0  B9R0.56  CC(=O)OCC[N+](C)(C)C C74167 [0,0,0,0,0,0|0,0,0]=0
1  B9R0.56  CC(=O)SCC[Si](C)(C)C 74845 [0,0,0,0,0,0|1,1,0]=2
2  B8R0.28  CC(=O)NCCC(C)C S10520 [1,0,0,0,0,0|2,0,0]=3
3  B8R0.28  CC(=O)OCCC(=O)O C77559 [1,0,0,0,0,0|3,0,0]=4
4  B10R0.31  CC(=O)O[C@@H](C)C[N+](C)(C)C C75939 [0,1,0,0,0,0|0,0,0]=1
5  B10R0.31  C[N+](C)(C)C[C@@H](O)CC(=O)[O-] 44208 [0,1,0,0,0,0|2,0,0]=3
6  B10R0.92  CC(C)(C)CC[C@H](N)C(=O)O D93747 [0,1,0,0,0,0|3,0,0]=4
7  B10R1.112  CC(C)(C)OC1CC(=O)C1 W15905 [0,0,0,1,0,0|3,0,0]=4
8  B10R1.302  CC1(C)CCNC(=O)CC1 W16051 [0,0,0,1,0,0|2,0,0]=3
9  B8R0.29  CC(=O)ONC(C)(C)C 77604 [0,0,0,0,1,0|2,0,0]=3
10  B8R0.29  CC(C)(S)CCC(=O)O P19032 [0,0,0,0,1,0|3,0,0]=4
11  B8R0.29  CC(C)=CCC(C)(C)C D93076 [0,0,0,0,1,0|2,0,1]=4
12  B7R0.4  CC(=O)OCCCBr C75766 [2,0,0,0,0,0|2,0,0]=4
13  B7R0.8  C[Si](C)(C)CCON C14911 [2,0,0,0,0,0|2,0,0]=4
14  B9R0.57  CC(C)(C)C[C@H](N)C(=O)O 51152 [0,1,0,0,1,0|2,0,0]=4
15  B11R0.34  C=C(COC(C)=O)C[Si](C)(C)C 71080 [0,1,0,0,0,1|1,0,0]=3
16  B11R0.199  CC(C)(C)OCCOS(C)(=O)=O AR2801 [0,1,0,0,0,1|2,0,0]=4
17  B9R1.49  CN1CCNC(=O)CC1 Y10078 [1,0,0,1,0,0|1,0,1]=4
18  B9R1.53  CC(=O)OC1CC(=O)C1 38846 [1,0,0,1,0,0|2,0,0]=4
19  B9R1.10  CC1(O)CCC(=O)CC1 F13738 [0,0,0,1,1,0|2,0,0]=4
20  B9R1.51  CC(C)(C)C1CC(=O)C1 P17616 [0,0,0,1,1,0|1,0,0]=3
21  B9R1.164  CC1(C)CC(C(=O)O)C1 59979 [0,0,0,1,1,0|2,0,0]=4
22  B7R0.6  CC(=O)ON=C(C)C F19954 [1,0,0,0,1,0|2,0,0]=4
23  B7R0.6  C[S+](C)CCC(=O)O T70554 [1,0,0,0,1,0|2,0,0]=4
24  B7R0.9  C[N+](C)(C)CC(=O)O D85123 [0,0,0,0,2,0|1,0,0]=3
25  B9R0.55  CC(=O)CCCOC(C)=O D74850 [1,0,0,0,0,1|2,0,0]=4