0 B10R0.91 BrCCCCC(=O)NCC=C Amb17244104 [0,0,0,0,0,0|2,0,0]=2 1 B10R0.91 C=CCCC(=O)NCCC#C Amb21942372 [0,0,0,0,0,0|2,0,2]=4 2 B10R0.91 C=CCNC(=O)NCCC#C Amb24755984 [0,0,0,0,0,0|2,0,2]=4 3 B10R0.91 C=CCNC(=O)NCCC#N Amb24755985 [0,0,0,0,0,0|3,0,1]=4 4 B10R0.91 C=CCNCC(=O)NCC=C Amb20082339 [0,0,0,0,0,0|2,0,2]=4 5 B10R0.91 C=CCOC(=O)NCCCN Amb22351167 [0,0,0,0,0,0|2,0,0]=2 6 B10R0.91 C=CCOC(=O)NCCCO Amb22348072 [0,0,0,0,0,0|2,0,0]=2 7 B10R0.91 CC#CCCC(=O)NCC=C Amb25383800 [0,0,0,0,0,0|1,0,2]=3 8 B10R0.91 CC#CCNC(=O)NCC=C Amb25741165 [0,0,0,0,0,0|2,0,2]=4 9 B10R0.91 CCCCC(=O)OCCCC Amb22002434 [0,0,0,0,0,0|2,0,2]=4 10 B10R0.91 CCCCCC(=O)C#CCO Amb24764948 [0,0,0,0,0,0|2,0,2]=4 11 B10R0.91 CCCCCC(=O)CCCC Amb10807442 [0,0,0,0,0,0|1,0,2]=3 12 B10R0.91 CCCCNC(=O)CCCO Amb17232293 [0,0,0,0,0,0|3,0,1]=4 13 B10R0.91 CCCCNC(=O)NCC#C Amb18182908 [0,0,0,0,0,0|2,0,2]=4 14 B10R0.91 CCCCNC(=O)NCC#N Amb18791639 [0,0,0,0,0,0|3,0,1]=4 15 B10R0.91 CCCCNC(=O)OCC#C Amb22002306 [0,0,0,0,0,0|1,0,2]=3 16 B10R0.91 CCCCOC(=O)CCCBr Amb22739641 [0,0,0,0,0,0|3,0,1]=4 17 B10R0.91 CCCCOC(=O)CCCN Amb22364433 [0,0,0,0,0,0|3,0,1]=4 18 B10R0.91 CCCCOC(=O)NCCCl Amb24103359 [0,0,0,0,0,0|3,0,1]=4 19 B10R0.91 CCCNC(=O)CCCCBr Amb17245316 [0,0,0,0,0,0|2,0,2]=4 20 B10R0.91 CCCNC(=O)CCCCO Amb17232297 [0,0,0,0,0,0|2,0,2]=4 21 B10R0.91 CCCNCC(=O)NCC=C Amb18799697 [0,0,0,0,0,0|2,0,0]=2 22 B10R0.91 CCCOC(=O)OCCCF Amb24077347 [0,0,0,0,0,0|2,0,2]=4 23 B10R0.91 CCCOCC(=O)OCCC Amb15692604 [0,0,0,0,0,0|1,0,2]=3 24 B10R0.91 CCOCCC(=O)OCCCl Amb24065564 [0,0,0,0,0,0|2,0,1]=3 25 B10R0.91 C\C=C\NC(=O)OCCCC Amb25384655 [0,0,0,0,0,0|2,0,2]=4 26 B10R0.91 NCCNC(=O)CCSCC Amb17503827 [0,0,0,0,0,0|3,0,1]=4 27 B10R0.91 OCCCCC(=O)NCC=C Amb17232204 [0,0,0,0,0,0|2,0,0]=2 28 B9R0.5 BrCCCCC(=O)NCC Amb17239684 [1,0,0,0,0,0|2,0,1]=4 29 B9R0.5 BrCCCNC(=O)OCC Amb10608871 [1,0,0,0,0,0|2,0,1]=4 30 B9R0.5 C#CCC(=O)CCCCN Amb25225096 [1,0,0,0,0,0|1,0,2]=4 31 B9R0.5 C=C=CC(=O)CCCCBr Amb25339293 [1,0,0,0,0,0|1,0,2]=4 32 B9R0.5 C=C=CC(=O)CCCCO Amb25146568 [1,0,0,0,0,0|1,0,2]=4 33 B9R0.5 C=CCC(=C)CCCCO Amb25133458 [1,0,0,0,0,0|2,0,0]=3 34 B9R0.5 C=CCC(=O)CCCC=C Amb25807556 [1,0,0,0,0,0|0,0,2]=3 35 B9R0.5 C=CCC(=O)CCCCBr Amb24477431 [1,0,0,0,0,0|1,0,0]=2 36 B9R0.5 C=CCC(=O)CCCCF Amb25357850 [1,0,0,0,0,0|1,0,0]=2 37 B9R0.5 C=CCC(=O)CCCCO Amb25319991 [1,0,0,0,0,0|1,0,0]=2 38 B9R0.5 C=CCC(=O)NCCCO Amb24445000 [1,0,0,0,0,0|2,0,0]=3 39 B9R0.5 C=CCC(=O)OCCCO Amb25380659 [1,0,0,0,0,0|2,0,0]=3 40 B9R0.5 C=CCC(N)CCCCO Amb24409650 [1,0,0,0,0,0|2,0,1]=4 41 B9R0.5 C=CCC(O)CCCCCl Amb25840892 [1,0,0,0,0,0|1,0,2]=4 42 B9R0.5 C=CC[C@@H](N)CCCCO Amb24674311 [1,0,0,0,0,0|2,0,1]=4 43 B9R0.5 C=CC[C@H](O)CCCCO Amb25294886 [1,0,0,0,0,0|1,0,2]=4 44 B9R0.5 C=COC(=O)NCCCO Amb24673925 [1,0,0,0,0,0|2,0,0]=3 45 B9R0.5 CCCC(=O)CCCCBr Amb25844585 [1,0,0,0,0,0|1,0,2]=4 46 B9R0.5 CCCC(=O)CCCCCl Amb25777036 [1,0,0,0,0,0|1,0,2]=4 47 B9R0.5 CCCC(=O)CCCCF Amb24462311 [1,0,0,0,0,0|1,0,2]=4 48 B9R0.5 CCCC(=O)CCCNC Amb24400968 [1,0,0,0,0,0|1,0,2]=4 49 B9R0.5 CCCC(=O)CCNCC Amb24568186 [1,0,0,0,0,0|1,0,2]=4 50 B9R0.5 CCCC(=O)CCOCC Amb25203937 [1,0,0,0,0,0|1,0,2]=4 51 B9R0.5 CCCCCC(=C)CCO Amb25802346 [1,0,0,0,0,0|2,0,1]=4 52 B9R0.5 CCCCCC(=O)C=C=O Amb24478254 [1,0,0,0,0,0|1,0,2]=4 53 B9R0.5 CCCCCC(=O)CC=N Amb25146702 [1,0,0,0,0,0|1,0,0]=2 54 B9R0.5 CCCCCC(=O)CC=O Amb25365648 [1,0,0,0,0,0|1,0,0]=2 55 B9R0.5 CCCCCC(=O)CCN Amb25061132 [1,0,0,0,0,0|1,0,1]=3 56 B9R0.5 CCCCCC(=O)CSC Amb18182560 [1,0,0,0,0,0|1,0,1]=3 57 B9R0.5 CCCCCC(=O)N=C=O Amb24392136 [1,0,0,0,0,0|2,0,1]=4 58 B9R0.5 CCCCCC(=O)NCO Amb24478944 [1,0,0,0,0,0|2,0,0]=3 59 B9R0.5 CCCCCC(=O)OC=C Amb17938956 [1,0,0,0,0,0|0,0,0]=1 60 B9R0.5 CCCCCC(=O)OCCl Amb24568887 [1,0,0,0,0,0|1,0,0]=2 61 B9R0.5 CCCCCC(=O)\C=C/N Amb24408490 [1,0,0,0,0,0|1,0,1]=3 62 B9R0.5 CCCCCC(=S)NCC Amb25375522 [1,0,0,0,0,0|1,1,1]=4 63 B9R0.5 CCCCCC(C)=CCN Amb25330387 [1,0,0,0,0,0|3,0,0]=4 64 B9R0.5 CCCCCC(C)=CCO Amb24704431 [1,0,0,0,0,0|3,0,0]=4 65 B9R0.5 CCCCCC(C)CC=C Amb25744101 [1,0,0,0,0,0|1,0,1]=3 66 B9R0.5 CCCCCC(C)CC=O Amb21953169 [1,0,0,0,0,0|2,0,1]=4 67 B9R0.5 CCCCCC(Cl)OCC Amb25298178 [1,0,0,0,0,0|1,0,2]=4 68 B9R0.5 CCCCCC(N)CC=C Amb24480685 [1,0,0,0,0,0|1,0,1]=3 69 B9R0.5 CCCCCC(O)=CC=O Amb25224445 [1,0,0,0,0,0|1,0,2]=4 70 B9R0.5 CCCCCN(C)CC=C Amb24588145 [1,0,0,0,0,0|2,0,0]=3 71 B9R0.5 CCCCCN(C)CC=O Amb24478014 [1,0,0,0,0,0|3,0,0]=4 72 B9R0.5 CCCCCS(=O)CC#N Amb24623517 [1,0,0,0,0,0|2,0,1]=4 73 B9R0.5 CCCCCS(=O)CCO Amb25071794 [1,0,0,0,0,0|2,0,1]=4 74 B9R0.5 CCCCC[C@@H](O)CC=O Amb24680284 [1,0,0,0,0,0|1,0,2]=4 75 B9R0.5 CCCCC\C(\C)=C/CBr Amb25290401 [1,0,0,0,0,0|3,0,0]=4 76 B9R0.5 CCCCC\C(\C)=C\C=O Amb18643627 [1,0,0,0,0,0|2,0,1]=4 77 B9R0.5 CCCCC\C(\O)=C\C=O Amb25326080 [1,0,0,0,0,0|1,0,2]=4 78 B9R0.5 CCCCNC(=O)CC#N Amb1203319 [1,0,0,0,0,0|2,0,1]=4 79 B9R0.5 CCCCNC(=O)CC=C Amb24472259 [1,0,0,0,0,0|1,0,0]=2 80 B9R0.5 CCCCNC(=O)CCBr Amb17330970 [1,0,0,0,0,0|2,0,1]=4 81 B9R0.5 CCCCNC(=O)CCN Amb21958196 [1,0,0,0,0,0|2,0,1]=4 82 B9R0.5 CCCCNC(=O)CCO Amb17334238 [1,0,0,0,0,0|2,0,1]=4 83 B9R0.5 CCCCNC(=O)CCS Amb24354823 [1,0,0,0,0,0|2,0,1]=4 84 B9R0.5 CCCCNC(=O)COC Amb23247497 [1,0,0,0,0,0|2,0,1]=4 85 B9R0.5 CCCCNC(=O)CON Amb25683647 [1,0,0,0,0,0|3,0,0]=4 86 B9R0.5 CCCCNC(=O)OCC Amb10552892 [1,0,0,0,0,0|1,0,1]=3 87 B9R0.5 CCCCNC(=O)OCCl Amb25703550 [1,0,0,0,0,0|2,0,0]=3 88 B9R0.5 CCCCNC(=O)OCF Amb24681120 [1,0,0,0,0,0|2,0,0]=3 89 B9R0.5 CCCCNC(=O)SCC Amb25131164 [1,0,0,0,0,0|1,1,1]=4 90 B9R0.5 CCCCNC(C)CC=C Amb24392479 [1,0,0,0,0,0|2,0,1]=4 91 B9R0.5 CCCCOC(=O)/C=C/C Amb17940289 [1,0,0,0,0,0|1,0,2]=4 92 B9R0.5 CCCCOC(=O)CC=O Amb24722099 [1,0,0,0,0,0|2,0,0]=3 93 B9R0.5 CCCCOC(=O)CCBr Amb25301954 [1,0,0,0,0,0|2,0,1]=4 94 B9R0.5 CCCCOC(=O)CON Amb25691107 [1,0,0,0,0,0|3,0,0]=4 95 B9R0.5 CCCCOC(=O)CSC Amb18798147 [1,0,0,0,0,0|2,0,1]=4 96 B9R0.5 CCCCOC(=O)NCCl Amb25831087 [1,0,0,0,0,0|3,0,0]=4 97 B9R0.5 CCCCOC(=O)\C=C\N Amb24446980 [1,0,0,0,0,0|2,0,1]=4 98 B9R0.5 CCCCSC(=O)CNC Amb24679979 [1,0,0,0,0,0|2,0,1]=4 99 B9R0.5 CCCCSC(=O)OCCl Amb24482256 [1,0,0,0,0,0|2,0,0]=3 100 B9R0.5 CCCNCC(=O)CC#C Amb25843804 [1,0,0,0,0,0|1,0,2]=4 101 B9R0.5 CCCNCC(=O)CCC Amb25041554 [1,0,0,0,0,0|1,0,2]=4 102 B9R0.5 CCCNCC(=O)COC Amb25228409 [1,0,0,0,0,0|2,0,1]=4 103 B9R0.5 CCCOCC(=O)CC#C Amb24709854 [1,0,0,0,0,0|1,0,2]=4 104 B9R0.5 CCCOCC(=O)CCC Amb25331735 [1,0,0,0,0,0|1,0,2]=4 105 B9R0.5 CCCOCC(=O)NCC Amb25336196 [1,0,0,0,0,0|2,0,1]=4 106 B9R0.5 CCCOCC(N)CC=C Amb24502259 [1,0,0,0,0,0|2,0,1]=4 107 B9R0.5 CCCOCC(O)CC=C Amb24478083 [1,0,0,0,0,0|1,0,2]=4 108 B9R0.5 CCCONC(=O)OCC Amb25046316 [1,0,0,0,0,0|2,0,1]=4 109 B9R0.5 CCCSCC(=O)CCC Amb18800477 [1,0,0,0,0,0|1,0,2]=4 110 B9R0.5 CCCSCC(=O)COC Amb25145038 [1,0,0,0,0,0|2,0,1]=4 111 B9R0.5 CCC\C=C\C(=O)CC=C Amb25370749 [1,0,0,0,0,0|0,0,2]=3 112 B9R0.5 CCC\C=C\C(=O)OCC Amb22001054 [1,0,0,0,0,0|0,0,3]=4 113 B9R0.5 CCNC(=O)CCCCN Amb24657917 [1,0,0,0,0,0|2,0,1]=4 114 B9R0.5 CCNC(=O)CCCSC Amb18411856 [1,0,0,0,0,0|2,0,1]=4 115 B9R0.5 CCNC(=O)CCNCC Amb20171977 [1,0,0,0,0,0|2,0,1]=4 116 B9R0.5 CCNCCC(C)CC=C Amb25681723 [1,0,0,0,0,0|2,0,1]=4 117 B9R0.5 CCNCCN(C)CC=C Amb25354291 [1,0,0,0,0,0|3,0,0]=4 118 B9R0.5 CCOC(=O)CC#CCC Amb25057125 [1,0,0,0,0,0|0,0,3]=4 119 B9R0.5 CCOC(=O)CCC#CC Amb17939773 [1,0,0,0,0,0|0,0,3]=4 120 B9R0.5 CCOC(=O)CCCC#C Amb18115788 [1,0,0,0,0,0|0,0,3]=4 121 B9R0.5 CCOC(=O)CCCC#N Amb16233123 [1,0,0,0,0,0|1,0,2]=4 122 B9R0.5 CCOC(=O)CCCC=O Amb22230665 [1,0,0,0,0,0|1,0,2]=4 123 B9R0.5 CCOC(=O)CCCCCl Amb24445064 [1,0,0,0,0,0|1,0,1]=3 124 B9R0.5 CCOC(=O)CCCCN Amb19957938 [1,0,0,0,0,0|1,0,1]=3 125 B9R0.5 CCOC(=O)CCCCS Amb25246862 [1,0,0,0,0,0|1,0,1]=3 126 B9R0.5 CCOC(=O)CCCSC Amb25058939 [1,0,0,0,0,0|1,0,1]=3 127 B9R0.5 CCOC(=O)CCC[Zn]Br Amb22000359 [1,0,0,0,0,0|2,0,1]=4 128 B9R0.5 CCOC(=O)CCSCCl Amb25109198 [1,0,0,0,0,0|2,0,1]=4 129 B9R0.5 CCOC(=O)CNCCN Amb24090356 [1,0,0,0,0,0|2,0,1]=4 130 B9R0.5 CCOC(=O)CNCCS Amb25032631 [1,0,0,0,0,0|2,0,1]=4 131 B9R0.5 CCOC(=O)COCCCl Amb19958740 [1,0,0,0,0,0|2,0,1]=4 132 B9R0.5 CCOC(=O)COCCN Amb25850783 [1,0,0,0,0,0|2,0,1]=4 133 B9R0.5 CCOC(=O)COCCO Amb24113532 [1,0,0,0,0,0|2,0,1]=4 134 B9R0.5 CCOC(=O)CSCCF Amb25220848 [1,0,0,0,0,0|2,0,1]=4 135 B9R0.5 CCOC(=O)NCCCN Amb24546405 [1,0,0,0,0,0|2,0,1]=4 136 B9R0.5 CCOC(=O)NCCOC Amb17792634 [1,0,0,0,0,0|2,0,1]=4 137 B9R0.5 CCOC(=O)OCCCF Amb24088656 [1,0,0,0,0,0|2,0,1]=4 138 B9R0.5 CCOC(=O)OCCCN Amb25840265 [1,0,0,0,0,0|2,0,1]=4 139 B9R0.5 CCOC(=O)OCCNC Amb25742600 [1,0,0,0,0,0|2,0,1]=4 140 B9R0.5 CCOCCC(=O)CC#C Amb25314014 [1,0,0,0,0,0|1,0,2]=4 141 B9R0.5 CCOCCC(=O)CC=C Amb25092467 [1,0,0,0,0,0|1,0,0]=2 142 B9R0.5 CCOCCC(=O)CSC Amb18798154 [1,0,0,0,0,0|2,0,1]=4 143 B9R0.5 CCOCCC(=O)\C=C\Cl Amb24383480 [1,0,0,0,0,0|2,0,1]=4 144 B9R0.5 CCOCCC(N)CC=C Amb24430906 [1,0,0,0,0,0|2,0,1]=4 145 B9R0.5 CCOCNC(=O)OCC Amb25117140 [1,0,0,0,0,0|2,0,1]=4 146 B9R0.5 CCSC(=O)CCCCO Amb25806700 [1,0,0,0,0,0|1,1,1]=4 147 B9R0.5 CC\C=C\CC(=O)OCC Amb10071538 [1,0,0,0,0,0|0,0,3]=4 148 B9R0.5 CN(CCCCO)CC=C Amb25100781 [1,0,0,0,0,0|3,0,0]=4 149 B9R0.5 CNCC(=O)NCCCC Amb21958174 [1,0,0,0,0,0|2,0,1]=4 150 B9R0.5 CNCCCC(O)CC=C Amb24479153 [1,0,0,0,0,0|1,0,2]=4 151 B9R0.5 CNCCC[C@H](O)CC=C Amb25113492 [1,0,0,0,0,0|1,0,2]=4 152 B9R0.5 COCC(=O)CCCCF Amb24475353 [1,0,0,0,0,0|2,0,1]=4 153 B9R0.5 COCC(=O)CCCCO Amb25709925 [1,0,0,0,0,0|2,0,1]=4 154 B9R0.5 COCC(=O)CCCSC Amb25060575 [1,0,0,0,0,0|2,0,1]=4 155 B9R0.5 COCC(=O)COCCC Amb24482505 [1,0,0,0,0,0|2,0,1]=4 156 B9R0.5 COCC(=O)OCCCC Amb20620642 [1,0,0,0,0,0|2,0,1]=4 157 B9R0.5 COCCCC(=O)CSC Amb18798153 [1,0,0,0,0,0|2,0,1]=4 158 B9R0.5 COCCOC(=O)CC=C Amb25228333 [1,0,0,0,0,0|2,0,0]=3 159 B9R0.5 COCSCC(=O)OCC Amb24482667 [1,0,0,0,0,0|2,0,1]=4 160 B9R0.5 CSCC(=O)CCCCF Amb25705722 [1,0,0,0,0,0|2,0,1]=4 161 B9R0.5 CSCCCC(O)CC=C Amb25823157 [1,0,0,0,0,0|1,0,2]=4 162 B9R0.5 C\C=C/C(=O)CCCCC Amb25086296 [1,0,0,0,0,0|0,0,2]=3 163 B9R0.5 C\C=C\C(=O)CCCCBr Amb25381449 [1,0,0,0,0,0|1,0,2]=4 164 B9R0.5 C\C=C\C(=O)CCCCC Amb25146367 [1,0,0,0,0,0|0,0,2]=3 165 B9R0.5 C\C=C\C(=O)CCCCCl Amb24548775 [1,0,0,0,0,0|1,0,2]=4 166 B9R0.5 C\C=C\C(=O)CCOCC Amb24676741 [1,0,0,0,0,0|1,0,2]=4 167 B9R0.5 C\C=C\CCC(=O)NC=C Amb24599003 [1,0,0,0,0,0|1,0,2]=4 168 B9R0.5 C\C=C\CCC(=O)OCC Amb25242775 [1,0,0,0,0,0|0,0,3]=4 169 B9R0.5 NCCCCC(=O)NCO Amb24715839 [1,0,0,0,0,0|3,0,0]=4 170 B9R0.5 NCCCCC(=O)OCC Amb10807401 [1,0,0,0,0,0|1,0,1]=3 171 B9R0.5 NCCCCN(CC=C)C Amb17334209 [1,0,0,0,0,0|3,0,0]=4 172 B9R0.5 O=C(CCCCCl)OCCl Amb24692453 [1,0,0,0,0,0|2,0,0]=3 173 B9R0.5 OCCCCC(=O)CCCl Amb25292236 [1,0,0,0,0,0|2,0,1]=4 174 B9R0.5 OCCCCC(=O)NCC Amb17231999 [1,0,0,0,0,0|2,0,1]=4 175 B9R0.5 OCCCCC(=O)OCC Amb17593658 [1,0,0,0,0,0|1,0,1]=3 176 B9R0.5 [C-]#[N+]CC(=O)NCCCC Amb24678845 [1,0,0,0,0,0|2,0,1]=4 177 B9R0.5 [C-]#[N+]CCCC(=O)OCC Amb2235706 [1,0,0,0,0,0|1,0,2]=4 178 B9R0.18 C#CCOC(=O)CCCCl Amb25823921 [1,0,0,0,0,0|1,0,2]=4 179 B9R0.18 C=CCCC(=C)CCCN Amb24444742 [1,0,0,0,0,0|3,0,0]=4 180 B9R0.18 C=CCCC(=O)CCC=C Amb25372884 [1,0,0,0,0,0|1,0,2]=4 181 B9R0.18 C=CCCC(=O)CCCCl Amb24665721 [1,0,0,0,0,0|2,0,0]=3 182 B9R0.18 C=CCCC(=O)CCCN Amb24509359 [1,0,0,0,0,0|2,0,0]=3 183 B9R0.18 C=CCCC(=O)NCCBr Amb25695021 [1,0,0,0,0,0|3,0,0]=4 184 B9R0.18 C=CCCC(=O)OCCF Amb24734769 [1,0,0,0,0,0|3,0,0]=4 185 B9R0.18 C=CCNC(=O)CCC#C Amb24753993 [1,0,0,0,0,0|1,0,2]=4 186 B9R0.18 C=CCNC(=O)CCC#N Amb17334163 [1,0,0,0,0,0|2,0,1]=4 187 B9R0.18 C=CCNC(=O)NCCCl Amb25268921 [1,0,0,0,0,0|3,0,0]=4 188 B9R0.18 C=CCNC(=O)NCCO Amb25189079 [1,0,0,0,0,0|3,0,0]=4 189 B9R0.18 C=CCNC(=O)OCC=C Amb25359097 [1,0,0,0,0,0|1,0,2]=4 190 B9R0.18 C=CCNC(=O)OCCN Amb25172487 [1,0,0,0,0,0|3,0,0]=4 191 B9R0.18 C=CCNC(=O)OCCO Amb24478916 [1,0,0,0,0,0|3,0,0]=4 192 B9R0.18 C=CCOC(=O)CCC#C Amb25256558 [1,0,0,0,0,0|0,0,2]=3 193 B9R0.18 C=CCOC(=O)CCC=O Amb24477023 [1,0,0,0,0,0|1,0,1]=3 194 B9R0.18 C=CCOC(=O)CCCBr Amb22049553 [1,0,0,0,0,0|1,0,0]=2 195 B9R0.18 C=CCOC(=O)CCCCl Amb19960006 [1,0,0,0,0,0|1,0,0]=2 196 B9R0.18 C=CCOC(=O)CCCN Amb24452753 [1,0,0,0,0,0|1,0,0]=2 197 B9R0.18 C=CCOC(=O)CCCO Amb25297452 [1,0,0,0,0,0|1,0,0]=2 198 B9R0.18 C=CCOC(=O)NCC#N Amb25756679 [1,0,0,0,0,0|2,0,1]=4 199 B9R0.18 C=CCOC(=O)NCCN Amb22348049 [1,0,0,0,0,0|2,0,0]=3 200 B9R0.18 C=CCOC(=O)NCCO Amb22348078 [1,0,0,0,0,0|2,0,0]=3 201 B9R0.18 C=CCOC(=O)OCC=C Amb17933999 [1,0,0,0,0,0|1,0,2]=4 202 B9R0.18 C=CCOC(=O)\C=C\CBr Amb25339302 [1,0,0,0,0,0|1,0,2]=4 203 B9R0.18 CCCCC(=O)CCC#C Amb25715132 [1,0,0,0,0,0|1,0,2]=4 204 B9R0.18 CCCCC(=O)CCC#N Amb18643440 [1,0,0,0,0,0|2,0,1]=4 205 B9R0.18 CCCCC(=O)CCC=O Amb24440961 [1,0,0,0,0,0|2,0,0]=3 206 B9R0.18 CCCCC(=O)CCCO Amb25146585 [1,0,0,0,0,0|2,0,1]=4 207 B9R0.18 CCCCC(=O)CCSC Amb24731683 [1,0,0,0,0,0|2,0,1]=4 208 B9R0.18 CCCCC(=O)CON=C Amb25205215 [1,0,0,0,0,0|3,0,0]=4 209 B9R0.18 CCCCC(=O)NCC#N Amb24589184 [1,0,0,0,0,0|2,0,1]=4 210 B9R0.18 CCCCC(=O)NCC=O Amb17102058 [1,0,0,0,0,0|2,0,0]=3 211 B9R0.18 CCCCC(=O)NCCCl Amb17103192 [1,0,0,0,0,0|2,0,1]=4 212 B9R0.18 CCCCC(=O)NCCI Amb24428497 [1,0,0,0,0,0|2,0,1]=4 213 B9R0.18 CCCCC(=O)NCCS Amb25366038 [1,0,0,0,0,0|2,0,1]=4 214 B9R0.18 CCCCC(=O)NCOC Amb24479090 [1,0,0,0,0,0|2,0,1]=4 215 B9R0.18 CCCCC(=O)NNC=O Amb24718146 [1,0,0,0,0,0|3,0,0]=4 216 B9R0.18 CCCCC(=O)OCC#N Amb25168860 [1,0,0,0,0,0|1,0,1]=3 217 B9R0.18 CCCCC(=O)OCC=C Amb22732606 [1,0,0,0,0,0|0,0,0]=1 218 B9R0.18 CCCCC(=O)OCC=O Amb25729160 [1,0,0,0,0,0|1,0,0]=2 219 B9R0.18 CCCCC(=O)OCCBr Amb24709719 [1,0,0,0,0,0|1,0,1]=3 220 B9R0.18 CCCCC(=O)OCCCl Amb25292212 [1,0,0,0,0,0|1,0,1]=3 221 B9R0.18 CCCCC(=O)OCCF Amb24447526 [1,0,0,0,0,0|1,0,1]=3 222 B9R0.18 CCCCC(=O)\C=C/C=O Amb25299416 [1,0,0,0,0,0|2,0,1]=4 223 B9R0.18 CCCCC(=O)\C=C\C=C Amb25338203 [1,0,0,0,0,0|1,0,1]=3 224 B9R0.18 CCCCC(Br)CCC=C Amb25365643 [1,0,0,0,0,0|2,0,1]=4 225 B9R0.18 CCCCC(N)CCC=C Amb25825777 [1,0,0,0,0,0|2,0,1]=4 226 B9R0.18 CCCCC(O)CCC=C Amb25682147 [1,0,0,0,0,0|1,0,2]=4 227 B9R0.18 CCCCP(=O)OCCCl Amb25101524 [1,0,0,0,0,0|2,0,1]=4 228 B9R0.18 CCCC[C@@H](O)CCC=C Amb25129816 [1,0,0,0,0,0|1,0,2]=4 229 B9R0.18 CCCNC(=O)OCC#C Amb25721062 [1,0,0,0,0,0|1,0,2]=4 230 B9R0.18 CCCNC(=O)OCCBr Amb25741764 [1,0,0,0,0,0|2,0,1]=4 231 B9R0.18 CCCNC(=O)OCCC Amb24460257 [1,0,0,0,0,0|1,0,2]=4 232 B9R0.18 CCCNC(=O)OCCCl Amb25084565 [1,0,0,0,0,0|2,0,1]=4 233 B9R0.18 CCCNC(=O)OCCI Amb25169397 [1,0,0,0,0,0|2,0,1]=4 234 B9R0.18 CCCNC(=O)ON=CC Amb25219884 [1,0,0,0,0,0|2,0,1]=4 235 B9R0.18 CCCOC(=O)CCCCl Amb19960299 [1,0,0,0,0,0|1,0,2]=4 236 B9R0.18 CCCOC(=O)CNCC Amb24358825 [1,0,0,0,0,0|1,0,2]=4 237 B9R0.18 CCCOC(=O)OCC=C Amb25185097 [1,0,0,0,0,0|1,0,0]=2 238 B9R0.18 CCCOC(=O)OCCC Amb22336422 [1,0,0,0,0,0|1,0,2]=4 239 B9R0.18 CCCOC(=O)OCCCl Amb24593589 [1,0,0,0,0,0|2,0,1]=4 240 B9R0.18 CCCOC(=O)OCCN Amb25126346 [1,0,0,0,0,0|2,0,1]=4 241 B9R0.18 CCCOC(=S)NCC=C Amb25253499 [1,0,0,0,0,0|2,1,0]=4 242 B9R0.18 CCCSC(=O)NCC=C Amb25269513 [1,0,0,0,0,0|2,0,0]=3 243 B9R0.18 CCC\N=C(\N)/SCC=C Amb24613739 [1,0,0,0,0,0|2,1,0]=4 244 B9R0.18 CCNCC(=O)CCC=C Amb24524422 [1,0,0,0,0,0|2,0,0]=3 245 B9R0.18 CCNCC(=O)NCC=C Amb20141777 [1,0,0,0,0,0|2,0,0]=3 246 B9R0.18 CCOCC(=O)NCC=C Amb22285256 [1,0,0,0,0,0|2,0,0]=3 247 B9R0.18 CCOCC(=O)OCCF Amb25807294 [1,0,0,0,0,0|2,0,1]=4 248 B9R0.18 CCSCC(=O)CCC=C Amb24350176 [1,0,0,0,0,0|2,0,0]=3 249 B9R0.18 CC\C=C\C(=O)CCC=C Amb25709972 [1,0,0,0,0,0|1,0,2]=4 250 B9R0.18 CC\C=C\C(=O)OCC=C Amb22730500 [1,0,0,0,0,0|0,0,2]=3 251 B9R0.18 CNCCC(=O)CCC=C Amb24524378 [1,0,0,0,0,0|2,0,0]=3 252 B9R0.18 CNCCC(=O)NCC=C Amb25206855 [1,0,0,0,0,0|2,0,0]=3 253 B9R0.18 COCCC(=O)NCC=C Amb24381162 [1,0,0,0,0,0|2,0,0]=3 254 B9R0.18 COCCC(=O)OCC=C Amb25130992 [1,0,0,0,0,0|1,0,0]=2 255 B9R0.18 COCCC(=O)OCCC Amb25219323 [1,0,0,0,0,0|1,0,2]=4 256 B9R0.18 COCCC(=O)OCCO Amb25845430 [1,0,0,0,0,0|2,0,1]=4 257 B9R0.18 COCNC(=O)CCC=C Amb25853209 [1,0,0,0,0,0|3,0,0]=4 258 B9R0.18 COCNC(=O)OCC=C Amb24502297 [1,0,0,0,0,0|2,0,0]=3 259 B9R0.18 COCOC(=O)CCCBr Amb24505065 [1,0,0,0,0,0|2,0,1]=4 260 B9R0.18 COCOC(=O)COCC Amb25066175 [1,0,0,0,0,0|2,0,1]=4 261 B9R0.18 CSCCC(=O)CCC=C Amb24655317 [1,0,0,0,0,0|2,0,0]=3 262 B9R0.18 CSSCC(=O)NCC=C Amb24466692 [1,0,0,0,0,0|3,0,0]=4 263 B9R0.18 NCCNC(=O)NCC=C Amb17231969 [1,0,0,0,0,0|3,0,0]=4 264 B9R0.18 O=C(CCCF)OCCCl Amb25299277 [1,0,0,0,0,0|2,0,1]=4 265 B9R0.18 OCCCC(=O)NCC=C Amb17231960 [1,0,0,0,0,0|2,0,0]=3 266 B9R0.45 C=CCCCCCCCBr Amb19895211 [1,0,0,0,0,0|2,0,1]=4 267 B9R0.45 C=CCCCCCCCN Amb24763980 [1,0,0,0,0,0|2,0,1]=4 268 B9R0.45 C=CCCCCCCCO Amb22733549 [1,0,0,0,0,0|2,0,1]=4 269 B9R0.45 C=CCCNCCCCF Amb25818131 [1,0,0,0,0,0|3,0,0]=4 270 B9R0.45 C=CCCOCCCCCl Amb18798172 [1,0,0,0,0,0|3,0,0]=4 271 B9R0.45 C=CCCOCCCCS Amb24673342 [1,0,0,0,0,0|3,0,0]=4 272 B9R0.45 C=CCC\C=C\CCCCl Amb24515097 [1,0,0,0,0,0|2,0,1]=4 273 B9R0.45 C=CCNCCCCCBr Amb25169345 [1,0,0,0,0,0|2,0,1]=4 274 B9R0.45 C=CCNCCCCCCl Amb25274553 [1,0,0,0,0,0|2,0,1]=4 275 B9R0.45 C=CCNCCCCCI Amb24479620 [1,0,0,0,0,0|2,0,1]=4 276 B9R0.45 C=CCOCCCCC=O Amb25105437 [1,0,0,0,0,0|1,0,2]=4 277 B9R0.45 C=CCOCCCCCBr Amb25141774 [1,0,0,0,0,0|1,0,1]=3 278 B9R0.45 C=CCOCCCCCO Amb25792274 [1,0,0,0,0,0|1,0,1]=3 279 B9R0.45 C=CCOCCCCCS Amb25136655 [1,0,0,0,0,0|1,0,1]=3 280 B9R0.45 C=CCOCCNCCF Amb25236520 [1,0,0,0,0,0|2,0,1]=4 281 B9R0.45 C=CCOCCOCCBr Amb25101176 [1,0,0,0,0,0|2,0,1]=4 282 B9R0.45 C=CCOCCOCCN Amb18111246 [1,0,0,0,0,0|2,0,1]=4 283 B9R0.45 C=CCOCCOCCO Amb17933929 [1,0,0,0,0,0|2,0,1]=4 284 B9R0.45 C=CCOCCSCCO Amb25177352 [1,0,0,0,0,0|2,0,1]=4 285 B9R0.45 C=CCONCCCC#C Amb24648078 [1,0,0,0,0,0|1,0,2]=4 286 B9R0.45 C=CCONCCCC#N Amb24578386 [1,0,0,0,0,0|2,0,1]=4 287 B9R0.45 C=CCO\N=C\CCCO Amb25043835 [1,0,0,0,0,0|2,0,1]=4 288 B9R0.45 CCCCCC#CCC=C Amb10563782 [1,0,0,0,0,0|1,0,1]=3 289 B9R0.45 CCCCCC=NCCO Amb25769358 [1,0,0,0,0,0|2,0,1]=4 290 B9R0.45 CCCCCCCOC=C Amb25817973 [1,0,0,0,0,0|2,0,1]=4 291 B9R0.45 CCCCCCOCC=C Amb17933923 [1,0,0,0,0,0|0,0,1]=2 292 B9R0.45 CCCCCCSCC=C Amb22733767 [1,0,0,0,0,0|0,1,1]=3 293 B9R0.45 CCCCCC\C=C/C=C Amb22641680 [1,0,0,0,0,0|1,0,2]=4 294 B9R0.45 CCCCCNOCC=C Amb25359199 [1,0,0,0,0,0|1,0,0]=2 295 B9R0.45 CCCCCSCCC=C Amb25120497 [1,0,0,0,0,0|2,0,0]=3 296 B9R0.45 CCCCC\C=C/CC=O Amb22731181 [1,0,0,0,0,0|2,0,0]=3 297 B9R0.45 CCCCC\C=C\C=CCl Amb24561711 [1,0,0,0,0,0|2,0,1]=4 298 B9R0.45 CCCCC\C=C\C=CN Amb25224315 [1,0,0,0,0,0|2,0,1]=4 299 B9R0.45 CCCCC\C=C\CCN Amb25123460 [1,0,0,0,0,0|2,0,1]=4 300 B9R0.45 CCCCOCCCC=C Amb25662912 [1,0,0,0,0,0|2,0,1]=4 301 B9R0.45 CCCCSCCCC=C Amb24482054 [1,0,0,0,0,0|2,0,1]=4 302 B9R0.45 CCCC\C=C/CCC=O Amb24477003 [1,0,0,0,0,0|2,0,1]=4 303 B9R0.45 CCCNCCNCC=C Amb25075002 [1,0,0,0,0,0|2,0,1]=4 304 B9R0.45 CCCNCCSCC=C Amb24449067 [1,0,0,0,0,0|1,1,1]=4 305 B9R0.45 CCCONCCCCC Amb25074780 [1,0,0,0,0,0|1,0,2]=4 306 B9R0.45 CCCSCCNCC=C Amb18797757 [1,0,0,0,0,0|2,0,1]=4 307 B9R0.45 CCC\C=C/CCCCC Amb22230436 [1,0,0,0,0,0|1,0,2]=4 308 B9R0.45 CCC\C=C\CCCCC Amb22231673 [1,0,0,0,0,0|1,0,2]=4 309 B9R0.45 CCNCCCOCC=C Amb24441883 [1,0,0,0,0,0|1,0,1]=3 310 B9R0.45 CCNCCCSCC=C Amb25080841 [1,0,0,0,0,0|1,1,1]=4 311 B9R0.45 CCNCCOCCC=C Amb25365870 [1,0,0,0,0,0|3,0,0]=4 312 B9R0.45 CCNCC\C=C\CC=C Amb25313982 [1,0,0,0,0,0|2,0,0]=3 313 B9R0.45 CCOCCCSCC=C Amb25851910 [1,0,0,0,0,0|1,1,1]=4 314 B9R0.45 CCONCCOCC=C Amb25272738 [1,0,0,0,0,0|2,0,1]=4 315 B9R0.45 CNCCCCOCC=C Amb24476920 [1,0,0,0,0,0|1,0,1]=3 316 B9R0.45 CNCCCNCCC=C Amb25739865 [1,0,0,0,0,0|3,0,0]=4 317 B9R0.45 COCCCCNCC=C Amb24607244 [1,0,0,0,0,0|2,0,1]=4 318 B9R0.45 CSCCCCNCC=C Amb25147739 [1,0,0,0,0,0|2,0,1]=4 319 B9R0.45 CSCCCNOCC=C Amb25360066 [1,0,0,0,0,0|2,0,0]=3 320 B9R0.45 CSCCCSCCC=C Amb25169431 [1,0,0,0,0,0|3,0,0]=4 321 B9R0.45 C\C=C/C=C\CCCCC Amb22641684 [1,0,0,0,0,0|1,0,2]=4 322 B9R0.45 OCCCCCNCC=C Amb17334217 [1,0,0,0,0,0|2,0,1]=4 323 B11R0.11 CCCCC(=O)C(CCCC)O Amb17594331 [0,1,0,0,0,0|1,0,2]=4 324 B11R0.11 CCCNC(=O)C(N)CCCC Amb18794439 [0,1,0,0,0,0|1,0,2]=4 325 B11R0.11 COCC[C@H](N)C(=O)OCCC Amb24053178 [0,1,0,0,0,0|1,0,2]=4 326 B11R0.11 CSCCC(N)C(=O)NCC=C Amb23511189 [0,1,0,0,0,0|2,0,0]=3 327 B11R0.11 CSCC[C@@H](N)C(=O)OCC=C Amb22746150 [0,1,0,0,0,0|1,0,0]=2 328 B11R0.11 CSCC[C@H]([NH3+])C(=O)OCC=C Amb22349473 [0,1,0,0,0,0|1,0,0]=2 329 B11R0.46 CCCCNC(=O)CCC(=O)C Amb17334851 [0,1,0,0,0,0|2,0,1]=4 330 B11R0.46 CCCCNC(=O)CCC(=O)Cl Amb17143098 [0,1,0,0,0,0|3,0,0]=4 331 B11R0.46 CCCCNC(=O)CCC(=O)O Amb1785994 [0,1,0,0,0,0|3,0,0]=4 332 B11R0.46 CCCCNC(=O)CCC(=S)N Amb17336047 [0,1,0,0,0,0|3,0,0]=4 333 B11R0.46 CCCCNC(=O)NCC(=O)O Amb1138541 [0,1,0,0,0,0|3,0,0]=4 334 B11R0.46 CCCCNC(=O)NCC(Br)=C Amb17924549 [0,1,0,0,0,0|2,0,0]=3 335 B11R0.46 CCCCOC(=O)CCC(O)=O Amb19888684 [0,1,0,0,0,0|3,0,0]=4 336 B11R0.46 COCCNC(=O)NCC(Br)=C Amb17924556 [0,1,0,0,0,0|3,0,0]=4 337 B11R0.70 CCC(C)NCC(=O)NCC=C Amb18806559 [0,1,0,0,0,0|2,0,0]=3 338 B11R0.70 COC(=O)CCC(=O)NCC=C Amb17400349 [0,1,0,0,0,0|2,0,1]=4 339 B11R0.81 C=CCOC(=O)NCCCCN Amb22348046 [0,1,0,0,0,0|1,0,0]=2 340 B11R0.81 C=CCOC(=O)NCCCCO Amb22348074 [0,1,0,0,0,0|1,0,0]=2 341 B11R0.81 C=CCOCCC(=O)OCC=C Amb17933914 [0,1,0,0,0,0|0,0,2]=3 342 B11R0.81 CCCCCCC(=O)CCCC Amb17940262 [0,1,0,0,0,0|1,0,2]=4 343 B11R0.81 CCCCCNC(=O)CCC#N Amb17334729 [0,1,0,0,0,0|2,0,1]=4 344 B11R0.81 CCCCCOC(=O)CCCC Amb22350606 [0,1,0,0,0,0|1,0,2]=4 345 B11R0.81 CCCCCOC(=O)CCCCl Amb19960302 [0,1,0,0,0,0|2,0,1]=4 346 B11R0.81 CCCCNCC(=O)NCC=C Amb19969747 [0,1,0,0,0,0|1,0,0]=2 347 B11R0.81 CCCOC(=O)CCCCCC Amb22167368 [0,1,0,0,0,0|0,0,2]=3 348 B11R0.81 COCCNCC(=O)NCC=C Amb20082516 [0,1,0,0,0,0|2,0,0]=3 349 B11R0.140 CCCCNC(=O)CNCC=C Amb18806566 [0,1,0,0,0,0|2,0,0]=3 350 B11R0.140 CCCCOC(=O)OCCCC Amb22732182 [0,1,0,0,0,0|1,0,2]=4 351 B11R0.140 CCCCOC(=O)OCCCF Amb24088693 [0,1,0,0,0,0|1,0,2]=4 352 B11R0.140 COCCNC(=O)CNCC=C Amb18807351 [0,1,0,0,0,0|3,0,0]=4 353 B11R0.147 C=CCNC(=O)CCCC(=O)O Amb1863934 [0,1,0,0,0,0|2,0,1]=4 354 B11R1.5 C#CCC1CCCCCC1=O Amb18796640 [0,0,0,1,0,0|1,0,2]=4 355 B11R1.5 C#CCN1CCCCCC1=O Amb18177185 [0,0,0,1,0,0|1,0,2]=4 356 B11R1.5 C=CCC1CCCCCC1=O Amb18181756 [0,0,0,1,0,0|1,0,0]=2 357 B11R1.5 C=CCC1CCCCCC1Br Amb25277926 [0,0,0,1,0,0|2,0,1]=4 358 B11R1.5 C=CCC1CCCCCC1Cl Amb18185761 [0,0,0,1,0,0|2,0,1]=4 359 B11R1.5 C=CCC1CCCCCC1N Amb18286582 [0,0,0,1,0,0|2,0,1]=4 360 B11R1.5 C=CCC1CCCCCC1O Amb18182944 [0,0,0,1,0,0|1,0,2]=4 361 B11R1.5 C=CCC1OCCCCC1=O Amb25730090 [0,0,0,1,0,0|2,0,0]=3 362 B11R1.5 C=CCC1SCCCCC1=O Amb25766897 [0,0,0,1,0,0|2,0,0]=3 363 B11R1.5 CCCC1CCCCCC1=O Amb18796794 [0,0,0,1,0,0|1,0,2]=4 364 B11R1.5 COCC1CCCCCC1=O Amb24671812 [0,0,0,1,0,0|2,0,1]=4 365 B11R1.5 N#CCC1CCCCCC1=O Amb25735835 [0,0,0,1,0,0|2,0,1]=4 366 B11R1.5 NCCC1CCCCCC1=O Amb18200342 [0,0,0,1,0,0|2,0,1]=4 367 B11R1.5 NCCN1CCCCCC1=O Amb10610308 [0,0,0,1,0,0|2,0,1]=4 368 B11R1.5 O=C1CCCCCC1CCF Amb24686950 [0,0,0,1,0,0|2,0,1]=4 369 B11R1.5 O=C1CCCCCN1CCS Amb25105854 [0,0,0,1,0,0|2,0,1]=4 370 B11R1.5 O=C1CCCCCN1\C=C\Cl Amb24518975 [0,0,0,1,0,0|2,0,1]=4 371 B11R1.5 O=CCN1CCCCCC1=O Amb18799577 [0,0,0,1,0,0|2,0,0]=3 372 B11R1.17 CCCCC1=CC=CNC1=O Amb25270944 [0,0,0,1,0,0|1,0,2]=4 373 B11R1.17 CCCCC1=CC=NNC1=O Amb24674074 [0,0,0,1,0,0|2,0,1]=4 374 B11R1.17 CCCCC1=CCCCC1=O Amb25150316 [0,0,0,1,0,0|1,0,2]=4 375 B11R1.17 CCCCC1C=CCCC1=O Amb25066414 [0,0,0,1,0,0|1,0,0]=2 376 B11R1.17 CCCCC1C=CCCC1Cl Amb25246994 [0,0,0,1,0,0|2,0,1]=4 377 B11R1.17 CCCCC1COCCC1=O Amb25720690 [0,0,0,1,0,0|2,0,1]=4 378 B11R1.17 CCCCC1NCCNC1=O Amb18989085 [0,0,0,1,0,0|2,0,1]=4 379 B11R1.17 CCCCC1OCCCC1=O Amb24456613 [0,0,0,1,0,0|2,0,1]=4 380 B11R1.17 CCCCC1SCCNC1=O Amb24484716 [0,0,0,1,0,0|2,0,1]=4 381 B11R1.17 CCCCN1C=CC=CC1=O Amb22739996 [0,0,0,1,0,0|2,0,1]=4 382 B11R1.17 CCCCN1C=CC=NC1=O Amb25041666 [0,0,0,1,0,0|2,0,1]=4 383 B11R1.17 CCCCN1C=CN=CC1=O Amb25137324 [0,0,0,1,0,0|3,0,0]=4 384 B11R1.17 CCCC[C@@H]1C=CCC[C@@H]1O Amb24515585 [0,0,0,1,0,0|1,0,2]=4 385 B11R1.17 CCCC[C@@H]1C=CCC[C@H]1O Amb24661095 [0,0,0,1,0,0|1,0,2]=4 386 B11R1.17 CCCC[C@@H]1CCCNC1=O Amb24509566 [0,0,0,1,0,0|1,0,2]=4 387 B11R1.17 CCCC[C@@H]1NCCNC1=O Amb24470005 [0,0,0,1,0,0|2,0,1]=4 388 B11R1.17 CCCC[C@H]1CCCCC1=O Amb24725293 [0,0,0,1,0,0|1,0,2]=4 389 B11R1.17 CCCC[C@H]1NCCNC1=O Amb25059217 [0,0,0,1,0,0|2,0,1]=4 390 B11R1.17 CCCCn1ccccc1=O Amb10553753 [0,0,0,1,0,0|2,0,1]=4 391 B11R1.17 O=C1OCCCC1CCCCl Amb25738330 [0,0,0,1,0,0|1,0,2]=4 392 B11R1.17 OCCCC1CCCOC1=O Amb25851451 [0,0,0,1,0,0|1,0,2]=4 393 B11R1.24 C=CCCC=1CCCC(N)C1 Amb25319369 [0,0,0,1,0,0|3,0,0]=4 394 B11R1.24 C=CCCC=1CCCC(O)C1 Amb24486478 [0,0,0,1,0,0|3,0,0]=4 395 B11R1.24 CC1CC(CCC1)OCC=O Amb18183073 [0,0,0,1,0,0|2,0,1]=4 396 B11R1.24 CC1CC(CCC1)SCC=C Amb25079128 [0,0,0,1,0,0|1,1,1]=4 397 B11R1.24 CC1CCN=C(NCC=C)S1 Amb24710746 [0,0,0,1,0,0|2,1,0]=4 398 B11R1.24 C[C@@H]1CN(CCC1)CCC=C Amb25318446 [0,0,0,1,0,0|3,0,0]=4 399 B11R1.24 C[C@@H]1C[C@@H](CCC1)OCC=O Amb24513048 [0,0,0,1,0,0|2,0,1]=4 400 B11R1.27 CCCCCC1=CC(=O)CS1 Amb24765347 [0,0,0,1,0,0|2,1,0]=4 401 B11R1.27 CCCCCC1=CCC(=O)N1 Amb25384805 [0,0,0,1,0,0|3,0,0]=4 402 B11R1.27 CCCCCC1CC(=O)CO1 Amb24766911 [0,0,0,1,0,0|2,0,1]=4 403 B11R1.27 CCCCCC1OCC(=C)O1 Amb24763039 [0,0,0,1,0,0|0,0,2]=3 404 B11R1.27 CCCCCC=1CC(=O)CC1 Amb24765342 [0,0,0,1,0,0|3,0,0]=4 405 B11R1.27 CCCCCc1[n]c(Cl)[n]o1 Amb24762751 [0,0,0,1,0,0|3,0,0]=4 406 B11R1.27 CCCCCc1[n]c(N)[n]o1 Amb25380455 [0,0,0,1,0,0|3,0,0]=4 407 B11R1.27 CCCCCc1cc(N)[n]o1 Amb25383063 [0,0,0,1,0,0|3,0,0]=4 408 B11R1.28 CCCCCc1[n]ccc[n]1 Amb24084930 [0,0,0,1,0,0|2,0,1]=4 409 B11R1.28 CCCCCc1cccnc1 Amb17672949 [0,0,0,1,0,0|3,0,0]=4 410 B11R1.29 C#CCCC(=O)C1CCCC1 Amb24748713 [0,0,0,1,0,0|1,0,2]=4 411 B11R1.29 C#CCOC(=O)C1COCC1 Amb24457443 [0,0,0,1,0,0|1,0,2]=4 412 B11R1.29 C#CCOC(=O)C1CSCC1 Amb25051066 [0,0,0,1,0,0|1,0,2]=4 413 B11R1.29 C#CCOC(=O)[C@@H]1CCCN1 Amb25083266 [0,0,0,1,0,0|1,0,2]=4 414 B11R1.29 C#CCOC(=O)[C@@H]1CCCO1 Amb25802478 [0,0,0,1,0,0|1,0,2]=4 415 B11R1.29 C=C(CCC=O)C1CCCC1 Amb25384433 [0,0,0,1,0,0|3,0,0]=4 416 B11R1.29 C=CCCC(=O)C1CCCS1 Amb25380004 [0,0,0,1,0,0|2,0,0]=3 417 B11R1.29 C=CCCC(=O)C=1CCCC1 Amb24766829 [0,0,0,1,0,0|1,0,2]=4 418 B11R1.29 C=CCCC(=O)N1CCCN1 Amb24762928 [0,0,0,1,0,0|3,0,0]=4 419 B11R1.29 C=CCCC(=O)N1CCCO1 Amb24755981 [0,0,0,1,0,0|3,0,0]=4 420 B11R1.29 C=CCCC(=O)N1CSCC1 Amb24755989 [0,0,0,1,0,0|3,0,0]=4 421 B11R1.29 C=CCCC(=O)[C@@H]1CCCN1 Amb24764727 [0,0,0,1,0,0|2,0,0]=3 422 B11R1.29 C=CCNC(=N)N1CCCC1 Amb25225795 [0,0,0,1,0,0|3,0,0]=4 423 B11R1.29 C=CCNC(=O)C1CC=CC1 Amb25741223 [0,0,0,1,0,0|1,0,2]=4 424 B11R1.29 C=CCNC(=O)C1CCCC1 Amb17870706 [0,0,0,1,0,0|1,0,0]=2 425 B11R1.29 C=CCNC(=O)C1CCCN1 Amb21958704 [0,0,0,1,0,0|2,0,0]=3 426 B11R1.29 C=CCNC(=O)C1CCCO1 Amb17871276 [0,0,0,1,0,0|2,0,0]=3 427 B11R1.29 C=CCNC(=O)C1CCCS1 Amb25172776 [0,0,0,1,0,0|2,0,0]=3 428 B11R1.29 C=CCNC(=O)C1CNCC1 Amb18302742 [0,0,0,1,0,0|2,0,0]=3 429 B11R1.29 C=CCNC(=O)C1COCC1 Amb25809776 [0,0,0,1,0,0|2,0,0]=3 430 B11R1.29 C=CCNC(=O)C1CSCC1 Amb25231128 [0,0,0,1,0,0|2,0,0]=3 431 B11R1.29 C=CCNC(=O)C=1CCCC1 Amb24429003 [0,0,0,1,0,0|1,0,2]=4 432 B11R1.29 C=CCNC(=O)N1CCCO1 Amb25098862 [0,0,0,1,0,0|3,0,0]=4 433 B11R1.29 C=CCNC(=O)[C@@H]1CNCC1 Amb25823023 [0,0,0,1,0,0|2,0,0]=3 434 B11R1.29 C=CCNC(=O)[C@H]1CNCC1 Amb24387627 [0,0,0,1,0,0|2,0,0]=3 435 B11R1.29 C=CCNC(=O)[C@H]1CSCN1 Amb24752077 [0,0,0,1,0,0|3,0,0]=4 436 B11R1.29 C=CCOC(=O)C1C=CCO1 Amb25382185 [0,0,0,1,0,0|1,0,2]=4 437 B11R1.29 C=CCOC(=O)C1CCCN1 Amb18644731 [0,0,0,1,0,0|1,0,0]=2 438 B11R1.29 C=CCOC(=O)C1COC=C1 Amb24763017 [0,0,0,1,0,0|1,0,2]=4 439 B11R1.29 C=CCOC(=O)C1SCCS1 Amb24755987 [0,0,0,1,0,0|2,0,0]=3 440 B11R1.29 C=CCOC(=O)C=1CCCC1 Amb25382182 [0,0,0,1,0,0|0,0,2]=3 441 B11R1.29 C=CCOC(=O)N1CC=CC1 Amb25382183 [0,0,0,1,0,0|1,0,2]=4 442 B11R1.29 C=CCOC(=O)N1CCC=C1 Amb24763015 [0,0,0,1,0,0|1,0,2]=4 443 B11R1.29 C=CCOC(=O)[C@@H]1CCCO1 Amb24755996 [0,0,0,1,0,0|1,0,0]=2 444 B11R1.29 C=CCOC(=O)[C@H]1CCCO1 Amb25372141 [0,0,0,1,0,0|1,0,0]=2 445 B11R1.29 CC(NCC=C)C1CCCC1 Amb18313118 [0,0,0,1,0,0|2,0,1]=4 446 B11R1.29 CCCOC(=O)C1CCCS1 Amb25379568 [0,0,0,1,0,0|1,0,2]=4 447 B11R1.29 CCCOC(=O)C1CNCC1 Amb18316033 [0,0,0,1,0,0|1,0,2]=4 448 B11R1.29 CCCOC(=O)C1COCC1 Amb18787751 [0,0,0,1,0,0|1,0,2]=4 449 B11R1.29 CCCOC(=O)C1CSCC1 Amb25379569 [0,0,0,1,0,0|1,0,2]=4 450 B11R1.29 CCCOC(=O)[C@@H]1CCCN1 Amb18177528 [0,0,0,1,0,0|1,0,2]=4 451 B11R1.29 COCCC(=O)C1CCCC1 Amb18177472 [0,0,0,1,0,0|2,0,1]=4 452 B11R1.29 COCOC(=O)C1CCCC1 Amb25382902 [0,0,0,1,0,0|1,0,1]=3 453 B11R1.29 CSCCC(=O)C1CCCC1 Amb25379584 [0,0,0,1,0,0|2,0,1]=4 454 B11R1.29 C[C@@H](NCC=C)C1CCCC1 Amb24762003 [0,0,0,1,0,0|2,0,1]=4 455 B11R1.29 C[C@H](NCC=C)C1CCCC1 Amb24762007 [0,0,0,1,0,0|2,0,1]=4 456 B11R1.29 C\C(=C\CC=C)\C1CCCN1 Amb25194348 [0,0,0,1,0,0|3,0,0]=4 457 B11R1.29 C\C(=C\CC=C)\C1CNCC1 Amb25250827 [0,0,0,1,0,0|3,0,0]=4 458 B11R1.29 N#CCCC(=O)C1CCCC1 Amb18181694 [0,0,0,1,0,0|2,0,1]=4 459 B11R1.29 N#CCNC(=O)C1CCCC1 Amb18791505 [0,0,0,1,0,0|2,0,1]=4 460 B11R1.29 NCCCC(=O)C1CCCC1 Amb18200351 [0,0,0,1,0,0|2,0,1]=4 461 B11R1.29 NCCNC(=O)C1CCCC1 Amb1135805 [0,0,0,1,0,0|2,0,1]=4 462 B11R1.29 NCCNC(=O)C1CCCC1 Amb13952111 [0,0,0,1,0,0|2,0,1]=4 463 B11R1.29 O=C(CCCCl)C1CCCC1 Amb25386366 [0,0,0,1,0,0|2,0,1]=4 464 B11R1.29 O=C(CCCF)C1CCCC1 Amb24766132 [0,0,0,1,0,0|2,0,1]=4 465 B11R1.29 O=C(NCCCl)C1CCCC1 Amb18790716 [0,0,0,1,0,0|2,0,1]=4 466 B11R1.29 O=C(NCCF)C1CCCC1 Amb25043300 [0,0,0,1,0,0|2,0,1]=4 467 B11R1.29 O=C(NCCI)C1CCCC1 Amb25064403 [0,0,0,1,0,0|2,0,1]=4 468 B11R1.29 O=CCCC(=O)N1CCCC1 Amb18125853 [0,0,0,1,0,0|3,0,0]=4 469 B11R1.29 O=CCNC(=O)C1CCCC1 Amb22896806 [0,0,0,1,0,0|2,0,0]=3 470 B11R1.29 O=CCOC(=O)N1CCCC1 Amb24765081 [0,0,0,1,0,0|2,0,0]=3 471 B11R1.29 OCCCC(=O)C1CCCC1 Amb24766127 [0,0,0,1,0,0|2,0,1]=4 472 B11R1.29 OCCOC(=O)C1CCCC1 Amb24762659 [0,0,0,1,0,0|1,0,1]=3 473 B11R1.29 OCCOC(=O)C1CCCO1 Amb24762660 [0,0,0,1,0,0|2,0,1]=4 474 B11R1.29 OCCOC(=O)C1CCCS1 Amb24762661 [0,0,0,1,0,0|2,0,1]=4 475 B11R1.29 OCCOC(=O)C1COCC1 Amb24762662 [0,0,0,1,0,0|2,0,1]=4 476 B11R1.29 OCCOC(=O)C1CSCC1 Amb24762663 [0,0,0,1,0,0|2,0,1]=4 477 B11R1.29 OCCOC(=O)[C@@H]1CCCN1 Amb25383814 [0,0,0,1,0,0|2,0,1]=4 478 B11R1.37 CCC1CCC(=O)NC1C=C Amb24629627 [0,0,0,1,0,0|1,0,0]=2 479 B11R1.37 CC[C@@H]1CCC(=O)N[C@H]1C=C Amb25328976 [0,0,0,1,0,0|1,0,0]=2 480 B11R1.101 O=C1CCC#CCCCCC1 Amb25128900 [0,0,0,1,0,0|1,0,2]=4 481 B11R1.101 O=C1CCC=CCCCC=C1 Amb24645378 [0,0,0,1,0,0|1,0,2]=4 482 B11R1.101 O=C1CCC=CCCCCN1 Amb24486107 [0,0,0,1,0,0|2,0,0]=3 483 B11R1.101 O=C1CCCC=CCCCC1 Amb25039892 [0,0,0,1,0,0|1,0,2]=4 484 B11R1.101 O=C1NCCCCCCCO1 Amb24443710 [0,0,0,1,0,0|1,0,2]=4 485 B11R1.110 CCCC1CC(=O)CCCC1 Amb25090747 [0,0,0,1,0,0|1,0,2]=4 486 B11R1.110 CCCC1CC(=O)NCCC1 Amb24484588 [0,0,0,1,0,0|1,0,2]=4 487 B11R1.144 O=C1CCC(=O)CCCCC1 Amb25830564 [0,0,0,1,0,0|2,0,0]=3 488 B11R1.144 O=C1CCCCCC(=O)C=C1 Amb25282753 [0,0,0,1,0,0|2,0,1]=4 489 B11R1.145 OC1CCCC(=O)OCCC1 Amb25149645 [0,0,0,1,0,0|1,0,2]=4 490 B11R1.182 CC1CCC(=O)CC1CCC Amb24467090 [0,0,0,1,0,0|1,0,2]=4 491 B11R1.182 CCCN1CC(=O)OCC1C Amb24373975 [0,0,0,1,0,0|1,0,2]=4 492 B11R1.182 C[C@@H]1CCC(=O)C[C@H]1CCC Amb25179748 [0,0,0,1,0,0|1,0,2]=4 493 B11R1.183 C=CC1CC(=O)CC1CC=C Amb24334810 [0,0,0,1,0,0|1,0,2]=4 494 B11R1.183 C=CC1CC(=O)OC1CCO Amb24556934 [0,0,0,1,0,0|3,0,0]=4 495 B11R1.183 C=C[C@@H]1CC(=O)C[C@H]1CC=C Amb24625810 [0,0,0,1,0,0|1,0,2]=4 496 B11R1.183 C=C[C@H]1CC(=O)O[C@H]1CCO Amb24595459 [0,0,0,1,0,0|3,0,0]=4 497 B11R1.183 C=C[C@H]1OC(=O)N[C@H]1CCO Amb25353489 [0,0,0,1,0,0|2,0,0]=3 498 B11R1.183 CCC1NC(=O)CC1CCC Amb25688371 [0,0,0,1,0,0|1,0,2]=4 499 B11R1.183 CCCC1NC(=O)OC1CO Amb25125883 [0,0,0,1,0,0|2,0,1]=4 500 B11R1.183 CCC[C@@H]1NC(=O)O[C@@H]1CO Amb25346241 [0,0,0,1,0,0|2,0,1]=4 501 B11R1.183 CCC[C@@H]1NC(=O)O[C@H]1CO Amb25271463 [0,0,0,1,0,0|2,0,1]=4 502 B11R1.183 CCOC1CC(=O)OC1CO Amb24672719 [0,0,0,1,0,0|2,0,1]=4 503 B11R1.183 CCSC1CC(=O)O[C@H]1CO Amb24719776 [0,0,0,1,0,0|2,0,1]=4 504 B11R1.183 CC[C@@H]1CC(=O)C[C@H]1CCC Amb24604137 [0,0,0,1,0,0|1,0,2]=4 505 B11R1.203 C=CCCC1CCCCCN1 Amb24418713 [0,0,0,1,0,0|2,0,1]=4 506 B11R1.203 C=CCOC1CCCNCC1 Amb25083125 [0,0,0,1,0,0|2,0,1]=4 507 B11R1.203 C=CC\C=C/1\CCCNCC1 Amb24487017 [0,0,0,1,0,0|3,0,0]=4 508 B11R1.203 O=CCCC=1CCCCCC1 Amb25277245 [0,0,0,1,0,0|3,0,0]=4 509 B11R1.203 O=CCOC1CCCCCC1 Amb18183074 [0,0,0,1,0,0|2,0,1]=4 510 B11R1.214 CNC1CN(CC1)OCC=C Amb24765659 [0,0,0,1,0,0|3,0,0]=4 511 B11R1.245 C=CC1CC(=O)CCCCC1 Amb24575840 [0,0,0,1,0,0|1,0,0]=2 512 B11R1.245 CCC1CC(=O)CCCCC1 Amb25151478 [0,0,0,1,0,0|1,0,2]=4 513 B11R1.245 CCC1CCCCCC(=O)N1 Amb25313080 [0,0,0,1,0,0|1,0,2]=4 514 B11R1.245 CC[C@@H]1CC(=O)CCCCC1 Amb25334919 [0,0,0,1,0,0|1,0,2]=4 515 B11R1.245 N#CC1CC(=O)CCCCC1 Amb24456549 [0,0,0,1,0,0|2,0,1]=4 516 B11R1.245 N#C[C@H]1CC(=O)CCCCC1 Amb25723273 [0,0,0,1,0,0|2,0,1]=4 517 B11R1.245 O=C1CCCCCC(=C1)C=O Amb25131196 [0,0,0,1,0,0|2,0,1]=4 518 B11R1.245 OC[C@H]1CCCCCC(=O)N1 Amb24642522 [0,0,0,1,0,0|2,0,1]=4 519 B11R1.276 CCC1CCCNC(=O)CC1 Amb25306110 [0,0,0,1,0,0|1,0,2]=4 520 B11R1.276 COC1CCC(=O)CCC=C1 Amb24370134 [0,0,0,1,0,0|2,0,0]=3 521 B11R1.282 CCC1CC1C(=O)CCC#C Amb24765620 [0,0,0,1,0,0|1,0,2]=4 522 B11R1.282 CCC1CC1C(=O)NCC#N Amb24528897 [0,0,0,1,0,0|2,0,1]=4 523 B11R1.282 CCC1CC1C(=O)NCC=C Amb24765571 [0,0,0,1,0,0|1,0,0]=2 524 B11R1.282 CCC1CC1C(=O)NCCBr Amb24765548 [0,0,0,1,0,0|2,0,1]=4 525 B11R1.282 CCC1CC1C(=O)NCCCl Amb24765547 [0,0,0,1,0,0|2,0,1]=4 526 B11R1.282 CCC1CC1C(=O)NCCI Amb24765549 [0,0,0,1,0,0|2,0,1]=4 527 B11R1.282 CCC1CC1C(=O)NCCN Amb24765607 [0,0,0,1,0,0|2,0,1]=4 528 B11R1.282 CCC1CC1C(=O)NCCO Amb24765579 [0,0,0,1,0,0|2,0,1]=4 529 B11R1.282 CCCNC(=O)C1CC1CC Amb24765545 [0,0,0,1,0,0|1,0,2]=4 530 B11R1.282 CCCNC(=O)[C@@H]1C[C@H]1CC Amb24765575 [0,0,0,1,0,0|1,0,2]=4 531 B11R1.282 CC[C@@H]1C[C@H]1C(=O)CCC#C Amb24765688 [0,0,0,1,0,0|1,0,2]=4 532 B11R1.282 CC[C@@H]1C[C@H]1C(=O)NCC=C Amb24765574 [0,0,0,1,0,0|1,0,0]=2 533 B11R1.282 CC[C@@H]1C[C@H]1C(=O)NCCBr Amb24765551 [0,0,0,1,0,0|2,0,1]=4 534 B11R1.282 CC[C@@H]1C[C@H]1C(=O)NCCCl Amb24765550 [0,0,0,1,0,0|2,0,1]=4 535 B11R1.282 CC[C@@H]1C[C@H]1C(=O)NCCI Amb24765552 [0,0,0,1,0,0|2,0,1]=4 536 B11R1.282 CC[C@@H]1C[C@H]1C(=O)NCCN Amb24765646 [0,0,0,1,0,0|2,0,1]=4 537 B11R1.282 CC[C@@H]1C[C@H]1C(=O)NCCO Amb24765619 [0,0,0,1,0,0|2,0,1]=4 538 B11R1.283 C=CCCC(=O)NC1CC1N Amb19028220 [0,0,0,1,0,0|3,0,0]=4 539 B11R1.283 C=CCNC(=O)NC1CC1N Amb24614856 [0,0,0,1,0,0|3,0,0]=4 540 B11R1.283 CC1CC1CC(=O)NCCC Amb24755882 [0,0,0,1,0,0|1,0,2]=4 541 B11R1.283 CC1CC1NC(=S)NCC=C Amb25285081 [0,0,0,1,0,0|2,1,0]=4 542 B11R1.283 CC1CC1N\C(\N)=N\CC=C Amb24525778 [0,0,0,1,0,0|3,0,0]=4 543 B11R1.283 C[C@@H]1C[C@H]1NC(=O)NCC=C Amb25031683 [0,0,0,1,0,0|2,0,0]=3 544 B11R1.284 C#CCNC(=O)CC1CCC1 Amb24340454 [0,0,0,1,0,0|1,0,2]=4 545 B11R1.284 C#CCOC(=O)CC1COC1 Amb24762651 [0,0,0,1,0,0|1,0,2]=4 546 B11R1.284 C=CCCC(=O)NC1CCC1 Amb25372161 [0,0,0,1,0,0|2,0,0]=3 547 B11R1.284 C=CCNC(=O)C=C1CCC1 Amb24607961 [0,0,0,1,0,0|1,0,2]=4 548 B11R1.284 C=CCNC(=O)NC1CNC1 Amb25189206 [0,0,0,1,0,0|3,0,0]=4 549 B11R1.284 C=CCNC(=O)OC1CCC1 Amb24765693 [0,0,0,1,0,0|2,0,0]=3 550 B11R1.284 C=CCNC(=S)NC1CCC1 Amb25306208 [0,0,0,1,0,0|2,1,0]=4 551 B11R1.284 C=CCOC(=O)C=C1CCC1 Amb24755988 [0,0,0,1,0,0|0,0,2]=3 552 B11R1.284 C=CC\N=C(\N)/NC1CCC1 Amb25283875 [0,0,0,1,0,0|3,0,0]=4 553 B11R1.285 C=CCNC(=O)CNC1CC1 Amb18182904 [0,0,0,1,0,0|2,0,0]=3 554 B11R1.285 C=CCNC(=O)\C=C\C1CC1 Amb25372183 [0,0,0,1,0,0|1,0,2]=4 555 B11R1.285 C=CCNC(=S)NCC1CC1 Amb25372139 [0,0,0,1,0,0|2,1,0]=4 556 B11R1.286 CC1CCN1C(=O)NCC=C Amb24732916 [0,0,0,1,0,0|2,0,0]=3 557 B11R1.303 C=CCC1C(CCC1=O)C=O Amb25116555 [0,0,0,1,0,0|2,0,1]=4 558 B11R1.303 C=CCN1C(CCC1=O)C=O Amb25298510 [0,0,0,1,0,0|2,0,1]=4 559 B11R1.303 C=CCN1C(CO)CCC1=O Amb22749925 [0,0,0,1,0,0|2,0,0]=3 560 B11R1.303 C=CCN1C(CO)COC1=O Amb24694151 [0,0,0,1,0,0|3,0,0]=4 561 B11R1.303 C=CCN1[C@H](CO)COC1=O Amb24615216 [0,0,0,1,0,0|3,0,0]=4 562 B11R1.303 C=CC[C@@H]1[C@H](CCC1=O)C=C Amb24588930 [0,0,0,1,0,0|1,0,2]=4 563 B11R1.303 C=CC[C@H]1[C@@H](CCC1=O)C=C Amb24512763 [0,0,0,1,0,0|1,0,2]=4 564 B11R1.303 C=CC[C@H]1[C@H](CO)COC1=O Amb24520294 [0,0,0,1,0,0|3,0,0]=4 565 B11R1.303 CC1CCC(CC)N1CC=C Amb25796165 [0,0,0,1,0,0|2,0,1]=4 566 B11R1.303 CCC1CCC(=O)N1CCN Amb18644860 [0,0,0,1,0,0|2,0,1]=4 567 B11R1.303 COC=1CCC(=O)C1CC=C Amb24486378 [0,0,0,1,0,0|2,0,1]=4 568 B11R1.339 CCC[C@@H]1CC(=O)[C@H]1CCC Amb24765333 [0,0,0,1,0,0|1,0,2]=4 569 B11R1.391 CCN1CCC(=O)CCC1=O Amb24729458 [0,0,0,1,0,0|3,0,0]=4 570 B11R1.391 CCN1CCC(=O)NCC1=O Amb25061586 [0,0,0,1,0,0|3,0,0]=4 571 B11R1.465 CC1=NOC(=O)C1CCCC Amb25071492 [0,0,0,1,0,0|1,0,1]=3 572 B11R1.465 CC=1NOC(=O)C1CCCC Amb24725267 [0,0,0,1,0,0|1,0,2]=4 573 B11R1.465 CCCCC1=C(O)CCC1=O Amb25053333 [0,0,0,1,0,0|2,0,1]=4 574 B11R1.465 CCCCC1C(=O)CCC1=O Amb25373329 [0,0,0,1,0,0|2,0,0]=3 575 B11R1.465 CCCCC=1C(=O)CCC1Cl Amb25712995 [0,0,0,1,0,0|2,0,1]=4 576 B11R1.465 CCCCN1C(=O)CSC1=O Amb17743755 [0,0,0,1,0,0|2,1,0]=4 577 B11R1.465 CNCCN1C(=O)OCC1=O Amb22642617 [0,0,0,1,0,0|3,0,0]=4 578 B11R1.465 NCCCN1C(=O)COC1=O Amb22642591 [0,0,0,1,0,0|3,0,0]=4 579 B11R1.465 OC1COC(=O)C1CCCO Amb25149755 [0,0,0,1,0,0|2,0,1]=4 580 B11R1.605 C=C1CCCC(=O)C1CC=C Amb24467083 [0,0,0,1,0,0|1,0,2]=4 581 B11R1.605 C=CCC1=C(N)CCCC1=O Amb25109277 [0,0,0,1,0,0|2,0,1]=4 582 B11R1.605 C=CCC1C(C)CCCC1=O Amb17593808 [0,0,0,1,0,0|1,0,0]=2 583 B11R1.605 C=CCN1C(=O)CCCC1=O Amb22410933 [0,0,0,1,0,0|2,0,1]=4 584 B11R1.605 CC1CCCC(=O)C1CCO Amb25373047 [0,0,0,1,0,0|2,0,1]=4 585 B11R1.605 CC1CCCC(C)N1CC=C Amb25295987 [0,0,0,1,0,0|2,0,1]=4 586 B11R1.605 CC1CCCC(N)C1CC=C Amb25780037 [0,0,0,1,0,0|2,0,1]=4 587 B11R1.605 CC1CCCC(O)C1CC=C Amb25211686 [0,0,0,1,0,0|1,0,2]=4 588 B11R1.605 CC=1CCCC(=O)C1CC=O Amb25318996 [0,0,0,1,0,0|2,0,1]=4 589 B11R1.605 C[C@@H]1CCCC(=O)C1CC=C Amb25102991 [0,0,0,1,0,0|1,0,0]=2 590 B11R1.605 C[C@@H]1CCCC(=O)[C@@H]1CC=C Amb25298442 [0,0,0,1,0,0|1,0,0]=2 591 B11R1.605 C[C@@H]1CCC[C@@H](N)[C@H]1CC=C Amb24738527 [0,0,0,1,0,0|2,0,1]=4 592 B11R1.605 C[C@@H]1CCC[C@H](C)N1CC=C Amb24485214 [0,0,0,1,0,0|2,0,1]=4 593 B11R1.841 CCCCC1C(C=C)NC1=O Amb24766496 [0,0,0,1,0,0|1,0,0]=2 594 B11R1.900 C=CCCC1(N)CCCCC1 Amb24486559 [0,0,0,1,0,0|2,0,1]=4 595 B11R1.900 CC1(CCCCC1)NCC=C Amb18295650 [0,0,0,1,0,0|2,0,1]=4 596 B11R1.900 CC1(CNCCC1)OCC=C Amb25090596 [0,0,0,1,0,0|2,0,1]=4 597 B11R1.956 CC1CCCC(O)C(C=C)O1 Amb25266688 [0,0,0,1,0,0|2,0,1]=4 598 B11R1.956 C[C@@H]1CCC[C@@H](O)[C@H](C=C)O1 Amb25355373 [0,0,0,1,0,0|2,0,1]=4 599 B11R1.1133 CC1(CCCC1Br)OCC=C Amb24418425 [0,0,0,1,0,0|2,0,1]=4 600 B8R0.1 BrCCC(=O)NCC=C Amb17323623 [2,0,0,0,0,0|2,0,0]=4 601 B8R0.1 C=CCC(=N)CCCCl Amb25145680 [2,0,0,0,0,0|2,0,0]=4 602 B8R0.1 C=CCC(=O)CCCCl Amb25138063 [2,0,0,0,0,0|1,0,0]=3 603 B8R0.1 C=CCC(=O)CCCO Amb24633875 [2,0,0,0,0,0|1,0,0]=3 604 B8R0.1 C=CCC(=O)NCCN Amb18313529 [2,0,0,0,0,0|2,0,0]=4 605 B8R0.1 C=CCC(=O)NCCO Amb24435431 [2,0,0,0,0,0|2,0,0]=4 606 B8R0.1 C=CCCC(=O)CCN Amb24763288 [2,0,0,0,0,0|2,0,0]=4 607 B8R0.1 C=CCNC(=O)CCN Amb21958210 [2,0,0,0,0,0|2,0,0]=4 608 B8R0.1 C=CCOC(=O)CC#N Amb1151261 [2,0,0,0,0,0|1,0,1]=4 609 B8R0.1 C=CCOC(=O)CC=C Amb22345945 [2,0,0,0,0,0|0,0,2]=4 610 B8R0.1 C=CCOC(=O)CCBr Amb25227535 [2,0,0,0,0,0|1,0,0]=3 611 B8R0.1 C=CCOC(=O)CCN Amb25146139 [2,0,0,0,0,0|1,0,0]=3 612 B8R0.1 C=CCOC(=O)NCO Amb24540438 [2,0,0,0,0,0|2,0,0]=4 613 B8R0.1 C=CCOS(=O)CCBr Amb25090308 [2,0,0,0,0,0|2,0,0]=4 614 B8R0.1 C=COC(=O)CCCBr Amb24576258 [2,0,0,0,0,0|1,0,0]=3 615 B8R0.1 C=COC(=O)CCCCl Amb25113897 [2,0,0,0,0,0|1,0,0]=3 616 B8R0.1 C=COC(=O)NCCO Amb25328650 [2,0,0,0,0,0|2,0,0]=4 617 B8R0.1 CC#CCC(=O)CC=C Amb24446657 [2,0,0,0,0,0|0,0,2]=4 618 B8R0.1 CCCC(=O)CCC=O Amb18642627 [2,0,0,0,0,0|2,0,0]=4 619 B8R0.1 CCCC(=O)NCC=O Amb17102055 [2,0,0,0,0,0|2,0,0]=4 620 B8R0.1 CCCC(=O)OCCBr Amb25087679 [2,0,0,0,0,0|1,0,1]=4 621 B8R0.1 CCCC(=O)\C=C\C=C Amb25233730 [2,0,0,0,0,0|1,0,1]=4 622 B8R0.1 CCCCC(=N)OCC Amb20673140 [2,0,0,0,0,0|1,0,1]=4 623 B8R0.1 CCCCC(=O)CC=C Amb10567269 [2,0,0,0,0,0|0,0,0]=2 624 B8R0.1 CCCCC(=O)CCCl Amb25705250 [2,0,0,0,0,0|1,0,1]=4 625 B8R0.1 CCCCC(=O)CNC Amb25824276 [2,0,0,0,0,0|1,0,1]=4 626 B8R0.1 CCCCC(=O)COC Amb19374627 [2,0,0,0,0,0|1,0,1]=4 627 B8R0.1 CCCCC(=O)NC=C Amb24359898 [2,0,0,0,0,0|1,0,0]=3 628 B8R0.1 CCCCC(=O)NCC Amb17787354 [2,0,0,0,0,0|1,0,1]=4 629 B8R0.1 CCCCC(=O)OC=C Amb17934207 [2,0,0,0,0,0|0,0,0]=2 630 B8R0.1 CCCCC(=O)\C=C\Cl Amb24650002 [2,0,0,0,0,0|1,0,1]=4 631 B8R0.1 CCCCC(=O)\C=C\S Amb24695018 [2,0,0,0,0,0|1,0,1]=4 632 B8R0.1 CCCCC(Br)CC=C Amb25065733 [2,0,0,0,0,0|1,0,1]=4 633 B8R0.1 CCCCC(N)CC=C Amb25082468 [2,0,0,0,0,0|1,0,1]=4 634 B8R0.1 CCCCC(O)CC=C Amb22052681 [2,0,0,0,0,0|0,0,2]=4 635 B8R0.1 CCCCN(C)CC=C Amb25097532 [2,0,0,0,0,0|2,0,0]=4 636 B8R0.1 CCCC[C@@H](N)CC=C Amb25118429 [2,0,0,0,0,0|1,0,1]=4 637 B8R0.1 CCCC[C@@H](O)CC=C Amb25698967 [2,0,0,0,0,0|0,0,2]=4 638 B8R0.1 CCCC[C@H](N)CC=C Amb24524170 [2,0,0,0,0,0|1,0,1]=4 639 B8R0.1 CCCNC(=O)NC=C Amb25836812 [2,0,0,0,0,0|2,0,0]=4 640 B8R0.1 CCCNC(=O)OCC Amb17787091 [2,0,0,0,0,0|1,0,1]=4 641 B8R0.1 CCCOC(=O)CC=O Amb24683609 [2,0,0,0,0,0|2,0,0]=4 642 B8R0.1 CCCOC(=O)OCCl Amb22054704 [2,0,0,0,0,0|2,0,0]=4 643 B8R0.1 CCCOC(=O)OCI Amb25316012 [2,0,0,0,0,0|2,0,0]=4 644 B8R0.1 CCC\C(\Br)=C\CC=C Amb24572866 [2,0,0,0,0,0|2,0,0]=4 645 B8R0.1 CCNC(=O)CCC=C Amb25662084 [2,0,0,0,0,0|2,0,0]=4 646 B8R0.1 CCNC(=O)OCC=C Amb25859064 [2,0,0,0,0,0|1,0,0]=3 647 B8R0.1 CCOC(=O)CCC=C Amb10601809 [2,0,0,0,0,0|2,0,0]=4 648 B8R0.1 CCOC(=O)CCCF Amb24649863 [2,0,0,0,0,0|1,0,1]=4 649 B8R0.1 CCOC(=O)CCCI Amb21520420 [2,0,0,0,0,0|1,0,1]=4 650 B8R0.1 CCOC(=O)CCCO Amb22733346 [2,0,0,0,0,0|1,0,1]=4 651 B8R0.1 CCOC(=O)NCC=C Amb17792413 [2,0,0,0,0,0|2,0,0]=4 652 B8R0.1 CCOC(=O)OCC=C Amb22230384 [2,0,0,0,0,0|1,0,0]=3 653 B8R0.1 CCOCC(=C)CC=C Amb24589449 [2,0,0,0,0,0|2,0,0]=4 654 B8R0.1 CCSC(=O)NCC=C Amb25146011 [2,0,0,0,0,0|2,0,0]=4 655 B8R0.1 CC\C=C\C(=O)CC=C Amb24637489 [2,0,0,0,0,0|0,0,2]=4 656 B8R0.1 CNCC(=O)CCC=C Amb25703229 [2,0,0,0,0,0|2,0,0]=4 657 B8R0.1 CNCC(=O)NCC=C Amb21958206 [2,0,0,0,0,0|2,0,0]=4 658 B8R0.1 CNCC(=O)OCC=C Amb18642698 [2,0,0,0,0,0|1,0,0]=3 659 B8R0.1 COCC(=O)CCC=C Amb25341961 [2,0,0,0,0,0|2,0,0]=4 660 B8R0.1 COCC(=O)NCC=C Amb23247500 [2,0,0,0,0,0|2,0,0]=4 661 B8R0.1 COCOC(=O)CCC Amb24333372 [2,0,0,0,0,0|1,0,1]=4 662 B8R0.1 CSCC(=O)OCC=C Amb25662265 [2,0,0,0,0,0|1,0,0]=3 663 B8R0.1 C\C=C\C(=O)CCCC Amb22043314 [2,0,0,0,0,0|0,0,2]=4 664 B8R0.1 C\C=C\CC(=O)CC=C Amb24625824 [2,0,0,0,0,0|0,0,2]=4 665 B8R0.1 ClCCCC(=O)OCC Amb1153203 [2,0,0,0,0,0|1,0,1]=4 666 B8R0.1 OCCC(=O)NCC=C Amb17334106 [2,0,0,0,0,0|2,0,0]=4 667 B8R0.1 [C-]#[N+]CC(=O)OCC=C Amb24505032 [2,0,0,0,0,0|1,0,1]=4 668 B8R0.4 C=CCCCCCCN Amb24624098 [2,0,0,0,0,0|1,0,1]=4 669 B8R0.4 C=CCCCCCCO Amb22230162 [2,0,0,0,0,0|1,0,1]=4 670 B8R0.4 C=CCNCCCCBr Amb24585821 [2,0,0,0,0,0|2,0,0]=4 671 B8R0.4 C=CCONCCCF Amb24557505 [2,0,0,0,0,0|2,0,0]=4 672 B8R0.4 C=CCSCCCCO Amb25115168 [2,0,0,0,0,0|1,1,0]=4 673 B8R0.4 C=CCSCCCCS Amb24502217 [2,0,0,0,0,0|1,1,0]=4 674 B8R0.4 C=CC\C=C\CCCBr Amb25241221 [2,0,0,0,0,0|1,0,1]=4 675 B8R0.4 C=CC\C=C\CCCCl Amb24584660 [2,0,0,0,0,0|1,0,1]=4 676 B8R0.4 C=CC\C=C\CCCO Amb25845279 [2,0,0,0,0,0|1,0,1]=4 677 B8R0.4 C=COCCCCCO Amb24420140 [2,0,0,0,0,0|1,0,1]=4 678 B8R0.4 C=C\C=C\CCCCBr Amb24693997 [2,0,0,0,0,0|1,0,1]=4 679 B8R0.4 C=C\C=C\CCCCCl Amb25107305 [2,0,0,0,0,0|1,0,1]=4 680 B8R0.4 C=C\C=C\CCCCN Amb18642357 [2,0,0,0,0,0|1,0,1]=4 681 B8R0.4 CCCC/C=C/OCC Amb17674075 [2,0,0,0,0,0|0,0,2]=4 682 B8R0.4 CCCCC#CCC=C Amb22228000 [2,0,0,0,0,0|0,0,2]=4 683 B8R0.4 CCCCC/C=C/CBr Amb17666913 [2,0,0,0,0,0|2,0,0]=4 684 B8R0.4 CCCCCC#CC=C Amb17940382 [2,0,0,0,0,0|0,0,2]=4 685 B8R0.4 CCCCCCOC=C Amb24440550 [2,0,0,0,0,0|0,0,1]=3 686 B8R0.4 CCCCCCOCC Amb17672946 [2,0,0,0,0,0|0,0,2]=4 687 B8R0.4 CCCCCOCC=C Amb22230169 [2,0,0,0,0,0|0,0,0]=2 688 B8R0.4 CCCCCOCCO Amb22264988 [2,0,0,0,0,0|1,0,1]=4 689 B8R0.4 CCCCCSCC=O Amb25113339 [2,0,0,0,0,0|1,1,0]=4 690 B8R0.4 CCCCC\C=C/C=O Amb24419726 [2,0,0,0,0,0|1,0,1]=4 691 B8R0.4 CCCCC\C=C/CC Amb22730456 [2,0,0,0,0,0|1,0,1]=4 692 B8R0.4 CCCCC\C=C\C=C Amb22641683 [2,0,0,0,0,0|0,0,1]=3 693 B8R0.4 CCCCC\C=C\CCl Amb24597697 [2,0,0,0,0,0|2,0,0]=4 694 B8R0.4 CCCCC\C=C\CN Amb18642556 [2,0,0,0,0,0|2,0,0]=4 695 B8R0.4 CCCCNCCC=C Amb25227693 [2,0,0,0,0,0|1,0,1]=4 696 B8R0.4 CCCC\C=C\CC=O Amb18642464 [2,0,0,0,0,0|1,0,1]=4 697 B8R0.4 CCCNCCCC=C Amb24415921 [2,0,0,0,0,0|1,0,1]=4 698 B8R0.4 CCCOCCOC=C Amb25032267 [2,0,0,0,0,0|1,0,1]=4 699 B8R0.4 CCNCCOCC=C Amb25237110 [2,0,0,0,0,0|1,0,0]=3 700 B8R0.4 CCNCCSCC=C Amb24619294 [2,0,0,0,0,0|1,1,0]=4 701 B8R0.4 CCOCCOCC=O Amb24052109 [2,0,0,0,0,0|2,0,0]=4 702 B8R0.4 CCSCCNCC=C Amb25690607 [2,0,0,0,0,0|2,0,0]=4 703 B8R0.4 CCSCCSCC=C Amb25318354 [2,0,0,0,0,0|1,1,0]=4 704 B8R0.4 CC\C=C/CCCCC Amb25258581 [2,0,0,0,0,0|1,0,1]=4 705 B8R0.4 CC\C=C\CCCCC Amb22347893 [2,0,0,0,0,0|1,0,1]=4 706 B8R0.4 CNCCCCCC=C Amb19335339 [2,0,0,0,0,0|1,0,1]=4 707 B8R0.4 COCCCNCC=C Amb17231858 [2,0,0,0,0,0|2,0,0]=4 708 B8R0.4 COCCCSCC=C Amb25845823 [2,0,0,0,0,0|1,1,0]=4 709 B8R0.4 NCCCCNCC=C Amb17334102 [2,0,0,0,0,0|2,0,0]=4 710 B8R0.4 NCCCCSCC=C Amb17500942 [2,0,0,0,0,0|1,1,0]=4 711 B8R0.4 OCCCCNCC=C Amb17334109 [2,0,0,0,0,0|2,0,0]=4 712 B8R0.6 BrCCCCC(=O)NC Amb17235862 [2,0,0,0,0,0|2,0,0]=4 713 B8R0.6 C=CC(=C)CCCCO Amb25281427 [2,0,0,0,0,0|2,0,0]=4 714 B8R0.6 C=CC(=O)CCCCBr Amb24480228 [2,0,0,0,0,0|1,0,0]=3 715 B8R0.6 C=CC(=O)CCCCCl Amb25711018 [2,0,0,0,0,0|1,0,0]=3 716 B8R0.6 C=CC(=O)CCCCF Amb25743214 [2,0,0,0,0,0|1,0,0]=3 717 B8R0.6 C=CC(=O)NCCCCl Amb25836279 [2,0,0,0,0,0|2,0,0]=4 718 B8R0.6 C=CC(=O)NCCCN Amb18305779 [2,0,0,0,0,0|2,0,0]=4 719 B8R0.6 C=CC(=O)OCCCF Amb22008270 [2,0,0,0,0,0|2,0,0]=4 720 B8R0.6 C=CC(=O)OCCCN Amb24120374 [2,0,0,0,0,0|2,0,0]=4 721 B8R0.6 C=CC(=O)OCCCO Amb22167329 [2,0,0,0,0,0|2,0,0]=4 722 B8R0.6 CCC(=O)CCCCF Amb25842980 [2,0,0,0,0,0|1,0,1]=4 723 B8R0.6 CCC(=O)CCCCN Amb25757344 [2,0,0,0,0,0|1,0,1]=4 724 B8R0.6 CCC(=O)CCCNC Amb24411172 [2,0,0,0,0,0|1,0,1]=4 725 B8R0.6 CCC(=O)CCCSC Amb24433713 [2,0,0,0,0,0|1,0,1]=4 726 B8R0.6 CCCC=CC(=O)OC Amb24093828 [2,0,0,0,0,0|0,0,2]=4 727 B8R0.6 CCCCCC(=C)C=O Amb18642442 [2,0,0,0,0,0|2,0,0]=4 728 B8R0.6 CCCCCC(=C)CCl Amb24703635 [2,0,0,0,0,0|2,0,0]=4 729 B8R0.6 CCCCCC(=C)CO Amb24556289 [2,0,0,0,0,0|2,0,0]=4 730 B8R0.6 CCCCCC(=O)C#N Amb25767785 [2,0,0,0,0,0|1,0,1]=4 731 B8R0.6 CCCCCC(=O)C=C Amb20671146 [2,0,0,0,0,0|0,0,0]=2 732 B8R0.6 CCCCCC(=O)C=O Amb18642604 [2,0,0,0,0,0|1,0,0]=3 733 B8R0.6 CCCCCC(=O)CBr Amb22276985 [2,0,0,0,0,0|1,0,0]=3 734 B8R0.6 CCCCCC(=O)CCl Amb17593704 [2,0,0,0,0,0|1,0,0]=3 735 B8R0.6 CCCCCC(=O)CI Amb22276984 [2,0,0,0,0,0|1,0,0]=3 736 B8R0.6 CCCCCC(=O)CN Amb18642725 [2,0,0,0,0,0|1,0,0]=3 737 B8R0.6 CCCCCC(=O)NC Amb24106949 [2,0,0,0,0,0|1,0,0]=3 738 B8R0.6 CCCCCC(=O)SC Amb22168308 [2,0,0,0,0,0|0,1,0]=3 739 B8R0.6 CCCCCC(Br)C=C Amb17666912 [2,0,0,0,0,0|1,0,1]=4 740 B8R0.6 CCCCCC(Cl)=CCl Amb25124050 [2,0,0,0,0,0|2,0,0]=4 741 B8R0.6 CCCCCC(Cl)C=C Amb24340311 [2,0,0,0,0,0|1,0,1]=4 742 B8R0.6 CCCCCC(Cl)OC Amb24340104 [2,0,0,0,0,0|1,0,1]=4 743 B8R0.6 CCCCCC(F)=CBr Amb24552014 [2,0,0,0,0,0|2,0,0]=4 744 B8R0.6 CCCCCC(F)=CCl Amb24557827 [2,0,0,0,0,0|2,0,0]=4 745 B8R0.6 CCCCCC(N)C=C Amb18642554 [2,0,0,0,0,0|1,0,1]=4 746 B8R0.6 CCCCCC(O)OC Amb25796374 [2,0,0,0,0,0|0,0,2]=4 747 B8R0.6 CCCCCN(C)OC Amb25295871 [2,0,0,0,0,0|2,0,0]=4 748 B8R0.6 CCCCNC(=N)OC Amb25691671 [2,0,0,0,0,0|2,0,0]=4 749 B8R0.6 CCCCNC(=O)CBr Amb17327510 [2,0,0,0,0,0|2,0,0]=4 750 B8R0.6 CCCCNC(=O)CCl Amb1204239 [2,0,0,0,0,0|2,0,0]=4 751 B8R0.6 CCCCNC(=O)CF Amb24585704 [2,0,0,0,0,0|2,0,0]=4 752 B8R0.6 CCCCNC(=O)CI Amb23447330 [2,0,0,0,0,0|2,0,0]=4 753 B8R0.6 CCCCNC(=O)CN Amb21958688 [2,0,0,0,0,0|2,0,0]=4 754 B8R0.6 CCCCNC(=O)NC Amb1060752 [2,0,0,0,0,0|2,0,0]=4 755 B8R0.6 CCCCNC(=S)OC Amb25757454 [2,0,0,0,0,0|1,1,0]=4 756 B8R0.6 CCCCOC(=O)C=C Amb22351622 [2,0,0,0,0,0|1,0,0]=3 757 B8R0.6 CCCCOC(=O)CBr Amb10601879 [2,0,0,0,0,0|2,0,0]=4 758 B8R0.6 CCCCOC(=O)CF Amb10838878 [2,0,0,0,0,0|2,0,0]=4 759 B8R0.6 CCCCOC(=O)CN Amb19373374 [2,0,0,0,0,0|2,0,0]=4 760 B8R0.6 CCCCOC(=O)C[NH3+] Amb22733556 [2,0,0,0,0,0|2,0,0]=4 761 B8R0.6 CCCCOC(=O)NC Amb24680085 [2,0,0,0,0,0|2,0,0]=4 762 B8R0.6 CCCNCC(=O)C=C Amb25215155 [2,0,0,0,0,0|1,0,0]=3 763 B8R0.6 CCCNCC(=O)CC Amb24715612 [2,0,0,0,0,0|1,0,1]=4 764 B8R0.6 CCCOCC(=O)C=C Amb24360271 [2,0,0,0,0,0|1,0,0]=3 765 B8R0.6 CCCOCC(=O)CO Amb24416729 [2,0,0,0,0,0|2,0,0]=4 766 B8R0.6 CCCONC(=O)C=C Amb25101856 [2,0,0,0,0,0|2,0,0]=4 767 B8R0.6 CCNCCC(=O)C=C Amb24550936 [2,0,0,0,0,0|1,0,0]=3 768 B8R0.6 CCOCCC(=O)CO Amb24478622 [2,0,0,0,0,0|2,0,0]=4 769 B8R0.6 CCOCCC(=O)NC Amb25302984 [2,0,0,0,0,0|2,0,0]=4 770 B8R0.6 CC\C=C\CC(=O)C=C Amb24574125 [2,0,0,0,0,0|0,0,2]=4 771 B8R0.6 CNC(=O)CCCSC Amb18411875 [2,0,0,0,0,0|2,0,0]=4 772 B8R0.6 CNCCCC(=O)NC Amb18303609 [2,0,0,0,0,0|2,0,0]=4 773 B8R0.6 CNCCCC(=O)NC Amb22098814 [2,0,0,0,0,0|2,0,0]=4 774 B8R0.6 CNCCNC(=O)C=C Amb19027445 [2,0,0,0,0,0|2,0,0]=4 775 B8R0.6 CNCCNC(=O)OC Amb19027453 [2,0,0,0,0,0|2,0,0]=4 776 B8R0.6 COC(=N)CCCCCl Amb25300747 [2,0,0,0,0,0|2,0,0]=4 777 B8R0.6 COC(=N)COCCC Amb25783562 [2,0,0,0,0,0|2,0,0]=4 778 B8R0.6 COC(=O)CCCC=C Amb22730759 [2,0,0,0,0,0|0,0,2]=4 779 B8R0.6 COC(=O)CCCCN Amb18642844 [2,0,0,0,0,0|1,0,0]=3 780 B8R0.6 COC(=O)CCCCO Amb22641583 [2,0,0,0,0,0|1,0,0]=3 781 B8R0.6 COC(=O)CCCON Amb25266351 [2,0,0,0,0,0|2,0,0]=4 782 B8R0.6 COC(=O)CCCSC Amb19878350 [2,0,0,0,0,0|1,0,0]=3 783 B8R0.6 COC(=O)CCC[Zn]Br Amb22898091 [2,0,0,0,0,0|2,0,0]=4 784 B8R0.6 COC(=O)CNOCC Amb24739353 [2,0,0,0,0,0|2,0,0]=4 785 B8R0.6 COC(=O)COCCN Amb24401799 [2,0,0,0,0,0|2,0,0]=4 786 B8R0.6 COC(=O)COCCO Amb24113538 [2,0,0,0,0,0|2,0,0]=4 787 B8R0.6 COC(=O)CSCCBr Amb25662052 [2,0,0,0,0,0|2,0,0]=4 788 B8R0.6 COC(=O)CSCCCl Amb24340126 [2,0,0,0,0,0|2,0,0]=4 789 B8R0.6 COC(=O)CSCCF Amb25821146 [2,0,0,0,0,0|2,0,0]=4 790 B8R0.6 COC(=O)CSCCN Amb19268671 [2,0,0,0,0,0|2,0,0]=4 791 B8R0.6 COC(=O)NCCSC Amb24379130 [2,0,0,0,0,0|2,0,0]=4 792 B8R0.6 COC(=O)NCOCC Amb24606808 [2,0,0,0,0,0|2,0,0]=4 793 B8R0.6 COC(=O)NOCCC Amb24381046 [2,0,0,0,0,0|2,0,0]=4 794 B8R0.6 COC(=O)OCCCBr Amb25361096 [2,0,0,0,0,0|2,0,0]=4 795 B8R0.6 COC(=O)OCCCF Amb24088642 [2,0,0,0,0,0|2,0,0]=4 796 B8R0.6 COC(=S)CCCCCl Amb25145676 [2,0,0,0,0,0|1,1,0]=4 797 B8R0.6 COCCCC(=N)OC Amb25127148 [2,0,0,0,0,0|2,0,0]=4 798 B8R0.6 COCCCC(=O)C=C Amb24479926 [2,0,0,0,0,0|1,0,0]=3 799 B8R0.6 CSCCOC(=O)C=C Amb17940077 [2,0,0,0,0,0|2,0,0]=4 800 B8R0.6 CSCSCC(=O)OC Amb25162165 [2,0,0,0,0,0|2,0,0]=4 801 B8R0.6 C[ClH]C(=O)CCCCBr Amb25242949 [2,0,0,0,0,0|2,0,0]=4 802 B8R0.6 C\C=C\CCC(=O)C=C Amb25179659 [2,0,0,0,0,0|0,0,2]=4 803 B8R0.6 NCCCCC(=O)OC Amb13951283 [2,0,0,0,0,0|1,0,0]=3 804 B8R0.6 O=C(CBr)CCCCCl Amb25339355 [2,0,0,0,0,0|2,0,0]=4 805 B8R0.6 OCCCCC(=O)NC Amb17231874 [2,0,0,0,0,0|2,0,0]=4 806 B10R0.1 CCCCCNC(=O)CC#N Amb1225537 [1,1,0,0,0,0|1,0,1]=4 807 B10R0.1 CCCCCNC(=O)CCO Amb17334465 [1,1,0,0,0,0|1,0,1]=4 808 B10R0.1 CCCCCNC(=O)COC Amb23247528 [1,1,0,0,0,0|1,0,1]=4 809 B10R0.1 CCNC(=O)CCNCCC Amb18797397 [1,1,0,0,0,0|1,0,1]=4 810 B10R0.1 CCOC(=O)CCCCC=O Amb22230667 [1,1,0,0,0,0|0,0,2]=4 811 B10R0.1 CCOC(=O)CCCOCC Amb22336385 [1,1,0,0,0,0|0,0,1]=3 812 B10R0.1 CCOC(=O)CCNCCN Amb18792258 [1,1,0,0,0,0|1,0,1]=4 813 B10R0.1 CCOC(=O)CCSCCN Amb18178450 [1,1,0,0,0,0|1,0,1]=4 814 B10R0.1 NCCCCCC(=O)OCC Amb10553125 [1,1,0,0,0,0|0,0,1]=3 815 B10R0.2 CC(CC(=O)OCC)SCC Amb18804594 [1,1,0,0,0,0|1,0,1]=4 816 B10R0.2 CCCC(CC(=O)OCC)N Amb10607611 [1,1,0,0,0,0|0,0,1]=3 817 B10R0.2 CCCC(CC(=O)OCC)O Amb10807459 [1,1,0,0,0,0|0,0,1]=3 818 B10R0.2 CCCC(N)CC(=O)OCC Amb22586906 [1,1,0,0,0,0|0,0,1]=3 819 B10R0.2 CCOC(=O)C[C@@H](O)CCN Amb23401359 [1,1,0,0,0,0|1,0,1]=4 820 B10R0.3 CCOC(=O)CCNC(C)C Amb19887847 [1,1,0,0,0,0|1,0,1]=4 821 B10R0.6 CC(=O)NC(=O)CCCCC Amb25383542 [1,1,0,0,0,0|1,0,1]=4 822 B10R0.6 CCCCCC(=O)CC(=O)C Amb10807435 [1,1,0,0,0,0|0,0,1]=3 823 B10R0.6 CCCCCC(=O)CC(C)C Amb18182142 [1,1,0,0,0,0|0,0,2]=4 824 B10R0.6 CCCCCC(=O)NC(N)=N Amb25386165 [1,1,0,0,0,0|2,0,0]=4 825 B10R0.6 CCCCCC(=O)NC(N)=O Amb24755476 [1,1,0,0,0,0|2,0,0]=4 826 B10R0.6 CCCCCC(=O)OC(C)C Amb22730708 [1,1,0,0,0,0|0,0,1]=3 827 B10R0.6 CCCCNC(=O)CC(N)=N Amb22913275 [1,1,0,0,0,0|2,0,0]=4 828 B10R0.6 CCCCNC(=O)OC(C)C Amb10569748 [1,1,0,0,0,0|1,0,1]=4 829 B10R0.6 CCCCOC(=O)CC(=O)C Amb2412117 [1,1,0,0,0,0|1,0,1]=4 830 B10R0.6 CCCOCC(=O)OC(C)C Amb15692603 [1,1,0,0,0,0|1,0,1]=4 831 B10R0.19 CCCCC(=O)C(=O)OCC Amb10603615 [1,1,0,0,0,0|0,0,2]=4 832 B10R0.19 CCCCC(N)C(=O)NCC Amb18179826 [1,1,0,0,0,0|1,0,1]=4 833 B10R0.19 CCOC(=O)C(Br)CCCBr Amb22234280 [1,1,0,0,0,0|1,0,1]=4 834 B10R0.19 CCOC(=O)C(O)CCSC Amb18186249 [1,1,0,0,0,0|1,0,1]=4 835 B10R0.19 CCOC(=O)[C@@H](N)CCCN Amb22745899 [1,1,0,0,0,0|1,0,1]=4 836 B10R0.19 NCCC[C@@H](C(=O)OCC)N Amb16234080 [1,1,0,0,0,0|1,0,1]=4 837 B10R0.108 CCC(C)COC(=O)NC=C Amb25384759 [1,1,0,0,0,0|2,0,0]=4 838 B10R0.156 NCCCCS(=O)(=O)CC=C Amb17501043 [1,1,0,0,0,0|2,0,0]=4 839 B10R0.18 C=CCNC(=O)NC(CC)C Amb2178685 [1,1,0,0,0,0|2,0,0]=4 840 B10R0.78 C=CCNC(=O)NCC(C)C Amb16948217 [1,1,0,0,0,0|2,0,0]=4 841 B10R0.78 CC(=C)CNC(=O)NCCC Amb24755294 [1,1,0,0,0,0|2,0,0]=4 842 B10R0.78 CC(C)NCC(=O)NCC=C Amb18799696 [1,1,0,0,0,0|2,0,0]=4 843 B10R0.78 CCCCC(=O)OCC(C)C Amb22230766 [1,1,0,0,0,0|0,0,2]=4 844 B10R0.78 C[C@@H](O)CNC(=O)NCC=C Amb24751123 [1,1,0,0,0,0|2,0,0]=4 845 B10R0.4 CCCCCCNCC(=C)C Amb17308745 [1,1,0,0,0,0|1,0,1]=4 846 B10R0.4 CCCCC\C=C\CC(=O)O Amb17593915 [1,1,0,0,0,0|2,0,0]=4 847 B10R0.71 C=CCCCCCCCCCl Amb22898754 [1,1,0,0,0,0|1,0,1]=4 848 B10R0.71 CCCCCC=CC=CC=O Amb24056155 [1,1,0,0,0,0|1,0,1]=4 849 B10R0.71 CCCCC\C=C/C=CC=C Amb22336558 [1,1,0,0,0,0|1,0,1]=4 850 B10R0.71 CCCCC\C=C\C=C/C=C Amb22546765 [1,1,0,0,0,0|1,0,1]=4 851 B10R0.71 CCCCC\C=C\C=C\C=C Amb22730166 [1,1,0,0,0,0|1,0,1]=4 852 B10R0.71 CCCCC\C=C\CCC=O Amb10071527 [1,1,0,0,0,0|1,0,1]=4 853 B10R0.71 CCOCCOCOCC=C Amb24090134 [1,1,0,0,0,0|1,0,1]=4 854 B10R0.71 C\C=C/C\C=C/CCCCC Amb22546768 [1,1,0,0,0,0|1,0,0]=3 855 B10R0.74 CCCCCC#CC(Br)C=C Amb25385947 [1,1,0,0,0,0|1,0,1]=4 856 B10R0.74 CCCCCC#CC(O)C=C Amb25386072 [1,1,0,0,0,0|1,0,1]=4 857 B10R0.74 CCCCCCCC(O)C=C Amb22168278 [1,1,0,0,0,0|1,0,1]=4 858 B10R0.74 CCCCC\C=C/C(C)C=C Amb22546637 [1,1,0,0,0,0|1,0,0]=3 859 B12R0.353 CSCC[C@H](N)C(=O)N(C)CC=C Amb24769170 [0,2,0,0,0,0|2,0,0]=4 860 B12R0.98 CCCCN(C)C(=O)NCC(Br)=C Amb17925169 [0,2,0,0,0,0|2,0,0]=4 861 B12R0.142 CCCCCC(=O)OCC(C)CC Amb24061295 [0,2,0,0,0,0|0,0,2]=4 862 B12R0.255 CC(=C)COC(=O)CCCCCC Amb22641514 [0,2,0,0,0,0|0,0,0]=2 863 B12R0.255 CCCCCCC(=O)OCC(=C)F Amb22641507 [0,2,0,0,0,0|0,0,0]=2 864 B12R0.255 CCCCCCC(=O)OCC(C)C Amb22735168 [0,2,0,0,0,0|0,0,2]=4 865 B12R0.255 CCCCCNC(=O)CCC(=O)Cl Amb17143340 [0,2,0,0,0,0|2,0,0]=4 866 B12R0.255 CCCCCNC(=O)CCC(=O)N Amb17143033 [0,2,0,0,0,0|2,0,0]=4 867 B12R0.255 COCCCNC(=O)NCC(Br)=C Amb17924552 [0,2,0,0,0,0|2,0,0]=4 868 B12R0.255 CSCCCCC(=O)NCC(O)=O Amb24769713 [0,2,0,0,0,0|2,0,0]=4 869 B12R0.47 CCCCOC(=O)CCCCCO Amb22054598 [0,2,0,0,0,0|0,0,2]=4 870 B12R0.47 COCCCNC(=O)CNCC=C Amb18329214 [0,2,0,0,0,0|2,0,0]=4 871 B12R0.114 CCCCCOC(=O)C(O)CC=C Amb22168136 [0,2,0,0,0,0|1,0,0]=3 872 B12R0.206 C=CCOC(=O)NCCCCCN Amb22348047 [0,2,0,0,0,0|0,0,0]=2 873 B12R0.206 C=CCOC(=O)NCCCCCO Amb22348076 [0,2,0,0,0,0|0,0,0]=2 874 B12R0.206 CCCCCCCC(=O)OCC=C Amb22338623 [0,2,0,0,0,0|0,0,0]=2 875 B12R0.206 COCCCNCC(=O)NCC=C Amb20219327 [0,2,0,0,0,0|1,0,0]=3 876 B12R0.233 CC(C)=CCOC(=O)CCCCC Amb22735098 [0,2,0,0,0,0|0,0,0]=2 877 B12R0.233 CCCCNC(=O)COCC(=O)O Amb1888825 [0,2,0,0,0,0|2,0,0]=4 878 B12R0.104 CC(C)(C)CSCC(=O)NCC=C Amb24271322 [0,2,0,0,0,0|2,0,0]=4 879 B12R0.318 CCCCCC(=O)OC(C)(N)CC Amb22274264 [0,2,0,0,0,0|0,0,2]=4 880 B10R1.10 C=CCC=1CCCC(Cl)C1 Amb24716747 [1,0,0,1,0,0|2,0,0]=4 881 B10R1.10 C=CCC=1CCCC(O)C1 Amb25285011 [1,0,0,1,0,0|2,0,0]=4 882 B10R1.10 CC1CC(CCC1)CC=C Amb24553146 [1,0,0,1,0,0|1,0,1]=4 883 B10R1.10 CCCC1C=CCC(=O)N1 Amb25799491 [1,0,0,1,0,0|1,0,0]=3 884 B10R1.10 CCCC1CC(=O)C=CO1 Amb25297506 [1,0,0,1,0,0|1,0,1]=4 885 B10R1.10 CCCC1CC(=O)CCC1 Amb22754799 [1,0,0,1,0,0|0,0,2]=4 886 B10R1.10 CCCC1CC(=O)CCN1 Amb18643754 [1,0,0,1,0,0|1,0,1]=4 887 B10R1.10 CCCC1CC(=O)CCN1 Amb22235732 [1,0,0,1,0,0|1,0,1]=4 888 B10R1.10 CCCC1CC(=O)CCO1 Amb24661952 [1,0,0,1,0,0|1,0,1]=4 889 B10R1.10 CCCC1CC(=O)CCS1 Amb25759710 [1,0,0,1,0,0|1,0,1]=4 890 B10R1.10 CCCC1CC=CC(=O)C1 Amb25723335 [1,0,0,1,0,0|0,0,2]=4 891 B10R1.10 CCC[C@@H]1CC(=O)CCN1 Amb24641836 [1,0,0,1,0,0|1,0,1]=4 892 B10R1.10 CCC[C@H]1CC(=O)C=CO1 Amb25086215 [1,0,0,1,0,0|1,0,1]=4 893 B10R1.10 CCC[C@H]1CC(=O)CCC1 Amb25145507 [1,0,0,1,0,0|0,0,2]=4 894 B10R1.11 C#CCC(=O)C1CCCC1 Amb24478108 [1,0,0,1,0,0|0,0,2]=4 895 B10R1.11 C=C=CC(=O)C1CCCC1 Amb25358947 [1,0,0,1,0,0|0,0,2]=4 896 B10R1.11 C=CCC(=O)C1CCCC1 Amb24413241 [1,0,0,1,0,0|0,0,0]=2 897 B10R1.11 C=CCC(=O)C1CCCN1 Amb24671015 [1,0,0,1,0,0|1,0,0]=3 898 B10R1.11 C=CCC(=O)C1CCCS1 Amb24641068 [1,0,0,1,0,0|1,0,0]=3 899 B10R1.11 C=CCC(=O)C1CSCC1 Amb24403814 [1,0,0,1,0,0|1,0,0]=3 900 B10R1.11 C=CCC(=O)C=1CCCC1 Amb24449025 [1,0,0,1,0,0|0,0,2]=4 901 B10R1.11 C=CCC(N)C1CCCC1 Amb18977595 [1,0,0,1,0,0|1,0,1]=4 902 B10R1.11 C=CC[C@@H](O)C1CCCC1 Amb24748510 [1,0,0,1,0,0|0,0,2]=4 903 B10R1.11 C=CC[C@H](N)C1CCCC1 Amb25680078 [1,0,0,1,0,0|1,0,1]=4 904 B10R1.11 C=COC(=O)N1CCCC1 Amb24093467 [1,0,0,1,0,0|1,0,0]=3 905 B10R1.11 CCCC(=O)C1CCCC1 Amb24559741 [1,0,0,1,0,0|0,0,2]=4 906 B10R1.11 CCOC(=N)C1CCCC1 Amb24464432 [1,0,0,1,0,0|1,0,1]=4 907 B10R1.11 CCOC(=O)C1CCCC1 Amb21929348 [1,0,0,1,0,0|0,0,1]=3 908 B10R1.11 CCOC(=O)C1CCCS1 Amb24554669 [1,0,0,1,0,0|1,0,1]=4 909 B10R1.11 CCOC(=O)C1CCNC1 Amb17740007 [1,0,0,1,0,0|1,0,1]=4 910 B10R1.11 CCOC(=O)C1CNCC1 Amb13887211 [1,0,0,1,0,0|1,0,1]=4 911 B10R1.11 CCOC(=O)C1COCC1 Amb10844811 [1,0,0,1,0,0|1,0,1]=4 912 B10R1.11 CCOC(=O)C1CSCC1 Amb25761644 [1,0,0,1,0,0|1,0,1]=4 913 B10R1.11 CCOC(=O)N1CCCC1 Amb17846863 [1,0,0,1,0,0|1,0,1]=4 914 B10R1.11 CCOC(=O)[C@@H]1CCCN1 Amb15692005 [1,0,0,1,0,0|1,0,1]=4 915 B10R1.11 CCOC(=O)[C@@H]1CCCN1 Amb22746877 [1,0,0,1,0,0|1,0,1]=4 916 B10R1.11 CCOC(=O)[C@@H]1CNCC1 Amb20670973 [1,0,0,1,0,0|1,0,1]=4 917 B10R1.11 CCOC(=O)[C@@H]1CNCC1 Amb22737483 [1,0,0,1,0,0|1,0,1]=4 918 B10R1.11 CCOC(=O)[C@H]1CCCN1 Amb22230604 [1,0,0,1,0,0|1,0,1]=4 919 B10R1.11 CCOC(=O)[C@H]1CCCN1 Amb24428260 [1,0,0,1,0,0|1,0,1]=4 920 B10R1.11 CCOC(=O)[C@H]1CNCC1 Amb20670974 [1,0,0,1,0,0|1,0,1]=4 921 B10R1.11 CCOC(=O)[C@H]1CNCC1 Amb22737482 [1,0,0,1,0,0|1,0,1]=4 922 B10R1.11 COCC(=O)C1CCCC1 Amb22058980 [1,0,0,1,0,0|1,0,1]=4 923 B10R1.11 CSCC(=O)C1CCCC1 Amb18797417 [1,0,0,1,0,0|1,0,1]=4 924 B10R1.11 C\C=C/C(=O)C1CCCC1 Amb25773395 [1,0,0,1,0,0|0,0,2]=4 925 B10R1.11 C\C=C\C(=O)C1CCCC1 Amb24502283 [1,0,0,1,0,0|0,0,2]=4 926 B10R1.11 NCCC(=O)C1CCCC1 Amb18831690 [1,0,0,1,0,0|1,0,1]=4 927 B10R1.11 O=C(CCCl)C1CCCC1 Amb24480584 [1,0,0,1,0,0|1,0,1]=4 928 B10R1.11 O=C(\C=C\Cl)C1CCCC1 Amb24425523 [1,0,0,1,0,0|1,0,1]=4 929 B10R1.11 O=CCC(=O)C1CCCO1 Amb25859362 [1,0,0,1,0,0|2,0,0]=4 930 B10R1.11 O=CCC(=O)C1COCC1 Amb25362797 [1,0,0,1,0,0|2,0,0]=4 931 B10R1.11 O=CCS(=O)C1CCCC1 Amb24741091 [1,0,0,1,0,0|2,0,0]=4 932 B10R1.11 OCCC(=O)C1CCCC1 Amb25146636 [1,0,0,1,0,0|1,0,1]=4 933 B10R1.19 C=C=C1CCCCCC1=O Amb25146555 [1,0,0,1,0,0|0,0,2]=4 934 B10R1.19 C=CC1CCCCCC1=O Amb25370731 [1,0,0,1,0,0|0,0,0]=2 935 B10R1.19 C=CC1CCCCCC1O Amb24748257 [1,0,0,1,0,0|0,0,2]=4 936 B10R1.19 CC[C@@H]1CCCCCC1=O Amb24582517 [1,0,0,1,0,0|0,0,2]=4 937 B10R1.19 C\C=C/1\CCCCCC1=O Amb24698888 [1,0,0,1,0,0|0,0,2]=4 938 B10R1.19 C\C=C\1/CCCCCC1=O Amb25191501 [1,0,0,1,0,0|0,0,2]=4 939 B10R1.19 ClCN1CCCCCC1=O Amb17949681 [1,0,0,1,0,0|2,0,0]=4 940 B10R1.19 N#CC1CCCCCC1=O Amb17593482 [1,0,0,1,0,0|1,0,1]=4 941 B10R1.19 NCN1CCCCCC1=O Amb25228465 [1,0,0,1,0,0|2,0,0]=4 942 B10R1.19 O=C/1CCCCC\C1=C/Cl Amb25779932 [1,0,0,1,0,0|1,0,1]=4 943 B10R1.19 O=C/1CCCCC\C1=C\Cl Amb24694009 [1,0,0,1,0,0|1,0,1]=4 944 B10R1.19 O=CC1CCCCCC1=O Amb25081591 [1,0,0,1,0,0|1,0,0]=3 945 B10R1.19 O=CN1CCCCCC1=O Amb24374197 [1,0,0,1,0,0|2,0,0]=4 946 B10R1.19 OCN1CCCCCC1=O Amb1038986 [1,0,0,1,0,0|2,0,0]=4 947 B10R1.19 OC[C@@H]1CCCCCC1=O Amb25706571 [1,0,0,1,0,0|1,0,1]=4 948 B10R1.21 BrCCCCc1ccco1 Amb24477250 [1,0,0,1,0,0|2,0,0]=4 949 B10R1.21 CCCCCc1[nH]cc[n]1 Amb25131865 [1,0,0,1,0,0|2,0,0]=4 950 B10R1.21 CCCCCc1[n]cc[s]1 Amb25297177 [1,0,0,1,0,0|1,1,0]=4 951 B10R1.21 CCCCCc1nnco1 Amb2208688 [1,0,0,1,0,0|2,0,0]=4 952 B10R1.21 CCCCNc1[n]cco1 Amb22586370 [1,0,0,1,0,0|2,0,0]=4 953 B10R1.21 CCCCNc1ncco1 Amb2382971 [1,0,0,1,0,0|2,0,0]=4 954 B10R1.21 CCCNCc1ccco1 Amb1127967 [1,0,0,1,0,0|2,0,0]=4 955 B10R1.21 CCCNCc1ccco1 Amb19890265 [1,0,0,1,0,0|2,0,0]=4 956 B10R1.21 CCCSCc1ccco1 Amb24430614 [1,0,0,1,0,0|2,0,0]=4 957 B10R1.21 ClCCCCc1ccco1 Amb17138477 [1,0,0,1,0,0|2,0,0]=4 958 B10R1.21 NCCCCc1[n]cco1 Amb25104705 [1,0,0,1,0,0|2,0,0]=4 959 B10R1.21 OCCCCC=1CC=CC1 Amb25353203 [1,0,0,1,0,0|2,0,0]=4 960 B10R1.21 OCCCCc1ccco1 Amb17106038 [1,0,0,1,0,0|2,0,0]=4 961 B10R1.21 SCCCCc1ccco1 Amb18563472 [1,0,0,1,0,0|2,0,0]=4 962 B10R1.25 CC1CC(=O)CCC1CC Amb25146818 [1,0,0,1,0,0|0,0,2]=4 963 B10R1.25 CC1NC(=O)CCC1CC Amb25328404 [1,0,0,1,0,0|1,0,1]=4 964 B10R1.25 CCC1CCC(=O)NC1=O Amb25131753 [1,0,0,1,0,0|2,0,0]=4 965 B10R1.25 CCC1CNC(=O)CC1=O Amb19957550 [1,0,0,1,0,0|2,0,0]=4 966 B10R1.25 CCC1OCC(=O)CC1=O Amb25213873 [1,0,0,1,0,0|2,0,0]=4 967 B10R1.29 CCCCC1=CCCC1=O Amb24361977 [1,0,0,1,0,0|0,0,2]=4 968 B10R1.29 CCCCC1=CCNC1=O Amb25836334 [1,0,0,1,0,0|1,0,1]=4 969 B10R1.29 CCCCC1=CCOC1=O Amb24637275 [1,0,0,1,0,0|0,0,1]=3 970 B10R1.29 CCCCC1CCCC1=O Amb19301037 [1,0,0,1,0,0|0,0,2]=4 971 B10R1.29 CCCCC1CCNC1=O Amb24424969 [1,0,0,1,0,0|1,0,1]=4 972 B10R1.29 CCCCC1N=COC1=O Amb24518667 [1,0,0,1,0,0|1,0,0]=3 973 B10R1.29 CCCCN1C=CNC1=O Amb25763197 [1,0,0,1,0,0|2,0,0]=4 974 B10R1.29 CCCCN1N=CCC1=O Amb25759152 [1,0,0,1,0,0|2,0,0]=4 975 B10R1.29 CCCC[C@@H]1C=CC[C@@H]1O Amb25332224 [1,0,0,1,0,0|0,0,2]=4 976 B10R1.29 CCCC[C@@H]1C=CC[C@H]1O Amb24556491 [1,0,0,1,0,0|0,0,2]=4 977 B10R1.29 CNCCC1C=NOC1=O Amb24741993 [1,0,0,1,0,0|2,0,0]=4 978 B10R1.29 COCCC1CCOC1=O Amb23538244 [1,0,0,1,0,0|1,0,1]=4 979 B10R1.29 CSCCC1N=COC1=O Amb24757013 [1,0,0,1,0,0|2,0,0]=4 980 B10R1.29 NCCCC1C=NOC1=O Amb19515739 [1,0,0,1,0,0|2,0,0]=4 981 B10R1.29 O=C1OCCC1CCCCl Amb24524522 [1,0,0,1,0,0|1,0,1]=4 982 B10R1.77 C=C1CC(=O)CCCCC1 Amb24478348 [1,0,0,1,0,0|0,0,0]=2 983 B10R1.77 CC1CC(=O)CCCCC1 Amb24631575 [1,0,0,1,0,0|0,0,2]=4 984 B10R1.77 CC=1CC(=O)CCCCC1 Amb25146549 [1,0,0,1,0,0|0,0,2]=4 985 B10R1.77 CC=1CCCCCC(=O)C1 Amb25162774 [1,0,0,1,0,0|0,0,2]=4 986 B10R1.77 O=C1CC(=O)CCCCC1 Amb22497156 [1,0,0,1,0,0|1,0,0]=3 987 B10R1.77 OC1CC(=O)CCCCC1 Amb24662265 [1,0,0,1,0,0|1,0,1]=4 988 B10R1.78 O=C1CC=C=CCCCC1 Amb24662549 [1,0,0,1,0,0|0,0,2]=4 989 B10R1.78 O=C1CC=CCCC=CC1 Amb24424842 [1,0,0,1,0,0|0,0,2]=4 990 B10R1.78 O=C1CC=CCCCCC1 Amb24571778 [1,0,0,1,0,0|0,0,0]=2 991 B10R1.78 O=C1CCC=CCCCC1 Amb25146533 [1,0,0,1,0,0|0,0,2]=4 992 B10R1.78 O=C1CCCCC=CC=C1 Amb22342438 [1,0,0,1,0,0|0,0,2]=4 993 B10R1.78 O=C1CCCCCC=CN1 Amb25073138 [1,0,0,1,0,0|1,0,0]=3 994 B10R1.78 O=C1CCCCCCC=C1 Amb22363956 [1,0,0,1,0,0|0,0,2]=4 995 B10R1.78 O=C1CCCCCCCC1 Amb16185450 [1,0,0,1,0,0|0,0,2]=4 996 B10R1.78 O=C1CCCCCNC=C1 Amb25324286 [1,0,0,1,0,0|1,0,1]=4 997 B10R1.79 CC1CCCC(=O)CC=C1 Amb25146784 [1,0,0,1,0,0|0,0,0]=2 998 B10R1.79 CC1CCCC(=O)CCC1 Amb24698935 [1,0,0,1,0,0|0,0,2]=4 999 B10R1.79 OC1CCCC(=O)CC=C1 Amb25059313 [1,0,0,1,0,0|1,0,0]=3 1000 B10R1.85 C=COC1CCCCCC1 Amb25054422 [1,0,0,1,0,0|1,0,1]=4 1001 B10R1.85 CCOC=1CCCCCN1 Amb25853756 [1,0,0,1,0,0|1,0,1]=4 1002 B10R1.130 CC1CC(=O)CC1CCC Amb24646473 [1,0,0,1,0,0|0,0,2]=4 1003 B10R1.130 CCCC1CC(=O)NC1=O Amb25069142 [1,0,0,1,0,0|2,0,0]=4 1004 B10R1.130 CCCC1CC(=O)OC1=O Amb24460269 [1,0,0,1,0,0|1,0,0]=3 1005 B10R1.130 CCCC1OC(=O)CC1=O Amb25830567 [1,0,0,1,0,0|2,0,0]=4 1006 B10R1.130 CCCC=1CC(=O)OC1O Amb22015243 [1,0,0,1,0,0|1,0,1]=4 1007 B10R1.130 CCCN1CC(=O)CC1=O Amb24624787 [1,0,0,1,0,0|2,0,0]=4 1008 B10R1.130 CCC[C@@H]1NC(=O)OC1=O Amb25244656 [1,0,0,1,0,0|2,0,0]=4 1009 B10R1.130 C[C@@H]1OC(=O)N[C@@H]1CCC Amb25275205 [1,0,0,1,0,0|1,0,1]=4 1010 B10R1.135 CCC1CC1C(=O)CC#C Amb24557582 [1,0,0,1,0,0|0,0,2]=4 1011 B10R1.135 CCC1CC1C(=O)CC#N Amb24597791 [1,0,0,1,0,0|1,0,1]=4 1012 B10R1.135 CCC1CC1C(=O)COC Amb24589728 [1,0,0,1,0,0|1,0,1]=4 1013 B10R1.135 CCC1CC1C(O)CC=C Amb25259944 [1,0,0,1,0,0|0,0,2]=4 1014 B10R1.135 CCOC(=O)C1CC1CC Amb24358493 [1,0,0,1,0,0|0,0,1]=3 1015 B10R1.135 CCOC(=O)C1CC1CCl Amb24457957 [1,0,0,1,0,0|1,0,1]=4 1016 B10R1.135 CCOC(=O)C1CC1CN Amb25727305 [1,0,0,1,0,0|1,0,1]=4 1017 B10R1.135 CCOC(=O)[C@@H]1C[C@@H]1CO Amb25308620 [1,0,0,1,0,0|1,0,1]=4 1018 B10R1.135 CCOC(=O)[C@@H]1C[C@H]1CCl Amb24587755 [1,0,0,1,0,0|1,0,1]=4 1019 B10R1.135 CCOC(=O)[C@@H]1C[C@H]1CN Amb24670327 [1,0,0,1,0,0|1,0,1]=4 1020 B10R1.135 CC[C@@H]1C[C@H]1C(=O)CC#N Amb24549098 [1,0,0,1,0,0|1,0,1]=4 1021 B10R1.135 CC[C@@H]1C[C@H]1C(=O)CC=C Amb25189758 [1,0,0,1,0,0|0,0,0]=2 1022 B10R1.135 CC[C@@H]1C[C@H]1C(=O)CSC Amb24528900 [1,0,0,1,0,0|1,0,1]=4 1023 B10R1.135 CC[C@@H]1C[C@H]1C(O)CC=C Amb25294760 [1,0,0,1,0,0|0,0,2]=4 1024 B10R1.136 C=CCC(=O)NC1CC1N Amb18994879 [1,0,0,1,0,0|2,0,0]=4 1025 B10R1.136 CC1CC1CC(=O)NCC Amb24719358 [1,0,0,1,0,0|1,0,1]=4 1026 B10R1.136 CC1CC1CC(=O)OCC Amb24482665 [1,0,0,1,0,0|0,0,1]=3 1027 B10R1.136 CCOC(=O)CN1CC1C Amb24078336 [1,0,0,1,0,0|1,0,1]=4 1028 B10R1.137 C=CCC(=O)CC1CCC1 Amb25808883 [1,0,0,1,0,0|0,0,0]=2 1029 B10R1.137 C=CCC(=O)CC1CNC1 Amb24392581 [1,0,0,1,0,0|1,0,0]=3 1030 B10R1.137 C=CCC(O)CC1CCC1 Amb25810188 [1,0,0,1,0,0|0,0,2]=4 1031 B10R1.137 CCOC(=N)CC1CCC1 Amb25219168 [1,0,0,1,0,0|1,0,1]=4 1032 B10R1.137 CCOC(=O)CC1CCC1 Amb21963823 [1,0,0,1,0,0|0,0,1]=3 1033 B10R1.137 CCOC(=O)CC1CCO1 Amb22236098 [1,0,0,1,0,0|1,0,1]=4 1034 B10R1.137 CCOC(=O)CC1CNC1 Amb24478908 [1,0,0,1,0,0|1,0,1]=4 1035 B10R1.137 CCOC(=O)CC1COC1 Amb22002165 [1,0,0,1,0,0|1,0,1]=4 1036 B10R1.137 CCOC(=O)NC1CCC1 Amb24427502 [1,0,0,1,0,0|1,0,1]=4 1037 B10R1.137 CN(CC=C)CC1CCC1 Amb25358396 [1,0,0,1,0,0|2,0,0]=4 1038 B10R1.137 N#CCC(=O)CC1CCC1 Amb25683520 [1,0,0,1,0,0|1,0,1]=4 1039 B10R1.137 NCCC(=O)CC1CCC1 Amb24376568 [1,0,0,1,0,0|1,0,1]=4 1040 B10R1.137 [O-]\C=C\C(=O)CC1CCC1 Amb25262246 [1,0,0,1,0,0|1,0,1]=4 1041 B10R1.138 C=CCC(=O)CCC1CC1 Amb24668492 [1,0,0,1,0,0|0,0,0]=2 1042 B10R1.138 C=CCC(=O)CNC1CC1 Amb24746405 [1,0,0,1,0,0|1,0,0]=3 1043 B10R1.138 CCOC(=O)CC[C@H]1CO1 Amb24654350 [1,0,0,1,0,0|1,0,1]=4 1044 B10R1.138 CCOC(=O)CSC1CC1 Amb25355964 [1,0,0,1,0,0|1,0,1]=4 1045 B10R1.138 CSCC(=O)CCC1CC1 Amb25118594 [1,0,0,1,0,0|1,0,1]=4 1046 B10R1.138 C\C=C\C(=O)CCC1CC1 Amb25043881 [1,0,0,1,0,0|0,0,2]=4 1047 B10R1.139 CC1CCC1C(=O)CCC Amb24414331 [1,0,0,1,0,0|0,0,2]=4 1048 B10R1.139 CCOC(=O)C1CCC1O Amb25061668 [1,0,0,1,0,0|1,0,1]=4 1049 B10R1.139 CCOC(=O)C1CCN1C Amb22230620 [1,0,0,1,0,0|1,0,1]=4 1050 B10R1.186 CCCCCC(=O)C1CC1 Amb25107230 [1,0,0,1,0,0|0,0,2]=4 1051 B10R1.186 CCCCCC(=O)N1CC1 Amb24482971 [1,0,0,1,0,0|1,0,1]=4 1052 B10R1.245 CC/1CCCC(=O)\C1=C/O Amb24354877 [1,0,0,1,0,0|1,0,1]=4 1053 B10R1.245 CC1CCCC(=O)C1C=C Amb24523000 [1,0,0,1,0,0|0,0,0]=2 1054 B10R1.245 CC1CCCC(=O)C1C=O Amb24736291 [1,0,0,1,0,0|1,0,0]=3 1055 B10R1.245 CC1CCCC(=O)C1CC Amb25146579 [1,0,0,1,0,0|0,0,2]=4 1056 B10R1.245 CC1CCCC(=O)C1SC Amb24706704 [1,0,0,1,0,0|1,0,1]=4 1057 B10R1.245 CC1CCCC(O)C1C=C Amb24672678 [1,0,0,1,0,0|0,0,2]=4 1058 B10R1.245 CC=1CCCC(=O)C1C=C Amb24584692 [1,0,0,1,0,0|0,0,2]=4 1059 B10R1.245 C[C@@H]/1CCCC(=O)\C1=C/O Amb25706976 [1,0,0,1,0,0|1,0,1]=4 1060 B10R1.245 C[C@@H]1CCCC(=O)C1C=O Amb24478244 [1,0,0,1,0,0|1,0,0]=3 1061 B10R1.245 C[C@@H]1CCCC(=O)[C@@H]1CO Amb24512767 [1,0,0,1,0,0|1,0,1]=4 1062 B10R1.245 C[C@@H]1CCCC(=O)[C@H]1OC Amb25294369 [1,0,0,1,0,0|1,0,1]=4 1063 B10R1.245 C[C@@H]1CCC[C@@H](O)[C@@H]1C=C Amb25332467 [1,0,0,1,0,0|0,0,2]=4 1064 B10R1.245 C[C@H]1CCCC(=O)[C@H]1CC Amb24631614 [1,0,0,1,0,0|0,0,2]=4 1065 B10R1.245 C[C@H]1CCCC(=O)[C@H]1OC Amb24587379 [1,0,0,1,0,0|1,0,1]=4 1066 B10R1.245 C\C=C/1\C(C)CCCC1=O Amb25146511 [1,0,0,1,0,0|0,0,2]=4 1067 B10R1.245 C\C=C\1/C(C)CCCC1=O Amb18048431 [1,0,0,1,0,0|0,0,2]=4 1068 B10R1.257 CCC1CCC(=O)C1CO Amb24709329 [1,0,0,1,0,0|1,0,1]=4 1069 B10R1.257 CCC1CCC(=O)N1CO Amb25331615 [1,0,0,1,0,0|2,0,0]=4 1070 B10R1.277 CC1=CC(=O)CCCC1C Amb24478380 [1,0,0,1,0,0|0,0,2]=4 1071 B10R1.277 CC=1CC(=O)CCCC1C Amb25830563 [1,0,0,1,0,0|0,0,2]=4 1072 B10R1.277 CN1CCCC(=O)CC1=S Amb24736355 [1,0,0,1,0,0|2,0,0]=4 1073 B10R1.277 C[C@@H]1CC(=O)CCC[C@@H]1C Amb25319342 [1,0,0,1,0,0|0,0,2]=4 1074 B10R1.277 C[C@@H]1CC(=O)CCC[C@H]1C Amb25179540 [1,0,0,1,0,0|0,0,2]=4 1075 B10R1.277 C[C@H]1CC(=O)CCC[C@H]1C Amb25179623 [1,0,0,1,0,0|0,0,2]=4 1076 B10R1.377 C=CCC1(N)CCCCC1 Amb24351599 [1,0,0,1,0,0|1,0,1]=4 1077 B10R1.406 C[C@@H]1CC(=O)[C@H]1CCCC Amb24620015 [1,0,0,1,0,0|0,0,2]=4 1078 B10R1.406 C[C@@H]1NC(=O)[C@@H]1CCCC Amb25326788 [1,0,0,1,0,0|1,0,1]=4 1079 B10R1.527 CC1CCCC1(O)CC=C Amb25112084 [1,0,0,1,0,0|0,0,2]=4 1080 B10R1.4 C=CCC1CCCNC1=O Amb25737285 [1,0,0,1,0,0|2,0,0]=4 1081 B10R1.4 C=CCC1CNCCC1=O Amb24478849 [1,0,0,1,0,0|2,0,0]=4 1082 B10R1.4 C=CCN1CCCCC1=O Amb22522115 [1,0,0,1,0,0|1,0,0]=3 1083 B10R1.4 C=CCN1CCNCC1=O Amb22009238 [1,0,0,1,0,0|2,0,0]=4 1084 B10R1.4 C=CC[C@@H]1CCCCC1=O Amb25202605 [1,0,0,1,0,0|1,0,0]=3 1085 B10R1.4 C=CC[C@H]1CCCCC1=O Amb24690493 [1,0,0,1,0,0|1,0,0]=3 1086 B10R1.4 C=COC1CCCCC1=O Amb25719510 [1,0,0,1,0,0|2,0,0]=4 1087 B10R1.4 CCCC1CCCOC1=O Amb25068420 [1,0,0,1,0,0|0,0,2]=4 1088 B10R1.4 O=CCC1CCCCC1=O Amb17593548 [1,0,0,1,0,0|2,0,0]=4 1089 B10R1.4 O=CCN1CCCCC1=O Amb25251440 [1,0,0,1,0,0|2,0,0]=4 1090 B10R1.17 C=CCOC1CCCCC1 Amb25174242 [1,0,0,1,0,0|1,0,1]=4 1091 B10R1.30 CC1CCC(=O)C=C1C=C Amb24372163 [1,0,0,1,0,0|1,0,1]=4 1092 B10R1.30 CC1COC(=O)NC1C=C Amb25194618 [1,0,0,1,0,0|2,0,0]=4 1093 B10R1.30 CCC1CC(=O)CCC1=O Amb25185197 [1,0,0,1,0,0|2,0,0]=4 1094 B10R1.30 CCC1NC(=O)OCC1=O Amb25210938 [1,0,0,1,0,0|2,0,0]=4 1095 B10R1.30 CC[C@@H]1NC(=O)OCC1=O Amb24680997 [1,0,0,1,0,0|2,0,0]=4 1096 B10R1.30 C[C@H]1COC(=O)N[C@H]1C=C Amb24609867 [1,0,0,1,0,0|2,0,0]=4 1097 B10R1.32 C=CC1OC(=O)NC1CCl Amb25799271 [1,0,0,1,0,0|2,0,0]=4 1098 B10R1.32 C=CC1OC(=O)OC1CO Amb25072482 [1,0,0,1,0,0|2,0,0]=4 1099 B10R1.32 C=C[C@H]1OC(=O)N[C@@H]1CO Amb24517502 [1,0,0,1,0,0|2,0,0]=4 1100 B10R1.32 CC[C@H]1NC(=O)O[C@H]1C=C Amb25026710 [1,0,0,1,0,0|1,0,0]=3 1101 B10R1.32 COC1CC(=O)OC1C=O Amb25735223 [1,0,0,1,0,0|2,0,0]=4 1102 B10R1.71 O=C1CCCNC(=O)CO1 Amb24504877 [1,0,0,1,0,0|2,0,0]=4 1103 B10R1.71 OC1CCC(=O)CCC=C1 Amb25146785 [1,0,0,1,0,0|2,0,0]=4 1104 B10R1.162 C=CC1CCCCC(O)O1 Amb24431727 [1,0,0,1,0,0|0,0,2]=4 1105 B10R1.162 CCC1CCCCC(=O)O1 Amb25174027 [1,0,0,1,0,0|0,0,2]=4 1106 B10R1.162 O=C1CCCC[C@@H](CBr)O1 Amb25351492 [1,0,0,1,0,0|1,0,1]=4 1107 B10R1.162 O=CC1CCCCC(=O)N1 Amb24479154 [1,0,0,1,0,0|2,0,0]=4 1108 B10R1.162 OC[C@@H]1CCCCC(=O)O1 Amb24481208 [1,0,0,1,0,0|1,0,1]=4 1109 B10R1.178 C=CCCC(=O)C1CNC1 Amb25291743 [1,0,0,1,0,0|2,0,0]=4 1110 B10R1.178 C=CCCC(=O)N1CCC1 Amb25741965 [1,0,0,1,0,0|2,0,0]=4 1111 B10R1.178 C=CCNC(=O)C1CCO1 Amb24584021 [1,0,0,1,0,0|2,0,0]=4 1112 B10R1.178 C=CCNC(=O)N1CCC1 Amb25285387 [1,0,0,1,0,0|2,0,0]=4 1113 B10R1.178 C=CCOC(=O)C1COC1 Amb25711840 [1,0,0,1,0,0|1,0,0]=3 1114 B10R1.178 O=CCNC(=O)C1CCC1 Amb22896803 [1,0,0,1,0,0|2,0,0]=4 1115 B10R1.178 OCCOC(=O)C1CCC1 Amb25308449 [1,0,0,1,0,0|1,0,1]=4 1116 B10R1.180 C=CCCC(=O)CC1CC1 Amb25742225 [1,0,0,1,0,0|1,0,0]=3 1117 B10R1.180 C=CCCC(=O)OC1CC1 Amb25851366 [1,0,0,1,0,0|2,0,0]=4 1118 B10R1.180 C=CCNC(=O)NC1CC1 Amb22396318 [1,0,0,1,0,0|2,0,0]=4 1119 B10R1.180 CCCCC(=O)OC1CC1 Amb25725030 [1,0,0,1,0,0|0,0,2]=4 1120 B10R1.187 CC/1CCC(=O)\C1=C/C=C Amb25128943 [1,0,0,1,0,0|1,0,1]=4 1121 B10R1.187 CC1NCC(=O)N1CC=C Amb24480878 [1,0,0,1,0,0|2,0,0]=4 1122 B10R1.187 CC=1CCC(=O)C1CC=C Amb24686385 [1,0,0,1,0,0|1,0,1]=4 1123 B10R1.187 CCCC1C(=O)CCC1=O Amb24449925 [1,0,0,1,0,0|2,0,0]=4 1124 B10R1.187 CCCC1C(N)COC1=O Amb24595484 [1,0,0,1,0,0|1,0,1]=4 1125 B10R1.187 C[C@@H]1CCC(=O)[C@H]1CC=C Amb24604865 [1,0,0,1,0,0|1,0,0]=3 1126 B10R1.293 CC1CC1C(=O)NCC=C Amb24711109 [1,0,0,1,0,0|1,0,0]=3 1127 B10R1.293 CC1CC1C(=O)OCC#N Amb25342140 [1,0,0,1,0,0|1,0,1]=4 1128 B10R1.293 CC1CC1C(=O)OCC=C Amb25852725 [1,0,0,1,0,0|0,0,0]=2 1129 B10R1.293 CC1CC1C(=O)OCCF Amb24482780 [1,0,0,1,0,0|1,0,1]=4 1130 B10R1.293 CC1CC1C(=O)OCOC Amb25716457 [1,0,0,1,0,0|1,0,1]=4 1131 B10R1.293 C[C@@H]1C[C@H]1C(=O)OCCO Amb25297088 [1,0,0,1,0,0|1,0,1]=4 1132 B10R1.293 C[C@H]1C[C@@H]1C(=O)NCC=C Amb25297978 [1,0,0,1,0,0|1,0,0]=3 1133 B10R1.293 C[C@H]1C[C@@H]1C(=O)OCC#C Amb24631744 [1,0,0,1,0,0|0,0,2]=4 1134 B10R1.293 C[C@H]1C[C@@H]1C(=O)OCCC Amb24633230 [1,0,0,1,0,0|0,0,2]=4 1135 B10R1.293 C[C@H]1C[C@@H]1C(=O)OCCF Amb24631745 [1,0,0,1,0,0|1,0,1]=4 1136 B10R1.316 CCC[C@@H]1[C@@H](C=O)OC1=O Amb25179656 [1,0,0,1,0,0|1,0,0]=3 1137 B10R1.316 CCC[C@H]1[C@H](C=O)OC1=O Amb25179661 [1,0,0,1,0,0|1,0,0]=3 1138 B10R1.316 CCOC1C(CC1=O)C=C Amb25146500 [1,0,0,1,0,0|2,0,0]=4 1139 B10R1.5 CCC1CCCN1CC=C Amb25283994 [1,0,0,1,0,0|1,0,1]=4 1140 B10R1.20 C=CC1C=CCCC1CCl Amb25368402 [1,0,0,1,0,0|2,0,0]=4 1141 B10R1.37 CC1CCC1NCCC=C Amb25325848 [1,0,0,1,0,0|2,0,0]=4 1142 B10R1.37 CC1CCC1NOCC=C Amb24543103 [1,0,0,1,0,0|1,0,0]=3 1143 B10R1.57 C=CCOCCC1CNC1 Amb25365307 [1,0,0,1,0,0|1,0,1]=4 1144 B10R1.57 C=CCOCCN1CCC1 Amb24737034 [1,0,0,1,0,0|1,0,1]=4 1145 B10R1.161 C=CC1CCCCCCC1 Amb17934189 [1,0,0,1,0,0|1,0,1]=4 1146 B12R1.53 C=CCCC(=O)CC1OCCO1 Amb24449798 [0,1,0,1,0,0|2,0,0]=4 1147 B12R1.53 C=CCNC(=N)NC1CCCC1 Amb18798949 [0,1,0,1,0,0|2,0,0]=4 1148 B12R1.53 C=CCNC(=O)C=C1CCCC1 Amb25091834 [0,1,0,1,0,0|1,0,1]=4 1149 B12R1.53 C=CCNC(=O)NC1CCCC1 Amb24622454 [0,1,0,1,0,0|1,0,0]=3 1150 B12R1.53 C=CCNC(=O)NC1COCC1 Amb25077450 [0,1,0,1,0,0|2,0,0]=4 1151 B12R1.53 C=CCNC(=O)NC1CSCC1 Amb24577234 [0,1,0,1,0,0|2,0,0]=4 1152 B12R1.100 CC1CC(O)C=C(C1)OCC=C Amb25156894 [0,1,0,1,0,0|1,0,1]=4 1153 B12R1.321 C=CCCC=1CCCCC(Cl)C1 Amb25816996 [0,1,0,1,0,0|2,0,0]=4 1154 B12R1.321 C=CCCC=1CCCCC(O)C1 Amb25817165 [0,1,0,1,0,0|2,0,0]=4 1155 B12R1.460 C=CCNC(=O)C1CCCC1=O Amb24497061 [0,1,0,1,0,0|1,0,1]=4 1156 B12R1.460 C=CCNC(=O)C1CCCC1O Amb25229094 [0,1,0,1,0,0|1,0,0]=3 1157 B12R1.460 C=CCNC(=O)C1COCC1N Amb25313753 [0,1,0,1,0,0|2,0,0]=4 1158 B12R1.460 C=CCNC(=O)[C@@H]1CCCN1O Amb25683452 [0,1,0,1,0,0|2,0,0]=4 1159 B12R1.460 CC1CCCC1C(=O)NCC=C Amb25355160 [0,1,0,1,0,0|1,0,0]=3 1160 B12R1.460 CC1CCCC1C(=O)OCC#N Amb25220808 [0,1,0,1,0,0|1,0,1]=4 1161 B12R1.460 CC1CCCN1C(=O)NCC=C Amb24457707 [0,1,0,1,0,0|1,0,0]=3 1162 B12R1.460 CC1CCCN1C(=O)NCC=C Amb25672131 [0,1,0,1,0,0|1,0,0]=3 1163 B12R1.460 CC1CCCN1C(=S)NCC=C Amb25749415 [0,1,0,1,0,0|1,1,0]=4 1164 B12R1.460 CC1CCOC1C(=O)NCC=C Amb25298844 [0,1,0,1,0,0|1,0,0]=3 1165 B12R1.460 CC1CCOC1C(=O)OCC#C Amb25822173 [0,1,0,1,0,0|0,0,2]=4 1166 B12R1.460 CC1CCOC1C(=O)OCC#N Amb24411981 [0,1,0,1,0,0|1,0,1]=4 1167 B12R1.460 CC1OCCC1C(=O)OCC#C Amb25817327 [0,1,0,1,0,0|0,0,2]=4 1168 B12R1.460 CC1OCCC1C(=O)OCC#N Amb25154407 [0,1,0,1,0,0|1,0,1]=4 1169 B12R1.460 CN1CCCC1C(=O)NCC=C Amb25161208 [0,1,0,1,0,0|1,0,0]=3 1170 B12R1.460 CN1CCCC1C(=O)OCC#C Amb24677342 [0,1,0,1,0,0|0,0,2]=4 1171 B12R1.460 CN1CCCC1C(=O)OCC#N Amb25833420 [0,1,0,1,0,0|1,0,1]=4 1172 B12R1.460 C[C@@H]1CCO[C@@H]1C(=O)OCC#C Amb24351821 [0,1,0,1,0,0|0,0,2]=4 1173 B12R1.460 C[C@@H]1CNC[C@H]1C(=O)NCC=C Amb25319544 [0,1,0,1,0,0|1,0,0]=3 1174 B12R1.462 CC1CC(C1)NC(=O)NCC=C Amb25099354 [0,1,0,1,0,0|2,0,0]=4 1175 B12R1.1095 CC1CC(=O)CC(=O)C1CC=C Amb25759597 [0,1,0,1,0,0|1,0,1]=4 1176 B12R1.1095 CC1CC(C)C(CC=C)C(=O)C1 Amb24537916 [0,1,0,1,0,0|1,0,0]=3 1177 B12R1.1141 CC1CC(=O)N(CC=C)CCN1 Amb25801056 [0,1,0,1,0,0|2,0,0]=4 1178 B12R1.18 C=C=CCC1CCCCCC1=O Amb25273025 [0,1,0,1,0,0|1,0,0]=3 1179 B12R1.18 C=CCCC1CCCCCC1=O Amb24729033 [0,1,0,1,0,0|1,0,0]=3 1180 B12R1.18 C=CCCC1CCCCNC1=O Amb24448445 [0,1,0,1,0,0|2,0,0]=4 1181 B12R1.18 C=CCOC1CCCCCC1=O Amb24633444 [0,1,0,1,0,0|0,0,0]=2 1182 B12R1.18 C=CCOC1CCCCCC1N Amb25050869 [0,1,0,1,0,0|1,0,1]=4 1183 B12R1.18 C=C\C=C\C1CCCCCC1=O Amb25202607 [0,1,0,1,0,0|1,0,1]=4 1184 B12R1.18 CCCC[C@@H]1C=CC=CNC1=O Amb25161373 [0,1,0,1,0,0|1,0,1]=4 1185 B12R1.18 C\C=C\CC1CCCCCC1=O Amb24470381 [0,1,0,1,0,0|1,0,0]=3 1186 B12R1.18 O=CCCN1CCCCCC1=O Amb18789015 [0,1,0,1,0,0|1,0,1]=4 1187 B12R1.29 C=CCNC(=O)C1CCC(F)C1 Amb25119686 [0,1,0,1,0,0|1,0,0]=3 1188 B12R1.29 C=CCNC(=O)N1CC(O)CC1 Amb25852176 [0,1,0,1,0,0|2,0,0]=4 1189 B12R1.29 C=CCNC(=O)N1C[C@@H](O)CC1 Amb24705086 [0,1,0,1,0,0|2,0,0]=4 1190 B12R1.29 C=CCNC(=O)N1C[C@H](O)CC1 Amb25295604 [0,1,0,1,0,0|2,0,0]=4 1191 B12R1.29 C=CCNC(=O)[C@H]1C[C@H](F)CN1 Amb25059412 [0,1,0,1,0,0|2,0,0]=4 1192 B12R1.29 CC1CC(CC1)C(=O)NCC=C Amb25769207 [0,1,0,1,0,0|1,0,0]=3 1193 B12R1.29 CC1CC(CO1)C(=O)NCC=C Amb25700206 [0,1,0,1,0,0|2,0,0]=4 1194 B12R1.29 CC1CCC(O1)C(=O)NCC=C Amb25344789 [0,1,0,1,0,0|1,0,0]=3 1195 B12R1.29 CC1CN(CC1)C(=O)NCC=C Amb24555418 [0,1,0,1,0,0|2,0,0]=4 1196 B12R1.29 N#CCOC(=O)C1CCC(F)C1 Amb24618598 [0,1,0,1,0,0|1,0,1]=4 1197 B12R1.30 C#CCOC(=O)C1CCOCC1 Amb25669730 [0,1,0,1,0,0|0,0,2]=4 1198 B12R1.30 C#CCOC(=O)C1CCSCC1 Amb24498009 [0,1,0,1,0,0|0,0,2]=4 1199 B12R1.30 C=CCNC(=O)C1CC=CCC1 Amb25346009 [0,1,0,1,0,0|1,0,1]=4 1200 B12R1.30 C=CCNC(=O)C1CCCCN1 Amb21958705 [0,1,0,1,0,0|1,0,0]=3 1201 B12R1.30 C=CCNC(=O)C1CCCCO1 Amb24390141 [0,1,0,1,0,0|1,0,0]=3 1202 B12R1.30 C=CCNC(=O)C1CCCCS1 Amb24487496 [0,1,0,1,0,0|1,0,0]=3 1203 B12R1.30 C=CCNC(=O)C1CCNCC1 Amb1111141 [0,1,0,1,0,0|1,0,0]=3 1204 B12R1.30 C=CCNC(=O)C1CCNCC1 Amb21958707 [0,1,0,1,0,0|1,0,0]=3 1205 B12R1.30 C=CCNC(=O)C1CCOCC1 Amb25046449 [0,1,0,1,0,0|1,0,0]=3 1206 B12R1.30 C=CCNC(=O)C1CCSCC1 Amb24371783 [0,1,0,1,0,0|1,0,0]=3 1207 B12R1.30 C=CCNC(=O)C1CNCCC1 Amb21958706 [0,1,0,1,0,0|1,0,0]=3 1208 B12R1.30 C=CCNC(=O)C1CNCCO1 Amb18981953 [0,1,0,1,0,0|2,0,0]=4 1209 B12R1.30 C=CCNC(=O)C1COCCC1 Amb25152579 [0,1,0,1,0,0|1,0,0]=3 1210 B12R1.30 C=CCNC(=O)C1COCCN1 Amb25701627 [0,1,0,1,0,0|2,0,0]=4 1211 B12R1.30 C=CCNC(=O)C1CSCCC1 Amb25091821 [0,1,0,1,0,0|1,0,0]=3 1212 B12R1.30 C=CCNC(=O)N1CCCCC1 Amb25678512 [0,1,0,1,0,0|1,0,0]=3 1213 B12R1.30 C=CCNC(=O)N1CCCCN1 Amb24630121 [0,1,0,1,0,0|2,0,0]=4 1214 B12R1.30 C=CCNC(=O)N1CCNCC1 Amb17232717 [0,1,0,1,0,0|2,0,0]=4 1215 B12R1.30 C=CCNC(=O)N1CCSCC1 Amb25832542 [0,1,0,1,0,0|2,0,0]=4 1216 B12R1.30 C=CCNC(=O)[C@@H]1CCCCN1 Amb25306502 [0,1,0,1,0,0|1,0,0]=3 1217 B12R1.30 C=CCNC(=O)[C@H]1CNCCO1 Amb25822986 [0,1,0,1,0,0|2,0,0]=4 1218 B12R1.30 C=CCOC(=O)N1CCNCC1 Amb22754004 [0,1,0,1,0,0|1,0,0]=3 1219 B12R1.30 CCCOC(=O)C1CC[NH2+]CC1 Amb22444481 [0,1,0,1,0,0|0,0,2]=4 1220 B12R1.30 N#CCOC(=O)C1CCCCO1 Amb25122422 [0,1,0,1,0,0|1,0,1]=4 1221 B12R1.30 N#CCOC(=O)C1CCCCS1 Amb25042456 [0,1,0,1,0,0|1,0,1]=4 1222 B12R1.30 NCCOC(=O)C1CCNCC1 Amb24079000 [0,1,0,1,0,0|1,0,1]=4 1223 B12R1.30 O=CCNC(=O)C1CCCCC1 Amb17102060 [0,1,0,1,0,0|2,0,0]=4 1224 B12R1.30 O=CCNC(=O)C1CCOCC1 Amb22896804 [0,1,0,1,0,0|2,0,0]=4 1225 B12R1.150 O=C1CCCCCC=CCC1Cl Amb25685278 [0,1,0,1,0,0|1,0,0]=3 1226 B12R1.374 CCCCC1NC(=O)CNC1=O Amb25103661 [0,1,0,1,0,0|2,0,0]=4 1227 B12R1.374 CCCCN1CC(=O)NCC1=O Amb25821705 [0,1,0,1,0,0|2,0,0]=4 1228 B12R1.374 CCCC[C@@H]1NC(=O)OCC1=O Amb25751798 [0,1,0,1,0,0|1,0,0]=3 1229 B12R1.374 CCCC[C@H]1NC(=O)CNC1=O Amb25368428 [0,1,0,1,0,0|2,0,0]=4 1230 B12R1.2022 C#CCOC(=O)C1(O)CCCC1 Amb24464336 [0,1,0,1,0,0|0,0,2]=4 1231 B12R1.2022 C=CCNC(=O)C1(F)CCCC1 Amb24495634 [0,1,0,1,0,0|1,0,0]=3 1232 B12R1.2022 C=CCNC(=O)C1(N)CCCC1 Amb18968898 [0,1,0,1,0,0|1,0,0]=3 1233 B12R1.2022 C=CCNC(=O)C1(N)COCC1 Amb24465774 [0,1,0,1,0,0|2,0,0]=4 1234 B12R1.2022 C=CCNC(=O)C1(O)CCCC1 Amb25669983 [0,1,0,1,0,0|1,0,0]=3 1235 B12R1.2022 C=CCNC(=O)C1(O)CSCC1 Amb24497947 [0,1,0,1,0,0|2,0,0]=4 1236 B12R1.2022 CC1(CCCN1)C(=O)NCC=C Amb25839739 [0,1,0,1,0,0|2,0,0]=4 1237 B12R1.2022 CC1(CCCO1)C(=O)NCC=C Amb25132389 [0,1,0,1,0,0|2,0,0]=4 1238 B12R1.2022 CC1(CCCS1)C(=O)NCC=C Amb24369668 [0,1,0,1,0,0|2,0,0]=4 1239 B12R1.2022 CC1(COCC1)C(=O)NCC=C Amb24473925 [0,1,0,1,0,0|2,0,0]=4 1240 B12R1.2022 N#CCOC(=O)C1(F)CCCC1 Amb24497999 [0,1,0,1,0,0|1,0,1]=4 1241 B12R1.3575 CCCCC1(C)C(=O)COC1=O Amb25833622 [0,1,0,1,0,0|1,0,0]=3 1242 B12R1.54 BrC(=C)CNC(=O)C1CCCO1 Amb14063817 [0,1,0,1,0,0|2,0,0]=4 1243 B12R1.54 BrC(=C)CNC(=O)C1COCC1 Amb14262899 [0,1,0,1,0,0|2,0,0]=4 1244 B12R1.54 C=C(Br)CNC(=O)C1CCCN1 Amb24571563 [0,1,0,1,0,0|2,0,0]=4 1245 B12R1.54 C=C(Br)CNC(=O)C1CCCN1 Amb24768508 [0,1,0,1,0,0|2,0,0]=4 1246 B12R1.54 C=C(Br)CNC(=O)C1CNCC1 Amb24768512 [0,1,0,1,0,0|2,0,0]=4 1247 B12R1.54 C=C(Br)CNC(=O)C1CSCC1 Amb24464031 [0,1,0,1,0,0|2,0,0]=4 1248 B12R1.54 C=C(Br)CNC(=O)N1CCCC1 Amb25072936 [0,1,0,1,0,0|2,0,0]=4 1249 B12R1.54 C=C(Br)CNC(=O)[C@@H]1CCCN1 Amb24768510 [0,1,0,1,0,0|2,0,0]=4 1250 B12R1.54 C=C(Br)CNC(=O)[C@@H]1CNCC1 Amb24769727 [0,1,0,1,0,0|2,0,0]=4 1251 B12R1.54 C=C(Br)CNC(=O)[C@H]1CCCO1 Amb24351246 [0,1,0,1,0,0|2,0,0]=4 1252 B12R1.54 C=C(Br)CNC(=O)[C@H]1CNCC1 Amb24769726 [0,1,0,1,0,0|2,0,0]=4 1253 B12R1.54 C=C(Cl)CNC(=O)C1CNCC1 Amb25807030 [0,1,0,1,0,0|2,0,0]=4 1254 B12R1.54 C=C(Cl)CNC(=O)C1COCC1 Amb24739206 [0,1,0,1,0,0|2,0,0]=4 1255 B12R1.54 C=C(Cl)CNC(=O)[C@@H]1CCCN1 Amb24492865 [0,1,0,1,0,0|2,0,0]=4 1256 B12R1.54 CC(=C)CNC(=O)C1CNCC1 Amb24459871 [0,1,0,1,0,0|2,0,0]=4 1257 B12R1.54 CC(=C)CNC(=O)N1CCCC1 Amb24391837 [0,1,0,1,0,0|2,0,0]=4 1258 B12R1.54 CC(=C)CNC(=O)[C@@H]1CCCO1 Amb24712129 [0,1,0,1,0,0|2,0,0]=4 1259 B12R1.54 CC(=C)CNC(=O)[C@H]1CCCO1 Amb25053790 [0,1,0,1,0,0|2,0,0]=4 1260 B12R1.54 CC(=O)CCC(=O)C1CCCC1 Amb18799103 [0,1,0,1,0,0|1,0,1]=4 1261 B12R1.54 CC(=O)CNC(=O)C1CCCC1 Amb24341601 [0,1,0,1,0,0|1,0,1]=4 1262 B12R1.54 NC(=O)CNC(=O)C1CCCC1 Amb25152479 [0,1,0,1,0,0|2,0,0]=4 1263 B12R1.54 NC(=S)CNC(=O)C1CCCC1 Amb19058500 [0,1,0,1,0,0|2,0,0]=4 1264 B12R1.54 O=C(C1CCCC1)NCC(=C)Br Amb14063569 [0,1,0,1,0,0|1,0,0]=3 1265 B12R1.54 O=C(C1CCCC1)NCC(=O)O Amb1116958 [0,1,0,1,0,0|2,0,0]=4 1266 B12R1.147 CC(=C)CNC(=O)NC1CC1C Amb25188014 [0,1,0,1,0,0|2,0,0]=4 1267 B12R1.147 CC1CC1NC(=O)NCC(=C)Br Amb24718184 [0,1,0,1,0,0|2,0,0]=4 1268 B12R1.206 O=C1CCC(=O)CCCCCC1 Amb25294442 [0,1,0,1,0,0|1,0,1]=4 1269 B12R1.210 C=C(Br)CN1CCCCCC1=O Amb25669895 [0,1,0,1,0,0|1,0,0]=3 1270 B12R1.210 CC(=C)CC1CCCCCC1=O Amb18798683 [0,1,0,1,0,0|1,0,0]=3 1271 B12R1.210 CC(=O)CC1CCCCCC1=O Amb24535501 [0,1,0,1,0,0|1,0,1]=4 1272 B12R1.210 CC(=O)CN1CCCCCC1=O Amb18806130 [0,1,0,1,0,0|1,0,1]=4 1273 B12R1.210 OC(=O)CC1CCCCCC1=O Amb18825694 [0,1,0,1,0,0|2,0,0]=4 1274 B12R1.230 CC1CCN1C(=O)NCC(=C)Br Amb25816420 [0,1,0,1,0,0|2,0,0]=4 1275 B12R1.276 CCCC1CC(=O)CC1C(O)=O Amb25138701 [0,1,0,1,0,0|2,0,0]=4 1276 B12R1.276 CCCC1CC(=O)NC1C(O)=O Amb25732823 [0,1,0,1,0,0|2,0,0]=4 1277 B12R1.484 CCCCCC(=O)OCC1CO1 Amb22734710 [0,1,0,1,0,0|0,0,2]=4 1278 B12R1.551 CC(=C)CNC(=O)NC1CCC1 Amb24356259 [0,1,0,1,0,0|2,0,0]=4 1279 B12R1.552 BrC(=C)CNC(=O)NCC1CC1 Amb17921596 [0,1,0,1,0,0|2,0,0]=4 1280 B12R1.620 CC(=C)CN1C(CO)CCC1=O Amb25831856 [0,1,0,1,0,0|2,0,0]=4 1281 B12R1.620 CC(=C)CN1[C@H](CO)CCC1=O Amb25080179 [0,1,0,1,0,0|2,0,0]=4 1282 B12R1.620 CCC1CCC(=O)N1CC(N)=O Amb25088260 [0,1,0,1,0,0|2,0,0]=4 1283 B12R1.1009 CC(=C)CC1C(C)CCCC1=O Amb24647750 [0,1,0,1,0,0|1,0,0]=3 1284 B12R1.1009 CC(=C)C[C@H]1[C@@H](C)CCCC1=O Amb25339600 [0,1,0,1,0,0|1,0,0]=3 1285 B12R1.1009 CC(=O)CN1C(C)CCCC1=O Amb24708287 [0,1,0,1,0,0|1,0,1]=4 1286 B12R1.1011 OC(=O)C1CC(=O)CCCCC1 Amb25187509 [0,1,0,1,0,0|2,0,0]=4 1287 B12R1.1343 C=C(Br)CNC=1CCCCCN1 Amb25116781 [0,1,0,1,0,0|2,0,0]=4 1288 B12R1.270 CCC1CC(CC=C)C(=O)CC1 Amb18798687 [0,1,0,1,0,0|1,0,0]=3 1289 B12R1.270 CNC1CN(CC=C)C(=O)CC1 Amb25283220 [0,1,0,1,0,0|2,0,0]=4 1290 B12R1.385 CC1CN(CCC1N)OCC=C Amb24508706 [0,1,0,1,0,0|2,0,0]=4 1291 B12R1.925 CC1CCC1NC(=O)NCC=C Amb24525681 [0,1,0,1,0,0|1,0,0]=3 1292 B12R1.925 CC1CCC1NC(=S)NCC=C Amb25817178 [0,1,0,1,0,0|1,1,0]=4 1293 B12R1.1122 CC1(CO)CCC(=O)N1CC=C Amb24475870 [0,1,0,1,0,0|2,0,0]=4 1294 B12R1.1452 CC1CCN(CC=O)C(=O)CC1 Amb24730185 [0,1,0,1,0,0|2,0,0]=4 1295 B12R1.1926 C=C[C@H]1OC(=O)C[C@@H]1[C@@H](O)CO Amb24632535 [0,1,0,1,0,0|1,0,0]=3 1296 B12R1.1926 CC(CC)C1CC(=O)OC1CO Amb25296099 [0,1,0,1,0,0|1,0,1]=4 1297 B12R1.1926 CCC(O)C1OC(=O)CC1C=C Amb25317375 [0,1,0,1,0,0|2,0,0]=4 1298 B12R1.2217 CCC(N)CN1C(=O)OCC1=O Amb22642711 [0,1,0,1,0,0|2,0,0]=4 1299 B12R1.52 C=CCC1CCCC=CCC1=O Amb24737373 [0,1,0,1,0,0|1,0,1]=4 1300 B12R1.52 C=CCC1CCCCCCC1=O Amb24584339 [0,1,0,1,0,0|1,0,0]=3 1301 B12R1.52 C=CCC1CCCCCNC1=N Amb25339678 [0,1,0,1,0,0|2,0,0]=4 1302 B12R1.52 C=C\C=C/1\CCCCCCC1=O Amb25768397 [0,1,0,1,0,0|1,0,1]=4 1303 B12R1.52 O=CCN1CCCCCCC1=O Amb18806129 [0,1,0,1,0,0|2,0,0]=4 1304 B12R1.215 O=C1CCC=CCCCCCC1 Amb25713005 [0,1,0,1,0,0|1,0,0]=3 1305 B12R1.215 O=C1CCCCCCCCCO1 Amb22732305 [0,1,0,1,0,0|0,0,2]=4 1306 B12R1.376 CC\C=C/[C@@H]1CC(=O)C[C@H]1C=C Amb24631582 [0,1,0,1,0,0|1,0,1]=4 1307 B12R1.407 C=CC1CC(=O)CCCCCC1 Amb25319948 [0,1,0,1,0,0|1,0,0]=3 1308 B12R1.567 CCCCCC1C(=O)CCC1=O Amb17594210 [0,1,0,1,0,0|2,0,0]=4 1309 B12R1.1007 O=C1CCCCC(=O)C=CCC1 Amb25713556 [0,1,0,1,0,0|1,0,1]=4 1310 B12R1.1007 O=C1CCCCC(Cl)CCCO1 Amb25701761 [0,1,0,1,0,0|0,0,2]=4 1311 B12R1.1112 C=CCN1C(CN)CCCC1=O Amb24497432 [0,1,0,1,0,0|1,0,0]=3 1312 B12R1.1112 CC[C@H]1CCCC(=O)C1CC=C Amb24736169 [0,1,0,1,0,0|1,0,0]=3 1313 B12R1.1120 C=CCN1C(=O)CCCCC1=O Amb25829724 [0,1,0,1,0,0|1,0,1]=4 1314 B12R1.1120 CC1CCCCC(=O)C1CC=C Amb24584468 [0,1,0,1,0,0|1,0,0]=3 1315 B12R1.1120 CC=1CCCCC(=O)C1CC=C Amb24706848 [0,1,0,1,0,0|1,0,0]=3 1316 B12R1.1120 C[C@H]1CCCCC(=O)[C@@H]1CC=C Amb24512688 [0,1,0,1,0,0|1,0,0]=3 1317 B12R1.28 CCCCCC1=CC=CC(=O)O1 Amb19668103 [0,1,0,1,0,0|1,0,1]=4 1318 B12R1.35 BrCCCCC(=O)c1ccco1 Amb10562219 [0,1,0,1,0,0|1,0,1]=4 1319 B12R1.35 CCCCOC(=O)c1ccco1 Amb17939066 [0,1,0,1,0,0|1,0,1]=4 1320 B12R1.35 C\C=C\CNC(=O)[C@H]1CCCN1 Amb24536435 [0,1,0,1,0,0|2,0,0]=4 1321 B12R1.154 O=C1CCCC(=O)CCCCC1 Amb25667597 [0,1,0,1,0,0|1,0,1]=4 1322 B12R1.154 O=C1CCCCCC(=O)OCC1 Amb25373050 [0,1,0,1,0,0|0,0,1]=3 1323 B12R1.154 OC1CC=CCCC(=O)OCC1 Amb25092112 [0,1,0,1,0,0|2,0,0]=4 1324 B12R1.268 C=C[C@H]1COC(=O)C[C@@H]1CC=O Amb24760806 [0,1,0,1,0,0|1,0,1]=4 1325 B12R1.268 CCC1CCC(=O)NC1CC=C Amb25825095 [0,1,0,1,0,0|1,0,0]=3 1326 B12R1.268 CC[C@H]1CCC(=O)N[C@H]1CC=C Amb25212252 [0,1,0,1,0,0|1,0,0]=3 1327 B12R1.268 C\C=C/1\COC(=O)CC1CCO Amb25332303 [0,1,0,1,0,0|1,0,0]=3 1328 B12R1.803 C\C=C\CN1[C@@H](CCC1=O)CO Amb25681432 [0,1,0,1,0,0|2,0,0]=4 1329 B12R1.1098 CC1CN(CC=C)C(=O)CCN1 Amb24644035 [0,1,0,1,0,0|2,0,0]=4 1330 B12R1.1098 CC1CNCC(=O)N(CC=C)C1 Amb25160032 [0,1,0,1,0,0|2,0,0]=4 1331 B12R1.1631 C=CCCN1C(O)CCCC1=O Amb25156805 [0,1,0,1,0,0|2,0,0]=4 1332 B12R1.1631 CC1CCCC(=O)C1C\C=C\C Amb24456563 [0,1,0,1,0,0|1,0,0]=3 1333 B12R1.1631 CC1CCNC(=O)C1NCC=C Amb24525838 [0,1,0,1,0,0|2,0,0]=4 1334 B12R1.1631 CC=1CCCC(=O)C1C\C=C\C Amb25128887 [0,1,0,1,0,0|1,0,1]=4 1335 B12R1.1631 C[C@@H]1CCCC(=O)[C@H]1CCC=C Amb24582496 [0,1,0,1,0,0|1,0,0]=3 1336 B12R1.57 CC(=C)C1CCC(=O)CC1C=C Amb24594704 [0,1,0,1,0,0|1,0,1]=4 1337 B12R1.57 CC(=C)[C@H]1CCC(=O)C[C@@H]1C=C Amb25230663 [0,1,0,1,0,0|1,0,1]=4 1338 B12R1.57 C[C@H](O)[C@H]1CNC(=O)C[C@@H]1C=C Amb24733470 [0,1,0,1,0,0|2,0,0]=4 1339 B12R1.65 CC(C)CC1NC(=O)OC1C=C Amb24401614 [0,1,0,1,0,0|1,0,0]=3 1340 B12R1.65 CC(C)C[C@@H]1NC(=O)O[C@H]1C=C Amb25236003 [0,1,0,1,0,0|1,0,0]=3 1341 B12R1.65 CC(C)C[C@H]1NC(=O)O[C@H]1C=C Amb24555616 [0,1,0,1,0,0|1,0,0]=3 1342 B12R1.65 C[C@@H](O)C[C@@H]1OC(=O)O[C@@H]1C=C Amb24515263 [0,1,0,1,0,0|1,0,0]=3 1343 B12R1.65 C[C@@H](O)C[C@@H]1OC(=O)O[C@H]1C=C Amb24515262 [0,1,0,1,0,0|1,0,0]=3 1344 B12R1.489 CC(C)C1CCC(=O)C1CC=C Amb25258458 [0,1,0,1,0,0|1,0,0]=3 1345 B12R1.489 CC(C)C1COC(=O)N1CC=C Amb25137284 [0,1,0,1,0,0|2,0,0]=4 1346 B12R1.489 CC(C)[C@@H]1CCC(=O)[C@@H]1CC=C Amb24634660 [0,1,0,1,0,0|1,0,0]=3 1347 B12R1.489 CC(C)[C@@H]1CCC(=O)[C@H]1CC=C Amb25300490 [0,1,0,1,0,0|1,0,0]=3 1348 B12R1.489 CC(C)[C@H]1CCC(=O)[C@@H]1CC=C Amb24573291 [0,1,0,1,0,0|1,0,0]=3 1349 B12R1.874 CC(C)CC1C=CCCC(=O)N1 Amb25159611 [0,1,0,1,0,0|2,0,0]=4 1350 B12R1.874 CC(C)C[C@H]1C=CCCC(=O)N1 Amb25289118 [0,1,0,1,0,0|2,0,0]=4 1351 B12R1.895 CC(C)CCC1C(=O)CCC1=O Amb24445730 [0,1,0,1,0,0|2,0,0]=4 1352 B12R1.895 CC(C)CCC1C(=O)COC1=O Amb25335550 [0,1,0,1,0,0|1,0,0]=3 1353 B12R1.1113 CC1(C)CCCC(=O)C1CC=O Amb24497233 [0,1,0,1,0,0|2,0,0]=4 1354 B12R1.1113 CC1(C)CNCC(=O)N1CC=C Amb24497433 [0,1,0,1,0,0|2,0,0]=4 1355 B12R1.2028 CC1(C)CCN1C(=O)NCC=C Amb24362566 [0,1,0,1,0,0|2,0,0]=4 1356 B12R1.2028 CC1(C)CNC1C(=O)NCC=C Amb25749425 [0,1,0,1,0,0|2,0,0]=4 1357 B12R1.2043 CC1(C)CC1NC(=O)NCC=C Amb24557096 [0,1,0,1,0,0|2,0,0]=4 1358 B12R1.25 CC1CCC=C(OCC=C)C1=O Amb25714326 [0,1,0,1,0,0|0,0,1]=3 1359 B12R1.281 C=CCC=1CCCCCC1C=O Amb24497297 [0,1,0,1,0,0|1,0,0]=3 1360 B12R1.410 O=CC1CCC=CCCCCC1 Amb25289087 [0,1,0,1,0,0|1,0,1]=4 1361 B12R1.15 CC(C#N)OC(=O)C1CCCC1 Amb25739627 [0,1,0,1,0,0|1,0,1]=4 1362 B12R1.15 CC(C=C)NC(=O)C1CCCN1 Amb24420278 [0,1,0,1,0,0|2,0,0]=4 1363 B12R1.15 CC(C=C)NC(=O)C1CCCO1 Amb25058156 [0,1,0,1,0,0|2,0,0]=4 1364 B12R1.15 CC(C=C)NC(=O)C1CCCS1 Amb25080748 [0,1,0,1,0,0|2,0,0]=4 1365 B12R1.15 CC(C=C)NC(=O)C1CCNC1 Amb24409197 [0,1,0,1,0,0|2,0,0]=4 1366 B12R1.15 CC(C=C)NC(=O)N1CCCC1 Amb25706667 [0,1,0,1,0,0|2,0,0]=4 1367 B12R1.15 CC(C=C)NC(=O)[C@@H]1CCCN1 Amb25308612 [0,1,0,1,0,0|2,0,0]=4 1368 B12R1.15 CC(C=C)NC(=O)[C@H]1CCNC1 Amb25672321 [0,1,0,1,0,0|2,0,0]=4 1369 B12R1.303 CC(C=C)NC(=O)NC1CC1C Amb25295811 [0,1,0,1,0,0|2,0,0]=4 1370 B12R1.303 CC(C=C)NC(=O)N[C@@H]1C[C@H]1C Amb24746123 [0,1,0,1,0,0|2,0,0]=4 1371 B12R1.304 CC(C=C)NC(=O)NC1CCC1 Amb24721271 [0,1,0,1,0,0|2,0,0]=4 1372 B12R1.365 CC(C=C)C1CCCCCC1=O Amb18798692 [0,1,0,1,0,0|1,0,0]=3 1373 B12R1.658 CC(C=C)N1[C@@H](CCC1=O)CO Amb25856376 [0,1,0,1,0,0|2,0,0]=4 1374 B12R1.1624 CC1OC(=O)C(CCCC)C1=O Amb24621700 [0,1,0,1,0,0|1,0,0]=3 1375 B12R1.1624 CCCCC1C(=O)OC(=O)C1=O Amb24364090 [0,1,0,1,0,0|1,0,1]=4 1376 B12R1.1624 C[C@@H]1OC(=O)[C@@H](CCCC)[C@H]1O Amb24668948 [0,1,0,1,0,0|1,0,1]=4 1377 B12R1.1624 C[C@H]1OC(=O)[C@H](CCCC)[C@H]1O Amb24575288 [0,1,0,1,0,0|1,0,1]=4 1378 B12R1.1748 CC(C=C)NC=1CCCCCN1 Amb25281495 [0,1,0,1,0,0|2,0,0]=4 1379 B12R1.3441 CC1CCCC(=O)C1C(O)C=C Amb24690647 [0,1,0,1,0,0|1,0,0]=3 1380 B12R1.1482 C=CC[C@@]1(F)CCCCCC1=O Amb24706827 [0,1,0,1,0,0|1,0,0]=3 1381 B12R1.1482 CC1(CC=C)CCCCCC1=O Amb24537924 [0,1,0,1,0,0|1,0,0]=3 1382 B12R1.1482 C[C@@]1(CC=C)CCCCCC1=O Amb24532515 [0,1,0,1,0,0|1,0,0]=3 1383 B12R1.1482 C[C@]1(CC=C)CCCCCC1=O Amb25130627 [0,1,0,1,0,0|1,0,0]=3 1384 B12R1.2606 CC1(CC=C)[C@@H](O)CCCC1=O Amb24553639 [0,1,0,1,0,0|2,0,0]=4 1385 B12R1.2606 C[C@@H]1CCCC(=O)[C@@]1(C)CC=C Amb24686478 [0,1,0,1,0,0|1,0,0]=3 1386 B12R1.2606 C[C@@H]1CCCC(=O)[C@@]1(O)CC=C Amb24582528 [0,1,0,1,0,0|1,0,0]=3 1387 B12R1.2606 C[C@]1(CC=C)[C@@H](O)CCCC1=O Amb24512744 [0,1,0,1,0,0|2,0,0]=4 1388 B12R2.214 O=C1CC2CCCC1CC2=O Amb25347589 [0,0,0,2,0,0|2,0,0]=4 1389 B12R2.227 O=C1CC2C1CCCCC2=O Amb25116601 [0,0,0,2,0,0|2,0,0]=4 1390 B12R2.229 O=C1CCCCC2C=CCC12 Amb25233744 [0,0,0,2,0,0|1,0,0]=3 1391 B12R2.229 O=C1CCCC[C@@H]2C=CC[C@H]12 Amb25264728 [0,0,0,2,0,0|1,0,0]=3 1392 B12R2.455 O=C1CCCC2CC1CC=C2 Amb25151500 [0,0,0,2,0,0|1,0,0]=3 1393 B12R2.707 O=C1C2CCCCC1CC=C2 Amb25134164 [0,0,0,2,0,0|1,0,0]=3 1394 B12R2.899 C=CCC1C2OC2CCC1=O Amb24364104 [0,0,0,2,0,0|2,0,0]=4 1395 B12R2.1041 O=C1CC2CCCC=CC2C1 Amb24737650 [0,0,0,2,0,0|1,0,0]=3 1396 B12R2.1041 O=C1C[C@H]2CCCC=C[C@H]2C1 Amb24512488 [0,0,0,2,0,0|1,0,0]=3 1397 B12R2.1442 C=CCC1CCC2CC2C1=O Amb23594432 [0,0,0,2,0,0|1,0,0]=3 1398 B12R2.1442 C=CCC1CCC2OC2C1=O Amb25298471 [0,0,0,2,0,0|2,0,0]=4 1399 B12R2.2271 C=CCC12CC1CCCC2=O Amb24577824 [0,0,0,2,0,0|1,0,0]=3 1400 B12R2.2271 C=CC[C@@]12O[C@@H]1CCCC2=O Amb24544648 [0,0,0,2,0,0|2,0,0]=4 1401 B12R2.4834 C=C[C@@H]1[C@@H]2[C@H]1CCCCC2=O Amb24570879 [0,0,0,2,0,0|1,0,0]=3 1402 B12R2.7 O=C1C=CC=CC12CCCC2 Amb24709365 [0,0,0,2,0,0|1,0,1]=4 1403 B12R2.24 O=C1CC2C=CCCC2CC1 Amb24633634 [0,0,0,2,0,0|1,0,0]=3 1404 B12R2.24 O=C1CC[C@H]2CCCC[C@H]2O1 Amb24590114 [0,0,0,2,0,0|0,0,2]=4 1405 B12R2.24 O=C1C[C@H]2C=CCC[C@@H]2CC1 Amb24512484 [0,0,0,2,0,0|1,0,0]=3 1406 B12R2.162 COCC1C2C=CC1CC2=O Amb25828399 [0,0,0,2,0,0|2,0,0]=4 1407 B12R2.162 COCC1[C@@H]2C=C[C@H]1CC2=O Amb24722918 [0,0,0,2,0,0|2,0,0]=4 1408 B12R2.162 COCC1[C@H]2C=C[C@@H]1CC2=O Amb25299128 [0,0,0,2,0,0|2,0,0]=4 1409 B12R2.196 O[C@H]1C=CCN2[C@H]1CCC2=O Amb25179833 [0,0,0,2,0,0|2,0,0]=4 1410 B12R2.215 O=C1CC2CCCCC1C=C2 Amb24737413 [0,0,0,2,0,0|1,0,0]=3 1411 B12R2.1081 O=C1COC[C@@H]2CC=CC[C@H]12 Amb24602977 [0,0,0,2,0,0|2,0,0]=4 1412 B12R2.1081 O=C1OCCN2CCCCC21 Amb24095702 [0,0,0,2,0,0|1,0,1]=4 1413 B12R2.2336 C=CCOC1CC2CC1CC2 Amb25173989 [0,0,0,2,0,0|1,0,1]=4 1414 B12R2.612 CC1C=CC2CC(=O)NCC21 Amb25049220 [0,0,0,2,0,0|2,0,0]=4 1415 B12R2.612 CC1CCN2C(=O)CCC2=C1 Amb24626069 [0,0,0,2,0,0|2,0,0]=4 1416 B12R2.612 C[C@H]1C=C[C@@H]2CC(=O)NC[C@@H]21 Amb24591189 [0,0,0,2,0,0|2,0,0]=4 1417 B12R2.202 C=C1C[C@H]2CCCC(=O)[C@H]2C1 Amb24608173 [0,0,0,2,0,0|1,0,0]=3 1418 B12R2.202 O=C1CC2CCCC(=O)C2O1 Amb25371654 [0,0,0,2,0,0|1,0,0]=3 1419 B12R2.202 O=C1C[C@@H]2CCCC(=O)[C@@H]2N1 Amb24374166 [0,0,0,2,0,0|2,0,0]=4 1420 B12R2.202 O=C1C[C@@H]2CCCC(=O)[C@H]2O1 Amb24631522 [0,0,0,2,0,0|1,0,0]=3 1421 B12R2.202 O=C1C[C@@H]2CCCC(Br)[C@@H]2O1 Amb24680289 [0,0,0,2,0,0|1,0,1]=4 1422 B12R2.202 OC1CCC[C@@H]2CC(=O)O[C@@H]21 Amb25332298 [0,0,0,2,0,0|1,0,1]=4 1423 B12R2.202 O[C@H]1CCC[C@@H]2CC(=O)O[C@H]21 Amb24640278 [0,0,0,2,0,0|1,0,1]=4 1424 B12R2.375 OCC1C=CC2OC(=O)CC12 Amb25788213 [0,0,0,2,0,0|1,0,0]=3 1425 B12R2.375 OC[C@@H]1C=C[C@@H]2OC(=O)C[C@H]12 Amb25283007 [0,0,0,2,0,0|1,0,0]=3 1426 B12R2.375 OC[C@H]1C=C[C@@H]2CC(=O)C[C@@H]21 Amb24617701 [0,0,0,2,0,0|2,0,0]=4 1427 B12R2.586 O=C1CCC=2CCC=CCC21 Amb25066377 [0,0,0,2,0,0|1,0,1]=4 1428 B12R2.586 O=C1CC[C@H]2CCC=CCN12 Amb24062065 [0,0,0,2,0,0|1,0,0]=3 1429 B12R2.586 O=C1CC[C@H]2CCC=CC[C@H]12 Amb24586790 [0,0,0,2,0,0|1,0,0]=3 1430 B12R2.586 O=C1COC=2CCCCCC21 Amb25072762 [0,0,0,2,0,0|2,0,0]=4 1431 B12R2.2918 C=C1COC2(CCCCC2)O1 Amb25198632 [0,0,0,2,0,0|0,0,2]=4 1432 B12R2.2034 C=C1C=CC(=O)C12CCCC2 Amb25334920 [0,0,0,2,0,0|1,0,1]=4 1433 B12R2.2034 O=C1CCC(=O)C12CCCC2 Amb25150330 [0,0,0,2,0,0|2,0,0]=4 1434 B12R2.2034 O=C1COC(=O)C12CCCC2 Amb24456700 [0,0,0,2,0,0|1,0,0]=3 1435 B12R2.2034 O=C1OOC(=O)C12CCCC2 Amb17779662 [0,0,0,2,0,0|2,0,0]=4 1436 B12R2.2262 C=CC1OC(O)C2CC1CC2 Amb25734456 [0,0,0,2,0,0|0,0,2]=4 1437 B12R2.132 CC1CCC2CCC(=O)OC21 Amb25124486 [0,0,0,2,0,0|0,0,2]=4 1438 B12R2.132 O=C1CC2C(CC1)CCC2=O Amb25848147 [0,0,0,2,0,0|2,0,0]=4 1439 B12R2.114 O=C1C[C@@H]2CCCC2=CCC1 Amb24646606 [0,0,0,2,0,0|1,0,0]=3 1440 B12R2.1067 O=C1NC2C=CCCCCC12 Amb25311294 [0,0,0,2,0,0|1,0,0]=3 1441 B12R2.2474 O=C1CCC=CCCC2OC12 Amb25371871 [0,0,0,2,0,0|2,0,0]=4 1442 B12R2.1155 O=C1CC2CCCC(C1)C=C2 Amb25150176 [0,0,0,2,0,0|1,0,0]=3 1443 B12R2.1155 O=C1C[C@@H]2CCC[C@H](C1)C=C2 Amb24551519 [0,0,0,2,0,0|1,0,0]=3 1444 B12R2.5478 O=C1CC2(CCC2)C=CC=C1 Amb24486441 [0,0,0,2,0,0|1,0,1]=4 1445 B12R2.606 O=C1CC2CC(=O)C=CC2O1 Amb25767107 [0,0,0,2,0,0|1,0,1]=4 1446 B12R2.606 OC1CC2CC(=O)OC2C=C1 Amb25152147 [0,0,0,2,0,0|1,0,0]=3 1447 B12R2.2325 CC12CCCC(=O)C1CC=C2 Amb25128876 [0,0,0,2,0,0|1,0,0]=3 1448 B12R2.2325 C[C@]12CCCC(=O)[C@H]1CC=C2 Amb24631208 [0,0,0,2,0,0|1,0,0]=3 1449 B12R2.1154 O=C1CC2CCCC(C1)C2=O Amb23448494 [0,0,0,2,0,0|2,0,0]=4 1450 B12R2.1154 O=C1C[C@H]2CCC[C@@H](O1)C2Br Amb25195904 [0,0,0,2,0,0|1,0,1]=4 1451 B12R2.1316 O=C1COC(=O)N[C@H]1C2CC2 Amb24402950 [0,0,0,2,0,0|2,0,0]=4 1452 B12R2.630 O=C1CC2CCC(CC1)C2=O Amb25142623 [0,0,0,2,0,0|2,0,0]=4 1453 B12R2.3932 CC12CCC1C(=O)CCC2=O Amb25838751 [0,0,0,2,0,0|2,0,0]=4 1454 B12R2.3932 C[C@]12CC[C@H]1C(=O)CCC2=O Amb24584432 [0,0,0,2,0,0|2,0,0]=4 1455 B12R2.591 CC1[C@H]2CCC(=O)[C@H]2CC1=C Amb25271011 [0,0,0,2,0,0|1,0,0]=3 1456 B12R2.1076 CC1OC2CC(=O)N2CC1=C Amb24419852 [0,0,0,2,0,0|2,0,0]=4 1457 B12R2.5129 CC12CCCC(=O)C1CC2=O Amb25151557 [0,0,0,2,0,0|2,0,0]=4