0 B9R0.56 CC(=O)OCC[B-](F)(F)F S11738 [0,0,0,0,0,0|4,0,0]=4 1 B9R0.56 CC(=O)OCC[N+](C)(C)C D81773 [0,0,0,0,0,0|0,0,0]=0 2 B9R0.56 CC(=O)OCC[N+](C)(C)C D88210 [0,0,0,0,0,0|0,0,0]=0 3 B9R0.56 CC(=O)SCC[N+](C)(C)C C93437 [0,0,0,0,0,0|0,1,0]=1 4 B9R0.56 C[N+](C)(C)CCCC(=O)O D83216 [0,0,0,0,0,0|2,0,0]=2 5 B9R0.56 C[N+](C)(C)NCCC(=O)O D97823 [0,0,0,0,0,0|3,0,0]=3 6 B8R0.21 CC(C)(S)CCOC=O D70907 [1,0,0,0,0,0|2,0,0]=3 7 B8R0.21 C[Si](C)(C)CCOCCl 75285 [1,0,0,0,0,0|2,0,1]=4 8 B8R0.28 CC(=O)CCC=C(C)C D77716 [1,0,0,0,0,0|2,0,1]=4 9 B8R0.28 CC(=O)CCCC(C)C D81757 [1,0,0,0,0,0|2,0,0]=3 10 B8R0.28 CC(=O)CCOC(C)=O D84229 [1,0,0,0,0,0|2,0,0]=3 11 B8R0.28 CC(=O)OCCN(C)C D88355 [1,0,0,0,0,0|0,0,1]=2 12 B8R0.28 CC(=O)OCOC(C)=O C16112 [1,0,0,0,0,0|3,0,0]=4 13 B8R0.28 CN(C)CCCC(=O)O F14882 [1,0,0,0,0,0|2,0,1]=4 14 B10R0.31 C[C@@H](C[N+](C)(C)C)OC(N)=O F20466 [0,1,0,0,0,0|1,0,0]=2 15 B10R0.31 C[C@H](CC(=O)Cl)CC(C)(C)C D92424 [0,1,0,0,0,0|3,0,0]=4 16 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)O D70668 [0,1,0,0,0,0|2,0,0]=3 17 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)O D95825 [0,1,0,0,0,0|2,0,0]=3 18 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)[O-] 43599 [0,1,0,0,0,0|2,0,0]=3 19 B10R0.31 C[N+](C)(C)C[C@@H](O)CC(=O)[O-] AC8488 [0,1,0,0,0,0|2,0,0]=3 20 B10R0.113 C[N+](C)(C)CCOP(=O)([O-])[O-] 73871 [0,1,0,0,0,0|2,0,0]=3 21 B10R0.113 C[N+](C)(C)CCOP(=O)([O-])[O-] AC8344 [0,1,0,0,0,0|2,0,0]=3 22 B10R1.55 CC(C)(C)[C@@H]1COC(=O)N1 AT13625 [0,0,0,1,0,0|2,0,0]=3 23 B8R0.29 CC(=O)C#C[Si](C)(C)C 75966 [0,0,0,0,1,0|1,0,2]=4 24 B8R0.29 CC(=O)OC[Si](C)(C)C D88457 [0,0,0,0,1,0|1,0,0]=2 25 B8R0.29 CC(C)(C)CCC(=O)O AB7068 [0,0,0,0,1,0|2,0,0]=3 26 B8R0.29 CC(C)(C)NCC(=O)O FD21623 [0,0,0,0,1,0|3,0,0]=4 27 B8R0.29 CC(C)(C)OCC(=O)O D70768 [0,0,0,0,1,0|3,0,0]=4 28 B7R0.4 C=CCCOC(C)=O 74074 [2,0,0,0,0,0|1,0,1]=4 29 B7R0.4 CC(=O)OCCCCl 22019 [2,0,0,0,0,0|2,0,0]=4 30 B7R0.4 CCCCOC(N)=O D89279 [2,0,0,0,0,0|2,0,0]=4 31 B7R0.4 CCCCSC(C)=O 79049 [2,0,0,0,0,0|1,1,0]=4 32 B7R0.8 C=CCC[Si](C)(C)C D93230 [2,0,0,0,0,0|1,0,1]=4 33 B7R0.8 CCCC[N+](C)(C)C D89168 [2,0,0,0,0,0|0,0,1]=3 34 B7R0.8 CCCC[N+](C)(C)C D97448 [2,0,0,0,0,0|0,0,1]=3 35 B7R0.8 C[N+](C)(C)CCCBr 35096 [2,0,0,0,0,0|1,0,1]=4 36 B9R0.38 CCCCCC[N+](C)(C)C D90893 [1,1,0,0,0,0|1,0,1]=4 37 B9R0.38 C[N+](C)(C)CCCCCBr AC8016 [1,1,0,0,0,0|1,0,1]=4 38 B9R0.1 C=CC(=O)OCCN(C)C D78266 [1,1,0,0,0,0|0,0,2]=4 39 B9R0.53 CC(=O)C[C@@H](C)CC(C)C D95694 [1,1,0,0,0,0|2,0,0]=4 40 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O 56506 [0,1,0,0,1,0|2,0,0]=4 41 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O 56507 [0,1,0,0,1,0|2,0,0]=4 42 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O 56508 [0,1,0,0,1,0|2,0,0]=4 43 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O 51153 [0,1,0,0,1,0|2,0,0]=4 44 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O 51154 [0,1,0,0,1,0|2,0,0]=4 45 B11R0.180 CCCC(=O)OCC[N+](C)(C)C D88683 [0,2,0,0,0,0|0,0,0]=2 46 B11R0.180 CCCC(=O)SCC[N+](C)(C)C 12424 [0,2,0,0,0,0|0,1,0]=3 47 B9R1.66 CC1(C)CCCC(=O)C1 F14897 [1,0,0,1,0,0|2,0,0]=4 48 B9R1.66 C[C@]1(O)CCOC(=O)C1 C76125 [1,0,0,1,0,0|2,0,0]=4 49 B9R1.35 CC(C)[C@@H]1CNC(=O)C1 P19175 [1,0,0,1,0,0|2,0,0]=4 50 B9R1.35 CC(C)[C@@H]1COC(=O)N1 33734 [1,0,0,1,0,0|2,0,0]=4 51 B9R1.35 CC(C)[C@@H]1COC(=O)N1 TD8068 [1,0,0,1,0,0|2,0,0]=4 52 B9R1.35 CC(C)[C@@H]1COC(=O)N1 W10689 [1,0,0,1,0,0|2,0,0]=4 53 B9R1.49 CN1CCCC(=O)CC1 34283 [1,0,0,1,0,0|1,0,1]=4 54 B9R1.49 CN1CCNC(=O)CC1 64338 [1,0,0,1,0,0|1,0,1]=4 55 B9R1.10 CC1(C)CCC(=O)CC1 35448 [0,0,0,1,1,0|1,0,0]=3 56 B9R1.10 CC1(C)COC(=O)OC1 F51892 [0,0,0,1,1,0|2,0,0]=4 57 B9R1.10 C[N+]1(C)CCC(=O)CC1 AB10340 [0,0,0,1,1,0|0,0,0]=2 58 B11R1.19 CC(C)(C)C1CCC(=O)CC1 12201 [0,1,0,1,0,0|2,0,0]=4 59 B7R0.6 C=C(C)COC(C)=O D88456 [1,0,0,0,1,0|1,0,1]=4 60 B7R0.6 CC(=O)CCC(C)=O D71099 [1,0,0,0,1,0|2,0,0]=4 61 B7R0.6 CC(=O)CCN(C)C D82201 [1,0,0,0,1,0|0,0,1]=3 62 B7R0.6 CC(C)CCC(=O)O 28835 [1,0,0,0,1,0|2,0,0]=4 63 B7R0.6 CN(C)CCC(=O)O 30383 [1,0,0,0,1,0|1,0,1]=4 64 B7R0.6 CN(C)CCC(=O)O 35949 [1,0,0,0,1,0|1,0,1]=4 65 B7R0.6 C[S+](C)CCC(=O)O 74954 [1,0,0,0,1,0|2,0,0]=4 66 B7R0.9 CC(=O)CC(C)(C)C A10213 [0,0,0,0,2,0|1,0,0]=3 67 B7R0.9 CC(=O)CC(C)(C)N 30483 [0,0,0,0,2,0|2,0,0]=4 68 B7R0.9 CC(=O)CC(C)(C)S D95275 [0,0,0,0,2,0|2,0,0]=4 69 B7R0.9 CC(=O)N[Si](C)(C)C D92366 [0,0,0,0,2,0|2,0,0]=4 70 B7R0.9 CC(C)(C)CC(=O)Cl P18012 [0,0,0,0,2,0|2,0,0]=4 71 B7R0.9 CC(C)(C)CC(=O)O D78179 [0,0,0,0,2,0|2,0,0]=4 72 B7R0.9 CC(C)(C)OC(N)=O AB3345 [0,0,0,0,2,0|2,0,0]=4 73 B7R0.9 C[C@H](O)C[N+](C)(C)C D91363 [0,0,0,0,2,0|0,0,2]=4 74 B7R0.9 C[C@H](O)C[N+](C)(C)C F16448 [0,0,0,0,2,0|0,0,2]=4 75 B7R0.9 C[N+](C)(C)CC(=O)[O-] 70061 [0,0,0,0,2,0|1,0,0]=3 76 B9R0.55 CC(=O)NCCCN(C)C AC5885 [1,0,0,0,0,1|1,0,1]=4