0 B8R0.21 C[Si](C)(C)CCOCCl T106619 [0,0,0,0,0,0|2,1,1]=4 1 B7R0.4 CC(C)CCOC=O I117534 [1,0,0,0,0,0|0,0,0]=1 2 B7R0.4 CC(C)CCOC=O I137773 [1,0,0,0,0,0|0,0,0]=1 3 B7R0.4 CC(C)CCON=O I106092 [1,0,0,0,0,0|1,0,0]=2 4 B7R0.4 CC(C)CCON=O I106093 [1,0,0,0,0,0|1,0,0]=2 5 B7R0.4 CCCCCC(C)C M113649 [1,0,0,0,0,0|2,0,1]=4 6 B7R0.4 CCCCCC(C)C M406726 [1,0,0,0,0,0|2,0,1]=4 7 B7R0.8 C(C(F)(F)F)OC=O T134919 [1,0,0,0,0,0|3,0,0]=4 8 B7R0.8 CC(C)(C)NCC=C N405609 [1,0,0,0,0,0|3,0,0]=4 9 B7R0.8 CCCCC(C)(C)C D106282 [1,0,0,0,0,0|2,0,1]=4 10 B7R0.8 CCCCC(C)(C)O M157782 [1,0,0,0,0,0|1,1,1]=4 11 B7R0.8 C[Si](C)(C)CCC=C B405460 [1,0,0,0,0,0|2,1,0]=4 12 B7R0.8 C[Si](C)(C)CCON O159958 [1,0,0,0,0,0|2,1,0]=4 13 B9R0.38 CC(C)(C)CCCCC=O G110311 [0,1,0,0,0,0|2,0,0]=3 14 B9R0.44 CC(CC=O)CC(C)(C)C T113592 [0,1,0,0,0,0|2,0,0]=3 15 B9R0.56 CC(=O)OCC[N+](C)(C)C A106023 [0,1,0,0,0,0|2,0,0]=3 16 B9R0.56 CC(=O)OCC[N+](C)(C)C A111014 [0,1,0,0,0,0|2,0,0]=3 17 B9R0.56 CC(=O)OCC[N+](C)(C)C A111015 [0,1,0,0,0,0|2,0,0]=3 18 B9R0.56 CC(=O)OCC[N+](C)(C)C A111033 [0,1,0,0,0,0|2,0,0]=3 19 B9R0.56 CC(=O)OCC[N+](C)(C)C A425009 [0,1,0,0,0,0|2,0,0]=3 20 B9R0.56 CC(=O)SCC[N+](C)(C)C A100869 [0,1,0,0,0,0|2,1,0]=4 21 B9R0.56 CC(=O)SCC[N+](C)(C)C A113536 [0,1,0,0,0,0|2,1,0]=4 22 B9R0.56 C[N+](C)(C)CCCC(=O)O B133529 [0,1,0,0,0,0|3,0,0]=4 23 B9R1.66 CC1(CCCC(=O)C1)C D138628 [0,0,0,1,0,0|2,0,0]=3 24 B9R1.66 CC1(CCOC(=O)C1)O D304342 [0,0,0,1,0,0|0,1,0]=2 25 B9R1.133 CC1(OCC(O1)C=O)C R134306 [0,0,0,1,0,0|2,1,0]=4 26 B6R0.4 CC(C)CCC#N I157667 [2,0,0,0,0,0|1,0,1]=4 27 B6R0.4 CC(C)CCC=O M586390 [2,0,0,0,0,0|0,0,0]=2 28 B6R0.4 CC(C)CCCBr B152440 [2,0,0,0,0,0|1,0,1]=4 29 B6R0.4 CC(C)CCCO I136441 [2,0,0,0,0,0|0,0,2]=4 30 B6R0.4 CC(C)COC=C I109049 [2,0,0,0,0,0|1,0,0]=3 31 B6R0.4 CC(C)COC=C I109050 [2,0,0,0,0,0|1,0,0]=3 32 B6R0.4 CC(C)COC=O I141415 [2,0,0,0,0,0|0,0,0]=2 33 B6R0.4 CC(C)COC=O I432878 [2,0,0,0,0,0|0,0,0]=2 34 B6R0.4 CC(C)CON=O I157486 [2,0,0,0,0,0|1,0,0]=3 35 B6R0.4 CC(C)NCC=C N339371 [2,0,0,0,0,0|2,0,0]=4 36 B6R0.4 CCCCC(C)C M158516 [2,0,0,0,0,0|1,0,1]=4 37 B6R0.6 CCCC=CC=O H107633 [2,0,0,0,0,0|1,0,1]=4 38 B6R0.6 CCCC=CC=O T425385 [2,0,0,0,0,0|1,0,1]=4 39 B6R0.6 CCCCCC=C H110653 [2,0,0,0,0,0|2,0,0]=4 40 B6R0.6 CCCCCC=C H110654 [2,0,0,0,0,0|2,0,0]=4 41 B6R0.6 CCCCCC=C H110655 [2,0,0,0,0,0|2,0,0]=4 42 B6R0.6 CCCCCC=O C109199 [2,0,0,0,0,0|1,0,0]=3 43 B6R0.6 CCCCCC=O C109200 [2,0,0,0,0,0|1,0,0]=3 44 B6R0.6 CCCCOC=C B123186 [2,0,0,0,0,0|1,0,0]=3 45 B6R0.6 CCCCOC=C B123187 [2,0,0,0,0,0|1,0,0]=3 46 B6R0.6 CCCCOC=O B109260 [2,0,0,0,0,0|0,0,0]=2 47 B6R0.6 CCCCOC=O B109261 [2,0,0,0,0,0|0,0,0]=2 48 B6R0.6 CCCCON=O B134686 [2,0,0,0,0,0|1,0,0]=3 49 B6R0.5 CC(C)(C)CC=O D133103 [2,0,0,0,0,0|1,0,0]=3 50 B6R0.5 CC(C)(C)CCBr B405387 [2,0,0,0,0,0|2,0,0]=4 51 B6R0.5 CC(C)(C)CCN D468789 [2,0,0,0,0,0|2,0,0]=4 52 B6R0.5 CC(C)(C)CCO D139098 [2,0,0,0,0,0|1,0,0]=3 53 B6R0.5 CC(C)(C)NC=O N159292 [2,0,0,0,0,0|2,0,0]=4 54 B6R0.5 CC(C)(C)OC=C T139444 [2,0,0,0,0,0|2,0,0]=4 55 B6R0.5 CC(C)(C)OC=O T341498 [2,0,0,0,0,0|1,0,0]=3 56 B6R0.5 CC(C)(C)ON=O B106794 [2,0,0,0,0,0|2,0,0]=4 57 B6R0.5 CC(C)(CCN)O A483316 [2,0,0,0,0,0|1,1,0]=4 58 B6R0.5 CC(C)(CCO)O M106425 [2,0,0,0,0,0|0,1,0]=3 59 B6R0.5 CC(C)(CCO)S M138699 [2,0,0,0,0,0|0,0,0]=2 60 B6R0.5 CCCC(C)(C)C D106287 [2,0,0,0,0,0|1,0,1]=4 61 B6R0.5 C[N+](C)(C)CCO C108896 [2,0,0,0,0,0|2,0,0]=4 62 B6R0.5 C[N+](C)(C)CCO C108897 [2,0,0,0,0,0|2,0,0]=4 63 B6R0.5 C[N+](C)(C)CCO C108898 [2,0,0,0,0,0|2,0,0]=4 64 B6R0.5 C[N+](C)(C)CCO C153893 [2,0,0,0,0,0|2,0,0]=4 65 B6R0.5 C[N+](C)(C)CCO C166651 [2,0,0,0,0,0|2,0,0]=4 66 B6R0.5 C[N+](C)(C)CCO C333456 [2,0,0,0,0,0|2,0,0]=4 67 B6R0.5 C[N+](C)(C)CCO C425396 [2,0,0,0,0,0|2,0,0]=4 68 B6R0.5 C[N+](C)(C)CCO C471988 [2,0,0,0,0,0|2,0,0]=4 69 B6R0.5 C[N+](C)(C)CCO C472029 [2,0,0,0,0,0|2,0,0]=4 70 B6R0.5 C[Si](C)(C)CCO T111253 [2,0,0,0,0,0|1,1,0]=4 71 B8R0.9 CN(C)CCN(C)C=O N159309 [1,1,0,0,0,0|2,0,0]=4 72 B8R0.28 CC(=CCOC(=O)C)C P138080 [1,1,0,0,0,0|0,0,2]=4 73 B8R0.28 CC(C)CCCC(=C)C D155274 [1,1,0,0,0,0|2,0,0]=4 74 B8R0.28 CC(C)CCCC(=O)C M158865 [1,1,0,0,0,0|1,0,0]=3 75 B8R0.28 CC(C)CCCC(=O)O M158389 [1,1,0,0,0,0|1,0,0]=3 76 B8R0.28 CC(C)CCOC(=O)C I112107 [1,1,0,0,0,0|0,0,0]=2 77 B8R0.28 CC(C)CCOC(=O)C I112108 [1,1,0,0,0,0|0,0,0]=2 78 B8R0.28 CC(C)CCOC(=O)C I112110 [1,1,0,0,0,0|0,0,0]=2 79 B8R0.28 CC(C)CCOC(=O)C T119705 [1,1,0,0,0,0|0,0,0]=2 80 B8R0.28 CC(C)CCO[N+](=O)[O-] I157464 [1,1,0,0,0,0|1,0,0]=3 81 B8R0.28 CN(C)CCCC(=O)O D589906 [1,1,0,0,0,0|2,0,0]=4 82 B8R0.28 CN(C)CCCC(=O)O W133561 [1,1,0,0,0,0|2,0,0]=4 83 B8R0.24 CC(CC(C)(C)C)C=C T161801 [1,1,0,0,0,0|2,0,0]=4 84 B8R0.29 CC(=O)OC[Si](C)(C)C T162333 [1,1,0,0,0,0|1,1,0]=4 85 B8R0.29 CC(=O)ONC(C)(C)C O159950 [1,1,0,0,0,0|2,0,0]=4 86 B8R0.29 CC(C)(C)NCC(=O)O N194621 [1,1,0,0,0,0|2,0,0]=4 87 B8R0.29 CC(CCC(=O)O)(F)F D586779 [1,1,0,0,0,0|2,0,0]=4 88 B8R0.29 C[Si](C)(C)CCC(=O)[O-] T303180 [1,1,0,0,0,0|1,1,0]=4 89 B10R0.65 CC(=O)OCCC(C)(C)OC M157992 [0,2,0,0,0,0|0,1,0]=3 90 B10R0.60 C[N+](C)(C)CCOC(=O)C=C A303741 [0,2,0,0,0,0|2,0,0]=4 91 B10R0.31 CC(CC(=O)Cl)CC(C)(C)C T161607 [0,2,0,0,0,0|2,0,0]=4 92 B10R0.31 CC(CC(=O)O)CC(C)(C)C T106595 [0,2,0,0,0,0|2,0,0]=4 93 B10R0.31 CC(C[N+](C)(C)C)OC(=O)C A100823 [0,2,0,0,0,0|2,0,0]=4 94 B10R0.31 CC(C[N+](C)(C)C)OC(=O)C M425166 [0,2,0,0,0,0|2,0,0]=4 95 B10R0.31 CC(C[N+](C)(C)C)OC(=O)C O135659 [0,2,0,0,0,0|2,0,0]=4 96 B10R0.31 CC(C[N+](C)(C)C)OC(=O)N B153105 [0,2,0,0,0,0|2,0,0]=4 97 B10R0.31 CC(C[N+](C)(C)C)OC(N)=O B408677 [0,2,0,0,0,0|2,0,0]=4 98 B10R0.48 CC(C)(C)CC(C)(C)NC=O N159448 [0,2,0,0,0,0|2,0,0]=4 99 B8R1.4 C1CNC(=O)CC1N A174477 [1,0,0,1,0,0|2,0,0]=4 100 B8R1.4 C1CNC(=O)CC1O H193522 [1,0,0,1,0,0|1,1,0]=4 101 B8R1.4 CC1CC(=O)CCO1 M172463 [1,0,0,1,0,0|2,0,0]=4 102 B8R1.4 CC1CCCC(=O)C1 M117710 [1,0,0,1,0,0|1,0,0]=3 103 B8R1.4 CC1CCCC(=O)C1 R472235 [1,0,0,1,0,0|1,0,0]=3 104 B8R1.4 CC1CCCC(=O)O1 D155361 [1,0,0,1,0,0|1,1,0]=4 105 B8R1.4 CC1CCOS(=O)O1 M120341 [1,0,0,1,0,0|1,1,0]=4 106 B8R1.19 CC1(CCCC1=O)C D131503 [1,0,0,1,0,0|1,0,0]=3 107 B8R1.19 CC1(CCOC1=O)C A151224 [1,0,0,1,0,0|0,0,0]=2 108 B8R1.19 CC1(CONC1=O)C D400297 [1,0,0,1,0,0|2,0,0]=4 109 B8R1.51 CC1(CC(=O)NC1)C D194493 [1,0,0,1,0,0|2,0,0]=4 110 B8R1.51 CC1(CCC(=O)C1)C D175598 [1,0,0,1,0,0|1,0,0]=3 111 B8R1.51 CC1(CCC(=O)N1)C D193696 [1,0,0,1,0,0|1,0,0]=3 112 B8R1.51 CC1(COC(=O)N1)C D135412 [1,0,0,1,0,0|1,0,0]=3 113 B8R1.51 CC1=NC(CO1)(C)C T141476 [1,0,0,1,0,0|2,0,0]=4 114 B10R1.55 CC(C)(C)C1COC(=O)N1 R474226 [0,1,0,1,0,0|1,0,0]=3 115 B10R1.65 C[Si](C)(C)N1CCOC1=O T161805 [0,1,0,1,0,0|1,1,0]=4 116 B10R1.329 CC1(CC(=O)OC(=O)C1)C D154429 [0,1,0,1,0,0|1,0,1]=4 117 B10R1.329 CC1CC(=O)CC(C1)(C)C T161473 [0,1,0,1,0,0|2,0,0]=4 118 B10R2.534 C1CC(=O)NC2(C1)CC2 A589439 [0,0,0,2,0,0|2,0,0]=4