2,0,0]=4
20  B16R0.274  CCCCCCCCCCCCCCC(=O)O CS-W004283 [1,1,0,0,0,0|2,0,0]=4
21  B16R0.274  CCCCCCCCCCNCCCC(=O)O CS-0221806 [1,1,0,0,0,0|2,0,0]=4
22  B16R0.274  O=C(O)CCCCCCCCCCCCCBr CS-0091052 [1,1,0,0,0,0|2,0,0]=4
23  B16R0.274  O=C(O)CCCCCCCCCCCCCO CS-0161824 [1,1,0,0,0,0|2,0,0]=4
24  B16R0.302  CCCCCCCCCCCC(O)CC(=O)O CS-W010260 [1,1,0,0,0,0|2,0,0]=4
25  B16R0.302  CCCCCCCCCCC[C@@H](O)CC(=O)O CS-0333355 [1,1,0,0,0,0|2,0,0]=4
26  B16R0.3292  CCCCCCCCCCCCS(=O)(=O)O[Na] CS-0148398 [1,1,0,0,0,0|0,0,0]=2
27  B16R0.3292  CCCCCCCCCCCCS(=O)(=O)O[Na] CS-W010092 [1,1,0,0,0,0|0,0,0]=2