0 B9R0.56 CC(=O)O[Hg]CC(C)(C)C S881805 [0,0,0,0,0,0|3,0,0]=3 1 B9R0.56 CC(C)(C)SCCC(=O)O PH010949 [0,0,0,0,0,0|4,0,0]=4 2 B8R0.21 CC(C)(S)CCOC=O CDS012047 [1,0,0,0,0,0|2,0,0]=3 3 B8R0.28 C=C(C)CCOC(=O)C S881171 [1,0,0,0,0,0|2,0,1]=4 4 B8R0.28 CC(=O)CCCC(=O)N PH008391 [1,0,0,0,0,0|3,0,0]=4 5 B8R0.28 CC(=O)CCCC(C)C CDS000306 [1,0,0,0,0,0|3,0,0]=4 6 B8R0.28 CC(=O)CCCN(C)C PH014778 [1,0,0,0,0,0|2,0,1]=4 7 B8R0.28 CC(=O)CCOC(=O)C PH003361 [1,0,0,0,0,0|3,0,0]=4 8 B8R0.28 CC(=O)OCCN(C)C PH011981 [1,0,0,0,0,0|1,0,1]=3 9 B8R0.28 CC(C)CCCC(=O)O CDS003381 [1,0,0,0,0,0|3,0,0]=4 10 B8R0.28 CC(C)NCCC(=O)N CDS021106 [1,0,0,0,0,0|3,0,0]=4 11 B8R0.28 CN(C)CCSC(=N)N CDS025262 [1,0,0,0,0,0|1,1,1]=4 12 B10R0.31 CC(CC(=O)O)CC(C)(C)C S415006 [0,1,0,0,0,0|3,0,0]=4 13 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)[O-] CDS013585 [0,1,0,0,0,0|2,0,0]=3 14 B10R0.60 C=CC(=O)NCC[N+](C)(C)C T300799 [0,1,0,0,0,0|2,0,0]=3 15 B10R0.60 CCC(=O)OCC[N+](C)(C)C S442631 [0,1,0,0,0,0|1,0,0]=2 16 B10R0.60 CNC(=O)CCNC(C)(C)C PH012675 [0,1,0,0,0,0|3,0,0]=4 17 B10R0.60 COC(=O)CCN[N+](C)(C)C S196320 [0,1,0,0,0,0|3,0,0]=4 18 B10R1.55 CC(C)(C)C1NCC(=O)N1 PH009486 [0,0,0,1,0,0|3,0,0]=4 19 B10R1.302 C[N+]1(CCNC(=O)CC1)C T281166 [0,0,0,1,0,0|2,0,0]=3 20 B8R0.29 CC(=O)CC[N+](C)(C)C S915017 [0,0,0,0,1,0|1,0,0]=2 21 B8R0.29 CC(C)(C)CCC(=O)O CDS009242 [0,0,0,0,1,0|2,0,0]=3 22 B8R0.29 CC(C)(C)OCC(=O)O CDS002729 [0,0,0,0,1,0|3,0,0]=4 23 B8R0.29 CC(C)(N)CCC(=O)O T160458 [0,0,0,0,1,0|3,0,0]=4 24 B10R0.15 CC(=O)OCCNC(C)(C)C PH012635 [0,0,0,0,0,1|2,0,0]=3 25 B7R0.4 C=COCCN(C)C S441066 [2,0,0,0,0,0|1,0,1]=4 26 B7R0.4 CSCCOC(=O)C S375721 [2,0,0,0,0,0|2,0,0]=4 27 B7R0.8 CCCC[N+](C)(C)C S949825 [2,0,0,0,0,0|1,0,1]=4 28 B7R0.8 C[N+](C)(C)CCCO S937398 [2,0,0,0,0,0|0,0,2]=4 29 B9R0.44 C=COC(=O)C[N+](C)(C)C R240613 [1,1,0,0,0,0|1,0,1]=4 30 B9R0.44 C=COC(=O)C[N+](C)(C)C R240966 [1,1,0,0,0,0|1,0,1]=4 31 B9R0.1 CC(C)CCOC(=O)CCl S431494 [1,1,0,0,0,0|2,0,0]=4 32 B9R0.1 CC(C)CCOC(=O)CS S570311 [1,1,0,0,0,0|2,0,0]=4 33 B9R0.1 COC(C)CCOC(=O)C CDS000509 [1,1,0,0,0,0|2,0,0]=4 34 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O CDS005404 [0,1,0,0,1,0|2,0,0]=4 35 B11R0.180 CCCC(=O)OCC[N+](C)(C)C R278742 [0,2,0,0,0,0|1,0,0]=3 36 B7R0.6 C=C(C)COC(=O)N S352055 [1,0,0,0,1,0|1,0,1]=4 37 B7R0.6 CC(C)CCC(=N)N CBR00806 [1,0,0,0,1,0|2,0,0]=4 38 B7R0.6 CC(C)CCC(=N)N PH014985 [1,0,0,0,1,0|2,0,0]=4 39 B7R0.6 CC(C)CCC(=O)Cl PH015411 [1,0,0,0,1,0|2,0,0]=4 40 B7R0.6 CC(C)COC(=O)N S362840 [1,0,0,0,1,0|1,0,0]=3 41 B7R0.6 CN(C)CCC(=O)O CDS000423 [1,0,0,0,1,0|1,0,1]=4 42 B7R0.6 CN(C)CCC(=O)O CDS013778 [1,0,0,0,1,0|1,0,1]=4 43 B7R0.6 C[S+](C)CCC(=O)O CDS000190 [1,0,0,0,1,0|2,0,0]=4