0 B7R0.1 BrCCCCCCBr Amb2686735 [0,0,0,0,0,0|2,0,2]=4 1 B7R0.1 BrCC\C=C\CCBr Amb17612549 [0,0,0,0,0,0|2,0,2]=4 2 B7R0.1 BrC\C=C\C=C\CBr Amb28286695 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.1 C#CCCC#CCC Amb27777157 [0,0,0,0,0,0|1,0,3]=4 4 B7R0.1 C#CCCCCCC Amb3940499 [0,0,0,0,0,0|1,0,3]=4 5 B7R0.1 C#CCCCCCO Amb10603074 [0,0,0,0,0,0|0,0,4]=4 6 B7R0.1 C#CCCCSCC Amb25960035 [0,0,0,0,0,0|2,0,2]=4 7 B7R0.1 C#CCCNOCC Amb27964390 [0,0,0,0,0,0|3,0,1]=4 8 B7R0.1 C#CCCSCCC Amb27410296 [0,0,0,0,0,0|2,0,2]=4 9 B7R0.1 C#CCC\C=C\CC Amb33267869 [0,0,0,0,0,0|1,0,1]=2 10 B7R0.1 C#CCOCCCO Amb26043047 [0,0,0,0,0,0|1,0,3]=4 11 B7R0.1 C#CCSCCCO Amb17502862 [0,0,0,0,0,0|1,0,3]=4 12 B7R0.1 C#CC\C=C\CCC Amb33424838 [0,0,0,0,0,0|1,0,3]=4 13 B7R0.1 C#C\C=C\C=C\CO Amb28065184 [0,0,0,0,0,0|0,0,4]=4 14 B7R0.1 C#C\C=C\CCCO Amb10605296 [0,0,0,0,0,0|0,0,2]=2 15 B7R0.1 C#C\C=C\CNCC Amb25175071 [0,0,0,0,0,0|2,0,2]=4 16 B7R0.1 C=C=CCCCCCl Amb27986085 [0,0,0,0,0,0|1,0,3]=4 17 B7R0.1 C=C=CCCCCO Amb17593159 [0,0,0,0,0,0|0,0,3]=3 18 B7R0.1 C=CCCCCCC Amb3940500 [0,0,0,0,0,0|1,0,3]=4 19 B7R0.1 C=CCCCCCO Amb4017321 [0,0,0,0,0,0|0,0,4]=4 20 B7R0.1 C=CCCCNCC Amb28461005 [0,0,0,0,0,0|2,0,2]=4 21 B7R0.1 C=CCCCNCC Amb32988644 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.1 C=CCCCSCC Amb27600986 [0,0,0,0,0,0|2,0,2]=4 23 B7R0.1 C=CCCC\C=C\C Amb24700388 [0,0,0,0,0,0|1,0,3]=4 24 B7R0.1 C=CCCNCCC Amb27796644 [0,0,0,0,0,0|2,0,2]=4 25 B7R0.1 C=CCCSCCC Amb27806215 [0,0,0,0,0,0|2,0,2]=4 26 B7R0.1 C=CCC\C=C\CO Amb27406831 [0,0,0,0,0,0|2,0,1]=3 27 B7R0.1 C=CCNCCCO Amb17308751 [0,0,0,0,0,0|1,0,3]=4 28 B7R0.1 C=CCOCCCO Amb25097051 [0,0,0,0,0,0|1,0,3]=4 29 B7R0.1 C=CC\C=C\CCC Amb4035888 [0,0,0,0,0,0|1,0,3]=4 30 B7R0.1 C=COCCCCO Amb8517109 [0,0,0,0,0,0|1,0,3]=4 31 B7R0.1 C=C\C=C\CCC=C Amb26026784 [0,0,0,0,0,0|1,0,3]=4 32 B7R0.1 C=C\C=C\CCCC Amb22729011 [0,0,0,0,0,0|1,0,2]=3 33 B7R0.1 C=C\C=C\CCCCl Amb28132447 [0,0,0,0,0,0|1,0,2]=3 34 B7R0.1 C=C\C=C\CCNC Amb18641669 [0,0,0,0,0,0|2,0,2]=4 35 B7R0.1 CC#CC#CCCO Amb28194224 [0,0,0,0,0,0|0,0,4]=4 36 B7R0.1 CC#CCCCCBr Amb27459340 [0,0,0,0,0,0|1,0,3]=4 37 B7R0.1 CC#CCCCCC Amb9134714 [0,0,0,0,0,0|1,0,3]=4 38 B7R0.1 CC#CCCCCO Amb17593158 [0,0,0,0,0,0|0,0,3]=3 39 B7R0.1 CC#CC\C=C\CO Amb27969438 [0,0,0,0,0,0|2,0,2]=4 40 B7R0.1 CC=C=CCCCC Amb28284500 [0,0,0,0,0,0|1,0,2]=3 41 B7R0.1 CC=C=C\C=C\CO Amb27853778 [0,0,0,0,0,0|0,0,4]=4 42 B7R0.1 CCC#CC#CCO Amb27946590 [0,0,0,0,0,0|0,0,4]=4 43 B7R0.1 CCC#CCCCBr Amb24443559 [0,0,0,0,0,0|1,0,2]=3 44 B7R0.1 CCC#CCCCC Amb4017968 [0,0,0,0,0,0|1,0,2]=3 45 B7R0.1 CCC#CCCCCl Amb28188357 [0,0,0,0,0,0|1,0,2]=3 46 B7R0.1 CCC#CCCCN Amb27838381 [0,0,0,0,0,0|1,0,2]=3 47 B7R0.1 CCC#CCCNC Amb27838421 [0,0,0,0,0,0|2,0,2]=4 48 B7R0.1 CCC#CSCCCl Amb27597938 [0,0,0,0,0,0|2,0,2]=4 49 B7R0.1 CCC#C\C=C\CBr Amb27637753 [0,0,0,0,0,0|2,0,2]=4 50 B7R0.1 CCC#C\C=C\CO Amb17779113 [0,0,0,0,0,0|0,0,4]=4 51 B7R0.1 CCCC#CCCC Amb8514642 [0,0,0,0,0,0|1,0,3]=4 52 B7R0.1 CCCC#CCCO Amb2721487 [0,0,0,0,0,0|0,0,3]=3 53 B7R0.1 CCCC=C=CCN Amb27838307 [0,0,0,0,0,0|1,0,3]=4 54 B7R0.1 CCCCC#CCBr Amb17670640 [0,0,0,0,0,0|2,0,2]=4 55 B7R0.1 CCCCCCC#N Amb7764659 [0,0,0,0,0,0|1,0,3]=4 56 B7R0.1 CCCCCCC=O Amb3939948 [0,0,0,0,0,0|0,0,4]=4 57 B7R0.1 CCCCCCCBr Amb3941482 [0,0,0,0,0,0|1,0,2]=3 58 B7R0.1 CCCCCCCC Amb8513274 [0,0,0,0,0,0|1,0,2]=3 59 B7R0.1 CCCCCCCCl Amb6608669 [0,0,0,0,0,0|1,0,2]=3 60 B7R0.1 CCCCCCCI Amb3940283 [0,0,0,0,0,0|1,0,2]=3 61 B7R0.1 CCCCCCCN Amb3940125 [0,0,0,0,0,0|1,0,2]=3 62 B7R0.1 CCCCCCCO Amb6608791 [0,0,0,0,0,0|0,0,2]=2 63 B7R0.1 CCCCCCC[Mg+] Amb22351260 [0,0,0,0,0,0|1,0,2]=3 64 B7R0.1 CCCCCCNC Amb4037010 [0,0,0,0,0,0|2,0,2]=4 65 B7R0.1 CCCCCCNN Amb7786617 [0,0,0,0,0,0|2,0,2]=4 66 B7R0.1 CCCCCCNO Amb24591654 [0,0,0,0,0,0|1,0,2]=3 67 B7R0.1 CCCCCCNO Amb32687464 [0,0,0,0,0,0|1,0,2]=3 68 B7R0.1 CCCCCCON Amb18641933 [0,0,0,0,0,0|2,0,2]=4 69 B7R0.1 CCCCCCSC Amb22359692 [0,0,0,0,0,0|2,0,2]=4 70 B7R0.1 CCCCCC[Mg]Br Amb22337740 [0,0,0,0,0,0|2,0,2]=4 71 B7R0.1 CCCCCC[Mg]Cl Amb22337541 [0,0,0,0,0,0|2,0,2]=4 72 B7R0.1 CCCCCNCC Amb6243353 [0,0,0,0,0,0|2,0,1]=3 73 B7R0.1 CCCCCNCN Amb28388761 [0,0,0,0,0,0|2,0,2]=4 74 B7R0.1 CCCCCNCO Amb28133981 [0,0,0,0,0,0|1,0,2]=3 75 B7R0.1 CCCCCOCC Amb22733705 [0,0,0,0,0,0|2,0,1]=3 76 B7R0.1 CCCCCSSC Amb25679654 [0,0,0,0,0,0|3,0,1]=4 77 B7R0.1 CCCCC\C=C\Br Amb27985859 [0,0,0,0,0,0|2,0,2]=4 78 B7R0.1 CCCCC\C=C\Cl Amb28384465 [0,0,0,0,0,0|2,0,2]=4 79 B7R0.1 CCCCC\C=C\I Amb22641605 [0,0,0,0,0,0|2,0,2]=4 80 B7R0.1 CCCCC\C=N\N Amb27837897 [0,0,0,0,0,0|3,0,1]=4 81 B7R0.1 CCCCC\C=N\O Amb27477089 [0,0,0,0,0,0|1,0,3]=4 82 B7R0.1 CCCCNCCC Amb3939261 [0,0,0,0,0,0|2,0,1]=3 83 B7R0.1 CCCCNCCF Amb27597327 [0,0,0,0,0,0|2,0,2]=4 84 B7R0.1 CCCCNCCN Amb4020675 [0,0,0,0,0,0|2,0,2]=4 85 B7R0.1 CCCCNCCO Amb2685641 [0,0,0,0,0,0|1,0,2]=3 86 B7R0.1 CCCCNCCS Amb22232390 [0,0,0,0,0,0|1,1,2]=4 87 B7R0.1 CCCCOCCBr Amb2720768 [0,0,0,0,0,0|2,0,2]=4 88 B7R0.1 CCCCOCCCl Amb8873731 [0,0,0,0,0,0|2,0,2]=4 89 B7R0.1 CCCCOCCI Amb24474438 [0,0,0,0,0,0|2,0,2]=4 90 B7R0.1 CCCCOCCN Amb8895131 [0,0,0,0,0,0|2,0,2]=4 91 B7R0.1 CCCCOCCO Amb3939290 [0,0,0,0,0,0|1,0,2]=3 92 B7R0.1 CCCCO\C=C/Cl Amb27777227 [0,0,0,0,0,0|3,0,1]=4 93 B7R0.1 CCCCO\C=C\Br Amb27858551 [0,0,0,0,0,0|3,0,1]=4 94 B7R0.1 CCCCPCCN Amb27831609 [0,0,0,0,0,0|2,0,2]=4 95 B7R0.1 CCCCSCCC Amb4017586 [0,0,0,0,0,0|2,0,1]=3 96 B7R0.1 CCCCSCCCl Amb9479748 [0,0,0,0,0,0|2,0,2]=4 97 B7R0.1 CCCCSCCN Amb2209242 [0,0,0,0,0,0|2,0,2]=4 98 B7R0.1 CCCCSCCO Amb1032995 [0,0,0,0,0,0|1,0,2]=3 99 B7R0.1 CCCCSSCC Amb26515761 [0,0,0,0,0,0|3,0,0]=3 100 B7R0.1 CCCCS\C=C/Cl Amb28048891 [0,0,0,0,0,0|3,0,1]=4 101 B7R0.1 CCCC\C=C\C#N Amb18641342 [0,0,0,0,0,0|2,0,1]=3 102 B7R0.1 CCCC\C=C\C=O Amb2720528 [0,0,0,0,0,0|2,0,1]=3 103 B7R0.1 CCCC\C=C\CN Amb25175053 [0,0,0,0,0,0|2,0,0]=2 104 B7R0.1 CCCC\C=C\CO Amb8514979 [0,0,0,0,0,0|2,0,0]=2 105 B7R0.1 CCCC\C=N\OC Amb27969362 [0,0,0,0,0,0|3,0,0]=3 106 B7R0.1 CCCC\N=C\CCl Amb28141548 [0,0,0,0,0,0|3,0,0]=3 107 B7R0.1 CCCNCCC#N Amb2690405 [0,0,0,0,0,0|2,0,2]=4 108 B7R0.1 CCCNCCC=O Amb27838403 [0,0,0,0,0,0|1,0,3]=4 109 B7R0.1 CCCNCCCCl Amb27593175 [0,0,0,0,0,0|2,0,1]=3 110 B7R0.1 CCCNCCCN Amb8515464 [0,0,0,0,0,0|2,0,1]=3 111 B7R0.1 CCCNCCCO Amb6733725 [0,0,0,0,0,0|1,0,1]=2 112 B7R0.1 CCCNCCSC Amb27162672 [0,0,0,0,0,0|3,0,1]=4 113 B7R0.1 CCCNNCCC Amb27818086 [0,0,0,0,0,0|3,0,1]=4 114 B7R0.1 CCCNOCCC Amb27792152 [0,0,0,0,0,0|3,0,1]=4 115 B7R0.1 CCCNOCCO Amb28139467 [0,0,0,0,0,0|2,0,1]=3 116 B7R0.1 CCCN\C=C\C#N Amb27424747 [0,0,0,0,0,0|3,0,1]=4 117 B7R0.1 CCCOCCCBr Amb8874784 [0,0,0,0,0,0|2,0,1]=3 118 B7R0.1 CCCOCCCCl Amb8874785 [0,0,0,0,0,0|2,0,1]=3 119 B7R0.1 CCCOCCCN Amb3940017 [0,0,0,0,0,0|2,0,1]=3 120 B7R0.1 CCCOCCCO Amb19962968 [0,0,0,0,0,0|1,0,1]=2 121 B7R0.1 CCCOCCCS Amb27212962 [0,0,0,0,0,0|1,1,1]=3 122 B7R0.1 CCCONCCN Amb27838359 [0,0,0,0,0,0|3,0,1]=4 123 B7R0.1 CCCONCCO Amb27455527 [0,0,0,0,0,0|2,0,1]=3 124 B7R0.1 CCCSC#CCO Amb27835121 [0,0,0,0,0,0|1,0,3]=4 125 B7R0.1 CCCSCCC#N Amb6680722 [0,0,0,0,0,0|2,0,2]=4 126 B7R0.1 CCCSCCCN Amb6680225 [0,0,0,0,0,0|2,0,1]=3 127 B7R0.1 CCCSCCCO Amb9370793 [0,0,0,0,0,0|1,0,1]=2 128 B7R0.1 CCCSCCON Amb27262198 [0,0,0,0,0,0|3,0,1]=4 129 B7R0.1 CCCSCCSC Amb27837913 [0,0,0,0,0,0|3,0,1]=4 130 B7R0.1 CCCSSCCO Amb27185480 [0,0,0,0,0,0|2,0,1]=3 131 B7R0.1 CCCSSSCC Amb26415260 [0,0,0,0,0,0|4,0,0]=4 132 B7R0.1 CCC[SiH2]CCCCl Amb28208530 [0,0,0,0,0,0|1,1,1]=3 133 B7R0.1 CCC\C=C/CCC Amb27838401 [0,0,0,0,0,0|1,0,2]=3 134 B7R0.1 CCC\C=C/CCO Amb22052625 [0,0,0,0,0,0|0,0,2]=2 135 B7R0.1 CCC\C=C\C=C\Cl Amb27657659 [0,0,0,0,0,0|2,0,2]=4 136 B7R0.1 CCC\C=C\CC#N Amb33172503 [0,0,0,0,0,0|1,0,3]=4 137 B7R0.1 CCC\C=C\CC=O Amb32954538 [0,0,0,0,0,0|0,0,4]=4 138 B7R0.1 CCC\C=C\CCBr Amb33242599 [0,0,0,0,0,0|1,0,2]=3 139 B7R0.1 CCC\C=C\CCC Amb9134769 [0,0,0,0,0,0|1,0,2]=3 140 B7R0.1 CCC\C=C\CCCl Amb32686957 [0,0,0,0,0,0|1,0,2]=3 141 B7R0.1 CCC\C=C\CCN Amb25221747 [0,0,0,0,0,0|1,0,2]=3 142 B7R0.1 CCC\C=C\CCO Amb22730273 [0,0,0,0,0,0|0,0,2]=2 143 B7R0.1 CCC\C=C\CCS Amb33373718 [0,0,0,0,0,0|0,1,2]=3 144 B7R0.1 CCC\C=C\CNC Amb33172653 [0,0,0,0,0,0|2,0,2]=4 145 B7R0.1 CCC\C=C\CNN Amb33425693 [0,0,0,0,0,0|2,0,2]=4 146 B7R0.1 CCC\C=C\CNO Amb33327497 [0,0,0,0,0,0|1,0,2]=3 147 B7R0.1 CCC\C=C\CON Amb33424912 [0,0,0,0,0,0|2,0,2]=4 148 B7R0.1 CCC\C=C\OCC Amb25074036 [0,0,0,0,0,0|2,0,1]=3 149 B7R0.1 CCC\C=N\CCO Amb28207113 [0,0,0,0,0,0|1,0,1]=2 150 B7R0.1 CCC\C=N\OCC Amb27880086 [0,0,0,0,0,0|3,0,1]=4 151 B7R0.1 CCNCCCCO Amb3940019 [0,0,0,0,0,0|1,0,1]=2 152 B7R0.1 CCNCCCOC Amb6730311 [0,0,0,0,0,0|3,0,1]=4 153 B7R0.1 CCNCCNCC Amb9885560 [0,0,0,0,0,0|3,0,1]=4 154 B7R0.1 CCNCCOCC Amb33529222 [0,0,0,0,0,0|3,0,1]=4 155 B7R0.1 CCNC\C=C/CO Amb28072875 [0,0,0,0,0,0|3,0,0]=3 156 B7R0.1 CCNC\C=C\CN Amb27972499 [0,0,0,0,0,0|3,0,0]=3 157 B7R0.1 CCNOCCOC Amb28315578 [0,0,0,0,0,0|4,0,0]=4 158 B7R0.1 CCOCCCC#N Amb6260880 [0,0,0,0,0,0|2,0,2]=4 159 B7R0.1 CCOCCCC=O Amb27236777 [0,0,0,0,0,0|1,0,3]=4 160 B7R0.1 CCOCCCCBr Amb8855444 [0,0,0,0,0,0|2,0,1]=3 161 B7R0.1 CCOCCCCCl Amb20242741 [0,0,0,0,0,0|2,0,1]=3 162 B7R0.1 CCOCCCCN Amb6249686 [0,0,0,0,0,0|2,0,1]=3 163 B7R0.1 CCOCCCCO Amb19148112 [0,0,0,0,0,0|1,0,1]=2 164 B7R0.1 CCOCCCON Amb18061683 [0,0,0,0,0,0|3,0,1]=4 165 B7R0.1 CCOCCOCC Amb8517552 [0,0,0,0,0,0|3,0,1]=4 166 B7R0.1 CCOC\C=C\CO Amb25221278 [0,0,0,0,0,0|3,0,0]=3 167 B7R0.1 CCOC\C=C\CS Amb28254606 [0,0,0,0,0,0|3,0,0]=3 168 B7R0.1 CCONCCC#N Amb27657635 [0,0,0,0,0,0|3,0,1]=4 169 B7R0.1 CCONCCCN Amb27244679 [0,0,0,0,0,0|3,0,0]=3 170 B7R0.1 CCONCCCO Amb28319900 [0,0,0,0,0,0|2,0,0]=2 171 B7R0.1 CCO\C=C/OCC Amb30621788 [0,0,0,0,0,0|3,0,1]=4 172 B7R0.1 CCO\C=C\CCO Amb28189265 [0,0,0,0,0,0|1,0,1]=2 173 B7R0.1 CCO\C=C\OCC Amb30621723 [0,0,0,0,0,0|3,0,1]=4 174 B7R0.1 CCSCCCC#N Amb6680685 [0,0,0,0,0,0|2,0,2]=4 175 B7R0.1 CCSCCCC=O Amb33323662 [0,0,0,0,0,0|1,0,3]=4 176 B7R0.1 CCSCCCCBr Amb9304999 [0,0,0,0,0,0|2,0,1]=3 177 B7R0.1 CCSCCCCCl Amb18796695 [0,0,0,0,0,0|2,0,1]=3 178 B7R0.1 CCSCCCCN Amb9391471 [0,0,0,0,0,0|2,0,1]=3 179 B7R0.1 CCSCCCCO Amb9370799 [0,0,0,0,0,0|1,0,1]=2 180 B7R0.1 CCSCCCCS Amb27223548 [0,0,0,0,0,0|1,1,1]=3 181 B7R0.1 CCSCCCNC Amb25044529 [0,0,0,0,0,0|3,0,1]=4 182 B7R0.1 CCSCCCNO Amb27778147 [0,0,0,0,0,0|2,0,1]=3 183 B7R0.1 CCSCCCON Amb26975230 [0,0,0,0,0,0|3,0,1]=4 184 B7R0.1 CCSCCSCC Amb4017493 [0,0,0,0,0,0|3,0,1]=4 185 B7R0.1 CCSCSCCCl Amb27645434 [0,0,0,0,0,0|3,0,1]=4 186 B7R0.1 CCSC\C=C\C=O Amb33323727 [0,0,0,0,0,0|3,0,1]=4 187 B7R0.1 CCSC\C=C\CN Amb33474425 [0,0,0,0,0,0|3,0,0]=3 188 B7R0.1 CCSC\C=C\CO Amb33475304 [0,0,0,0,0,0|3,0,0]=3 189 B7R0.1 CC\C=C/CCCO Amb22053865 [0,0,0,0,0,0|0,0,0]=0 190 B7R0.1 CC\C=C\C#CCO Amb28206471 [0,0,0,0,0,0|0,0,2]=2 191 B7R0.1 CC\C=C\C=C\C=O Amb8392847 [0,0,0,0,0,0|0,0,4]=4 192 B7R0.1 CC\C=C\C=C\CN Amb33267973 [0,0,0,0,0,0|1,0,2]=3 193 B7R0.1 CC\C=C\C=C\CO Amb32953372 [0,0,0,0,0,0|0,0,2]=2 194 B7R0.1 CC\C=C\CCC#N Amb33172608 [0,0,0,0,0,0|1,0,1]=2 195 B7R0.1 CC\C=C\CCC=O Amb27390797 [0,0,0,0,0,0|0,0,2]=2 196 B7R0.1 CC\C=C\CCCBr Amb27232700 [0,0,0,0,0,0|1,0,0]=1 197 B7R0.1 CC\C=C\CCCC Amb19930202 [0,0,0,0,0,0|1,0,0]=1 198 B7R0.1 CC\C=C\CCCCl Amb28410595 [0,0,0,0,0,0|1,0,0]=1 199 B7R0.1 CC\C=C\CCCN Amb33474692 [0,0,0,0,0,0|1,0,0]=1 200 B7R0.1 CC\C=C\CCCO Amb33172698 [0,0,0,0,0,0|0,0,0]=0 201 B7R0.1 CC\C=C\CCCS Amb32882557 [0,0,0,0,0,0|0,1,0]=1 202 B7R0.1 CC\C=C\CCNC Amb32953435 [0,0,0,0,0,0|2,0,0]=2 203 B7R0.1 CC\C=C\CCNN Amb27435651 [0,0,0,0,0,0|2,0,0]=2 204 B7R0.1 CC\C=C\CCON Amb33268245 [0,0,0,0,0,0|2,0,0]=2 205 B7R0.1 CC\C=C\CCSC Amb27397344 [0,0,0,0,0,0|2,0,0]=2 206 B7R0.1 CC\C=C\CN=C=O Amb33449407 [0,0,0,0,0,0|1,0,2]=3 207 B7R0.1 CC\C=C\CN=C=S Amb27431907 [0,0,0,0,0,0|1,1,1]=3 208 B7R0.1 CC\C=C\CN=[N+]=[N-] Amb32953646 [0,0,0,0,0,0|3,0,0]=3 209 B7R0.1 CC\C=N\CCCC Amb27946052 [0,0,0,0,0,0|2,0,0]=2 210 B7R0.1 CC\C=N\OCCCl Amb27770489 [0,0,0,0,0,0|3,0,0]=3 211 B7R0.1 CNCC#CCCO Amb26509827 [0,0,0,0,0,0|1,0,3]=4 212 B7R0.1 CNCCCCCF Amb27595210 [0,0,0,0,0,0|2,0,2]=4 213 B7R0.1 CNCCCCCI Amb27953747 [0,0,0,0,0,0|2,0,2]=4 214 B7R0.1 CNCCCCCN Amb23448496 [0,0,0,0,0,0|2,0,2]=4 215 B7R0.1 CNCCCCCO Amb17334069 [0,0,0,0,0,0|1,0,2]=3 216 B7R0.1 CNCCCCCO Amb33551687 [0,0,0,0,0,0|1,0,2]=3 217 B7R0.1 CNCCNCCO Amb4020109 [0,0,0,0,0,0|2,0,2]=4 218 B7R0.1 CNCCOCCO Amb33536922 [0,0,0,0,0,0|2,0,2]=4 219 B7R0.1 CNCCSCCO Amb27475549 [0,0,0,0,0,0|2,0,2]=4 220 B7R0.1 COCC#CCCO Amb28069664 [0,0,0,0,0,0|1,0,3]=4 221 B7R0.1 COCCCCCBr Amb18182548 [0,0,0,0,0,0|2,0,2]=4 222 B7R0.1 COCCCCCCl Amb9001649 [0,0,0,0,0,0|2,0,2]=4 223 B7R0.1 COCCCCCI Amb27603403 [0,0,0,0,0,0|2,0,2]=4 224 B7R0.1 COCCCCCN Amb13951647 [0,0,0,0,0,0|2,0,2]=4 225 B7R0.1 COCCCCCO Amb19374978 [0,0,0,0,0,0|1,0,2]=3 226 B7R0.1 COCCCCCS Amb25138209 [0,0,0,0,0,0|1,1,2]=4 227 B7R0.1 COCCNCCO Amb3939014 [0,0,0,0,0,0|2,0,2]=4 228 B7R0.1 COCCOCCO Amb4605829 [0,0,0,0,0,0|2,0,2]=4 229 B7R0.1 COCCSCCO Amb9273918 [0,0,0,0,0,0|2,0,2]=4 230 B7R0.1 COCC\C=C\C=O Amb33377482 [0,0,0,0,0,0|3,0,1]=4 231 B7R0.1 COCC\C=C\CCl Amb10844762 [0,0,0,0,0,0|3,0,0]=3 232 B7R0.1 COCC\C=C\CN Amb33474375 [0,0,0,0,0,0|3,0,0]=3 233 B7R0.1 COCC\C=C\CO Amb32954125 [0,0,0,0,0,0|3,0,0]=3 234 B7R0.1 COCOCCCBr Amb28385749 [0,0,0,0,0,0|3,0,1]=4 235 B7R0.1 COCOCCCCl Amb27194584 [0,0,0,0,0,0|3,0,1]=4 236 B7R0.1 COCOCCCN Amb25989339 [0,0,0,0,0,0|3,0,1]=4 237 B7R0.1 COCOCCCO Amb23591016 [0,0,0,0,0,0|2,0,1]=3 238 B7R0.1 CONCCCCF Amb28401069 [0,0,0,0,0,0|3,0,1]=4 239 B7R0.1 CO\C=C\CCC=O Amb18641790 [0,0,0,0,0,0|1,0,2]=3 240 B7R0.1 CSCCCCCBr Amb25052398 [0,0,0,0,0,0|2,0,2]=4 241 B7R0.1 CSCCCCCCl Amb18179464 [0,0,0,0,0,0|2,0,2]=4 242 B7R0.1 CSCCCCCF Amb28049310 [0,0,0,0,0,0|2,0,2]=4 243 B7R0.1 CSCCCCCN Amb24271082 [0,0,0,0,0,0|2,0,2]=4 244 B7R0.1 CSCCCCCO Amb24271084 [0,0,0,0,0,0|1,0,2]=3 245 B7R0.1 CSCCCCCS Amb24633807 [0,0,0,0,0,0|1,1,2]=4 246 B7R0.1 CSCCOCCO Amb28368979 [0,0,0,0,0,0|2,0,2]=4 247 B7R0.1 CSCC\C=C\C=O Amb32953448 [0,0,0,0,0,0|3,0,1]=4 248 B7R0.1 CSCC\C=C\CN Amb33198278 [0,0,0,0,0,0|3,0,0]=3 249 B7R0.1 CSCC\C=C\CO Amb33198279 [0,0,0,0,0,0|3,0,0]=3 250 B7R0.1 CSCOCCCBr Amb27477765 [0,0,0,0,0,0|3,0,1]=4 251 B7R0.1 C\C=C/CCCCC Amb4035902 [0,0,0,0,0,0|1,0,2]=3 252 B7R0.1 C\C=C/CCCCO Amb4019856 [0,0,0,0,0,0|0,0,2]=2 253 B7R0.1 C\C=C\C#CCCO Amb15695309 [0,0,0,0,0,0|0,0,3]=3 254 B7R0.1 C\C=C\C=C\CCBr Amb28201639 [0,0,0,0,0,0|1,0,2]=3 255 B7R0.1 C\C=C\C=C\CCC Amb27493119 [0,0,0,0,0,0|1,0,2]=3 256 B7R0.1 C\C=C\C=C\CCN Amb28245294 [0,0,0,0,0,0|1,0,2]=3 257 B7R0.1 C\C=C\C=C\CCO Amb27459750 [0,0,0,0,0,0|0,0,2]=2 258 B7R0.1 C\C=C\CCCCC Amb8513437 [0,0,0,0,0,0|1,0,2]=3 259 B7R0.1 C\C=C\CCCCN Amb27209196 [0,0,0,0,0,0|1,0,2]=3 260 B7R0.1 C\C=C\CNCCC Amb28127654 [0,0,0,0,0,0|2,0,2]=4 261 B7R0.1 C\C=C\CNCCN Amb27983366 [0,0,0,0,0,0|2,0,2]=4 262 B7R0.1 C\C=C\CSCCO Amb9362982 [0,0,0,0,0,0|1,0,2]=3 263 B7R0.1 C\C=C\C\C=C\CBr Amb28051944 [0,0,0,0,0,0|2,0,2]=4 264 B7R0.1 C\C=C\SSCCC Amb25865705 [0,0,0,0,0,0|3,0,1]=4 265 B7R0.1 C\C=N/CCCCN Amb27838890 [0,0,0,0,0,0|2,0,2]=4 266 B7R0.1 ClCCCCCCBr Amb10602445 [0,0,0,0,0,0|2,0,2]=4 267 B7R0.1 ClCCCCCCCl Amb8513108 [0,0,0,0,0,0|2,0,2]=4 268 B7R0.1 ClCCCCCCI Amb20670134 [0,0,0,0,0,0|2,0,2]=4 269 B7R0.1 ClCCCCOCCl Amb27628371 [0,0,0,0,0,0|3,0,1]=4 270 B7R0.1 ClCCCNCCCl Amb13952668 [0,0,0,0,0,0|3,0,1]=4 271 B7R0.1 ClCCCNCCCl Amb18125911 [0,0,0,0,0,0|3,0,1]=4 272 B7R0.1 ClCCCSCCCl Amb24426165 [0,0,0,0,0,0|3,0,1]=4 273 B7R0.1 ClCC\C=C\CCCl Amb24481434 [0,0,0,0,0,0|2,0,2]=4 274 B7R0.1 ClCOCCCCBr Amb28195199 [0,0,0,0,0,0|3,0,1]=4 275 B7R0.1 ClC\C=C\C=C\CCl Amb27818096 [0,0,0,0,0,0|2,0,2]=4 276 B7R0.1 ClC\C=C\CCCCl Amb27421977 [0,0,0,0,0,0|2,0,0]=2 277 B7R0.1 FCCCCCCCl Amb27817669 [0,0,0,0,0,0|2,0,2]=4 278 B7R0.1 FCCCCCCI Amb25080138 [0,0,0,0,0,0|2,0,2]=4 279 B7R0.1 FCCCCCCS Amb24569228 [0,0,0,0,0,0|1,1,2]=4 280 B7R0.1 FCCNCCCCl Amb27233248 [0,0,0,0,0,0|3,0,1]=4 281 B7R0.1 FCCSCCCCl Amb27172909 [0,0,0,0,0,0|3,0,1]=4 282 B7R0.1 ICCCCCCI Amb8514815 [0,0,0,0,0,0|2,0,2]=4 283 B7R0.1 N#CCCCCCO Amb27665577 [0,0,0,0,0,0|1,0,3]=4 284 B7R0.1 N#CCC\C=C\CN Amb28241261 [0,0,0,0,0,0|2,0,1]=3 285 B7R0.1 N#CCOCCCO Amb24720648 [0,0,0,0,0,0|2,0,2]=4 286 B7R0.1 N#C\C=C\CCC#N Amb4016497 [0,0,0,0,0,0|2,0,2]=4 287 B7R0.1 NCCC#CCCO Amb27229366 [0,0,0,0,0,0|1,0,3]=4 288 B7R0.1 NCCCCCCBr Amb18648322 [0,0,0,0,0,0|2,0,2]=4 289 B7R0.1 NCCCCCCCl Amb31030966 [0,0,0,0,0,0|2,0,2]=4 290 B7R0.1 NCCCCCCF Amb28314228 [0,0,0,0,0,0|2,0,2]=4 291 B7R0.1 NCCCCCCN Amb2573303 [0,0,0,0,0,0|2,0,2]=4 292 B7R0.1 NCCCCCCN Amb8516658 [0,0,0,0,0,0|2,0,2]=4 293 B7R0.1 NCCCCCCO Amb2720515 [0,0,0,0,0,0|1,0,2]=3 294 B7R0.1 NCCCCCCS Amb18642745 [0,0,0,0,0,0|1,1,2]=4 295 B7R0.1 NCCCCCCS Amb24099361 [0,0,0,0,0,0|1,1,2]=4 296 B7R0.1 NCCCCCNO Amb24381036 [0,0,0,0,0,0|2,0,2]=4 297 B7R0.1 NCCCCCNO Amb33483225 [0,0,0,0,0,0|2,0,2]=4 298 B7R0.1 NCCCNCCBr Amb26319089 [0,0,0,0,0,0|3,0,1]=4 299 B7R0.1 NCCCNCCBr Amb8391138 [0,0,0,0,0,0|3,0,1]=4 300 B7R0.1 NCCCNCCF Amb28076267 [0,0,0,0,0,0|3,0,1]=4 301 B7R0.1 NCCCNCCN Amb2725582 [0,0,0,0,0,0|3,0,1]=4 302 B7R0.1 NCCCNCCO Amb4035734 [0,0,0,0,0,0|2,0,2]=4 303 B7R0.1 NCCCNCCS Amb17607860 [0,0,0,0,0,0|3,0,1]=4 304 B7R0.1 NCCCOCCCl Amb27199285 [0,0,0,0,0,0|3,0,1]=4 305 B7R0.1 NCCCOCCF Amb27169291 [0,0,0,0,0,0|3,0,1]=4 306 B7R0.1 NCCCOCCF Amb33299411 [0,0,0,0,0,0|3,0,1]=4 307 B7R0.1 NCCCOCCO Amb33534338 [0,0,0,0,0,0|2,0,2]=4 308 B7R0.1 NCCCSCCO Amb9481738 [0,0,0,0,0,0|2,0,2]=4 309 B7R0.1 NCCC\C=C/CO Amb27838308 [0,0,0,0,0,0|2,0,0]=2 310 B7R0.1 NCCC\C=C\CO Amb24117506 [0,0,0,0,0,0|2,0,0]=2 311 B7R0.1 NCCC\C=C\CO Amb33734220 [0,0,0,0,0,0|2,0,0]=2 312 B7R0.1 NCCC\C=C\CO Amb33743765 [0,0,0,0,0,0|2,0,0]=2 313 B7R0.1 NCCNCCCCl Amb27429827 [0,0,0,0,0,0|3,0,1]=4 314 B7R0.1 NCCNCCCO Amb22732348 [0,0,0,0,0,0|2,0,1]=3 315 B7R0.1 NCCOCCCBr Amb33804025 [0,0,0,0,0,0|3,0,1]=4 316 B7R0.1 NCCOCCCBr Amb33804759 [0,0,0,0,0,0|3,0,1]=4 317 B7R0.1 NCCOCCCCl Amb33803399 [0,0,0,0,0,0|3,0,1]=4 318 B7R0.1 NCCOCCCCl Amb33804230 [0,0,0,0,0,0|3,0,1]=4 319 B7R0.1 NCCOCCCO Amb33551903 [0,0,0,0,0,0|2,0,1]=3 320 B7R0.1 NCCOCCCO Amb9392883 [0,0,0,0,0,0|2,0,1]=3 321 B7R0.1 NCCSCCCF Amb28284467 [0,0,0,0,0,0|3,0,1]=4 322 B7R0.1 NCCSCCCO Amb8876329 [0,0,0,0,0,0|2,0,1]=3 323 B7R0.1 O=C=NCCCCO Amb27758809 [0,0,0,0,0,0|2,0,2]=4 324 B7R0.1 O=CCCCCCO Amb18641885 [0,0,0,0,0,0|1,0,3]=4 325 B7R0.1 O=CCSCCCO Amb27871143 [0,0,0,0,0,0|2,0,2]=4 326 B7R0.1 O=CNCCCCO Amb28187191 [0,0,0,0,0,0|2,0,2]=4 327 B7R0.1 O=C\C=C\C=C\CO Amb27424442 [0,0,0,0,0,0|1,0,3]=4 328 B7R0.1 O=C\C=C\CCC=O Amb18124241 [0,0,0,0,0,0|1,0,3]=4 329 B7R0.1 OCC#CCCCO Amb22365275 [0,0,0,0,0,0|1,0,2]=3 330 B7R0.1 OCCC#CCCO Amb2721707 [0,0,0,0,0,0|1,0,3]=4 331 B7R0.1 OCCCCCCBr Amb24063183 [0,0,0,0,0,0|1,0,2]=3 332 B7R0.1 OCCCCCCBr Amb8514955 [0,0,0,0,0,0|1,0,2]=3 333 B7R0.1 OCCCCCCCl Amb2686112 [0,0,0,0,0,0|1,0,2]=3 334 B7R0.1 OCCCCCCF Amb24428671 [0,0,0,0,0,0|1,0,2]=3 335 B7R0.1 OCCCCCCI Amb28048917 [0,0,0,0,0,0|1,0,2]=3 336 B7R0.1 OCCCCCCO Amb6869970 [0,0,0,0,0,0|1,0,2]=3 337 B7R0.1 OCCCCCCS Amb9786744 [0,0,0,0,0,0|1,0,2]=3 338 B7R0.1 OCCCC\C=N\O Amb22336271 [0,0,0,0,0,0|2,0,1]=3 339 B7R0.1 OCCCNCCCl Amb27599845 [0,0,0,0,0,0|2,0,1]=3 340 B7R0.1 OCCCNCCO Amb4034437 [0,0,0,0,0,0|2,0,1]=3 341 B7R0.1 OCCCOCCCl Amb28194887 [0,0,0,0,0,0|2,0,1]=3 342 B7R0.1 OCCCSCCO Amb33531539 [0,0,0,0,0,0|2,0,1]=3 343 B7R0.1 OCCNCCCCl Amb27655296 [0,0,0,0,0,0|2,0,2]=4 344 B7R0.1 OCCOCCCCl Amb28128414 [0,0,0,0,0,0|2,0,2]=4 345 B7R0.1 OCCOCCCF Amb22008105 [0,0,0,0,0,0|2,0,2]=4 346 B7R0.1 OCCSSCCO Amb8513773 [0,0,0,0,0,0|3,0,1]=4 347 B7R0.1 OCC\C=C/CCCl Amb27424782 [0,0,0,0,0,0|1,0,2]=3 348 B7R0.1 OCC\C=C\CCO Amb17614949 [0,0,0,0,0,0|1,0,2]=3 349 B7R0.1 OCOCCOCO Amb24609373 [0,0,0,0,0,0|3,0,1]=4 350 B7R0.1 OC\C=C/C=C\CO Amb26515771 [0,0,0,0,0,0|1,0,2]=3 351 B7R0.1 OC\C=C/CCCCl Amb27862350 [0,0,0,0,0,0|2,0,0]=2 352 B7R0.1 OC\C=C\C=C\CO Amb33328625 [0,0,0,0,0,0|1,0,2]=3 353 B7R0.1 OC\C=C\CCCO Amb27205649 [0,0,0,0,0,0|1,0,0]=1 354 B7R0.1 O\C=C\C=C\CCO Amb27605420 [0,0,0,0,0,0|1,0,2]=3 355 B7R0.1 S=C=NC\C=C/CCl Amb27453545 [0,0,0,0,0,0|2,1,1]=4 356 B7R0.1 S=C=NC\C=C\CCl Amb28203941 [0,0,0,0,0,0|2,1,1]=4 357 B7R0.1 SCCCSCCS Amb27656809 [0,0,0,0,0,0|2,1,1]=4 358 B7R0.1 [C-]#[N+]CCCCCC Amb2235425 [0,0,0,0,0,0|2,0,2]=4 359 B7R0.1 [C-]#[N+]CCCOCC Amb3973110 [0,0,0,0,0,0|3,0,1]=4 360 B7R0.1 [C-]#[N+]CCCSCC Amb33324017 [0,0,0,0,0,0|3,0,1]=4 361 B7R0.1 [C-]#[N+]CCOCCC Amb1981102 [0,0,0,0,0,0|3,0,1]=4 362 B7R0.1 [C-]#[N+]CC\C=C\CC Amb33268261 [0,0,0,0,0,0|2,0,0]=2 363 B7R0.1 [C-]#[N+]C\C=C\CCC Amb33327126 [0,0,0,0,0,0|2,0,2]=4 364 B7R0.1 [N-]=[N+]=NCCCCO Amb20623556 [0,0,0,0,0,0|3,0,1]=4 365 B7R0.1 [N-]=[N+]=NC\C=C\CCl Amb28428354 [0,0,0,0,0,0|4,0,0]=4 366 B7R0.1 [N-]=[N+]=NC\C=C\CO Amb27635137 [0,0,0,0,0,0|4,0,0]=4 367 B6R0.6 BrCCCCCBr Amb6608668 [1,0,0,0,0,0|2,0,1]=4 368 B6R0.6 C#CCCCCC Amb6297206 [1,0,0,0,0,0|1,0,2]=4 369 B6R0.6 C#CCCCCO Amb6336500 [1,0,0,0,0,0|0,0,3]=4 370 B6R0.6 C#CCCOCC Amb33169090 [1,0,0,0,0,0|2,0,1]=4 371 B6R0.6 C#CCCSCC Amb24670860 [1,0,0,0,0,0|2,0,1]=4 372 B6R0.6 C#CC\C=C\CC Amb33267986 [1,0,0,0,0,0|0,0,2]=3 373 B6R0.6 C#CC\C=C\CCl Amb24622483 [1,0,0,0,0,0|1,0,2]=4 374 B6R0.6 C#CC\C=C\CO Amb28398942 [1,0,0,0,0,0|1,0,2]=4 375 B6R0.6 C#C\C=C\CCC Amb33424839 [1,0,0,0,0,0|0,0,2]=3 376 B6R0.6 C=C=CCCCCl Amb17939722 [1,0,0,0,0,0|1,0,2]=4 377 B6R0.6 C=C=CCCCN Amb27222280 [1,0,0,0,0,0|1,0,2]=4 378 B6R0.6 C=C=CCCCO Amb10605300 [1,0,0,0,0,0|0,0,2]=3 379 B6R0.6 C=C=COCCO Amb25721997 [1,0,0,0,0,0|1,0,2]=4 380 B6R0.6 C=CC#CCCO Amb17593058 [1,0,0,0,0,0|0,0,3]=4 381 B6R0.6 C=CCCCCBr Amb3940222 [1,0,0,0,0,0|1,0,2]=4 382 B6R0.6 C=CCCCCC Amb3940498 [1,0,0,0,0,0|1,0,2]=4 383 B6R0.6 C=CCCCCCl Amb2692039 [1,0,0,0,0,0|1,0,2]=4 384 B6R0.6 C=CCCCCF Amb24409527 [1,0,0,0,0,0|1,0,2]=4 385 B6R0.6 C=CCCCCI Amb26858458 [1,0,0,0,0,0|1,0,2]=4 386 B6R0.6 C=CCCCCN Amb18639514 [1,0,0,0,0,0|1,0,2]=4 387 B6R0.6 C=CCCCCO Amb3940341 [1,0,0,0,0,0|0,0,2]=3 388 B6R0.6 C=CCCCNO Amb27437399 [1,0,0,0,0,0|1,0,2]=4 389 B6R0.6 C=CCCSCC Amb27213772 [1,0,0,0,0,0|2,0,1]=4 390 B6R0.6 C=CCC\C=C\C Amb22734684 [1,0,0,0,0,0|1,0,1]=3 391 B6R0.6 C=CCNCCO Amb6706545 [1,0,0,0,0,0|1,0,2]=4 392 B6R0.6 C=CCOCCO Amb3940609 [1,0,0,0,0,0|1,0,2]=4 393 B6R0.6 C=COCCCC Amb8513427 [1,0,0,0,0,0|2,0,1]=4 394 B6R0.6 C=COCCCCl Amb27613489 [1,0,0,0,0,0|2,0,1]=4 395 B6R0.6 C=COCCCF Amb22008255 [1,0,0,0,0,0|2,0,1]=4 396 B6R0.6 C=COCCCN Amb3997182 [1,0,0,0,0,0|2,0,1]=4 397 B6R0.6 C=CSCCCN Amb27800121 [1,0,0,0,0,0|2,0,1]=4 398 B6R0.6 C=C\C=C\CCBr Amb32679337 [1,0,0,0,0,0|1,0,2]=4 399 B6R0.6 C=C\C=C\CCC Amb33171502 [1,0,0,0,0,0|0,0,2]=3 400 B6R0.6 C=C\C=C\CCN Amb18639048 [1,0,0,0,0,0|1,0,2]=4 401 B6R0.6 C=C\C=C\CCN Amb32679368 [1,0,0,0,0,0|1,0,2]=4 402 B6R0.6 C=C\C=C\CCO Amb34916666 [1,0,0,0,0,0|0,0,2]=3 403 B6R0.6 C=C\C=C\CNC Amb25244153 [1,0,0,0,0,0|1,0,2]=4 404 B6R0.6 CC#CCCCBr Amb18791571 [1,0,0,0,0,0|1,0,2]=4 405 B6R0.6 CC#CCCCCl Amb27865837 [1,0,0,0,0,0|1,0,2]=4 406 B6R0.6 CC#CCCCO Amb20242139 [1,0,0,0,0,0|0,0,2]=3 407 B6R0.6 CC#C\C=C\CCl Amb27786901 [1,0,0,0,0,0|1,0,2]=4 408 B6R0.6 CC#C\C=C\CO Amb27808675 [1,0,0,0,0,0|0,0,3]=4 409 B6R0.6 CC=C=CCCI Amb27777241 [1,0,0,0,0,0|1,0,2]=4 410 B6R0.6 CC=C=CCCO Amb25888408 [1,0,0,0,0,0|0,0,2]=3 411 B6R0.6 CCC#CCCBr Amb24712364 [1,0,0,0,0,0|1,0,2]=4 412 B6R0.6 CCC#CCCC Amb9134713 [1,0,0,0,0,0|0,0,2]=3 413 B6R0.6 CCC#CCCCl Amb25147478 [1,0,0,0,0,0|1,0,2]=4 414 B6R0.6 CCC#CCCI Amb24636544 [1,0,0,0,0,0|1,0,2]=4 415 B6R0.6 CCC#CCCN Amb26415259 [1,0,0,0,0,0|1,0,2]=4 416 B6R0.6 CCC#CCCO Amb8514641 [1,0,0,0,0,0|0,0,2]=3 417 B6R0.6 CCC#COCC Amb6336486 [1,0,0,0,0,0|1,0,2]=4 418 B6R0.6 CCCC#CCBr Amb25061301 [1,0,0,0,0,0|1,0,2]=4 419 B6R0.6 CCCC#CCN Amb17593063 [1,0,0,0,0,0|1,0,2]=4 420 B6R0.6 CCCC=C=CBr Amb27477883 [1,0,0,0,0,0|1,0,2]=4 421 B6R0.6 CCCCBOC Amb22728871 [1,0,0,0,0,0|2,0,1]=4 422 B6R0.6 CCCCC=[N+]=[N-] Amb28184340 [1,0,0,0,0,0|2,0,1]=4 423 B6R0.6 CCCCCC#N Amb6250301 [1,0,0,0,0,0|1,0,2]=4 424 B6R0.6 CCCCCC=O Amb3939522 [1,0,0,0,0,0|0,0,3]=4 425 B6R0.6 CCCCCCBr Amb3940085 [1,0,0,0,0,0|1,0,1]=3 426 B6R0.6 CCCCCCC Amb8513177 [1,0,0,0,0,0|0,0,2]=3 427 B6R0.6 CCCCCCCl Amb7764628 [1,0,0,0,0,0|1,0,1]=3 428 B6R0.6 CCCCCCF Amb8516643 [1,0,0,0,0,0|1,0,1]=3 429 B6R0.6 CCCCCCI Amb6608700 [1,0,0,0,0,0|1,0,1]=3 430 B6R0.6 CCCCCCN Amb2721179 [1,0,0,0,0,0|1,0,1]=3 431 B6R0.6 CCCCCCN Amb3940465 [1,0,0,0,0,0|1,0,1]=3 432 B6R0.6 CCCCCCO Amb3941500 [1,0,0,0,0,0|0,0,1]=2 433 B6R0.6 CCCCCCS Amb8514502 [1,0,0,0,0,0|0,1,1]=3 434 B6R0.6 CCCCCC[SiH3] Amb19893900 [1,0,0,0,0,0|1,0,1]=3 435 B6R0.6 CCCCCNC Amb3939381 [1,0,0,0,0,0|1,0,2]=4 436 B6R0.6 CCCCCNN Amb32693399 [1,0,0,0,0,0|2,0,1]=4 437 B6R0.6 CCCCCNN Amb6249376 [1,0,0,0,0,0|2,0,1]=4 438 B6R0.6 CCCCCNO Amb25067859 [1,0,0,0,0,0|1,0,1]=3 439 B6R0.6 CCCCCOC Amb9787609 [1,0,0,0,0,0|1,0,2]=4 440 B6R0.6 CCCCCON Amb18122095 [1,0,0,0,0,0|2,0,1]=4 441 B6R0.6 CCCCCSC Amb21618865 [1,0,0,0,0,0|1,0,2]=4 442 B6R0.6 CCCCNC=O Amb4017838 [1,0,0,0,0,0|3,0,0]=4 443 B6R0.6 CCCCNCC Amb3939842 [1,0,0,0,0,0|1,0,1]=3 444 B6R0.6 CCCCNOC Amb24479420 [1,0,0,0,0,0|2,0,1]=4 445 B6R0.6 CCCCOC=O Amb6608882 [1,0,0,0,0,0|3,0,0]=4 446 B6R0.6 CCCCOCC Amb2685642 [1,0,0,0,0,0|1,0,1]=3 447 B6R0.6 CCCCOCO Amb24480826 [1,0,0,0,0,0|1,0,1]=3 448 B6R0.6 CCCCSCC Amb9787545 [1,0,0,0,0,0|1,0,1]=3 449 B6R0.6 CCCCSCCl Amb25146885 [1,0,0,0,0,0|2,0,1]=4 450 B6R0.6 CCCCSCO Amb27623932 [1,0,0,0,0,0|1,0,1]=3 451 B6R0.6 CCCC\C=C\I Amb25173925 [1,0,0,0,0,0|2,0,0]=3 452 B6R0.6 CCCNCCC Amb3939352 [1,0,0,0,0,0|1,0,1]=3 453 B6R0.6 CCCNCCCl Amb17334074 [1,0,0,0,0,0|2,0,1]=4 454 B6R0.6 CCCNCCN Amb8515461 [1,0,0,0,0,0|2,0,1]=4 455 B6R0.6 CCCNCCO Amb3939869 [1,0,0,0,0,0|1,0,1]=3 456 B6R0.6 CCCNCOC Amb27830080 [1,0,0,0,0,0|2,0,1]=4 457 B6R0.6 CCCNNCC Amb27409240 [1,0,0,0,0,0|2,0,0]=3 458 B6R0.6 CCCN\C=N\N Amb28049932 [1,0,0,0,0,0|3,0,0]=4 459 B6R0.6 CCCOCCC Amb8513440 [1,0,0,0,0,0|1,0,1]=3 460 B6R0.6 CCCOCCCl Amb8514866 [1,0,0,0,0,0|2,0,1]=4 461 B6R0.6 CCCOCCI Amb27596856 [1,0,0,0,0,0|2,0,1]=4 462 B6R0.6 CCCOCCN Amb3939563 [1,0,0,0,0,0|2,0,1]=4 463 B6R0.6 CCCOCCO Amb3939227 [1,0,0,0,0,0|1,0,1]=3 464 B6R0.6 CCCSCCBr Amb9304990 [1,0,0,0,0,0|2,0,1]=4 465 B6R0.6 CCCSCCC Amb9787473 [1,0,0,0,0,0|1,0,1]=3 466 B6R0.6 CCCSCCCl Amb9304987 [1,0,0,0,0,0|2,0,1]=4 467 B6R0.6 CCCSCCN Amb19888435 [1,0,0,0,0,0|2,0,1]=4 468 B6R0.6 CCCSCCN Amb6268693 [1,0,0,0,0,0|2,0,1]=4 469 B6R0.6 CCCSCCS Amb28050075 [1,0,0,0,0,0|1,1,1]=4 470 B6R0.6 CCCSCNC Amb27879006 [1,0,0,0,0,0|2,0,1]=4 471 B6R0.6 CCCSSCC Amb24063527 [1,0,0,0,0,0|2,0,0]=3 472 B6R0.6 CCCSSSC Amb8392859 [1,0,0,0,0,0|3,0,0]=4 473 B6R0.6 CCC\C=C/C=O Amb25885814 [1,0,0,0,0,0|1,0,1]=3 474 B6R0.6 CCC\C=C\C=O Amb3940431 [1,0,0,0,0,0|1,0,1]=3 475 B6R0.6 CCC\C=C\CCl Amb27482813 [1,0,0,0,0,0|1,0,0]=2 476 B6R0.6 CCC\C=C\CN Amb33475254 [1,0,0,0,0,0|1,0,0]=2 477 B6R0.6 CCC\C=C\CO Amb32660968 [1,0,0,0,0,0|1,0,0]=2 478 B6R0.6 CCC\C=C\CS Amb33373719 [1,0,0,0,0,0|1,0,0]=2 479 B6R0.6 CCN=C=NCC Amb27664435 [1,0,0,0,0,0|2,0,1]=4 480 B6R0.6 CCNCCC#N Amb2720499 [1,0,0,0,0,0|2,0,1]=4 481 B6R0.6 CCNCCCBr Amb27265760 [1,0,0,0,0,0|2,0,0]=3 482 B6R0.6 CCNCCCF Amb28050218 [1,0,0,0,0,0|2,0,0]=3 483 B6R0.6 CCNCCCN Amb17315269 [1,0,0,0,0,0|2,0,0]=3 484 B6R0.6 CCNCCCO Amb6733726 [1,0,0,0,0,0|1,0,0]=2 485 B6R0.6 CCNCCOC Amb32653021 [1,0,0,0,0,0|2,0,1]=4 486 B6R0.6 CCNCCOC Amb3939818 [1,0,0,0,0,0|2,0,1]=4 487 B6R0.6 CCNCCSC Amb19024605 [1,0,0,0,0,0|2,0,1]=4 488 B6R0.6 CCNCCSC Amb28941534 [1,0,0,0,0,0|2,0,1]=4 489 B6R0.6 CCNCNCC Amb27174562 [1,0,0,0,0,0|2,0,1]=4 490 B6R0.6 CCNC\C=C/I Amb23539308 [1,0,0,0,0,0|3,0,0]=4 491 B6R0.6 CCNOCCO Amb28281707 [1,0,0,0,0,0|2,0,0]=3 492 B6R0.6 CCN\C=C/C=O Amb27793118 [1,0,0,0,0,0|2,0,1]=4 493 B6R0.6 CCOCCC#N Amb4019489 [1,0,0,0,0,0|2,0,1]=4 494 B6R0.6 CCOCCC=O Amb25688261 [1,0,0,0,0,0|1,0,2]=4 495 B6R0.6 CCOCCCBr Amb8828206 [1,0,0,0,0,0|2,0,0]=3 496 B6R0.6 CCOCCCCl Amb6255304 [1,0,0,0,0,0|2,0,0]=3 497 B6R0.6 CCOCCCN Amb3939347 [1,0,0,0,0,0|2,0,0]=3 498 B6R0.6 CCOCCCO Amb3939322 [1,0,0,0,0,0|1,0,0]=2 499 B6R0.6 CCOCCNC Amb19959934 [1,0,0,0,0,0|2,0,1]=4 500 B6R0.6 CCOCCNC Amb33529221 [1,0,0,0,0,0|2,0,1]=4 501 B6R0.6 CCOCCNN Amb22587352 [1,0,0,0,0,0|3,0,0]=4 502 B6R0.6 CCOCCNN Amb6744628 [1,0,0,0,0,0|3,0,0]=4 503 B6R0.6 CCOCCOC Amb22052684 [1,0,0,0,0,0|2,0,1]=4 504 B6R0.6 CCOCCON Amb18061689 [1,0,0,0,0,0|3,0,0]=4 505 B6R0.6 CCOCOCC Amb8515183 [1,0,0,0,0,0|2,0,1]=4 506 B6R0.6 CCOC\C=C\Br Amb28244732 [1,0,0,0,0,0|3,0,0]=4 507 B6R0.6 CCONOCC Amb27590258 [1,0,0,0,0,0|3,0,0]=4 508 B6R0.6 CCO[SiH2]OCC Amb27655870 [1,0,0,0,0,0|2,1,0]=4 509 B6R0.6 CCO\C=C/C#N Amb16233146 [1,0,0,0,0,0|2,0,1]=4 510 B6R0.6 CCO\C=C/C=O Amb27423444 [1,0,0,0,0,0|2,0,1]=4 511 B6R0.6 CCO\C=C\C#N Amb8514953 [1,0,0,0,0,0|2,0,1]=4 512 B6R0.6 CCO\C=C\C=O Amb18639560 [1,0,0,0,0,0|2,0,1]=4 513 B6R0.6 CCO\C=C\SC Amb30621789 [1,0,0,0,0,0|2,0,0]=3 514 B6R0.6 CCSCCC#N Amb6680683 [1,0,0,0,0,0|2,0,1]=4 515 B6R0.6 CCSCCC=O Amb27254551 [1,0,0,0,0,0|1,0,2]=4 516 B6R0.6 CCSCCCBr Amb9305000 [1,0,0,0,0,0|2,0,0]=3 517 B6R0.6 CCSCCCI Amb28461625 [1,0,0,0,0,0|2,0,0]=3 518 B6R0.6 CCSCCCN Amb6680223 [1,0,0,0,0,0|2,0,0]=3 519 B6R0.6 CCSCCCO Amb3939588 [1,0,0,0,0,0|1,0,0]=2 520 B6R0.6 CCSCCCS Amb26476929 [1,0,0,0,0,0|1,1,0]=3 521 B6R0.6 CCSCCNC Amb16186669 [1,0,0,0,0,0|2,0,1]=4 522 B6R0.6 CCSCCNN Amb27218047 [1,0,0,0,0,0|3,0,0]=4 523 B6R0.6 CCSCCNO Amb33324087 [1,0,0,0,0,0|2,0,0]=3 524 B6R0.6 CCSCCON Amb24414250 [1,0,0,0,0,0|3,0,0]=4 525 B6R0.6 CCSCSCC Amb17609604 [1,0,0,0,0,0|2,0,1]=4 526 B6R0.6 CCSSSCC Amb22168293 [1,0,0,0,0,0|3,0,0]=4 527 B6R0.6 CC\C=C/CC=O Amb18639157 [1,0,0,0,0,0|0,0,2]=3 528 B6R0.6 CC\C=C/CCC Amb26600858 [1,0,0,0,0,0|0,0,0]=1 529 B6R0.6 CC\C=C/CCCl Amb27815138 [1,0,0,0,0,0|1,0,0]=2 530 B6R0.6 CC\C=C/CCI Amb28399922 [1,0,0,0,0,0|1,0,0]=2 531 B6R0.6 CC\C=C/CCO Amb2720771 [1,0,0,0,0,0|0,0,0]=1 532 B6R0.6 CC\C=C\C=C/Br Amb27392254 [1,0,0,0,0,0|1,0,2]=4 533 B6R0.6 CC\C=C\C=C\Br Amb27233492 [1,0,0,0,0,0|1,0,2]=4 534 B6R0.6 CC\C=C\CC#N Amb33224095 [1,0,0,0,0,0|1,0,1]=3 535 B6R0.6 CC\C=C\CCBr Amb17570067 [1,0,0,0,0,0|1,0,0]=2 536 B6R0.6 CC\C=C\CCC Amb19930065 [1,0,0,0,0,0|0,0,0]=1 537 B6R0.6 CC\C=C\CCCl Amb27452933 [1,0,0,0,0,0|1,0,0]=2 538 B6R0.6 CC\C=C\CCN Amb17569886 [1,0,0,0,0,0|1,0,0]=2 539 B6R0.6 CC\C=C\CCO Amb3940339 [1,0,0,0,0,0|0,0,0]=1 540 B6R0.6 CC\C=C\CCS Amb32882654 [1,0,0,0,0,0|0,1,0]=2 541 B6R0.6 CC\C=C\CNC Amb26618015 [1,0,0,0,0,0|1,0,0]=2 542 B6R0.6 CC\C=C\CNN Amb33269453 [1,0,0,0,0,0|2,0,0]=3 543 B6R0.6 CC\C=C\CNO Amb33225042 [1,0,0,0,0,0|1,0,0]=2 544 B6R0.6 CC\C=C\CON Amb33268661 [1,0,0,0,0,0|2,0,0]=3 545 B6R0.6 CC\C=C\OCC Amb33986090 [1,0,0,0,0,0|1,0,0]=2 546 B6R0.6 CNCCCCCl Amb34916601 [1,0,0,0,0,0|2,0,1]=4 547 B6R0.6 CNCCCCF Amb27231439 [1,0,0,0,0,0|2,0,1]=4 548 B6R0.6 CNCCCCN Amb17334048 [1,0,0,0,0,0|2,0,1]=4 549 B6R0.6 CNCCCCN Amb2698063 [1,0,0,0,0,0|2,0,1]=4 550 B6R0.6 CNCCCCO Amb33539277 [1,0,0,0,0,0|1,0,1]=3 551 B6R0.6 CNCC\C=C\Cl Amb27605601 [1,0,0,0,0,0|3,0,0]=4 552 B6R0.6 CNC\C=C\CCl Amb28050469 [1,0,0,0,0,0|2,0,0]=3 553 B6R0.6 CNC\C=N\OC Amb27830571 [1,0,0,0,0,0|3,0,0]=4 554 B6R0.6 CN\N=N\CCO Amb27857439 [1,0,0,0,0,0|3,0,0]=4 555 B6R0.6 COCCCCBr Amb8855443 [1,0,0,0,0,0|2,0,1]=4 556 B6R0.6 COCCCCCl Amb17942999 [1,0,0,0,0,0|2,0,1]=4 557 B6R0.6 COCCCCI Amb25933499 [1,0,0,0,0,0|2,0,1]=4 558 B6R0.6 COCCCCN Amb10610278 [1,0,0,0,0,0|2,0,1]=4 559 B6R0.6 COCCCCN Amb6251056 [1,0,0,0,0,0|2,0,1]=4 560 B6R0.6 COCCCCO Amb17666901 [1,0,0,0,0,0|1,0,1]=3 561 B6R0.6 COCCCCS Amb24654696 [1,0,0,0,0,0|1,1,1]=4 562 B6R0.6 COCCCNO Amb33378127 [1,0,0,0,0,0|2,0,1]=4 563 B6R0.6 COCCOCO Amb28281708 [1,0,0,0,0,0|2,0,1]=4 564 B6R0.6 COCNCCO Amb18522071 [1,0,0,0,0,0|2,0,1]=4 565 B6R0.6 COCOCCO Amb23590973 [1,0,0,0,0,0|2,0,1]=4 566 B6R0.6 COC\C=C\C#N Amb18120668 [1,0,0,0,0,0|2,0,1]=4 567 B6R0.6 COC\C=C\C=O Amb33473884 [1,0,0,0,0,0|2,0,1]=4 568 B6R0.6 COC\C=C\CBr Amb28050318 [1,0,0,0,0,0|2,0,0]=3 569 B6R0.6 COC\C=C\CN Amb28341719 [1,0,0,0,0,0|2,0,0]=3 570 B6R0.6 COC\C=C\CO Amb33428788 [1,0,0,0,0,0|2,0,0]=3 571 B6R0.6 CONCCCN Amb26953498 [1,0,0,0,0,0|3,0,0]=4 572 B6R0.6 CONCCCN Amb30584683 [1,0,0,0,0,0|3,0,0]=4 573 B6R0.6 CONCCCN Amb32666616 [1,0,0,0,0,0|3,0,0]=4 574 B6R0.6 CONCCCO Amb24479622 [1,0,0,0,0,0|2,0,0]=3 575 B6R0.6 CONCCCO Amb33456216 [1,0,0,0,0,0|2,0,0]=3 576 B6R0.6 CSC#CCCO Amb17593203 [1,0,0,0,0,0|1,0,2]=4 577 B6R0.6 CSCCCCBr Amb19054837 [1,0,0,0,0,0|2,0,1]=4 578 B6R0.6 CSCCCCCl Amb25240444 [1,0,0,0,0,0|2,0,1]=4 579 B6R0.6 CSCCCCF Amb27620229 [1,0,0,0,0,0|2,0,1]=4 580 B6R0.6 CSCCCCN Amb17500948 [1,0,0,0,0,0|2,0,1]=4 581 B6R0.6 CSCCCCO Amb9825911 [1,0,0,0,0,0|1,0,1]=3 582 B6R0.6 CSCCCCS Amb27461555 [1,0,0,0,0,0|1,1,1]=4 583 B6R0.6 CSCCCNO Amb27948053 [1,0,0,0,0,0|2,0,1]=4 584 B6R0.6 CSC\C=C\C=O Amb33271737 [1,0,0,0,0,0|2,0,1]=4 585 B6R0.6 CSC\C=C\CCl Amb27473343 [1,0,0,0,0,0|2,0,0]=3 586 B6R0.6 CSC\C=C\CN Amb33474032 [1,0,0,0,0,0|2,0,0]=3 587 B6R0.6 CSC\C=C\CO Amb33079758 [1,0,0,0,0,0|2,0,0]=3 588 B6R0.6 C\C=C/CCC=O Amb28202620 [1,0,0,0,0,0|0,0,2]=3 589 B6R0.6 C\C=C/CCCC Amb24467666 [1,0,0,0,0,0|1,0,0]=2 590 B6R0.6 C\C=C/CCCN Amb27658374 [1,0,0,0,0,0|1,0,0]=2 591 B6R0.6 C\C=C/CCCO Amb17614951 [1,0,0,0,0,0|0,0,0]=1 592 B6R0.6 C\C=C\C=C\CBr Amb27433479 [1,0,0,0,0,0|1,0,2]=4 593 B6R0.6 C\C=C\C=C\CCl Amb32652238 [1,0,0,0,0,0|1,0,2]=4 594 B6R0.6 C\C=C\C=C\CN Amb18639062 [1,0,0,0,0,0|1,0,2]=4 595 B6R0.6 C\C=C\C=C\CN Amb24117256 [1,0,0,0,0,0|1,0,2]=4 596 B6R0.6 C\C=C\C=C\CO Amb27848287 [1,0,0,0,0,0|0,0,2]=3 597 B6R0.6 C\C=C\CCC=O Amb17593074 [1,0,0,0,0,0|0,0,2]=3 598 B6R0.6 C\C=C\CCCC Amb8515158 [1,0,0,0,0,0|1,0,0]=2 599 B6R0.6 C\C=C\CCCI Amb25837122 [1,0,0,0,0,0|1,0,0]=2 600 B6R0.6 C\C=C\CCCO Amb22347882 [1,0,0,0,0,0|0,0,0]=1 601 B6R0.6 C\C=C\SCCC Amb22168314 [1,0,0,0,0,0|1,0,1]=3 602 B6R0.6 C\C=N\NCCO Amb25888442 [1,0,0,0,0,0|2,0,0]=3 603 B6R0.6 ClCCCCCBr Amb2724373 [1,0,0,0,0,0|2,0,1]=4 604 B6R0.6 ClCCCCCCl Amb6608828 [1,0,0,0,0,0|2,0,1]=4 605 B6R0.6 ClCCCCCI Amb10069913 [1,0,0,0,0,0|2,0,1]=4 606 B6R0.6 ClCCCOCBr Amb28458531 [1,0,0,0,0,0|3,0,0]=4 607 B6R0.6 ClCCCOCCl Amb24479881 [1,0,0,0,0,0|3,0,0]=4 608 B6R0.6 ClCOCCCBr Amb25889019 [1,0,0,0,0,0|3,0,0]=4 609 B6R0.6 Cl\C=C/OCCCl Amb27843981 [1,0,0,0,0,0|3,0,0]=4 610 B6R0.6 Cl\C=C\SCCCl Amb28197764 [1,0,0,0,0,0|3,0,0]=4 611 B6R0.6 FCCCCCBr Amb15701635 [1,0,0,0,0,0|2,0,1]=4 612 B6R0.6 FCCCCCF Amb27397467 [1,0,0,0,0,0|2,0,1]=4 613 B6R0.6 FCCCCCS Amb24409033 [1,0,0,0,0,0|1,1,1]=4 614 B6R0.6 ICCCCCI Amb8514835 [1,0,0,0,0,0|2,0,1]=4 615 B6R0.6 N#CCCCCO Amb33531864 [1,0,0,0,0,0|1,0,2]=4 616 B6R0.6 N#CC\C=C\CCl Amb25174294 [1,0,0,0,0,0|2,0,1]=4 617 B6R0.6 N#CC\C=C\CO Amb27604469 [1,0,0,0,0,0|2,0,1]=4 618 B6R0.6 N#C\C=C/CCCl Amb28074025 [1,0,0,0,0,0|2,0,1]=4 619 B6R0.6 NCC#CCCO Amb27175344 [1,0,0,0,0,0|1,0,2]=4 620 B6R0.6 NCCCCC=O Amb26627836 [1,0,0,0,0,0|2,0,1]=4 621 B6R0.6 NCCCCCBr Amb26581378 [1,0,0,0,0,0|2,0,1]=4 622 B6R0.6 NCCCCCCl Amb17593241 [1,0,0,0,0,0|2,0,1]=4 623 B6R0.6 NCCCCCF Amb28383861 [1,0,0,0,0,0|2,0,1]=4 624 B6R0.6 NCCCCCF Amb35747648 [1,0,0,0,0,0|2,0,1]=4 625 B6R0.6 NCCCCCI Amb27596855 [1,0,0,0,0,0|2,0,1]=4 626 B6R0.6 NCCCCCN Amb22002397 [1,0,0,0,0,0|2,0,1]=4 627 B6R0.6 NCCCCCN Amb8513099 [1,0,0,0,0,0|2,0,1]=4 628 B6R0.6 NCCCCCO Amb3939337 [1,0,0,0,0,0|1,0,1]=3 629 B6R0.6 NCCCCCS Amb33362345 [1,0,0,0,0,0|1,1,1]=4 630 B6R0.6 NCCCCCS Amb33527075 [1,0,0,0,0,0|1,1,1]=4 631 B6R0.6 NCCCCNO Amb24117989 [1,0,0,0,0,0|2,0,1]=4 632 B6R0.6 NCCCCNO Amb27668394 [1,0,0,0,0,0|2,0,1]=4 633 B6R0.6 NCCCNC=O Amb5723517 [1,0,0,0,0,0|3,0,0]=4 634 B6R0.6 NCCCOCF Amb33224234 [1,0,0,0,0,0|3,0,0]=4 635 B6R0.6 NCCC\C=C/I Amb28050291 [1,0,0,0,0,0|2,0,0]=3 636 B6R0.6 NCCNCCO Amb6600573 [1,0,0,0,0,0|2,0,1]=4 637 B6R0.6 NCCOCCO Amb3939011 [1,0,0,0,0,0|2,0,1]=4 638 B6R0.6 NCCSCCO Amb2725559 [1,0,0,0,0,0|2,0,1]=4 639 B6R0.6 NC\C=C\CCF Amb33196118 [1,0,0,0,0,0|2,0,0]=3 640 B6R0.6 NC\C=C\CCN Amb24113141 [1,0,0,0,0,0|2,0,0]=3 641 B6R0.6 NC\C=C\CCN Amb24113896 [1,0,0,0,0,0|2,0,0]=3 642 B6R0.6 NC\C=C\CCO Amb27969293 [1,0,0,0,0,0|1,0,0]=2 643 B6R0.6 NNCCCCO Amb24692523 [1,0,0,0,0,0|2,0,1]=4 644 B6R0.6 O=CCCCCBr Amb18126353 [1,0,0,0,0,0|2,0,1]=4 645 B6R0.6 O=CCCCCCl Amb18123550 [1,0,0,0,0,0|2,0,1]=4 646 B6R0.6 O=CCCCCO Amb10603837 [1,0,0,0,0,0|1,0,1]=3 647 B6R0.6 O=CCC\C=C/Br Amb27838206 [1,0,0,0,0,0|1,0,2]=4 648 B6R0.6 O=CCC\C=C\Cl Amb27955198 [1,0,0,0,0,0|1,0,2]=4 649 B6R0.6 O=CNCCCO Amb27248821 [1,0,0,0,0,0|2,0,0]=3 650 B6R0.6 O=C\C=C/CCO Amb27235316 [1,0,0,0,0,0|1,0,1]=3 651 B6R0.6 O=C\C=C\CCF Amb33429802 [1,0,0,0,0,0|2,0,1]=4 652 B6R0.6 O=[PH2]OCCCO Amb27218913 [1,0,0,0,0,0|3,0,0]=4 653 B6R0.6 OCCC#CCBr Amb27401919 [1,0,0,0,0,0|1,0,2]=4 654 B6R0.6 OCCCC#CBr Amb28401370 [1,0,0,0,0,0|1,0,2]=4 655 B6R0.6 OCCCC#CCl Amb27457965 [1,0,0,0,0,0|1,0,2]=4 656 B6R0.6 OCCCCCBr Amb10603824 [1,0,0,0,0,0|1,0,1]=3 657 B6R0.6 OCCCCCCl Amb8386939 [1,0,0,0,0,0|1,0,1]=3 658 B6R0.6 OCCCCCF Amb24479828 [1,0,0,0,0,0|1,0,1]=3 659 B6R0.6 OCCCCCO Amb6296608 [1,0,0,0,0,0|1,0,1]=3 660 B6R0.6 OCCCCNO Amb27396013 [1,0,0,0,0,0|2,0,1]=4 661 B6R0.6 OCCC\C=C\Br Amb27483322 [1,0,0,0,0,0|1,0,0]=2 662 B6R0.6 OCCC\C=C\I Amb27879078 [1,0,0,0,0,0|1,0,0]=2 663 B6R0.6 OCCNCCF Amb27468539 [1,0,0,0,0,0|2,0,1]=4 664 B6R0.6 OCCNCCO Amb22035219 [1,0,0,0,0,0|2,0,1]=4 665 B6R0.6 OCCNCCO Amb3997179 [1,0,0,0,0,0|2,0,1]=4 666 B6R0.6 OCCNCCS Amb18522180 [1,0,0,0,0,0|2,0,1]=4 667 B6R0.6 OCCOCCBr Amb24057456 [1,0,0,0,0,0|2,0,1]=4 668 B6R0.6 OCCOCCCl Amb3940337 [1,0,0,0,0,0|2,0,1]=4 669 B6R0.6 OCCOCCF Amb17593119 [1,0,0,0,0,0|2,0,1]=4 670 B6R0.6 OCCOCCI Amb27602214 [1,0,0,0,0,0|2,0,1]=4 671 B6R0.6 OCCOCCO Amb32671216 [1,0,0,0,0,0|2,0,1]=4 672 B6R0.6 OCCOCCO Amb6608789 [1,0,0,0,0,0|2,0,1]=4 673 B6R0.6 OCCOCCS Amb22008751 [1,0,0,0,0,0|2,0,1]=4 674 B6R0.6 OCCPCCO Amb27185495 [1,0,0,0,0,0|2,0,1]=4 675 B6R0.6 OCCSCCCl Amb27413860 [1,0,0,0,0,0|2,0,1]=4 676 B6R0.6 OCCSCCO Amb6891967 [1,0,0,0,0,0|2,0,1]=4 677 B6R0.6 OCCSCCS Amb27829564 [1,0,0,0,0,0|2,0,1]=4 678 B6R0.6 OCC\C=C/CBr Amb27750410 [1,0,0,0,0,0|1,0,0]=2 679 B6R0.6 OCC\C=C\CCl Amb27227431 [1,0,0,0,0,0|1,0,0]=2 680 B6R0.6 OCSCSCO Amb27826296 [1,0,0,0,0,0|3,0,0]=4 681 B6R0.6 OC\C=C\C=C\Br Amb27750080 [1,0,0,0,0,0|1,0,2]=4 682 B6R0.6 OC\C=C\C=C\Cl Amb27858902 [1,0,0,0,0,0|1,0,2]=4 683 B6R0.6 OC\C=C\CCF Amb33196119 [1,0,0,0,0,0|2,0,0]=3 684 B6R0.6 OC\C=C\CCO Amb26017278 [1,0,0,0,0,0|1,0,0]=2 685 B6R0.6 SCCCCCS Amb8514611 [1,0,0,0,0,0|1,1,1]=4 686 B6R0.6 [C-]#[N+]CCCCC Amb2684559 [1,0,0,0,0,0|2,0,1]=4 687 B6R0.6 [C-]#[N+]CCOCC Amb1981103 [1,0,0,0,0,0|3,0,0]=4 688 B6R0.6 [C-]#[N+]CCSCC Amb33324019 [1,0,0,0,0,0|3,0,0]=4 689 B6R0.6 [C-]#[N+]C\C=C\CC Amb33268263 [1,0,0,0,0,0|1,0,1]=3 690 B6R0.6 [N-]=[N+]=NCCCO Amb33538391 [1,0,0,0,0,0|3,0,0]=4 691 B8R0.1 C#CCCC(=O)CCC Amb8869650 [0,1,0,0,0,0|1,0,2]=4 692 B8R0.1 C#CCCC(=O)NCC Amb27167266 [0,1,0,0,0,0|2,0,1]=4 693 B8R0.1 C#CCCC(=O)OCC Amb18636093 [0,1,0,0,0,0|2,0,1]=4 694 B8R0.1 C#CCC\C(C)=C/CCl Amb27485213 [0,1,0,0,0,0|2,0,1]=4 695 B8R0.1 C#C\C=C\C(O)CCC Amb27405234 [0,1,0,0,0,0|1,0,2]=4 696 B8R0.1 C=C(CCN)CCCC Amb25883662 [0,1,0,0,0,0|2,0,1]=4 697 B8R0.1 C=C(\C=C\C)CCCCl Amb28282689 [0,1,0,0,0,0|1,0,1]=3 698 B8R0.1 C=C(\C=C\C)\C=C\CO Amb27665468 [0,1,0,0,0,0|0,0,3]=4 699 B8R0.1 C=C(\C=C\CC)CCN Amb33267514 [0,1,0,0,0,0|1,0,1]=3 700 B8R0.1 C=C=CC(=O)CCCCl Amb27470781 [0,1,0,0,0,0|1,0,2]=4 701 B8R0.1 C=CCC(=C)CCCO Amb27213958 [0,1,0,0,0,0|0,0,3]=4 702 B8R0.1 C=CCC(C)\C=C\CO Amb27956637 [0,1,0,0,0,0|2,0,1]=4 703 B8R0.1 C=CCCC(=O)CCC Amb9031599 [0,1,0,0,0,0|1,0,2]=4 704 B8R0.1 C=CCCC(=O)OCC Amb10601809 [0,1,0,0,0,0|2,0,1]=4 705 B8R0.1 C=CCCC(=O)\C=C\C Amb27227017 [0,1,0,0,0,0|1,0,2]=4 706 B8R0.1 C=CCC\C(Cl)=C/CO Amb28205777 [0,1,0,0,0,0|2,0,1]=4 707 B8R0.1 CC#CC[C@@H](C)CCO Amb27768833 [0,1,0,0,0,0|0,0,3]=4 708 B8R0.1 CC#C\C(C)=C\CCO Amb28321567 [0,1,0,0,0,0|0,0,3]=4 709 B8R0.1 CC(CCBr)CCCO Amb27863912 [0,1,0,0,0,0|1,0,2]=4 710 B8R0.1 CC(CCO)CCCO Amb28189390 [0,1,0,0,0,0|1,0,2]=4 711 B8R0.1 CC(CCO)NCCN Amb27473736 [0,1,0,0,0,0|2,0,1]=4 712 B8R0.1 CC(CCO)SCCF Amb27164900 [0,1,0,0,0,0|2,0,1]=4 713 B8R0.1 CC=C=CC(O)CCC Amb28321362 [0,1,0,0,0,0|1,0,2]=4 714 B8R0.1 CCC#CC(Br)CCC Amb27243978 [0,1,0,0,0,0|1,0,2]=4 715 B8R0.1 CCCC(=N)NCCF Amb28314727 [0,1,0,0,0,0|2,0,1]=4 716 B8R0.1 CCCC(=O)CCC=O Amb18642627 [0,1,0,0,0,0|0,0,3]=4 717 B8R0.1 CCCC(=O)CCCF Amb28182770 [0,1,0,0,0,0|1,0,1]=3 718 B8R0.1 CCCC(=O)CCCN Amb27866597 [0,1,0,0,0,0|1,0,1]=3 719 B8R0.1 CCCC(=O)C\C=N/O Amb27838762 [0,1,0,0,0,0|1,0,2]=4 720 B8R0.1 CCCC(=O)C\C=N\O Amb27260514 [0,1,0,0,0,0|1,0,2]=4 721 B8R0.1 CCCC(=O)NCCCl Amb17103189 [0,1,0,0,0,0|2,0,1]=4 722 B8R0.1 CCCC(=O)NCCI Amb27225208 [0,1,0,0,0,0|2,0,1]=4 723 B8R0.1 CCCC(=O)NCCN Amb6242301 [0,1,0,0,0,0|2,0,1]=4 724 B8R0.1 CCCC(=O)NCCO Amb5797547 [0,1,0,0,0,0|1,0,1]=3 725 B8R0.1 CCCC(=O)OCCBr Amb25087679 [0,1,0,0,0,0|2,0,1]=4 726 B8R0.1 CCCC(=O)OCCF Amb27448709 [0,1,0,0,0,0|2,0,1]=4 727 B8R0.1 CCCC(=O)OCCO Amb25937003 [0,1,0,0,0,0|1,0,1]=3 728 B8R0.1 CCCC(=O)SCCBr Amb27264823 [0,1,0,0,0,0|2,0,1]=4 729 B8R0.1 CCCC(=O)SCCO Amb27841882 [0,1,0,0,0,0|1,0,1]=3 730 B8R0.1 CCCC(=O)\C=C\CO Amb27806763 [0,1,0,0,0,0|0,0,3]=4 731 B8R0.1 CCCC(=O)\C=C\SC Amb26062168 [0,1,0,0,0,0|2,0,1]=4 732 B8R0.1 CCCC(Br)CCCN Amb27645439 [0,1,0,0,0,0|1,0,2]=4 733 B8R0.1 CCCC(C)CCCBr Amb33533621 [0,1,0,0,0,0|1,0,2]=4 734 B8R0.1 CCCC(C)CCCCl Amb27859186 [0,1,0,0,0,0|1,0,2]=4 735 B8R0.1 CCCC(C)CCCN Amb27654811 [0,1,0,0,0,0|1,0,2]=4 736 B8R0.1 CCCC(C)CCCO Amb25135097 [0,1,0,0,0,0|0,0,2]=3 737 B8R0.1 CCCC(C)CCCS Amb33320795 [0,1,0,0,0,0|0,1,2]=4 738 B8R0.1 CCCC(C)\C=C\C=O Amb18642466 [0,1,0,0,0,0|2,0,1]=4 739 B8R0.1 CCCC(C)\C=C\CN Amb28197349 [0,1,0,0,0,0|2,0,0]=3 740 B8R0.1 CCCC(C)\C=C\CO Amb33449086 [0,1,0,0,0,0|2,0,0]=3 741 B8R0.1 CCCC(C)\C=N\OC Amb28074710 [0,1,0,0,0,0|3,0,0]=4 742 B8R0.1 CCCC(N)CCCN Amb27255552 [0,1,0,0,0,0|1,0,2]=4 743 B8R0.1 CCCC(O)CCCBr Amb27591160 [0,1,0,0,0,0|1,0,2]=4 744 B8R0.1 CCCC(O)CCCO Amb4035231 [0,1,0,0,0,0|0,0,2]=3 745 B8R0.1 CCCC(O)CCCS Amb25740546 [0,1,0,0,0,0|0,1,2]=4 746 B8R0.1 CCCC(O)CNCC Amb27175353 [0,1,0,0,0,0|2,0,1]=4 747 B8R0.1 CCCC(O)\C=C\C=O Amb24513207 [0,1,0,0,0,0|2,0,1]=4 748 B8R0.1 CCCC(O)\C=C\CO Amb27406730 [0,1,0,0,0,0|2,0,0]=3 749 B8R0.1 CCCC(O)\C=C\SC Amb28315563 [0,1,0,0,0,0|2,0,0]=3 750 B8R0.1 CCCCC(=N)OCC Amb20673140 [0,1,0,0,0,0|2,0,0]=3 751 B8R0.1 CCCCC(=N)OCC Amb26549922 [0,1,0,0,0,0|2,0,0]=3 752 B8R0.1 CCCCC(=O)CCC Amb3940685 [0,1,0,0,0,0|1,0,1]=3 753 B8R0.1 CCCCC(=O)CCN Amb28186730 [0,1,0,0,0,0|2,0,1]=4 754 B8R0.1 CCCCC(=O)CNC Amb25824276 [0,1,0,0,0,0|2,0,1]=4 755 B8R0.1 CCCCC(=O)COC Amb19374627 [0,1,0,0,0,0|2,0,1]=4 756 B8R0.1 CCCCC(=O)CSC Amb27837495 [0,1,0,0,0,0|2,0,1]=4 757 B8R0.1 CCCCC(=O)OCC Amb6296060 [0,1,0,0,0,0|2,0,0]=3 758 B8R0.1 CCCCC(=O)OCCl Amb28314260 [0,1,0,0,0,0|3,0,0]=4 759 B8R0.1 CCCCC(=O)\C=C\Cl Amb24650002 [0,1,0,0,0,0|2,0,1]=4 760 B8R0.1 CCCCC(=O)\C=C\O Amb26515841 [0,1,0,0,0,0|2,0,1]=4 761 B8R0.1 CCCCC(=O)\C=N\O Amb27963887 [0,1,0,0,0,0|3,0,0]=4 762 B8R0.1 CCCCC(Br)CCC Amb13951105 [0,1,0,0,0,0|1,0,2]=4 763 B8R0.1 CCCCC(C)CCBr Amb25809503 [0,1,0,0,0,0|1,0,2]=4 764 B8R0.1 CCCCC(C)CCC Amb22229830 [0,1,0,0,0,0|1,0,2]=4 765 B8R0.1 CCCCC(C)CCN Amb27817638 [0,1,0,0,0,0|1,0,2]=4 766 B8R0.1 CCCCC(C)CCO Amb22229364 [0,1,0,0,0,0|0,0,2]=3 767 B8R0.1 CCCCC(Cl)CCC Amb22229751 [0,1,0,0,0,0|1,0,2]=4 768 B8R0.1 CCCCC(Cl)CCO Amb27791848 [0,1,0,0,0,0|0,0,2]=3 769 B8R0.1 CCCCC(F)CCN Amb28383115 [0,1,0,0,0,0|1,0,2]=4 770 B8R0.1 CCCCC(F)CCO Amb27664743 [0,1,0,0,0,0|0,0,2]=3 771 B8R0.1 CCCCC(I)CCC Amb25314282 [0,1,0,0,0,0|1,0,2]=4 772 B8R0.1 CCCCC(N)CCC Amb9031790 [0,1,0,0,0,0|1,0,2]=4 773 B8R0.1 CCCCC(N)CCO Amb18642854 [0,1,0,0,0,0|0,0,2]=3 774 B8R0.1 CCCCC(N)CCO Amb24117271 [0,1,0,0,0,0|0,0,2]=3 775 B8R0.1 CCCCC(O)CCN Amb25784846 [0,1,0,0,0,0|1,0,2]=4 776 B8R0.1 CCCCN(C)CCO Amb3204758 [0,1,0,0,0,0|1,0,2]=4 777 B8R0.1 CCCCN(N)CCO Amb28398931 [0,1,0,0,0,0|1,0,2]=4 778 B8R0.1 CCCCS(=O)CCO Amb6752517 [0,1,0,0,0,0|1,0,2]=4 779 B8R0.1 CCCC[C@@H](C)CCO Amb24477883 [0,1,0,0,0,0|0,0,2]=3 780 B8R0.1 CCCC[C@@H](Cl)CCC Amb27185673 [0,1,0,0,0,0|1,0,2]=4 781 B8R0.1 CCCC[C@@H](N)CCO Amb22748774 [0,1,0,0,0,0|0,0,2]=3 782 B8R0.1 CCCC[C@@H](O)CCBr Amb28320766 [0,1,0,0,0,0|1,0,2]=4 783 B8R0.1 CCCC[C@@H](O)CCN Amb24716695 [0,1,0,0,0,0|1,0,2]=4 784 B8R0.1 CCCC[C@H](F)CCO Amb28049226 [0,1,0,0,0,0|0,0,2]=3 785 B8R0.1 CCCC[C@H](N)CCO Amb27947953 [0,1,0,0,0,0|0,0,2]=3 786 B8R0.1 CCCC[C@H](O)CCBr Amb27483780 [0,1,0,0,0,0|1,0,2]=4 787 B8R0.1 CCCC[C@H](O)CCN Amb26996017 [0,1,0,0,0,0|1,0,2]=4 788 B8R0.1 CCCC\C(C)=C\C#N Amb27613270 [0,1,0,0,0,0|2,0,1]=4 789 B8R0.1 CCCC\C(C)=C\CO Amb28041191 [0,1,0,0,0,0|2,0,0]=3 790 B8R0.1 CCCC\C(C)=N\OC Amb27169368 [0,1,0,0,0,0|3,0,0]=4 791 B8R0.1 CCCC\C(F)=C\CO Amb28315526 [0,1,0,0,0,0|2,0,0]=3 792 B8R0.1 CCCC\C(I)=C\CO Amb28057014 [0,1,0,0,0,0|2,0,0]=3 793 B8R0.1 CCCC\C(N)=C\C#N Amb28312838 [0,1,0,0,0,0|2,0,1]=4 794 B8R0.1 CCCC\C(N)=N\OC Amb27837654 [0,1,0,0,0,0|3,0,0]=4 795 B8R0.1 CCCC\C(O)=C\C=O Amb27257932 [0,1,0,0,0,0|2,0,1]=4 796 B8R0.1 CCCC\C([O-])=C\C#N Amb32671470 [0,1,0,0,0,0|2,0,1]=4 797 B8R0.1 CCCN(C)CCCI Amb28318380 [0,1,0,0,0,0|2,0,1]=4 798 B8R0.1 CCCN(C)CCCN Amb6670577 [0,1,0,0,0,0|2,0,1]=4 799 B8R0.1 CCCNC(=N)SCC Amb25162798 [0,1,0,0,0,0|3,0,0]=4 800 B8R0.1 CCCNC(=O)CCO Amb17334123 [0,1,0,0,0,0|1,0,2]=4 801 B8R0.1 CCCNC(=O)NCC Amb3101998 [0,1,0,0,0,0|3,0,0]=4 802 B8R0.1 CCCNC(=O)OCC Amb17787091 [0,1,0,0,0,0|3,0,0]=4 803 B8R0.1 CCCNC(C)CCCl Amb28285307 [0,1,0,0,0,0|2,0,1]=4 804 B8R0.1 CCCOC(=N)CCO Amb27757381 [0,1,0,0,0,0|1,0,2]=4 805 B8R0.1 CCCOC(=O)CCC Amb8517637 [0,1,0,0,0,0|2,0,1]=4 806 B8R0.1 CCCOC(=O)CCO Amb22504631 [0,1,0,0,0,0|1,0,2]=4 807 B8R0.1 CCCOC(=O)NCC Amb26642760 [0,1,0,0,0,0|3,0,0]=4 808 B8R0.1 CCCOC(=S)NCC Amb28340500 [0,1,0,0,0,0|3,0,0]=4 809 B8R0.1 CCCS(=O)CCCBr Amb27398529 [0,1,0,0,0,0|2,0,1]=4 810 B8R0.1 CCCSC(=O)NCC Amb27244385 [0,1,0,0,0,0|3,0,0]=4 811 B8R0.1 CCCSC(=S)NCC Amb24419019 [0,1,0,0,0,0|3,0,0]=4 812 B8R0.1 CCC[C@@H](C)CCCBr Amb27607669 [0,1,0,0,0,0|1,0,2]=4 813 B8R0.1 CCC[C@@H](C)CCCN Amb27488815 [0,1,0,0,0,0|1,0,2]=4 814 B8R0.1 CCC[C@@H](C)CCCO Amb28292905 [0,1,0,0,0,0|0,0,2]=3 815 B8R0.1 CCC[C@H](C)CCCO Amb28065801 [0,1,0,0,0,0|0,0,2]=3 816 B8R0.1 CCC[C@H](C)\C=C\C=O Amb27949653 [0,1,0,0,0,0|2,0,1]=4 817 B8R0.1 CCC[C@H](C)\C=C\CO Amb28049085 [0,1,0,0,0,0|2,0,0]=3 818 B8R0.1 CCC[C@H](N)CNCC Amb26957468 [0,1,0,0,0,0|2,0,1]=4 819 B8R0.1 CCC[C@H](N)CSCC Amb28369366 [0,1,0,0,0,0|2,0,1]=4 820 B8R0.1 CCC[C@H](O)CCCO Amb28049112 [0,1,0,0,0,0|0,0,2]=3 821 B8R0.1 CCC[C@H](O)\C=C\C#N Amb27213959 [0,1,0,0,0,0|2,0,1]=4 822 B8R0.1 CCC\C(C)=N\CCN Amb27784288 [0,1,0,0,0,0|2,0,1]=4 823 B8R0.1 CCC\N=C(/N)SCC Amb27829091 [0,1,0,0,0,0|3,0,0]=4 824 B8R0.1 CCC\N=C(/N)SCC Amb27956411 [0,1,0,0,0,0|3,0,0]=4 825 B8R0.1 CCNC(=N)CCOC Amb27945630 [0,1,0,0,0,0|3,0,0]=4 826 B8R0.1 CCNC(=N)NCCN Amb27753227 [0,1,0,0,0,0|3,0,0]=4 827 B8R0.1 CCNC(=N)NCCO Amb27793991 [0,1,0,0,0,0|2,0,0]=3 828 B8R0.1 CCNC(=N)NCCS Amb27450534 [0,1,0,0,0,0|2,1,0]=4 829 B8R0.1 CCNC(=O)CCC#N Amb17334083 [0,1,0,0,0,0|2,0,1]=4 830 B8R0.1 CCNC(=O)CCC=O Amb27665109 [0,1,0,0,0,0|1,0,2]=4 831 B8R0.1 CCNC(=O)CCCCl Amb1136094 [0,1,0,0,0,0|2,0,0]=3 832 B8R0.1 CCNC(=O)CCCN Amb6270972 [0,1,0,0,0,0|2,0,0]=3 833 B8R0.1 CCNC(=O)CCCO Amb17231872 [0,1,0,0,0,0|1,0,0]=2 834 B8R0.1 CCNC(=O)CCOC Amb25027996 [0,1,0,0,0,0|3,0,0]=4 835 B8R0.1 CCNC(=O)CCON Amb27245128 [0,1,0,0,0,0|3,0,0]=4 836 B8R0.1 CCNC(=O)COCC Amb3445547 [0,1,0,0,0,0|3,0,0]=4 837 B8R0.1 CCNC(=O)NCCN Amb10808619 [0,1,0,0,0,0|3,0,0]=4 838 B8R0.1 CCNC(=O)NCCN Amb2786291 [0,1,0,0,0,0|3,0,0]=4 839 B8R0.1 CCNC(=O)NCCO Amb9361462 [0,1,0,0,0,0|2,0,0]=3 840 B8R0.1 CCNC(=O)OCCN Amb28132703 [0,1,0,0,0,0|3,0,0]=4 841 B8R0.1 CCNC(=S)NCCF Amb25978249 [0,1,0,0,0,0|3,0,0]=4 842 B8R0.1 CCNCC(=O)NCC Amb33334645 [0,1,0,0,0,0|3,0,0]=4 843 B8R0.1 CCNCC(=O)NCC Amb423615 [0,1,0,0,0,0|3,0,0]=4 844 B8R0.1 CCNCC(=O)OCC Amb33527965 [0,1,0,0,0,0|3,0,0]=4 845 B8R0.1 CCNCC(C)CCCl Amb27950091 [0,1,0,0,0,0|2,0,1]=4 846 B8R0.1 CCOC(=N)CCCBr Amb20673080 [0,1,0,0,0,0|2,0,0]=3 847 B8R0.1 CCOC(=N)CCCBr Amb26019479 [0,1,0,0,0,0|2,0,0]=3 848 B8R0.1 CCOC(=N)CCCCl Amb8427994 [0,1,0,0,0,0|2,0,0]=3 849 B8R0.1 CCOC(=N)CCCCl Amb9173329 [0,1,0,0,0,0|2,0,0]=3 850 B8R0.1 CCOC(=N)CCCO Amb27390716 [0,1,0,0,0,0|1,0,0]=2 851 B8R0.1 CCOC(=N)CCNC Amb25367262 [0,1,0,0,0,0|3,0,0]=4 852 B8R0.1 CCOC(=N)CCOC Amb25300008 [0,1,0,0,0,0|3,0,0]=4 853 B8R0.1 CCOC(=N)CCOC Amb31377414 [0,1,0,0,0,0|3,0,0]=4 854 B8R0.1 CCOC(=O)CCC#N Amb3941721 [0,1,0,0,0,0|2,0,1]=4 855 B8R0.1 CCOC(=O)CCC=O Amb17593369 [0,1,0,0,0,0|1,0,2]=4 856 B8R0.1 CCOC(=O)CCCBr Amb3940218 [0,1,0,0,0,0|2,0,0]=3 857 B8R0.1 CCOC(=O)CCCCl Amb1153203 [0,1,0,0,0,0|2,0,0]=3 858 B8R0.1 CCOC(=O)CCCN Amb2720231 [0,1,0,0,0,0|2,0,0]=3 859 B8R0.1 CCOC(=O)CCCN Amb3938993 [0,1,0,0,0,0|2,0,0]=3 860 B8R0.1 CCOC(=O)CCCO Amb22733346 [0,1,0,0,0,0|1,0,0]=2 861 B8R0.1 CCOC(=O)CCCS Amb27424650 [0,1,0,0,0,0|1,1,0]=3 862 B8R0.1 CCOC(=O)CCNC Amb28934933 [0,1,0,0,0,0|3,0,0]=4 863 B8R0.1 CCOC(=O)CCNC Amb9026169 [0,1,0,0,0,0|3,0,0]=4 864 B8R0.1 CCOC(=O)CCNN Amb23504114 [0,1,0,0,0,0|3,0,0]=4 865 B8R0.1 CCOC(=O)CCNO Amb27406192 [0,1,0,0,0,0|2,0,0]=3 866 B8R0.1 CCOC(=O)CCON Amb24481776 [0,1,0,0,0,0|3,0,0]=4 867 B8R0.1 CCOC(=O)COCCl Amb28066573 [0,1,0,0,0,0|3,0,0]=4 868 B8R0.1 CCOC(=O)CSCC Amb7755283 [0,1,0,0,0,0|3,0,0]=4 869 B8R0.1 CCOC(=O)CSCCl Amb27267833 [0,1,0,0,0,0|3,0,0]=4 870 B8R0.1 CCOC(=O)NCCCl Amb10601693 [0,1,0,0,0,0|3,0,0]=4 871 B8R0.1 CCOC(=O)NCCN Amb18304505 [0,1,0,0,0,0|3,0,0]=4 872 B8R0.1 CCOC(=O)NCCN Amb33552162 [0,1,0,0,0,0|3,0,0]=4 873 B8R0.1 CCOC(=O)NCCO Amb3939457 [0,1,0,0,0,0|2,0,0]=3 874 B8R0.1 CCOC(=O)OCCBr Amb24480075 [0,1,0,0,0,0|3,0,0]=4 875 B8R0.1 CCOC(=O)OCCO Amb28072969 [0,1,0,0,0,0|2,0,0]=3 876 B8R0.1 CCOC(=O)OCCS Amb26511404 [0,1,0,0,0,0|2,1,0]=4 877 B8R0.1 CCOC(=O)SCCCl Amb27453639 [0,1,0,0,0,0|3,0,0]=4 878 B8R0.1 CCOC(=O)\C=C\CO Amb27154784 [0,1,0,0,0,0|1,0,2]=4 879 B8R0.1 CCOC(C)CCCBr Amb33006294 [0,1,0,0,0,0|2,0,1]=4 880 B8R0.1 CCOC(C)CCCN Amb28049325 [0,1,0,0,0,0|2,0,1]=4 881 B8R0.1 CCOC(C)CCCO Amb26454825 [0,1,0,0,0,0|1,0,1]=3 882 B8R0.1 CCOC(C)CCCS Amb33424965 [0,1,0,0,0,0|1,1,1]=4 883 B8R0.1 CCOC(C)\C=C\CN Amb33425048 [0,1,0,0,0,0|3,0,0]=4 884 B8R0.1 CCOC(C)\C=C\CO Amb33225077 [0,1,0,0,0,0|3,0,0]=4 885 B8R0.1 CCOCC(=N)OCC Amb25095949 [0,1,0,0,0,0|3,0,0]=4 886 B8R0.1 CCOCC(=O)OCC Amb2720920 [0,1,0,0,0,0|3,0,0]=4 887 B8R0.1 CCOCC(C)CCBr Amb27632410 [0,1,0,0,0,0|2,0,1]=4 888 B8R0.1 CCOCC(C)CCO Amb27662371 [0,1,0,0,0,0|1,0,1]=3 889 B8R0.1 CCOCC(Cl)CCO Amb27983791 [0,1,0,0,0,0|1,0,1]=3 890 B8R0.1 CCOCC(N)CCO Amb27955043 [0,1,0,0,0,0|1,0,1]=3 891 B8R0.1 CCOCC(O)CCN Amb26342443 [0,1,0,0,0,0|2,0,1]=4 892 B8R0.1 CCOCN(C)CCO Amb27394886 [0,1,0,0,0,0|2,0,1]=4 893 B8R0.1 CCOC[C@@H](O)CCN Amb32660151 [0,1,0,0,0,0|2,0,1]=4 894 B8R0.1 CCOC[C@H](O)CCN Amb32660157 [0,1,0,0,0,0|2,0,1]=4 895 B8R0.1 CCONC(=O)CCO Amb27826995 [0,1,0,0,0,0|2,0,1]=4 896 B8R0.1 CCO[PH](=O)OCCO Amb27768647 [0,1,0,0,0,0|3,0,0]=4 897 B8R0.1 CCSC(=O)CCCBr Amb27440205 [0,1,0,0,0,0|2,0,0]=3 898 B8R0.1 CCSC(=O)CCCCl Amb27412565 [0,1,0,0,0,0|2,0,0]=3 899 B8R0.1 CCSCC(C)CCN Amb33324044 [0,1,0,0,0,0|2,0,1]=4 900 B8R0.1 CCSCC(F)CCN Amb33323743 [0,1,0,0,0,0|2,0,1]=4 901 B8R0.1 CCSCC(N)CCO Amb25336776 [0,1,0,0,0,0|1,0,1]=3 902 B8R0.1 CCSCC(O)CCN Amb26613825 [0,1,0,0,0,0|2,0,1]=4 903 B8R0.1 CCSC[C@@H](O)CCN Amb33321297 [0,1,0,0,0,0|2,0,1]=4 904 B8R0.1 CCSC[C@H](O)CCN Amb33321513 [0,1,0,0,0,0|2,0,1]=4 905 B8R0.1 CCS\C(Cl)=N\CCCl Amb28193741 [0,1,0,0,0,0|3,0,0]=4 906 B8R0.1 CC\C=C(/Br)CN=[N+]=[N-] Amb28239825 [0,1,0,0,0,0|3,0,0]=4 907 B8R0.1 CC\C=C(C)/C=C/CN Amb27787683 [0,1,0,0,0,0|1,0,2]=4 908 B8R0.1 CC\C=C(\C)CCCO Amb28192896 [0,1,0,0,0,0|0,0,0]=1 909 B8R0.1 CC\C=C(\C)NCCN Amb27815059 [0,1,0,0,0,0|2,0,0]=3 910 B8R0.1 CC\C=C(\C)SCCO Amb27260247 [0,1,0,0,0,0|1,0,0]=2 911 B8R0.1 CC\C=C/C(=O)CCC Amb27838798 [0,1,0,0,0,0|1,0,1]=3 912 B8R0.1 CC\C=C\C(=O)CCN Amb33268706 [0,1,0,0,0,0|1,0,1]=3 913 B8R0.1 CC\C=C\C(=O)CNC Amb33268702 [0,1,0,0,0,0|2,0,1]=4 914 B8R0.1 CC\C=C\C(=O)COC Amb27793962 [0,1,0,0,0,0|2,0,1]=4 915 B8R0.1 CC\C=C\C(=O)OCC Amb22008263 [0,1,0,0,0,0|2,0,1]=4 916 B8R0.1 CC\C=C\C(C)CC=O Amb27838607 [0,1,0,0,0,0|0,0,2]=3 917 B8R0.1 CC\C=C\C(C)CCN Amb33268705 [0,1,0,0,0,0|1,0,0]=2 918 B8R0.1 CC\C=C\C(C)CON Amb33268243 [0,1,0,0,0,0|2,0,0]=3 919 B8R0.1 CC\C=C\C(C)N=C=O Amb33268688 [0,1,0,0,0,0|1,0,2]=4 920 B8R0.1 CC\C=C\C(F)CCN Amb33268246 [0,1,0,0,0,0|1,0,0]=2 921 B8R0.1 CC\C=C\C(N)CCO Amb33225039 [0,1,0,0,0,0|0,0,0]=1 922 B8R0.1 CC\C=C\C(O)CC#N Amb33267979 [0,1,0,0,0,0|1,0,1]=3 923 B8R0.1 CC\C=C\C(O)CCN Amb33268711 [0,1,0,0,0,0|1,0,0]=2 924 B8R0.1 CC\C=C\C(O)CNC Amb33268703 [0,1,0,0,0,0|2,0,0]=3 925 B8R0.1 CC\C=C\[C@@H](O)CCN Amb33268248 [0,1,0,0,0,0|1,0,0]=2 926 B8R0.1 CC\C=C\[C@H](O)CCN Amb33268249 [0,1,0,0,0,0|1,0,0]=2 927 B8R0.1 CN(CCCl)CCCO Amb27403185 [0,1,0,0,0,0|2,0,1]=4 928 B8R0.1 CN(CCN)CCCO Amb25735966 [0,1,0,0,0,0|2,0,1]=4 929 B8R0.1 CN(CCO)CCCO Amb28049324 [0,1,0,0,0,0|2,0,1]=4 930 B8R0.1 CNCC(=O)NCCO Amb8866820 [0,1,0,0,0,0|2,0,1]=4 931 B8R0.1 CNCCC(C)CCO Amb17569925 [0,1,0,0,0,0|1,0,2]=4 932 B8R0.1 COCC(=O)CCCCl Amb27838444 [0,1,0,0,0,0|2,0,1]=4 933 B8R0.1 COCC(=O)CCCO Amb27869244 [0,1,0,0,0,0|1,0,1]=3 934 B8R0.1 COCC(=O)NCCO Amb25828239 [0,1,0,0,0,0|2,0,1]=4 935 B8R0.1 COCC(=O)OCCO Amb28366893 [0,1,0,0,0,0|2,0,1]=4 936 B8R0.1 COCC(C)\C=C\CBr Amb25222701 [0,1,0,0,0,0|3,0,0]=4 937 B8R0.1 COCC(O)CCCO Amb27806873 [0,1,0,0,0,0|1,0,2]=4 938 B8R0.1 COCCC(N)CCO Amb32946713 [0,1,0,0,0,0|1,0,2]=4 939 B8R0.1 COCCC(O)CCO Amb28189604 [0,1,0,0,0,0|1,0,2]=4 940 B8R0.1 COCC\C(Br)=C\CCl Amb27950724 [0,1,0,0,0,0|3,0,0]=4 941 B8R0.1 COCC\C(C)=C\CCl Amb28351548 [0,1,0,0,0,0|3,0,0]=4 942 B8R0.1 COCC\C(Cl)=C\CBr Amb27868052 [0,1,0,0,0,0|3,0,0]=4 943 B8R0.1 COCOC(C)CCO Amb26875634 [0,1,0,0,0,0|2,0,1]=4 944 B8R0.1 COCSC(C)CCO Amb27180843 [0,1,0,0,0,0|2,0,1]=4 945 B8R0.1 CONC(=O)CCCO Amb27810629 [0,1,0,0,0,0|2,0,0]=3 946 B8R0.1 CONC(=O)NCCO Amb27649685 [0,1,0,0,0,0|3,0,0]=4 947 B8R0.1 CSCCC(N)CCO Amb27455675 [0,1,0,0,0,0|1,0,2]=4 948 B8R0.1 CSCC[C@@H](N)CCO Amb27950118 [0,1,0,0,0,0|1,0,2]=4 949 B8R0.1 CSCC[C@H](N)CCO Amb27236737 [0,1,0,0,0,0|1,0,2]=4 950 B8R0.1 CSNC(=O)NCCO Amb27848127 [0,1,0,0,0,0|3,0,0]=4 951 B8R0.1 CS\C=C\C(C)CCN Amb27655514 [0,1,0,0,0,0|2,0,0]=3 952 B8R0.1 C\C(=C/C=C/Cl)CCO Amb27233484 [0,1,0,0,0,0|1,0,2]=4 953 B8R0.1 C\C(=C/CBr)CCCCl Amb27789900 [0,1,0,0,0,0|2,0,0]=3 954 B8R0.1 C\C(=C/CCO)CCBr Amb27489112 [0,1,0,0,0,0|1,0,2]=4 955 B8R0.1 C\C(=C/CCl)CCC=O Amb27622941 [0,1,0,0,0,0|1,0,2]=4 956 B8R0.1 C\C(=C/CO)CCC=O Amb27827380 [0,1,0,0,0,0|1,0,2]=4 957 B8R0.1 C\C(=C/CO)CCCN Amb27469758 [0,1,0,0,0,0|2,0,0]=3 958 B8R0.1 C\C(=C/CO)NCCO Amb27761133 [0,1,0,0,0,0|2,0,0]=3 959 B8R0.1 C\C(=C\CCl)CCC=O Amb27865820 [0,1,0,0,0,0|1,0,2]=4 960 B8R0.1 C\C=C/C(=O)CCC#N Amb28350705 [0,1,0,0,0,0|1,0,2]=4 961 B8R0.1 C\C=C\C(=O)CCC=O Amb24610089 [0,1,0,0,0,0|0,0,3]=4 962 B8R0.1 C\C=C\C(=O)CCCC Amb22043314 [0,1,0,0,0,0|1,0,1]=3 963 B8R0.1 C\C=C\C(=O)NCCC Amb26018237 [0,1,0,0,0,0|2,0,1]=4 964 B8R0.1 C\C=C\C(=O)NCCN Amb18289751 [0,1,0,0,0,0|2,0,1]=4 965 B8R0.1 C\C=C\C(=O)OCCBr Amb27409046 [0,1,0,0,0,0|2,0,1]=4 966 B8R0.1 C\C=C\C(O)CCCC Amb4605888 [0,1,0,0,0,0|1,0,2]=4 967 B8R0.1 C\C=C\CS(=O)CCO Amb28345117 [0,1,0,0,0,0|1,0,2]=4 968 B8R0.1 C\C=C\C[C@H](O)CCC Amb27424856 [0,1,0,0,0,0|1,0,2]=4 969 B8R0.1 NCCCC(N)CCO Amb28285147 [0,1,0,0,0,0|1,0,2]=4 970 B8R0.1 O=C(CCBr)CCCCl Amb24434557 [0,1,0,0,0,0|2,0,1]=4 971 B8R0.1 O=C(CCBr)NCCO Amb17325574 [0,1,0,0,0,0|2,0,1]=4 972 B8R0.1 O=C(CCCl)NCCO Amb17326981 [0,1,0,0,0,0|2,0,1]=4 973 B8R0.1 O=C(CCO)NCCO Amb28197638 [0,1,0,0,0,0|2,0,1]=4 974 B8R0.1 O=C(CCS)NCCO Amb24417502 [0,1,0,0,0,0|2,0,1]=4 975 B8R0.1 O=C(CCS)OCCO Amb2721244 [0,1,0,0,0,0|2,0,1]=4 976 B8R0.1 O=C\C=C/C(=O)CCO Amb27643576 [0,1,0,0,0,0|1,0,2]=4 977 B8R0.1 OCCCC(Cl)CCCl Amb27409130 [0,1,0,0,0,0|1,0,2]=4 978 B8R0.1 OCCCC(O)CCO Amb28366883 [0,1,0,0,0,0|1,0,2]=4 979 B8R0.1 OC\C=C\C(O)CCBr Amb28434657 [0,1,0,0,0,0|2,0,0]=3 980 B8R0.1 [C-]#[N+]CCC(=O)OCC Amb2592648 [0,1,0,0,0,0|3,0,0]=4 981 B8R0.4 BrCCCCCCCBr Amb10069015 [0,1,0,0,0,0|1,0,2]=4 982 B8R0.4 BrCCCOCCCBr Amb27206373 [0,1,0,0,0,0|2,0,1]=4 983 B8R0.4 C#CCCCCCCC Amb3940501 [0,1,0,0,0,0|1,0,2]=4 984 B8R0.4 C#CCCCCCCO Amb16231466 [0,1,0,0,0,0|0,0,3]=4 985 B8R0.4 C#CCCCC\C=C/C Amb28291350 [0,1,0,0,0,0|1,0,2]=4 986 B8R0.4 C#CCCCC\C=C\C Amb28077120 [0,1,0,0,0,0|1,0,2]=4 987 B8R0.4 C#CCCCNOCC Amb27466905 [0,1,0,0,0,0|3,0,0]=4 988 B8R0.4 C#CCCC\C=C\CBr Amb27484040 [0,1,0,0,0,0|2,0,0]=3 989 B8R0.4 C#CCCNCCCO Amb27837526 [0,1,0,0,0,0|1,0,2]=4 990 B8R0.4 C#CCCO\C=C\CO Amb28315455 [0,1,0,0,0,0|2,0,1]=4 991 B8R0.4 C#CCC\C=C\CCC Amb33373746 [0,1,0,0,0,0|1,0,1]=3 992 B8R0.4 C#CCC\C=C\CCCl Amb27793128 [0,1,0,0,0,0|1,0,1]=3 993 B8R0.4 C#CCOCCCCO Amb28292910 [0,1,0,0,0,0|1,0,2]=4 994 B8R0.4 C#CC\C=C\CCNC Amb27403808 [0,1,0,0,0,0|2,0,1]=4 995 B8R0.4 C#C\C=C\C=C\CCO Amb28315560 [0,1,0,0,0,0|0,0,3]=4 996 B8R0.4 C#C\C=C\CCNCC Amb27174739 [0,1,0,0,0,0|1,0,2]=4 997 B8R0.4 C#C\C=C\NCCCC Amb27247245 [0,1,0,0,0,0|1,0,2]=4 998 B8R0.4 C=CCCCCCCC Amb3940502 [0,1,0,0,0,0|1,0,2]=4 999 B8R0.4 C=CCCCCCCO Amb22230162 [0,1,0,0,0,0|0,0,3]=4 1000 B8R0.4 C=CCCCCNCC Amb27461423 [0,1,0,0,0,0|2,0,1]=4 1001 B8R0.4 C=CCCC\C=C\CBr Amb27477769 [0,1,0,0,0,0|2,0,0]=3 1002 B8R0.4 C=CCCC\C=C\CO Amb19930201 [0,1,0,0,0,0|2,0,0]=3 1003 B8R0.4 C=CCC\C=C\CCCl Amb27967746 [0,1,0,0,0,0|1,0,1]=3 1004 B8R0.4 C=CCNC\C=C\CC Amb27432892 [0,1,0,0,0,0|1,0,1]=3 1005 B8R0.4 C=CCOCCCCO Amb26022466 [0,1,0,0,0,0|1,0,2]=4 1006 B8R0.4 C=CCOC\C=C/CBr Amb27768655 [0,1,0,0,0,0|2,0,1]=4 1007 B8R0.4 C=CCOC\C=C\CBr Amb27433951 [0,1,0,0,0,0|2,0,1]=4 1008 B8R0.4 C=CCSC\C=C\CN Amb27953494 [0,1,0,0,0,0|2,0,1]=4 1009 B8R0.4 C=CCSC\C=C\CO Amb27761655 [0,1,0,0,0,0|2,0,1]=4 1010 B8R0.4 C=CC\C=C\CCNC Amb27813996 [0,1,0,0,0,0|2,0,1]=4 1011 B8R0.4 C=C\C=C\CCCCBr Amb32688174 [0,1,0,0,0,0|1,0,2]=4 1012 B8R0.4 C=C\C=C\CCCCC Amb22641683 [0,1,0,0,0,0|1,0,2]=4 1013 B8R0.4 C=C\C=C\CCCCCl Amb32688173 [0,1,0,0,0,0|1,0,2]=4 1014 B8R0.4 C=C\C=C\CCNCC Amb27873157 [0,1,0,0,0,0|1,0,2]=4 1015 B8R0.4 C=C\C=C\CNCCC Amb26967633 [0,1,0,0,0,0|1,0,2]=4 1016 B8R0.4 CC#CC#CCCCO Amb28318701 [0,1,0,0,0,0|0,0,3]=4 1017 B8R0.4 CC#CCCCCCO Amb27243915 [0,1,0,0,0,0|0,0,3]=4 1018 B8R0.4 CC#CCCNCCO Amb27410371 [0,1,0,0,0,0|0,0,3]=4 1019 B8R0.4 CC#CCC\C=C\CBr Amb27161292 [0,1,0,0,0,0|2,0,1]=4 1020 B8R0.4 CC#C\C=C\C=C\CO Amb28049108 [0,1,0,0,0,0|0,0,3]=4 1021 B8R0.4 CC#C\C=C\NCCC Amb27799237 [0,1,0,0,0,0|2,0,1]=4 1022 B8R0.4 CCC#CC#CCCO Amb17593246 [0,1,0,0,0,0|0,0,3]=4 1023 B8R0.4 CCC#CCC#CCO Amb9134785 [0,1,0,0,0,0|0,0,3]=4 1024 B8R0.4 CCC#CCCCC#N Amb25727195 [0,1,0,0,0,0|1,0,2]=4 1025 B8R0.4 CCC#CCCCCC Amb9134716 [0,1,0,0,0,0|1,0,2]=4 1026 B8R0.4 CCC#CCCCCN Amb28049876 [0,1,0,0,0,0|1,0,2]=4 1027 B8R0.4 CCC#CCCCCO Amb26362942 [0,1,0,0,0,0|0,0,2]=3 1028 B8R0.4 CCC#CCC\C=C\O Amb28049153 [0,1,0,0,0,0|0,0,3]=4 1029 B8R0.4 CCC#CCOCCBr Amb28075793 [0,1,0,0,0,0|1,0,2]=4 1030 B8R0.4 CCC#CC\C=C/CO Amb17593279 [0,1,0,0,0,0|0,0,3]=4 1031 B8R0.4 CCC#C\C=C\CCO Amb27472464 [0,1,0,0,0,0|0,0,2]=3 1032 B8R0.4 CCC=C=CC#CCO Amb27956645 [0,1,0,0,0,0|0,0,2]=3 1033 B8R0.4 CCCC#CCCCC Amb9134717 [0,1,0,0,0,0|1,0,2]=4 1034 B8R0.4 CCCC=C=CCCO Amb17593316 [0,1,0,0,0,0|0,0,2]=3 1035 B8R0.4 CCCCBCCCC Amb27624537 [0,1,0,0,0,0|1,0,2]=4 1036 B8R0.4 CCCCC#CCCCl Amb28050989 [0,1,0,0,0,0|1,0,2]=4 1037 B8R0.4 CCCCC#CCCO Amb2721716 [0,1,0,0,0,0|0,0,3]=4 1038 B8R0.4 CCCCCCCC#N Amb7764637 [0,1,0,0,0,0|1,0,2]=4 1039 B8R0.4 CCCCCCCC=O Amb6891949 [0,1,0,0,0,0|0,0,3]=4 1040 B8R0.4 CCCCCCCCBr Amb2689971 [0,1,0,0,0,0|1,0,2]=4 1041 B8R0.4 CCCCCCCCC Amb8513269 [0,1,0,0,0,0|1,0,2]=4 1042 B8R0.4 CCCCCCCCCl Amb7757832 [0,1,0,0,0,0|1,0,2]=4 1043 B8R0.4 CCCCCCCCF Amb10840379 [0,1,0,0,0,0|1,0,2]=4 1044 B8R0.4 CCCCCCCCI Amb637144 [0,1,0,0,0,0|1,0,2]=4 1045 B8R0.4 CCCCCCCCN Amb2720240 [0,1,0,0,0,0|1,0,2]=4 1046 B8R0.4 CCCCCCCCN Amb3940466 [0,1,0,0,0,0|1,0,2]=4 1047 B8R0.4 CCCCCCCCO Amb6608788 [0,1,0,0,0,0|0,0,2]=3 1048 B8R0.4 CCCCCCCCS Amb8513530 [0,1,0,0,0,0|0,1,2]=4 1049 B8R0.4 CCCCCCCC[SiH3] Amb19893984 [0,1,0,0,0,0|1,0,2]=4 1050 B8R0.4 CCCCCCCNC Amb7761453 [0,1,0,0,0,0|1,0,2]=4 1051 B8R0.4 CCCCCCCNN Amb7794376 [0,1,0,0,0,0|1,0,2]=4 1052 B8R0.4 CCCCCCCOC Amb24584912 [0,1,0,0,0,0|0,0,2]=3 1053 B8R0.4 CCCCCCCSC Amb22359861 [0,1,0,0,0,0|0,1,2]=4 1054 B8R0.4 CCCCCCNCC Amb6730567 [0,1,0,0,0,0|1,0,2]=4 1055 B8R0.4 CCCCCCOCC Amb17672946 [0,1,0,0,0,0|1,0,2]=4 1056 B8R0.4 CCCCCCOCCl Amb27473208 [0,1,0,0,0,0|1,0,2]=4 1057 B8R0.4 CCCCCNCCC Amb6688182 [0,1,0,0,0,0|1,0,2]=4 1058 B8R0.4 CCCCCNCCCl Amb17334288 [0,1,0,0,0,0|1,0,2]=4 1059 B8R0.4 CCCCCNCCI Amb27411190 [0,1,0,0,0,0|1,0,2]=4 1060 B8R0.4 CCCCCNCCN Amb17091049 [0,1,0,0,0,0|1,0,2]=4 1061 B8R0.4 CCCCCNCCO Amb3940022 [0,1,0,0,0,0|0,0,2]=3 1062 B8R0.4 CCCCCOCCCl Amb8902963 [0,1,0,0,0,0|1,0,2]=4 1063 B8R0.4 CCCCCOCCO Amb22264988 [0,1,0,0,0,0|0,0,2]=3 1064 B8R0.4 CCCCCOCCS Amb27752940 [0,1,0,0,0,0|0,1,2]=4 1065 B8R0.4 CCCCCSCCCl Amb25887277 [0,1,0,0,0,0|1,0,2]=4 1066 B8R0.4 CCCCCSCCN Amb6275043 [0,1,0,0,0,0|1,0,2]=4 1067 B8R0.4 CCCCCSCCO Amb1032987 [0,1,0,0,0,0|0,0,2]=3 1068 B8R0.4 CCCCCSCOC Amb27771414 [0,1,0,0,0,0|1,0,2]=4 1069 B8R0.4 CCCCC\C=C\C#N Amb18642132 [0,1,0,0,0,0|2,0,1]=4 1070 B8R0.4 CCCCC\C=C\CBr Amb17666913 [0,1,0,0,0,0|2,0,0]=3 1071 B8R0.4 CCCCC\C=C\CO Amb33038088 [0,1,0,0,0,0|2,0,0]=3 1072 B8R0.4 CCCCC\C=N\OC Amb28204102 [0,1,0,0,0,0|2,0,1]=4 1073 B8R0.4 CCCCNCCCBr Amb28399869 [0,1,0,0,0,0|1,0,2]=4 1074 B8R0.4 CCCCNCCCC Amb22348285 [0,1,0,0,0,0|1,0,2]=4 1075 B8R0.4 CCCCNCCCC Amb3939027 [0,1,0,0,0,0|1,0,2]=4 1076 B8R0.4 CCCCNCCCC Amb4017913 [0,1,0,0,0,0|1,0,2]=4 1077 B8R0.4 CCCCNCCCCl Amb24529030 [0,1,0,0,0,0|1,0,2]=4 1078 B8R0.4 CCCCNCCCCl Amb33164142 [0,1,0,0,0,0|1,0,2]=4 1079 B8R0.4 CCCCNCCCN Amb17315267 [0,1,0,0,0,0|1,0,2]=4 1080 B8R0.4 CCCCNCCCO Amb4304116 [0,1,0,0,0,0|0,0,2]=3 1081 B8R0.4 CCCCNCCOC Amb6685727 [0,1,0,0,0,0|1,0,2]=4 1082 B8R0.4 CCCCNOCCO Amb27956595 [0,1,0,0,0,0|1,0,2]=4 1083 B8R0.4 CCCCOCCCBr Amb8895241 [0,1,0,0,0,0|1,0,2]=4 1084 B8R0.4 CCCCOCCCC Amb8513426 [0,1,0,0,0,0|1,0,2]=4 1085 B8R0.4 CCCCOCCCN Amb3939348 [0,1,0,0,0,0|1,0,2]=4 1086 B8R0.4 CCCCOCCOC Amb33847381 [0,1,0,0,0,0|1,0,2]=4 1087 B8R0.4 CCCCPCCCC Amb22730293 [0,1,0,0,0,0|1,0,2]=4 1088 B8R0.4 CCCCPCCCN Amb27217298 [0,1,0,0,0,0|1,0,2]=4 1089 B8R0.4 CCCCSCCCF Amb27449027 [0,1,0,0,0,0|1,0,2]=4 1090 B8R0.4 CCCCSCCCN Amb9261123 [0,1,0,0,0,0|1,0,2]=4 1091 B8R0.4 CCCCSCCCS Amb28453845 [0,1,0,0,0,0|0,1,2]=4 1092 B8R0.4 CCCCSCCOC Amb27827301 [0,1,0,0,0,0|1,0,2]=4 1093 B8R0.4 CCCCS\C=C\CO Amb27219509 [0,1,0,0,0,0|2,0,0]=3 1094 B8R0.4 CCCC[NH2+]CCCC Amb22732582 [0,1,0,0,0,0|1,0,2]=4 1095 B8R0.4 CCCC[NH2+]CCCC Amb8516289 [0,1,0,0,0,0|1,0,2]=4 1096 B8R0.4 CCCC[SnH4+2]CCCC Amb22045422 [0,1,0,0,0,0|1,0,2]=4 1097 B8R0.4 CCCC[SnH4+2]CCCC Amb22045423 [0,1,0,0,0,0|1,0,2]=4 1098 B8R0.4 CCCC\C=C/CCO Amb26586236 [0,1,0,0,0,0|1,0,0]=2 1099 B8R0.4 CCCC\C=C\CCN Amb27788288 [0,1,0,0,0,0|1,0,0]=2 1100 B8R0.4 CCCC\C=C\CCO Amb9134733 [0,1,0,0,0,0|1,0,0]=2 1101 B8R0.4 CCCC\C=C\OCC Amb17674075 [0,1,0,0,0,0|1,0,0]=2 1102 B8R0.4 CCCNCCCCI Amb28072729 [0,1,0,0,0,0|1,0,2]=4 1103 B8R0.4 CCCNCCCCN Amb17334115 [0,1,0,0,0,0|1,0,2]=4 1104 B8R0.4 CCCNCCCCS Amb28349265 [0,1,0,0,0,0|0,1,2]=4 1105 B8R0.4 CCCNCCCOC Amb6730309 [0,1,0,0,0,0|1,0,1]=3 1106 B8R0.4 CCCNCCOCC Amb8841458 [0,1,0,0,0,0|2,0,1]=4 1107 B8R0.4 CCCNCCSCC Amb27837542 [0,1,0,0,0,0|2,0,1]=4 1108 B8R0.4 CCCNCNCCC Amb28250874 [0,1,0,0,0,0|2,0,1]=4 1109 B8R0.4 CCCNCSCCC Amb27784117 [0,1,0,0,0,0|2,0,1]=4 1110 B8R0.4 CCCOCCCC#N Amb8874818 [0,1,0,0,0,0|2,0,1]=4 1111 B8R0.4 CCCOCCCC=O Amb27795367 [0,1,0,0,0,0|1,0,2]=4 1112 B8R0.4 CCCOCCCCBr Amb8874783 [0,1,0,0,0,0|1,0,2]=4 1113 B8R0.4 CCCOCCCCCl Amb18181651 [0,1,0,0,0,0|1,0,2]=4 1114 B8R0.4 CCCOCCCCO Amb27395455 [0,1,0,0,0,0|0,0,2]=3 1115 B8R0.4 CCCOCCCON Amb27420839 [0,1,0,0,0,0|1,0,1]=3 1116 B8R0.4 CCCOCCNCC Amb28146663 [0,1,0,0,0,0|2,0,1]=4 1117 B8R0.4 CCCOCCOCCl Amb28246338 [0,1,0,0,0,0|2,0,1]=4 1118 B8R0.4 CCCOCOCCC Amb22230733 [0,1,0,0,0,0|2,0,1]=4 1119 B8R0.4 CCCOC\C=C\CCl Amb27628817 [0,1,0,0,0,0|2,0,0]=3 1120 B8R0.4 CCCSCCCC#N Amb6680724 [0,1,0,0,0,0|2,0,1]=4 1121 B8R0.4 CCCSCCCCCl Amb18798739 [0,1,0,0,0,0|1,0,2]=4 1122 B8R0.4 CCCSCCCCN Amb9391521 [0,1,0,0,0,0|1,0,2]=4 1123 B8R0.4 CCCSCCCCO Amb9370795 [0,1,0,0,0,0|0,0,2]=3 1124 B8R0.4 CCCSCCCCS Amb27766901 [0,1,0,0,0,0|0,1,2]=4 1125 B8R0.4 CCCSCCCOC Amb27837637 [0,1,0,0,0,0|1,0,1]=3 1126 B8R0.4 CCCSCCOCC Amb27970679 [0,1,0,0,0,0|2,0,1]=4 1127 B8R0.4 CCC\C=C/CCCC Amb26023943 [0,1,0,0,0,0|1,0,0]=2 1128 B8R0.4 CCC\C=C\C#CCO Amb27661089 [0,1,0,0,0,0|0,0,2]=3 1129 B8R0.4 CCC\C=C\C=C/CN Amb27768643 [0,1,0,0,0,0|1,0,2]=4 1130 B8R0.4 CCC\C=C\C=C\CBr Amb28285136 [0,1,0,0,0,0|1,0,2]=4 1131 B8R0.4 CCC\C=C\C=C\CCl Amb27630001 [0,1,0,0,0,0|1,0,2]=4 1132 B8R0.4 CCC\C=C\C=C\CN Amb27252152 [0,1,0,0,0,0|1,0,2]=4 1133 B8R0.4 CCC\C=C\C=C\CO Amb22053869 [0,1,0,0,0,0|0,0,2]=3 1134 B8R0.4 CCC\C=C\CCC#N Amb33226017 [0,1,0,0,0,0|1,0,1]=3 1135 B8R0.4 CCC\C=C\CCC=O Amb33172232 [0,1,0,0,0,0|0,0,2]=3 1136 B8R0.4 CCC\C=C\CCCBr Amb26574256 [0,1,0,0,0,0|1,0,0]=2 1137 B8R0.4 CCC\C=C\CCCC Amb2778543 [0,1,0,0,0,0|1,0,0]=2 1138 B8R0.4 CCC\C=C\CCCN Amb33327176 [0,1,0,0,0,0|1,0,0]=2 1139 B8R0.4 CCC\C=C\CCCS Amb33373717 [0,1,0,0,0,0|0,1,0]=2 1140 B8R0.4 CCC\C=C\CCNC Amb33429318 [0,1,0,0,0,0|2,0,0]=3 1141 B8R0.4 CCC\C=C\CCON Amb33424856 [0,1,0,0,0,0|0,0,2]=3 1142 B8R0.4 CCC\C=C\CCSC Amb27810331 [0,1,0,0,0,0|2,0,0]=3 1143 B8R0.4 CCC\C=C\CN=C=O Amb33172054 [0,1,0,0,0,0|1,0,2]=4 1144 B8R0.4 CCC\C=C\CN=[N+]=[N-] Amb33359656 [0,1,0,0,0,0|3,0,0]=4 1145 B8R0.4 CCC\C=C\COC=O Amb22231662 [0,1,0,0,0,0|1,0,2]=4 1146 B8R0.4 CCC\C=N\CCCC Amb19375587 [0,1,0,0,0,0|1,0,1]=3 1147 B8R0.4 CCNCCCCC#N Amb27763344 [0,1,0,0,0,0|2,0,1]=4 1148 B8R0.4 CCNCCCCCF Amb27956469 [0,1,0,0,0,0|1,0,2]=4 1149 B8R0.4 CCNCCCCCI Amb27761837 [0,1,0,0,0,0|1,0,2]=4 1150 B8R0.4 CCNCCCCCN Amb27447573 [0,1,0,0,0,0|1,0,2]=4 1151 B8R0.4 CCNCCCCCO Amb17334130 [0,1,0,0,0,0|0,0,2]=3 1152 B8R0.4 CCNCCCCOC Amb27837458 [0,1,0,0,0,0|1,0,1]=3 1153 B8R0.4 CCNCCCCSC Amb27837487 [0,1,0,0,0,0|1,1,1]=4 1154 B8R0.4 CCNCCCNCC Amb20171936 [0,1,0,0,0,0|2,0,1]=4 1155 B8R0.4 CCNCCCSCC Amb27647486 [0,1,0,0,0,0|2,0,1]=4 1156 B8R0.4 CCNCCNCCF Amb27768816 [0,1,0,0,0,0|2,0,1]=4 1157 B8R0.4 CCNCCNCCN Amb27411449 [0,1,0,0,0,0|2,0,1]=4 1158 B8R0.4 CCNCCOCCBr Amb27208133 [0,1,0,0,0,0|2,0,1]=4 1159 B8R0.4 CCNCCOCCN Amb25305457 [0,1,0,0,0,0|2,0,1]=4 1160 B8R0.4 CCNCCOCCO Amb6736237 [0,1,0,0,0,0|1,0,1]=3 1161 B8R0.4 CCN\C=C\CNCC Amb27627377 [0,1,0,0,0,0|2,0,0]=3 1162 B8R0.4 CCN\N=C\CCCO Amb27662112 [0,1,0,0,0,0|1,0,0]=2 1163 B8R0.4 CCOCC=C=CCCl Amb27811427 [0,1,0,0,0,0|3,0,0]=4 1164 B8R0.4 CCOCCCCCBr Amb24502334 [0,1,0,0,0,0|1,0,2]=4 1165 B8R0.4 CCOCCCCCCl Amb9001650 [0,1,0,0,0,0|1,0,2]=4 1166 B8R0.4 CCOCCCCCS Amb27835597 [0,1,0,0,0,0|0,1,2]=4 1167 B8R0.4 CCOCCCCNC Amb28049603 [0,1,0,0,0,0|2,0,1]=4 1168 B8R0.4 CCOCCNCCBr Amb27629210 [0,1,0,0,0,0|2,0,1]=4 1169 B8R0.4 CCOCCNCCCl Amb27801916 [0,1,0,0,0,0|2,0,1]=4 1170 B8R0.4 CCOCCNCCN Amb27603963 [0,1,0,0,0,0|2,0,1]=4 1171 B8R0.4 CCOCCNCCS Amb28048707 [0,1,0,0,0,0|1,1,1]=4 1172 B8R0.4 CCOCCOCCCl Amb8828467 [0,1,0,0,0,0|2,0,1]=4 1173 B8R0.4 CCOCCOCCN Amb30585145 [0,1,0,0,0,0|2,0,1]=4 1174 B8R0.4 CCOCCOCCN Amb6243196 [0,1,0,0,0,0|2,0,1]=4 1175 B8R0.4 CCOCCOCCO Amb8513162 [0,1,0,0,0,0|1,0,1]=3 1176 B8R0.4 CCOCCSCCF Amb28122264 [0,1,0,0,0,0|2,0,1]=4 1177 B8R0.4 CCOCC\C=C\CCl Amb27470132 [0,1,0,0,0,0|2,0,0]=3 1178 B8R0.4 CCOCC\C=N\OC Amb28049682 [0,1,0,0,0,0|3,0,0]=4 1179 B8R0.4 CCOCSCCCN Amb28143434 [0,1,0,0,0,0|2,0,1]=4 1180 B8R0.4 CCOCSCCCO Amb27842168 [0,1,0,0,0,0|1,0,1]=3 1181 B8R0.4 CCOC\C=C\CCO Amb27972232 [0,1,0,0,0,0|0,0,2]=3 1182 B8R0.4 CCONCCCCO Amb28326276 [0,1,0,0,0,0|1,0,1]=3 1183 B8R0.4 CCO\N=C\CSCC Amb27953958 [0,1,0,0,0,0|3,0,0]=4 1184 B8R0.4 CCSCCCCC=O Amb24690525 [0,1,0,0,0,0|1,0,2]=4 1185 B8R0.4 CCSCCCCCBr Amb25887441 [0,1,0,0,0,0|1,0,2]=4 1186 B8R0.4 CCSCCCCCCl Amb9304998 [0,1,0,0,0,0|1,0,2]=4 1187 B8R0.4 CCSCCCCCF Amb28207049 [0,1,0,0,0,0|1,0,2]=4 1188 B8R0.4 CCSCCCCCN Amb28049047 [0,1,0,0,0,0|1,0,2]=4 1189 B8R0.4 CCSCCCCNC Amb27837488 [0,1,0,0,0,0|2,0,1]=4 1190 B8R0.4 CCSCCCCOC Amb27651458 [0,1,0,0,0,0|1,0,1]=3 1191 B8R0.4 CCSCCNCCF Amb27241603 [0,1,0,0,0,0|2,0,1]=4 1192 B8R0.4 CCSCCNCCO Amb27454287 [0,1,0,0,0,0|1,0,1]=3 1193 B8R0.4 CCSCCOCCBr Amb27856710 [0,1,0,0,0,0|2,0,1]=4 1194 B8R0.4 CCSCCOCCCl Amb27978105 [0,1,0,0,0,0|2,0,1]=4 1195 B8R0.4 CCSCCOCCN Amb17501990 [0,1,0,0,0,0|2,0,1]=4 1196 B8R0.4 CCSCCSCCF Amb27768840 [0,1,0,0,0,0|2,0,1]=4 1197 B8R0.4 CC\C=C/CCCCC Amb25258581 [0,1,0,0,0,0|1,0,0]=2 1198 B8R0.4 CC\C=C/CCCCN Amb28313712 [0,1,0,0,0,0|1,0,0]=2 1199 B8R0.4 CC\C=C/CCCCO Amb22052636 [0,1,0,0,0,0|0,0,0]=1 1200 B8R0.4 CC\C=C/CCOC=O Amb22230430 [0,1,0,0,0,0|0,0,2]=3 1201 B8R0.4 CC\C=C/C\C=C\C=O Amb28251042 [0,1,0,0,0,0|0,0,3]=4 1202 B8R0.4 CC\C=C\C=C\CNC Amb27434865 [0,1,0,0,0,0|1,0,2]=4 1203 B8R0.4 CC\C=C\CC#CCO Amb27398594 [0,1,0,0,0,0|0,0,1]=2 1204 B8R0.4 CC\C=C\CCCC=O Amb33171685 [0,1,0,0,0,0|0,0,1]=2 1205 B8R0.4 CC\C=C\CCCCC Amb22347893 [0,1,0,0,0,0|1,0,0]=2 1206 B8R0.4 CC\C=C\CCCCN Amb33079175 [0,1,0,0,0,0|1,0,0]=2 1207 B8R0.4 CC\C=C\CCN=C=O Amb33359304 [0,1,0,0,0,0|0,0,2]=3 1208 B8R0.4 CC\C=C\CCNCC Amb27647277 [0,1,0,0,0,0|1,0,0]=2 1209 B8R0.4 CC\C=C\CCOC=O Amb25147211 [0,1,0,0,0,0|0,0,2]=3 1210 B8R0.4 CC\C=C\CCSCC Amb27260956 [0,1,0,0,0,0|1,0,0]=2 1211 B8R0.4 CC\C=C\CC\C=C\I Amb28071366 [0,1,0,0,0,0|1,0,1]=3 1212 B8R0.4 CC\C=C\C\C=C\CCl Amb27628399 [0,1,0,0,0,0|1,0,1]=3 1213 B8R0.4 CC\N=C\C=C\NCC Amb27391067 [0,1,0,0,0,0|2,0,1]=4 1214 B8R0.4 CNCCCCCCF Amb28137350 [0,1,0,0,0,0|1,0,2]=4 1215 B8R0.4 CNCCCCCCN Amb22641938 [0,1,0,0,0,0|1,0,2]=4 1216 B8R0.4 CNCCCCCCN Amb32667312 [0,1,0,0,0,0|1,0,2]=4 1217 B8R0.4 CNCCCCCCO Amb2721293 [0,1,0,0,0,0|0,0,2]=3 1218 B8R0.4 CNCCCCCOC Amb17569940 [0,1,0,0,0,0|1,0,2]=4 1219 B8R0.4 CNCCCOCCO Amb27855882 [0,1,0,0,0,0|1,0,2]=4 1220 B8R0.4 CNCCNCCCF Amb27768818 [0,1,0,0,0,0|2,0,1]=4 1221 B8R0.4 CNCCOCCCF Amb27393733 [0,1,0,0,0,0|2,0,1]=4 1222 B8R0.4 CNCCSCCCN Amb27768770 [0,1,0,0,0,0|2,0,1]=4 1223 B8R0.4 COCC#CCCCBr Amb27613532 [0,1,0,0,0,0|1,0,2]=4 1224 B8R0.4 COCC#C\C=C\CO Amb28049274 [0,1,0,0,0,0|1,0,2]=4 1225 B8R0.4 COCCCCCCBr Amb26928164 [0,1,0,0,0,0|1,0,2]=4 1226 B8R0.4 COCCCCCCCl Amb18180174 [0,1,0,0,0,0|1,0,2]=4 1227 B8R0.4 COCCCCCCN Amb27799019 [0,1,0,0,0,0|1,0,2]=4 1228 B8R0.4 COCCCCCCO Amb28189816 [0,1,0,0,0,0|0,0,2]=3 1229 B8R0.4 COCCCCCOC Amb22348093 [0,1,0,0,0,0|1,0,2]=4 1230 B8R0.4 COCCCCNOC Amb27593039 [0,1,0,0,0,0|2,0,1]=4 1231 B8R0.4 COCCCNCCCl Amb17334317 [0,1,0,0,0,0|2,0,1]=4 1232 B8R0.4 COCCCNCCN Amb17091021 [0,1,0,0,0,0|2,0,1]=4 1233 B8R0.4 COCCCNCCO Amb9213213 [0,1,0,0,0,0|1,0,2]=4 1234 B8R0.4 COCCCOCCCl Amb18177244 [0,1,0,0,0,0|2,0,1]=4 1235 B8R0.4 COCCCOCCI Amb27253165 [0,1,0,0,0,0|2,0,1]=4 1236 B8R0.4 COCCCOCCN Amb27751129 [0,1,0,0,0,0|2,0,1]=4 1237 B8R0.4 COCCCOCCO Amb26344833 [0,1,0,0,0,0|1,0,2]=4 1238 B8R0.4 COCCCSCCBr Amb28049052 [0,1,0,0,0,0|2,0,1]=4 1239 B8R0.4 COCCCSCCCl Amb28411442 [0,1,0,0,0,0|2,0,1]=4 1240 B8R0.4 COCCCSCCS Amb27980898 [0,1,0,0,0,0|2,0,1]=4 1241 B8R0.4 COCCNCCCN Amb17315289 [0,1,0,0,0,0|2,0,1]=4 1242 B8R0.4 COCCNCCCO Amb9246587 [0,1,0,0,0,0|1,0,1]=3 1243 B8R0.4 COCCOCCCBr Amb9204139 [0,1,0,0,0,0|2,0,1]=4 1244 B8R0.4 COCCOCCCCl Amb6256006 [0,1,0,0,0,0|2,0,1]=4 1245 B8R0.4 COCCOCCCN Amb1154665 [0,1,0,0,0,0|2,0,1]=4 1246 B8R0.4 COCCOCCCO Amb26608683 [0,1,0,0,0,0|1,0,1]=3 1247 B8R0.4 COCCOCCCS Amb27981281 [0,1,0,0,0,0|1,1,1]=4 1248 B8R0.4 COCCONCCO Amb27257086 [0,1,0,0,0,0|2,0,1]=4 1249 B8R0.4 COCCSCCCBr Amb9304977 [0,1,0,0,0,0|2,0,1]=4 1250 B8R0.4 COCCSCCCF Amb28293660 [0,1,0,0,0,0|2,0,1]=4 1251 B8R0.4 COCCSCCCS Amb27838576 [0,1,0,0,0,0|1,1,1]=4 1252 B8R0.4 COCOCCCCCl Amb22641569 [0,1,0,0,0,0|2,0,1]=4 1253 B8R0.4 COCOC\C=C/CCl Amb27809688 [0,1,0,0,0,0|2,0,0]=3 1254 B8R0.4 COCOC\C=C\CCl Amb27435121 [0,1,0,0,0,0|2,0,0]=3 1255 B8R0.4 COC\C=C\CCC=O Amb26931864 [0,1,0,0,0,0|0,0,2]=3 1256 B8R0.4 CO\C=C\C=C\CCO Amb27660890 [0,1,0,0,0,0|0,0,2]=3 1257 B8R0.4 CO\C=C\CCCCO Amb27448464 [0,1,0,0,0,0|1,0,0]=2 1258 B8R0.4 CO\N=C\CCCC=O Amb27408636 [0,1,0,0,0,0|2,0,1]=4 1259 B8R0.4 CO\N=C\CCCCO Amb28049141 [0,1,0,0,0,0|1,0,1]=3 1260 B8R0.4 CO\N=C\CCCSC Amb27452550 [0,1,0,0,0,0|2,1,0]=4 1261 B8R0.4 CSCCCCCCN Amb24532830 [0,1,0,0,0,0|1,0,2]=4 1262 B8R0.4 CSCCCCCCO Amb22367888 [0,1,0,0,0,0|0,0,2]=3 1263 B8R0.4 CSCCCCCCS Amb27801758 [0,1,0,0,0,0|0,1,2]=4 1264 B8R0.4 CSCCNCCCBr Amb28137679 [0,1,0,0,0,0|2,0,1]=4 1265 B8R0.4 CSCCNCCCCl Amb27599936 [0,1,0,0,0,0|2,0,1]=4 1266 B8R0.4 CSCCNCCCF Amb28136726 [0,1,0,0,0,0|2,0,1]=4 1267 B8R0.4 CSCCOCCCN Amb27146302 [0,1,0,0,0,0|2,0,1]=4 1268 B8R0.4 CSCOC\C=C\CO Amb27452450 [0,1,0,0,0,0|2,1,0]=4 1269 B8R0.4 C\C=C/C=C/CCCBr Amb27878672 [0,1,0,0,0,0|1,0,1]=3 1270 B8R0.4 C\C=C/CCCCC=O Amb26854801 [0,1,0,0,0,0|0,0,3]=4 1271 B8R0.4 C\C=C/CCCCCC Amb27478896 [0,1,0,0,0,0|1,0,2]=4 1272 B8R0.4 C\C=C\C=C=CCCO Amb27812339 [0,1,0,0,0,0|0,0,2]=3 1273 B8R0.4 C\C=C\C=C\CCCC Amb24477896 [0,1,0,0,0,0|1,0,1]=3 1274 B8R0.4 C\C=C\C=C\CCCO Amb17593323 [0,1,0,0,0,0|0,0,1]=2 1275 B8R0.4 C\C=C\CCCCCC Amb19930200 [0,1,0,0,0,0|1,0,2]=4 1276 B8R0.4 C\C=C\CCCCCO Amb25247777 [0,1,0,0,0,0|0,0,2]=3 1277 B8R0.4 C\C=C\CCCCNO Amb27849039 [0,1,0,0,0,0|0,0,2]=3 1278 B8R0.4 C\C=C\CNCCCI Amb27652349 [0,1,0,0,0,0|1,0,2]=4 1279 B8R0.4 C\C=C\CNCCCN Amb27175088 [0,1,0,0,0,0|1,0,2]=4 1280 B8R0.4 C\C=C\COCCCBr Amb27949261 [0,1,0,0,0,0|1,0,2]=4 1281 B8R0.4 C\C=C\CSCCOC Amb27766159 [0,1,0,0,0,0|1,0,2]=4 1282 B8R0.4 C\C=C\C\C=C\CCO Amb27978414 [0,1,0,0,0,0|0,0,2]=3 1283 B8R0.4 C\C=C\OCCCCO Amb27486247 [0,1,0,0,0,0|0,0,2]=3 1284 B8R0.4 C\C=C\OC\C=C\CO Amb27790228 [0,1,0,0,0,0|1,0,2]=4 1285 B8R0.4 ClCCCCCCCBr Amb24323576 [0,1,0,0,0,0|1,0,2]=4 1286 B8R0.4 ClCCCCCCCCl Amb22232563 [0,1,0,0,0,0|1,0,2]=4 1287 B8R0.4 ClCCCNCCCCl Amb25147083 [0,1,0,0,0,0|2,0,1]=4 1288 B8R0.4 ClCCCOCCCCl Amb2700587 [0,1,0,0,0,0|2,0,1]=4 1289 B8R0.4 ClCCCSCCCCl Amb27808763 [0,1,0,0,0,0|2,0,1]=4 1290 B8R0.4 FCCCCNCCBr Amb28457765 [0,1,0,0,0,0|2,0,1]=4 1291 B8R0.4 FCCCCNCCCl Amb27255714 [0,1,0,0,0,0|2,0,1]=4 1292 B8R0.4 FCCCCNCCF Amb27799430 [0,1,0,0,0,0|2,0,1]=4 1293 B8R0.4 FCCCNCCCBr Amb27843825 [0,1,0,0,0,0|2,0,1]=4 1294 B8R0.4 FCCCNCCCCl Amb27838497 [0,1,0,0,0,0|2,0,1]=4 1295 B8R0.4 FCCCSCCCCl Amb27243197 [0,1,0,0,0,0|2,0,1]=4 1296 B8R0.4 FCCCSCCCF Amb27977388 [0,1,0,0,0,0|2,0,1]=4 1297 B8R0.4 FCCNC\C=C\CCl Amb27663609 [0,1,0,0,0,0|2,0,0]=3 1298 B8R0.4 N#CCCC\C=C/CBr Amb28325715 [0,1,0,0,0,0|2,0,0]=3 1299 B8R0.4 N#CCCNCCCO Amb9243306 [0,1,0,0,0,0|1,0,2]=4 1300 B8R0.4 N#CCCSCCCO Amb17502405 [0,1,0,0,0,0|1,0,2]=4 1301 B8R0.4 N#C\C=C\CCCC=O Amb18642109 [0,1,0,0,0,0|1,0,2]=4 1302 B8R0.4 N#C\C=C\CCCCBr Amb27965026 [0,1,0,0,0,0|2,0,1]=4 1303 B8R0.4 N#C\C=C\CCCCCl Amb27622521 [0,1,0,0,0,0|2,0,1]=4 1304 B8R0.4 NCCCCCCCBr Amb27817795 [0,1,0,0,0,0|1,0,2]=4 1305 B8R0.4 NCCCCCCCBr Amb33321489 [0,1,0,0,0,0|1,0,2]=4 1306 B8R0.4 NCCCCCCCF Amb25918508 [0,1,0,0,0,0|1,0,2]=4 1307 B8R0.4 NCCCCCCCN Amb3370862 [0,1,0,0,0,0|1,0,2]=4 1308 B8R0.4 NCCCCCCCO Amb24120448 [0,1,0,0,0,0|0,0,2]=3 1309 B8R0.4 NCCCCCCCO Amb33544521 [0,1,0,0,0,0|0,0,2]=3 1310 B8R0.4 NCCCCCCCS Amb25147209 [0,1,0,0,0,0|0,1,2]=4 1311 B8R0.4 NCCCCNCCBr Amb27865413 [0,1,0,0,0,0|2,0,1]=4 1312 B8R0.4 NCCCCNCCN Amb24117220 [0,1,0,0,0,0|2,0,1]=4 1313 B8R0.4 NCCCCNCCN Amb25378773 [0,1,0,0,0,0|2,0,1]=4 1314 B8R0.4 NCCCCNCCO Amb8394908 [0,1,0,0,0,0|1,0,2]=4 1315 B8R0.4 NCCCCOCCO Amb6681146 [0,1,0,0,0,0|1,0,2]=4 1316 B8R0.4 NCCCCSCCN Amb27872081 [0,1,0,0,0,0|2,0,1]=4 1317 B8R0.4 NCCCCSCCO Amb17500958 [0,1,0,0,0,0|1,0,2]=4 1318 B8R0.4 NCCCC\C=C\CO Amb24117507 [0,1,0,0,0,0|2,0,0]=3 1319 B8R0.4 NCCCC\C=C\CO Amb27780423 [0,1,0,0,0,0|2,0,0]=3 1320 B8R0.4 NCCCNCCCN Amb8513191 [0,1,0,0,0,0|2,0,1]=4 1321 B8R0.4 NCCCNCCCO Amb19959935 [0,1,0,0,0,0|1,0,1]=3 1322 B8R0.4 NCCCOCCCF Amb27391202 [0,1,0,0,0,0|2,0,1]=4 1323 B8R0.4 NCCCOCCCN Amb17593392 [0,1,0,0,0,0|2,0,1]=4 1324 B8R0.4 NCCCOCCCO Amb35788244 [0,1,0,0,0,0|1,0,1]=3 1325 B8R0.4 NCCCOCCCO Amb9392882 [0,1,0,0,0,0|1,0,1]=3 1326 B8R0.4 NCCCSCCCO Amb17500713 [0,1,0,0,0,0|1,0,1]=3 1327 B8R0.4 NCCSCCCCF Amb27830248 [0,1,0,0,0,0|2,0,1]=4 1328 B8R0.4 NCCSCCCCS Amb27878524 [0,1,0,0,0,0|1,1,1]=4 1329 B8R0.4 NCC\C=C/CCCN Amb28056104 [0,1,0,0,0,0|1,0,0]=2 1330 B8R0.4 NCC\C=N\CCCN Amb28041352 [0,1,0,0,0,0|2,0,0]=3 1331 B8R0.4 NC\C=C\CSCCO Amb27185672 [0,1,0,0,0,0|1,0,0]=2 1332 B8R0.4 NOCCCSCCO Amb27420973 [0,1,0,0,0,0|2,0,1]=4 1333 B8R0.4 O=CCCC\C=C\CO Amb27169480 [0,1,0,0,0,0|1,0,1]=3 1334 B8R0.4 O=CCCOCCCO Amb28428559 [0,1,0,0,0,0|1,0,2]=4 1335 B8R0.4 O=CCC\C=C\CCBr Amb25961650 [0,1,0,0,0,0|0,0,2]=3 1336 B8R0.4 O=C\C=C/CCCC=O Amb28202061 [0,1,0,0,0,0|1,0,2]=4 1337 B8R0.4 OCCCCCCCBr Amb9787726 [0,1,0,0,0,0|0,0,2]=3 1338 B8R0.4 OCCCCCCCF Amb25381297 [0,1,0,0,0,0|0,0,2]=3 1339 B8R0.4 OCCCCCCCI Amb32411247 [0,1,0,0,0,0|0,0,2]=3 1340 B8R0.4 OCCCCCCCO Amb8513178 [0,1,0,0,0,0|0,0,2]=3 1341 B8R0.4 OCCCCNCCO Amb28049076 [0,1,0,0,0,0|1,0,1]=3 1342 B8R0.4 OCCCCOCCO Amb25185198 [0,1,0,0,0,0|1,0,1]=3 1343 B8R0.4 OCCCNCCCO Amb28984089 [0,1,0,0,0,0|1,0,1]=3 1344 B8R0.4 OCCCNCCCO Amb8393926 [0,1,0,0,0,0|1,0,1]=3 1345 B8R0.4 OCCCOCCCCl Amb28058754 [0,1,0,0,0,0|1,0,1]=3 1346 B8R0.4 OCCCOCCCO Amb24626114 [0,1,0,0,0,0|1,0,1]=3 1347 B8R0.4 OCCC\C=C\CCI Amb22364705 [0,1,0,0,0,0|0,0,0]=1 1348 B8R0.4 OCCNCC=C=CBr Amb28458450 [0,1,0,0,0,0|1,0,2]=4 1349 B8R0.4 OCCNCNCCO Amb10790096 [0,1,0,0,0,0|2,0,1]=4 1350 B8R0.4 OCCOCCOCO Amb27651930 [0,1,0,0,0,0|2,0,1]=4 1351 B8R0.4 OCCOCOCCO Amb25923012 [0,1,0,0,0,0|2,0,1]=4 1352 B8R0.4 OC\C=C\CCCCO Amb27642149 [0,1,0,0,0,0|1,0,0]=2 1353 B8R0.4 OC\C=C\C\C=C\CO Amb27835108 [0,1,0,0,0,0|1,0,1]=3 1354 B8R0.4 OC\C=C\O\C=C\CO Amb27662354 [0,1,0,0,0,0|1,0,2]=4 1355 B8R0.4 [C-]#[N+]CCCCCCC Amb33747260 [0,1,0,0,0,0|1,0,2]=4 1356 B8R0.4 [C-]#[N+]CC\C=C\CCC Amb33424871 [0,1,0,0,0,0|2,0,0]=3 1357 B8R0.6 C#CC(O)C\C=C\CC Amb28370524 [0,1,0,0,0,0|1,0,1]=3 1358 B8R0.6 C#CCCCC(=O)CC Amb27837514 [0,1,0,0,0,0|1,0,2]=4 1359 B8R0.6 C#CCC\C=C(/C)CN Amb27180721 [0,1,0,0,0,0|2,0,1]=4 1360 B8R0.6 C#C[C@H](O)C\C=C\CC Amb27484599 [0,1,0,0,0,0|1,0,1]=3 1361 B8R0.6 C=C(CBr)CCCCC Amb27875113 [0,1,0,0,0,0|2,0,1]=4 1362 B8R0.6 C=C(CC)CCCCCl Amb27430621 [0,1,0,0,0,0|1,0,1]=3 1363 B8R0.6 C=C(CC)CCCCO Amb25057130 [0,1,0,0,0,0|0,0,1]=2 1364 B8R0.6 C=C(CC)CNCCC Amb27456809 [0,1,0,0,0,0|2,0,1]=4 1365 B8R0.6 C=C(CC)CNCCF Amb27979485 [0,1,0,0,0,0|2,0,1]=4 1366 B8R0.6 C=C(CC)CSCCN Amb27174810 [0,1,0,0,0,0|2,0,1]=4 1367 B8R0.6 C=C(CC)NCCCC Amb27230099 [0,1,0,0,0,0|2,0,0]=3 1368 B8R0.6 C=C(CCCCCl)OC Amb27470874 [0,1,0,0,0,0|2,0,1]=4 1369 B8R0.6 C=C(CO)CCCCO Amb27405284 [0,1,0,0,0,0|1,0,1]=3 1370 B8R0.6 C=C(CO)CSCCO Amb27959258 [0,1,0,0,0,0|2,0,1]=4 1371 B8R0.6 C=C(\C=C\CCC)CBr Amb33335674 [0,1,0,0,0,0|2,0,1]=4 1372 B8R0.6 C=C(\C=C\CCC)CN Amb33424828 [0,1,0,0,0,0|2,0,1]=4 1373 B8R0.6 C=CC(=O)C\C=C/CC Amb27838780 [0,1,0,0,0,0|1,0,2]=4 1374 B8R0.6 C=CC(=O)C\C=C\CC Amb24574125 [0,1,0,0,0,0|1,0,2]=4 1375 B8R0.6 C=CC(=O)NCCCO Amb33531592 [0,1,0,0,0,0|1,0,2]=4 1376 B8R0.6 C=CC(=O)OCCCO Amb22167329 [0,1,0,0,0,0|1,0,2]=4 1377 B8R0.6 C=CC(Br)C\C=C/CC Amb27233567 [0,1,0,0,0,0|1,0,1]=3 1378 B8R0.6 C=CC(O)C\C=C\SC Amb28079059 [0,1,0,0,0,0|2,0,1]=4 1379 B8R0.6 C=CCCCC(=O)CC Amb27249620 [0,1,0,0,0,0|1,0,2]=4 1380 B8R0.6 C=C[C@@H](O)C\C=C\CC Amb28049222 [0,1,0,0,0,0|1,0,1]=3 1381 B8R0.6 C=C\C(Br)=C/CCCO Amb28079052 [0,1,0,0,0,0|0,0,2]=3 1382 B8R0.6 CC(CN)OCCCO Amb26646401 [0,1,0,0,0,0|2,0,1]=4 1383 B8R0.6 CC(CO)CCCCO Amb27751851 [0,1,0,0,0,0|1,0,2]=4 1384 B8R0.6 CC(CO)COCCO Amb35752401 [0,1,0,0,0,0|2,0,1]=4 1385 B8R0.6 CC(CO)CSCCF Amb27861873 [0,1,0,0,0,0|2,0,1]=4 1386 B8R0.6 CC(CO)NCCCO Amb27245497 [0,1,0,0,0,0|2,0,1]=4 1387 B8R0.6 CC(CO)OCCCO Amb28049139 [0,1,0,0,0,0|2,0,1]=4 1388 B8R0.6 CCC#CCC(N)CO Amb28058292 [0,1,0,0,0,0|0,0,2]=3 1389 B8R0.6 CCC#CC[C@H](O)CCl Amb28398502 [0,1,0,0,0,0|1,0,2]=4 1390 B8R0.6 CCC(=N)NCCOC Amb27837451 [0,1,0,0,0,0|3,0,0]=4 1391 B8R0.6 CCC(=O)CCCCO Amb27867195 [0,1,0,0,0,0|0,0,1]=2 1392 B8R0.6 CCC(=O)CSCCCl Amb28399270 [0,1,0,0,0,0|2,0,1]=4 1393 B8R0.6 CCC(=O)CSCCO Amb4165967 [0,1,0,0,0,0|1,0,1]=3 1394 B8R0.6 CCC(=O)NCCC#N Amb17399812 [0,1,0,0,0,0|2,0,1]=4 1395 B8R0.6 CCC(=O)NCCC=O Amb17102166 [0,1,0,0,0,0|1,0,2]=4 1396 B8R0.6 CCC(=O)NCCCBr Amb9209422 [0,1,0,0,0,0|2,0,0]=3 1397 B8R0.6 CCC(=O)NCCCCl Amb3886595 [0,1,0,0,0,0|2,0,0]=3 1398 B8R0.6 CCC(=O)NCCCI Amb27222536 [0,1,0,0,0,0|2,0,0]=3 1399 B8R0.6 CCC(=O)NCCCN Amb6280448 [0,1,0,0,0,0|2,0,0]=3 1400 B8R0.6 CCC(=O)NCCCO Amb5797471 [0,1,0,0,0,0|1,0,0]=2 1401 B8R0.6 CCC(=O)NCCON Amb17138375 [0,1,0,0,0,0|3,0,0]=4 1402 B8R0.6 CCC(=O)NOCCO Amb27946298 [0,1,0,0,0,0|2,0,0]=3 1403 B8R0.6 CCC(=O)OCCCBr Amb27262082 [0,1,0,0,0,0|2,0,0]=3 1404 B8R0.6 CCC(=O)OCCCO Amb28138647 [0,1,0,0,0,0|1,0,0]=2 1405 B8R0.6 CCC(=O)OCCOC Amb27977811 [0,1,0,0,0,0|3,0,0]=4 1406 B8R0.6 CCC(C)=C=CCCO Amb27978471 [0,1,0,0,0,0|0,0,2]=3 1407 B8R0.6 CCC(C)CCCCN Amb25146190 [0,1,0,0,0,0|1,0,2]=4 1408 B8R0.6 CCC(C)CCCCO Amb25367714 [0,1,0,0,0,0|0,0,2]=3 1409 B8R0.6 CCC(C)CNCCO Amb3940071 [0,1,0,0,0,0|1,0,2]=4 1410 B8R0.6 CCC(C)COCCO Amb27198059 [0,1,0,0,0,0|1,0,2]=4 1411 B8R0.6 CCC(C)C\C=C\CBr Amb27607864 [0,1,0,0,0,0|2,0,0]=3 1412 B8R0.6 CCC(C)NCCCBr Amb27838582 [0,1,0,0,0,0|2,0,1]=4 1413 B8R0.6 CCC(C)NCCCF Amb27838485 [0,1,0,0,0,0|2,0,1]=4 1414 B8R0.6 CCC(C)NCCCN Amb17315265 [0,1,0,0,0,0|2,0,1]=4 1415 B8R0.6 CCC(C)NCCCO Amb6733732 [0,1,0,0,0,0|1,0,1]=3 1416 B8R0.6 CCC(C)OCCCBr Amb18321256 [0,1,0,0,0,0|2,0,1]=4 1417 B8R0.6 CCC(C)OCCCCl Amb18176654 [0,1,0,0,0,0|2,0,1]=4 1418 B8R0.6 CCC(C)OCCCN Amb20076070 [0,1,0,0,0,0|2,0,1]=4 1419 B8R0.6 CCC(C)SCCCO Amb9273773 [0,1,0,0,0,0|1,0,1]=3 1420 B8R0.6 CCC(C)S\C=C\CO Amb28074680 [0,1,0,0,0,0|3,0,0]=4 1421 B8R0.6 CCC(F)CSCCO Amb27757051 [0,1,0,0,0,0|1,0,2]=4 1422 B8R0.6 CCC(N)CNCCO Amb33230048 [0,1,0,0,0,0|1,0,2]=4 1423 B8R0.6 CCC(N)CSCCO Amb28285128 [0,1,0,0,0,0|1,0,2]=4 1424 B8R0.6 CCC(O)CCCCCl Amb27786918 [0,1,0,0,0,0|1,0,2]=4 1425 B8R0.6 CCC(O)CCCCO Amb27762946 [0,1,0,0,0,0|0,0,2]=3 1426 B8R0.6 CCC(O)C\C=C\OC Amb28049147 [0,1,0,0,0,0|2,0,0]=3 1427 B8R0.6 CCC(O)C\C=C\SC Amb28192901 [0,1,0,0,0,0|2,0,0]=3 1428 B8R0.6 CCC=C=CC(=O)CC Amb27838620 [0,1,0,0,0,0|1,0,2]=4 1429 B8R0.6 CCCBCC(C)CCl Amb27771247 [0,1,0,0,0,0|2,0,1]=4 1430 B8R0.6 CCCC#CC(C)CO Amb27662312 [0,1,0,0,0,0|0,0,3]=4 1431 B8R0.6 CCCCCC(=O)CC Amb8513554 [0,1,0,0,0,0|1,0,1]=3 1432 B8R0.6 CCCCCC(=O)CO Amb27956467 [0,1,0,0,0,0|0,0,3]=4 1433 B8R0.6 CCCCCC(=O)CS Amb27750258 [0,1,0,0,0,0|2,0,1]=4 1434 B8R0.6 CCCCCC(=O)OC Amb6608968 [0,1,0,0,0,0|2,0,1]=4 1435 B8R0.6 CCCCCC(Br)CC Amb18324626 [0,1,0,0,0,0|1,0,2]=4 1436 B8R0.6 CCCCCC(C)CBr Amb26013045 [0,1,0,0,0,0|1,0,2]=4 1437 B8R0.6 CCCCCC(C)CC Amb22229361 [0,1,0,0,0,0|1,0,2]=4 1438 B8R0.6 CCCCCC(C)CCl Amb24401516 [0,1,0,0,0,0|1,0,2]=4 1439 B8R0.6 CCCCCC(C)CN Amb27624450 [0,1,0,0,0,0|1,0,2]=4 1440 B8R0.6 CCCCCC(C)CO Amb21618749 [0,1,0,0,0,0|0,0,2]=3 1441 B8R0.6 CCCCCC(Cl)CC Amb22229245 [0,1,0,0,0,0|1,0,2]=4 1442 B8R0.6 CCCCCC(Cl)CN Amb28410342 [0,1,0,0,0,0|1,0,2]=4 1443 B8R0.6 CCCCCC(F)CN Amb24117054 [0,1,0,0,0,0|1,0,2]=4 1444 B8R0.6 CCCCCC(N)CO Amb24524295 [0,1,0,0,0,0|0,0,2]=3 1445 B8R0.6 CCCCCC(O)CF Amb22546481 [0,1,0,0,0,0|1,0,2]=4 1446 B8R0.6 CCCCCC(O)CN Amb8630208 [0,1,0,0,0,0|1,0,2]=4 1447 B8R0.6 CCCCCC(O)CO Amb22227711 [0,1,0,0,0,0|0,0,2]=3 1448 B8R0.6 CCCCCC(O)CS Amb27404970 [0,1,0,0,0,0|0,1,2]=4 1449 B8R0.6 CCCCCC(S)CN Amb27469627 [0,1,0,0,0,0|1,0,2]=4 1450 B8R0.6 CCCCCN(C)CC Amb27809466 [0,1,0,0,0,0|2,0,1]=4 1451 B8R0.6 CCCCC[C@@H](C)CO Amb28318700 [0,1,0,0,0,0|0,0,2]=3 1452 B8R0.6 CCCCC[C@@H](O)CC Amb25708717 [0,1,0,0,0,0|1,0,2]=4 1453 B8R0.6 CCCCC[C@@H](O)CO Amb28281704 [0,1,0,0,0,0|0,0,2]=3 1454 B8R0.6 CCCCC[C@H](O)CC Amb25326807 [0,1,0,0,0,0|1,0,2]=4 1455 B8R0.6 CCCCC[C@H](O)CO Amb27762354 [0,1,0,0,0,0|0,0,2]=3 1456 B8R0.6 CCCCNC(=O)CBr Amb17327510 [0,1,0,0,0,0|3,0,0]=4 1457 B8R0.6 CCCCNC(=O)CC Amb3373336 [0,1,0,0,0,0|2,0,0]=3 1458 B8R0.6 CCCCNC(=O)CCl Amb1204239 [0,1,0,0,0,0|3,0,0]=4 1459 B8R0.6 CCCCNC(=O)CN Amb21958688 [0,1,0,0,0,0|3,0,0]=4 1460 B8R0.6 CCCCNC(=O)CN Amb5783028 [0,1,0,0,0,0|3,0,0]=4 1461 B8R0.6 CCCCNC(=O)CO Amb5798171 [0,1,0,0,0,0|3,0,0]=4 1462 B8R0.6 CCCCNC(=O)NC Amb1060752 [0,1,0,0,0,0|3,0,0]=4 1463 B8R0.6 CCCCNC(=O)OC Amb3364701 [0,1,0,0,0,0|3,0,0]=4 1464 B8R0.6 CCCCNC(=S)CC Amb27975765 [0,1,0,0,0,0|2,0,0]=3 1465 B8R0.6 CCCCNC(C)CC Amb6608873 [0,1,0,0,0,0|2,0,1]=4 1466 B8R0.6 CCCCOC(=N)CBr Amb27758698 [0,1,0,0,0,0|3,0,0]=4 1467 B8R0.6 CCCCOC(=N)CCl Amb29847969 [0,1,0,0,0,0|3,0,0]=4 1468 B8R0.6 CCCCOC(=O)CCl Amb2724515 [0,1,0,0,0,0|3,0,0]=4 1469 B8R0.6 CCCCOC(=O)CN Amb19373374 [0,1,0,0,0,0|3,0,0]=4 1470 B8R0.6 CCCCOC(=O)CN Amb3939626 [0,1,0,0,0,0|3,0,0]=4 1471 B8R0.6 CCCCOC(=O)CO Amb9277787 [0,1,0,0,0,0|3,0,0]=4 1472 B8R0.6 CCCCOC(=O)CS Amb4034596 [0,1,0,0,0,0|3,0,0]=4 1473 B8R0.6 CCCCOC(=O)C[NH3+] Amb22733556 [0,1,0,0,0,0|3,0,0]=4 1474 B8R0.6 CCCCOC(=O)NC Amb24680085 [0,1,0,0,0,0|3,0,0]=4 1475 B8R0.6 CCCCOC(=O)OC Amb25921901 [0,1,0,0,0,0|3,0,0]=4 1476 B8R0.6 CCCCOC(=S)NC Amb28120184 [0,1,0,0,0,0|3,0,0]=4 1477 B8R0.6 CCCCOC(C)CO Amb24712962 [0,1,0,0,0,0|1,0,2]=4 1478 B8R0.6 CCCCOC(O)CC Amb28429916 [0,1,0,0,0,0|2,0,1]=4 1479 B8R0.6 CCCCO[C@@H](C)CO Amb27631909 [0,1,0,0,0,0|1,0,2]=4 1480 B8R0.6 CCCCSC(=O)CBr Amb27627822 [0,1,0,0,0,0|3,0,0]=4 1481 B8R0.6 CCCCSC(=O)CCl Amb27660104 [0,1,0,0,0,0|3,0,0]=4 1482 B8R0.6 CCCCSC(=S)NC Amb28119899 [0,1,0,0,0,0|3,0,0]=4 1483 B8R0.6 CCCCSC(C)CC Amb4017931 [0,1,0,0,0,0|2,0,1]=4 1484 B8R0.6 CCCC\C=C(/Br)C=O Amb28130465 [0,1,0,0,0,0|2,0,1]=4 1485 B8R0.6 CCCC\C=C(/C)CBr Amb27865492 [0,1,0,0,0,0|2,0,0]=3 1486 B8R0.6 CCCC\C=C(/Cl)C=O Amb27949654 [0,1,0,0,0,0|2,0,1]=4 1487 B8R0.6 CCCC\C=C(\Br)C=O Amb28196734 [0,1,0,0,0,0|2,0,1]=4 1488 B8R0.6 CCCC\C=C(\C)CBr Amb27444640 [0,1,0,0,0,0|2,0,0]=3 1489 B8R0.6 CCCC\C=C(\C)CCl Amb25317209 [0,1,0,0,0,0|2,0,0]=3 1490 B8R0.6 CCCC\C=C(\C)CI Amb27879768 [0,1,0,0,0,0|2,0,0]=3 1491 B8R0.6 CCCC\C=C(\C)CN Amb28288856 [0,1,0,0,0,0|2,0,0]=3 1492 B8R0.6 CCCC\C=C(\Cl)CO Amb28315452 [0,1,0,0,0,0|2,0,0]=3 1493 B8R0.6 CCCC\C=C(\F)CO Amb27835021 [0,1,0,0,0,0|2,0,0]=3 1494 B8R0.6 CCCNCC(C)CCl Amb27976521 [0,1,0,0,0,0|2,0,1]=4 1495 B8R0.6 CCCNCC(Cl)CC Amb27856521 [0,1,0,0,0,0|2,0,1]=4 1496 B8R0.6 CCCNCC(N)CC Amb25918794 [0,1,0,0,0,0|2,0,1]=4 1497 B8R0.6 CCCNCC(O)CCl Amb27267938 [0,1,0,0,0,0|2,0,1]=4 1498 B8R0.6 CCCNCC(O)CF Amb28254417 [0,1,0,0,0,0|2,0,1]=4 1499 B8R0.6 CCCNCC(O)CO Amb8854777 [0,1,0,0,0,0|1,0,1]=3 1500 B8R0.6 CCCNC[C@@H](O)CC Amb27662024 [0,1,0,0,0,0|2,0,1]=4 1501 B8R0.6 CCCNC[C@@H](O)CO Amb33041826 [0,1,0,0,0,0|1,0,1]=3 1502 B8R0.6 CCCOCC(=O)CC Amb27837457 [0,1,0,0,0,0|2,0,1]=4 1503 B8R0.6 CCCOCC(Br)CCl Amb28367013 [0,1,0,0,0,0|2,0,1]=4 1504 B8R0.6 CCCOCC(C)CBr Amb24370433 [0,1,0,0,0,0|2,0,1]=4 1505 B8R0.6 CCCOCC(C)CCl Amb26053445 [0,1,0,0,0,0|2,0,1]=4 1506 B8R0.6 CCCOCC(C)CS Amb27834985 [0,1,0,0,0,0|1,1,1]=4 1507 B8R0.6 CCCOCC(Cl)CBr Amb27391140 [0,1,0,0,0,0|2,0,1]=4 1508 B8R0.6 CCCOCC(Cl)CCl Amb27657524 [0,1,0,0,0,0|2,0,1]=4 1509 B8R0.6 CCCOCC(N)CC Amb17485992 [0,1,0,0,0,0|2,0,1]=4 1510 B8R0.6 CCCOCC(N)CN Amb28312993 [0,1,0,0,0,0|2,0,1]=4 1511 B8R0.6 CCCOCC(O)CCl Amb28144574 [0,1,0,0,0,0|2,0,1]=4 1512 B8R0.6 CCCOCC(O)CO Amb10071476 [0,1,0,0,0,0|1,0,1]=3 1513 B8R0.6 CCCOC[C@@H](N)CC Amb27804406 [0,1,0,0,0,0|2,0,1]=4 1514 B8R0.6 CCCOC[C@H](N)CC Amb28139029 [0,1,0,0,0,0|2,0,1]=4 1515 B8R0.6 CCCOC[C@H](O)CO Amb28049195 [0,1,0,0,0,0|1,0,1]=3 1516 B8R0.6 CCCSCC(=O)CC Amb27837484 [0,1,0,0,0,0|2,0,1]=4 1517 B8R0.6 CCCSCC(C)CBr Amb28122637 [0,1,0,0,0,0|2,0,1]=4 1518 B8R0.6 CCCSCC(C)CS Amb27981763 [0,1,0,0,0,0|1,1,1]=4 1519 B8R0.6 CCCSCC(F)CC Amb28190116 [0,1,0,0,0,0|2,0,1]=4 1520 B8R0.6 CCCSCC(N)CC Amb17485961 [0,1,0,0,0,0|2,0,1]=4 1521 B8R0.6 CCCSCC(N)CO Amb28364274 [0,1,0,0,0,0|1,0,1]=3 1522 B8R0.6 CCCSCC(O)CC Amb28049075 [0,1,0,0,0,0|2,0,1]=4 1523 B8R0.6 CCCSCC(O)CO Amb27858570 [0,1,0,0,0,0|1,0,1]=3 1524 B8R0.6 CCCSC[C@@H](O)CC Amb27956460 [0,1,0,0,0,0|2,0,1]=4 1525 B8R0.6 CCC\C=C/C(=O)OC Amb27423496 [0,1,0,0,0,0|2,0,1]=4 1526 B8R0.6 CCC\C=C\C(=O)CBr Amb27477837 [0,1,0,0,0,0|2,0,1]=4 1527 B8R0.6 CCC\C=C\C(=O)CC Amb26400662 [0,1,0,0,0,0|1,0,1]=3 1528 B8R0.6 CCC\C=C\C(=O)CCl Amb33220754 [0,1,0,0,0,0|2,0,1]=4 1529 B8R0.6 CCC\C=C\C(=O)CN Amb33327186 [0,1,0,0,0,0|2,0,1]=4 1530 B8R0.6 CCC\C=C\C(=O)OC Amb6366801 [0,1,0,0,0,0|2,0,1]=4 1531 B8R0.6 CCC\C=C\C(C)CBr Amb33335692 [0,1,0,0,0,0|1,0,2]=4 1532 B8R0.6 CCC\C=C\C(C)CN Amb33327177 [0,1,0,0,0,0|1,0,2]=4 1533 B8R0.6 CCC\C=C\C(F)CN Amb33424867 [0,1,0,0,0,0|1,0,2]=4 1534 B8R0.6 CCC\C=C\C(N)CO Amb33475098 [0,1,0,0,0,0|0,0,2]=3 1535 B8R0.6 CCC\C=C\C(O)CBr Amb33335721 [0,1,0,0,0,0|1,0,2]=4 1536 B8R0.6 CCC\C=C\C(O)CC Amb27247981 [0,1,0,0,0,0|1,0,2]=4 1537 B8R0.6 CCC\C=C\C(O)CF Amb33424833 [0,1,0,0,0,0|1,0,2]=4 1538 B8R0.6 CCC\C=C\C(O)CN Amb24565967 [0,1,0,0,0,0|1,0,2]=4 1539 B8R0.6 CCC\C=C\C(O)CO Amb28458069 [0,1,0,0,0,0|0,0,2]=3 1540 B8R0.6 CCC\C=C\[C@@H](N)CO Amb33429684 [0,1,0,0,0,0|0,0,2]=3 1541 B8R0.6 CCC\C=C\[C@@H](O)CN Amb33424865 [0,1,0,0,0,0|1,0,2]=4 1542 B8R0.6 CCC\C=C\[C@H](N)CO Amb33424863 [0,1,0,0,0,0|0,0,2]=3 1543 B8R0.6 CCC\C=C\[C@H](O)CN Amb33424864 [0,1,0,0,0,0|1,0,2]=4 1544 B8R0.6 CCNCCC(O)CC Amb27483130 [0,1,0,0,0,0|2,0,1]=4 1545 B8R0.6 CCOCCC(=O)CC Amb27837472 [0,1,0,0,0,0|2,0,1]=4 1546 B8R0.6 CCOCCC(Br)CCl Amb27440196 [0,1,0,0,0,0|2,0,1]=4 1547 B8R0.6 CCOCCC(C)CBr Amb24552402 [0,1,0,0,0,0|2,0,1]=4 1548 B8R0.6 CCOCCC(C)CCl Amb24478711 [0,1,0,0,0,0|2,0,1]=4 1549 B8R0.6 CCOCCC(Cl)CBr Amb27262848 [0,1,0,0,0,0|2,0,1]=4 1550 B8R0.6 CCOCCC(Cl)CCl Amb28458365 [0,1,0,0,0,0|2,0,1]=4 1551 B8R0.6 CCOCCC(Cl)CO Amb28118931 [0,1,0,0,0,0|1,0,1]=3 1552 B8R0.6 CCOCC[C@H](N)CO Amb27488751 [0,1,0,0,0,0|1,0,1]=3 1553 B8R0.6 CCOCC[C@H](N)CS Amb28247584 [0,1,0,0,0,0|1,1,1]=4 1554 B8R0.6 CCOC\C=C(/Cl)CBr Amb28073624 [0,1,0,0,0,0|3,0,0]=4 1555 B8R0.6 CCOC\C=C(\C)CCl Amb27968870 [0,1,0,0,0,0|3,0,0]=4 1556 B8R0.6 CCOC\C=C(\Cl)CCl Amb27638368 [0,1,0,0,0,0|3,0,0]=4 1557 B8R0.6 CCONCC(C)CBr Amb27837599 [0,1,0,0,0,0|3,0,0]=4 1558 B8R0.6 CCO\C=C\C(=O)CC Amb22055193 [0,1,0,0,0,0|2,0,1]=4 1559 B8R0.6 CCO\N=C\C(=O)CC Amb28055522 [0,1,0,0,0,0|3,0,0]=4 1560 B8R0.6 CCS(=O)NCCCO Amb27443514 [0,1,0,0,0,0|2,0,0]=3 1561 B8R0.6 CCSCCC(C)CBr Amb25112497 [0,1,0,0,0,0|2,0,1]=4 1562 B8R0.6 CCSCCC(C)CCl Amb25829491 [0,1,0,0,0,0|2,0,1]=4 1563 B8R0.6 CCSCCC(N)CN Amb27392673 [0,1,0,0,0,0|2,0,1]=4 1564 B8R0.6 CCSCCC(N)CO Amb25820753 [0,1,0,0,0,0|1,0,1]=3 1565 B8R0.6 CCSCCC(O)CN Amb24581930 [0,1,0,0,0,0|2,0,1]=4 1566 B8R0.6 CCSCSC(C)CO Amb27255978 [0,1,0,0,0,0|2,0,1]=4 1567 B8R0.6 CCS\C=C\C(=O)CC Amb24424828 [0,1,0,0,0,0|2,0,1]=4 1568 B8R0.6 CC[C@@H](C)CCCCO Amb22801082 [0,1,0,0,0,0|0,0,2]=3 1569 B8R0.6 CC[C@H](C)CCCCO Amb22226718 [0,1,0,0,0,0|0,0,2]=3 1570 B8R0.6 CC[C@H](C)OCCCBr Amb27477872 [0,1,0,0,0,0|2,0,1]=4 1571 B8R0.6 CC[C@H](C)OCCCO Amb28315453 [0,1,0,0,0,0|1,0,1]=3 1572 B8R0.6 CC\C(C)=C\C=C\CO Amb28049121 [0,1,0,0,0,0|0,0,2]=3 1573 B8R0.6 CC\C(C)=C\CCC=O Amb28131737 [0,1,0,0,0,0|0,0,2]=3 1574 B8R0.6 CC\C(C)=C\CCCCl Amb27626884 [0,1,0,0,0,0|1,0,0]=2 1575 B8R0.6 CC\C(C)=N/CCCN Amb28060249 [0,1,0,0,0,0|2,0,0]=3 1576 B8R0.6 CC\C(C)=N\CCCN Amb27849925 [0,1,0,0,0,0|2,0,0]=3 1577 B8R0.6 CC\C(C)=N\CCCO Amb28190308 [0,1,0,0,0,0|1,0,0]=2 1578 B8R0.6 CC\C(C)=N\NCCO Amb25889624 [0,1,0,0,0,0|2,0,0]=3 1579 B8R0.6 CC\C(C)=N\OCCO Amb28315448 [0,1,0,0,0,0|2,0,0]=3 1580 B8R0.6 CC\C=C/CC(Cl)C=O Amb27424637 [0,1,0,0,0,0|0,0,2]=3 1581 B8R0.6 CC\C=C/C[C@H](Br)C=O Amb28125055 [0,1,0,0,0,0|0,0,2]=3 1582 B8R0.6 CC\C=C\CC(=O)OC Amb8517644 [0,1,0,0,0,0|2,0,1]=4 1583 B8R0.6 CC\C=C\CC(C)C=O Amb27255568 [0,1,0,0,0,0|0,0,2]=3 1584 B8R0.6 CC\C=C\CC(C)CO Amb27956568 [0,1,0,0,0,0|0,0,0]=1 1585 B8R0.6 CC\C=C\CC(Cl)C=O Amb26924259 [0,1,0,0,0,0|0,0,2]=3 1586 B8R0.6 CC\C=C\CC(N)CO Amb26437812 [0,1,0,0,0,0|0,0,0]=1 1587 B8R0.6 CC\C=C\CC(O)C#N Amb27396979 [0,1,0,0,0,0|1,0,1]=3 1588 B8R0.6 CC\C=C\CC(O)CCl Amb27775573 [0,1,0,0,0,0|1,0,0]=2 1589 B8R0.6 CC\C=C\CC(O)CN Amb33079626 [0,1,0,0,0,0|1,0,0]=2 1590 B8R0.6 CC\C=C\CC(O)CO Amb27775912 [0,1,0,0,0,0|0,0,0]=1 1591 B8R0.6 CC\C=C\C[C@H](C)CO Amb27765926 [0,1,0,0,0,0|0,0,0]=1 1592 B8R0.6 CC\C=C\C[C@H](O)C#N Amb27812333 [0,1,0,0,0,0|1,0,1]=3 1593 B8R0.6 CC\C=C\C[C@H](O)CC Amb27164460 [0,1,0,0,0,0|1,0,0]=2 1594 B8R0.6 CC\C=C\C[C@H](O)CO Amb27432264 [0,1,0,0,0,0|0,0,0]=1 1595 B8R0.6 CNC(=N)NCCCF Amb27242132 [0,1,0,0,0,0|3,0,0]=4 1596 B8R0.6 CNC(=N)NCCCN Amb27858102 [0,1,0,0,0,0|3,0,0]=4 1597 B8R0.6 CNC(=N)SCCCO Amb27221089 [0,1,0,0,0,0|2,0,0]=3 1598 B8R0.6 CNC(=O)CCCCBr Amb17235862 [0,1,0,0,0,0|2,0,1]=4 1599 B8R0.6 CNC(=O)CCCCN Amb27220816 [0,1,0,0,0,0|2,0,1]=4 1600 B8R0.6 CNC(=O)CCCCO Amb17231874 [0,1,0,0,0,0|1,0,1]=3 1601 B8R0.6 CNC(=O)COCCO Amb28285253 [0,1,0,0,0,0|2,0,1]=4 1602 B8R0.6 CNC(=O)NCCCCl Amb13951257 [0,1,0,0,0,0|3,0,0]=4 1603 B8R0.6 CNC(=O)NCCCF Amb27843538 [0,1,0,0,0,0|3,0,0]=4 1604 B8R0.6 CNC(=O)NCCCN Amb18908303 [0,1,0,0,0,0|3,0,0]=4 1605 B8R0.6 CNC(=O)NCCCN Amb33743450 [0,1,0,0,0,0|3,0,0]=4 1606 B8R0.6 CNC(=O)NCCCO Amb27161587 [0,1,0,0,0,0|2,0,0]=3 1607 B8R0.6 CNC(=O)OCCCN Amb27243133 [0,1,0,0,0,0|3,0,0]=4 1608 B8R0.6 CNC(=O)OCCCN Amb33803867 [0,1,0,0,0,0|3,0,0]=4 1609 B8R0.6 CNC(=O)SCCCCl Amb27750203 [0,1,0,0,0,0|3,0,0]=4 1610 B8R0.6 CNC(=S)NCCCO Amb25777180 [0,1,0,0,0,0|2,0,0]=3 1611 B8R0.6 CNC(=S)NNCCO Amb27834871 [0,1,0,0,0,0|3,0,0]=4 1612 B8R0.6 CNC(C)CCCCO Amb17569927 [0,1,0,0,0,0|1,0,2]=4 1613 B8R0.6 COC(=N)CCCCCl Amb32941935 [0,1,0,0,0,0|2,0,1]=4 1614 B8R0.6 COC(=N)COCCO Amb27857878 [0,1,0,0,0,0|2,0,1]=4 1615 B8R0.6 COC(=O)C#CCCO Amb22230912 [0,1,0,0,0,0|1,0,2]=4 1616 B8R0.6 COC(=O)CCCCBr Amb3940220 [0,1,0,0,0,0|2,0,1]=4 1617 B8R0.6 COC(=O)CCCCCl Amb3940767 [0,1,0,0,0,0|2,0,1]=4 1618 B8R0.6 COC(=O)CCCCI Amb4018545 [0,1,0,0,0,0|2,0,1]=4 1619 B8R0.6 COC(=O)CCCCN Amb13951283 [0,1,0,0,0,0|2,0,1]=4 1620 B8R0.6 COC(=O)CCCCN Amb18642844 [0,1,0,0,0,0|2,0,1]=4 1621 B8R0.6 COC(=O)CCCCO Amb22641583 [0,1,0,0,0,0|1,0,1]=3 1622 B8R0.6 COC(=O)CCCCS Amb27218229 [0,1,0,0,0,0|1,1,1]=4 1623 B8R0.6 COC(=O)COCCO Amb24113538 [0,1,0,0,0,0|2,0,1]=4 1624 B8R0.6 COC(=O)CSCCO Amb9245011 [0,1,0,0,0,0|2,0,1]=4 1625 B8R0.6 COC(=O)NCCCF Amb27968335 [0,1,0,0,0,0|3,0,0]=4 1626 B8R0.6 COC(=O)OCCCF Amb24088642 [0,1,0,0,0,0|3,0,0]=4 1627 B8R0.6 COC(=O)\C=C\CCBr Amb22756459 [0,1,0,0,0,0|2,0,1]=4 1628 B8R0.6 COC(=O)\C=C\CCN Amb27617644 [0,1,0,0,0,0|2,0,1]=4 1629 B8R0.6 COC(=O)\C=C\CCO Amb26347391 [0,1,0,0,0,0|1,0,1]=3 1630 B8R0.6 COC(=S)SCCCF Amb27837959 [0,1,0,0,0,0|3,0,0]=4 1631 B8R0.6 COCCCC(N)CO Amb26550641 [0,1,0,0,0,0|1,0,2]=4 1632 B8R0.6 COCCCC(O)CO Amb27588922 [0,1,0,0,0,0|1,0,2]=4 1633 B8R0.6 COCOCC(N)CO Amb27601063 [0,1,0,0,0,0|2,0,1]=4 1634 B8R0.6 COCOCC(O)CO Amb27632031 [0,1,0,0,0,0|2,0,1]=4 1635 B8R0.6 COCOC[C@@H](C)CO Amb24478614 [0,1,0,0,0,0|2,0,1]=4 1636 B8R0.6 CSC(=S)OCCCO Amb27593920 [0,1,0,0,0,0|2,0,0]=3 1637 B8R0.6 CSCCCC(N)CO Amb25888586 [0,1,0,0,0,0|1,0,2]=4 1638 B8R0.6 CSCSCC(O)CO Amb27212112 [0,1,0,0,0,0|2,0,1]=4 1639 B8R0.6 CS[C@H](C)\C=C\CCO Amb27605380 [0,1,0,0,0,0|1,0,2]=4 1640 B8R0.6 C[C@H](CO)CCCCO Amb27804560 [0,1,0,0,0,0|1,0,2]=4 1641 B8R0.6 C\C(=C/CCC#N)CO Amb28245386 [0,1,0,0,0,0|2,0,1]=4 1642 B8R0.6 C\C(=C/CCC=O)CO Amb28248122 [0,1,0,0,0,0|1,0,2]=4 1643 B8R0.6 C\C(=C/CCCBr)CO Amb28348616 [0,1,0,0,0,0|2,0,0]=3 1644 B8R0.6 C\C(=C/CCCN)CO Amb28077171 [0,1,0,0,0,0|2,0,0]=3 1645 B8R0.6 C\C(=C\C=C\CO)CO Amb27780271 [0,1,0,0,0,0|1,0,2]=4 1646 B8R0.6 C\C(=C\CCC=O)CO Amb18642621 [0,1,0,0,0,0|1,0,2]=4 1647 B8R0.6 C\C=C(/C)CCCCO Amb28385373 [0,1,0,0,0,0|0,0,2]=3 1648 B8R0.6 C\C=C(\C)CCCCBr Amb26877158 [0,1,0,0,0,0|1,0,2]=4 1649 B8R0.6 C\C=C\C=C\C(C)CO Amb27660980 [0,1,0,0,0,0|0,0,2]=3 1650 B8R0.6 C\C=C\C=C\C(O)CN Amb27804094 [0,1,0,0,0,0|1,0,2]=4 1651 B8R0.6 C\C=C\C=C\[C@@H](O)CC Amb27956631 [0,1,0,0,0,0|1,0,2]=4 1652 B8R0.6 C\C=C\CCC(C)CO Amb27662361 [0,1,0,0,0,0|0,0,2]=3 1653 B8R0.6 C\C=C\CSC(C)CO Amb27641132 [0,1,0,0,0,0|1,0,2]=4 1654 B8R0.6 C\C=C\OCC(O)CO Amb27406972 [0,1,0,0,0,0|1,0,1]=3 1655 B8R0.6 NC(CO)COCCO Amb27956486 [0,1,0,0,0,0|2,0,1]=4 1656 B8R0.6 NCC(=O)NCCCCl Amb33483904 [0,1,0,0,0,0|3,0,0]=4 1657 B8R0.6 NCC(=O)NCCCCl Amb33483921 [0,1,0,0,0,0|3,0,0]=4 1658 B8R0.6 NCC(=O)OCCCO Amb27430485 [0,1,0,0,0,0|2,0,0]=3 1659 B8R0.6 NCCCCC(N)CO Amb27403112 [0,1,0,0,0,0|1,0,2]=4 1660 B8R0.6 NCCCC[C@H](N)CO Amb25883920 [0,1,0,0,0,0|1,0,2]=4 1661 B8R0.6 NCCCC[C@H](N)CO Amb33801813 [0,1,0,0,0,0|1,0,2]=4 1662 B8R0.6 NCCCNC(=O)CBr Amb27837527 [0,1,0,0,0,0|3,0,0]=4 1663 B8R0.6 NCCCNC(=O)CN Amb19011430 [0,1,0,0,0,0|3,0,0]=4 1664 B8R0.6 NCCCNC(=O)CO Amb28346767 [0,1,0,0,0,0|3,0,0]=4 1665 B8R0.6 NCCCNC(=O)CS Amb27391980 [0,1,0,0,0,0|3,0,0]=4 1666 B8R0.6 NCCNCC(N)CO Amb27234820 [0,1,0,0,0,0|2,0,1]=4 1667 B8R0.6 NCCNCC(O)CO Amb28198046 [0,1,0,0,0,0|2,0,1]=4 1668 B8R0.6 NCCNC[C@H](N)CO Amb27218189 [0,1,0,0,0,0|2,0,1]=4 1669 B8R0.6 NCCNC[C@H](O)CO Amb27480727 [0,1,0,0,0,0|2,0,1]=4 1670 B8R0.6 O=C(CBr)NCCCF Amb28289230 [0,1,0,0,0,0|3,0,0]=4 1671 B8R0.6 O=C(CBr)NCCCO Amb17329705 [0,1,0,0,0,0|2,0,0]=3 1672 B8R0.6 O=C(CCl)NCCCCl Amb2125567 [0,1,0,0,0,0|3,0,0]=4 1673 B8R0.6 O=C(CCl)NCCCF Amb27198384 [0,1,0,0,0,0|3,0,0]=4 1674 B8R0.6 O=C(CCl)NCCCO Amb4477240 [0,1,0,0,0,0|2,0,0]=3 1675 B8R0.6 O=C(CCl)OCCCO Amb27198162 [0,1,0,0,0,0|2,0,0]=3 1676 B8R0.6 O=C(CO)NCCCO Amb5798092 [0,1,0,0,0,0|2,0,0]=3 1677 B8R0.6 O=C(CO)OCCCCl Amb27457140 [0,1,0,0,0,0|3,0,0]=4 1678 B8R0.6 O=C(CO)OCCCF Amb27765133 [0,1,0,0,0,0|3,0,0]=4 1679 B8R0.6 O=C(CS)NCCCF Amb27628663 [0,1,0,0,0,0|3,0,0]=4 1680 B8R0.6 O=C\C(F)=C\CCCCl Amb28429849 [0,1,0,0,0,0|2,0,1]=4 1681 B8R0.6 OCC#CC[C@@H](O)CO Amb28191975 [0,1,0,0,0,0|1,0,2]=4 1682 B8R0.6 OCC#CC[C@H](O)CO Amb27589715 [0,1,0,0,0,0|1,0,2]=4 1683 B8R0.6 OCC(O)CCCCBr Amb27444663 [0,1,0,0,0,0|1,0,2]=4 1684 B8R0.6 OCC(O)COCCCl Amb27596579 [0,1,0,0,0,0|2,0,1]=4 1685 B8R0.6 OCCCCC(O)CBr Amb27219046 [0,1,0,0,0,0|1,0,2]=4 1686 B8R0.6 OCCCCC(O)CO Amb8513368 [0,1,0,0,0,0|1,0,2]=4 1687 B8R0.6 OCCNCC(O)CO Amb25288018 [0,1,0,0,0,0|2,0,1]=4 1688 B8R0.6 OCCNC[C@H](O)CO Amb27980519 [0,1,0,0,0,0|2,0,1]=4 1689 B8R0.6 OCCOCC(Cl)CO Amb28142003 [0,1,0,0,0,0|2,0,1]=4 1690 B8R0.6 OCCSCC(O)CO Amb25945811 [0,1,0,0,0,0|2,0,1]=4 1691 B8R0.6 OC[C@@H](O)CNCCF Amb27852630 [0,1,0,0,0,0|2,0,1]=4 1692 B8R0.6 OC\C(F)=C\CCCCl Amb27623942 [0,1,0,0,0,0|2,0,0]=3 1693 B8R0.6 [C-]#[N+]CCNC(=O)CC Amb27879557 [0,1,0,0,0,0|3,0,0]=4 1694 B8R0.7 C#C\C=C\CCC(=O)O Amb10605297 [0,1,0,0,0,0|0,0,3]=4 1695 B8R0.7 C=C(Br)CC\C=C\CO Amb27808770 [0,1,0,0,0,0|2,0,1]=4 1696 B8R0.7 C=C(C)C#CCCCO Amb27874899 [0,1,0,0,0,0|0,0,3]=4 1697 B8R0.7 C=C(C)CCCCCO Amb27641867 [0,1,0,0,0,0|0,0,3]=4 1698 B8R0.7 C=C(C)CNCCCO Amb28285230 [0,1,0,0,0,0|1,0,2]=4 1699 B8R0.7 C=C(C)\C=C\CCCBr Amb25264506 [0,1,0,0,0,0|1,0,1]=3 1700 B8R0.7 C=C(C)\C=C\CCCCl Amb27494353 [0,1,0,0,0,0|1,0,1]=3 1701 B8R0.7 C=C(C)\C=C\CCNC Amb25883809 [0,1,0,0,0,0|2,0,1]=4 1702 B8R0.7 C=C=CCCCC(C)O Amb28315442 [0,1,0,0,0,0|0,0,3]=4 1703 B8R0.7 C=C\C=C\CCC(=O)O Amb10605294 [0,1,0,0,0,0|0,0,3]=4 1704 B8R0.7 CC(=O)CCCCCO Amb27237283 [0,1,0,0,0,0|0,0,3]=4 1705 B8R0.7 CC(=O)CC\C=C/CO Amb27828969 [0,1,0,0,0,0|1,0,2]=4 1706 B8R0.7 CC(=O)NCCCCO Amb17102977 [0,1,0,0,0,0|1,0,2]=4 1707 B8R0.7 CC(=O)NOCCCO Amb28205723 [0,1,0,0,0,0|2,0,1]=4 1708 B8R0.7 CC(=O)OCCCCO Amb25714960 [0,1,0,0,0,0|1,0,2]=4 1709 B8R0.7 CC(=O)\C=C\CCC#N Amb18642111 [0,1,0,0,0,0|1,0,2]=4 1710 B8R0.7 CC(=O)\C=C\NCCCl Amb27439668 [0,1,0,0,0,0|2,0,1]=4 1711 B8R0.7 CC(C)=C=CCCCCl Amb27173200 [0,1,0,0,0,0|1,0,2]=4 1712 B8R0.7 CC(C)=CCCCCBr Amb25933172 [0,1,0,0,0,0|1,0,2]=4 1713 B8R0.7 CC(C)=CCCCCCl Amb32688153 [0,1,0,0,0,0|1,0,2]=4 1714 B8R0.7 CC(C)=CCCCCN Amb28345726 [0,1,0,0,0,0|1,0,2]=4 1715 B8R0.7 CC(C)=CCCCCO Amb28315431 [0,1,0,0,0,0|0,0,2]=3 1716 B8R0.7 CC(C)=C\C=C\CCBr Amb27878458 [0,1,0,0,0,0|1,0,2]=4 1717 B8R0.7 CC(C)CC#CCCO Amb28206065 [0,1,0,0,0,0|0,0,3]=4 1718 B8R0.7 CC(C)CCCCCBr Amb16231055 [0,1,0,0,0,0|1,0,2]=4 1719 B8R0.7 CC(C)CCCCCCl Amb27592473 [0,1,0,0,0,0|1,0,2]=4 1720 B8R0.7 CC(C)CCCCCN Amb18124327 [0,1,0,0,0,0|1,0,2]=4 1721 B8R0.7 CC(C)CCCCCO Amb22055777 [0,1,0,0,0,0|0,0,2]=3 1722 B8R0.7 CC(C)CCNCCO Amb4034535 [0,1,0,0,0,0|1,0,2]=4 1723 B8R0.7 CC(C)CCOCCO Amb10609610 [0,1,0,0,0,0|1,0,2]=4 1724 B8R0.7 CC(C)CC\C=C\CCl Amb28133989 [0,1,0,0,0,0|2,0,0]=3 1725 B8R0.7 CC(C)CNCCCBr Amb27401785 [0,1,0,0,0,0|2,0,1]=4 1726 B8R0.7 CC(C)CNCCCN Amb17315266 [0,1,0,0,0,0|2,0,1]=4 1727 B8R0.7 CC(C)CNCCCO Amb534463 [0,1,0,0,0,0|1,0,1]=3 1728 B8R0.7 CC(C)COCCCBr Amb8828212 [0,1,0,0,0,0|2,0,1]=4 1729 B8R0.7 CC(C)COCCCCl Amb6255740 [0,1,0,0,0,0|2,0,1]=4 1730 B8R0.7 CC(C)COCCCN Amb1154609 [0,1,0,0,0,0|2,0,1]=4 1731 B8R0.7 CC(C)COCCCO Amb19317273 [0,1,0,0,0,0|1,0,1]=3 1732 B8R0.7 CC(C)COCCCS Amb27842108 [0,1,0,0,0,0|1,1,1]=4 1733 B8R0.7 CC(C)CSCCCCl Amb9304955 [0,1,0,0,0,0|2,0,1]=4 1734 B8R0.7 CC(C)CSCCCN Amb9203029 [0,1,0,0,0,0|2,0,1]=4 1735 B8R0.7 CC(C)CSCCCO Amb9273779 [0,1,0,0,0,0|1,0,1]=3 1736 B8R0.7 CC(C)CS\C=C\CO Amb28051939 [0,1,0,0,0,0|3,0,0]=4 1737 B8R0.7 CC(C)C\C=C\CCCl Amb27255207 [0,1,0,0,0,0|1,0,2]=4 1738 B8R0.7 CC(C)C\C=C\CCO Amb24340184 [0,1,0,0,0,0|0,0,2]=3 1739 B8R0.7 CC(C)C\C=N\CCN Amb27653243 [0,1,0,0,0,0|2,0,1]=4 1740 B8R0.7 CC(C)NCCCCCl Amb27759406 [0,1,0,0,0,0|2,0,1]=4 1741 B8R0.7 CC(C)NCCCCF Amb27852540 [0,1,0,0,0,0|2,0,1]=4 1742 B8R0.7 CC(C)NCCCCN Amb17334116 [0,1,0,0,0,0|2,0,1]=4 1743 B8R0.7 CC(C)NCCCCO Amb17334129 [0,1,0,0,0,0|1,0,1]=3 1744 B8R0.7 CC(C)NC\C=C\CCl Amb28146785 [0,1,0,0,0,0|3,0,0]=4 1745 B8R0.7 CC(C)NNCCCN Amb18642858 [0,1,0,0,0,0|3,0,0]=4 1746 B8R0.7 CC(C)OCCCCBr Amb8855453 [0,1,0,0,0,0|2,0,1]=4 1747 B8R0.7 CC(C)OCCCCCl Amb18181677 [0,1,0,0,0,0|2,0,1]=4 1748 B8R0.7 CC(C)OCCCCN Amb6243226 [0,1,0,0,0,0|2,0,1]=4 1749 B8R0.7 CC(C)OCCCCO Amb24704996 [0,1,0,0,0,0|1,0,1]=3 1750 B8R0.7 CC(C)OCCCCS Amb27220452 [0,1,0,0,0,0|1,1,1]=4 1751 B8R0.7 CC(C)OC\C=C\CN Amb33474232 [0,1,0,0,0,0|3,0,0]=4 1752 B8R0.7 CC(C)OC\C=C\CO Amb33079442 [0,1,0,0,0,0|3,0,0]=4 1753 B8R0.7 CC(C)O[SiH2]CCCN Amb28128457 [0,1,0,0,0,0|2,1,0]=4 1754 B8R0.7 CC(C)O\C=C\CCO Amb28315471 [0,1,0,0,0,0|1,0,1]=3 1755 B8R0.7 CC(C)SCCCCBr Amb26443109 [0,1,0,0,0,0|2,0,1]=4 1756 B8R0.7 CC(C)SCCCCCl Amb18798740 [0,1,0,0,0,0|2,0,1]=4 1757 B8R0.7 CC(C)SCCCCN Amb17500947 [0,1,0,0,0,0|2,0,1]=4 1758 B8R0.7 CC(C)SCCCCO Amb28049080 [0,1,0,0,0,0|1,0,1]=3 1759 B8R0.7 CC(C)SCCCCS Amb27833171 [0,1,0,0,0,0|1,1,1]=4 1760 B8R0.7 CC(C)SC\C=C\CCl Amb28321203 [0,1,0,0,0,0|3,0,0]=4 1761 B8R0.7 CC(C)SC\C=C\CN Amb28061485 [0,1,0,0,0,0|3,0,0]=4 1762 B8R0.7 CC(C)SC\C=C\CS Amb27833172 [0,1,0,0,0,0|3,0,0]=4 1763 B8R0.7 CC(C)\C=C\C#CCO Amb27456506 [0,1,0,0,0,0|0,0,2]=3 1764 B8R0.7 CC(C)\C=C\C=C\CBr Amb28291568 [0,1,0,0,0,0|1,0,2]=4 1765 B8R0.7 CC(C)\C=C\CCCBr Amb27878117 [0,1,0,0,0,0|1,0,0]=2 1766 B8R0.7 CC(C)\C=C\CCCCl Amb28193361 [0,1,0,0,0,0|1,0,0]=2 1767 B8R0.7 CC(C)\C=C\CCCO Amb28045718 [0,1,0,0,0,0|0,0,0]=1 1768 B8R0.7 CC(C)\C=N\CCCCl Amb28046843 [0,1,0,0,0,0|2,0,0]=3 1769 B8R0.7 CC(C)\C=N\CCCN Amb27420098 [0,1,0,0,0,0|2,0,0]=3 1770 B8R0.7 CC(C)\C=N\NCCO Amb24644241 [0,1,0,0,0,0|2,0,0]=3 1771 B8R0.7 CC(C)\C=N\OCCBr Amb27408587 [0,1,0,0,0,0|3,0,0]=4 1772 B8R0.7 CC(C)\C=N\OCCO Amb27632055 [0,1,0,0,0,0|2,0,0]=3 1773 B8R0.7 CC(Cl)CCCCCO Amb27656999 [0,1,0,0,0,0|0,0,2]=3 1774 B8R0.7 CC(Cl)CNCCCCl Amb27637862 [0,1,0,0,0,0|2,0,1]=4 1775 B8R0.7 CC(Cl)C\C=C\CCO Amb26421608 [0,1,0,0,0,0|0,0,2]=3 1776 B8R0.7 CC(Cl)OCCCCCl Amb28383422 [0,1,0,0,0,0|2,0,1]=4 1777 B8R0.7 CC(F)CCCCCBr Amb27781575 [0,1,0,0,0,0|1,0,2]=4 1778 B8R0.7 CC(F)CSCCCN Amb27209900 [0,1,0,0,0,0|2,0,1]=4 1779 B8R0.7 CC(N)CCCCCO Amb24386350 [0,1,0,0,0,0|0,0,2]=3 1780 B8R0.7 CC(N)CNCCCF Amb27162848 [0,1,0,0,0,0|2,0,1]=4 1781 B8R0.7 CC(N)COCCCO Amb27635056 [0,1,0,0,0,0|1,0,1]=3 1782 B8R0.7 CC(N)CSCCCF Amb27223251 [0,1,0,0,0,0|2,0,1]=4 1783 B8R0.7 CC(O)CCC#CCO Amb28315496 [0,1,0,0,0,0|1,0,2]=4 1784 B8R0.7 CC(O)CCCCCF Amb27660009 [0,1,0,0,0,0|1,0,2]=4 1785 B8R0.7 CC(O)CCCCCO Amb27464322 [0,1,0,0,0,0|0,0,2]=3 1786 B8R0.7 CC(O)CCNCCN Amb27768810 [0,1,0,0,0,0|2,0,1]=4 1787 B8R0.7 CC(O)CC\C=C\C#N Amb27836028 [0,1,0,0,0,0|1,0,1]=3 1788 B8R0.7 CC(O)CNCCCF Amb27273615 [0,1,0,0,0,0|2,0,1]=4 1789 B8R0.7 CC(O)CNCCCO Amb17308669 [0,1,0,0,0,0|1,0,1]=3 1790 B8R0.7 CC(O)COCCCN Amb28318924 [0,1,0,0,0,0|2,0,1]=4 1791 B8R0.7 CC(O)COCOCO Amb28248280 [0,1,0,0,0,0|2,0,1]=4 1792 B8R0.7 CC(O)CSCCCS Amb27956596 [0,1,0,0,0,0|1,1,1]=4 1793 B8R0.7 CC(O)\C=C\CCC#N Amb27424649 [0,1,0,0,0,0|1,0,1]=3 1794 B8R0.7 CC(O)\C=C\CCC=O Amb28134828 [0,1,0,0,0,0|0,0,2]=3 1795 B8R0.7 CCC#CCCC(=O)O Amb28046178 [0,1,0,0,0,0|0,0,3]=4 1796 B8R0.7 CCC#CCCC(O)O Amb28064154 [0,1,0,0,0,0|0,0,2]=3 1797 B8R0.7 CCCC#CC[C@@H](C)O Amb27652867 [0,1,0,0,0,0|0,0,3]=4 1798 B8R0.7 CCCCC#CC(C)Br Amb27645420 [0,1,0,0,0,0|1,0,2]=4 1799 B8R0.7 CCCCC#CC(C)C Amb28291437 [0,1,0,0,0,0|1,0,2]=4 1800 B8R0.7 CCCCC#CC(C)O Amb27231182 [0,1,0,0,0,0|1,0,2]=4 1801 B8R0.7 CCCCC#C[C@@H](C)O Amb27835165 [0,1,0,0,0,0|1,0,2]=4 1802 B8R0.7 CCCCCCB(O)O Amb2722519 [0,1,0,0,0,0|1,0,2]=4 1803 B8R0.7 CCCCCCC(=O)O Amb34915914 [0,1,0,0,0,0|0,0,3]=4 1804 B8R0.7 CCCCCCC(=O)O Amb3499439 [0,1,0,0,0,0|0,0,3]=4 1805 B8R0.7 CCCCCCC(Br)Br Amb33299433 [0,1,0,0,0,0|1,0,2]=4 1806 B8R0.7 CCCCCCC(C)Br Amb8387237 [0,1,0,0,0,0|1,0,2]=4 1807 B8R0.7 CCCCCCC(C)C Amb6366318 [0,1,0,0,0,0|1,0,2]=4 1808 B8R0.7 CCCCCCC(C)Cl Amb7795644 [0,1,0,0,0,0|1,0,2]=4 1809 B8R0.7 CCCCCCC(C)I Amb3940584 [0,1,0,0,0,0|1,0,2]=4 1810 B8R0.7 CCCCCCC(C)N Amb3940458 [0,1,0,0,0,0|1,0,2]=4 1811 B8R0.7 CCCCCCC(C)O Amb3940385 [0,1,0,0,0,0|0,0,2]=3 1812 B8R0.7 CCCCCCC(C)S Amb7795225 [0,1,0,0,0,0|0,1,2]=4 1813 B8R0.7 CCCCCCC(O)O Amb27451028 [0,1,0,0,0,0|0,0,2]=3 1814 B8R0.7 CCCCCC[C@@H](C)Br Amb26563385 [0,1,0,0,0,0|1,0,2]=4 1815 B8R0.7 CCCCCC[C@@H](C)N Amb8516401 [0,1,0,0,0,0|1,0,2]=4 1816 B8R0.7 CCCCCC[C@@H](C)O Amb8513616 [0,1,0,0,0,0|0,0,2]=3 1817 B8R0.7 CCCCCC[C@H](C)Br Amb28401131 [0,1,0,0,0,0|1,0,2]=4 1818 B8R0.7 CCCCCC[C@H](C)N Amb8516350 [0,1,0,0,0,0|1,0,2]=4 1819 B8R0.7 CCCCCNC(C)C Amb6250709 [0,1,0,0,0,0|2,0,1]=4 1820 B8R0.7 CCCCCSC(C)C Amb27197323 [0,1,0,0,0,0|2,0,1]=4 1821 B8R0.7 CCCCCSC(C)Cl Amb27477698 [0,1,0,0,0,0|2,0,1]=4 1822 B8R0.7 CCCCNCC(C)C Amb6690984 [0,1,0,0,0,0|2,0,1]=4 1823 B8R0.7 CCCCNCC(C)O Amb9246458 [0,1,0,0,0,0|1,0,2]=4 1824 B8R0.7 CCCCOCC(C)Br Amb27390173 [0,1,0,0,0,0|2,0,1]=4 1825 B8R0.7 CCCCOCC(C)C Amb26035939 [0,1,0,0,0,0|2,0,1]=4 1826 B8R0.7 CCCCOCC(C)O Amb4019960 [0,1,0,0,0,0|1,0,2]=4 1827 B8R0.7 CCCCOC[C@@H](C)N Amb27838727 [0,1,0,0,0,0|2,0,1]=4 1828 B8R0.7 CCCCOC[C@H](C)N Amb28326216 [0,1,0,0,0,0|2,0,1]=4 1829 B8R0.7 CCCCSCC(C)C Amb4017929 [0,1,0,0,0,0|2,0,1]=4 1830 B8R0.7 CCCCSCC(C)N Amb27772074 [0,1,0,0,0,0|2,0,1]=4 1831 B8R0.7 CCCCSCC(C)O Amb27768766 [0,1,0,0,0,0|1,0,2]=4 1832 B8R0.7 CCCC\C=C/C(C)=O Amb28074727 [0,1,0,0,0,0|1,0,1]=3 1833 B8R0.7 CCCC\C=C\B(O)O Amb10068585 [0,1,0,0,0,0|3,0,0]=4 1834 B8R0.7 CCCC\C=C\C(=O)Cl Amb2688651 [0,1,0,0,0,0|2,0,1]=4 1835 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [0,1,0,0,0,0|2,0,1]=4 1836 B8R0.7 CCCC\C=C\C(=O)[O-] Amb17778116 [0,1,0,0,0,0|2,0,1]=4 1837 B8R0.7 CCCC\C=C\[C@H](C)O Amb27950980 [0,1,0,0,0,0|1,0,0]=2 1838 B8R0.7 CCCC\N=C\[C@H](C)Cl Amb27401792 [0,1,0,0,0,0|2,0,0]=3 1839 B8R0.7 CCCNCCC(=O)O Amb18633174 [0,1,0,0,0,0|1,0,2]=4 1840 B8R0.7 CCCNCCC(=O)O Amb2372065 [0,1,0,0,0,0|1,0,2]=4 1841 B8R0.7 CCCNCCC(C)C Amb6279764 [0,1,0,0,0,0|2,0,1]=4 1842 B8R0.7 CCCNCCC(F)F Amb20667932 [0,1,0,0,0,0|2,0,1]=4 1843 B8R0.7 CCCNCCC(F)F Amb26012789 [0,1,0,0,0,0|2,0,1]=4 1844 B8R0.7 CCCNCC[C@@H](C)O Amb27251174 [0,1,0,0,0,0|1,0,1]=3 1845 B8R0.7 CCCNCC[PH](=O)O Amb28056179 [0,1,0,0,0,0|2,0,1]=4 1846 B8R0.7 CCCN\C=C\C(C)=S Amb27168202 [0,1,0,0,0,0|2,0,1]=4 1847 B8R0.7 CCCOCCC(=O)O Amb8874502 [0,1,0,0,0,0|1,0,2]=4 1848 B8R0.7 CCCOCCC(C)Cl Amb27768653 [0,1,0,0,0,0|2,0,1]=4 1849 B8R0.7 CCCOCCC(C)O Amb27438490 [0,1,0,0,0,0|1,0,1]=3 1850 B8R0.7 CCCSCCC(C)C Amb28400564 [0,1,0,0,0,0|2,0,1]=4 1851 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [0,1,0,0,0,0|0,0,3]=4 1852 B8R0.7 CCC\C=C\CC(C)Br Amb26397126 [0,1,0,0,0,0|1,0,2]=4 1853 B8R0.7 CCC\C=C\CC(C)Cl Amb26636688 [0,1,0,0,0,0|1,0,2]=4 1854 B8R0.7 CCC\C=C\CC(C)O Amb27766099 [0,1,0,0,0,0|0,0,2]=3 1855 B8R0.7 CCC\C=C\CN(C)O Amb33224461 [0,1,0,0,0,0|1,0,2]=4 1856 B8R0.7 CCC\C=C\C[C@@H](C)N Amb33424842 [0,1,0,0,0,0|1,0,2]=4 1857 B8R0.7 CCC\C=C\C[C@@H](C)O Amb33424840 [0,1,0,0,0,0|0,0,2]=3 1858 B8R0.7 CCC\C=C\C[C@H](C)N Amb33424841 [0,1,0,0,0,0|1,0,2]=4 1859 B8R0.7 CCC\C=C\C[C@H](C)O Amb33358968 [0,1,0,0,0,0|0,0,2]=3 1860 B8R0.7 CCNCCCC(=O)O Amb30585148 [0,1,0,0,0,0|1,0,2]=4 1861 B8R0.7 CCNCCCC(=O)O Amb6253896 [0,1,0,0,0,0|1,0,2]=4 1862 B8R0.7 CCNCCCC(C)Cl Amb27768830 [0,1,0,0,0,0|2,0,1]=4 1863 B8R0.7 CCOC#CCC(C)O Amb27804467 [0,1,0,0,0,0|1,0,2]=4 1864 B8R0.7 CCOCCCC(=O)O Amb6257602 [0,1,0,0,0,0|1,0,2]=4 1865 B8R0.7 CCONCCC(C)F Amb27617250 [0,1,0,0,0,0|3,0,0]=4 1866 B8R0.7 CCO\C=N\CC(=O)O Amb27440832 [0,1,0,0,0,0|2,0,1]=4 1867 B8R0.7 CCSCCCB(O)O Amb24351131 [0,1,0,0,0,0|2,0,1]=4 1868 B8R0.7 CCSCCCC(=O)O Amb6680204 [0,1,0,0,0,0|1,0,2]=4 1869 B8R0.7 CCSCCCC(C)C Amb27588655 [0,1,0,0,0,0|2,0,1]=4 1870 B8R0.7 CCSCCCC(C)N Amb26049335 [0,1,0,0,0,0|2,0,1]=4 1871 B8R0.7 CCSCCCC(C)O Amb26319707 [0,1,0,0,0,0|1,0,1]=3 1872 B8R0.7 CCSCCC[C@@H](C)N Amb33323737 [0,1,0,0,0,0|2,0,1]=4 1873 B8R0.7 CCSCCC[C@@H](C)O Amb33323738 [0,1,0,0,0,0|1,0,1]=3 1874 B8R0.7 CCSCCC[C@H](C)N Amb33323735 [0,1,0,0,0,0|2,0,1]=4 1875 B8R0.7 CCSCCC[C@H](C)O Amb33323739 [0,1,0,0,0,0|1,0,1]=3 1876 B8R0.7 CCSC\C=C\C(C)=O Amb33323646 [0,1,0,0,0,0|2,0,1]=4 1877 B8R0.7 CCSC\C=C\C(C)N Amb33323650 [0,1,0,0,0,0|2,0,0]=3 1878 B8R0.7 CCSSCCC(=O)O Amb27837279 [0,1,0,0,0,0|2,0,1]=4 1879 B8R0.7 CC\C=C/CCC(=O)O Amb25831265 [0,1,0,0,0,0|0,0,1]=2 1880 B8R0.7 CC\C=C/SCC(C)=O Amb24615236 [0,1,0,0,0,0|1,0,2]=4 1881 B8R0.7 CC\C=C\C=C\C(=O)O Amb33359031 [0,1,0,0,0,0|0,0,3]=4 1882 B8R0.7 CC\C=C\C=C\C(C)N Amb33267512 [0,1,0,0,0,0|1,0,2]=4 1883 B8R0.7 CC\C=C\C=C\C(C)O Amb28049199 [0,1,0,0,0,0|0,0,2]=3 1884 B8R0.7 CC\C=C\C=C\[C@@H](C)O Amb27424950 [0,1,0,0,0,0|0,0,2]=3 1885 B8R0.7 CC\C=C\CCC(=O)O Amb18642608 [0,1,0,0,0,0|0,0,1]=2 1886 B8R0.7 CC\C=C\CCC(C)=O Amb24523649 [0,1,0,0,0,0|0,0,2]=3 1887 B8R0.7 CC\C=C\CCC(C)C Amb25811237 [0,1,0,0,0,0|1,0,0]=2 1888 B8R0.7 CC\C=C\CCC(C)N Amb27875423 [0,1,0,0,0,0|1,0,0]=2 1889 B8R0.7 CC\C=C\CCC(C)O Amb33079835 [0,1,0,0,0,0|0,0,0]=1 1890 B8R0.7 CC\C=C\CCC(N)=O Amb27221048 [0,1,0,0,0,0|0,0,2]=3 1891 B8R0.7 CC\C=C\CC[C@@H](C)N Amb33267990 [0,1,0,0,0,0|1,0,0]=2 1892 B8R0.7 CC\C=C\CC[C@@H](C)O Amb33267991 [0,1,0,0,0,0|0,0,0]=1 1893 B8R0.7 CC\C=C\CC[C@H](C)N Amb33267989 [0,1,0,0,0,0|1,0,0]=2 1894 B8R0.7 CC\C=C\CC[C@H](C)O Amb33267992 [0,1,0,0,0,0|0,0,0]=1 1895 B8R0.7 CC\C=C\CC[N+](=O)[O-] Amb33267977 [0,1,0,0,0,0|1,0,1]=3 1896 B8R0.7 CC\C=C\CNC(C)=O Amb27828159 [0,1,0,0,0,0|1,0,2]=4 1897 B8R0.7 CC\C=C\COC(C)=O Amb27487199 [0,1,0,0,0,0|1,0,2]=4 1898 B8R0.7 CC\C=C\NCC(C)C Amb27655952 [0,1,0,0,0,0|2,0,0]=3 1899 B8R0.7 CC\C=C\OCC(C)=O Amb25235223 [0,1,0,0,0,0|1,0,2]=4 1900 B8R0.7 CC\C=C\SCC(C)=O Amb28245395 [0,1,0,0,0,0|1,0,2]=4 1901 B8R0.7 CN(C)CCCCCO Amb17334131 [0,1,0,0,0,0|1,0,2]=4 1902 B8R0.7 CN(C)CC\C=C\CN Amb33271979 [0,1,0,0,0,0|3,0,0]=4 1903 B8R0.7 CN(C)CC\C=C\CO Amb33272512 [0,1,0,0,0,0|3,0,0]=4 1904 B8R0.7 CN(C)NCCCCO Amb27635131 [0,1,0,0,0,0|2,0,1]=4 1905 B8R0.7 CNCCCCC(C)O Amb17569923 [0,1,0,0,0,0|1,0,2]=4 1906 B8R0.7 CNCC\C=C\C(C)C Amb27482988 [0,1,0,0,0,0|2,0,0]=3 1907 B8R0.7 COCCCCC(C)O Amb25235448 [0,1,0,0,0,0|1,0,2]=4 1908 B8R0.7 COCCCC[C@@H](C)O Amb33377490 [0,1,0,0,0,0|1,0,2]=4 1909 B8R0.7 COCCCC[C@H](C)O Amb33377491 [0,1,0,0,0,0|1,0,2]=4 1910 B8R0.7 COCC\C=C\C(C)=O Amb33377354 [0,1,0,0,0,0|2,0,1]=4 1911 B8R0.7 COCC\C=C\C(C)Cl Amb27400371 [0,1,0,0,0,0|2,0,0]=3 1912 B8R0.7 COCC\C=C\C(C)N Amb33377304 [0,1,0,0,0,0|2,0,0]=3 1913 B8R0.7 CSCCCCC(C)O Amb27863049 [0,1,0,0,0,0|1,0,2]=4 1914 B8R0.7 CSCCCC[C@@H](C)O Amb33198291 [0,1,0,0,0,0|1,0,2]=4 1915 B8R0.7 CSCCCC[C@H](C)O Amb33198292 [0,1,0,0,0,0|1,0,2]=4 1916 B8R0.7 CSCC\C=C\C(C)=O Amb33197615 [0,1,0,0,0,0|2,0,1]=4 1917 B8R0.7 CSCC\C=C\C(C)N Amb33203363 [0,1,0,0,0,0|2,0,0]=3 1918 B8R0.7 C[C@@H](N)CNCCCF Amb27956501 [0,1,0,0,0,0|2,0,1]=4 1919 B8R0.7 C[C@@H](O)CC#CCCO Amb27618252 [0,1,0,0,0,0|0,0,3]=4 1920 B8R0.7 C[C@@H](O)CCCCCO Amb28461367 [0,1,0,0,0,0|0,0,2]=3 1921 B8R0.7 C[C@H](O)CNCCCN Amb27755469 [0,1,0,0,0,0|2,0,1]=4 1922 B8R0.7 C[SiH2]CCCCC(C)O Amb28049251 [0,1,0,0,0,0|0,1,2]=4 1923 B8R0.7 C\C(N)=N\CCCCO Amb28457978 [0,1,0,0,0,0|1,0,2]=4 1924 B8R0.7 C\C=C\C=C\CC(=O)O Amb27755824 [0,1,0,0,0,0|0,0,3]=4 1925 B8R0.7 C\C=C\CCCC(=O)O Amb18642615 [0,1,0,0,0,0|0,0,3]=4 1926 B8R0.7 C\C=C\CCCC(C)Br Amb27845432 [0,1,0,0,0,0|1,0,2]=4 1927 B8R0.7 N#C\C=C\CCC(=O)O Amb27785050 [0,1,0,0,0,0|1,0,2]=4 1928 B8R0.7 NCCC\C=C\C(=O)O Amb25221789 [0,1,0,0,0,0|2,0,1]=4 1929 B8R0.7 O=C(Cl)\C=C\CCCCl Amb27439280 [0,1,0,0,0,0|2,0,1]=4 1930 B8R0.7 O=C(O)\C=C/SCCO Amb27430273 [0,1,0,0,0,0|2,0,1]=4 1931 B8R0.7 O=C(O)\C=C\CCCCl Amb18644386 [0,1,0,0,0,0|2,0,1]=4 1932 B8R0.7 O=C(O)\C=C\NCCO Amb28056766 [0,1,0,0,0,0|2,0,1]=4 1933 B8R0.7 O=C(O)\C=C\SCCO Amb28281149 [0,1,0,0,0,0|2,0,1]=4 1934 B8R0.7 O=C\C=C\CCC(=O)O Amb26920160 [0,1,0,0,0,0|1,0,2]=4 1935 B8R0.7 OCCCCC=C(F)F Amb27225930 [0,1,0,0,0,0|1,0,2]=4 1936 B8R0.7 OCCCOCC(F)F Amb26407194 [0,1,0,0,0,0|2,0,1]=4 1937 B8R0.7 OCCC\C=C\B(O)O Amb24588560 [0,1,0,0,0,0|2,0,0]=3 1938 B8R1.2 BrCC1=CCCCC1 Amb23439167 [0,0,0,1,0,0|2,0,0]=3 1939 B8R1.2 BrCC1=CCOCC1 Amb24483111 [0,0,0,1,0,0|3,0,0]=4 1940 B8R1.2 BrCC1=COCCC1 Amb33335785 [0,0,0,1,0,0|3,0,0]=4 1941 B8R1.2 BrCC1=COCCO1 Amb29866238 [0,0,0,1,0,0|2,0,0]=3 1942 B8R1.2 BrCC1=NOCCO1 Amb27984826 [0,0,0,1,0,0|3,0,0]=4 1943 B8R1.2 BrCC1C=CCCC1 Amb25869978 [0,0,0,1,0,0|1,0,2]=4 1944 B8R1.2 BrCC1CC=CCC1 Amb26515715 [0,0,0,1,0,0|1,0,0]=2 1945 B8R1.2 BrCC1CC=CCO1 Amb27985852 [0,0,0,1,0,0|2,0,0]=3 1946 B8R1.2 BrCC1CCCCC1 Amb3940090 [0,0,0,1,0,0|1,0,2]=4 1947 B8R1.2 BrCC1CCCCO1 Amb1680201 [0,0,0,1,0,0|1,0,2]=4 1948 B8R1.2 BrCC1CCCNC1 Amb22229216 [0,0,0,1,0,0|2,0,1]=4 1949 B8R1.2 BrCC1CCCNC1 Amb6316208 [0,0,0,1,0,0|2,0,1]=4 1950 B8R1.2 BrCC1CCCOC1 Amb18178619 [0,0,0,1,0,0|2,0,1]=4 1951 B8R1.2 BrCC1CCCSC1 Amb28206709 [0,0,0,1,0,0|2,0,1]=4 1952 B8R1.2 BrCC1CCNCC1 Amb17935872 [0,0,0,1,0,0|2,0,1]=4 1953 B8R1.2 BrCC1CCNCC1 Amb19516018 [0,0,0,1,0,0|2,0,1]=4 1954 B8R1.2 BrCC1CCNCC1 Amb8631527 [0,0,0,1,0,0|2,0,1]=4 1955 B8R1.2 BrCC1CCOCC1 Amb2684131 [0,0,0,1,0,0|2,0,1]=4 1956 B8R1.2 BrCC1CCSCC1 Amb22011704 [0,0,0,1,0,0|2,0,1]=4 1957 B8R1.2 BrCC1OCCCO1 Amb10576216 [0,0,0,1,0,0|2,0,1]=4 1958 B8R1.2 BrC[C@@H]1CCCCO1 Amb27793586 [0,0,0,1,0,0|1,0,2]=4 1959 B8R1.2 C#CC1=CCCCC1 Amb1102053 [0,0,0,1,0,0|1,0,2]=4 1960 B8R1.2 C#CC1CC=CCC1 Amb33203447 [0,0,0,1,0,0|1,0,1]=3 1961 B8R1.2 C=CC1=CCCCC1 Amb24387238 [0,0,0,1,0,0|1,0,2]=4 1962 B8R1.2 CC=C1CCCCC1 Amb8513433 [0,0,0,1,0,0|1,0,2]=4 1963 B8R1.2 CCC1=CCCCC1 Amb25337001 [0,0,0,1,0,0|1,0,0]=2 1964 B8R1.2 CCC1=CNCCC1 Amb27404529 [0,0,0,1,0,0|2,0,0]=3 1965 B8R1.2 CCC1=CSCCN1 Amb27838422 [0,0,0,1,0,0|2,0,0]=3 1966 B8R1.2 CCC1=NCCCN1 Amb17670475 [0,0,0,1,0,0|2,0,0]=3 1967 B8R1.2 CCC1=NCCCS1 Amb26526830 [0,0,0,1,0,0|1,1,0]=3 1968 B8R1.2 CCC1C=CCCC1 Amb27883191 [0,0,0,1,0,0|1,0,2]=4 1969 B8R1.2 CCC1CCCCC1 Amb6296025 [0,0,0,1,0,0|1,0,2]=4 1970 B8R1.2 CCC1CCCCN1 Amb10683459 [0,0,0,1,0,0|1,0,2]=4 1971 B8R1.2 CCC1CCCCN1 Amb5716839 [0,0,0,1,0,0|1,0,2]=4 1972 B8R1.2 CCC1CCCCO1 Amb2703732 [0,0,0,1,0,0|0,0,2]=3 1973 B8R1.2 CCC1CCCNC1 Amb19516506 [0,0,0,1,0,0|2,0,1]=4 1974 B8R1.2 CCC1CCCNC1 Amb7969496 [0,0,0,1,0,0|2,0,1]=4 1975 B8R1.2 CCC1CCNC=N1 Amb35656308 [0,0,0,1,0,0|3,0,0]=4 1976 B8R1.2 CCC1CCNCC1 Amb17760296 [0,0,0,1,0,0|2,0,1]=4 1977 B8R1.2 CCC1CCNCC1 Amb19272296 [0,0,0,1,0,0|2,0,1]=4 1978 B8R1.2 CCC1CNC=CS1 Amb27446999 [0,0,0,1,0,0|3,0,0]=4 1979 B8R1.2 CCC1CNCCO1 Amb13951287 [0,0,0,1,0,0|1,0,2]=4 1980 B8R1.2 CCC1CNCCO1 Amb6892218 [0,0,0,1,0,0|1,0,2]=4 1981 B8R1.2 CCC1NCCCN1 Amb24445855 [0,0,0,1,0,0|2,0,1]=4 1982 B8R1.2 CCC1NCCCO1 Amb17506192 [0,0,0,1,0,0|1,0,1]=3 1983 B8R1.2 CCN1CCCCC1 Amb8387388 [0,0,0,1,0,0|2,0,1]=4 1984 B8R1.2 CCN1CCCCN1 Amb27473714 [0,0,0,1,0,0|2,0,1]=4 1985 B8R1.2 CC[C@@H]1CCCCN1 Amb22892832 [0,0,0,1,0,0|1,0,2]=4 1986 B8R1.2 CC[C@@H]1CCCNC1 Amb27166756 [0,0,0,1,0,0|2,0,1]=4 1987 B8R1.2 CC[C@@H]1CNCCO1 Amb22736874 [0,0,0,1,0,0|1,0,2]=4 1988 B8R1.2 CC[C@@H]1CNCCO1 Amb34144519 [0,0,0,1,0,0|1,0,2]=4 1989 B8R1.2 CC[C@H]1CCCCN1 Amb20241520 [0,0,0,1,0,0|1,0,2]=4 1990 B8R1.2 CC[C@H]1CCCNC1 Amb27872130 [0,0,0,1,0,0|2,0,1]=4 1991 B8R1.2 CC[C@H]1CNCCO1 Amb20242973 [0,0,0,1,0,0|1,0,2]=4 1992 B8R1.2 CC[C@H]1CNCCO1 Amb22226505 [0,0,0,1,0,0|1,0,2]=4 1993 B8R1.2 CN=C1CCCCC1 Amb27838980 [0,0,0,1,0,0|2,0,1]=4 1994 B8R1.2 CNC1=NCCCC1 Amb23570622 [0,0,0,1,0,0|2,0,1]=4 1995 B8R1.2 CNC1=NCCCC1 Amb28934861 [0,0,0,1,0,0|2,0,1]=4 1996 B8R1.2 CNC1=NCCCN1 Amb27219635 [0,0,0,1,0,0|3,0,0]=4 1997 B8R1.2 CNC1=NCCCS1 Amb7762035 [0,0,0,1,0,0|2,1,0]=4 1998 B8R1.2 CNC1CCCCO1 Amb26068497 [0,0,0,1,0,0|1,0,2]=4 1999 B8R1.2 COC1=CCCCC1 Amb10601667 [0,0,0,1,0,0|2,0,0]=3 2000 B8R1.2 COC1=CCNCC1 Amb27174213 [0,0,0,1,0,0|3,0,0]=4 2001 B8R1.2 COC1=CCOCC1 Amb21927983 [0,0,0,1,0,0|3,0,0]=4 2002 B8R1.2 COC1=NCCCC1 Amb2689803 [0,0,0,1,0,0|2,0,1]=4 2003 B8R1.2 COC1=NCCCN1 Amb27838826 [0,0,0,1,0,0|3,0,0]=4 2004 B8R1.2 COC1C=CCCO1 Amb27443733 [0,0,0,1,0,0|1,0,2]=4 2005 B8R1.2 COC1CCC=CO1 Amb8513795 [0,0,0,1,0,0|3,0,0]=4 2006 B8R1.2 COC1CCCCO1 Amb21955138 [0,0,0,1,0,0|1,0,2]=4 2007 B8R1.2 CSC1=CCCCC1 Amb28316123 [0,0,0,1,0,0|2,0,0]=3 2008 B8R1.2 CSC1=NCCCN1 Amb1154745 [0,0,0,1,0,0|3,0,0]=4 2009 B8R1.2 CSC1=NCCCN1 Amb8490167 [0,0,0,1,0,0|3,0,0]=4 2010 B8R1.2 CSC1=NCCCS1 Amb2724845 [0,0,0,1,0,0|2,1,0]=4 2011 B8R1.2 C\N=C1/NCCCO1 Amb28282697 [0,0,0,1,0,0|2,0,0]=3 2012 B8R1.2 ClCC1=CCCCO1 Amb23585659 [0,0,0,1,0,0|1,0,0]=2 2013 B8R1.2 ClCC1=COCCO1 Amb28199866 [0,0,0,1,0,0|2,0,0]=3 2014 B8R1.2 ClCC1=CSCCO1 Amb27254189 [0,0,0,1,0,0|2,0,0]=3 2015 B8R1.2 ClCC1=NCCCN1 Amb27265563 [0,0,0,1,0,0|3,0,0]=4 2016 B8R1.2 ClCC1=NCCCN1 Amb32686526 [0,0,0,1,0,0|3,0,0]=4 2017 B8R1.2 ClCC1C=CCCC1 Amb17672830 [0,0,0,1,0,0|1,0,2]=4 2018 B8R1.2 ClCC1CC=CCC1 Amb24481355 [0,0,0,1,0,0|1,0,0]=2 2019 B8R1.2 ClCC1CC=CCO1 Amb27494302 [0,0,0,1,0,0|2,0,0]=3 2020 B8R1.2 ClCC1CCCCC1 Amb6717235 [0,0,0,1,0,0|1,0,2]=4 2021 B8R1.2 ClCC1CCCCO1 Amb2723692 [0,0,0,1,0,0|1,0,2]=4 2022 B8R1.2 ClCC1CCCNC1 Amb20618020 [0,0,0,1,0,0|2,0,1]=4 2023 B8R1.2 ClCC1CCCNC1 Amb22229227 [0,0,0,1,0,0|2,0,1]=4 2024 B8R1.2 ClCC1CCCOC1 Amb1102676 [0,0,0,1,0,0|2,0,1]=4 2025 B8R1.2 ClCC1CCCSC1 Amb33223993 [0,0,0,1,0,0|2,0,1]=4 2026 B8R1.2 ClCC1CCNCC1 Amb20618009 [0,0,0,1,0,0|2,0,1]=4 2027 B8R1.2 ClCC1CCNCC1 Amb22229730 [0,0,0,1,0,0|2,0,1]=4 2028 B8R1.2 ClCC1CCOCC1 Amb33530364 [0,0,0,1,0,0|2,0,1]=4 2029 B8R1.2 ClCC1CCSCC1 Amb35694770 [0,0,0,1,0,0|2,0,1]=4 2030 B8R1.2 ClCC1OCCCO1 Amb4035387 [0,0,0,1,0,0|2,0,1]=4 2031 B8R1.2 ClC[C@H]1CCCCO1 Amb27879106 [0,0,0,1,0,0|1,0,2]=4 2032 B8R1.2 FCC1CCCNC1 Amb13885420 [0,0,0,1,0,0|2,0,1]=4 2033 B8R1.2 FCC1CCCNC1 Amb13889108 [0,0,0,1,0,0|2,0,1]=4 2034 B8R1.2 FCC1CCNCC1 Amb13885415 [0,0,0,1,0,0|2,0,1]=4 2035 B8R1.2 FCC1CCNCC1 Amb21960845 [0,0,0,1,0,0|2,0,1]=4 2036 B8R1.2 ICC1CC=CCC1 Amb30018639 [0,0,0,1,0,0|1,0,0]=2 2037 B8R1.2 ICC1CCCCC1 Amb22263046 [0,0,0,1,0,0|1,0,2]=4 2038 B8R1.2 ICC1CCCCO1 Amb24060887 [0,0,0,1,0,0|1,0,2]=4 2039 B8R1.2 ICC1CCNCC1 Amb21860434 [0,0,0,1,0,0|2,0,1]=4 2040 B8R1.2 ICC1CCNCC1 Amb22229802 [0,0,0,1,0,0|2,0,1]=4 2041 B8R1.2 ICC1CCNCC1 Amb33299469 [0,0,0,1,0,0|2,0,1]=4 2042 B8R1.2 ICC1CCOCC1 Amb2723455 [0,0,0,1,0,0|2,0,1]=4 2043 B8R1.2 N#CC1=CCCCC1 Amb2720853 [0,0,0,1,0,0|2,0,1]=4 2044 B8R1.2 N#CC1=CCCCO1 Amb2700340 [0,0,0,1,0,0|1,0,1]=3 2045 B8R1.2 N#CC1=COCCO1 Amb9677385 [0,0,0,1,0,0|2,0,1]=4 2046 B8R1.2 N#CC1CC=CCC1 Amb2720936 [0,0,0,1,0,0|1,0,1]=3 2047 B8R1.2 NCC1=CCCCC1 Amb10607847 [0,0,0,1,0,0|2,0,0]=3 2048 B8R1.2 NCC1=CCCCC1 Amb22587029 [0,0,0,1,0,0|2,0,0]=3 2049 B8R1.2 NCC1=CCCCO1 Amb33457505 [0,0,0,1,0,0|1,0,0]=2 2050 B8R1.2 NCC1=CCCCO1 Amb8009853 [0,0,0,1,0,0|1,0,0]=2 2051 B8R1.2 NCC1=CCCOC1 Amb24329061 [0,0,0,1,0,0|3,0,0]=4 2052 B8R1.2 NCC1=CCCOC1 Amb28934826 [0,0,0,1,0,0|3,0,0]=4 2053 B8R1.2 NCC1=CCNCC1 Amb26942552 [0,0,0,1,0,0|3,0,0]=4 2054 B8R1.2 NCC1=CCNCC1 Amb33483617 [0,0,0,1,0,0|3,0,0]=4 2055 B8R1.2 NCC1=CCOCC1 Amb24608110 [0,0,0,1,0,0|3,0,0]=4 2056 B8R1.2 NCC1=CCOCC1 Amb28934924 [0,0,0,1,0,0|3,0,0]=4 2057 B8R1.2 NCC1=COCCC1 Amb27202637 [0,0,0,1,0,0|3,0,0]=4 2058 B8R1.2 NCC1=COCCO1 Amb9677510 [0,0,0,1,0,0|2,0,0]=3 2059 B8R1.2 NCC1=NCCCN1 Amb13952559 [0,0,0,1,0,0|3,0,0]=4 2060 B8R1.2 NCC1=NCCCN1 Amb26861317 [0,0,0,1,0,0|3,0,0]=4 2061 B8R1.2 NCC1C=CCCC1 Amb18641664 [0,0,0,1,0,0|1,0,2]=4 2062 B8R1.2 NCC1CC=CCC1 Amb17718909 [0,0,0,1,0,0|1,0,0]=2 2063 B8R1.2 NCC1CC=CCO1 Amb33457361 [0,0,0,1,0,0|2,0,0]=3 2064 B8R1.2 NCC1CC=CCO1 Amb33457362 [0,0,0,1,0,0|2,0,0]=3 2065 B8R1.2 NCC1CCC=CO1 Amb16233709 [0,0,0,1,0,0|2,0,0]=3 2066 B8R1.2 NCC1CCCCC1 Amb1158677 [0,0,0,1,0,0|1,0,2]=4 2067 B8R1.2 NCC1CCCCO1 Amb19372867 [0,0,0,1,0,0|1,0,2]=4 2068 B8R1.2 NCC1CCCCO1 Amb2723691 [0,0,0,1,0,0|1,0,2]=4 2069 B8R1.2 NCC1CCCNC1 Amb8393087 [0,0,0,1,0,0|2,0,1]=4 2070 B8R1.2 NCC1CCCNC1 Amb8631270 [0,0,0,1,0,0|2,0,1]=4 2071 B8R1.2 NCC1CCCOC1 Amb10603286 [0,0,0,1,0,0|2,0,1]=4 2072 B8R1.2 NCC1CCCOC1 Amb1092537 [0,0,0,1,0,0|2,0,1]=4 2073 B8R1.2 NCC1CCCOC1 Amb22492350 [0,0,0,1,0,0|2,0,1]=4 2074 B8R1.2 NCC1CCCSC1 Amb18831922 [0,0,0,1,0,0|2,0,1]=4 2075 B8R1.2 NCC1CCNCC1 Amb2684474 [0,0,0,1,0,0|2,0,1]=4 2076 B8R1.2 NCC1CCOCC1 Amb1099138 [0,0,0,1,0,0|2,0,1]=4 2077 B8R1.2 NCC1CCOCC1 Amb33534332 [0,0,0,1,0,0|2,0,1]=4 2078 B8R1.2 NCC1CCSCC1 Amb18279249 [0,0,0,1,0,0|2,0,1]=4 2079 B8R1.2 NCC1CCSCC1 Amb6572257 [0,0,0,1,0,0|2,0,1]=4 2080 B8R1.2 NCC1OCCCO1 Amb17226711 [0,0,0,1,0,0|2,0,1]=4 2081 B8R1.2 NC[C@@H]1CCCCO1 Amb22225424 [0,0,0,1,0,0|1,0,2]=4 2082 B8R1.2 NC[C@@H]1CCCCO1 Amb24062887 [0,0,0,1,0,0|1,0,2]=4 2083 B8R1.2 NC[C@@H]1CCCNC1 Amb2699508 [0,0,0,1,0,0|2,0,1]=4 2084 B8R1.2 NC[C@@H]1CCCOC1 Amb25849361 [0,0,0,1,0,0|2,0,1]=4 2085 B8R1.2 NC[C@@H]1CCCOC1 Amb31028901 [0,0,0,1,0,0|2,0,1]=4 2086 B8R1.2 NC[C@H]1CCCCO1 Amb22225114 [0,0,0,1,0,0|1,0,2]=4 2087 B8R1.2 NC[C@H]1CCCCO1 Amb24061931 [0,0,0,1,0,0|1,0,2]=4 2088 B8R1.2 NC[C@H]1CCCNC1 Amb2699507 [0,0,0,1,0,0|2,0,1]=4 2089 B8R1.2 NC[C@H]1CCCNC1 Amb32660927 [0,0,0,1,0,0|2,0,1]=4 2090 B8R1.2 NC[C@H]1CCCOC1 Amb24483141 [0,0,0,1,0,0|2,0,1]=4 2091 B8R1.2 NC[C@H]1CCCOC1 Amb31028900 [0,0,0,1,0,0|2,0,1]=4 2092 B8R1.2 NNC1=CCCCC1 Amb27880817 [0,0,0,1,0,0|3,0,0]=4 2093 B8R1.2 NNC1=CCCCO1 Amb28125675 [0,0,0,1,0,0|2,0,0]=3 2094 B8R1.2 NNC1CC=CCC1 Amb33318607 [0,0,0,1,0,0|2,0,0]=3 2095 B8R1.2 NOC1CC=CCC1 Amb27422798 [0,0,0,1,0,0|2,0,0]=3 2096 B8R1.2 O=CC1=CCCCC1 Amb33545149 [0,0,0,1,0,0|2,0,1]=4 2097 B8R1.2 O=CC1=COCCO1 Amb2786548 [0,0,0,1,0,0|2,0,1]=4 2098 B8R1.2 O=CC1CC=CCC1 Amb3372080 [0,0,0,1,0,0|0,0,2]=3 2099 B8R1.2 O=CC1CC=CSC1 Amb27434846 [0,0,0,1,0,0|1,0,2]=4 2100 B8R1.2 O=CC1CCC=CO1 Amb3939141 [0,0,0,1,0,0|1,0,2]=4 2101 B8R1.2 O=C[C@@H]1CC=CCC1 Amb27966684 [0,0,0,1,0,0|0,0,2]=3 2102 B8R1.2 O=C[C@@H]1CCC=CO1 Amb28284610 [0,0,0,1,0,0|1,0,2]=4 2103 B8R1.2 O=C[C@H]1CC=CCC1 Amb533150 [0,0,0,1,0,0|0,0,2]=3 2104 B8R1.2 OCC1=CCCCC1 Amb24122911 [0,0,0,1,0,0|2,0,0]=3 2105 B8R1.2 OCC1=CCCCO1 Amb20248629 [0,0,0,1,0,0|1,0,0]=2 2106 B8R1.2 OCC1=CCCOC1 Amb24329074 [0,0,0,1,0,0|3,0,0]=4 2107 B8R1.2 OCC1=CCOCC1 Amb27394889 [0,0,0,1,0,0|3,0,0]=4 2108 B8R1.2 OCC1=CCSCC1 Amb28189541 [0,0,0,1,0,0|3,0,0]=4 2109 B8R1.2 OCC1=COCCC1 Amb24426430 [0,0,0,1,0,0|3,0,0]=4 2110 B8R1.2 OCC1=COCCO1 Amb19319714 [0,0,0,1,0,0|2,0,0]=3 2111 B8R1.2 OCC1=CSCCS1 Amb27766515 [0,0,0,1,0,0|2,1,0]=4 2112 B8R1.2 OCC1=NCCCN1 Amb28326118 [0,0,0,1,0,0|3,0,0]=4 2113 B8R1.2 OCC1C=CCCC1 Amb17593156 [0,0,0,1,0,0|0,0,2]=3 2114 B8R1.2 OCC1C=CCCN1 Amb32683449 [0,0,0,1,0,0|1,0,2]=4 2115 B8R1.2 OCC1C=CCCO1 Amb27249902 [0,0,0,1,0,0|1,0,2]=4 2116 B8R1.2 OCC1C=CCOC1 Amb27755980 [0,0,0,1,0,0|1,0,2]=4 2117 B8R1.2 OCC1CC=CCC1 Amb3939071 [0,0,0,1,0,0|0,0,0]=1 2118 B8R1.2 OCC1CC=CCO1 Amb25316226 [0,0,0,1,0,0|1,0,0]=2 2119 B8R1.2 OCC1CCC=CO1 Amb3939374 [0,0,0,1,0,0|1,0,0]=2 2120 B8R1.2 OCC1CCCCC1 Amb3939316 [0,0,0,1,0,0|0,0,2]=3 2121 B8R1.2 OCC1CCCCN1 Amb6768986 [0,0,0,1,0,0|1,0,2]=4 2122 B8R1.2 OCC1CCCCN1 Amb9703110 [0,0,0,1,0,0|1,0,2]=4 2123 B8R1.2 OCC1CCCCO1 Amb9703167 [0,0,0,1,0,0|1,0,2]=4 2124 B8R1.2 OCC1CCCCS1 Amb20669084 [0,0,0,1,0,0|1,0,2]=4 2125 B8R1.2 OCC1CCCNC1 Amb22001796 [0,0,0,1,0,0|1,0,1]=3 2126 B8R1.2 OCC1CCCNC1 Amb2695684 [0,0,0,1,0,0|1,0,1]=3 2127 B8R1.2 OCC1CCCOC1 Amb1093253 [0,0,0,1,0,0|1,0,1]=3 2128 B8R1.2 OCC1CCCSC1 Amb18202835 [0,0,0,1,0,0|1,0,1]=3 2129 B8R1.2 OCC1CCNCC1 Amb20242610 [0,0,0,1,0,0|1,0,1]=3 2130 B8R1.2 OCC1CCNCC1 Amb2695656 [0,0,0,1,0,0|1,0,1]=3 2131 B8R1.2 OCC1CCOCC1 Amb2684132 [0,0,0,1,0,0|1,0,1]=3 2132 B8R1.2 OCC1CCSCC1 Amb7990078 [0,0,0,1,0,0|1,0,1]=3 2133 B8R1.2 OCC1CCSCN1 Amb27216503 [0,0,0,1,0,0|2,0,1]=4 2134 B8R1.2 OCC1CNCCN1 Amb20240990 [0,0,0,1,0,0|2,0,1]=4 2135 B8R1.2 OCC1CNCCN1 Amb8630776 [0,0,0,1,0,0|2,0,1]=4 2136 B8R1.2 OCC1CNCCO1 Amb19957720 [0,0,0,1,0,0|2,0,1]=4 2137 B8R1.2 OCC1CNCCO1 Amb33546015 [0,0,0,1,0,0|2,0,1]=4 2138 B8R1.2 OCC1COCCN1 Amb10067154 [0,0,0,1,0,0|2,0,1]=4 2139 B8R1.2 OCC1COCCN1 Amb19516092 [0,0,0,1,0,0|2,0,1]=4 2140 B8R1.2 OCC1COCCO1 Amb10607696 [0,0,0,1,0,0|2,0,1]=4 2141 B8R1.2 OCC1CSCCN1 Amb4009237 [0,0,0,1,0,0|2,0,1]=4 2142 B8R1.2 OCN1CCCCC1 Amb25949562 [0,0,0,1,0,0|1,0,2]=4 2143 B8R1.2 OCN1CCNCC1 Amb22231021 [0,0,0,1,0,0|2,0,1]=4 2144 B8R1.2 OC[C@@H]1C=CCOC1 Amb27398322 [0,0,0,1,0,0|1,0,2]=4 2145 B8R1.2 OC[C@@H]1CCCCN1 Amb13886314 [0,0,0,1,0,0|1,0,2]=4 2146 B8R1.2 OC[C@@H]1CCCCO1 Amb24182043 [0,0,0,1,0,0|1,0,2]=4 2147 B8R1.2 OC[C@@H]1CCCNC1 Amb10603201 [0,0,0,1,0,0|1,0,1]=3 2148 B8R1.2 OC[C@@H]1CCCNC1 Amb22504548 [0,0,0,1,0,0|1,0,1]=3 2149 B8R1.2 OC[C@@H]1CCCNN1 Amb28138668 [0,0,0,1,0,0|2,0,1]=4 2150 B8R1.2 OC[C@@H]1CCCOC1 Amb27236984 [0,0,0,1,0,0|1,0,1]=3 2151 B8R1.2 OC[C@@H]1CNCCN1 Amb15690750 [0,0,0,1,0,0|2,0,1]=4 2152 B8R1.2 OC[C@@H]1CNCCO1 Amb10067152 [0,0,0,1,0,0|2,0,1]=4 2153 B8R1.2 OC[C@@H]1CNCCO1 Amb17933818 [0,0,0,1,0,0|2,0,1]=4 2154 B8R1.2 OC[C@@H]1COCCN1 Amb2695533 [0,0,0,1,0,0|2,0,1]=4 2155 B8R1.2 OC[C@@H]1COCCN1 Amb8630125 [0,0,0,1,0,0|2,0,1]=4 2156 B8R1.2 OC[C@@H]1COCCO1 Amb22752848 [0,0,0,1,0,0|2,0,1]=4 2157 B8R1.2 OC[C@H]1CC=CCO1 Amb27198230 [0,0,0,1,0,0|1,0,0]=2 2158 B8R1.2 OC[C@H]1CCC=CO1 Amb27771482 [0,0,0,1,0,0|1,0,0]=2 2159 B8R1.2 OC[C@H]1CCCCN1 Amb13886286 [0,0,0,1,0,0|1,0,2]=4 2160 B8R1.2 OC[C@H]1CCCCO1 Amb25873825 [0,0,0,1,0,0|1,0,2]=4 2161 B8R1.2 OC[C@H]1CCCNC1 Amb10603243 [0,0,0,1,0,0|1,0,1]=3 2162 B8R1.2 OC[C@H]1CCCNC1 Amb22388477 [0,0,0,1,0,0|1,0,1]=3 2163 B8R1.2 OC[C@H]1CCCOC1 Amb24413844 [0,0,0,1,0,0|1,0,1]=3 2164 B8R1.2 OC[C@H]1CNCCN1 Amb22288655 [0,0,0,1,0,0|2,0,1]=4 2165 B8R1.2 OC[C@H]1CNCCN1 Amb24444183 [0,0,0,1,0,0|2,0,1]=4 2166 B8R1.2 OC[C@H]1CNCCO1 Amb10067151 [0,0,0,1,0,0|2,0,1]=4 2167 B8R1.2 OC[C@H]1CNCCO1 Amb8630630 [0,0,0,1,0,0|2,0,1]=4 2168 B8R1.2 OC[C@H]1COCCN1 Amb15691976 [0,0,0,1,0,0|2,0,1]=4 2169 B8R1.2 OC[C@H]1COCCN1 Amb2695534 [0,0,0,1,0,0|2,0,1]=4 2170 B8R1.2 OC[C@H]1COCCO1 Amb25724377 [0,0,0,1,0,0|2,0,1]=4 2171 B8R1.2 ONC1CCCNC1 Amb28048987 [0,0,0,1,0,0|2,0,1]=4 2172 B8R1.2 O[NH2+]C1CCCCC1 Amb9826874 [0,0,0,1,0,0|1,0,2]=4 2173 B8R1.2 SCC1=CCCOC1 Amb32788343 [0,0,0,1,0,0|3,0,0]=4 2174 B8R1.2 SCC1=COCCC1 Amb33319974 [0,0,0,1,0,0|3,0,0]=4 2175 B8R1.2 SCC1CC=CCC1 Amb29866611 [0,0,0,1,0,0|0,1,0]=2 2176 B8R1.2 SCC1CCC=CO1 Amb32788204 [0,0,0,1,0,0|1,1,0]=3 2177 B8R1.2 SCC1CCCCC1 Amb6255606 [0,0,0,1,0,0|0,1,2]=4 2178 B8R1.2 SCC1CCCCO1 Amb23585661 [0,0,0,1,0,0|1,0,2]=4 2179 B8R1.2 SCC1CCCNC1 Amb17503130 [0,0,0,1,0,0|1,1,1]=4 2180 B8R1.2 SCC1CCCOC1 Amb26590340 [0,0,0,1,0,0|1,1,1]=4 2181 B8R1.2 SCC1CCCSC1 Amb32788278 [0,0,0,1,0,0|1,1,1]=4 2182 B8R1.2 SCC1CCNCC1 Amb17503031 [0,0,0,1,0,0|1,1,1]=4 2183 B8R1.2 SCC1CCOCC1 Amb25708148 [0,0,0,1,0,0|1,1,1]=4 2184 B8R1.2 [C-]#[N+]C1=CCCCC1 Amb10603087 [0,0,0,1,0,0|2,0,1]=4 2185 B8R1.2 [C-]#[N+]C1CC=CCC1 Amb33314430 [0,0,0,1,0,0|2,0,0]=3 2186 B8R1.2 [CH2-]CC1CCCCC1 Amb24117227 [0,0,0,1,0,0|1,0,2]=4 2187 B8R1.5 CC1=CCCCC1Br Amb27856502 [0,0,0,1,0,0|1,0,2]=4 2188 B8R1.5 CC1=CCCCC1C Amb22489910 [0,0,0,1,0,0|1,0,2]=4 2189 B8R1.5 CC1=CCCCC1Cl Amb28207840 [0,0,0,1,0,0|1,0,2]=4 2190 B8R1.5 CC1=CCCCC1O Amb22365276 [0,0,0,1,0,0|0,0,2]=3 2191 B8R1.5 CC1=CCOCC1O Amb28411303 [0,0,0,1,0,0|1,0,2]=4 2192 B8R1.5 CC1C=CCC=[N+]1[O-] Amb27470795 [0,0,0,1,0,0|1,0,2]=4 2193 B8R1.5 CC1C=CCCC1Cl Amb27816488 [0,0,0,1,0,0|1,0,0]=2 2194 B8R1.5 CC1C=CCCC1N Amb27623320 [0,0,0,1,0,0|1,0,0]=2 2195 B8R1.5 CC1CC=CCC1C Amb22364352 [0,0,0,1,0,0|1,0,2]=4 2196 B8R1.5 CC1CC=CCC1N Amb25975568 [0,0,0,1,0,0|1,0,2]=4 2197 B8R1.5 CC1CCC=CC1=O Amb17593138 [0,0,0,1,0,0|2,0,1]=4 2198 B8R1.5 CC1CCC=CC1N Amb18641660 [0,0,0,1,0,0|2,0,0]=3 2199 B8R1.5 CC1CCCCC1Br Amb8835443 [0,0,0,1,0,0|1,0,2]=4 2200 B8R1.5 CC1CCCCC1C Amb8513143 [0,0,0,1,0,0|1,0,2]=4 2201 B8R1.5 CC1CCCCC1Cl Amb9205060 [0,0,0,1,0,0|1,0,2]=4 2202 B8R1.5 CC1CCCCC1N Amb9702773 [0,0,0,1,0,0|1,0,2]=4 2203 B8R1.5 CC1CCCCC1O Amb3940289 [0,0,0,1,0,0|0,0,2]=3 2204 B8R1.5 CC1CCCCC1S Amb9208050 [0,0,0,1,0,0|0,1,2]=4 2205 B8R1.5 CC1CCCCN1O Amb28121416 [0,0,0,1,0,0|1,0,2]=4 2206 B8R1.5 CC1CCCNC1C Amb1089738 [0,0,0,1,0,0|2,0,1]=4 2207 B8R1.5 CC1CCCNC1C Amb19338160 [0,0,0,1,0,0|2,0,1]=4 2208 B8R1.5 CC1CCCOC1O Amb28207170 [0,0,0,1,0,0|1,0,2]=4 2209 B8R1.5 CC1CCNCC1C Amb22059495 [0,0,0,1,0,0|2,0,1]=4 2210 B8R1.5 CC1CCNCC1O Amb22406220 [0,0,0,1,0,0|1,0,2]=4 2211 B8R1.5 CC1CCNCC1O Amb23440259 [0,0,0,1,0,0|1,0,2]=4 2212 B8R1.5 CC1CNCCC1Br Amb25125494 [0,0,0,1,0,0|2,0,1]=4 2213 B8R1.5 CC1CNCCC1F Amb26572956 [0,0,0,1,0,0|2,0,1]=4 2214 B8R1.5 CC1CNCCC1N Amb23440690 [0,0,0,1,0,0|2,0,1]=4 2215 B8R1.5 CC1CNCCC1O Amb33544532 [0,0,0,1,0,0|1,0,1]=3 2216 B8R1.5 CC1CNCCC1O Amb4362742 [0,0,0,1,0,0|1,0,1]=3 2217 B8R1.5 CC1CNCCC1S Amb26641892 [0,0,0,1,0,0|1,1,1]=4 2218 B8R1.5 CC1COCCC1Br Amb27242904 [0,0,0,1,0,0|2,0,1]=4 2219 B8R1.5 CC1COCCC1N Amb18833016 [0,0,0,1,0,0|2,0,1]=4 2220 B8R1.5 CC1COCCC1N Amb28934837 [0,0,0,1,0,0|2,0,1]=4 2221 B8R1.5 CC1COCCC1O Amb22299437 [0,0,0,1,0,0|1,0,1]=3 2222 B8R1.5 CC1COCCC1S Amb22299438 [0,0,0,1,0,0|1,1,1]=4 2223 B8R1.5 CC1CSCCC1N Amb18202892 [0,0,0,1,0,0|2,0,1]=4 2224 B8R1.5 CC1CSCCC1O Amb26370414 [0,0,0,1,0,0|1,0,1]=3 2225 B8R1.5 CC1NCCCC1N Amb24715672 [0,0,0,1,0,0|2,0,1]=4 2226 B8R1.5 CC1NCCCC1O Amb27839609 [0,0,0,1,0,0|1,0,1]=3 2227 B8R1.5 CC1NCCCC1O Amb28934842 [0,0,0,1,0,0|1,0,1]=3 2228 B8R1.5 CC1NCCCC1S Amb32788772 [0,0,0,1,0,0|1,1,1]=4 2229 B8R1.5 CC1NCCOC1O Amb25031508 [0,0,0,1,0,0|2,0,1]=4 2230 B8R1.5 CC1OCC=CC1O Amb27978022 [0,0,0,1,0,0|3,0,0]=4 2231 B8R1.5 CC1OCCCC1Br Amb22500038 [0,0,0,1,0,0|2,0,1]=4 2232 B8R1.5 CC1SCCCC1Br Amb24483260 [0,0,0,1,0,0|2,0,1]=4 2233 B8R1.5 CC1SCCCC1N Amb24699153 [0,0,0,1,0,0|2,0,1]=4 2234 B8R1.5 CC1SCCCC1O Amb26865931 [0,0,0,1,0,0|1,0,1]=3 2235 B8R1.5 CC1SCCCC1S Amb24658420 [0,0,0,1,0,0|1,1,1]=4 2236 B8R1.5 C[C@@H]1C=CCC[C@@H]1Cl Amb27235850 [0,0,0,1,0,0|1,0,0]=2 2237 B8R1.5 C[C@@H]1C=CCC[C@@H]1O Amb27208180 [0,0,0,1,0,0|0,0,0]=1 2238 B8R1.5 C[C@@H]1C=CCC[C@H]1O Amb27442958 [0,0,0,1,0,0|0,0,0]=1 2239 B8R1.5 C[C@@H]1CC=CC[C@@H]1N Amb27799251 [0,0,0,1,0,0|1,0,2]=4 2240 B8R1.5 C[C@@H]1CC=CC[C@H]1C Amb28061692 [0,0,0,1,0,0|1,0,2]=4 2241 B8R1.5 C[C@@H]1CC=CC[C@H]1N Amb24568280 [0,0,0,1,0,0|1,0,2]=4 2242 B8R1.5 C[C@@H]1CC=CC[C@H]1N Amb32721599 [0,0,0,1,0,0|1,0,2]=4 2243 B8R1.5 C[C@@H]1CC=CC[C@H]1O Amb28318165 [0,0,0,1,0,0|0,0,2]=3 2244 B8R1.5 C[C@@H]1CCC=CC1=O Amb28316223 [0,0,0,1,0,0|2,0,1]=4 2245 B8R1.5 C[C@@H]1CCC=CC1O Amb28435732 [0,0,0,1,0,0|2,0,0]=3 2246 B8R1.5 C[C@@H]1CCC=C[C@@H]1Cl Amb28134614 [0,0,0,1,0,0|2,0,0]=3 2247 B8R1.5 C[C@@H]1CCC=C[C@@H]1O Amb27652339 [0,0,0,1,0,0|2,0,0]=3 2248 B8R1.5 C[C@@H]1CCC=C[C@H]1N Amb27487557 [0,0,0,1,0,0|2,0,0]=3 2249 B8R1.5 C[C@@H]1CCC=C[C@H]1O Amb28053681 [0,0,0,1,0,0|2,0,0]=3 2250 B8R1.5 C[C@@H]1CCCC[C@@H]1N Amb22746982 [0,0,0,1,0,0|1,0,2]=4 2251 B8R1.5 C[C@@H]1CCCC[C@@H]1N Amb22899193 [0,0,0,1,0,0|1,0,2]=4 2252 B8R1.5 C[C@@H]1CCCC[C@@H]1O Amb22801473 [0,0,0,1,0,0|0,0,2]=3 2253 B8R1.5 C[C@@H]1CCCC[C@H]1Br Amb27250883 [0,0,0,1,0,0|1,0,2]=4 2254 B8R1.5 C[C@@H]1CCCC[C@H]1C Amb22801359 [0,0,0,1,0,0|1,0,2]=4 2255 B8R1.5 C[C@@H]1CCCC[C@H]1N Amb8393225 [0,0,0,1,0,0|1,0,2]=4 2256 B8R1.5 C[C@@H]1CCCC[C@H]1O Amb2780856 [0,0,0,1,0,0|0,0,2]=3 2257 B8R1.5 C[C@@H]1CCCN[C@@H]1C Amb34912851 [0,0,0,1,0,0|2,0,1]=4 2258 B8R1.5 C[C@@H]1CCCO[C@@H]1O Amb27452063 [0,0,0,1,0,0|1,0,2]=4 2259 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb22886317 [0,0,0,1,0,0|1,0,2]=4 2260 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb24694415 [0,0,0,1,0,0|1,0,2]=4 2261 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb22886316 [0,0,0,1,0,0|1,0,2]=4 2262 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb24553941 [0,0,0,1,0,0|1,0,2]=4 2263 B8R1.5 C[C@@H]1CCOC[C@H]1O Amb28345042 [0,0,0,1,0,0|1,0,2]=4 2264 B8R1.5 C[C@@H]1CNCC[C@@H]1O Amb22232040 [0,0,0,1,0,0|1,0,1]=3 2265 B8R1.5 C[C@@H]1CNCC[C@@H]1O Amb31291752 [0,0,0,1,0,0|1,0,1]=3 2266 B8R1.5 C[C@@H]1CNCC[C@H]1O Amb22270263 [0,0,0,1,0,0|1,0,1]=3 2267 B8R1.5 C[C@@H]1CNCC[C@H]1O Amb22757834 [0,0,0,1,0,0|1,0,1]=3 2268 B8R1.5 C[C@@H]1COCC[C@@H]1N Amb22745852 [0,0,0,1,0,0|2,0,1]=4 2269 B8R1.5 C[C@@H]1COCC[C@H]1N Amb23440138 [0,0,0,1,0,0|2,0,1]=4 2270 B8R1.5 C[C@@H]1COCC[C@H]1N Amb25929881 [0,0,0,1,0,0|2,0,1]=4 2271 B8R1.5 C[C@@H]1NCCC[C@@H]1O Amb26431095 [0,0,0,1,0,0|1,0,1]=3 2272 B8R1.5 C[C@@H]1NCCC[C@@H]1O Amb32680789 [0,0,0,1,0,0|1,0,1]=3 2273 B8R1.5 C[C@@H]1OCCC[C@H]1Br Amb27444138 [0,0,0,1,0,0|2,0,1]=4 2274 B8R1.5 C[C@@H]1OCCC[C@H]1Cl Amb27453022 [0,0,0,1,0,0|2,0,1]=4 2275 B8R1.5 C[C@H]1CCC=CC1=O Amb28316171 [0,0,0,1,0,0|2,0,1]=4 2276 B8R1.5 C[C@H]1CCC=C[C@@H]1O Amb27443159 [0,0,0,1,0,0|2,0,0]=3 2277 B8R1.5 C[C@H]1CCCC[C@@H]1C Amb6298314 [0,0,0,1,0,0|1,0,2]=4 2278 B8R1.5 C[C@H]1CCCC[C@@H]1Cl Amb27198993 [0,0,0,1,0,0|1,0,2]=4 2279 B8R1.5 C[C@H]1CCCC[C@@H]1O Amb10842239 [0,0,0,1,0,0|0,0,2]=3 2280 B8R1.5 C[C@H]1CCCC[C@H]1Br Amb27656872 [0,0,0,1,0,0|1,0,2]=4 2281 B8R1.5 C[C@H]1CCCC[C@H]1C Amb6298877 [0,0,0,1,0,0|1,0,2]=4 2282 B8R1.5 C[C@H]1CCCC[C@H]1N Amb25911858 [0,0,0,1,0,0|1,0,2]=4 2283 B8R1.5 C[C@H]1CCCC[C@H]1N Amb33620881 [0,0,0,1,0,0|1,0,2]=4 2284 B8R1.5 C[C@H]1CCCO[C@@H]1O Amb27452053 [0,0,0,1,0,0|1,0,2]=4 2285 B8R1.5 C[C@H]1CCNC[C@@H]1O Amb26892110 [0,0,0,1,0,0|1,0,2]=4 2286 B8R1.5 C[C@H]1CCNC[C@@H]1O Amb33726126 [0,0,0,1,0,0|1,0,2]=4 2287 B8R1.5 C[C@H]1CCNC[C@H]1O Amb25339261 [0,0,0,1,0,0|1,0,2]=4 2288 B8R1.5 C[C@H]1CCNC[C@H]1O Amb32409390 [0,0,0,1,0,0|1,0,2]=4 2289 B8R1.5 C[C@H]1CCOC[C@H]1O Amb27484771 [0,0,0,1,0,0|1,0,2]=4 2290 B8R1.5 C[C@H]1CNCC[C@@H]1O Amb24059398 [0,0,0,1,0,0|1,0,1]=3 2291 B8R1.5 C[C@H]1COCC[C@@H]1N Amb27440842 [0,0,0,1,0,0|2,0,1]=4 2292 B8R1.5 C[C@H]1COCC[C@@H]1N Amb33726124 [0,0,0,1,0,0|2,0,1]=4 2293 B8R1.5 C[C@H]1COCC[C@H]1N Amb22736636 [0,0,0,1,0,0|2,0,1]=4 2294 B8R1.5 C[C@H]1COCC[C@H]1N Amb32409393 [0,0,0,1,0,0|2,0,1]=4 2295 B8R1.5 C[C@H]1CSCC[C@@H]1O Amb28286731 [0,0,0,1,0,0|1,0,1]=3 2296 B8R1.5 ClC1C=CCCC1Cl Amb24707559 [0,0,0,1,0,0|2,0,0]=3 2297 B8R1.5 NC1C=CCCC1N Amb26045190 [0,0,0,1,0,0|2,0,0]=3 2298 B8R1.5 NC1CCCCC1O Amb22228578 [0,0,0,1,0,0|1,0,2]=4 2299 B8R1.5 NC1CCCCC1O Amb31302362 [0,0,0,1,0,0|1,0,2]=4 2300 B8R1.5 NC1CCCCC1O Amb3428551 [0,0,0,1,0,0|1,0,2]=4 2301 B8R1.5 NC1CNCCC1O Amb26874176 [0,0,0,1,0,0|2,0,1]=4 2302 B8R1.5 NC1COCCC1O Amb18198755 [0,0,0,1,0,0|2,0,1]=4 2303 B8R1.5 NC1COCCC1O Amb32753157 [0,0,0,1,0,0|2,0,1]=4 2304 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993806 [0,0,0,1,0,0|1,0,2]=4 2305 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993917 [0,0,0,1,0,0|1,0,2]=4 2306 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993805 [0,0,0,1,0,0|1,0,2]=4 2307 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993916 [0,0,0,1,0,0|1,0,2]=4 2308 B8R1.5 N[C@@H]1CNCC[C@H]1O Amb32674491 [0,0,0,1,0,0|2,0,1]=4 2309 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb23385320 [0,0,0,1,0,0|2,0,1]=4 2310 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb26888092 [0,0,0,1,0,0|2,0,1]=4 2311 B8R1.5 N[C@@H]1COCC[C@H]1O Amb22748653 [0,0,0,1,0,0|2,0,1]=4 2312 B8R1.5 N[C@@H]1COCC[C@H]1O Amb23385302 [0,0,0,1,0,0|2,0,1]=4 2313 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb19515805 [0,0,0,1,0,0|1,0,2]=4 2314 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb2612694 [0,0,0,1,0,0|1,0,2]=4 2315 B8R1.5 N[C@H]1CCCC[C@H]1O Amb19516016 [0,0,0,1,0,0|1,0,2]=4 2316 B8R1.5 N[C@H]1CCCC[C@H]1O Amb20622436 [0,0,0,1,0,0|1,0,2]=4 2317 B8R1.5 N[C@H]1COCC[C@@H]1O Amb25231772 [0,0,0,1,0,0|2,0,1]=4 2318 B8R1.5 N[C@H]1COCC[C@H]1O Amb24617518 [0,0,0,1,0,0|2,0,1]=4 2319 B8R1.5 N[C@H]1COCC[C@H]1O Amb33872533 [0,0,0,1,0,0|2,0,1]=4 2320 B8R1.5 O=C1C=CCCC1Br Amb27477843 [0,0,0,1,0,0|2,0,1]=4 2321 B8R1.5 O=C1C=CCCC1O Amb27165534 [0,0,0,1,0,0|1,0,1]=3 2322 B8R1.5 OC1C=CSCC1O Amb27399718 [0,0,0,1,0,0|2,0,0]=3 2323 B8R1.5 OC1CCCC=C1Br Amb17594500 [0,0,0,1,0,0|1,0,2]=4 2324 B8R1.5 OC1CCCC=C1Cl Amb27970979 [0,0,0,1,0,0|1,0,2]=4 2325 B8R1.5 OC1CCCCC1Br Amb17594580 [0,0,0,1,0,0|1,0,2]=4 2326 B8R1.5 OC1CCCCC1F Amb28141588 [0,0,0,1,0,0|1,0,2]=4 2327 B8R1.5 OC1CCCCC1I Amb10601565 [0,0,0,1,0,0|1,0,2]=4 2328 B8R1.5 OC1CCCCC1O Amb534699 [0,0,0,1,0,0|1,0,2]=4 2329 B8R1.5 OC1CCCCC1S Amb28061858 [0,0,0,1,0,0|1,0,2]=4 2330 B8R1.5 OC1CCCOC1O Amb27594250 [0,0,0,1,0,0|2,0,1]=4 2331 B8R1.5 OC1CCNCC1F Amb23401846 [0,0,0,1,0,0|2,0,1]=4 2332 B8R1.5 OC1CCNCC1F Amb23401853 [0,0,0,1,0,0|2,0,1]=4 2333 B8R1.5 OC1CCNCC1O Amb22493773 [0,0,0,1,0,0|2,0,1]=4 2334 B8R1.5 OC1CCNCC1O Amb33992215 [0,0,0,1,0,0|2,0,1]=4 2335 B8R1.5 OC1CCOCC1F Amb28079111 [0,0,0,1,0,0|2,0,1]=4 2336 B8R1.5 OC1CCSCC1O Amb27211025 [0,0,0,1,0,0|2,0,1]=4 2337 B8R1.5 O[C@@H]1C=CCC[C@H]1Br Amb28245256 [0,0,0,1,0,0|2,0,0]=3 2338 B8R1.5 O[C@@H]1C=NNC[C@H]1O Amb27213924 [0,0,0,1,0,0|3,0,0]=4 2339 B8R1.5 O[C@@H]1CC=CC[C@H]1Br Amb27666976 [0,0,0,1,0,0|1,0,2]=4 2340 B8R1.5 O[C@@H]1CC=CC[C@H]1Cl Amb27782069 [0,0,0,1,0,0|1,0,2]=4 2341 B8R1.5 O[C@@H]1CC=CC[C@H]1O Amb28318474 [0,0,0,1,0,0|1,0,2]=4 2342 B8R1.5 O[C@@H]1CCCC=C1Br Amb25687871 [0,0,0,1,0,0|1,0,2]=4 2343 B8R1.5 O[C@@H]1CCCC=C1Cl Amb28067316 [0,0,0,1,0,0|1,0,2]=4 2344 B8R1.5 O[C@@H]1CCCC[C@@H]1Cl Amb8394050 [0,0,0,1,0,0|1,0,2]=4 2345 B8R1.5 O[C@@H]1CCCC[C@H]1Br Amb17940195 [0,0,0,1,0,0|1,0,2]=4 2346 B8R1.5 O[C@@H]1CCCC[C@H]1Cl Amb17844352 [0,0,0,1,0,0|1,0,2]=4 2347 B8R1.5 O[C@@H]1CCCC[C@H]1F Amb10606383 [0,0,0,1,0,0|1,0,2]=4 2348 B8R1.5 O[C@@H]1CCCC[C@H]1O Amb6754065 [0,0,0,1,0,0|1,0,2]=4 2349 B8R1.5 O[C@@H]1CCCC[C@H]1S Amb27205716 [0,0,0,1,0,0|1,0,2]=4 2350 B8R1.5 O[C@@H]1CCCO[C@H]1O Amb27659639 [0,0,0,1,0,0|2,0,1]=4 2351 B8R1.5 O[C@@H]1CCNC[C@@H]1F Amb22886301 [0,0,0,1,0,0|2,0,1]=4 2352 B8R1.5 O[C@@H]1CCNC[C@@H]1F Amb23439240 [0,0,0,1,0,0|2,0,1]=4 2353 B8R1.5 O[C@@H]1CCNC[C@H]1F Amb22886315 [0,0,0,1,0,0|2,0,1]=4 2354 B8R1.5 O[C@@H]1CCNC[C@H]1F Amb23439239 [0,0,0,1,0,0|2,0,1]=4 2355 B8R1.5 O[C@@H]1CCNC[C@H]1O Amb22746225 [0,0,0,1,0,0|2,0,1]=4 2356 B8R1.5 O[C@@H]1CCNC[C@H]1O Amb22748912 [0,0,0,1,0,0|2,0,1]=4 2357 B8R1.5 O[C@@H]1CCOC[C@@H]1F Amb26443063 [0,0,0,1,0,0|2,0,1]=4 2358 B8R1.5 O[C@@H]1CCOC[C@H]1F Amb25054496 [0,0,0,1,0,0|2,0,1]=4 2359 B8R1.5 O[C@H]1CC=CC[C@@H]1S Amb27219069 [0,0,0,1,0,0|1,0,2]=4 2360 B8R1.5 O[C@H]1CCCC=C1Br Amb24505024 [0,0,0,1,0,0|1,0,2]=4 2361 B8R1.5 O[C@H]1CCCC[C@@H]1Cl Amb27420202 [0,0,0,1,0,0|1,0,2]=4 2362 B8R1.5 O[C@H]1CCCC[C@@H]1F Amb26565801 [0,0,0,1,0,0|1,0,2]=4 2363 B8R1.5 O[C@H]1CCCC[C@@H]1O Amb2778553 [0,0,0,1,0,0|1,0,2]=4 2364 B8R1.5 O[C@H]1CCCC[C@H]1Br Amb8394049 [0,0,0,1,0,0|1,0,2]=4 2365 B8R1.5 O[C@H]1CCCC[C@H]1Cl Amb27629800 [0,0,0,1,0,0|1,0,2]=4 2366 B8R1.5 O[C@H]1CCCC[C@H]1O Amb2720739 [0,0,0,1,0,0|1,0,2]=4 2367 B8R1.5 O[C@H]1CCCC[C@H]1S Amb28205526 [0,0,0,1,0,0|1,0,2]=4 2368 B8R1.5 O[C@H]1CCNC[C@@H]1F Amb27850581 [0,0,0,1,0,0|2,0,1]=4 2369 B8R1.5 O[C@H]1CCNC[C@@H]1F Amb33801195 [0,0,0,1,0,0|2,0,1]=4 2370 B8R1.5 O[C@H]1CCNC[C@@H]1O Amb33805289 [0,0,0,1,0,0|2,0,1]=4 2371 B8R1.5 O[C@H]1CCNC[C@@H]1O Amb8630297 [0,0,0,1,0,0|2,0,1]=4 2372 B8R1.5 O[C@H]1CCNC[C@H]1F Amb32643985 [0,0,0,1,0,0|2,0,1]=4 2373 B8R1.5 O[C@H]1CCNC[C@H]1O Amb15701275 [0,0,0,1,0,0|2,0,1]=4 2374 B8R1.5 O[C@H]1CCNC[C@H]1O Amb22754314 [0,0,0,1,0,0|2,0,1]=4 2375 B8R1.5 O[C@H]1CCOC[C@@H]1F Amb34160539 [0,0,0,1,0,0|2,0,1]=4 2376 B8R1.5 O[C@H]1CCOC[C@H]1F Amb26389608 [0,0,0,1,0,0|2,0,1]=4 2377 B8R1.5 O[C@H]1CNCC[C@H]1O Amb22406028 [0,0,0,1,0,0|2,0,1]=4 2378 B8R1.5 O[C@H]1CNCC[C@H]1O Amb8630296 [0,0,0,1,0,0|2,0,1]=4 2379 B8R1.5 [NH3+][C@@H]1CCCC[C@@H]1O Amb24112952 [0,0,0,1,0,0|1,0,2]=4 2380 B8R1.8 BrCC=C1CCCC1 Amb28458294 [0,0,0,1,0,0|2,0,0]=3 2381 B8R1.8 BrCCC1CCCC1 Amb18178329 [0,0,0,1,0,0|1,0,2]=4 2382 B8R1.8 BrCCC1CCCN1 Amb26066464 [0,0,0,1,0,0|2,0,1]=4 2383 B8R1.8 BrCCC1CCCN1 Amb32663240 [0,0,0,1,0,0|2,0,1]=4 2384 B8R1.8 BrCCC1CCCO1 Amb33547829 [0,0,0,1,0,0|1,0,2]=4 2385 B8R1.8 BrCCC1CCCS1 Amb33433092 [0,0,0,1,0,0|2,0,1]=4 2386 B8R1.8 BrCCC1CCNC1 Amb22274601 [0,0,0,1,0,0|2,0,1]=4 2387 B8R1.8 BrCCC1CCOC1 Amb15701388 [0,0,0,1,0,0|2,0,1]=4 2388 B8R1.8 BrCCC1CCSC1 Amb32688122 [0,0,0,1,0,0|2,0,1]=4 2389 B8R1.8 C=CCC1C=CCC1 Amb27467489 [0,0,0,1,0,0|1,0,1]=3 2390 B8R1.8 C=CCC1C=CCN1 Amb27838974 [0,0,0,1,0,0|2,0,1]=4 2391 B8R1.8 CCCC1=NCCO1 Amb4034543 [0,0,0,1,0,0|1,0,1]=3 2392 B8R1.8 CCCC1=NCCS1 Amb9805517 [0,0,0,1,0,0|1,1,1]=4 2393 B8R1.8 CCCC1C=CCC1 Amb4019564 [0,0,0,1,0,0|1,0,0]=2 2394 B8R1.8 CCCC1C=CCN1 Amb10608151 [0,0,0,1,0,0|2,0,0]=3 2395 B8R1.8 CCCC1CC=CC1 Amb35634520 [0,0,0,1,0,0|1,0,2]=4 2396 B8R1.8 CCCC1CCCC1 Amb4019556 [0,0,0,1,0,0|1,0,2]=4 2397 B8R1.8 CCCC1CCCN1 Amb22587167 [0,0,0,1,0,0|1,0,2]=4 2398 B8R1.8 CCCC1CCCN1 Amb9714691 [0,0,0,1,0,0|1,0,2]=4 2399 B8R1.8 CCCC1CCNC1 Amb10607827 [0,0,0,1,0,0|2,0,1]=4 2400 B8R1.8 CCCC1CCNC1 Amb32414607 [0,0,0,1,0,0|2,0,1]=4 2401 B8R1.8 CCCC1CNC=N1 Amb30021062 [0,0,0,1,0,0|3,0,0]=4 2402 B8R1.8 CCCC1CNCO1 Amb27391630 [0,0,0,1,0,0|1,0,2]=4 2403 B8R1.8 CCCC1OCCS1 Amb9786141 [0,0,0,1,0,0|1,0,2]=4 2404 B8R1.8 CCCN1CCCO1 Amb27589395 [0,0,0,1,0,0|1,0,1]=3 2405 B8R1.8 CCNB1CCCC1 Amb28072082 [0,0,0,1,0,0|3,0,0]=4 2406 B8R1.8 CCNC1=NCCN1 Amb27862049 [0,0,0,1,0,0|3,0,0]=4 2407 B8R1.8 CCNC1CCCC1 Amb6250623 [0,0,0,1,0,0|2,0,1]=4 2408 B8R1.8 CCNC1CCCC1 Amb8503448 [0,0,0,1,0,0|2,0,1]=4 2409 B8R1.8 CCNC1CCCN1 Amb28133387 [0,0,0,1,0,0|2,0,1]=4 2410 B8R1.8 CCOC1=CCCC1 Amb22490985 [0,0,0,1,0,0|2,0,0]=3 2411 B8R1.8 CCOC1=NCCC1 Amb19943923 [0,0,0,1,0,0|2,0,0]=3 2412 B8R1.8 CCOC1CCCO1 Amb22228805 [0,0,0,1,0,0|1,0,1]=3 2413 B8R1.8 CCOC1OCCO1 Amb10569618 [0,0,0,1,0,0|2,0,1]=4 2414 B8R1.8 CCOC1OCCS1 Amb10569619 [0,0,0,1,0,0|2,0,1]=4 2415 B8R1.8 CCSC1=NCCN1 Amb9175088 [0,0,0,1,0,0|3,0,0]=4 2416 B8R1.8 CCSC1CCCC1 Amb27764393 [0,0,0,1,0,0|2,0,1]=4 2417 B8R1.8 CC\C=C1/CCNC1 Amb33136384 [0,0,0,1,0,0|2,0,0]=3 2418 B8R1.8 CNCC1=CCCC1 Amb28143077 [0,0,0,1,0,0|2,0,1]=4 2419 B8R1.8 CNCC1=CCCO1 Amb28048914 [0,0,0,1,0,0|1,0,2]=4 2420 B8R1.8 CNCC1CCCO1 Amb33483486 [0,0,0,1,0,0|1,0,2]=4 2421 B8R1.8 CNCC1CCCO1 Amb9714028 [0,0,0,1,0,0|1,0,2]=4 2422 B8R1.8 CNC[C@@H]1CCCO1 Amb27153906 [0,0,0,1,0,0|1,0,2]=4 2423 B8R1.8 CNC[C@H]1CCCO1 Amb24526936 [0,0,0,1,0,0|1,0,2]=4 2424 B8R1.8 CONC1=NCCC1 Amb28341138 [0,0,0,1,0,0|3,0,0]=4 2425 B8R1.8 CSCC1CCCO1 Amb26894759 [0,0,0,1,0,0|1,0,2]=4 2426 B8R1.8 C\C=C\C1=CCCC1 Amb27460268 [0,0,0,1,0,0|1,0,1]=3 2427 B8R1.8 C\C=C\C1OCCO1 Amb17334061 [0,0,0,1,0,0|1,0,2]=4 2428 B8R1.8 C\C=C\N1CCCC1 Amb26887224 [0,0,0,1,0,0|2,0,1]=4 2429 B8R1.8 ClCCC1=NCCO1 Amb28399375 [0,0,0,1,0,0|2,0,1]=4 2430 B8R1.8 ClCCC1CC=CC1 Amb27468735 [0,0,0,1,0,0|1,0,2]=4 2431 B8R1.8 ClCCC1CCCC1 Amb27452931 [0,0,0,1,0,0|1,0,2]=4 2432 B8R1.8 ClCCC1CCCO1 Amb25888267 [0,0,0,1,0,0|1,0,2]=4 2433 B8R1.8 ClCCC1CCOC1 Amb24532020 [0,0,0,1,0,0|2,0,1]=4 2434 B8R1.8 ClCCC1CCSC1 Amb32688121 [0,0,0,1,0,0|2,0,1]=4 2435 B8R1.8 ClCC[C@@H]1CCCN1 Amb27874071 [0,0,0,1,0,0|2,0,1]=4 2436 B8R1.8 ClCC[C@H]1CCNC1 Amb27788406 [0,0,0,1,0,0|2,0,1]=4 2437 B8R1.8 ClC\C=C1\CCSC1 Amb28128310 [0,0,0,1,0,0|3,0,0]=4 2438 B8R1.8 FCCC1CCCN1 Amb27798978 [0,0,0,1,0,0|2,0,1]=4 2439 B8R1.8 FCCC1CCNC1 Amb21959205 [0,0,0,1,0,0|2,0,1]=4 2440 B8R1.8 ICCC1CCCC1 Amb24383289 [0,0,0,1,0,0|1,0,2]=4 2441 B8R1.8 ICCC1CCCO1 Amb27860272 [0,0,0,1,0,0|1,0,2]=4 2442 B8R1.8 ICCC1CCNC1 Amb22296926 [0,0,0,1,0,0|2,0,1]=4 2443 B8R1.8 N#CC=C1CCCC1 Amb17672923 [0,0,0,1,0,0|2,0,1]=4 2444 B8R1.8 N#CC=C1OCCO1 Amb17593143 [0,0,0,1,0,0|2,0,1]=4 2445 B8R1.8 N#CNC1C=CCC1 Amb35713398 [0,0,0,1,0,0|2,0,1]=4 2446 B8R1.8 N#C\C=C1/CCCN1 Amb18123359 [0,0,0,1,0,0|2,0,1]=4 2447 B8R1.8 N#C\C=C1\CCCO1 Amb28316221 [0,0,0,1,0,0|1,0,1]=3 2448 B8R1.8 NCCC1=CC=CC1 Amb27975816 [0,0,0,1,0,0|1,0,2]=4 2449 B8R1.8 NCCC1=CCCC1 Amb18641665 [0,0,0,1,0,0|1,0,2]=4 2450 B8R1.8 NCCC1=CCCC1 Amb32681165 [0,0,0,1,0,0|1,0,2]=4 2451 B8R1.8 NCCC1=NCCO1 Amb27665941 [0,0,0,1,0,0|2,0,1]=4 2452 B8R1.8 NCCC1C=CC=C1 Amb27596137 [0,0,0,1,0,0|1,0,2]=4 2453 B8R1.8 NCCC1CC=CC1 Amb28068699 [0,0,0,1,0,0|1,0,2]=4 2454 B8R1.8 NCCC1CC=CC1 Amb30585106 [0,0,0,1,0,0|1,0,2]=4 2455 B8R1.8 NCCC1CCCC1 Amb1089736 [0,0,0,1,0,0|1,0,2]=4 2456 B8R1.8 NCCC1CCCC1 Amb2099819 [0,0,0,1,0,0|1,0,2]=4 2457 B8R1.8 NCCC1CCCC1 Amb7969704 [0,0,0,1,0,0|1,0,2]=4 2458 B8R1.8 NCCC1CCCN1 Amb18954128 [0,0,0,1,0,0|2,0,1]=4 2459 B8R1.8 NCCC1CCCN1 Amb32651929 [0,0,0,1,0,0|2,0,1]=4 2460 B8R1.8 NCCC1CCCO1 Amb13952618 [0,0,0,1,0,0|1,0,2]=4 2461 B8R1.8 NCCC1CCCO1 Amb9708331 [0,0,0,1,0,0|1,0,2]=4 2462 B8R1.8 NCCC1CCCS1 Amb32656287 [0,0,0,1,0,0|2,0,1]=4 2463 B8R1.8 NCCC1CCCS1 Amb32656288 [0,0,0,1,0,0|2,0,1]=4 2464 B8R1.8 NCCC1CCNC1 Amb18833027 [0,0,0,1,0,0|2,0,1]=4 2465 B8R1.8 NCCC1CCNC1 Amb32675662 [0,0,0,1,0,0|2,0,1]=4 2466 B8R1.8 NCCC1CCOC1 Amb15701360 [0,0,0,1,0,0|2,0,1]=4 2467 B8R1.8 NCCC1CCOC1 Amb22001860 [0,0,0,1,0,0|2,0,1]=4 2468 B8R1.8 NCCC1CCSC1 Amb18199484 [0,0,0,1,0,0|2,0,1]=4 2469 B8R1.8 NCCN1C=NCC1 Amb27865687 [0,0,0,1,0,0|3,0,0]=4 2470 B8R1.8 NCCN1CCCO1 Amb27629498 [0,0,0,1,0,0|2,0,1]=4 2471 B8R1.8 NCC[C@@H]1CCCN1 Amb28341793 [0,0,0,1,0,0|2,0,1]=4 2472 B8R1.8 NCC[C@@H]1CN=CN1 Amb28348709 [0,0,0,1,0,0|3,0,0]=4 2473 B8R1.8 NCC[C@H]1CCCN1 Amb27984256 [0,0,0,1,0,0|2,0,1]=4 2474 B8R1.8 NCC[C@H]1CCCN1 Amb32651958 [0,0,0,1,0,0|2,0,1]=4 2475 B8R1.8 NCC[C@H]1CCCO1 Amb32664981 [0,0,0,1,0,0|1,0,2]=4 2476 B8R1.8 NCC[C@H]1CCCO1 Amb32670639 [0,0,0,1,0,0|1,0,2]=4 2477 B8R1.8 NCC[C@H]1CCNC1 Amb27633932 [0,0,0,1,0,0|2,0,1]=4 2478 B8R1.8 NC\C=C1/CCCS1 Amb27469674 [0,0,0,1,0,0|1,1,0]=3 2479 B8R1.8 NC\C=C1\CCCS1 Amb28059808 [0,0,0,1,0,0|1,1,0]=3 2480 B8R1.8 NC\C=C1\CCSC1 Amb27163727 [0,0,0,1,0,0|3,0,0]=4 2481 B8R1.8 N\N=C\C1CCCO1 Amb27409222 [0,0,0,1,0,0|2,0,1]=4 2482 B8R1.8 O=C\C=C1\CCCO1 Amb26868026 [0,0,0,1,0,0|1,0,1]=3 2483 B8R1.8 OCCC1C=CCN1 Amb32950238 [0,0,0,1,0,0|1,0,0]=2 2484 B8R1.8 OCCC1CC=CC1 Amb24482557 [0,0,0,1,0,0|0,0,2]=3 2485 B8R1.8 OCCC1CCCC1 Amb2721230 [0,0,0,1,0,0|0,0,2]=3 2486 B8R1.8 OCCC1CCCN1 Amb22754588 [0,0,0,1,0,0|1,0,1]=3 2487 B8R1.8 OCCC1CCCN1 Amb8630850 [0,0,0,1,0,0|1,0,1]=3 2488 B8R1.8 OCCC1CCCO1 Amb20622383 [0,0,0,1,0,0|1,0,1]=3 2489 B8R1.8 OCCC1CCCS1 Amb25998759 [0,0,0,1,0,0|1,0,1]=3 2490 B8R1.8 OCCC1CCNC1 Amb22406195 [0,0,0,1,0,0|1,0,1]=3 2491 B8R1.8 OCCC1CCNC1 Amb9782130 [0,0,0,1,0,0|1,0,1]=3 2492 B8R1.8 OCCC1CCOC1 Amb33541612 [0,0,0,1,0,0|1,0,1]=3 2493 B8R1.8 OCCC1CCSC1 Amb18202827 [0,0,0,1,0,0|1,0,1]=3 2494 B8R1.8 OCCC1CSCN1 Amb32946528 [0,0,0,1,0,0|2,0,1]=4 2495 B8R1.8 OCCC1NCCS1 Amb24446611 [0,0,0,1,0,0|2,0,1]=4 2496 B8R1.8 OCCC1OCCO1 Amb22264778 [0,0,0,1,0,0|2,0,1]=4 2497 B8R1.8 OCCN1CCC=N1 Amb15701438 [0,0,0,1,0,0|2,0,0]=3 2498 B8R1.8 OCCN1CCCC1 Amb22002207 [0,0,0,1,0,0|1,0,2]=4 2499 B8R1.8 OCCN1CCCC1 Amb535402 [0,0,0,1,0,0|1,0,2]=4 2500 B8R1.8 OCCN1CCOC1 Amb2721125 [0,0,0,1,0,0|2,0,1]=4 2501 B8R1.8 OCC[C@@H]1C=CCO1 Amb27206175 [0,0,0,1,0,0|1,0,0]=2 2502 B8R1.8 OCC[C@@H]1CCCN1 Amb8630851 [0,0,0,1,0,0|1,0,1]=3 2503 B8R1.8 OCC[C@@H]1CCCO1 Amb27836253 [0,0,0,1,0,0|1,0,1]=3 2504 B8R1.8 OCC[C@@H]1CCNC1 Amb22299725 [0,0,0,1,0,0|1,0,1]=3 2505 B8R1.8 OCC[C@@H]1CCNC1 Amb24411426 [0,0,0,1,0,0|1,0,1]=3 2506 B8R1.8 OCC[C@H]1CCCO1 Amb27431469 [0,0,0,1,0,0|1,0,1]=3 2507 B8R1.8 OCC[C@H]1CCNC1 Amb22299669 [0,0,0,1,0,0|1,0,1]=3 2508 B8R1.8 OCC[C@H]1CCNC1 Amb27785890 [0,0,0,1,0,0|1,0,1]=3 2509 B8R1.8 OCC[n+]1ccsc1 Amb24518966 [0,0,0,1,0,0|2,0,1]=4 2510 B8R1.8 OCCc1ccco1 Amb17089516 [0,0,0,1,0,0|1,0,2]=4 2511 B8R1.8 OCCc1cccs1 Amb2099445 [0,0,0,1,0,0|1,0,2]=4 2512 B8R1.8 OCCc1ccno1 Amb27164449 [0,0,0,1,0,0|2,0,1]=4 2513 B8R1.8 OCCc1ccns1 Amb23441022 [0,0,0,1,0,0|2,0,1]=4 2514 B8R1.8 OCCc1ccoc1 Amb25802261 [0,0,0,1,0,0|1,0,2]=4 2515 B8R1.8 OCCc1ccon1 Amb33198329 [0,0,0,1,0,0|2,0,1]=4 2516 B8R1.8 OCCc1ccsc1 Amb3939119 [0,0,0,1,0,0|1,0,2]=4 2517 B8R1.8 OCCc1ccsn1 Amb28453528 [0,0,0,1,0,0|2,0,1]=4 2518 B8R1.8 OCCn1cccc1 Amb9174997 [0,0,0,1,0,0|1,0,2]=4 2519 B8R1.8 OCCn1cccn1 Amb6382238 [0,0,0,1,0,0|2,0,1]=4 2520 B8R1.8 OCCn1ccnc1 Amb2688741 [0,0,0,1,0,0|2,0,1]=4 2521 B8R1.8 OCCn1ccnn1 Amb6307296 [0,0,0,1,0,0|3,0,0]=4 2522 B8R1.8 ONCC1CCCC1 Amb25952639 [0,0,0,1,0,0|1,0,2]=4 2523 B8R1.8 ONCC1CCCO1 Amb25684501 [0,0,0,1,0,0|2,0,1]=4 2524 B8R1.8 ONCC1CCCS1 Amb33416564 [0,0,0,1,0,0|2,0,1]=4 2525 B8R1.8 ONCC1CCOC1 Amb25935174 [0,0,0,1,0,0|2,0,1]=4 2526 B8R1.8 ONCC1CCSC1 Amb27981633 [0,0,0,1,0,0|2,0,1]=4 2527 B8R1.8 O\N=C\C1CCCO1 Amb27251474 [0,0,0,1,0,0|2,0,1]=4 2528 B8R1.8 S=C=NC1C=CCC1 Amb30007027 [0,0,0,1,0,0|1,1,1]=4 2529 B8R1.8 SCCC1CCCC1 Amb26475267 [0,0,0,1,0,0|0,1,2]=4 2530 B8R1.8 SCCC1CCCO1 Amb27220272 [0,0,0,1,0,0|1,0,2]=4 2531 B8R1.8 SCCC1CCCS1 Amb33415373 [0,0,0,1,0,0|1,1,1]=4 2532 B8R1.8 SCCC1CCNC1 Amb22298487 [0,0,0,1,0,0|1,1,1]=4 2533 B8R1.8 SCCC1CCOC1 Amb27783671 [0,0,0,1,0,0|1,1,1]=4 2534 B8R1.8 SCCC1CCSC1 Amb33141475 [0,0,0,1,0,0|1,1,1]=4 2535 B8R1.8 [N-]=[N+]=NC1C=CCC1 Amb28397148 [0,0,0,1,0,0|3,0,0]=4 2536 B8R1.9 CC1CC1CCCBr Amb33431531 [0,0,0,1,0,0|1,0,2]=4 2537 B8R1.9 CC1CC1CCCN Amb33224007 [0,0,0,1,0,0|1,0,2]=4 2538 B8R1.9 CC1CC1CCCO Amb33213606 [0,0,0,1,0,0|0,0,2]=3 2539 B8R1.9 CC1CC1CCCS Amb33143845 [0,0,0,1,0,0|0,1,2]=4 2540 B8R1.9 CC1CC1NCCO Amb18298792 [0,0,0,1,0,0|1,0,2]=4 2541 B8R1.9 CC1CC1\C=C\C=O Amb33474885 [0,0,0,1,0,0|2,0,1]=4 2542 B8R1.9 CC1CC1\C=C\CN Amb33144897 [0,0,0,1,0,0|2,0,0]=3 2543 B8R1.9 CC1CC1\C=C\CO Amb33358423 [0,0,0,1,0,0|2,0,0]=3 2544 B8R1.9 CC1OC1CCCBr Amb28383540 [0,0,0,1,0,0|2,0,1]=4 2545 B8R1.9 CC1OC1CCCO Amb28344681 [0,0,0,1,0,0|1,0,1]=3 2546 B8R1.9 CCCCC1CC1N Amb25989937 [0,0,0,1,0,0|1,0,2]=4 2547 B8R1.9 CCCCC1OC1O Amb27493204 [0,0,0,1,0,0|1,0,2]=4 2548 B8R1.9 CCCC[C@@H]1C[C@@H]1Cl Amb27857045 [0,0,0,1,0,0|1,0,2]=4 2549 B8R1.9 CCCC[C@@H]1C[C@H]1N Amb27188372 [0,0,0,1,0,0|1,0,2]=4 2550 B8R1.9 CCCO[C@@H]1C[C@H]1N Amb33347099 [0,0,0,1,0,0|2,0,1]=4 2551 B8R1.9 CCSCC1CC1N Amb33324026 [0,0,0,1,0,0|2,0,1]=4 2552 B8R1.9 CCSC[C@@H]1C[C@H]1N Amb33324037 [0,0,0,1,0,0|2,0,1]=4 2553 B8R1.9 CC\C=C\C1CC1N Amb33268684 [0,0,0,1,0,0|1,0,0]=2 2554 B8R1.9 CC\C=C\[C@@H]1C[C@H]1N Amb33268685 [0,0,0,1,0,0|1,0,0]=2 2555 B8R1.9 C[C@@H]1C[C@H]1NCCO Amb35750313 [0,0,0,1,0,0|1,0,2]=4 2556 B8R1.9 C[C@@H]1C[C@H]1OCCO Amb28430706 [0,0,0,1,0,0|1,0,2]=4 2557 B8R1.9 C[C@H]1C[C@H]1\C=C\C=O Amb27631312 [0,0,0,1,0,0|2,0,1]=4 2558 B8R1.9 C[C@H]1O[C@@H]1CCCCl Amb27229206 [0,0,0,1,0,0|2,0,1]=4 2559 B8R1.9 C[C@H]1O[C@H]1CCCBr Amb27863536 [0,0,0,1,0,0|2,0,1]=4 2560 B8R1.9 O[C@@H]1C[C@H]1CCCCl Amb27202822 [0,0,0,1,0,0|1,0,2]=4 2561 B8R1.9 O[C@H]1C[C@@H]1CCCCl Amb27428217 [0,0,0,1,0,0|1,0,2]=4 2562 B8R1.10 BrCCCC1CCC1 Amb25756718 [0,0,0,1,0,0|1,0,2]=4 2563 B8R1.10 BrCCCN1CCC1 Amb24412145 [0,0,0,1,0,0|2,0,1]=4 2564 B8R1.10 BrC\C=C\C1CCC1 Amb27448944 [0,0,0,1,0,0|2,0,0]=3 2565 B8R1.10 CCCCC1CCN1 Amb25353385 [0,0,0,1,0,0|1,0,2]=4 2566 B8R1.10 CCCNC1CCC1 Amb18989245 [0,0,0,1,0,0|2,0,1]=4 2567 B8R1.10 CCNCC1CCC1 Amb33545240 [0,0,0,1,0,0|2,0,1]=4 2568 B8R1.10 CCNCC1CCC1 Amb8853715 [0,0,0,1,0,0|2,0,1]=4 2569 B8R1.10 CCNCC1CCN1 Amb27228331 [0,0,0,1,0,0|2,0,1]=4 2570 B8R1.10 CCSCC1CCC1 Amb27838037 [0,0,0,1,0,0|2,0,1]=4 2571 B8R1.10 CCSCC1CCN1 Amb33324020 [0,0,0,1,0,0|2,0,1]=4 2572 B8R1.10 CC\C=C\C1CCN1 Amb33269504 [0,0,0,1,0,0|1,0,0]=2 2573 B8R1.10 CC\C=C\C1CNC1 Amb33269454 [0,0,0,1,0,0|2,0,0]=3 2574 B8R1.10 ClCCCN1CCC1 Amb27220226 [0,0,0,1,0,0|2,0,1]=4 2575 B8R1.10 ICCCC1CCC1 Amb29849579 [0,0,0,1,0,0|1,0,2]=4 2576 B8R1.10 NCCCC1CCC1 Amb23570814 [0,0,0,1,0,0|1,0,2]=4 2577 B8R1.10 NCCCC1CCC1 Amb28934907 [0,0,0,1,0,0|1,0,2]=4 2578 B8R1.10 NCCCN1CCC1 Amb22039460 [0,0,0,1,0,0|2,0,1]=4 2579 B8R1.10 NC\C=C\C1CCC1 Amb33449322 [0,0,0,1,0,0|2,0,0]=3 2580 B8R1.10 O=CCCC1=CCC1 Amb28130448 [0,0,0,1,0,0|0,0,2]=3 2581 B8R1.10 O=C\C=C\C1CCC1 Amb33361629 [0,0,0,1,0,0|2,0,1]=4 2582 B8R1.10 OCCCC1CCC1 Amb23570813 [0,0,0,1,0,0|0,0,2]=3 2583 B8R1.10 OCCCC1CCN1 Amb27792141 [0,0,0,1,0,0|1,0,1]=3 2584 B8R1.10 OCCCC1CNC1 Amb22737371 [0,0,0,1,0,0|1,0,2]=4 2585 B8R1.10 OCCCN1CCC1 Amb22292344 [0,0,0,1,0,0|1,0,1]=3 2586 B8R1.10 OCCNC1CCC1 Amb18982433 [0,0,0,1,0,0|1,0,2]=4 2587 B8R1.10 OCCOC1CCC1 Amb20622528 [0,0,0,1,0,0|1,0,2]=4 2588 B8R1.10 OCCSC1CCC1 Amb27424672 [0,0,0,1,0,0|1,0,2]=4 2589 B8R1.10 OCNCC1CCC1 Amb27838337 [0,0,0,1,0,0|1,0,2]=4 2590 B8R1.10 OC\C=C\C1CCC1 Amb33079656 [0,0,0,1,0,0|2,0,0]=3 2591 B8R1.10 SCCCC1CCC1 Amb33197136 [0,0,0,1,0,0|0,1,2]=4 2592 B8R1.11 C=CC1=CCCC1O Amb28429765 [0,0,0,1,0,0|0,0,2]=3 2593 B8R1.11 CC1CCC=C1C#N Amb28286175 [0,0,0,1,0,0|2,0,1]=4 2594 B8R1.11 CC1CCC=C1CCl Amb27816584 [0,0,0,1,0,0|2,0,0]=3 2595 B8R1.11 CC1CCCC1CBr Amb27484135 [0,0,0,1,0,0|1,0,2]=4 2596 B8R1.11 CC1CCCC1CN Amb28990978 [0,0,0,1,0,0|1,0,2]=4 2597 B8R1.11 CC1CCCC1CN Amb33527076 [0,0,0,1,0,0|1,0,2]=4 2598 B8R1.11 CC1CCNC1CO Amb23441154 [0,0,0,1,0,0|1,0,2]=4 2599 B8R1.11 CC1CNCC1CCl Amb27467789 [0,0,0,1,0,0|2,0,1]=4 2600 B8R1.11 CC1CNCC1CN Amb2696276 [0,0,0,1,0,0|2,0,1]=4 2601 B8R1.11 CC1CNCC1CO Amb25739981 [0,0,0,1,0,0|1,0,1]=3 2602 B8R1.11 CC1CNCC1CO Amb29083427 [0,0,0,1,0,0|1,0,1]=3 2603 B8R1.11 CC1COCC1CBr Amb35616316 [0,0,0,1,0,0|2,0,1]=4 2604 B8R1.11 CC1COCC1CCl Amb25889386 [0,0,0,1,0,0|2,0,1]=4 2605 B8R1.11 CC1COCC1CO Amb23399676 [0,0,0,1,0,0|1,0,1]=3 2606 B8R1.11 CC1COCC1NO Amb35635908 [0,0,0,1,0,0|2,0,1]=4 2607 B8R1.11 CC1NC=NC1CO Amb8389436 [0,0,0,1,0,0|2,0,0]=3 2608 B8R1.11 CC1NCCC1CCl Amb27249431 [0,0,0,1,0,0|2,0,1]=4 2609 B8R1.11 CC1NCCC1CN Amb18203354 [0,0,0,1,0,0|2,0,1]=4 2610 B8R1.11 CC1NCCC1CO Amb26463701 [0,0,0,1,0,0|1,0,1]=3 2611 B8R1.11 CC1OCCC1CBr Amb33550567 [0,0,0,1,0,0|2,0,1]=4 2612 B8R1.11 CC1OCCC1CCl Amb25882789 [0,0,0,1,0,0|2,0,1]=4 2613 B8R1.11 CC1OCCC1CO Amb26515717 [0,0,0,1,0,0|1,0,1]=3 2614 B8R1.11 CC1OCCC1CS Amb33426771 [0,0,0,1,0,0|1,1,1]=4 2615 B8R1.11 CC1SCCC1CN Amb27625343 [0,0,0,1,0,0|2,0,1]=4 2616 B8R1.11 CCC1=C(C)CCC1 Amb22227944 [0,0,0,1,0,0|1,0,2]=4 2617 B8R1.11 CCC1=C(S)CCO1 Amb28253028 [0,0,0,1,0,0|1,1,1]=4 2618 B8R1.11 CCC1=CC=CC1C Amb28247297 [0,0,0,1,0,0|1,0,2]=4 2619 B8R1.11 CCC1=CCCC1=O Amb17778667 [0,0,0,1,0,0|0,0,2]=3 2620 B8R1.11 CCC1=CCCC1C Amb26515704 [0,0,0,1,0,0|1,0,0]=2 2621 B8R1.11 CCC1=CCSC1=O Amb27967999 [0,0,0,1,0,0|1,0,2]=4 2622 B8R1.11 CCC1=NCCC1C Amb26621065 [0,0,0,1,0,0|2,0,0]=3 2623 B8R1.11 CCC1C=CCC1Br Amb27794804 [0,0,0,1,0,0|1,0,2]=4 2624 B8R1.11 CCC1CCCC1C Amb25788505 [0,0,0,1,0,0|1,0,2]=4 2625 B8R1.11 CCC1CCCC1N Amb9776220 [0,0,0,1,0,0|1,0,2]=4 2626 B8R1.11 CCC1CCCC1O Amb20621081 [0,0,0,1,0,0|0,0,2]=3 2627 B8R1.11 CCC1CCCC1S Amb24759652 [0,0,0,1,0,0|0,1,2]=4 2628 B8R1.11 CCC1CCNC1C Amb28934809 [0,0,0,1,0,0|2,0,1]=4 2629 B8R1.11 CCC1CNCC1C Amb28346924 [0,0,0,1,0,0|2,0,1]=4 2630 B8R1.11 CCC1CNCC1O Amb28245846 [0,0,0,1,0,0|1,0,2]=4 2631 B8R1.11 CCC1COCC1O Amb24675632 [0,0,0,1,0,0|1,0,2]=4 2632 B8R1.11 CCC1CSCC1O Amb28316138 [0,0,0,1,0,0|1,0,2]=4 2633 B8R1.11 CCC1NCCC1C Amb28934808 [0,0,0,1,0,0|2,0,1]=4 2634 B8R1.11 CCC1NCCC1N Amb18203353 [0,0,0,1,0,0|2,0,1]=4 2635 B8R1.11 CCC1NCCC1O Amb18833009 [0,0,0,1,0,0|1,0,1]=3 2636 B8R1.11 CCC1NCCC1O Amb32411997 [0,0,0,1,0,0|1,0,1]=3 2637 B8R1.11 CCC1NN=CC1C Amb27204804 [0,0,0,1,0,0|3,0,0]=4 2638 B8R1.11 CCC1OCCC1N Amb25702085 [0,0,0,1,0,0|2,0,1]=4 2639 B8R1.11 CCC1OCCC1O Amb27197541 [0,0,0,1,0,0|1,0,1]=3 2640 B8R1.11 CCC1SCCC1Br Amb28285217 [0,0,0,1,0,0|2,0,1]=4 2641 B8R1.11 CCC1SCCC1O Amb27409767 [0,0,0,1,0,0|1,0,1]=3 2642 B8R1.11 CC[C@@H]1C=CC[C@H]1Br Amb27965412 [0,0,0,1,0,0|1,0,2]=4 2643 B8R1.11 CC[C@@H]1C=CC[C@H]1O Amb27208141 [0,0,0,1,0,0|0,0,2]=3 2644 B8R1.11 CC[C@@H]1CCC[C@@H]1N Amb27786242 [0,0,0,1,0,0|1,0,2]=4 2645 B8R1.11 CC[C@@H]1CCC[C@H]1N Amb27786896 [0,0,0,1,0,0|1,0,2]=4 2646 B8R1.11 CC[C@@H]1CCC[C@H]1O Amb26421340 [0,0,0,1,0,0|0,0,2]=3 2647 B8R1.11 CC[C@@H]1CNC[C@H]1O Amb24560816 [0,0,0,1,0,0|1,0,2]=4 2648 B8R1.11 CC[C@@H]1COC[C@H]1O Amb32944586 [0,0,0,1,0,0|1,0,2]=4 2649 B8R1.11 CC[C@@H]1NCC[C@H]1C Amb18833052 [0,0,0,1,0,0|2,0,1]=4 2650 B8R1.11 CC[C@@H]1NCC[C@H]1O Amb25168928 [0,0,0,1,0,0|1,0,1]=3 2651 B8R1.11 CC[C@@H]1NCC[C@H]1O Amb33379057 [0,0,0,1,0,0|1,0,1]=3 2652 B8R1.11 CC[C@@H]1OCC[C@H]1Br Amb27634877 [0,0,0,1,0,0|2,0,1]=4 2653 B8R1.11 CC[C@@H]1OCC[C@H]1N Amb24401717 [0,0,0,1,0,0|2,0,1]=4 2654 B8R1.11 CC[C@H]1C=CC[C@@H]1O Amb27653157 [0,0,0,1,0,0|0,0,2]=3 2655 B8R1.11 CC[C@H]1CCC[C@@H]1C Amb26430749 [0,0,0,1,0,0|1,0,2]=4 2656 B8R1.11 CC[C@H]1CCC[C@H]1C Amb28194950 [0,0,0,1,0,0|1,0,2]=4 2657 B8R1.11 CC[C@H]1CNC[C@H]1O Amb27459736 [0,0,0,1,0,0|1,0,2]=4 2658 B8R1.11 CC[C@H]1OCC[C@H]1O Amb28435763 [0,0,0,1,0,0|1,0,1]=3 2659 B8R1.11 CC[C@H]1SCC[C@H]1O Amb27625677 [0,0,0,1,0,0|1,0,1]=3 2660 B8R1.11 CCc1ccsc1O Amb26547659 [0,0,0,1,0,0|1,0,2]=4 2661 B8R1.11 CN1CCCC1CO Amb13951143 [0,0,0,1,0,0|1,0,2]=4 2662 B8R1.11 CN1CCC[C@@H]1CO Amb13887229 [0,0,0,1,0,0|1,0,2]=4 2663 B8R1.11 CN1CCC[C@H]1CO Amb3939162 [0,0,0,1,0,0|1,0,2]=4 2664 B8R1.11 CN1CSCC1CO Amb28145118 [0,0,0,1,0,0|2,0,1]=4 2665 B8R1.11 CN1NCCC1CO Amb27849176 [0,0,0,1,0,0|2,0,1]=4 2666 B8R1.11 CN1NCCC1CO Amb35826247 [0,0,0,1,0,0|2,0,1]=4 2667 B8R1.11 CNC1=CCCC1=O Amb28457232 [0,0,0,1,0,0|1,0,2]=4 2668 B8R1.11 CNC1CCCC1O Amb17231821 [0,0,0,1,0,0|1,0,2]=4 2669 B8R1.11 CN[C@@H]1CCC[C@@H]1O Amb27240798 [0,0,0,1,0,0|1,0,2]=4 2670 B8R1.11 CN[C@@H]1CCC[C@H]1O Amb16230279 [0,0,0,1,0,0|1,0,2]=4 2671 B8R1.11 COC1=CCCC1=O Amb28316240 [0,0,0,1,0,0|1,0,2]=4 2672 B8R1.11 COC1=NCCC1C Amb4136376 [0,0,0,1,0,0|3,0,0]=4 2673 B8R1.11 COC1C=CCC1O Amb27805128 [0,0,0,1,0,0|1,0,2]=4 2674 B8R1.11 COC1CC=CC1Cl Amb27657668 [0,0,0,1,0,0|3,0,0]=4 2675 B8R1.11 COC1CCCC1O Amb19515034 [0,0,0,1,0,0|1,0,2]=4 2676 B8R1.11 CO[C@@H]1CC=C[C@H]1Cl Amb28128757 [0,0,0,1,0,0|3,0,0]=4 2677 B8R1.11 CO[C@@H]1CC=C[C@H]1O Amb28069634 [0,0,0,1,0,0|3,0,0]=4 2678 B8R1.11 CO[C@@H]1CCC[C@@H]1O Amb28400066 [0,0,0,1,0,0|1,0,2]=4 2679 B8R1.11 CO[C@@H]1CCC[C@H]1O Amb19372843 [0,0,0,1,0,0|1,0,2]=4 2680 B8R1.11 CO[C@H]1CCC[C@@H]1O Amb27245897 [0,0,0,1,0,0|1,0,2]=4 2681 B8R1.11 CSC1=CCCC1=O Amb28351431 [0,0,0,1,0,0|1,0,2]=4 2682 B8R1.11 CSC1CC=CC1Cl Amb27865466 [0,0,0,1,0,0|3,0,0]=4 2683 B8R1.11 CS[C@@H]1CC=C[C@H]1Cl Amb28132459 [0,0,0,1,0,0|3,0,0]=4 2684 B8R1.11 CS[C@@H]1CCC[C@@H]1O Amb27853579 [0,0,0,1,0,0|1,0,2]=4 2685 B8R1.11 C[C@@H]1CCC[C@H]1CBr Amb24603453 [0,0,0,1,0,0|1,0,2]=4 2686 B8R1.11 C[C@@H]1CCC[C@H]1CO Amb25258782 [0,0,0,1,0,0|0,0,2]=3 2687 B8R1.11 C[C@@H]1CCO[C@@H]1CO Amb33328615 [0,0,0,1,0,0|1,0,2]=4 2688 B8R1.11 C[C@@H]1CNC[C@H]1CN Amb28062618 [0,0,0,1,0,0|2,0,1]=4 2689 B8R1.11 C[C@@H]1CNC[C@H]1CO Amb13883444 [0,0,0,1,0,0|1,0,1]=3 2690 B8R1.11 C[C@@H]1COC[C@H]1CO Amb28346310 [0,0,0,1,0,0|1,0,1]=3 2691 B8R1.11 C[C@@H]1NCC[C@@H]1CO Amb26414508 [0,0,0,1,0,0|1,0,1]=3 2692 B8R1.11 C[C@@H]1OCC[C@@H]1CN Amb22886286 [0,0,0,1,0,0|2,0,1]=4 2693 B8R1.11 C[C@@H]1OCC[C@@H]1CO Amb22886851 [0,0,0,1,0,0|1,0,1]=3 2694 B8R1.11 C[C@H]1CCC=C1C=O Amb28251104 [0,0,0,1,0,0|2,0,1]=4 2695 B8R1.11 C[C@H]1CCC[C@@H]1CN Amb28423931 [0,0,0,1,0,0|1,0,2]=4 2696 B8R1.11 C[C@H]1CCN[C@@H]1CO Amb27631283 [0,0,0,1,0,0|1,0,2]=4 2697 B8R1.11 C[C@H]1CNC[C@@H]1CO Amb22232058 [0,0,0,1,0,0|1,0,1]=3 2698 B8R1.11 C[C@H]1CNC[C@@H]1CO Amb34159412 [0,0,0,1,0,0|1,0,1]=3 2699 B8R1.11 C[C@H]1CNC[C@H]1CN Amb32672061 [0,0,0,1,0,0|2,0,1]=4 2700 B8R1.11 C[C@H]1NCC[C@H]1CO Amb27629700 [0,0,0,1,0,0|1,0,1]=3 2701 B8R1.11 C[C@H]1OCC[C@@H]1CO Amb34915718 [0,0,0,1,0,0|1,0,1]=3 2702 B8R1.11 C[C@H]1OCC[C@H]1CO Amb25328798 [0,0,0,1,0,0|1,0,1]=3 2703 B8R1.11 Cc1ccoc1CO Amb6572130 [0,0,0,1,0,0|1,0,2]=4 2704 B8R1.11 Cc1ccsc1CO Amb837436 [0,0,0,1,0,0|1,0,2]=4 2705 B8R1.11 Cn1cccc1CO Amb837316 [0,0,0,1,0,0|1,0,2]=4 2706 B8R1.11 Cn1ccnc1CO Amb1679789 [0,0,0,1,0,0|2,0,1]=4 2707 B8R1.11 Cn1ccnc1CO Amb20668539 [0,0,0,1,0,0|2,0,1]=4 2708 B8R1.11 NC1C=CCC1CO Amb27403535 [0,0,0,1,0,0|1,0,0]=2 2709 B8R1.11 NC1CCCC1CO Amb18641836 [0,0,0,1,0,0|1,0,2]=4 2710 B8R1.11 NC1CCCC1CO Amb32666151 [0,0,0,1,0,0|1,0,2]=4 2711 B8R1.11 NC1COCC1CO Amb24581733 [0,0,0,1,0,0|2,0,1]=4 2712 B8R1.11 NC1COCC1CO Amb30585130 [0,0,0,1,0,0|2,0,1]=4 2713 B8R1.11 NCC1CCCC1O Amb22756654 [0,0,0,1,0,0|1,0,2]=4 2714 B8R1.11 NCC1CCCC1O Amb9286702 [0,0,0,1,0,0|1,0,2]=4 2715 B8R1.11 NCC1NCCC1O Amb28245401 [0,0,0,1,0,0|2,0,1]=4 2716 B8R1.11 NC[C@@H]1CCC[C@@H]1O Amb25983417 [0,0,0,1,0,0|1,0,2]=4 2717 B8R1.11 NC[C@@H]1CCC[C@@H]1O Amb33743299 [0,0,0,1,0,0|1,0,2]=4 2718 B8R1.11 NC[C@@H]1CCC[C@H]1O Amb26550059 [0,0,0,1,0,0|1,0,2]=4 2719 B8R1.11 NC[C@@H]1CCC[C@H]1O Amb32663131 [0,0,0,1,0,0|1,0,2]=4 2720 B8R1.11 NC[C@H]1CCC[C@@H]1O Amb26873019 [0,0,0,1,0,0|1,0,2]=4 2721 B8R1.11 NC[C@H]1CCC[C@@H]1O Amb32663080 [0,0,0,1,0,0|1,0,2]=4 2722 B8R1.11 NC[C@H]1CCC[C@H]1O Amb25218839 [0,0,0,1,0,0|1,0,2]=4 2723 B8R1.11 NC[C@H]1CCC[C@H]1O Amb33743876 [0,0,0,1,0,0|1,0,2]=4 2724 B8R1.11 NC[C@H]1NCC[C@@H]1O Amb28056116 [0,0,0,1,0,0|2,0,1]=4 2725 B8R1.11 N[C@@H]1CCC[C@@H]1CO Amb22746052 [0,0,0,1,0,0|1,0,2]=4 2726 B8R1.11 N[C@@H]1CCC[C@@H]1CO Amb24056609 [0,0,0,1,0,0|1,0,2]=4 2727 B8R1.11 N[C@@H]1CCC[C@H]1CO Amb22231643 [0,0,0,1,0,0|1,0,2]=4 2728 B8R1.11 N[C@@H]1COC[C@@H]1CO Amb31169044 [0,0,0,1,0,0|2,0,1]=4 2729 B8R1.11 N[C@@H]1COC[C@@H]1CO Amb33456236 [0,0,0,1,0,0|2,0,1]=4 2730 B8R1.11 N[C@H]1CCC[C@H]1CO Amb1994025 [0,0,0,1,0,0|1,0,2]=4 2731 B8R1.11 N[C@H]1COC[C@H]1CO Amb27188192 [0,0,0,1,0,0|2,0,1]=4 2732 B8R1.11 O=C1C=CCC1CO Amb27802494 [0,0,0,1,0,0|1,0,1]=3 2733 B8R1.11 O=C1C=COC1CO Amb27482018 [0,0,0,1,0,0|2,0,1]=4 2734 B8R1.11 O=C1CCC=C1CBr Amb27232822 [0,0,0,1,0,0|1,0,2]=4 2735 B8R1.11 O=C[C@H]1CC=C[C@H]1O Amb27237646 [0,0,0,1,0,0|1,0,2]=4 2736 B8R1.11 OC1CCCC1CCl Amb24386443 [0,0,0,1,0,0|1,0,2]=4 2737 B8R1.11 OCC1CC=CC1O Amb25923040 [0,0,0,1,0,0|1,0,0]=2 2738 B8R1.11 OCC1CCCC1F Amb28318750 [0,0,0,1,0,0|1,0,2]=4 2739 B8R1.11 OCC1CCCC1O Amb8504106 [0,0,0,1,0,0|1,0,2]=4 2740 B8R1.11 OCC1CNCC1O Amb22587601 [0,0,0,1,0,0|2,0,1]=4 2741 B8R1.11 OCC1CNCC1O Amb26440714 [0,0,0,1,0,0|2,0,1]=4 2742 B8R1.11 OCC1NCCC1O Amb18641923 [0,0,0,1,0,0|2,0,1]=4 2743 B8R1.11 OCC1NCCC1O Amb24117910 [0,0,0,1,0,0|2,0,1]=4 2744 B8R1.11 OCC1OCCC1O Amb26993579 [0,0,0,1,0,0|2,0,1]=4 2745 B8R1.11 OCC1SC=CC1O Amb27763688 [0,0,0,1,0,0|2,0,0]=3 2746 B8R1.11 OC[C@@H]1CC=C[C@@H]1O Amb22233136 [0,0,0,1,0,0|1,0,0]=2 2747 B8R1.11 OC[C@@H]1CCC[C@H]1Cl Amb27454845 [0,0,0,1,0,0|1,0,2]=4 2748 B8R1.11 OC[C@@H]1CCC[C@H]1O Amb28077597 [0,0,0,1,0,0|1,0,2]=4 2749 B8R1.11 OC[C@@H]1CNC[C@H]1F Amb31251496 [0,0,0,1,0,0|2,0,1]=4 2750 B8R1.11 OC[C@@H]1CNC[C@H]1F Amb33457278 [0,0,0,1,0,0|2,0,1]=4 2751 B8R1.11 OC[C@@H]1CNC[C@H]1O Amb22757877 [0,0,0,1,0,0|2,0,1]=4 2752 B8R1.11 OC[C@@H]1OC=C[C@H]1O Amb25376799 [0,0,0,1,0,0|2,0,0]=3 2753 B8R1.11 OC[C@H]1C=CC[C@@H]1O Amb27427837 [0,0,0,1,0,0|1,0,2]=4 2754 B8R1.11 OC[C@H]1CC=C[C@H]1O Amb24514501 [0,0,0,1,0,0|1,0,0]=2 2755 B8R1.11 OC[C@H]1CNC[C@H]1O Amb22757874 [0,0,0,1,0,0|2,0,1]=4 2756 B8R1.11 OC[C@H]1CNC[C@H]1O Amb27420150 [0,0,0,1,0,0|2,0,1]=4 2757 B8R1.11 OC[C@H]1NCC[C@@H]1O Amb27246014 [0,0,0,1,0,0|2,0,1]=4 2758 B8R1.11 OC[C@H]1NCC[C@@H]1O Amb31291450 [0,0,0,1,0,0|2,0,1]=4 2759 B8R1.11 OC[C@H]1OC=C[C@@H]1O Amb27967186 [0,0,0,1,0,0|2,0,0]=3 2760 B8R1.11 OC[C@H]1OCCC1O Amb27594751 [0,0,0,1,0,0|2,0,1]=4 2761 B8R1.11 OC[C@H]1OCC[C@@H]1O Amb27194035 [0,0,0,1,0,0|2,0,1]=4 2762 B8R1.11 OC[C@H]1OCC[C@H]1O Amb27423676 [0,0,0,1,0,0|2,0,1]=4 2763 B8R1.11 ONC1CC=CC1O Amb27431560 [0,0,0,1,0,0|2,0,0]=3 2764 B8R1.11 O\N=C1/CCCC1O Amb28069662 [0,0,0,1,0,0|2,0,1]=4 2765 B8R1.12 CCC1C=CC1CO Amb28285219 [0,0,0,1,0,0|0,0,2]=3 2766 B8R1.12 CCC1CCC1CBr Amb33512084 [0,0,0,1,0,0|1,0,2]=4 2767 B8R1.12 CCC1CCC1CN Amb24483083 [0,0,0,1,0,0|1,0,2]=4 2768 B8R1.12 CCC1CCN1CC Amb27833239 [0,0,0,1,0,0|2,0,1]=4 2769 B8R1.12 CCC1COC1CO Amb25948271 [0,0,0,1,0,0|1,0,2]=4 2770 B8R1.12 CCN1CCC1CN Amb27631267 [0,0,0,1,0,0|2,0,1]=4 2771 B8R1.12 CCN1CCC1CO Amb32668190 [0,0,0,1,0,0|1,0,1]=3 2772 B8R1.12 CNC1CCC1CO Amb27657865 [0,0,0,1,0,0|1,0,2]=4 2773 B8R1.12 CN[C@@H]1CC[C@H]1CO Amb27785815 [0,0,0,1,0,0|1,0,2]=4 2774 B8R1.12 COC1CCC1CO Amb24473419 [0,0,0,1,0,0|1,0,2]=4 2775 B8R1.12 CO[C@@H]1CC[C@@H]1CO Amb34913167 [0,0,0,1,0,0|1,0,2]=4 2776 B8R1.12 CO[C@@H]1CC[C@H]1CO Amb28059364 [0,0,0,1,0,0|1,0,2]=4 2777 B8R1.12 OCC1C=CC1CO Amb27471112 [0,0,0,1,0,0|1,0,2]=4 2778 B8R1.12 OCC1CCC1CF Amb27965576 [0,0,0,1,0,0|1,0,2]=4 2779 B8R1.12 OCC1CCC1CO Amb20248362 [0,0,0,1,0,0|1,0,2]=4 2780 B8R1.12 OC[C@@H]1CC[C@H]1CO Amb24725649 [0,0,0,1,0,0|1,0,2]=4 2781 B8R1.12 OC[C@H]1C=C[C@H]1CO Amb27472626 [0,0,0,1,0,0|1,0,2]=4 2782 B8R1.12 OC[C@H]1CC[C@H]1CO Amb26476284 [0,0,0,1,0,0|1,0,2]=4 2783 B8R1.13 CC#CC1CCC1O Amb32945208 [0,0,0,1,0,0|0,0,3]=4 2784 B8R1.13 CC1CCC1CCN Amb28049312 [0,0,0,1,0,0|1,0,2]=4 2785 B8R1.13 CC1CC\C1=C/CN Amb27969937 [0,0,0,1,0,0|2,0,0]=3 2786 B8R1.13 CCCC1CCC1O Amb24359183 [0,0,0,1,0,0|0,0,2]=3 2787 B8R1.13 CCCC1SCC1O Amb27803103 [0,0,0,1,0,0|1,0,2]=4 2788 B8R1.13 CCO[C@@H]1CC[C@@H]1N Amb33495620 [0,0,0,1,0,0|2,0,1]=4 2789 B8R1.13 CCO[C@@H]1CC[C@H]1O Amb33495613 [0,0,0,1,0,0|1,0,1]=3 2790 B8R1.13 COCC1CCC1O Amb32944318 [0,0,0,1,0,0|1,0,2]=4 2791 B8R1.13 C\C=C\C1CCC1O Amb33212898 [0,0,0,1,0,0|0,0,2]=3 2792 B8R1.17 CCC1C[C@H]1CCO Amb28429951 [0,0,0,1,0,0|0,0,2]=3 2793 B8R1.17 CCC1OC1CCO Amb25144428 [0,0,0,1,0,0|1,0,1]=3 2794 B8R1.17 CCCC1=CC1CO Amb27804429 [0,0,0,1,0,0|0,0,2]=3 2795 B8R1.17 CCCC1CC1CC Amb25784549 [0,0,0,1,0,0|1,0,2]=4 2796 B8R1.17 CCCC1SC1CO Amb27751937 [0,0,0,1,0,0|1,0,2]=4 2797 B8R1.17 CCC[C@@H]1C[C@H]1CN Amb33209408 [0,0,0,1,0,0|1,0,2]=4 2798 B8R1.17 CCC[C@@H]1C[C@H]1CN Amb33465479 [0,0,0,1,0,0|1,0,2]=4 2799 B8R1.17 CCC[C@@H]1C[C@H]1CO Amb24533879 [0,0,0,1,0,0|0,0,2]=3 2800 B8R1.17 CCC[C@@H]1O[C@@H]1CO Amb26564240 [0,0,0,1,0,0|1,0,2]=4 2801 B8R1.17 CCC[C@H]1C[C@H]1CO Amb28345377 [0,0,0,1,0,0|0,0,2]=3 2802 B8R1.17 CCC[C@H]1S[C@@H]1CO Amb27977865 [0,0,0,1,0,0|1,0,2]=4 2803 B8R1.17 CCOC1CC1CBr Amb35732117 [0,0,0,1,0,0|2,0,1]=4 2804 B8R1.17 CCOC1CC1CCl Amb35732115 [0,0,0,1,0,0|2,0,1]=4 2805 B8R1.17 CCOC1CC1CN Amb35713826 [0,0,0,1,0,0|2,0,1]=4 2806 B8R1.17 CCOC1CC1CO Amb28048916 [0,0,0,1,0,0|1,0,1]=3 2807 B8R1.17 CC[C@@H]1C[C@H]1CCN Amb32697069 [0,0,0,1,0,0|1,0,2]=4 2808 B8R1.17 CC[C@@H]1O[C@H]1CCCl Amb28436373 [0,0,0,1,0,0|2,0,1]=4 2809 B8R1.17 CC[C@@H]1O[C@H]1CCN Amb27810614 [0,0,0,1,0,0|2,0,1]=4 2810 B8R1.17 CC[C@H]1O[C@@H]1CCBr Amb28247992 [0,0,0,1,0,0|2,0,1]=4 2811 B8R1.17 CC[C@H]1O[C@@H]1CCN Amb28369654 [0,0,0,1,0,0|2,0,1]=4 2812 B8R1.17 CC[C@H]1O[C@H]1CCBr Amb27640561 [0,0,0,1,0,0|2,0,1]=4 2813 B8R1.17 CC[C@H]1O[C@H]1CCCl Amb27630507 [0,0,0,1,0,0|2,0,1]=4 2814 B8R1.17 CC\C=C1\CC1CO Amb27879710 [0,0,0,1,0,0|0,0,0]=1 2815 B8R1.17 COC[C@@H]1C[C@H]1CO Amb27853195 [0,0,0,1,0,0|1,0,2]=4 2816 B8R1.17 CONC1CC1CO Amb27783686 [0,0,0,1,0,0|2,0,1]=4 2817 B8R1.17 C\C=C\C1CC1CO Amb28069598 [0,0,0,1,0,0|0,0,2]=3 2818 B8R1.17 C\C=C\[C@@H]1C[C@@H]1CO Amb27219006 [0,0,0,1,0,0|0,0,2]=3 2819 B8R1.17 C\C=C\[C@@H]1O[C@H]1CO Amb27980584 [0,0,0,1,0,0|1,0,2]=4 2820 B8R1.17 OC[C@@H]1C[C@H]1CCBr Amb28193405 [0,0,0,1,0,0|1,0,2]=4 2821 B8R1.22 BrC1C=CC=CCC1 Amb27629198 [0,0,0,1,0,0|1,0,2]=4 2822 B8R1.22 BrC1CCCCCC1 Amb3940357 [0,0,0,1,0,0|1,0,2]=4 2823 B8R1.22 BrC1CCCOCC1 Amb24753175 [0,0,0,1,0,0|2,0,1]=4 2824 B8R1.22 BrC1CCCSCC1 Amb35627432 [0,0,0,1,0,0|2,0,1]=4 2825 B8R1.22 CC1=CC=NCCN1 Amb27844506 [0,0,0,1,0,0|2,0,1]=4 2826 B8R1.22 CC1=CCCCCC1 Amb22227978 [0,0,0,1,0,0|1,0,2]=4 2827 B8R1.22 CC1CCCCCN1 Amb18943961 [0,0,0,1,0,0|1,0,2]=4 2828 B8R1.22 CC1CCCCCN1 Amb22055352 [0,0,0,1,0,0|1,0,2]=4 2829 B8R1.22 CC1CCCCCO1 Amb22364798 [0,0,0,1,0,0|0,0,2]=3 2830 B8R1.22 CC1CCCCNC1 Amb22886304 [0,0,0,1,0,0|2,0,1]=4 2831 B8R1.22 CC1CCCCNC1 Amb27202179 [0,0,0,1,0,0|2,0,1]=4 2832 B8R1.22 CC1CCCNCC1 Amb22546367 [0,0,0,1,0,0|2,0,1]=4 2833 B8R1.22 CC1CCCNCC1 Amb9316855 [0,0,0,1,0,0|2,0,1]=4 2834 B8R1.22 CC1CCCOCO1 Amb28046311 [0,0,0,1,0,0|1,0,2]=4 2835 B8R1.22 CC1CCNCCO1 Amb26412871 [0,0,0,1,0,0|1,0,2]=4 2836 B8R1.22 CC1CCNCCO1 Amb30585117 [0,0,0,1,0,0|1,0,2]=4 2837 B8R1.22 CC1CNCCCN1 Amb33544983 [0,0,0,1,0,0|2,0,1]=4 2838 B8R1.22 CC1CNCCCO1 Amb22886427 [0,0,0,1,0,0|1,0,1]=3 2839 B8R1.22 CC1CNCCCO1 Amb9358449 [0,0,0,1,0,0|1,0,1]=3 2840 B8R1.22 CC1CNCCCS1 Amb27238313 [0,0,0,1,0,0|1,1,1]=4 2841 B8R1.22 CC1COCCCN1 Amb18624880 [0,0,0,1,0,0|2,0,1]=4 2842 B8R1.22 CC1CSCCCN1 Amb25870575 [0,0,0,1,0,0|2,0,1]=4 2843 B8R1.22 CC1CSCCCN1 Amb30585125 [0,0,0,1,0,0|2,0,1]=4 2844 B8R1.22 CC1OCCCCO1 Amb22731719 [0,0,0,1,0,0|1,0,1]=3 2845 B8R1.22 C[C@@H]1CCCCCN1 Amb27391648 [0,0,0,1,0,0|1,0,2]=4 2846 B8R1.22 C[C@@H]1CCNCCO1 Amb27624211 [0,0,0,1,0,0|1,0,2]=4 2847 B8R1.22 C[C@@H]1CNCCCN1 Amb35825205 [0,0,0,1,0,0|2,0,1]=4 2848 B8R1.22 C[C@@H]1COCCCN1 Amb27881643 [0,0,0,1,0,0|2,0,1]=4 2849 B8R1.22 C[C@H]1CNCCCN1 Amb26461498 [0,0,0,1,0,0|2,0,1]=4 2850 B8R1.22 C[C@H]1CNCCCO1 Amb35752396 [0,0,0,1,0,0|1,0,1]=3 2851 B8R1.22 ClC1CC=CC=CC1 Amb28198665 [0,0,0,1,0,0|1,0,2]=4 2852 B8R1.22 ClC1CCCOCC1 Amb27471515 [0,0,0,1,0,0|2,0,1]=4 2853 B8R1.22 ClC1CCCSCC1 Amb35650778 [0,0,0,1,0,0|2,0,1]=4 2854 B8R1.22 FC1CCCCCC1 Amb28049012 [0,0,0,1,0,0|1,0,2]=4 2855 B8R1.22 FC1CCCNCC1 Amb22886243 [0,0,0,1,0,0|2,0,1]=4 2856 B8R1.22 FC1CCCNCC1 Amb27453588 [0,0,0,1,0,0|2,0,1]=4 2857 B8R1.22 IC1CCCOCC1 Amb26563301 [0,0,0,1,0,0|2,0,1]=4 2858 B8R1.22 NC1C=CCCCC1 Amb24377373 [0,0,0,1,0,0|2,0,0]=3 2859 B8R1.22 NC1CC=CCCC1 Amb27408037 [0,0,0,1,0,0|1,0,2]=4 2860 B8R1.22 NC1CCC=CCC1 Amb24427232 [0,0,0,1,0,0|1,0,0]=2 2861 B8R1.22 NC1CCC=CCC1 Amb30585112 [0,0,0,1,0,0|1,0,0]=2 2862 B8R1.22 NC1CCCCCC1 Amb2720336 [0,0,0,1,0,0|1,0,2]=4 2863 B8R1.22 NC1CCCNCC1 Amb4296999 [0,0,0,1,0,0|2,0,1]=4 2864 B8R1.22 NC1CCCOCC1 Amb33547346 [0,0,0,1,0,0|2,0,1]=4 2865 B8R1.22 NC1CCCSCC1 Amb18199477 [0,0,0,1,0,0|2,0,1]=4 2866 B8R1.22 NC1CCCSCC1 Amb33328660 [0,0,0,1,0,0|2,0,1]=4 2867 B8R1.22 O=C1C=CCCCC1 Amb10601704 [0,0,0,1,0,0|2,0,1]=4 2868 B8R1.22 O=C1C=CCCCN1 Amb22500450 [0,0,0,1,0,0|2,0,1]=4 2869 B8R1.22 O=C1CCC=CCC1 Amb22230447 [0,0,0,1,0,0|0,0,2]=3 2870 B8R1.22 O=C1CCC=COC1 Amb27812549 [0,0,0,1,0,0|1,0,2]=4 2871 B8R1.22 OC1C=CC=CCC1 Amb27766443 [0,0,0,1,0,0|0,0,2]=3 2872 B8R1.22 OC1C=CCCCC1 Amb26034783 [0,0,0,1,0,0|2,0,0]=3 2873 B8R1.22 OC1CCC=CCO1 Amb28197000 [0,0,0,1,0,0|1,0,0]=2 2874 B8R1.22 OC1CCCCCC1 Amb3940358 [0,0,0,1,0,0|0,0,2]=3 2875 B8R1.22 OC1CCCCCO1 Amb4034492 [0,0,0,1,0,0|1,0,2]=4 2876 B8R1.22 OC1CCCCCS1 Amb17615898 [0,0,0,1,0,0|1,0,2]=4 2877 B8R1.22 OC1CCCCNC1 Amb22371121 [0,0,0,1,0,0|1,0,2]=4 2878 B8R1.22 OC1CCCCNC1 Amb22886250 [0,0,0,1,0,0|1,0,2]=4 2879 B8R1.22 OC1CCCCOC1 Amb27424901 [0,0,0,1,0,0|1,0,2]=4 2880 B8R1.22 OC1CCCNCC1 Amb19958701 [0,0,0,1,0,0|1,0,1]=3 2881 B8R1.22 OC1CCCNCC1 Amb2695607 [0,0,0,1,0,0|1,0,1]=3 2882 B8R1.22 OC1CCCOCC1 Amb18202762 [0,0,0,1,0,0|1,0,1]=3 2883 B8R1.22 OC1CCCSCC1 Amb18202861 [0,0,0,1,0,0|1,0,1]=3 2884 B8R1.22 OC1OCCCCO1 Amb27197834 [0,0,0,1,0,0|2,0,1]=4 2885 B8R1.22 O[C@@H]1C=CCCCC1 Amb28205998 [0,0,0,1,0,0|2,0,0]=3 2886 B8R1.22 O[C@@H]1CCCCOC1 Amb28125793 [0,0,0,1,0,0|1,0,2]=4 2887 B8R1.22 O[C@H]1CCCOCC1 Amb28058426 [0,0,0,1,0,0|1,0,1]=3 2888 B8R1.22 SC1CCCCCC1 Amb9208052 [0,0,0,1,0,0|0,1,2]=4 2889 B8R1.22 SC1CCCNCC1 Amb32788297 [0,0,0,1,0,0|1,1,1]=4 2890 B8R1.22 SC1CCCOCC1 Amb25189775 [0,0,0,1,0,0|1,1,1]=4 2891 B8R1.22 SC1CCCSCC1 Amb32788173 [0,0,0,1,0,0|1,1,1]=4 2892 B8R1.36 BrCCCCC1CC1 Amb27220703 [0,0,0,1,0,0|1,0,2]=4 2893 B8R1.36 BrCCCCC1CO1 Amb16234127 [0,0,0,1,0,0|1,0,2]=4 2894 B8R1.36 BrCCOCC1CO1 Amb33743831 [0,0,0,1,0,0|2,0,1]=4 2895 B8R1.36 CCCCCC1CC1 Amb27203905 [0,0,0,1,0,0|1,0,2]=4 2896 B8R1.36 CCCCCC1CO1 Amb19892425 [0,0,0,1,0,0|0,0,2]=3 2897 B8R1.36 CCCCC[C@@H]1CO1 Amb27862379 [0,0,0,1,0,0|0,0,2]=3 2898 B8R1.36 CCCCNC1CC1 Amb1128506 [0,0,0,1,0,0|2,0,1]=4 2899 B8R1.36 CCCCNC1CC1 Amb6892806 [0,0,0,1,0,0|2,0,1]=4 2900 B8R1.36 CCCNCC1CC1 Amb3939845 [0,0,0,1,0,0|2,0,1]=4 2901 B8R1.36 CCC\C=C\C1CO1 Amb33475203 [0,0,0,1,0,0|0,0,2]=3 2902 B8R1.36 CCC\C=C\[C@@H]1CO1 Amb33373326 [0,0,0,1,0,0|0,0,2]=3 2903 B8R1.36 CCC\C=C\[C@H]1CO1 Amb33373327 [0,0,0,1,0,0|0,0,2]=3 2904 B8R1.36 CCNCCC1CC1 Amb19018993 [0,0,0,1,0,0|2,0,1]=4 2905 B8R1.36 CCOCCC1CO1 Amb25679046 [0,0,0,1,0,0|1,0,1]=3 2906 B8R1.36 CCSCCC1CO1 Amb26575735 [0,0,0,1,0,0|1,0,1]=3 2907 B8R1.36 CC\C=C\CC1CO1 Amb33079841 [0,0,0,1,0,0|0,0,0]=1 2908 B8R1.36 COCCCC1CO1 Amb24676522 [0,0,0,1,0,0|1,0,2]=4 2909 B8R1.36 CSCCCC1CO1 Amb24687956 [0,0,0,1,0,0|1,0,2]=4 2910 B8R1.36 C\C=C\C=C\C1CO1 Amb27654185 [0,0,0,1,0,0|0,0,2]=3 2911 B8R1.36 C\C=C\CCC1CO1 Amb27662671 [0,0,0,1,0,0|0,0,2]=3 2912 B8R1.36 C\C=C\CC[C@H]1CO1 Amb27852839 [0,0,0,1,0,0|0,0,2]=3 2913 B8R1.36 ClCCCCC1CC1 Amb27422896 [0,0,0,1,0,0|1,0,2]=4 2914 B8R1.36 ClCCCCC1CO1 Amb25727648 [0,0,0,1,0,0|1,0,2]=4 2915 B8R1.36 ClCCOC[C@@H]1CO1 Amb28255551 [0,0,0,1,0,0|2,0,1]=4 2916 B8R1.36 NCCCCC1CC1 Amb18833054 [0,0,0,1,0,0|1,0,2]=4 2917 B8R1.36 NCCCNC1CC1 Amb17315307 [0,0,0,1,0,0|2,0,1]=4 2918 B8R1.36 NCCCOC1CC1 Amb28436320 [0,0,0,1,0,0|2,0,1]=4 2919 B8R1.36 NCC\N=C\C1CC1 Amb27599822 [0,0,0,1,0,0|2,0,1]=4 2920 B8R1.36 NC\C=C\CC1CC1 Amb33361219 [0,0,0,1,0,0|2,0,0]=3 2921 B8R1.36 O=C\C=C\CC1CC1 Amb33474661 [0,0,0,1,0,0|2,0,1]=4 2922 B8R1.36 OCCCC=C1CC1 Amb28400996 [0,0,0,1,0,0|0,0,0]=1 2923 B8R1.36 OCCCCC1CC1 Amb26059385 [0,0,0,1,0,0|0,0,2]=3 2924 B8R1.36 OCCCCC1CO1 Amb28410478 [0,0,0,1,0,0|1,0,2]=4 2925 B8R1.36 OCCCC[C@H]1CO1 Amb28206206 [0,0,0,1,0,0|1,0,2]=4 2926 B8R1.36 OCCCNC1CC1 Amb17317872 [0,0,0,1,0,0|1,0,1]=3 2927 B8R1.36 OCCCOC1CC1 Amb27260208 [0,0,0,1,0,0|1,0,1]=3 2928 B8R1.36 OCCCSC1CC1 Amb28284998 [0,0,0,1,0,0|1,0,1]=3 2929 B8R1.36 OCCNCC1CC1 Amb30640115 [0,0,0,1,0,0|1,0,2]=4 2930 B8R1.36 OCCNCC1CC1 Amb6707494 [0,0,0,1,0,0|1,0,2]=4 2931 B8R1.36 OCCOCC1CC1 Amb24729221 [0,0,0,1,0,0|1,0,2]=4 2932 B8R1.36 OCCOCC1CO1 Amb9731370 [0,0,0,1,0,0|2,0,1]=4 2933 B8R1.36 OCCSCC1CC1 Amb9423411 [0,0,0,1,0,0|1,0,2]=4 2934 B8R1.36 OC\C=C\CC1CC1 Amb33361220 [0,0,0,1,0,0|2,0,0]=3 2935 B8R1.36 ONCCCC1CC1 Amb27427292 [0,0,0,1,0,0|1,0,2]=4 2936 B8R1.36 SCCCCC1CC1 Amb32788277 [0,0,0,1,0,0|0,1,2]=4 2937 B8R1.49 C1=CCCC=CCC1 Amb20240928 [0,0,0,1,0,0|1,0,1]=3 2938 B8R1.49 C1=CCCC=CCC1 Amb21858295 [0,0,0,1,0,0|1,0,1]=3 2939 B8R1.49 C1=CCCC=CCC1 Amb21962105 [0,0,0,1,0,0|1,0,1]=3 2940 B8R1.49 C1=CCCC=CCC1 Amb22001947 [0,0,0,1,0,0|1,0,1]=3 2941 B8R1.49 C1=CCCC=CCC1 Amb22729533 [0,0,0,1,0,0|1,0,1]=3 2942 B8R1.49 C1=CCCC=CCC1 Amb32414658 [0,0,0,1,0,0|1,0,1]=3 2943 B8R1.49 C1=CCCC=CCC1 Amb34910796 [0,0,0,1,0,0|1,0,1]=3 2944 B8R1.49 C1=CCCC=CCC1 Amb35796422 [0,0,0,1,0,0|1,0,1]=3 2945 B8R1.49 C1=CCCC=CCC1 Amb35825507 [0,0,0,1,0,0|1,0,1]=3 2946 B8R1.49 C1=CCCC=CCC1 Amb8389257 [0,0,0,1,0,0|1,0,1]=3 2947 B8R1.49 C1=CCCC=CCC1 Amb8389289 [0,0,0,1,0,0|1,0,1]=3 2948 B8R1.49 C1=CCCC=CCC1 Amb8514435 [0,0,0,1,0,0|1,0,1]=3 2949 B8R1.49 C1=CCCC=CCC1 Amb8515194 [0,0,0,1,0,0|1,0,1]=3 2950 B8R1.49 C1=CCCC=CCC1 Amb8517196 [0,0,0,1,0,0|1,0,1]=3 2951 B8R1.49 C1=CCCC=CCC1 Amb8517269 [0,0,0,1,0,0|1,0,1]=3 2952 B8R1.49 C1=CCCCC=CC1 Amb27858879 [0,0,0,1,0,0|1,0,1]=3 2953 B8R1.49 C1=CCCCCC=C1 Amb4034451 [0,0,0,1,0,0|1,0,2]=4 2954 B8R1.49 C1=CCCCCCC1 Amb8513502 [0,0,0,1,0,0|1,0,0]=2 2955 B8R1.49 C1=CCCNCCC1 Amb28346195 [0,0,0,1,0,0|1,0,0]=2 2956 B8R1.49 C1=CCNCCCC1 Amb33038369 [0,0,0,1,0,0|2,0,0]=3 2957 B8R1.49 C1=CCNCCCC1 Amb33038370 [0,0,0,1,0,0|2,0,0]=3 2958 B8R1.49 C1CCCNCCC1 Amb3997183 [0,0,0,1,0,0|1,0,2]=4 2959 B8R1.49 C1CCNCCNC1 Amb24428659 [0,0,0,1,0,0|2,0,1]=4 2960 B8R1.49 C1CNCCCNC1 Amb6740292 [0,0,0,1,0,0|2,0,1]=4 2961 B8R1.49 C1CNCCCOC1 Amb26627441 [0,0,0,1,0,0|1,0,1]=3 2962 B8R1.49 C1COCOCCN1 Amb20669185 [0,0,0,1,0,0|2,0,1]=4 2963 B8R1.49 C1COCOCCO1 Amb22227715 [0,0,0,1,0,0|2,0,1]=4 2964 B5R0.2 BrCCCCBr Amb2686718 [2,0,0,0,0,0|2,0,0]=4 2965 B5R0.2 BrCCCCI Amb25861429 [2,0,0,0,0,0|2,0,0]=4 2966 B5R0.2 BrC\C=C/CBr Amb28319006 [2,0,0,0,0,0|2,0,0]=4 2967 B5R0.2 BrC\C=C\CBr Amb33985973 [2,0,0,0,0,0|2,0,0]=4 2968 B5R0.2 Br\C=C\CCBr Amb25663040 [2,0,0,0,0,0|2,0,0]=4 2969 B5R0.2 C#CCCC=C Amb18117518 [2,0,0,0,0,0|1,0,1]=4 2970 B5R0.2 C#CCCCC Amb4135448 [2,0,0,0,0,0|1,0,1]=4 2971 B5R0.2 C#CCCCO Amb1219893 [2,0,0,0,0,0|0,0,2]=4 2972 B5R0.2 C#C\C=C\CC Amb33267987 [2,0,0,0,0,0|0,0,2]=4 2973 B5R0.2 C#C\C=C\CO Amb17670556 [2,0,0,0,0,0|0,0,2]=4 2974 B5R0.2 C#NCCCC Amb31132446 [2,0,0,0,0,0|2,0,0]=4 2975 B5R0.2 C=C=CCCO Amb17593020 [2,0,0,0,0,0|0,0,2]=4 2976 B5R0.2 C=CC#CCO Amb17593015 [2,0,0,0,0,0|0,0,2]=4 2977 B5R0.2 C=CCCC#N Amb10605750 [2,0,0,0,0,0|1,0,1]=4 2978 B5R0.2 C=CCCC=C Amb8513514 [2,0,0,0,0,0|1,0,1]=4 2979 B5R0.2 C=CCCC=O Amb4358616 [2,0,0,0,0,0|0,0,2]=4 2980 B5R0.2 C=CCCCBr Amb3940219 [2,0,0,0,0,0|1,0,0]=3 2981 B5R0.2 C=CCCCC Amb3940497 [2,0,0,0,0,0|1,0,0]=3 2982 B5R0.2 C=CCCCCl Amb22229585 [2,0,0,0,0,0|1,0,0]=3 2983 B5R0.2 C=CCCCF Amb25689705 [2,0,0,0,0,0|1,0,0]=3 2984 B5R0.2 C=CCCCI Amb25278794 [2,0,0,0,0,0|1,0,0]=3 2985 B5R0.2 C=CCCCN Amb18299670 [2,0,0,0,0,0|1,0,0]=3 2986 B5R0.2 C=CCCCN Amb22001451 [2,0,0,0,0,0|1,0,0]=3 2987 B5R0.2 C=CCCCO Amb8513439 [2,0,0,0,0,0|0,0,0]=2 2988 B5R0.2 C=CCCC[CH2-] Amb32644015 [2,0,0,0,0,0|1,0,0]=3 2989 B5R0.2 C=CCCNC Amb18993048 [2,0,0,0,0,0|2,0,0]=4 2990 B5R0.2 C=CCCNC Amb33553635 [2,0,0,0,0,0|2,0,0]=4 2991 B5R0.2 C=CCCOC Amb28065418 [2,0,0,0,0,0|2,0,0]=4 2992 B5R0.2 C=CCCON Amb22233632 [2,0,0,0,0,0|2,0,0]=4 2993 B5R0.2 C=CCCON Amb22896384 [2,0,0,0,0,0|2,0,0]=4 2994 B5R0.2 C=CCCSC Amb24431590 [2,0,0,0,0,0|2,0,0]=4 2995 B5R0.2 C=CCNCC Amb13951161 [2,0,0,0,0,0|2,0,0]=4 2996 B5R0.2 C=CCNCC Amb6683951 [2,0,0,0,0,0|2,0,0]=4 2997 B5R0.2 C=CCOCBr Amb28384107 [2,0,0,0,0,0|2,0,0]=4 2998 B5R0.2 C=CCOCC Amb2684299 [2,0,0,0,0,0|2,0,0]=4 2999 B5R0.2 C=CCOCCl Amb28429831 [2,0,0,0,0,0|2,0,0]=4 3000 B5R0.2 C=CCSCC Amb6366495 [2,0,0,0,0,0|2,0,0]=4 3001 B5R0.2 C=CCSCCl Amb25859631 [2,0,0,0,0,0|2,0,0]=4 3002 B5R0.2 C=CC\C=C/C Amb26426294 [2,0,0,0,0,0|0,0,2]=4 3003 B5R0.2 C=CNCCC Amb27461242 [2,0,0,0,0,0|1,0,1]=4 3004 B5R0.2 C=COCCC Amb17940706 [2,0,0,0,0,0|1,0,1]=4 3005 B5R0.2 C=COCCI Amb28245341 [2,0,0,0,0,0|2,0,0]=4 3006 B5R0.2 C=COCCN Amb17593030 [2,0,0,0,0,0|2,0,0]=4 3007 B5R0.2 C=COCCN Amb32409664 [2,0,0,0,0,0|2,0,0]=4 3008 B5R0.2 C=COCCO Amb17674184 [2,0,0,0,0,0|1,0,0]=3 3009 B5R0.2 C=CSCCCl Amb27390785 [2,0,0,0,0,0|2,0,0]=4 3010 B5R0.2 C=CSCCO Amb27607172 [2,0,0,0,0,0|1,0,0]=3 3011 B5R0.2 C=C\C=C\CC Amb8513434 [2,0,0,0,0,0|0,0,2]=4 3012 B5R0.2 C=NCCCCl Amb28346586 [2,0,0,0,0,0|2,0,0]=4 3013 B5R0.2 CC#CCCC Amb8515369 [2,0,0,0,0,0|0,0,2]=4 3014 B5R0.2 CC#CCCO Amb2721725 [2,0,0,0,0,0|0,0,2]=4 3015 B5R0.2 CCC#CCC Amb8515372 [2,0,0,0,0,0|0,0,2]=4 3016 B5R0.2 CCC#CCO Amb2721726 [2,0,0,0,0,0|0,0,2]=4 3017 B5R0.2 CCCCC#N Amb6662839 [2,0,0,0,0,0|1,0,1]=4 3018 B5R0.2 CCCCC=O Amb3939655 [2,0,0,0,0,0|0,0,2]=4 3019 B5R0.2 CCCCCBr Amb3940084 [2,0,0,0,0,0|1,0,0]=3 3020 B5R0.2 CCCCCC Amb2447471 [2,0,0,0,0,0|0,0,1]=3 3021 B5R0.2 CCCCCCl Amb8514576 [2,0,0,0,0,0|1,0,0]=3 3022 B5R0.2 CCCCCF Amb10838686 [2,0,0,0,0,0|1,0,0]=3 3023 B5R0.2 CCCCCI Amb6891946 [2,0,0,0,0,0|1,0,0]=3 3024 B5R0.2 CCCCCN Amb3939830 [2,0,0,0,0,0|1,0,0]=3 3025 B5R0.2 CCCCCO Amb3939051 [2,0,0,0,0,0|0,0,0]=2 3026 B5R0.2 CCCCCS Amb8513287 [2,0,0,0,0,0|0,1,0]=3 3027 B5R0.2 CCCCC[SiH3] Amb19893989 [2,0,0,0,0,0|1,0,0]=3 3028 B5R0.2 CCCCNC Amb3939351 [2,0,0,0,0,0|1,0,1]=4 3029 B5R0.2 CCCCNN Amb1105203 [2,0,0,0,0,0|2,0,0]=4 3030 B5R0.2 CCCCNN Amb22230363 [2,0,0,0,0,0|2,0,0]=4 3031 B5R0.2 CCCCNN Amb33055062 [2,0,0,0,0,0|2,0,0]=4 3032 B5R0.2 CCCCNO Amb24686451 [2,0,0,0,0,0|1,0,0]=3 3033 B5R0.2 CCCCNO Amb32687485 [2,0,0,0,0,0|1,0,0]=3 3034 B5R0.2 CCCCON Amb17101066 [2,0,0,0,0,0|2,0,0]=4 3035 B5R0.2 CCCCON Amb6308542 [2,0,0,0,0,0|2,0,0]=4 3036 B5R0.2 CCCCSC Amb4036342 [2,0,0,0,0,0|1,0,1]=4 3037 B5R0.2 CCCNC=S Amb27754027 [2,0,0,0,0,0|2,0,0]=4 3038 B5R0.2 CCCNCC Amb3939843 [2,0,0,0,0,0|1,0,0]=3 3039 B5R0.2 CCCNNC Amb25283190 [2,0,0,0,0,0|2,0,0]=4 3040 B5R0.2 CCCOCBr Amb25351883 [2,0,0,0,0,0|2,0,0]=4 3041 B5R0.2 CCCOCC Amb17673668 [2,0,0,0,0,0|1,0,0]=3 3042 B5R0.2 CCCOCCl Amb22002403 [2,0,0,0,0,0|2,0,0]=4 3043 B5R0.2 CCCSCC Amb22168047 [2,0,0,0,0,0|1,0,0]=3 3044 B5R0.2 CCCSCCl Amb28146719 [2,0,0,0,0,0|2,0,0]=4 3045 B5R0.2 CCC\C=C\Br Amb17673688 [2,0,0,0,0,0|1,0,0]=3 3046 B5R0.2 CCC\C=C\Cl Amb25026521 [2,0,0,0,0,0|1,0,0]=3 3047 B5R0.2 CCC\C=C\N Amb27217273 [2,0,0,0,0,0|1,0,0]=3 3048 B5R0.2 CCC\C=N\O Amb27213413 [2,0,0,0,0,0|1,0,1]=4 3049 B5R0.2 CCNCCBr Amb27950012 [2,0,0,0,0,0|2,0,0]=4 3050 B5R0.2 CCNCCCl Amb17334050 [2,0,0,0,0,0|2,0,0]=4 3051 B5R0.2 CCNCCCl Amb33869917 [2,0,0,0,0,0|2,0,0]=4 3052 B5R0.2 CCNCCF Amb27858242 [2,0,0,0,0,0|2,0,0]=4 3053 B5R0.2 CCNCCI Amb27856942 [2,0,0,0,0,0|2,0,0]=4 3054 B5R0.2 CCNCCN Amb6297789 [2,0,0,0,0,0|2,0,0]=4 3055 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|1,0,0]=3 3056 B5R0.2 CCNCCO Amb3940070 [2,0,0,0,0,0|1,0,0]=3 3057 B5R0.2 CCNCCP Amb27188285 [2,0,0,0,0,0|2,0,0]=4 3058 B5R0.2 CCNNCC Amb16233609 [2,0,0,0,0,0|2,0,0]=4 3059 B5R0.2 CCNOCC Amb26852166 [2,0,0,0,0,0|2,0,0]=4 3060 B5R0.2 CCNOCC Amb32655926 [2,0,0,0,0,0|2,0,0]=4 3061 B5R0.2 CCOCCBr Amb1158671 [2,0,0,0,0,0|2,0,0]=4 3062 B5R0.2 CCOCCCl Amb8390350 [2,0,0,0,0,0|2,0,0]=4 3063 B5R0.2 CCOCCI Amb25117446 [2,0,0,0,0,0|2,0,0]=4 3064 B5R0.2 CCOCCN Amb1130918 [2,0,0,0,0,0|2,0,0]=4 3065 B5R0.2 CCOCCN Amb29844456 [2,0,0,0,0,0|2,0,0]=4 3066 B5R0.2 CCOCCO Amb3939142 [2,0,0,0,0,0|1,0,0]=3 3067 B5R0.2 CCOCCS Amb9316644 [2,0,0,0,0,0|1,1,0]=4 3068 B5R0.2 CCO\C=C/Br Amb2455970 [2,0,0,0,0,0|2,0,0]=4 3069 B5R0.2 CCO\C=C/Cl Amb28315611 [2,0,0,0,0,0|2,0,0]=4 3070 B5R0.2 CCO\C=C\Br Amb10068669 [2,0,0,0,0,0|2,0,0]=4 3071 B5R0.2 CCSCCBr Amb2685158 [2,0,0,0,0,0|2,0,0]=4 3072 B5R0.2 CCSCCCl Amb3940261 [2,0,0,0,0,0|2,0,0]=4 3073 B5R0.2 CCSCCN Amb2687948 [2,0,0,0,0,0|2,0,0]=4 3074 B5R0.2 CCSCCN Amb9825826 [2,0,0,0,0,0|2,0,0]=4 3075 B5R0.2 CCSCCO Amb1085958 [2,0,0,0,0,0|1,0,0]=3 3076 B5R0.2 CCSCCS Amb27167723 [2,0,0,0,0,0|1,1,0]=4 3077 B5R0.2 CCSSCC Amb8516624 [2,0,0,0,0,0|2,0,0]=4 3078 B5R0.2 CCS\C=C/Cl Amb28244706 [2,0,0,0,0,0|2,0,0]=4 3079 B5R0.2 CC[Se][Se]CC Amb17670683 [2,0,0,0,0,0|2,0,0]=4 3080 B5R0.2 CC\C=C/C#N Amb25707862 [2,0,0,0,0,0|1,0,1]=4 3081 B5R0.2 CC\C=C/CBr Amb33483269 [2,0,0,0,0,0|1,0,0]=3 3082 B5R0.2 CC\C=C/CC Amb8517211 [2,0,0,0,0,0|0,0,0]=2 3083 B5R0.2 CC\C=C/CO Amb10975881 [2,0,0,0,0,0|0,0,0]=2 3084 B5R0.2 CC\C=C\C#N Amb9703178 [2,0,0,0,0,0|1,0,1]=4 3085 B5R0.2 CC\C=C\C=O Amb33986391 [2,0,0,0,0,0|0,0,2]=4 3086 B5R0.2 CC\C=C\CBr Amb3940176 [2,0,0,0,0,0|1,0,0]=3 3087 B5R0.2 CC\C=C\CC Amb4016243 [2,0,0,0,0,0|0,0,0]=2 3088 B5R0.2 CC\C=C\CCl Amb33051993 [2,0,0,0,0,0|1,0,0]=3 3089 B5R0.2 CC\C=C\CI Amb27634949 [2,0,0,0,0,0|1,0,0]=3 3090 B5R0.2 CC\C=C\CN Amb27447017 [2,0,0,0,0,0|1,0,0]=3 3091 B5R0.2 CC\C=C\CN Amb33526952 [2,0,0,0,0,0|1,0,0]=3 3092 B5R0.2 CC\C=C\CO Amb22347892 [2,0,0,0,0,0|0,0,0]=2 3093 B5R0.2 CC\C=C\CS Amb33341360 [2,0,0,0,0,0|0,1,0]=3 3094 B5R0.2 CC\N=N/CC Amb27851864 [2,0,0,0,0,0|2,0,0]=4 3095 B5R0.2 CC\N=N\CC Amb17940073 [2,0,0,0,0,0|2,0,0]=4 3096 B5R0.2 CNCCCBr Amb28291325 [2,0,0,0,0,0|2,0,0]=4 3097 B5R0.2 CNCCCBr Amb33473632 [2,0,0,0,0,0|2,0,0]=4 3098 B5R0.2 CNCCCCl Amb22002154 [2,0,0,0,0,0|2,0,0]=4 3099 B5R0.2 CNCCCCl Amb3941419 [2,0,0,0,0,0|2,0,0]=4 3100 B5R0.2 CNCCCF Amb27405698 [2,0,0,0,0,0|2,0,0]=4 3101 B5R0.2 CNCCCN Amb2698065 [2,0,0,0,0,0|2,0,0]=4 3102 B5R0.2 CNCCCO Amb9246656 [2,0,0,0,0,0|1,0,0]=3 3103 B5R0.2 CNCCNO Amb27976196 [2,0,0,0,0,0|2,0,0]=4 3104 B5R0.2 CNC\C=C/I Amb23539307 [2,0,0,0,0,0|2,0,0]=4 3105 B5R0.2 CNOCCO Amb27637954 [2,0,0,0,0,0|2,0,0]=4 3106 B5R0.2 CN\C=C\NC Amb26415734 [2,0,0,0,0,0|2,0,0]=4 3107 B5R0.2 COCCCBr Amb8828205 [2,0,0,0,0,0|2,0,0]=4 3108 B5R0.2 COCCCCl Amb6255994 [2,0,0,0,0,0|2,0,0]=4 3109 B5R0.2 COCCCF Amb22007998 [2,0,0,0,0,0|2,0,0]=4 3110 B5R0.2 COCCCI Amb33546474 [2,0,0,0,0,0|2,0,0]=4 3111 B5R0.2 COCCCN Amb3939346 [2,0,0,0,0,0|2,0,0]=4 3112 B5R0.2 COCCCO Amb8385593 [2,0,0,0,0,0|1,0,0]=3 3113 B5R0.2 COCCCS Amb13952794 [2,0,0,0,0,0|1,1,0]=4 3114 B5R0.2 COCCNO Amb25284480 [2,0,0,0,0,0|2,0,0]=4 3115 B5R0.2 CONCCO Amb27658816 [2,0,0,0,0,0|2,0,0]=4 3116 B5R0.2 CO\C=C\OC Amb25986508 [2,0,0,0,0,0|2,0,0]=4 3117 B5R0.2 CSCCCBr Amb18180189 [2,0,0,0,0,0|2,0,0]=4 3118 B5R0.2 CSCCCCl Amb10602296 [2,0,0,0,0,0|2,0,0]=4 3119 B5R0.2 CSCCCN Amb33801570 [2,0,0,0,0,0|2,0,0]=4 3120 B5R0.2 CSCCCN Amb6718923 [2,0,0,0,0,0|2,0,0]=4 3121 B5R0.2 CSCCCO Amb3939523 [2,0,0,0,0,0|1,0,0]=3 3122 B5R0.2 CSCCCS Amb25744031 [2,0,0,0,0,0|1,1,0]=4 3123 B5R0.2 CSCCNO Amb33272071 [2,0,0,0,0,0|2,0,0]=4 3124 B5R0.2 CS\C=C\CCl Amb26494423 [2,0,0,0,0,0|2,0,0]=4 3125 B5R0.2 C[SiH2]CCCN Amb28049027 [2,0,0,0,0,0|1,1,0]=4 3126 B5R0.2 C\C=C/C=C/C Amb26318493 [2,0,0,0,0,0|0,0,2]=4 3127 B5R0.2 C\C=C/CCC Amb6366719 [2,0,0,0,0,0|0,0,0]=2 3128 B5R0.2 C\C=C/CCO Amb19930204 [2,0,0,0,0,0|0,0,0]=2 3129 B5R0.2 C\C=C\C=C\C Amb27622458 [2,0,0,0,0,0|0,0,2]=4 3130 B5R0.2 C\C=C\CC#N Amb2720721 [2,0,0,0,0,0|1,0,1]=4 3131 B5R0.2 C\C=C\CC=O Amb26655030 [2,0,0,0,0,0|0,0,2]=4 3132 B5R0.2 C\C=C\CCBr Amb32667161 [2,0,0,0,0,0|1,0,0]=3 3133 B5R0.2 C\C=C\CCCl Amb26978891 [2,0,0,0,0,0|1,0,0]=3 3134 B5R0.2 C\C=C\CCN Amb19374038 [2,0,0,0,0,0|1,0,0]=3 3135 B5R0.2 C\C=C\CCN Amb33038294 [2,0,0,0,0,0|1,0,0]=3 3136 B5R0.2 C\C=C\CCO Amb24655557 [2,0,0,0,0,0|0,0,0]=2 3137 B5R0.2 C\C=C\CNC Amb28049814 [2,0,0,0,0,0|1,0,0]=3 3138 B5R0.2 C\C=C\CON Amb18560216 [2,0,0,0,0,0|2,0,0]=4 3139 B5R0.2 C\C=C\OCC Amb8516635 [2,0,0,0,0,0|1,0,0]=3 3140 B5R0.2 C\C=C\SSC Amb9790327 [2,0,0,0,0,0|2,0,0]=4 3141 B5R0.2 C\C=N\CCC Amb27954749 [2,0,0,0,0,0|1,0,0]=3 3142 B5R0.2 C\C=N\CCN Amb27837883 [2,0,0,0,0,0|2,0,0]=4 3143 B5R0.2 ClCCCCBr Amb8391065 [2,0,0,0,0,0|2,0,0]=4 3144 B5R0.2 ClCCCCCl Amb6608890 [2,0,0,0,0,0|2,0,0]=4 3145 B5R0.2 ClCCCCI Amb8517518 [2,0,0,0,0,0|2,0,0]=4 3146 B5R0.2 ClC\C=C/CCl Amb17612607 [2,0,0,0,0,0|2,0,0]=4 3147 B5R0.2 ClC\C=C\CBr Amb25025755 [2,0,0,0,0,0|2,0,0]=4 3148 B5R0.2 ClC\C=C\CCl Amb33512860 [2,0,0,0,0,0|2,0,0]=4 3149 B5R0.2 ClC\C=C\CI Amb25810730 [2,0,0,0,0,0|2,0,0]=4 3150 B5R0.2 Cl\C=C\CCCl Amb25929864 [2,0,0,0,0,0|2,0,0]=4 3151 B5R0.2 Cl\C=C\CCI Amb27647471 [2,0,0,0,0,0|2,0,0]=4 3152 B5R0.2 FCCCCBr Amb2685210 [2,0,0,0,0,0|2,0,0]=4 3153 B5R0.2 FCCCCCl Amb27655616 [2,0,0,0,0,0|2,0,0]=4 3154 B5R0.2 FCCCCF Amb10839858 [2,0,0,0,0,0|2,0,0]=4 3155 B5R0.2 FCCCCI Amb28283837 [2,0,0,0,0,0|2,0,0]=4 3156 B5R0.2 FCCCCS Amb25065453 [2,0,0,0,0,0|1,1,0]=4 3157 B5R0.2 FC\C=C\CBr Amb27838048 [2,0,0,0,0,0|2,0,0]=4 3158 B5R0.2 FC\C=C\CF Amb27194556 [2,0,0,0,0,0|2,0,0]=4 3159 B5R0.2 ICCCCI Amb17672573 [2,0,0,0,0,0|2,0,0]=4 3160 B5R0.2 N#CCCCO Amb4021727 [2,0,0,0,0,0|1,0,1]=4 3161 B5R0.2 NCCCC=O Amb26851044 [2,0,0,0,0,0|2,0,0]=4 3162 B5R0.2 NCCCCBr Amb21858985 [2,0,0,0,0,0|2,0,0]=4 3163 B5R0.2 NCCCCCl Amb18640687 [2,0,0,0,0,0|2,0,0]=4 3164 B5R0.2 NCCCCCl Amb22233734 [2,0,0,0,0,0|2,0,0]=4 3165 B5R0.2 NCCCCF Amb26017241 [2,0,0,0,0,0|2,0,0]=4 3166 B5R0.2 NCCCCF Amb28555328 [2,0,0,0,0,0|2,0,0]=4 3167 B5R0.2 NCCCCI Amb27837961 [2,0,0,0,0,0|2,0,0]=4 3168 B5R0.2 NCCCCN Amb22489528 [2,0,0,0,0,0|2,0,0]=4 3169 B5R0.2 NCCCCN Amb6608640 [2,0,0,0,0,0|2,0,0]=4 3170 B5R0.2 NCCCCN Amb8514498 [2,0,0,0,0,0|2,0,0]=4 3171 B5R0.2 NCCCCO Amb3939336 [2,0,0,0,0,0|1,0,0]=3 3172 B5R0.2 NCCCCS Amb17500976 [2,0,0,0,0,0|1,1,0]=4 3173 B5R0.2 NCCCCS Amb22546260 [2,0,0,0,0,0|1,1,0]=4 3174 B5R0.2 NCCCNO Amb27882495 [2,0,0,0,0,0|2,0,0]=4 3175 B5R0.2 NCCCNO Amb32729324 [2,0,0,0,0,0|2,0,0]=4 3176 B5R0.2 NCC\C=C\Cl Amb27391191 [2,0,0,0,0,0|2,0,0]=4 3177 B5R0.2 NC\C=C/CCl Amb9825993 [2,0,0,0,0,0|2,0,0]=4 3178 B5R0.2 NC\C=C/CN Amb24093464 [2,0,0,0,0,0|2,0,0]=4 3179 B5R0.2 NC\C=C/CN Amb27795924 [2,0,0,0,0,0|2,0,0]=4 3180 B5R0.2 NC\C=C\CCl Amb32662005 [2,0,0,0,0,0|2,0,0]=4 3181 B5R0.2 NC\C=C\CCl Amb32668923 [2,0,0,0,0,0|2,0,0]=4 3182 B5R0.2 NC\C=C\CF Amb33429498 [2,0,0,0,0,0|2,0,0]=4 3183 B5R0.2 NC\C=C\CN Amb25131233 [2,0,0,0,0,0|2,0,0]=4 3184 B5R0.2 NC\C=C\CN Amb33548994 [2,0,0,0,0,0|2,0,0]=4 3185 B5R0.2 NC\C=C\CO Amb33212383 [2,0,0,0,0,0|1,0,0]=3 3186 B5R0.2 NC\C=C\CO Amb33495152 [2,0,0,0,0,0|1,0,0]=3 3187 B5R0.2 NNCCCO Amb19514839 [2,0,0,0,0,0|2,0,0]=4 3188 B5R0.2 NNCCCO Amb22058994 [2,0,0,0,0,0|2,0,0]=4 3189 B5R0.2 NOCCCO Amb18061671 [2,0,0,0,0,0|2,0,0]=4 3190 B5R0.2 O=CCCCBr Amb18644189 [2,0,0,0,0,0|2,0,0]=4 3191 B5R0.2 O=CCCCCl Amb8395190 [2,0,0,0,0,0|2,0,0]=4 3192 B5R0.2 O=CCCCF Amb24056028 [2,0,0,0,0,0|2,0,0]=4 3193 B5R0.2 O=CCCCI Amb27249641 [2,0,0,0,0,0|2,0,0]=4 3194 B5R0.2 O=CCCCO Amb24589235 [2,0,0,0,0,0|1,0,0]=3 3195 B5R0.2 O=COCCO Amb26625741 [2,0,0,0,0,0|2,0,0]=4 3196 B5R0.2 O=C\C=C\CO Amb24356008 [2,0,0,0,0,0|1,0,1]=4 3197 B5R0.2 OCCCCBr Amb8395353 [2,0,0,0,0,0|1,0,0]=3 3198 B5R0.2 OCCCCCl Amb1101976 [2,0,0,0,0,0|1,0,0]=3 3199 B5R0.2 OCCCCF Amb17593046 [2,0,0,0,0,0|1,0,0]=3 3200 B5R0.2 OCCCCO Amb2793029 [2,0,0,0,0,0|1,0,0]=3 3201 B5R0.2 OCCNCO Amb22228429 [2,0,0,0,0,0|2,0,0]=4 3202 B5R0.2 OCCOCCl Amb24673634 [2,0,0,0,0,0|2,0,0]=4 3203 B5R0.2 OCC\C=C\Br Amb27425005 [2,0,0,0,0,0|1,0,0]=3 3204 B5R0.2 OCC\C=C\Cl Amb27859286 [2,0,0,0,0,0|1,0,0]=3 3205 B5R0.2 OC\C=C/CO Amb8383639 [2,0,0,0,0,0|1,0,0]=3 3206 B5R0.2 OC\C=C\CBr Amb22054537 [2,0,0,0,0,0|1,0,0]=3 3207 B5R0.2 OC\C=C\CCl Amb17593109 [2,0,0,0,0,0|1,0,0]=3 3208 B5R0.2 OC\C=C\CF Amb33379282 [2,0,0,0,0,0|1,0,0]=3 3209 B5R0.2 OC\C=C\CO Amb22733427 [2,0,0,0,0,0|1,0,0]=3 3210 B5R0.2 OC\C=C\CO Amb6609016 [2,0,0,0,0,0|1,0,0]=3 3211 B5R0.2 ONCCCF Amb25931859 [2,0,0,0,0,0|2,0,0]=4 3212 B5R0.2 SCCCCS Amb8513069 [2,0,0,0,0,0|1,1,0]=4 3213 B5R0.2 [C-]#[N+]CCCC Amb2235001 [2,0,0,0,0,0|2,0,0]=4 3214 B7R0.3 C#CC(=C)CCCO Amb17593132 [1,1,0,0,0,0|0,0,2]=4 3215 B7R0.3 C#CC(=O)CCCO Amb27593195 [1,1,0,0,0,0|0,0,2]=4 3216 B7R0.3 C#CC(C)\C=C\CC Amb33267985 [1,1,0,0,0,0|0,0,2]=4 3217 B7R0.3 C#CC(O)C\C=C\C Amb28284578 [1,1,0,0,0,0|1,0,1]=4 3218 B7R0.3 C#C\C(C)=C\CCO Amb28206463 [1,1,0,0,0,0|0,0,2]=4 3219 B7R0.3 C#C\C=C\[C@@H](O)CC Amb27978765 [1,1,0,0,0,0|0,0,2]=4 3220 B7R0.3 C=C(C=O)CCCC Amb4025817 [1,1,0,0,0,0|2,0,0]=4 3221 B7R0.3 C=C(C=O)CCCO Amb28128165 [1,1,0,0,0,0|1,0,0]=3 3222 B7R0.3 C=C(CBr)CCCC Amb25249105 [1,1,0,0,0,0|1,0,1]=4 3223 B7R0.3 C=C(CBr)CCCCl Amb27865558 [1,1,0,0,0,0|2,0,0]=4 3224 B7R0.3 C=C(CC)CCC=O Amb27233336 [1,1,0,0,0,0|0,0,2]=4 3225 B7R0.3 C=C(CC)CCCBr Amb27491082 [1,1,0,0,0,0|1,0,0]=3 3226 B7R0.3 C=C(CC)CCCC Amb9787281 [1,1,0,0,0,0|0,0,1]=3 3227 B7R0.3 C=C(CC)CCCCl Amb28397002 [1,1,0,0,0,0|1,0,0]=3 3228 B7R0.3 C=C(CC)CCCN Amb27631266 [1,1,0,0,0,0|1,0,0]=3 3229 B7R0.3 C=C(CC)CCCO Amb26032857 [1,1,0,0,0,0|0,0,0]=2 3230 B7R0.3 C=C(CC)CCNC Amb28325353 [1,1,0,0,0,0|1,0,1]=4 3231 B7R0.3 C=C(CC)CSCC Amb28291726 [1,1,0,0,0,0|1,0,1]=4 3232 B7R0.3 C=C(CCl)CCCC Amb25889368 [1,1,0,0,0,0|1,0,1]=4 3233 B7R0.3 C=C(CN)CCCC Amb27630595 [1,1,0,0,0,0|1,0,1]=4 3234 B7R0.3 C=C(\C=C\CC)CBr Amb33480597 [1,1,0,0,0,0|1,0,1]=4 3235 B7R0.3 C=C(\C=C\CC)CCl Amb33057664 [1,1,0,0,0,0|1,0,1]=4 3236 B7R0.3 C=C(\C=C\CC)CN Amb33225015 [1,1,0,0,0,0|1,0,1]=4 3237 B7R0.3 C=C=C(C)CCCO Amb28321385 [1,1,0,0,0,0|0,0,2]=4 3238 B7R0.3 C=CC(=O)CCCC Amb25062494 [1,1,0,0,0,0|1,0,1]=4 3239 B7R0.3 C=CC(=O)CCCCl Amb24568327 [1,1,0,0,0,0|1,0,1]=4 3240 B7R0.3 C=CC(=O)NCCO Amb9361225 [1,1,0,0,0,0|1,0,1]=4 3241 B7R0.3 C=CC(Br)\C=C\CC Amb26887832 [1,1,0,0,0,0|0,0,2]=4 3242 B7R0.3 C=CC(C)CCCO Amb22641468 [1,1,0,0,0,0|0,0,2]=4 3243 B7R0.3 C=CC(C)C\C=C\C Amb4016446 [1,1,0,0,0,0|1,0,1]=4 3244 B7R0.3 C=CC(O)C\C=C/C Amb25983129 [1,1,0,0,0,0|1,0,1]=4 3245 B7R0.3 C=CC(O)C\C=C\C Amb27666343 [1,1,0,0,0,0|1,0,1]=4 3246 B7R0.3 C=CC(O)\C=C\CC Amb27451021 [1,1,0,0,0,0|0,0,2]=4 3247 B7R0.3 C=CCCC(=O)CC Amb9031676 [1,1,0,0,0,0|1,0,1]=4 3248 B7R0.3 C=CCCC(C)CO Amb27760347 [1,1,0,0,0,0|0,0,2]=4 3249 B7R0.3 C=CCCC(N)CO Amb33532619 [1,1,0,0,0,0|0,0,2]=4 3250 B7R0.3 C=CCCC(O)CO Amb10071251 [1,1,0,0,0,0|0,0,2]=4 3251 B7R0.3 C=CCC[C@@H](O)CO Amb27405919 [1,1,0,0,0,0|0,0,2]=4 3252 B7R0.3 C=CCC[C@H](N)CO Amb27390564 [1,1,0,0,0,0|0,0,2]=4 3253 B7R0.3 C=CC\C=C(/C)CC Amb24694420 [1,1,0,0,0,0|0,0,2]=4 3254 B7R0.3 C=COCC(O)CO Amb28321386 [1,1,0,0,0,0|1,0,1]=4 3255 B7R0.3 C=C[C@H](O)CCCO Amb27423134 [1,1,0,0,0,0|0,0,2]=4 3256 B7R0.3 C=C\C=C\C(O)CO Amb28074781 [1,1,0,0,0,0|0,0,2]=4 3257 B7R0.3 CC#CCC(N)CO Amb26475841 [1,1,0,0,0,0|0,0,2]=4 3258 B7R0.3 CC#CC[C@H](N)CO Amb27493024 [1,1,0,0,0,0|0,0,2]=4 3259 B7R0.3 CC#CC[C@H](O)CO Amb27805825 [1,1,0,0,0,0|0,0,2]=4 3260 B7R0.3 CC(CCl)CCCO Amb27439284 [1,1,0,0,0,0|1,0,1]=4 3261 B7R0.3 CC(CN)CCCO Amb17569906 [1,1,0,0,0,0|1,0,1]=4 3262 B7R0.3 CC(CN)CCCO Amb28934846 [1,1,0,0,0,0|1,0,1]=4 3263 B7R0.3 CC(CO)CCCN Amb17569904 [1,1,0,0,0,0|1,0,1]=4 3264 B7R0.3 CC(CO)CCCN Amb32686956 [1,1,0,0,0,0|1,0,1]=4 3265 B7R0.3 CC(CO)CCCO Amb25098490 [1,1,0,0,0,0|1,0,1]=4 3266 B7R0.3 CC(CO)CNC=O Amb27482480 [1,1,0,0,0,0|2,0,0]=4 3267 B7R0.3 CC(\C=C\CN)CO Amb26629186 [1,1,0,0,0,0|1,0,0]=3 3268 B7R0.3 CCC#CC(Br)CC Amb27232694 [1,1,0,0,0,0|0,0,2]=4 3269 B7R0.3 CCC#CC(C)CC Amb27860422 [1,1,0,0,0,0|0,0,2]=4 3270 B7R0.3 CCC#CC(O)CC Amb2721491 [1,1,0,0,0,0|0,0,2]=4 3271 B7R0.3 CCC#C[C@H](O)CC Amb28400640 [1,1,0,0,0,0|0,0,2]=4 3272 B7R0.3 CCC(=N)NCCF Amb28078284 [1,1,0,0,0,0|2,0,0]=4 3273 B7R0.3 CCC(=O)CCC#N Amb25321503 [1,1,0,0,0,0|1,0,1]=4 3274 B7R0.3 CCC(=O)CCCBr Amb25765636 [1,1,0,0,0,0|1,0,0]=3 3275 B7R0.3 CCC(=O)CCCCl Amb17593423 [1,1,0,0,0,0|1,0,0]=3 3276 B7R0.3 CCC(=O)CCCN Amb18833012 [1,1,0,0,0,0|1,0,0]=3 3277 B7R0.3 CCC(=O)CCNC Amb27963044 [1,1,0,0,0,0|1,0,1]=4 3278 B7R0.3 CCC(=O)CCSC Amb25680024 [1,1,0,0,0,0|1,0,1]=4 3279 B7R0.3 CCC(=O)NCCCl Amb17103188 [1,1,0,0,0,0|2,0,0]=4 3280 B7R0.3 CCC(=O)NCCF Amb27972779 [1,1,0,0,0,0|2,0,0]=4 3281 B7R0.3 CCC(=O)NCCN Amb1137732 [1,1,0,0,0,0|2,0,0]=4 3282 B7R0.3 CCC(=O)NCCN Amb32434788 [1,1,0,0,0,0|2,0,0]=4 3283 B7R0.3 CCC(=O)NCCN Amb33741516 [1,1,0,0,0,0|2,0,0]=4 3284 B7R0.3 CCC(=O)NCCO Amb5797470 [1,1,0,0,0,0|1,0,0]=3 3285 B7R0.3 CCC(=O)NCCS Amb24505089 [1,1,0,0,0,0|1,1,0]=4 3286 B7R0.3 CCC(=O)OCCBr Amb27424669 [1,1,0,0,0,0|2,0,0]=4 3287 B7R0.3 CCC(=O)OCCF Amb27981291 [1,1,0,0,0,0|2,0,0]=4 3288 B7R0.3 CCC(=O)OCCO Amb27217859 [1,1,0,0,0,0|1,0,0]=3 3289 B7R0.3 CCC(=O)SCCBr Amb27865550 [1,1,0,0,0,0|2,0,0]=4 3290 B7R0.3 CCC(=S)NCCO Amb27203312 [1,1,0,0,0,0|1,0,0]=3 3291 B7R0.3 CCC(=S)SCCCl Amb27461164 [1,1,0,0,0,0|2,0,0]=4 3292 B7R0.3 CCC(=S)\C=C\NC Amb27838915 [1,1,0,0,0,0|1,0,1]=4 3293 B7R0.3 CCC(Br)\C=N\OC Amb27658550 [1,1,0,0,0,0|2,0,0]=4 3294 B7R0.3 CCC(C)CCCBr Amb18184302 [1,1,0,0,0,0|1,0,1]=4 3295 B7R0.3 CCC(C)CCCCl Amb25094579 [1,1,0,0,0,0|1,0,1]=4 3296 B7R0.3 CCC(C)CCCN Amb17569898 [1,1,0,0,0,0|1,0,1]=4 3297 B7R0.3 CCC(C)CCCO Amb28070020 [1,1,0,0,0,0|0,0,1]=3 3298 B7R0.3 CCC(C)CCCS Amb33318441 [1,1,0,0,0,0|0,1,1]=4 3299 B7R0.3 CCC(C)CCNO Amb27442658 [1,1,0,0,0,0|1,0,1]=4 3300 B7R0.3 CCC(C)NCCO Amb6707239 [1,1,0,0,0,0|1,0,1]=4 3301 B7R0.3 CCC(C)\C=C\C=O Amb32954899 [1,1,0,0,0,0|1,0,1]=4 3302 B7R0.3 CCC(C)\C=C\CBr Amb27233120 [1,1,0,0,0,0|1,0,0]=3 3303 B7R0.3 CCC(C)\C=C\CN Amb33171992 [1,1,0,0,0,0|1,0,0]=3 3304 B7R0.3 CCC(C)\C=C\CO Amb32954901 [1,1,0,0,0,0|1,0,0]=3 3305 B7R0.3 CCC(Cl)CCCCl Amb19959959 [1,1,0,0,0,0|1,0,1]=4 3306 B7R0.3 CCC(N)CCCN Amb27392660 [1,1,0,0,0,0|1,0,1]=4 3307 B7R0.3 CCC(N)CCCO Amb18641929 [1,1,0,0,0,0|0,0,1]=3 3308 B7R0.3 CCC(N)C\C=C\Cl Amb35606913 [1,1,0,0,0,0|2,0,0]=4 3309 B7R0.3 CCC(O)CCCN Amb18202667 [1,1,0,0,0,0|1,0,1]=4 3310 B7R0.3 CCC(O)CCCN Amb19374975 [1,1,0,0,0,0|1,0,1]=4 3311 B7R0.3 CCC(O)CCCO Amb17593216 [1,1,0,0,0,0|0,0,1]=3 3312 B7R0.3 CCC(O)\C=C\C=O Amb16233610 [1,1,0,0,0,0|1,0,1]=4 3313 B7R0.3 CCC(O)\C=C\SC Amb27641903 [1,1,0,0,0,0|1,0,0]=3 3314 B7R0.3 CCCCC(=N)OC Amb17617956 [1,1,0,0,0,0|1,0,1]=4 3315 B7R0.3 CCCCC(=N)OC Amb25353357 [1,1,0,0,0,0|1,0,1]=4 3316 B7R0.3 CCCCC(=O)CBr Amb24563421 [1,1,0,0,0,0|1,0,1]=4 3317 B7R0.3 CCCCC(=O)CC Amb4605999 [1,1,0,0,0,0|0,0,1]=3 3318 B7R0.3 CCCCC(=O)CCl Amb17593420 [1,1,0,0,0,0|1,0,1]=4 3319 B7R0.3 CCCCC(=O)CN Amb24473062 [1,1,0,0,0,0|1,0,1]=4 3320 B7R0.3 CCCCC(=O)CO Amb26073501 [1,1,0,0,0,0|0,0,2]=4 3321 B7R0.3 CCCCC(=O)NC Amb5797766 [1,1,0,0,0,0|1,0,1]=4 3322 B7R0.3 CCCCC(=S)NC Amb27838397 [1,1,0,0,0,0|1,0,1]=4 3323 B7R0.3 CCCCC(Br)CBr Amb8517633 [1,1,0,0,0,0|1,0,1]=4 3324 B7R0.3 CCCCC(Br)CC Amb18804679 [1,1,0,0,0,0|0,0,2]=4 3325 B7R0.3 CCCCC(Br)CF Amb28410717 [1,1,0,0,0,0|1,0,1]=4 3326 B7R0.3 CCCCC(C)CBr Amb22227886 [1,1,0,0,0,0|1,0,1]=4 3327 B7R0.3 CCCCC(C)CC Amb10071971 [1,1,0,0,0,0|0,0,2]=4 3328 B7R0.3 CCCCC(C)CCl Amb24481359 [1,1,0,0,0,0|1,0,1]=4 3329 B7R0.3 CCCCC(C)CN Amb18311071 [1,1,0,0,0,0|1,0,1]=4 3330 B7R0.3 CCCCC(C)CO Amb17593205 [1,1,0,0,0,0|0,0,1]=3 3331 B7R0.3 CCCCC(Cl)CBr Amb27490970 [1,1,0,0,0,0|1,0,1]=4 3332 B7R0.3 CCCCC(Cl)CC Amb25361621 [1,1,0,0,0,0|0,0,2]=4 3333 B7R0.3 CCCCC(Cl)CCl Amb9787250 [1,1,0,0,0,0|1,0,1]=4 3334 B7R0.3 CCCCC(Cl)CN Amb31030967 [1,1,0,0,0,0|1,0,1]=4 3335 B7R0.3 CCCCC(F)CBr Amb27758689 [1,1,0,0,0,0|1,0,1]=4 3336 B7R0.3 CCCCC(F)CN Amb24117055 [1,1,0,0,0,0|1,0,1]=4 3337 B7R0.3 CCCCC(N)CC Amb33527796 [1,1,0,0,0,0|0,0,2]=4 3338 B7R0.3 CCCCC(N)CC Amb9031866 [1,1,0,0,0,0|0,0,2]=4 3339 B7R0.3 CCCCC(N)CN Amb19009750 [1,1,0,0,0,0|1,0,1]=4 3340 B7R0.3 CCCCC(N)CO Amb3939373 [1,1,0,0,0,0|0,0,1]=3 3341 B7R0.3 CCCCC(N)CS Amb27961155 [1,1,0,0,0,0|0,1,1]=4 3342 B7R0.3 CCCCC(O)CBr Amb25233429 [1,1,0,0,0,0|1,0,1]=4 3343 B7R0.3 CCCCC(O)CC Amb10844720 [1,1,0,0,0,0|0,0,2]=4 3344 B7R0.3 CCCCC(O)CCl Amb24481415 [1,1,0,0,0,0|1,0,1]=4 3345 B7R0.3 CCCCC(O)CF Amb27807497 [1,1,0,0,0,0|1,0,1]=4 3346 B7R0.3 CCCCC(O)CN Amb8630130 [1,1,0,0,0,0|1,0,1]=4 3347 B7R0.3 CCCCC(O)CO Amb8390318 [1,1,0,0,0,0|0,0,1]=3 3348 B7R0.3 CCCCC(S)CC Amb25314909 [1,1,0,0,0,0|0,0,2]=4 3349 B7R0.3 CCCCC(S)CN Amb27643759 [1,1,0,0,0,0|1,0,1]=4 3350 B7R0.3 CCCCN(N)CC Amb17593206 [1,1,0,0,0,0|1,0,1]=4 3351 B7R0.3 CCCCN(O)CC Amb27230146 [1,1,0,0,0,0|1,0,1]=4 3352 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [1,1,0,0,0,0|0,0,1]=3 3353 B7R0.3 CCCC[C@@H](C)CN Amb27780030 [1,1,0,0,0,0|1,0,1]=4 3354 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [1,1,0,0,0,0|0,0,1]=3 3355 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [1,1,0,0,0,0|0,0,1]=3 3356 B7R0.3 CCCC[C@@H](N)CC Amb28461624 [1,1,0,0,0,0|0,0,2]=4 3357 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [1,1,0,0,0,0|0,0,1]=3 3358 B7R0.3 CCCC[C@@H](O)CN Amb33428417 [1,1,0,0,0,0|1,0,1]=4 3359 B7R0.3 CCCC[C@H](C)CN Amb25889982 [1,1,0,0,0,0|1,0,1]=4 3360 B7R0.3 CCCC[C@H](C)CO Amb26370424 [1,1,0,0,0,0|0,0,1]=3 3361 B7R0.3 CCCC[C@H](F)CO Amb28315208 [1,1,0,0,0,0|0,0,1]=3 3362 B7R0.3 CCCC[C@H](N)CO Amb3941478 [1,1,0,0,0,0|0,0,1]=3 3363 B7R0.3 CCCC[C@H](O)CF Amb27656199 [1,1,0,0,0,0|1,0,1]=4 3364 B7R0.3 CCCC[C@H](O)CN Amb33428416 [1,1,0,0,0,0|1,0,1]=4 3365 B7R0.3 CCCC[C@H](S)CO Amb27804425 [1,1,0,0,0,0|0,0,1]=3 3366 B7R0.3 CCCC\C(Br)=C\Cl Amb27484205 [1,1,0,0,0,0|2,0,0]=4 3367 B7R0.3 CCCNC(=N)NC Amb28128375 [1,1,0,0,0,0|2,0,0]=4 3368 B7R0.3 CCCNC(=N)SC Amb27839564 [1,1,0,0,0,0|2,0,0]=4 3369 B7R0.3 CCCNC(=O)CBr Amb17330843 [1,1,0,0,0,0|2,0,0]=4 3370 B7R0.3 CCCNC(=O)CC Amb5797516 [1,1,0,0,0,0|1,0,0]=3 3371 B7R0.3 CCCNC(=O)CCl Amb1207068 [1,1,0,0,0,0|2,0,0]=4 3372 B7R0.3 CCCNC(=O)CI Amb23512283 [1,1,0,0,0,0|2,0,0]=4 3373 B7R0.3 CCCNC(=O)CN Amb10781813 [1,1,0,0,0,0|2,0,0]=4 3374 B7R0.3 CCCNC(=O)CN Amb426858 [1,1,0,0,0,0|2,0,0]=4 3375 B7R0.3 CCCNC(=O)CO Amb5798169 [1,1,0,0,0,0|2,0,0]=4 3376 B7R0.3 CCCNC(=S)NC Amb4016503 [1,1,0,0,0,0|2,0,0]=4 3377 B7R0.3 CCCNC(C)CC Amb3939844 [1,1,0,0,0,0|1,0,1]=4 3378 B7R0.3 CCCNC(C)CO Amb9359690 [1,1,0,0,0,0|1,0,1]=4 3379 B7R0.3 CCCOC(=O)CCl Amb9787444 [1,1,0,0,0,0|2,0,0]=4 3380 B7R0.3 CCCOC(=O)CN Amb9826861 [1,1,0,0,0,0|2,0,0]=4 3381 B7R0.3 CCCOC(=O)CO Amb25964379 [1,1,0,0,0,0|2,0,0]=4 3382 B7R0.3 CCCOC(=O)OC Amb27153532 [1,1,0,0,0,0|2,0,0]=4 3383 B7R0.3 CCCOC(C)CC Amb27250865 [1,1,0,0,0,0|1,0,1]=4 3384 B7R0.3 CCCOC(C)CO Amb26370350 [1,1,0,0,0,0|1,0,1]=4 3385 B7R0.3 CCCSC(=O)CBr Amb28385643 [1,1,0,0,0,0|2,0,0]=4 3386 B7R0.3 CCCSC(=O)CC Amb25882938 [1,1,0,0,0,0|1,0,0]=3 3387 B7R0.3 CCCSC(=O)NC Amb27788550 [1,1,0,0,0,0|2,0,0]=4 3388 B7R0.3 CCCSC(C)CC Amb4017932 [1,1,0,0,0,0|1,0,1]=4 3389 B7R0.3 CCCSC(C)CO Amb27593226 [1,1,0,0,0,0|1,0,1]=4 3390 B7R0.3 CCC\C=C(/C)CC Amb25260956 [1,1,0,0,0,0|0,0,0]=2 3391 B7R0.3 CCC\C=C(/C)CCl Amb27803634 [1,1,0,0,0,0|1,0,0]=3 3392 B7R0.3 CCC\C=C(/Cl)C=O Amb27201672 [1,1,0,0,0,0|1,0,1]=4 3393 B7R0.3 CCC\C=C(\C)CBr Amb27984757 [1,1,0,0,0,0|1,0,0]=3 3394 B7R0.3 CCC\C=C(\C)CN Amb27953132 [1,1,0,0,0,0|1,0,0]=3 3395 B7R0.3 CCC\C=C(\Cl)CCl Amb27656326 [1,1,0,0,0,0|1,0,0]=3 3396 B7R0.3 CCN(C)CCCCl Amb10608259 [1,1,0,0,0,0|2,0,0]=4 3397 B7R0.3 CCN(C)CCCCl Amb22587199 [1,1,0,0,0,0|2,0,0]=4 3398 B7R0.3 CCN(C)CCCF Amb27837917 [1,1,0,0,0,0|2,0,0]=4 3399 B7R0.3 CCN(C)CCCN Amb6670583 [1,1,0,0,0,0|2,0,0]=4 3400 B7R0.3 CCN(C)CCCO Amb8428182 [1,1,0,0,0,0|1,0,0]=3 3401 B7R0.3 CCN(O)CCCN Amb27839388 [1,1,0,0,0,0|2,0,0]=4 3402 B7R0.3 CCNCC(C)CC Amb20623802 [1,1,0,0,0,0|1,0,1]=4 3403 B7R0.3 CCNCC(C)CC Amb6719189 [1,1,0,0,0,0|1,0,1]=4 3404 B7R0.3 CCNCC(C)CCl Amb28254657 [1,1,0,0,0,0|2,0,0]=4 3405 B7R0.3 CCNCC(C)CN Amb18314895 [1,1,0,0,0,0|2,0,0]=4 3406 B7R0.3 CCNCC(Cl)CC Amb28049008 [1,1,0,0,0,0|1,0,1]=4 3407 B7R0.3 CCNCC(N)CC Amb18304998 [1,1,0,0,0,0|1,0,1]=4 3408 B7R0.3 CCNCC(O)CC Amb9870468 [1,1,0,0,0,0|1,0,1]=4 3409 B7R0.3 CCNCC(O)CCl Amb18124503 [1,1,0,0,0,0|2,0,0]=4 3410 B7R0.3 CCNCC(O)CF Amb26895337 [1,1,0,0,0,0|2,0,0]=4 3411 B7R0.3 CCNCC(O)CN Amb18062380 [1,1,0,0,0,0|2,0,0]=4 3412 B7R0.3 CCNCC(O)CO Amb8856483 [1,1,0,0,0,0|1,0,0]=3 3413 B7R0.3 CCNC[C@@H](N)CC Amb27588708 [1,1,0,0,0,0|1,0,1]=4 3414 B7R0.3 CCNC[C@@H](O)CC Amb28129052 [1,1,0,0,0,0|1,0,1]=4 3415 B7R0.3 CCNC[C@H](O)CC Amb26984963 [1,1,0,0,0,0|1,0,1]=4 3416 B7R0.3 CCNC[C@H](O)CO Amb27830790 [1,1,0,0,0,0|1,0,0]=3 3417 B7R0.3 CCOCC(=O)CC Amb27406475 [1,1,0,0,0,0|1,0,1]=4 3418 B7R0.3 CCOCC(=O)CO Amb28066809 [1,1,0,0,0,0|1,0,1]=4 3419 B7R0.3 CCOCC(Br)CF Amb32863276 [1,1,0,0,0,0|2,0,0]=4 3420 B7R0.3 CCOCC(Br)CO Amb27791752 [1,1,0,0,0,0|1,0,0]=3 3421 B7R0.3 CCOCC(C)CBr Amb26847509 [1,1,0,0,0,0|2,0,0]=4 3422 B7R0.3 CCOCC(C)CCl Amb26887689 [1,1,0,0,0,0|2,0,0]=4 3423 B7R0.3 CCOCC(C)CN Amb8868817 [1,1,0,0,0,0|2,0,0]=4 3424 B7R0.3 CCOCC(C)CO Amb25823989 [1,1,0,0,0,0|1,0,0]=3 3425 B7R0.3 CCOCC(Cl)CCl Amb27644856 [1,1,0,0,0,0|2,0,0]=4 3426 B7R0.3 CCOCC(Cl)CO Amb27974227 [1,1,0,0,0,0|1,0,0]=3 3427 B7R0.3 CCOCC(N)CC Amb17485991 [1,1,0,0,0,0|1,0,1]=4 3428 B7R0.3 CCOCC(N)CO Amb25890491 [1,1,0,0,0,0|1,0,0]=3 3429 B7R0.3 CCOCC(N)CO Amb32666301 [1,1,0,0,0,0|1,0,0]=3 3430 B7R0.3 CCOCC(O)CF Amb28321363 [1,1,0,0,0,0|2,0,0]=4 3431 B7R0.3 CCOCC(O)CN Amb31202384 [1,1,0,0,0,0|2,0,0]=4 3432 B7R0.3 CCOCC(O)CN Amb9707991 [1,1,0,0,0,0|2,0,0]=4 3433 B7R0.3 CCOCC(O)CO Amb19148881 [1,1,0,0,0,0|1,0,0]=3 3434 B7R0.3 CCOCC(S)CN Amb32788187 [1,1,0,0,0,0|2,0,0]=4 3435 B7R0.3 CCOC[C@@H](C)CN Amb33748152 [1,1,0,0,0,0|2,0,0]=4 3436 B7R0.3 CCOC[C@@H](C)CO Amb33735552 [1,1,0,0,0,0|1,0,0]=3 3437 B7R0.3 CCOC[C@@H](N)CO Amb27838360 [1,1,0,0,0,0|1,0,0]=3 3438 B7R0.3 CCOC[C@@H](N)CO Amb32653631 [1,1,0,0,0,0|1,0,0]=3 3439 B7R0.3 CCOC[C@H](C)CN Amb33747417 [1,1,0,0,0,0|2,0,0]=4 3440 B7R0.3 CCOC[C@H](C)CO Amb25999202 [1,1,0,0,0,0|1,0,0]=3 3441 B7R0.3 CCOC[C@H](N)CC Amb28400800 [1,1,0,0,0,0|1,0,1]=4 3442 B7R0.3 CCOC[C@H](O)CN Amb27457943 [1,1,0,0,0,0|2,0,0]=4 3443 B7R0.3 CCS(=O)CCCCl Amb27188737 [1,1,0,0,0,0|2,0,0]=4 3444 B7R0.3 CCS(=O)CCCN Amb18306016 [1,1,0,0,0,0|2,0,0]=4 3445 B7R0.3 CCS(=O)NCCO Amb28437123 [1,1,0,0,0,0|2,0,0]=4 3446 B7R0.3 CCSCC(C)CBr Amb26852087 [1,1,0,0,0,0|2,0,0]=4 3447 B7R0.3 CCSCC(C)CC Amb27395876 [1,1,0,0,0,0|1,0,1]=4 3448 B7R0.3 CCSCC(C)CCl Amb27469104 [1,1,0,0,0,0|2,0,0]=4 3449 B7R0.3 CCSCC(C)CN Amb9391465 [1,1,0,0,0,0|2,0,0]=4 3450 B7R0.3 CCSCC(F)CN Amb33324013 [1,1,0,0,0,0|2,0,0]=4 3451 B7R0.3 CCSCC(N)CC Amb17485958 [1,1,0,0,0,0|1,0,1]=4 3452 B7R0.3 CCSCC(N)CO Amb18643038 [1,1,0,0,0,0|1,0,0]=3 3453 B7R0.3 CCSCC(O)CBr Amb26957421 [1,1,0,0,0,0|2,0,0]=4 3454 B7R0.3 CCSCC(O)CC Amb27827536 [1,1,0,0,0,0|1,0,1]=4 3455 B7R0.3 CCSCC(O)CCl Amb17593873 [1,1,0,0,0,0|2,0,0]=4 3456 B7R0.3 CCSCC(O)CF Amb28062913 [1,1,0,0,0,0|2,0,0]=4 3457 B7R0.3 CCSCC(O)CN Amb6680865 [1,1,0,0,0,0|2,0,0]=4 3458 B7R0.3 CCSCC(O)CO Amb4019001 [1,1,0,0,0,0|1,0,0]=3 3459 B7R0.3 CCSC[C@@H](N)CO Amb26504944 [1,1,0,0,0,0|1,0,0]=3 3460 B7R0.3 CCSC[C@@H](O)CN Amb26370394 [1,1,0,0,0,0|2,0,0]=4 3461 B7R0.3 CCSC[C@H](N)CC Amb27987520 [1,1,0,0,0,0|1,0,1]=4 3462 B7R0.3 CCSC[C@H](N)CO Amb26564857 [1,1,0,0,0,0|1,0,0]=3 3463 B7R0.3 CCSC[C@H](O)CN Amb27213896 [1,1,0,0,0,0|2,0,0]=4 3464 B7R0.3 CCSSC(C)CC Amb28284462 [1,1,0,0,0,0|2,0,0]=4 3465 B7R0.3 CC[C@@H](C)CCCCl Amb27166913 [1,1,0,0,0,0|1,0,1]=4 3466 B7R0.3 CC[C@@H](C)CCCO Amb22799989 [1,1,0,0,0,0|0,0,1]=3 3467 B7R0.3 CC[C@@H](O)\C=C\C#N Amb27763639 [1,1,0,0,0,0|1,0,1]=4 3468 B7R0.3 CC[C@H](C)CCCBr Amb27619630 [1,1,0,0,0,0|1,0,1]=4 3469 B7R0.3 CC[C@H](C)CCCO Amb22226203 [1,1,0,0,0,0|0,0,1]=3 3470 B7R0.3 CC[C@H](C)\C=C\C=O Amb27873518 [1,1,0,0,0,0|1,0,1]=4 3471 B7R0.3 CC[C@H](O)\C=C\C=O Amb28070938 [1,1,0,0,0,0|1,0,1]=4 3472 B7R0.3 CC[PH](=O)OCCO Amb27456713 [1,1,0,0,0,0|2,0,0]=4 3473 B7R0.3 CC\C(Br)=C\CCO Amb28453501 [1,1,0,0,0,0|0,0,0]=2 3474 B7R0.3 CC\C(C)=C/CCO Amb25264354 [1,1,0,0,0,0|0,0,0]=2 3475 B7R0.3 CC\C(C)=C\CCBr Amb10070627 [1,1,0,0,0,0|1,0,0]=3 3476 B7R0.3 CC\C(C)=C\CCN Amb27243209 [1,1,0,0,0,0|1,0,0]=3 3477 B7R0.3 CC\C(C)=C\CCO Amb28388883 [1,1,0,0,0,0|0,0,0]=2 3478 B7R0.3 CC\C(C)=C\CNC Amb31161536 [1,1,0,0,0,0|1,0,0]=3 3479 B7R0.3 CC\C(C)=N\CCN Amb28126958 [1,1,0,0,0,0|2,0,0]=4 3480 B7R0.3 CC\C=C\C(=O)CBr Amb25251595 [1,1,0,0,0,0|1,0,1]=4 3481 B7R0.3 CC\C=C\C(=O)CC Amb25283354 [1,1,0,0,0,0|0,0,1]=3 3482 B7R0.3 CC\C=C\C(=O)CCl Amb33057661 [1,1,0,0,0,0|1,0,1]=4 3483 B7R0.3 CC\C=C\C(=O)CN Amb33268678 [1,1,0,0,0,0|1,0,1]=4 3484 B7R0.3 CC\C=C\C(=O)OC Amb2689583 [1,1,0,0,0,0|1,0,1]=4 3485 B7R0.3 CC\C=C\C(C)C#N Amb33269939 [1,1,0,0,0,0|1,0,1]=4 3486 B7R0.3 CC\C=C\C(C)C=O Amb33474380 [1,1,0,0,0,0|0,0,2]=4 3487 B7R0.3 CC\C=C\C(C)CBr Amb33009079 [1,1,0,0,0,0|1,0,0]=3 3488 B7R0.3 CC\C=C\C(C)CC Amb26433198 [1,1,0,0,0,0|0,0,0]=2 3489 B7R0.3 CC\C=C\C(C)CN Amb33269951 [1,1,0,0,0,0|1,0,0]=3 3490 B7R0.3 CC\C=C\C(C)ON Amb33268113 [1,1,0,0,0,0|2,0,0]=4 3491 B7R0.3 CC\C=C\C(F)C=O Amb26049149 [1,1,0,0,0,0|0,0,2]=4 3492 B7R0.3 CC\C=C\C(F)CN Amb33268199 [1,1,0,0,0,0|1,0,0]=3 3493 B7R0.3 CC\C=C\C(N)CO Amb33268713 [1,1,0,0,0,0|0,0,0]=2 3494 B7R0.3 CC\C=C\C(O)CBr Amb33009081 [1,1,0,0,0,0|1,0,0]=3 3495 B7R0.3 CC\C=C\C(O)CC Amb27619562 [1,1,0,0,0,0|0,0,0]=2 3496 B7R0.3 CC\C=C\C(O)CCl Amb33262139 [1,1,0,0,0,0|1,0,0]=3 3497 B7R0.3 CC\C=C\C(O)CF Amb33267982 [1,1,0,0,0,0|1,0,0]=3 3498 B7R0.3 CC\C=C\C(O)CN Amb33359770 [1,1,0,0,0,0|1,0,0]=3 3499 B7R0.3 CC\C=C\C(O)CO Amb32953425 [1,1,0,0,0,0|0,0,0]=2 3500 B7R0.3 CC\C=C\[C@@H](C)CO Amb28366044 [1,1,0,0,0,0|0,0,0]=2 3501 B7R0.3 CC\C=C\[C@@H](N)CO Amb33268251 [1,1,0,0,0,0|0,0,0]=2 3502 B7R0.3 CC\C=C\[C@@H](O)CC Amb28188274 [1,1,0,0,0,0|0,0,0]=2 3503 B7R0.3 CC\C=C\[C@@H](O)CN Amb33268255 [1,1,0,0,0,0|1,0,0]=3 3504 B7R0.3 CC\C=C\[C@H](N)CO Amb33268252 [1,1,0,0,0,0|0,0,0]=2 3505 B7R0.3 CC\C=C\[C@H](O)CN Amb33268254 [1,1,0,0,0,0|1,0,0]=3 3506 B7R0.3 CC\C=N\S(=O)CC Amb35726547 [1,1,0,0,0,0|2,0,0]=4 3507 B7R0.3 CN(C=O)CCCO Amb17593211 [1,1,0,0,0,0|2,0,0]=4 3508 B7R0.3 CNC(=N)SCCO Amb27625125 [1,1,0,0,0,0|2,0,0]=4 3509 B7R0.3 CNC(=O)CCCCl Amb1137464 [1,1,0,0,0,0|2,0,0]=4 3510 B7R0.3 CNC(=O)CCCI Amb27625606 [1,1,0,0,0,0|2,0,0]=4 3511 B7R0.3 CNC(=O)CCCN Amb6263864 [1,1,0,0,0,0|2,0,0]=4 3512 B7R0.3 CNC(=O)CCCN Amb9176288 [1,1,0,0,0,0|2,0,0]=4 3513 B7R0.3 CNC(=O)CCCO Amb17231829 [1,1,0,0,0,0|1,0,0]=3 3514 B7R0.3 CNC(=O)CCCS Amb27259921 [1,1,0,0,0,0|1,1,0]=4 3515 B7R0.3 CNC(=O)NCCO Amb24376074 [1,1,0,0,0,0|2,0,0]=4 3516 B7R0.3 CNC(=O)OCCO Amb3939460 [1,1,0,0,0,0|2,0,0]=4 3517 B7R0.3 CNC(=S)NCCO Amb4303417 [1,1,0,0,0,0|2,0,0]=4 3518 B7R0.3 CNC(C)CCCO Amb17569902 [1,1,0,0,0,0|1,0,1]=4 3519 B7R0.3 CNCCC(C)CO Amb17569900 [1,1,0,0,0,0|1,0,1]=4 3520 B7R0.3 COC(=N)CCCCl Amb16231406 [1,1,0,0,0,0|2,0,0]=4 3521 B7R0.3 COC(=N)CCCCl Amb27631457 [1,1,0,0,0,0|2,0,0]=4 3522 B7R0.3 COC(=N)CCCS Amb27628992 [1,1,0,0,0,0|1,1,0]=4 3523 B7R0.3 COC(=O)CCCBr Amb8516943 [1,1,0,0,0,0|2,0,0]=4 3524 B7R0.3 COC(=O)CCCCl Amb3940271 [1,1,0,0,0,0|2,0,0]=4 3525 B7R0.3 COC(=O)CCCI Amb3941711 [1,1,0,0,0,0|2,0,0]=4 3526 B7R0.3 COC(=O)CCCN Amb402626 [1,1,0,0,0,0|2,0,0]=4 3527 B7R0.3 COC(=O)CCCS Amb19373761 [1,1,0,0,0,0|1,1,0]=4 3528 B7R0.3 COC(=O)CCC[NH3+] Amb2778689 [1,1,0,0,0,0|2,0,0]=4 3529 B7R0.3 COC(=O)NCCO Amb9285601 [1,1,0,0,0,0|2,0,0]=4 3530 B7R0.3 COC(C)\C=C\CN Amb27841637 [1,1,0,0,0,0|2,0,0]=4 3531 B7R0.3 COCCC(N)CO Amb32952892 [1,1,0,0,0,0|1,0,1]=4 3532 B7R0.3 COCCC(N)CO Amb33532817 [1,1,0,0,0,0|1,0,1]=4 3533 B7R0.3 COCCC(O)CO Amb28128880 [1,1,0,0,0,0|1,0,1]=4 3534 B7R0.3 COCC[C@@H](N)CO Amb33377807 [1,1,0,0,0,0|1,0,1]=4 3535 B7R0.3 COCC[C@H](N)CO Amb25937729 [1,1,0,0,0,0|1,0,1]=4 3536 B7R0.3 COC\C=C(/Br)CCl Amb27477321 [1,1,0,0,0,0|2,0,0]=4 3537 B7R0.3 COC\C=C(\Cl)CCl Amb28428438 [1,1,0,0,0,0|2,0,0]=4 3538 B7R0.3 CON(C)CCCO Amb26370515 [1,1,0,0,0,0|2,0,0]=4 3539 B7R0.3 CO\N=C\C(O)CO Amb27978233 [1,1,0,0,0,0|2,0,0]=4 3540 B7R0.3 CSC(=O)CCCCl Amb27249585 [1,1,0,0,0,0|2,0,0]=4 3541 B7R0.3 CSC(=S)NCCO Amb25939436 [1,1,0,0,0,0|2,0,0]=4 3542 B7R0.3 CSCCC(N)CO Amb4036829 [1,1,0,0,0,0|1,0,1]=4 3543 B7R0.3 CSCCC(O)CO Amb26019209 [1,1,0,0,0,0|1,0,1]=4 3544 B7R0.3 CSCC[C@@H](N)CO Amb8516106 [1,1,0,0,0,0|1,0,1]=4 3545 B7R0.3 CSCC[C@H](N)CO Amb2720562 [1,1,0,0,0,0|1,0,1]=4 3546 B7R0.3 CSSCC(C)CO Amb27166642 [1,1,0,0,0,0|2,0,0]=4 3547 B7R0.3 C[C@@H](CN)CCCO Amb27947738 [1,1,0,0,0,0|1,0,1]=4 3548 B7R0.3 C[C@@H](CO)CCCBr Amb28128316 [1,1,0,0,0,0|1,0,1]=4 3549 B7R0.3 C[C@@H](CO)CCCO Amb27664197 [1,1,0,0,0,0|1,0,1]=4 3550 B7R0.3 C\C(=C/CCBr)CO Amb27454855 [1,1,0,0,0,0|2,0,0]=4 3551 B7R0.3 C\C(=C/CCCl)CCl Amb28422738 [1,1,0,0,0,0|2,0,0]=4 3552 B7R0.3 C\C(=C/CCCl)CO Amb27600969 [1,1,0,0,0,0|2,0,0]=4 3553 B7R0.3 C\C(=C\CCCl)CCl Amb27195288 [1,1,0,0,0,0|2,0,0]=4 3554 B7R0.3 C\C(C=O)=C/CCO Amb28255738 [1,1,0,0,0,0|1,0,1]=4 3555 B7R0.3 C\C(CCCO)=N/O Amb28207168 [1,1,0,0,0,0|2,0,0]=4 3556 B7R0.3 C\C=C(/C)CCCC Amb22229367 [1,1,0,0,0,0|1,0,0]=3 3557 B7R0.3 C\C=C(/C)NCCC Amb27881221 [1,1,0,0,0,0|1,0,1]=4 3558 B7R0.3 C\C=C(/Cl)CCCCl Amb27832144 [1,1,0,0,0,0|1,0,0]=3 3559 B7R0.3 C\C=C(\C)CCCBr Amb28325651 [1,1,0,0,0,0|1,0,0]=3 3560 B7R0.3 C\C=C(\C)CCCN Amb27412873 [1,1,0,0,0,0|1,0,0]=3 3561 B7R0.3 C\C=C(\C)NCCN Amb27838834 [1,1,0,0,0,0|2,0,0]=4 3562 B7R0.3 C\C=C(\Cl)CCCCl Amb27421928 [1,1,0,0,0,0|1,0,0]=3 3563 B7R0.3 C\C=C/CC(Cl)CC Amb27760501 [1,1,0,0,0,0|1,0,0]=3 3564 B7R0.3 C\C=C/CC(O)CCl Amb27217302 [1,1,0,0,0,0|1,0,0]=3 3565 B7R0.3 C\C=C\CC(=N)NO Amb26582540 [1,1,0,0,0,0|1,0,1]=4 3566 B7R0.3 C\C=C\CC(C)C=O Amb17593164 [1,1,0,0,0,0|0,0,2]=4 3567 B7R0.3 C\C=C\CC(N)CN Amb27482086 [1,1,0,0,0,0|1,0,0]=3 3568 B7R0.3 C\C=C\CC(N)CN Amb32718693 [1,1,0,0,0,0|1,0,0]=3 3569 B7R0.3 C\C=C\CC(N)CO Amb24625761 [1,1,0,0,0,0|0,0,0]=2 3570 B7R0.3 C\C=C\CC(N)CO Amb30585118 [1,1,0,0,0,0|0,0,0]=2 3571 B7R0.3 C\C=C\CC(O)CO Amb27761815 [1,1,0,0,0,0|0,0,0]=2 3572 B7R0.3 C\C=C\CN(C)CC Amb27956345 [1,1,0,0,0,0|2,0,0]=4 3573 B7R0.3 C\C=C\C[C@@H](C)CO Amb27650152 [1,1,0,0,0,0|0,0,0]=2 3574 B7R0.3 C\C=C\C[C@@H](O)CO Amb27981099 [1,1,0,0,0,0|0,0,0]=2 3575 B7R0.3 C\C=C\C[C@H](C)C=O Amb27403477 [1,1,0,0,0,0|0,0,2]=4 3576 B7R0.3 C\C=C\C[C@H](O)CO Amb27452087 [1,1,0,0,0,0|0,0,0]=2 3577 B7R0.3 C\C=C\SC(Cl)CC Amb28138039 [1,1,0,0,0,0|1,0,1]=4 3578 B7R0.3 N#C\C=C\C(Cl)CO Amb27793056 [1,1,0,0,0,0|1,0,1]=4 3579 B7R0.3 N=C(CCl)NCCO Amb28341725 [1,1,0,0,0,0|2,0,0]=4 3580 B7R0.3 NC(CO)CCCF Amb28069002 [1,1,0,0,0,0|1,0,1]=4 3581 B7R0.3 NC(CO)CCCO Amb18641979 [1,1,0,0,0,0|1,0,1]=4 3582 B7R0.3 NC(\C=C\CO)CO Amb27831437 [1,1,0,0,0,0|1,0,0]=3 3583 B7R0.3 NCC(=O)NCCO Amb9023087 [1,1,0,0,0,0|2,0,0]=4 3584 B7R0.3 NCCCC(N)CO Amb27665423 [1,1,0,0,0,0|1,0,1]=4 3585 B7R0.3 NCCCC(O)CO Amb27759884 [1,1,0,0,0,0|1,0,1]=4 3586 B7R0.3 NCC\C=C(/Cl)CN Amb27838982 [1,1,0,0,0,0|2,0,0]=4 3587 B7R0.3 NCC\C=C(\Cl)CN Amb28193495 [1,1,0,0,0,0|2,0,0]=4 3588 B7R0.3 NC[C@H](O)CCCO Amb27632965 [1,1,0,0,0,0|1,0,1]=4 3589 B7R0.3 NC\C(F)=C\CCO Amb28411180 [1,1,0,0,0,0|1,0,0]=3 3590 B7R0.3 NC\C=C\C(N)CF Amb26441962 [1,1,0,0,0,0|2,0,0]=4 3591 B7R0.3 NNC(=O)CCCO Amb535400 [1,1,0,0,0,0|2,0,0]=4 3592 B7R0.3 N[C@@H](CO)CCCO Amb28254525 [1,1,0,0,0,0|1,0,1]=4 3593 B7R0.3 N[C@H](CO)CCCO Amb24117047 [1,1,0,0,0,0|1,0,1]=4 3594 B7R0.3 O=C(CBr)CCCBr Amb27153779 [1,1,0,0,0,0|2,0,0]=4 3595 B7R0.3 O=C(CBr)CCCCl Amb27875989 [1,1,0,0,0,0|2,0,0]=4 3596 B7R0.3 O=C(CCl)CCCBr Amb22395325 [1,1,0,0,0,0|2,0,0]=4 3597 B7R0.3 O=C(CCl)CCCCl Amb22395285 [1,1,0,0,0,0|2,0,0]=4 3598 B7R0.3 O=C(CCl)NCCO Amb5716292 [1,1,0,0,0,0|2,0,0]=4 3599 B7R0.3 O=C(CO)CCCO Amb27227084 [1,1,0,0,0,0|1,0,0]=3 3600 B7R0.3 O=C(CO)NCCO Amb5798091 [1,1,0,0,0,0|2,0,0]=4 3601 B7R0.3 O=C(CS)OCCO Amb26476359 [1,1,0,0,0,0|2,0,0]=4 3602 B7R0.3 O=CC(=O)CCCO Amb27751348 [1,1,0,0,0,0|1,0,0]=3 3603 B7R0.3 O=CC(Cl)CCCO Amb27831369 [1,1,0,0,0,0|1,0,1]=4 3604 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [1,1,0,0,0,0|1,0,1]=4 3605 B7R0.3 O=C\C(Br)=C/CCO Amb27841266 [1,1,0,0,0,0|1,0,1]=4 3606 B7R0.3 O=C\C(F)=C\CCO Amb27798298 [1,1,0,0,0,0|1,0,1]=4 3607 B7R0.3 O=C\C=C\[C@H](O)CO Amb28208342 [1,1,0,0,0,0|1,0,1]=4 3608 B7R0.3 OCC(O)CCCCl Amb17593523 [1,1,0,0,0,0|1,0,1]=4 3609 B7R0.3 OCC(O)C\C=C\Br Amb27255231 [1,1,0,0,0,0|1,0,0]=3 3610 B7R0.3 OCCCC(Cl)CCl Amb27203325 [1,1,0,0,0,0|1,0,1]=4 3611 B7R0.3 OCCCC(O)CO Amb17593225 [1,1,0,0,0,0|1,0,1]=4 3612 B7R0.3 OCCCC(S)CS Amb27185627 [1,1,0,0,0,0|1,0,1]=4 3613 B7R0.3 OCCC[C@@H](O)CO Amb27213939 [1,1,0,0,0,0|1,0,1]=4 3614 B7R0.3 OCCC[C@H](Cl)CO Amb27165705 [1,1,0,0,0,0|1,0,1]=4 3615 B7R0.3 OCC\C=C(\Cl)CCl Amb27879840 [1,1,0,0,0,0|1,0,0]=3 3616 B7R0.3 OCOCC(O)CO Amb27181053 [1,1,0,0,0,0|2,0,0]=4 3617 B7R0.3 OC[C@@H](O)CCCCl Amb27235461 [1,1,0,0,0,0|1,0,1]=4 3618 B7R0.3 [C-]#[N+]C(C)\C=C\CC Amb33268262 [1,1,0,0,0,0|1,0,1]=4 3619 B7R0.4 C#CCCC=C(C)C Amb30023880 [1,1,0,0,0,0|1,0,1]=4 3620 B7R0.4 C=C(C)C#CCCO Amb2721683 [1,1,0,0,0,0|0,0,2]=4 3621 B7R0.4 C=C(C)CCCCC Amb6298938 [1,1,0,0,0,0|1,0,1]=4 3622 B7R0.4 C=C(C)CCCCO Amb26872404 [1,1,0,0,0,0|0,0,1]=3 3623 B7R0.4 C=C(C)CC\C=C\C Amb25746764 [1,1,0,0,0,0|1,0,1]=4 3624 B7R0.4 C=C(C)COCCO Amb27452088 [1,1,0,0,0,0|1,0,1]=4 3625 B7R0.4 C=C(C)C\C=C\CO Amb27181043 [1,1,0,0,0,0|1,0,1]=4 3626 B7R0.4 C=C(F)CCCCO Amb22641473 [1,1,0,0,0,0|0,0,2]=4 3627 B7R0.4 C=CCCC=C(C)C Amb25789441 [1,1,0,0,0,0|1,0,1]=4 3628 B7R0.4 C=CCCCC(C)O Amb22059432 [1,1,0,0,0,0|0,0,2]=4 3629 B7R0.4 C=C\C=C\C[C@@H](C)O Amb27946739 [1,1,0,0,0,0|0,0,2]=4 3630 B7R0.4 CC#C\C=C\C(C)Cl Amb28245258 [1,1,0,0,0,0|0,0,2]=4 3631 B7R0.4 CC#C\C=C\[C@@H](C)O Amb27431386 [1,1,0,0,0,0|0,0,2]=4 3632 B7R0.4 CC(=N)NCCCO Amb27967298 [1,1,0,0,0,0|1,0,0]=3 3633 B7R0.4 CC(=O)C#CCCO Amb28316149 [1,1,0,0,0,0|0,0,2]=4 3634 B7R0.4 CC(=O)C=C=CCO Amb28284681 [1,1,0,0,0,0|0,0,2]=4 3635 B7R0.4 CC(=O)CCCCBr Amb16234126 [1,1,0,0,0,0|1,0,1]=4 3636 B7R0.4 CC(=O)CCCCCl Amb3941549 [1,1,0,0,0,0|1,0,1]=4 3637 B7R0.4 CC(=O)CCCCF Amb27490855 [1,1,0,0,0,0|1,0,1]=4 3638 B7R0.4 CC(=O)CCCCN Amb27401218 [1,1,0,0,0,0|1,0,1]=4 3639 B7R0.4 CC(=O)CCCCO Amb10603864 [1,1,0,0,0,0|0,0,1]=3 3640 B7R0.4 CC(=O)COCCO Amb28122841 [1,1,0,0,0,0|1,0,1]=4 3641 B7R0.4 CC(=O)CSCCO Amb4165952 [1,1,0,0,0,0|1,0,1]=4 3642 B7R0.4 CC(=O)NCCCBr Amb8826231 [1,1,0,0,0,0|2,0,0]=4 3643 B7R0.4 CC(=O)NCCCCl Amb3886559 [1,1,0,0,0,0|2,0,0]=4 3644 B7R0.4 CC(=O)NCCCN Amb10610286 [1,1,0,0,0,0|2,0,0]=4 3645 B7R0.4 CC(=O)NCCCN Amb6664982 [1,1,0,0,0,0|2,0,0]=4 3646 B7R0.4 CC(=O)NCCCO Amb3429354 [1,1,0,0,0,0|1,0,0]=3 3647 B7R0.4 CC(=O)NOCCO Amb27484242 [1,1,0,0,0,0|2,0,0]=4 3648 B7R0.4 CC(=O)OCCCBr Amb26515737 [1,1,0,0,0,0|2,0,0]=4 3649 B7R0.4 CC(=O)OCCCCl Amb3940269 [1,1,0,0,0,0|2,0,0]=4 3650 B7R0.4 CC(=O)OCCCO Amb25854267 [1,1,0,0,0,0|1,0,0]=3 3651 B7R0.4 CC(=O)OCCCS Amb4018773 [1,1,0,0,0,0|1,1,0]=4 3652 B7R0.4 CC(=O)SCCCBr Amb17610077 [1,1,0,0,0,0|2,0,0]=4 3653 B7R0.4 CC(=O)SCCCCl Amb3940270 [1,1,0,0,0,0|2,0,0]=4 3654 B7R0.4 CC(=O)\C=C\CCF Amb33196081 [1,1,0,0,0,0|1,0,1]=4 3655 B7R0.4 CC(=O)\C=C\CCO Amb26479998 [1,1,0,0,0,0|0,0,1]=3 3656 B7R0.4 CC(=S)OCCCO Amb28381661 [1,1,0,0,0,0|1,0,0]=3 3657 B7R0.4 CC(Br)C=C=CCO Amb27484054 [1,1,0,0,0,0|0,0,2]=4 3658 B7R0.4 CC(Br)CCCCCl Amb27858670 [1,1,0,0,0,0|1,0,1]=4 3659 B7R0.4 CC(C)=C=CCCO Amb27265946 [1,1,0,0,0,0|0,0,2]=4 3660 B7R0.4 CC(C)=CCCC#N Amb18124144 [1,1,0,0,0,0|1,0,1]=4 3661 B7R0.4 CC(C)=CCCC=O Amb17593168 [1,1,0,0,0,0|0,0,2]=4 3662 B7R0.4 CC(C)=CCCCN Amb18641749 [1,1,0,0,0,0|1,0,0]=3 3663 B7R0.4 CC(C)=CCCCO Amb26478086 [1,1,0,0,0,0|0,0,0]=2 3664 B7R0.4 CC(C)=CCCON Amb35588109 [1,1,0,0,0,0|2,0,0]=4 3665 B7R0.4 CC(C)=COCCO Amb27662198 [1,1,0,0,0,0|1,0,0]=3 3666 B7R0.4 CC(C)=C\C=C\CO Amb28400370 [1,1,0,0,0,0|0,0,2]=4 3667 B7R0.4 CC(C)=NCCCN Amb28126946 [1,1,0,0,0,0|2,0,0]=4 3668 B7R0.4 CC(C)=NOCCO Amb8385274 [1,1,0,0,0,0|2,0,0]=4 3669 B7R0.4 CC(C)C=C=CCO Amb27424344 [1,1,0,0,0,0|0,0,2]=4 3670 B7R0.4 CC(C)CCCCBr Amb2721514 [1,1,0,0,0,0|1,0,1]=4 3671 B7R0.4 CC(C)CCCCCl Amb20670590 [1,1,0,0,0,0|1,0,1]=4 3672 B7R0.4 CC(C)CCCCN Amb33548422 [1,1,0,0,0,0|1,0,1]=4 3673 B7R0.4 CC(C)CCCCN Amb9304907 [1,1,0,0,0,0|1,0,1]=4 3674 B7R0.4 CC(C)CCCCO Amb3939382 [1,1,0,0,0,0|0,0,1]=3 3675 B7R0.4 CC(C)CCCCS Amb32788388 [1,1,0,0,0,0|0,1,1]=4 3676 B7R0.4 CC(C)CCNCO Amb27403355 [1,1,0,0,0,0|1,0,1]=4 3677 B7R0.4 CC(C)CNCCO Amb22587152 [1,1,0,0,0,0|1,0,1]=4 3678 B7R0.4 CC(C)CNCCO Amb6707299 [1,1,0,0,0,0|1,0,1]=4 3679 B7R0.4 CC(C)COCCO Amb3939640 [1,1,0,0,0,0|1,0,1]=4 3680 B7R0.4 CC(C)C\C=C\C=O Amb33359709 [1,1,0,0,0,0|1,0,1]=4 3681 B7R0.4 CC(C)C\C=C\CN Amb24615023 [1,1,0,0,0,0|1,0,0]=3 3682 B7R0.4 CC(C)C\C=C\CO Amb25851501 [1,1,0,0,0,0|1,0,0]=3 3683 B7R0.4 CC(C)NCCCF Amb27753882 [1,1,0,0,0,0|2,0,0]=4 3684 B7R0.4 CC(C)NCCCN Amb8515462 [1,1,0,0,0,0|2,0,0]=4 3685 B7R0.4 CC(C)NCCCO Amb22492397 [1,1,0,0,0,0|1,0,0]=3 3686 B7R0.4 CC(C)NCCCO Amb4422880 [1,1,0,0,0,0|1,0,0]=3 3687 B7R0.4 CC(C)OCCCBr Amb8828214 [1,1,0,0,0,0|2,0,0]=4 3688 B7R0.4 CC(C)OCCCCl Amb6255095 [1,1,0,0,0,0|2,0,0]=4 3689 B7R0.4 CC(C)OCCCN Amb6608864 [1,1,0,0,0,0|2,0,0]=4 3690 B7R0.4 CC(C)OCCCN Amb6892638 [1,1,0,0,0,0|2,0,0]=4 3691 B7R0.4 CC(C)OCCCO Amb10608350 [1,1,0,0,0,0|1,0,0]=3 3692 B7R0.4 CC(C)OCCCS Amb24551906 [1,1,0,0,0,0|1,1,0]=4 3693 B7R0.4 CC(C)OCCNO Amb33274852 [1,1,0,0,0,0|2,0,0]=4 3694 B7R0.4 CC(C)ONCCO Amb27421126 [1,1,0,0,0,0|2,0,0]=4 3695 B7R0.4 CC(C)SCCCBr Amb19053955 [1,1,0,0,0,0|2,0,0]=4 3696 B7R0.4 CC(C)SCCCN Amb10075505 [1,1,0,0,0,0|2,0,0]=4 3697 B7R0.4 CC(C)SCCCO Amb17502841 [1,1,0,0,0,0|1,0,0]=3 3698 B7R0.4 CC(C)\C=C\CC#N Amb24428238 [1,1,0,0,0,0|1,0,1]=4 3699 B7R0.4 CC(C)\C=C\CCBr Amb17570209 [1,1,0,0,0,0|1,0,0]=3 3700 B7R0.4 CC(C)\C=C\CCN Amb17569896 [1,1,0,0,0,0|1,0,0]=3 3701 B7R0.4 CC(C)\C=C\CCO Amb25117403 [1,1,0,0,0,0|0,0,0]=2 3702 B7R0.4 CC(C)\C=N\CCN Amb28072811 [1,1,0,0,0,0|2,0,0]=4 3703 B7R0.4 CC(F)CCCCCl Amb27596141 [1,1,0,0,0,0|1,0,1]=4 3704 B7R0.4 CC(N)CCCCBr Amb27814547 [1,1,0,0,0,0|1,0,1]=4 3705 B7R0.4 CC(N)CCCCCl Amb27867737 [1,1,0,0,0,0|1,0,1]=4 3706 B7R0.4 CC(N)CCCCF Amb25954668 [1,1,0,0,0,0|1,0,1]=4 3707 B7R0.4 CC(N)CCCCN Amb25214697 [1,1,0,0,0,0|1,0,1]=4 3708 B7R0.4 CC(N)CCCCN Amb33551364 [1,1,0,0,0,0|1,0,1]=4 3709 B7R0.4 CC(N)CCCCO Amb17569907 [1,1,0,0,0,0|0,0,1]=3 3710 B7R0.4 CC(N)CCCCO Amb28934868 [1,1,0,0,0,0|0,0,1]=3 3711 B7R0.4 CC(N)\C=C\CCF Amb33196065 [1,1,0,0,0,0|1,0,0]=3 3712 B7R0.4 CC(O)CCCC=O Amb18641887 [1,1,0,0,0,0|1,0,1]=4 3713 B7R0.4 CC(O)CCCCF Amb27486303 [1,1,0,0,0,0|1,0,1]=4 3714 B7R0.4 CC(O)CCCCN Amb17569903 [1,1,0,0,0,0|1,0,1]=4 3715 B7R0.4 CC(O)CCCCO Amb22227757 [1,1,0,0,0,0|0,0,1]=3 3716 B7R0.4 CC(O)CCCC[SiH3] Amb28322353 [1,1,0,0,0,0|0,1,1]=4 3717 B7R0.4 CC(O)CC\C=C\Cl Amb27878569 [1,1,0,0,0,0|1,0,0]=3 3718 B7R0.4 CC(O)CNCCO Amb4020001 [1,1,0,0,0,0|1,0,1]=4 3719 B7R0.4 CC(O)CSCCO Amb22055428 [1,1,0,0,0,0|1,0,1]=4 3720 B7R0.4 CC(O)C\C=C\C#N Amb18641649 [1,1,0,0,0,0|1,0,1]=4 3721 B7R0.4 CC(O)C\C=C\CO Amb27432058 [1,1,0,0,0,0|1,0,0]=3 3722 B7R0.4 CC(O)\C=C\CC#N Amb27394878 [1,1,0,0,0,0|1,0,1]=4 3723 B7R0.4 CC(O)\C=C\CCBr Amb27228895 [1,1,0,0,0,0|1,0,0]=3 3724 B7R0.4 CC(O)\C=C\CCO Amb28138579 [1,1,0,0,0,0|0,0,0]=2 3725 B7R0.4 CC(S)CCCCN Amb32788406 [1,1,0,0,0,0|1,0,1]=4 3726 B7R0.4 CCC#CCC(C)C Amb6336495 [1,1,0,0,0,0|0,0,2]=4 3727 B7R0.4 CCC#CCC(C)O Amb22045231 [1,1,0,0,0,0|0,0,2]=4 3728 B7R0.4 CCC#CC[C@@H](C)O Amb27659866 [1,1,0,0,0,0|0,0,2]=4 3729 B7R0.4 CCC=C=CC(C)N Amb27838389 [1,1,0,0,0,0|0,0,2]=4 3730 B7R0.4 CCCC#CC(C)Br Amb28384079 [1,1,0,0,0,0|0,0,2]=4 3731 B7R0.4 CCCC#CC(C)O Amb24273363 [1,1,0,0,0,0|0,0,2]=4 3732 B7R0.4 CCCC#C[C@@H](C)O Amb27826359 [1,1,0,0,0,0|0,0,2]=4 3733 B7R0.4 CCCCC=C(C)C Amb22228888 [1,1,0,0,0,0|1,0,0]=3 3734 B7R0.4 CCCCCB(O)O Amb2447470 [1,1,0,0,0,0|1,0,1]=4 3735 B7R0.4 CCCCCC(=O)O Amb3939846 [1,1,0,0,0,0|0,0,2]=4 3736 B7R0.4 CCCCCC(C)=O Amb6608885 [1,1,0,0,0,0|1,0,1]=4 3737 B7R0.4 CCCCCC(C)Br Amb3940202 [1,1,0,0,0,0|0,0,2]=4 3738 B7R0.4 CCCCCC(C)C Amb8513253 [1,1,0,0,0,0|0,0,2]=4 3739 B7R0.4 CCCCCC(C)Cl Amb22228752 [1,1,0,0,0,0|0,0,2]=4 3740 B7R0.4 CCCCCC(C)N Amb21962698 [1,1,0,0,0,0|0,0,2]=4 3741 B7R0.4 CCCCCC(C)N Amb3939364 [1,1,0,0,0,0|0,0,2]=4 3742 B7R0.4 CCCCCC(C)O Amb8383668 [1,1,0,0,0,0|0,0,1]=3 3743 B7R0.4 CCCCCC(C)S Amb17939452 [1,1,0,0,0,0|0,0,2]=4 3744 B7R0.4 CCCCCC(Cl)Cl Amb27206941 [1,1,0,0,0,0|1,0,1]=4 3745 B7R0.4 CCCCCC(F)Br Amb24641242 [1,1,0,0,0,0|1,0,1]=4 3746 B7R0.4 CCCCCC(O)Cl Amb27232933 [1,1,0,0,0,0|0,0,1]=3 3747 B7R0.4 CCCCCC(O)O Amb25921998 [1,1,0,0,0,0|0,0,1]=3 3748 B7R0.4 CCCCCN(C)O Amb33428427 [1,1,0,0,0,0|1,0,1]=4 3749 B7R0.4 CCCCC[C@@H](C)N Amb3941400 [1,1,0,0,0,0|0,0,2]=4 3750 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,1,0,0,0,0|0,0,1]=3 3751 B7R0.4 CCCCC[C@H](C)N Amb8516349 [1,1,0,0,0,0|0,0,2]=4 3752 B7R0.4 CCCCC[C@H](C)O Amb8395591 [1,1,0,0,0,0|0,0,1]=3 3753 B7R0.4 CCCCNC(C)=N Amb27663050 [1,1,0,0,0,0|2,0,0]=4 3754 B7R0.4 CCCCNC(C)=O Amb5835711 [1,1,0,0,0,0|2,0,0]=4 3755 B7R0.4 CCCCNC(C)C Amb2111112 [1,1,0,0,0,0|1,0,1]=4 3756 B7R0.4 CCCCNC(C)C Amb6251422 [1,1,0,0,0,0|1,0,1]=4 3757 B7R0.4 CCCCOC(C)=O Amb6608782 [1,1,0,0,0,0|2,0,0]=4 3758 B7R0.4 CCCCOC(C)Cl Amb17689402 [1,1,0,0,0,0|1,0,1]=4 3759 B7R0.4 CCCCOC(C)O Amb26537694 [1,1,0,0,0,0|1,0,1]=4 3760 B7R0.4 CCCCSC(C)C Amb4020661 [1,1,0,0,0,0|1,0,1]=4 3761 B7R0.4 CCCCSC(C)O Amb27191967 [1,1,0,0,0,0|1,0,1]=4 3762 B7R0.4 CCCNCC(C)C Amb6258024 [1,1,0,0,0,0|1,0,1]=4 3763 B7R0.4 CCCNCC(C)O Amb9359420 [1,1,0,0,0,0|1,0,1]=4 3764 B7R0.4 CCCNCC(C)S Amb18124358 [1,1,0,0,0,0|1,0,1]=4 3765 B7R0.4 CCCNC[C@@H](C)N Amb27835548 [1,1,0,0,0,0|1,0,1]=4 3766 B7R0.4 CCCNOC(C)C Amb27203616 [1,1,0,0,0,0|2,0,0]=4 3767 B7R0.4 CCCOC[C@@H](C)N Amb28048953 [1,1,0,0,0,0|1,0,1]=4 3768 B7R0.4 CCCOC[C@@H](C)O Amb28048955 [1,1,0,0,0,0|1,0,1]=4 3769 B7R0.4 CCCSCC(C)C Amb4017817 [1,1,0,0,0,0|1,0,1]=4 3770 B7R0.4 CCCSCC(C)O Amb27463818 [1,1,0,0,0,0|1,0,1]=4 3771 B7R0.4 CCCSCC(C)S Amb32788151 [1,1,0,0,0,0|1,0,1]=4 3772 B7R0.4 CCCSC[C@@H](C)O Amb27641885 [1,1,0,0,0,0|1,0,1]=4 3773 B7R0.4 CCCSSC(C)C Amb25952313 [1,1,0,0,0,0|2,0,0]=4 3774 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [1,1,0,0,0,0|0,0,1]=3 3775 B7R0.4 CCC\C=C\C(=N)N Amb33358507 [1,1,0,0,0,0|1,0,1]=4 3776 B7R0.4 CCC\C=C\C(=O)Cl Amb2688716 [1,1,0,0,0,0|1,0,1]=4 3777 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [1,1,0,0,0,0|1,0,1]=4 3778 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [1,1,0,0,0,0|0,0,1]=3 3779 B7R0.4 CCC\C=C\C(C)C Amb4019553 [1,1,0,0,0,0|0,0,0]=2 3780 B7R0.4 CCC\C=C\C(C)N Amb33374704 [1,1,0,0,0,0|0,0,0]=2 3781 B7R0.4 CCC\C=C\C(C)O Amb25083446 [1,1,0,0,0,0|0,0,0]=2 3782 B7R0.4 CCC\C=C\C(Cl)Cl Amb28385533 [1,1,0,0,0,0|1,0,0]=3 3783 B7R0.4 CCC\C=C\C(N)=O Amb26397290 [1,1,0,0,0,0|1,0,1]=4 3784 B7R0.4 CCC\C=C\[C@@H](C)N Amb33327161 [1,1,0,0,0,0|0,0,0]=2 3785 B7R0.4 CCC\C=C\[C@@H](C)O Amb33429966 [1,1,0,0,0,0|0,0,0]=2 3786 B7R0.4 CCC\C=C\[C@H](C)N Amb33327160 [1,1,0,0,0,0|0,0,0]=2 3787 B7R0.4 CCC\C=C\[C@H](C)O Amb27857282 [1,1,0,0,0,0|0,0,0]=2 3788 B7R0.4 CCC\C=C\[N+](=O)[O-] Amb24558342 [1,1,0,0,0,0|2,0,0]=4 3789 B7R0.4 CCC\C=N\S(C)=O Amb29858759 [1,1,0,0,0,0|2,0,0]=4 3790 B7R0.4 CCNCCC(=O)O Amb28934794 [1,1,0,0,0,0|1,0,1]=4 3791 B7R0.4 CCNCCC(=O)O Amb7766402 [1,1,0,0,0,0|1,0,1]=4 3792 B7R0.4 CCNCCC(C)C Amb6244455 [1,1,0,0,0,0|1,0,1]=4 3793 B7R0.4 CCNCCC(C)O Amb27239293 [1,1,0,0,0,0|1,0,0]=3 3794 B7R0.4 CCOCCC(=O)O Amb3939859 [1,1,0,0,0,0|1,0,1]=4 3795 B7R0.4 CCOCCC(C)Cl Amb28422675 [1,1,0,0,0,0|1,0,1]=4 3796 B7R0.4 CCOCCC(C)N Amb7772189 [1,1,0,0,0,0|1,0,1]=4 3797 B7R0.4 CCOCCC(C)O Amb27852957 [1,1,0,0,0,0|1,0,0]=3 3798 B7R0.4 CCOCCC(Cl)Cl Amb27984892 [1,1,0,0,0,0|2,0,0]=4 3799 B7R0.4 CCOCC[C@H](C)N Amb24439507 [1,1,0,0,0,0|1,0,1]=4 3800 B7R0.4 CCOCC[C@H](C)O Amb27946039 [1,1,0,0,0,0|1,0,0]=3 3801 B7R0.4 CCO\C=C\C(C)=O Amb25330041 [1,1,0,0,0,0|1,0,1]=4 3802 B7R0.4 CCO\C=C\C(C)C Amb22261439 [1,1,0,0,0,0|1,0,0]=3 3803 B7R0.4 CCSCCC(=O)O Amb6273140 [1,1,0,0,0,0|1,0,1]=4 3804 B7R0.4 CCSCCC(C)Br Amb33435746 [1,1,0,0,0,0|1,0,1]=4 3805 B7R0.4 CCSCCC(C)C Amb22230685 [1,1,0,0,0,0|1,0,1]=4 3806 B7R0.4 CCSCCC(C)Cl Amb28458510 [1,1,0,0,0,0|1,0,1]=4 3807 B7R0.4 CCSCCC(C)N Amb19149259 [1,1,0,0,0,0|1,0,1]=4 3808 B7R0.4 CCSCCC(C)O Amb28048927 [1,1,0,0,0,0|1,0,0]=3 3809 B7R0.4 CCSCCN(C)O Amb33324043 [1,1,0,0,0,0|2,0,0]=4 3810 B7R0.4 CCSCC[C@@H](C)N Amb33323734 [1,1,0,0,0,0|1,0,1]=4 3811 B7R0.4 CCSCC[C@@H](C)O Amb33223925 [1,1,0,0,0,0|1,0,0]=3 3812 B7R0.4 CCSCC[C@H](C)N Amb33323728 [1,1,0,0,0,0|1,0,1]=4 3813 B7R0.4 CCSCC[C@H](C)O Amb33323733 [1,1,0,0,0,0|1,0,0]=3 3814 B7R0.4 CCS\C=C/C(C)=O Amb28122375 [1,1,0,0,0,0|1,0,1]=4 3815 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [1,1,0,0,0,0|0,0,1]=3 3816 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [1,1,0,0,0,0|0,0,1]=3 3817 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [1,1,0,0,0,0|0,0,2]=4 3818 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [1,1,0,0,0,0|0,0,1]=3 3819 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [1,1,0,0,0,0|0,0,1]=3 3820 B7R0.4 CC\C=C\CC(C)Br Amb33009075 [1,1,0,0,0,0|0,0,0]=2 3821 B7R0.4 CC\C=C\CC(C)C Amb4016285 [1,1,0,0,0,0|0,0,0]=2 3822 B7R0.4 CC\C=C\CC(C)N Amb25357984 [1,1,0,0,0,0|0,0,0]=2 3823 B7R0.4 CC\C=C\CC(C)O Amb33079090 [1,1,0,0,0,0|0,0,0]=2 3824 B7R0.4 CC\C=C\CC(N)=S Amb33225501 [1,1,0,0,0,0|0,1,1]=4 3825 B7R0.4 CC\C=C\CN(C)O Amb33268704 [1,1,0,0,0,0|1,0,0]=3 3826 B7R0.4 CC\C=C\C[C@@H](C)N Amb33225016 [1,1,0,0,0,0|0,0,0]=2 3827 B7R0.4 CC\C=C\C[C@@H](C)O Amb33359513 [1,1,0,0,0,0|0,0,0]=2 3828 B7R0.4 CC\C=C\C[C@H](C)N Amb33267988 [1,1,0,0,0,0|0,0,0]=2 3829 B7R0.4 CC\C=C\C[C@H](C)O Amb33474377 [1,1,0,0,0,0|0,0,0]=2 3830 B7R0.4 CC\C=C\C[N+](=O)[O-] Amb33267962 [1,1,0,0,0,0|1,0,1]=4 3831 B7R0.4 CC\C=C\C[PH](=O)O Amb8391288 [1,1,0,0,0,0|1,0,0]=3 3832 B7R0.4 CN(C)CCCCO Amb9273966 [1,1,0,0,0,0|1,0,1]=4 3833 B7R0.4 CN(C)C\C=C\CCl Amb27816601 [1,1,0,0,0,0|2,0,0]=4 3834 B7R0.4 CN(N)CCCCO Amb28133877 [1,1,0,0,0,0|1,0,1]=4 3835 B7R0.4 CNCCCC(C)O Amb17569899 [1,1,0,0,0,0|1,0,1]=4 3836 B7R0.4 CNCCC[C@@H](C)O Amb27784601 [1,1,0,0,0,0|1,0,1]=4 3837 B7R0.4 CNC\C=C\C(C)C Amb27828260 [1,1,0,0,0,0|1,0,0]=3 3838 B7R0.4 COCCCC(C)O Amb4020863 [1,1,0,0,0,0|1,0,1]=4 3839 B7R0.4 COCCC[C@@H](C)O Amb33428680 [1,1,0,0,0,0|1,0,1]=4 3840 B7R0.4 COCCC[C@H](C)O Amb27396064 [1,1,0,0,0,0|1,0,1]=4 3841 B7R0.4 COC\C=C\C(C)=O Amb33359822 [1,1,0,0,0,0|1,0,1]=4 3842 B7R0.4 COC\C=C\C(C)Cl Amb27791751 [1,1,0,0,0,0|1,0,0]=3 3843 B7R0.4 COC\C=C\C(C)N Amb33429413 [1,1,0,0,0,0|1,0,0]=3 3844 B7R0.4 CSCCCC(C)O Amb25958947 [1,1,0,0,0,0|1,0,1]=4 3845 B7R0.4 CSCCC[C@@H](C)O Amb33198286 [1,1,0,0,0,0|1,0,1]=4 3846 B7R0.4 CSCCC[C@H](C)O Amb33198288 [1,1,0,0,0,0|1,0,1]=4 3847 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [1,1,0,0,0,0|1,0,1]=4 3848 B7R0.4 CSC\C=C\C(C)=O Amb33359530 [1,1,0,0,0,0|1,0,1]=4 3849 B7R0.4 CSC\C=C\C(C)Cl Amb27267373 [1,1,0,0,0,0|1,0,0]=3 3850 B7R0.4 CSC\C=C\C(C)N Amb33269663 [1,1,0,0,0,0|1,0,0]=3 3851 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [1,1,0,0,0,0|1,0,1]=4 3852 B7R0.4 C[C@@H](N)CCCCF Amb33196127 [1,1,0,0,0,0|1,0,1]=4 3853 B7R0.4 C[C@@H](O)CCCCBr Amb28343132 [1,1,0,0,0,0|1,0,1]=4 3854 B7R0.4 C[C@@H](O)CCCCCl Amb8517538 [1,1,0,0,0,0|1,0,1]=4 3855 B7R0.4 C[C@@H](O)CCCCF Amb33196128 [1,1,0,0,0,0|1,0,1]=4 3856 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [1,1,0,0,0,0|1,0,1]=4 3857 B7R0.4 C[C@H](F)CCCCO Amb27945000 [1,1,0,0,0,0|0,0,1]=3 3858 B7R0.4 C[C@H](N)CCCCF Amb33480694 [1,1,0,0,0,0|1,0,1]=4 3859 B7R0.4 C[C@H](O)CCCCF Amb33196129 [1,1,0,0,0,0|1,0,1]=4 3860 B7R0.4 C[C@H](O)CCCCO Amb28381637 [1,1,0,0,0,0|0,0,1]=3 3861 B7R0.4 C[C@H](O)C\C=C\CO Amb27945050 [1,1,0,0,0,0|1,0,0]=3 3862 B7R0.4 C[SiH](C)OCCCO Amb28065227 [1,1,0,0,0,0|1,1,0]=4 3863 B7R0.4 C\C(Br)=C\CCCBr Amb22347606 [1,1,0,0,0,0|1,0,0]=3 3864 B7R0.4 C\C(Cl)=C\CCC=O Amb27792418 [1,1,0,0,0,0|0,0,2]=4 3865 B7R0.4 C\C(Cl)=C\CCCO Amb27211291 [1,1,0,0,0,0|0,0,0]=2 3866 B7R0.4 C\C=C\C#CC(C)O Amb28053910 [1,1,0,0,0,0|0,0,2]=4 3867 B7R0.4 C\C=C\C=C/C(C)O Amb22342426 [1,1,0,0,0,0|0,0,2]=4 3868 B7R0.4 C\C=C\C=C\C(C)O Amb27843477 [1,1,0,0,0,0|0,0,2]=4 3869 B7R0.4 C\C=C\C=C\[C@@H](C)O Amb27223068 [1,1,0,0,0,0|0,0,2]=4 3870 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [1,1,0,0,0,0|0,0,1]=3 3871 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [1,1,0,0,0,0|0,0,2]=4 3872 B7R0.4 C\C=C\CCC(C)Br Amb25889216 [1,1,0,0,0,0|1,0,0]=3 3873 B7R0.4 C\C=C\CCC(C)C Amb24401080 [1,1,0,0,0,0|1,0,0]=3 3874 B7R0.4 C\C=C\CCC(C)N Amb27838292 [1,1,0,0,0,0|1,0,0]=3 3875 B7R0.4 C\C=C\CCC(C)O Amb32665057 [1,1,0,0,0,0|0,0,0]=2 3876 B7R0.4 C\C=C\CC[C@@H](C)O Amb27652940 [1,1,0,0,0,0|0,0,0]=2 3877 B7R0.4 C\C=C\CNC(C)C Amb18641745 [1,1,0,0,0,0|2,0,0]=4 3878 B7R0.4 C\C=C\NCC(C)C Amb27839051 [1,1,0,0,0,0|1,0,1]=4 3879 B7R0.4 ClCCCC=C(Cl)Cl Amb28284505 [1,1,0,0,0,0|2,0,0]=4 3880 B7R0.4 FC(F)\C=C\CCCl Amb27408007 [1,1,0,0,0,0|2,0,0]=4 3881 B7R0.4 NC(=O)CCCCO Amb3939470 [1,1,0,0,0,0|1,0,1]=4 3882 B7R0.4 NC(=O)NCCCO Amb9248133 [1,1,0,0,0,0|2,0,0]=4 3883 B7R0.4 NCCCC=C(Cl)Cl Amb27400339 [1,1,0,0,0,0|2,0,0]=4 3884 B7R0.4 NCC\C=C\C(F)F Amb27833918 [1,1,0,0,0,0|2,0,0]=4 3885 B7R0.4 O=C(O)CCCCO Amb9214971 [1,1,0,0,0,0|1,0,1]=4 3886 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [1,1,0,0,0,0|1,0,1]=4 3887 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [1,1,0,0,0,0|1,0,1]=4 3888 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [1,1,0,0,0,0|1,0,1]=4 3889 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [1,1,0,0,0,0|1,0,1]=4 3890 B7R0.4 O=C([O-])CCCCO Amb13952763 [1,1,0,0,0,0|1,0,1]=4 3891 B7R0.4 O=C([O-])CCCCO Amb22749314 [1,1,0,0,0,0|1,0,1]=4 3892 B7R0.4 O=CCCCC(O)O Amb25889261 [1,1,0,0,0,0|1,0,1]=4 3893 B7R0.4 OC(Cl)CCCCCl Amb27410884 [1,1,0,0,0,0|1,0,1]=4 3894 B7R0.4 OCCCC=C(F)F Amb28287397 [1,1,0,0,0,0|1,0,0]=3 3895 B7R0.4 OCC\C=C\B(O)O Amb26996240 [1,1,0,0,0,0|2,0,0]=4 3896 B7R0.7 C#CCC(O)\C=C\C Amb17593133 [1,1,0,0,0,0|1,0,1]=4 3897 B7R0.7 C=C(CCC)CCC Amb25088297 [1,1,0,0,0,0|0,0,1]=3 3898 B7R0.7 C=C(CCC)CCN Amb33374808 [1,1,0,0,0,0|1,0,1]=4 3899 B7R0.7 C=C(CCC)CCO Amb27642086 [1,1,0,0,0,0|0,0,1]=3 3900 B7R0.7 C=C(CCO)CCO Amb25371349 [1,1,0,0,0,0|1,0,1]=4 3901 B7R0.7 C=C(CCO)COC Amb32945409 [1,1,0,0,0,0|1,0,1]=4 3902 B7R0.7 C=CCC(C)CCO Amb27603507 [1,1,0,0,0,0|0,0,2]=4 3903 B7R0.7 C=CCC(C)\C=C\C Amb27201351 [1,1,0,0,0,0|1,0,1]=4 3904 B7R0.7 C=CCC(O)\C=C\C Amb25359897 [1,1,0,0,0,0|1,0,1]=4 3905 B7R0.7 C=CC[C@@H](N)CCO Amb27398150 [1,1,0,0,0,0|0,0,2]=4 3906 B7R0.7 C=CC[C@@H](O)\C=C\C Amb27410498 [1,1,0,0,0,0|1,0,1]=4 3907 B7R0.7 C=CC\C(C)=C\CC Amb26515782 [1,1,0,0,0,0|0,0,2]=4 3908 B7R0.7 C=C\C=C(/C)CCC Amb24577361 [1,1,0,0,0,0|0,0,2]=4 3909 B7R0.7 CC#CC(=O)CCC Amb17593135 [1,1,0,0,0,0|0,0,2]=4 3910 B7R0.7 CC#CC(C)CCO Amb28455683 [1,1,0,0,0,0|0,0,2]=4 3911 B7R0.7 CC(CCN)CCO Amb17569905 [1,1,0,0,0,0|1,0,1]=4 3912 B7R0.7 CC(CCO)CCI Amb25262818 [1,1,0,0,0,0|1,0,1]=4 3913 B7R0.7 CC(CCO)CCO Amb17939001 [1,1,0,0,0,0|1,0,1]=4 3914 B7R0.7 CCCC(=N)OCC Amb20672875 [1,1,0,0,0,0|1,0,0]=3 3915 B7R0.7 CCCC(=N)OCC Amb25070806 [1,1,0,0,0,0|1,0,0]=3 3916 B7R0.7 CCCC(=O)C=[N+]=[N-] Amb28048975 [1,1,0,0,0,0|2,0,0]=4 3917 B7R0.7 CCCC(=O)CCBr Amb27845324 [1,1,0,0,0,0|1,0,1]=4 3918 B7R0.7 CCCC(=O)CCC Amb6608653 [1,1,0,0,0,0|0,0,1]=3 3919 B7R0.7 CCCC(=O)CCCl Amb17593421 [1,1,0,0,0,0|1,0,1]=4 3920 B7R0.7 CCCC(=O)CCN Amb25104618 [1,1,0,0,0,0|1,0,1]=4 3921 B7R0.7 CCCC(=O)CNC Amb27251893 [1,1,0,0,0,0|1,0,1]=4 3922 B7R0.7 CCCC(=O)OCBr Amb27659135 [1,1,0,0,0,0|2,0,0]=4 3923 B7R0.7 CCCC(=O)OCC Amb3940136 [1,1,0,0,0,0|1,0,0]=3 3924 B7R0.7 CCCC(=O)OCCl Amb8384806 [1,1,0,0,0,0|2,0,0]=4 3925 B7R0.7 CCCC(=O)\C=C\Cl Amb17593395 [1,1,0,0,0,0|1,0,1]=4 3926 B7R0.7 CCCC(=O)\C=C\N Amb17593176 [1,1,0,0,0,0|1,0,1]=4 3927 B7R0.7 CCCC(=S)OCC Amb22168045 [1,1,0,0,0,0|1,0,0]=3 3928 B7R0.7 CCCC(Br)CCC Amb8968455 [1,1,0,0,0,0|0,0,2]=4 3929 B7R0.7 CCCC(Br)CCCl Amb27472207 [1,1,0,0,0,0|1,0,1]=4 3930 B7R0.7 CCCC(Br)\C=C\O Amb28458444 [1,1,0,0,0,0|2,0,0]=4 3931 B7R0.7 CCCC(C)CCBr Amb24526467 [1,1,0,0,0,0|1,0,1]=4 3932 B7R0.7 CCCC(C)CCC Amb22229829 [1,1,0,0,0,0|0,0,2]=4 3933 B7R0.7 CCCC(C)CCCl Amb24333870 [1,1,0,0,0,0|1,0,1]=4 3934 B7R0.7 CCCC(C)CCN Amb31145475 [1,1,0,0,0,0|1,0,1]=4 3935 B7R0.7 CCCC(C)CCN Amb839082 [1,1,0,0,0,0|1,0,1]=4 3936 B7R0.7 CCCC(C)CCO Amb22733616 [1,1,0,0,0,0|0,0,1]=3 3937 B7R0.7 CCCC(C)CCS Amb33320804 [1,1,0,0,0,0|0,1,1]=4 3938 B7R0.7 CCCC(C)CNO Amb26632405 [1,1,0,0,0,0|1,0,1]=4 3939 B7R0.7 CCCC(C)NCC Amb22586730 [1,1,0,0,0,0|1,0,1]=4 3940 B7R0.7 CCCC(C)NCC Amb9726218 [1,1,0,0,0,0|1,0,1]=4 3941 B7R0.7 CCCC(C)OCC Amb22733741 [1,1,0,0,0,0|1,0,1]=4 3942 B7R0.7 CCCC(F)CCN Amb25869704 [1,1,0,0,0,0|1,0,1]=4 3943 B7R0.7 CCCC(F)CCO Amb27662632 [1,1,0,0,0,0|0,0,1]=3 3944 B7R0.7 CCCC(N)CCC Amb1102706 [1,1,0,0,0,0|0,0,2]=4 3945 B7R0.7 CCCC(N)CCN Amb27838332 [1,1,0,0,0,0|1,0,1]=4 3946 B7R0.7 CCCC(N)CCO Amb22050841 [1,1,0,0,0,0|0,0,1]=3 3947 B7R0.7 CCCC(O)CCC Amb4035747 [1,1,0,0,0,0|0,0,2]=4 3948 B7R0.7 CCCC(O)CCN Amb22642684 [1,1,0,0,0,0|1,0,1]=4 3949 B7R0.7 CCCC(O)CCO Amb24181777 [1,1,0,0,0,0|0,0,1]=3 3950 B7R0.7 CCCC(O)\C=C\F Amb27981709 [1,1,0,0,0,0|2,0,0]=4 3951 B7R0.7 CCCC(S)CCC Amb7784733 [1,1,0,0,0,0|0,0,2]=4 3952 B7R0.7 CCCN(C)CCC Amb9787750 [1,1,0,0,0,0|1,0,1]=4 3953 B7R0.7 CCCN(C)CCO Amb3204757 [1,1,0,0,0,0|1,0,1]=4 3954 B7R0.7 CCCN(N)CCC Amb17593208 [1,1,0,0,0,0|1,0,1]=4 3955 B7R0.7 CCCN(N)CCO Amb27424310 [1,1,0,0,0,0|1,0,1]=4 3956 B7R0.7 CCCP(Cl)CCC Amb24120641 [1,1,0,0,0,0|1,0,1]=4 3957 B7R0.7 CCCS(=O)CCC Amb6366329 [1,1,0,0,0,0|1,0,1]=4 3958 B7R0.7 CCCS(=O)NCC Amb28062922 [1,1,0,0,0,0|2,0,0]=4 3959 B7R0.7 CCC[C@@H](C)CCBr Amb28363763 [1,1,0,0,0,0|1,0,1]=4 3960 B7R0.7 CCC[C@@H](N)CCO Amb22746035 [1,1,0,0,0,0|0,0,1]=3 3961 B7R0.7 CCC[C@@H](O)CCN Amb33204237 [1,1,0,0,0,0|1,0,1]=4 3962 B7R0.7 CCC[C@@H](O)CCO Amb24422125 [1,1,0,0,0,0|0,0,1]=3 3963 B7R0.7 CCC[C@H](N)CCO Amb25889377 [1,1,0,0,0,0|0,0,1]=3 3964 B7R0.7 CCC[C@H](N)CCO Amb32409602 [1,1,0,0,0,0|0,0,1]=3 3965 B7R0.7 CCC[C@H](O)CCN Amb33204238 [1,1,0,0,0,0|1,0,1]=4 3966 B7R0.7 CCC[PH](=O)CCC Amb26366296 [1,1,0,0,0,0|1,0,1]=4 3967 B7R0.7 CCC\C(Br)=C/C=O Amb28252419 [1,1,0,0,0,0|1,0,1]=4 3968 B7R0.7 CCC\C(C)=C\C#N Amb28120820 [1,1,0,0,0,0|1,0,1]=4 3969 B7R0.7 CCC\C(C)=C\C=O Amb27237056 [1,1,0,0,0,0|1,0,1]=4 3970 B7R0.7 CCC\C(C)=C\CCl Amb27252320 [1,1,0,0,0,0|1,0,0]=3 3971 B7R0.7 CCC\C(C)=C\CN Amb28256367 [1,1,0,0,0,0|1,0,0]=3 3972 B7R0.7 CCC\C(C)=C\CO Amb28287554 [1,1,0,0,0,0|1,0,0]=3 3973 B7R0.7 CCC\C(N)=N\NC Amb28283892 [1,1,0,0,0,0|2,0,0]=4 3974 B7R0.7 CCC\C([O-])=C\C#N Amb33483436 [1,1,0,0,0,0|1,0,1]=4 3975 B7R0.7 CCNC(=N)CSC Amb27410145 [1,1,0,0,0,0|2,0,0]=4 3976 B7R0.7 CCNC(=N)NCC Amb27226132 [1,1,0,0,0,0|2,0,0]=4 3977 B7R0.7 CCNC(=O)CCBr Amb17324658 [1,1,0,0,0,0|2,0,0]=4 3978 B7R0.7 CCNC(=O)CCCl Amb1138928 [1,1,0,0,0,0|2,0,0]=4 3979 B7R0.7 CCNC(=O)CCN Amb1131291 [1,1,0,0,0,0|2,0,0]=4 3980 B7R0.7 CCNC(=O)CCN Amb21956669 [1,1,0,0,0,0|2,0,0]=4 3981 B7R0.7 CCNC(=O)CCO Amb17334068 [1,1,0,0,0,0|1,0,0]=3 3982 B7R0.7 CCNC(=O)CNC Amb1971537 [1,1,0,0,0,0|2,0,0]=4 3983 B7R0.7 CCNC(=O)CNC Amb33548995 [1,1,0,0,0,0|2,0,0]=4 3984 B7R0.7 CCNC(=O)CSC Amb27873687 [1,1,0,0,0,0|2,0,0]=4 3985 B7R0.7 CCNC(=O)NCC Amb8484443 [1,1,0,0,0,0|2,0,0]=4 3986 B7R0.7 CCNC(=O)OCC Amb8517332 [1,1,0,0,0,0|2,0,0]=4 3987 B7R0.7 CCNC(=O)SCC Amb24271089 [1,1,0,0,0,0|2,0,0]=4 3988 B7R0.7 CCNC(=S)NCC Amb6608832 [1,1,0,0,0,0|2,0,0]=4 3989 B7R0.7 CCNC(=S)SCC Amb27839147 [1,1,0,0,0,0|2,0,0]=4 3990 B7R0.7 CCNC(C)CCO Amb8428187 [1,1,0,0,0,0|1,0,0]=3 3991 B7R0.7 CCOC(=N)CCBr Amb20672901 [1,1,0,0,0,0|2,0,0]=4 3992 B7R0.7 CCOC(=N)CCBr Amb25798516 [1,1,0,0,0,0|2,0,0]=4 3993 B7R0.7 CCOC(=N)CCCl Amb8427995 [1,1,0,0,0,0|2,0,0]=4 3994 B7R0.7 CCOC(=N)CCCl Amb9173330 [1,1,0,0,0,0|2,0,0]=4 3995 B7R0.7 CCOC(=N)CCO Amb27827757 [1,1,0,0,0,0|1,0,0]=3 3996 B7R0.7 CCOC(=N)CNC Amb24529172 [1,1,0,0,0,0|2,0,0]=4 3997 B7R0.7 CCOC(=N)COC Amb23504134 [1,1,0,0,0,0|2,0,0]=4 3998 B7R0.7 CCOC(=N)COC Amb28989436 [1,1,0,0,0,0|2,0,0]=4 3999 B7R0.7 CCOC(=N)OCC Amb26911602 [1,1,0,0,0,0|2,0,0]=4 4000 B7R0.7 CCOC(=O)CCBr Amb3940217 [1,1,0,0,0,0|2,0,0]=4 4001 B7R0.7 CCOC(=O)CCCl Amb3940265 [1,1,0,0,0,0|2,0,0]=4 4002 B7R0.7 CCOC(=O)CCF Amb22492835 [1,1,0,0,0,0|2,0,0]=4 4003 B7R0.7 CCOC(=O)CCI Amb19957952 [1,1,0,0,0,0|2,0,0]=4 4004 B7R0.7 CCOC(=O)CCN Amb2684293 [1,1,0,0,0,0|2,0,0]=4 4005 B7R0.7 CCOC(=O)CCN Amb2697378 [1,1,0,0,0,0|2,0,0]=4 4006 B7R0.7 CCOC(=O)CCO Amb8867845 [1,1,0,0,0,0|1,0,0]=3 4007 B7R0.7 CCOC(=O)CCS Amb20620159 [1,1,0,0,0,0|1,1,0]=4 4008 B7R0.7 CCOC(=O)CC[NH3+] Amb24113699 [1,1,0,0,0,0|2,0,0]=4 4009 B7R0.7 CCOC(=O)CNC Amb33531143 [1,1,0,0,0,0|2,0,0]=4 4010 B7R0.7 CCOC(=O)CNC Amb3941374 [1,1,0,0,0,0|2,0,0]=4 4011 B7R0.7 CCOC(=O)CNO Amb27947131 [1,1,0,0,0,0|2,0,0]=4 4012 B7R0.7 CCOC(=O)COC Amb2726240 [1,1,0,0,0,0|2,0,0]=4 4013 B7R0.7 CCOC(=O)CSC Amb8514150 [1,1,0,0,0,0|2,0,0]=4 4014 B7R0.7 CCOC(=O)NCO Amb25790752 [1,1,0,0,0,0|2,0,0]=4 4015 B7R0.7 CCOC(=O)OCC Amb6608863 [1,1,0,0,0,0|2,0,0]=4 4016 B7R0.7 CCOC(=S)CCBr Amb27634903 [1,1,0,0,0,0|2,0,0]=4 4017 B7R0.7 CCOC(=S)CCCl Amb28067770 [1,1,0,0,0,0|2,0,0]=4 4018 B7R0.7 CCOC(=S)SCC Amb17939407 [1,1,0,0,0,0|2,0,0]=4 4019 B7R0.7 CCOC(C)CCBr Amb28123922 [1,1,0,0,0,0|2,0,0]=4 4020 B7R0.7 CCOC(C)CCN Amb19022809 [1,1,0,0,0,0|2,0,0]=4 4021 B7R0.7 CCOC(C)CCO Amb4017406 [1,1,0,0,0,0|1,0,0]=3 4022 B7R0.7 CCOC(C)CCS Amb33424966 [1,1,0,0,0,0|1,1,0]=4 4023 B7R0.7 CCOC(C)CNO Amb33425739 [1,1,0,0,0,0|2,0,0]=4 4024 B7R0.7 CCSC(=O)CCN Amb28043103 [1,1,0,0,0,0|2,0,0]=4 4025 B7R0.7 CCSC(=O)CCO Amb28044792 [1,1,0,0,0,0|1,0,0]=3 4026 B7R0.7 CCSC(=O)SCC Amb3986705 [1,1,0,0,0,0|2,0,0]=4 4027 B7R0.7 CCSC(=S)SCC Amb25771412 [1,1,0,0,0,0|2,0,0]=4 4028 B7R0.7 CCSC(C)CCCl Amb27880855 [1,1,0,0,0,0|2,0,0]=4 4029 B7R0.7 CCSC(C)CCO Amb26655908 [1,1,0,0,0,0|1,0,0]=3 4030 B7R0.7 CC\C=C(/C)CC#N Amb27492983 [1,1,0,0,0,0|1,0,1]=4 4031 B7R0.7 CC\C=C(/C)CCC Amb28140596 [1,1,0,0,0,0|0,0,0]=2 4032 B7R0.7 CC\C=C(/C)CCO Amb27640229 [1,1,0,0,0,0|0,0,0]=2 4033 B7R0.7 CC\C=C(\C)CCO Amb27441640 [1,1,0,0,0,0|0,0,0]=2 4034 B7R0.7 CC\N=C(/N)SCC Amb24623199 [1,1,0,0,0,0|2,0,0]=4 4035 B7R0.7 CC\N=C(/N)SCC Amb27809281 [1,1,0,0,0,0|2,0,0]=4 4036 B7R0.7 CC\N=C(/N)SCC Amb28344791 [1,1,0,0,0,0|2,0,0]=4 4037 B7R0.7 CNCC(C)CCO Amb17569901 [1,1,0,0,0,0|1,0,1]=4 4038 B7R0.7 CNCC(O)CCO Amb27593318 [1,1,0,0,0,0|1,0,1]=4 4039 B7R0.7 CNC\C(C)=C\CN Amb35609099 [1,1,0,0,0,0|2,0,0]=4 4040 B7R0.7 COCC(C)CCO Amb24604394 [1,1,0,0,0,0|1,0,1]=4 4041 B7R0.7 COCC(Cl)CCO Amb28454426 [1,1,0,0,0,0|1,0,1]=4 4042 B7R0.7 COCC(N)CCO Amb19338150 [1,1,0,0,0,0|1,0,1]=4 4043 B7R0.7 COC[C@@H](N)CCO Amb27964057 [1,1,0,0,0,0|1,0,1]=4 4044 B7R0.7 COC\C(C)=C\CBr Amb27408994 [1,1,0,0,0,0|2,0,0]=4 4045 B7R0.7 COC\C(C)=C\CCl Amb28073593 [1,1,0,0,0,0|2,0,0]=4 4046 B7R0.7 COC\C(C)=C\CO Amb32684679 [1,1,0,0,0,0|2,0,0]=4 4047 B7R0.7 COC\C(Cl)=C\CCl Amb27488805 [1,1,0,0,0,0|2,0,0]=4 4048 B7R0.7 CSCC(N)CCO Amb19515713 [1,1,0,0,0,0|1,0,1]=4 4049 B7R0.7 CSC\C(C)=C\CCl Amb27254190 [1,1,0,0,0,0|2,0,0]=4 4050 B7R0.7 CSSC(C)CCO Amb27593225 [1,1,0,0,0,0|2,0,0]=4 4051 B7R0.7 C\C(=C/C#N)CCO Amb27762036 [1,1,0,0,0,0|1,0,1]=4 4052 B7R0.7 C\C(=C/CO)CCO Amb27406988 [1,1,0,0,0,0|1,0,0]=3 4053 B7R0.7 C\C=C/[C@@H](C)CCBr Amb27433882 [1,1,0,0,0,0|1,0,0]=3 4054 B7R0.7 C\C=C\C(=O)CCC Amb25717214 [1,1,0,0,0,0|0,0,1]=3 4055 B7R0.7 C\C=C\C(=O)CCCl Amb27803642 [1,1,0,0,0,0|1,0,1]=4 4056 B7R0.7 C\C=C\C(=O)COC Amb28315679 [1,1,0,0,0,0|1,0,1]=4 4057 B7R0.7 C\C=C\C(=O)OCC Amb8513578 [1,1,0,0,0,0|1,0,1]=4 4058 B7R0.7 C\C=C\C(Br)CCC Amb17672603 [1,1,0,0,0,0|1,0,0]=3 4059 B7R0.7 C\C=C\C(C)CC=O Amb25366468 [1,1,0,0,0,0|0,0,2]=4 4060 B7R0.7 C\C=C\C(C)CCC Amb26633016 [1,1,0,0,0,0|1,0,0]=3 4061 B7R0.7 C\C=C\C(C)CCO Amb27437234 [1,1,0,0,0,0|0,0,0]=2 4062 B7R0.7 C\C=C\C(Cl)CSC Amb27657144 [1,1,0,0,0,0|2,0,0]=4 4063 B7R0.7 C\C=C\C(O)CCO Amb3354799 [1,1,0,0,0,0|0,0,0]=2 4064 B7R0.7 C\C=C\[C@@H](C)CC=O Amb27791915 [1,1,0,0,0,0|0,0,2]=4 4065 B7R0.7 C\C=C\[C@@H](C)CCO Amb27651868 [1,1,0,0,0,0|0,0,0]=2 4066 B7R0.7 C\C=C\[C@H](O)CCO Amb27164439 [1,1,0,0,0,0|0,0,0]=2 4067 B7R0.7 C\C=N\N(C)CCO Amb27260211 [1,1,0,0,0,0|2,0,0]=4 4068 B7R0.7 NC(CCO)CCF Amb32946596 [1,1,0,0,0,0|1,0,1]=4 4069 B7R0.7 NC(CCO)CCO Amb25324048 [1,1,0,0,0,0|1,0,1]=4 4070 B7R0.7 NCCC(O)CCO Amb27876317 [1,1,0,0,0,0|1,0,1]=4 4071 B7R0.7 NCC[C@@H](O)CCO Amb28187429 [1,1,0,0,0,0|1,0,1]=4 4072 B7R0.7 NC\C=C(\Cl)CCCl Amb27173501 [1,1,0,0,0,0|2,0,0]=4 4073 B7R0.7 O=C(CCO)CCO Amb22002370 [1,1,0,0,0,0|1,0,1]=4 4074 B7R0.7 OCCC(O)CCO Amb17593226 [1,1,0,0,0,0|1,0,1]=4 4075 B9R0.4 C=C(C)\C=C(\C)CCCN Amb28397314 [0,2,0,0,0,0|1,0,1]=4 4076 B9R0.4 CC(=O)\C=C(\C)NCCO Amb24358034 [0,2,0,0,0,0|1,0,1]=4 4077 B9R0.4 CC(C)=CC(=O)CCCO Amb27954159 [0,2,0,0,0,0|0,0,1]=3 4078 B9R0.4 CC(C)=CC(C)CCCO Amb28079248 [0,2,0,0,0,0|0,0,2]=4 4079 B9R0.4 CC(C)CC(=O)CCCCl Amb27474400 [0,2,0,0,0,0|1,0,1]=4 4080 B9R0.4 CC(C)CC(=O)NCCO Amb5797805 [0,2,0,0,0,0|1,0,1]=4 4081 B9R0.4 CC(C)CC(=O)OCCO Amb26515094 [0,2,0,0,0,0|1,0,1]=4 4082 B9R0.4 CC(C)CC(C)\C=C\CBr Amb28253262 [0,2,0,0,0,0|2,0,0]=4 4083 B9R0.4 CC(C)CC(O)CCCO Amb27791444 [0,2,0,0,0,0|0,0,2]=4 4084 B9R0.4 CC(C)C[C@H](C)\C=C\CO Amb27208174 [0,2,0,0,0,0|2,0,0]=4 4085 B9R0.4 CC(C)NC(=O)CCCCl Amb1128189 [0,2,0,0,0,0|2,0,0]=4 4086 B9R0.4 CC(C)NC(=O)CCCN Amb5785121 [0,2,0,0,0,0|2,0,0]=4 4087 B9R0.4 CC(C)NC(=O)CCCO Amb17231998 [0,2,0,0,0,0|1,0,0]=3 4088 B9R0.4 CC(C)OC(=O)CCCCl Amb8393887 [0,2,0,0,0,0|2,0,0]=4 4089 B9R0.4 CC(C)OC(=O)CCCF Amb27838923 [0,2,0,0,0,0|2,0,0]=4 4090 B9R0.4 CC(C)OC(=O)CCCN Amb33164176 [0,2,0,0,0,0|2,0,0]=4 4091 B9R0.4 CC(C)OC(=O)CCCN Amb9493129 [0,2,0,0,0,0|2,0,0]=4 4092 B9R0.4 CC(C)OC(=S)SCCO Amb24386829 [0,2,0,0,0,0|2,0,0]=4 4093 B9R0.4 CC(O)CC(=O)\C=C\CCl Amb27596140 [0,2,0,0,0,0|1,0,1]=4 4094 B9R0.4 CCCCC(=O)C=C(C)C Amb27664643 [0,2,0,0,0,0|1,0,1]=4 4095 B9R0.4 CCCCC(=O)CC(C)Cl Amb27984861 [0,2,0,0,0,0|1,0,1]=4 4096 B9R0.4 CCCCC(=O)OC(C)C Amb22733766 [0,2,0,0,0,0|2,0,0]=4 4097 B9R0.4 CCCCC(=S)NC(C)C Amb28121062 [0,2,0,0,0,0|2,0,0]=4 4098 B9R0.4 CCCCC(C)CC(C)O Amb27839043 [0,2,0,0,0,0|0,0,2]=4 4099 B9R0.4 CCCC[C@@H](O)C[C@@H](C)O Amb27394748 [0,2,0,0,0,0|0,0,2]=4 4100 B9R0.4 CCCC[C@H](O)C[C@@H](C)O Amb27833061 [0,2,0,0,0,0|0,0,2]=4 4101 B9R0.4 CCCC[C@H](O)C[C@H](C)O Amb27594737 [0,2,0,0,0,0|0,0,2]=4 4102 B9R0.4 CCCC\C(C)=C\C(C)O Amb27977773 [0,2,0,0,0,0|1,0,0]=3 4103 B9R0.4 CCCC\C(C)=C\[C@H](C)O Amb27766553 [0,2,0,0,0,0|1,0,0]=3 4104 B9R0.4 CCCC\C(O)=C/C(C)=O Amb28184671 [0,2,0,0,0,0|1,0,1]=4 4105 B9R0.4 CCCC\C(O)=C\C(C)=O Amb27432598 [0,2,0,0,0,0|1,0,1]=4 4106 B9R0.4 CCNCC(C)CC(C)O Amb27961754 [0,2,0,0,0,0|1,0,1]=4 4107 B9R0.4 CC\C=C\C(=O)CC(C)C Amb25146526 [0,2,0,0,0,0|1,0,1]=4 4108 B9R0.4 CC\C=C\C(=O)C[C@@H](C)O Amb28321915 [0,2,0,0,0,0|0,0,1]=3 4109 B9R0.4 CC\C=C\C(C)CC(=O)O Amb32954891 [0,2,0,0,0,0|0,0,1]=3 4110 B9R0.4 CC\C=C\C(N)CC(=O)O Amb25843767 [0,2,0,0,0,0|0,0,1]=3 4111 B9R0.4 CC\C=C\C(O)CC(=O)O Amb33429309 [0,2,0,0,0,0|0,0,1]=3 4112 B9R0.4 CC\C=C\C(O)CC(C)C Amb28188228 [0,2,0,0,0,0|1,0,0]=3 4113 B9R0.4 CC\C=C\[C@@H](O)CC(=O)O Amb33268250 [0,2,0,0,0,0|0,0,1]=3 4114 B9R0.4 CC\C=C\[C@H](O)CC(=O)O Amb28340505 [0,2,0,0,0,0|0,0,1]=3 4115 B9R0.4 CN(C)CC(=O)CCCO Amb25715067 [0,2,0,0,0,0|1,0,1]=4 4116 B9R0.4 CN(C)NC(=O)CCCO Amb27617010 [0,2,0,0,0,0|2,0,0]=4 4117 B9R0.4 C[C@H](O)CN(C)CCCO Amb28126891 [0,2,0,0,0,0|1,0,1]=4 4118 B9R0.4 C\C(=C/C(C)C)CCC=O Amb27229823 [0,2,0,0,0,0|0,0,2]=4 4119 B9R0.4 C\C(N)=C/C(=O)OCCO Amb27202419 [0,2,0,0,0,0|1,0,1]=4 4120 B9R0.4 C\C(N)=C\C(=O)OCCO Amb27267857 [0,2,0,0,0,0|1,0,1]=4 4121 B9R0.5 C#CCC(C)C\C=C\CO Amb27220732 [0,2,0,0,0,0|2,0,0]=4 4122 B9R0.5 C#CCC(O)\C=C\CCC Amb27839290 [0,2,0,0,0,0|1,0,1]=4 4123 B9R0.5 C#CCCCC(=O)OCC Amb18115788 [0,2,0,0,0,0|2,0,0]=4 4124 B9R0.5 C#CCCC\C(C)=C\CO Amb27839289 [0,2,0,0,0,0|2,0,0]=4 4125 B9R0.5 C#CC[C@@H](O)\C=C\CCC Amb27472241 [0,2,0,0,0,0|1,0,1]=4 4126 B9R0.5 C#C\C=C\CN(C)CCO Amb28401112 [0,2,0,0,0,0|0,0,2]=4 4127 B9R0.5 C=C(C#CCCO)CCO Amb27945328 [0,2,0,0,0,0|0,0,2]=4 4128 B9R0.5 C=C(CCC)CCCCCl Amb27835284 [0,2,0,0,0,0|1,0,1]=4 4129 B9R0.5 C=C(CCO)CCCCN Amb28193274 [0,2,0,0,0,0|1,0,1]=4 4130 B9R0.5 C=C(\C=C\CCC)CCN Amb33373740 [0,2,0,0,0,0|1,0,1]=4 4131 B9R0.5 C=CCC\C=C(/C)CCBr Amb28428701 [0,2,0,0,0,0|1,0,1]=4 4132 B9R0.5 C=CCC\C=C(\C)CCBr Amb28053510 [0,2,0,0,0,0|1,0,1]=4 4133 B9R0.5 C=CC[C@@H](O)\C=C\CCC Amb27426691 [0,2,0,0,0,0|1,0,1]=4 4134 B9R0.5 C=CC[C@H](O)\C=C\CCC Amb28400908 [0,2,0,0,0,0|1,0,1]=4 4135 B9R0.5 CC(CCO)NCCCF Amb27229545 [0,2,0,0,0,0|1,0,1]=4 4136 B9R0.5 CC(\C=C\CCO)CCO Amb28294140 [0,2,0,0,0,0|0,0,0]=2 4137 B9R0.5 CCCC(=O)CCCCN Amb28058184 [0,2,0,0,0,0|1,0,1]=4 4138 B9R0.5 CCCC(=O)CCCSC Amb27758287 [0,2,0,0,0,0|0,1,1]=4 4139 B9R0.5 CCCC(=O)COCCCl Amb27244905 [0,2,0,0,0,0|1,0,1]=4 4140 B9R0.5 CCCC(=O)COCCN Amb27413187 [0,2,0,0,0,0|1,0,1]=4 4141 B9R0.5 CCCC(=O)CSCCO Amb18800667 [0,2,0,0,0,0|0,0,1]=3 4142 B9R0.5 CCCC(=O)NOCCO Amb28293706 [0,2,0,0,0,0|1,0,1]=4 4143 B9R0.5 CCCC(=O)OCCCN Amb27272615 [0,2,0,0,0,0|1,0,1]=4 4144 B9R0.5 CCCC(=O)OCCCO Amb28292589 [0,2,0,0,0,0|0,0,1]=3 4145 B9R0.5 CCCC(=O)\C=C/NCC Amb28321904 [0,2,0,0,0,0|1,0,1]=4 4146 B9R0.5 CCCC(=O)\C=C\CCO Amb27409476 [0,2,0,0,0,0|0,0,1]=3 4147 B9R0.5 CCCC(=O)\C=C\NCC Amb26617598 [0,2,0,0,0,0|1,0,1]=4 4148 B9R0.5 CCCC(=O)\C=C\SCC Amb25146559 [0,2,0,0,0,0|1,0,1]=4 4149 B9R0.5 CCCC(C)CCCCO Amb28046661 [0,2,0,0,0,0|0,0,2]=4 4150 B9R0.5 CCCC(C)COCCO Amb26080123 [0,2,0,0,0,0|0,0,2]=4 4151 B9R0.5 CCCC(C)\C=C\CCN Amb27812532 [0,2,0,0,0,0|1,0,0]=3 4152 B9R0.5 CCCC(C)\C=N\OCC Amb28126906 [0,2,0,0,0,0|2,0,0]=4 4153 B9R0.5 CCCC(F)CCCCO Amb27856506 [0,2,0,0,0,0|0,0,2]=4 4154 B9R0.5 CCCC(N)CSCCO Amb27968788 [0,2,0,0,0,0|0,0,2]=4 4155 B9R0.5 CCCC(O)C\C=C\CO Amb27614990 [0,2,0,0,0,0|2,0,0]=4 4156 B9R0.5 CCCCCC(=O)CCC Amb2720457 [0,2,0,0,0,0|1,0,1]=4 4157 B9R0.5 CCCCCC(=O)CCO Amb27627789 [0,2,0,0,0,0|0,0,2]=4 4158 B9R0.5 CCCCCC(=O)COC Amb27171123 [0,2,0,0,0,0|1,0,1]=4 4159 B9R0.5 CCCCCC(=O)NCC Amb3373540 [0,2,0,0,0,0|1,0,1]=4 4160 B9R0.5 CCCCCC(Br)COC Amb27849558 [0,2,0,0,0,0|0,0,2]=4 4161 B9R0.5 CCCCCC(C)CCO Amb24733660 [0,2,0,0,0,0|0,0,2]=4 4162 B9R0.5 CCCCCC(Cl)COC Amb18798379 [0,2,0,0,0,0|0,0,2]=4 4163 B9R0.5 CCCCCC(N)COC Amb27206898 [0,2,0,0,0,0|0,0,2]=4 4164 B9R0.5 CCCCCC(O)CCO Amb22270100 [0,2,0,0,0,0|0,0,2]=4 4165 B9R0.5 CCCCCN(C)CCO Amb3204759 [0,2,0,0,0,0|0,0,2]=4 4166 B9R0.5 CCCCC[C@@H](O)CCO Amb27946548 [0,2,0,0,0,0|0,0,2]=4 4167 B9R0.5 CCCCC[C@H](C)CCO Amb26861853 [0,2,0,0,0,0|0,0,2]=4 4168 B9R0.5 CCCCC\C(Cl)=C\CCl Amb27749688 [0,2,0,0,0,0|2,0,0]=4 4169 B9R0.5 CCCCC\C(I)=C\CO Amb4017430 [0,2,0,0,0,0|2,0,0]=4 4170 B9R0.5 CCCCNC(=N)NCC Amb28118745 [0,2,0,0,0,0|2,0,0]=4 4171 B9R0.5 CCCCNC(=O)CCBr Amb17330970 [0,2,0,0,0,0|2,0,0]=4 4172 B9R0.5 CCCCNC(=O)CCC Amb5797594 [0,2,0,0,0,0|1,0,1]=4 4173 B9R0.5 CCCCNC(=O)CCCl Amb6248093 [0,2,0,0,0,0|2,0,0]=4 4174 B9R0.5 CCCCNC(=O)CCN Amb5784977 [0,2,0,0,0,0|2,0,0]=4 4175 B9R0.5 CCCCNC(=O)CNC Amb6280977 [0,2,0,0,0,0|2,0,0]=4 4176 B9R0.5 CCCCNC(=O)CSC Amb27877947 [0,2,0,0,0,0|2,0,0]=4 4177 B9R0.5 CCCCNC(=O)NCC Amb4018863 [0,2,0,0,0,0|2,0,0]=4 4178 B9R0.5 CCCCNC(=O)OCC Amb10552892 [0,2,0,0,0,0|2,0,0]=4 4179 B9R0.5 CCCCNC(=S)OCC Amb27235690 [0,2,0,0,0,0|2,0,0]=4 4180 B9R0.5 CCCCNC(C)CCO Amb27594265 [0,2,0,0,0,0|0,0,2]=4 4181 B9R0.5 CCCCOC(=O)CCCl Amb2722788 [0,2,0,0,0,0|2,0,0]=4 4182 B9R0.5 CCCCOC(=O)CCO Amb27211287 [0,2,0,0,0,0|2,0,0]=4 4183 B9R0.5 CCCCOC(=O)CCS Amb8516995 [0,2,0,0,0,0|2,0,0]=4 4184 B9R0.5 CCCCOC(=O)COC Amb20620642 [0,2,0,0,0,0|2,0,0]=4 4185 B9R0.5 CCCCOC(=O)NCC Amb27412996 [0,2,0,0,0,0|2,0,0]=4 4186 B9R0.5 CCCCOC(=S)NCC Amb27393051 [0,2,0,0,0,0|2,0,0]=4 4187 B9R0.5 CCCCSC(=O)NCC Amb27462695 [0,2,0,0,0,0|2,0,0]=4 4188 B9R0.5 CCCCS\C(C)=C\CO Amb27651728 [0,2,0,0,0,0|2,0,0]=4 4189 B9R0.5 CCCC\C=C(\C)CCO Amb27662306 [0,2,0,0,0,0|1,0,0]=3 4190 B9R0.5 CCCC\N=C(/N)SCC Amb24660507 [0,2,0,0,0,0|2,0,0]=4 4191 B9R0.5 CCCN(C)C\C=C\CCl Amb27165329 [0,2,0,0,0,0|2,0,0]=4 4192 B9R0.5 CCCN(C)C\C=C\CN Amb27792818 [0,2,0,0,0,0|2,0,0]=4 4193 B9R0.5 CCCN(C)C\C=C\CS Amb27753507 [0,2,0,0,0,0|2,0,0]=4 4194 B9R0.5 CCCNCC(=O)OCC Amb6714488 [0,2,0,0,0,0|2,0,0]=4 4195 B9R0.5 CCCNCC(N)COC Amb28137479 [0,2,0,0,0,0|1,0,1]=4 4196 B9R0.5 CCCNCC(O)CCO Amb27453664 [0,2,0,0,0,0|0,0,2]=4 4197 B9R0.5 CCCNC[C@H](O)COC Amb28126305 [0,2,0,0,0,0|1,0,1]=4 4198 B9R0.5 CCCOCC(=N)OCC Amb27399250 [0,2,0,0,0,0|2,0,0]=4 4199 B9R0.5 CCCOCC(N)COC Amb27807201 [0,2,0,0,0,0|1,0,1]=4 4200 B9R0.5 CCCSCC(=O)CCC Amb18800477 [0,2,0,0,0,0|1,0,1]=4 4201 B9R0.5 CCCSCC(O)COC Amb27620692 [0,2,0,0,0,0|1,0,1]=4 4202 B9R0.5 CCC[C@@H](F)CCCCO Amb27617034 [0,2,0,0,0,0|0,0,2]=4 4203 B9R0.5 CCC[C@@H](N)CCCOC Amb27167802 [0,2,0,0,0,0|0,0,2]=4 4204 B9R0.5 CCC[C@H](C)CCCCO Amb27972560 [0,2,0,0,0,0|0,0,2]=4 4205 B9R0.5 CCC[C@H](C)OCCCO Amb27839315 [0,2,0,0,0,0|0,0,2]=4 4206 B9R0.5 CCC[C@H](F)CCCCO Amb27835909 [0,2,0,0,0,0|0,0,2]=4 4207 B9R0.5 CCC[C@H](N)CCCCO Amb27799723 [0,2,0,0,0,0|0,0,2]=4 4208 B9R0.5 CCC[C@H](O)C\C=C\CO Amb27617048 [0,2,0,0,0,0|2,0,0]=4 4209 B9R0.5 CCC\C(C)=C\CCC=O Amb27224748 [0,2,0,0,0,0|0,0,2]=4 4210 B9R0.5 CCC\C(C)=N\CCCN Amb27469410 [0,2,0,0,0,0|1,0,1]=4 4211 B9R0.5 CCC\C=C/C(O)CCCl Amb27173673 [0,2,0,0,0,0|1,0,0]=3 4212 B9R0.5 CCC\C=C\C(=O)CCC Amb17593554 [0,2,0,0,0,0|1,0,1]=4 4213 B9R0.5 CCC\C=C\C(=O)CCN Amb33327175 [0,2,0,0,0,0|1,0,1]=4 4214 B9R0.5 CCC\C=C\C(=O)CNC Amb33327172 [0,2,0,0,0,0|1,0,1]=4 4215 B9R0.5 CCC\C=C\C(C)CC=O Amb27615137 [0,2,0,0,0,0|0,0,2]=4 4216 B9R0.5 CCC\C=C\C(C)CCN Amb33327174 [0,2,0,0,0,0|1,0,0]=3 4217 B9R0.5 CCC\C=C\C(C)CON Amb33424693 [0,2,0,0,0,0|0,0,2]=4 4218 B9R0.5 CCC\C=C\C(F)CCN Amb33424859 [0,2,0,0,0,0|1,0,0]=3 4219 B9R0.5 CCC\C=C\C(N)CCO Amb33327183 [0,2,0,0,0,0|0,0,0]=2 4220 B9R0.5 CCC\C=C\C(O)CC#N Amb33448422 [0,2,0,0,0,0|1,0,1]=4 4221 B9R0.5 CCC\C=C\C(O)CCC Amb27839603 [0,2,0,0,0,0|1,0,0]=3 4222 B9R0.5 CCC\C=C\C(O)CCN Amb33327184 [0,2,0,0,0,0|1,0,0]=3 4223 B9R0.5 CCC\C=C\C(O)CCO Amb27456608 [0,2,0,0,0,0|0,0,0]=2 4224 B9R0.5 CCC\C=C\C(O)CNC Amb33327173 [0,2,0,0,0,0|2,0,0]=4 4225 B9R0.5 CCC\C=C\[C@@H](O)CCN Amb33424860 [0,2,0,0,0,0|1,0,0]=3 4226 B9R0.5 CCC\C=C\[C@H](O)CCN Amb33424861 [0,2,0,0,0,0|1,0,0]=3 4227 B9R0.5 CCNC(=N)CCOCC Amb27965191 [0,2,0,0,0,0|2,0,0]=4 4228 B9R0.5 CCNC(=N)NCCCN Amb27883545 [0,2,0,0,0,0|2,0,0]=4 4229 B9R0.5 CCNC(=O)CCCC#N Amb28063756 [0,2,0,0,0,0|2,0,0]=4 4230 B9R0.5 CCNC(=O)CCCCBr Amb17239684 [0,2,0,0,0,0|1,0,1]=4 4231 B9R0.5 CCNC(=O)CCCNC Amb28126927 [0,2,0,0,0,0|2,0,0]=4 4232 B9R0.5 CCNC(=O)CCCOC Amb27179856 [0,2,0,0,0,0|1,0,0]=3 4233 B9R0.5 CCNC(=O)CNCCF Amb27962781 [0,2,0,0,0,0|2,0,0]=4 4234 B9R0.5 CCNC(=O)CNCCO Amb9246603 [0,2,0,0,0,0|1,0,0]=3 4235 B9R0.5 CCNC(=O)COCCN Amb27837714 [0,2,0,0,0,0|2,0,0]=4 4236 B9R0.5 CCNC(=O)CSCCBr Amb27249104 [0,2,0,0,0,0|2,0,0]=4 4237 B9R0.5 CCNC(=O)NCCCF Amb27458114 [0,2,0,0,0,0|2,0,0]=4 4238 B9R0.5 CCNC(=O)NCCCO Amb4018873 [0,2,0,0,0,0|1,0,0]=3 4239 B9R0.5 CCNC(=O)NCCOC Amb4018874 [0,2,0,0,0,0|2,0,0]=4 4240 B9R0.5 CCNC(=O)OCCCCl Amb27805521 [0,2,0,0,0,0|2,0,0]=4 4241 B9R0.5 CCNC(=O)OCCOC Amb26558291 [0,2,0,0,0,0|2,0,0]=4 4242 B9R0.5 CCNC(=S)NCCCO Amb25364013 [0,2,0,0,0,0|1,0,0]=3 4243 B9R0.5 CCNC(=S)NNCCO Amb27766330 [0,2,0,0,0,0|2,0,0]=4 4244 B9R0.5 CCNC(C)CCCCO Amb28280233 [0,2,0,0,0,0|0,0,2]=4 4245 B9R0.5 CCNC(C)CCCOC Amb28122940 [0,2,0,0,0,0|1,0,1]=4 4246 B9R0.5 CCNCCC(=O)OCC Amb9026175 [0,2,0,0,0,0|2,0,0]=4 4247 B9R0.5 CCOC(=N)CCCCBr Amb25890174 [0,2,0,0,0,0|1,0,1]=4 4248 B9R0.5 CCOC(=N)CCCCCl Amb26392208 [0,2,0,0,0,0|1,0,1]=4 4249 B9R0.5 CCOC(=N)CCCOC Amb28141924 [0,2,0,0,0,0|1,0,0]=3 4250 B9R0.5 CCOC(=N)COCCO Amb28345357 [0,2,0,0,0,0|1,0,0]=3 4251 B9R0.5 CCOC(=O)C#CCCO Amb24480935 [0,2,0,0,0,0|0,0,2]=4 4252 B9R0.5 CCOC(=O)C=C=CCO Amb27839366 [0,2,0,0,0,0|0,0,2]=4 4253 B9R0.5 CCOC(=O)CCCC#N Amb16233123 [0,2,0,0,0,0|2,0,0]=4 4254 B9R0.5 CCOC(=O)CCCC=O Amb22230665 [0,2,0,0,0,0|1,0,1]=4 4255 B9R0.5 CCOC(=O)CCCCBr Amb3940221 [0,2,0,0,0,0|1,0,1]=4 4256 B9R0.5 CCOC(=O)CCCCI Amb4006406 [0,2,0,0,0,0|1,0,1]=4 4257 B9R0.5 CCOC(=O)CCCCN Amb10807401 [0,2,0,0,0,0|1,0,1]=4 4258 B9R0.5 CCOC(=O)CCCCN Amb33527726 [0,2,0,0,0,0|1,0,1]=4 4259 B9R0.5 CCOC(=O)CCCNC Amb9204023 [0,2,0,0,0,0|2,0,0]=4 4260 B9R0.5 CCOC(=O)CCCOC Amb27837737 [0,2,0,0,0,0|1,0,0]=3 4261 B9R0.5 CCOC(=O)CCCSC Amb25058939 [0,2,0,0,0,0|1,1,0]=4 4262 B9R0.5 CCOC(=O)CCNOC Amb27838886 [0,2,0,0,0,0|2,0,0]=4 4263 B9R0.5 CCOC(=O)CCSCC Amb9026307 [0,2,0,0,0,0|2,0,0]=4 4264 B9R0.5 CCOC(=O)CNCCF Amb27754664 [0,2,0,0,0,0|2,0,0]=4 4265 B9R0.5 CCOC(=O)CNCCN Amb30868135 [0,2,0,0,0,0|2,0,0]=4 4266 B9R0.5 CCOC(=O)COCCBr Amb8394720 [0,2,0,0,0,0|2,0,0]=4 4267 B9R0.5 CCOC(=O)COCCCl Amb19958740 [0,2,0,0,0,0|2,0,0]=4 4268 B9R0.5 CCOC(=O)COCCN Amb25850783 [0,2,0,0,0,0|2,0,0]=4 4269 B9R0.5 CCOC(=O)COCCN Amb28555601 [0,2,0,0,0,0|2,0,0]=4 4270 B9R0.5 CCOC(=O)COCCO Amb24113532 [0,2,0,0,0,0|1,0,0]=3 4271 B9R0.5 CCOC(=O)COCOC Amb27624738 [0,2,0,0,0,0|2,0,0]=4 4272 B9R0.5 CCOC(=O)NCCCF Amb27770329 [0,2,0,0,0,0|2,0,0]=4 4273 B9R0.5 CCOC(=O)OCCCBr Amb27231554 [0,2,0,0,0,0|2,0,0]=4 4274 B9R0.5 CCOC(=O)OCCCCl Amb27594095 [0,2,0,0,0,0|2,0,0]=4 4275 B9R0.5 CCOC(=O)OCCCF Amb24088656 [0,2,0,0,0,0|2,0,0]=4 4276 B9R0.5 CCOC(=O)OCCCO Amb28050600 [0,2,0,0,0,0|1,0,0]=3 4277 B9R0.5 CCOC(=O)\C=C\CCO Amb26008238 [0,2,0,0,0,0|0,0,1]=3 4278 B9R0.5 CCOC(=O)\C=C\CCO Amb33715375 [0,2,0,0,0,0|0,0,1]=3 4279 B9R0.5 CCOC(=S)NCCCS Amb27239537 [0,2,0,0,0,0|1,1,0]=4 4280 B9R0.5 CCOC(C)CCCCO Amb28050663 [0,2,0,0,0,0|0,0,2]=4 4281 B9R0.5 CCOC(C)C\C=C\CCl Amb24551883 [0,2,0,0,0,0|2,0,0]=4 4282 B9R0.5 CCOC(Cl)COCCO Amb27666865 [0,2,0,0,0,0|1,0,1]=4 4283 B9R0.5 CCOCCC(=O)OCC Amb6608774 [0,2,0,0,0,0|2,0,0]=4 4284 B9R0.5 CCOCCC(Br)COC Amb28050030 [0,2,0,0,0,0|1,0,1]=4 4285 B9R0.5 CCOCCC(O)CCO Amb27663664 [0,2,0,0,0,0|0,0,2]=4 4286 B9R0.5 CCOCCN(C)CCO Amb27427761 [0,2,0,0,0,0|1,0,1]=4 4287 B9R0.5 CCONC[C@@H](O)COC Amb28315973 [0,2,0,0,0,0|2,0,0]=4 4288 B9R0.5 CCONC[C@H](O)COC Amb27255088 [0,2,0,0,0,0|2,0,0]=4 4289 B9R0.5 CCO\C=C\C(C)CC=O Amb25701589 [0,2,0,0,0,0|0,0,2]=4 4290 B9R0.5 CCO\C=C\C(Cl)OCC Amb28053805 [0,2,0,0,0,0|2,0,0]=4 4291 B9R0.5 CCSCCN(C)CCO Amb27663085 [0,2,0,0,0,0|1,0,1]=4 4292 B9R0.5 CC\C=C(/C)CCCCC Amb27666327 [0,2,0,0,0,0|1,0,0]=3 4293 B9R0.5 CC\C=C(C)/C=C/CCO Amb28050672 [0,2,0,0,0,0|0,0,1]=3 4294 B9R0.5 CC\C=C(\C)CCCC=O Amb27850024 [0,2,0,0,0,0|0,0,1]=3 4295 B9R0.5 CC\C=C(\C)C\C=C\CO Amb27761451 [0,2,0,0,0,0|0,0,1]=3 4296 B9R0.5 CC\C=C\CC(Br)CCC Amb27488172 [0,2,0,0,0,0|1,0,0]=3 4297 B9R0.5 CC\C=C\CC(O)CCO Amb27605392 [0,2,0,0,0,0|0,0,0]=2 4298 B9R0.5 CNCC(=O)NCCCN Amb27217696 [0,2,0,0,0,0|2,0,0]=4 4299 B9R0.5 CNCC(=O)NCCCS Amb27637747 [0,2,0,0,0,0|1,1,0]=4 4300 B9R0.5 CNC\C=C\C(C)COC Amb27950660 [0,2,0,0,0,0|2,0,0]=4 4301 B9R0.5 COCC(=O)CCCCN Amb28050471 [0,2,0,0,0,0|1,0,1]=4 4302 B9R0.5 COCC(=O)NCCCN Amb33527047 [0,2,0,0,0,0|2,0,0]=4 4303 B9R0.5 COCC(=O)NCCCN Amb6259229 [0,2,0,0,0,0|2,0,0]=4 4304 B9R0.5 COCC(=O)OCCCO Amb26408081 [0,2,0,0,0,0|1,0,0]=3 4305 B9R0.5 COCC(C)NCCCO Amb27768603 [0,2,0,0,0,0|1,0,1]=4 4306 B9R0.5 COCC(O)CCCCO Amb27760907 [0,2,0,0,0,0|0,0,2]=4 4307 B9R0.5 COCCC\C(C)=C\CO Amb27826189 [0,2,0,0,0,0|1,0,0]=3 4308 B9R0.5 COCCNC(C)CCO Amb28246289 [0,2,0,0,0,0|1,0,1]=4 4309 B9R0.5 COCOC\C(C)=C\CCl Amb27197703 [0,2,0,0,0,0|2,0,0]=4 4310 B9R0.5 COCOC\C(C)=C\CO Amb27471949 [0,2,0,0,0,0|2,0,0]=4 4311 B9R0.5 CO\C=C(/C)CCCC=O Amb27199142 [0,2,0,0,0,0|1,0,1]=4 4312 B9R0.5 CO\C=C(\C)CCCCO Amb27427194 [0,2,0,0,0,0|1,0,0]=3 4313 B9R0.5 CSCCSC(C)CCO Amb28456145 [0,2,0,0,0,0|1,0,1]=4 4314 B9R0.5 C\C(=C/C#N)OCCCO Amb28050758 [0,2,0,0,0,0|1,0,1]=4 4315 B9R0.5 C\C(=C/CO)CCCC=O Amb28287918 [0,2,0,0,0,0|1,0,1]=4 4316 B9R0.5 C\C(=C/CO)CCCCCl Amb27254213 [0,2,0,0,0,0|2,0,0]=4 4317 B9R0.5 C\C(=C/CO)CCCCO Amb27594384 [0,2,0,0,0,0|1,0,0]=3 4318 B9R0.5 C\C(CCO)=N/NCCO Amb27211820 [0,2,0,0,0,0|2,0,0]=4 4319 B9R0.5 C\C=C\C(=O)CCCC#N Amb26981073 [0,2,0,0,0,0|1,0,1]=4 4320 B9R0.5 C\C=C\C(=O)CCCC=O Amb25743030 [0,2,0,0,0,0|0,0,2]=4 4321 B9R0.5 C\C=C\C(=O)CCCCC Amb25146367 [0,2,0,0,0,0|1,0,1]=4 4322 B9R0.5 C\C=C\C(=O)CCCCF Amb27652289 [0,2,0,0,0,0|1,0,1]=4 4323 B9R0.5 C\C=C\C(=O)CCCOC Amb27235499 [0,2,0,0,0,0|0,0,1]=3 4324 B9R0.5 C\C=C\C(=O)COCCC Amb28312884 [0,2,0,0,0,0|1,0,1]=4 4325 B9R0.5 C\C=C\C(=O)NCCCC Amb27474050 [0,2,0,0,0,0|1,0,1]=4 4326 B9R0.5 C\C=C\C(=O)NCCCN Amb27984514 [0,2,0,0,0,0|1,0,1]=4 4327 B9R0.5 C\C=C\C(=O)OCCCC Amb17940289 [0,2,0,0,0,0|1,0,1]=4 4328 B9R0.5 C\C=C\C(=O)OCCOC Amb24404476 [0,2,0,0,0,0|1,0,1]=4 4329 B9R0.5 C\C=C\CCC(O)CCO Amb28350050 [0,2,0,0,0,0|0,0,2]=4 4330 B9R0.5 C\C=C\CCC(O)COC Amb27487822 [0,2,0,0,0,0|0,0,2]=4 4331 B9R0.5 ClC\C=C(/Cl)CCCCCl Amb27872281 [0,2,0,0,0,0|2,0,0]=4 4332 B9R0.5 N#CCC(=O)NCCCO Amb5781537 [0,2,0,0,0,0|1,0,1]=4 4333 B9R0.5 NC(CCO)CSCCO Amb27262281 [0,2,0,0,0,0|1,0,1]=4 4334 B9R0.5 NCCC(=O)NCCCCl Amb28122933 [0,2,0,0,0,0|2,0,0]=4 4335 B9R0.5 NCCC(=O)NCCCF Amb27265917 [0,2,0,0,0,0|2,0,0]=4 4336 B9R0.5 NCCC(=O)NCCCS Amb27985973 [0,2,0,0,0,0|1,1,0]=4 4337 B9R0.5 NCCC(=O)OCCCO Amb27482412 [0,2,0,0,0,0|1,0,0]=3 4338 B9R0.5 N\C(CCO)=N/OCCO Amb27223157 [0,2,0,0,0,0|2,0,0]=4 4339 B9R0.5 O=C(CCBr)NCCCO Amb17331230 [0,2,0,0,0,0|1,0,0]=3 4340 B9R0.5 O=C(CCCl)NCCCCl Amb2125612 [0,2,0,0,0,0|2,0,0]=4 4341 B9R0.5 O=C(CCCl)NCCCO Amb17327508 [0,2,0,0,0,0|1,0,0]=3 4342 B9R0.5 O=C(CCCl)OCCCCl Amb27477838 [0,2,0,0,0,0|2,0,0]=4 4343 B9R0.5 O=C(CCO)OCCCO Amb27652860 [0,2,0,0,0,0|1,0,0]=3 4344 B9R0.5 OCCC#CC(Br)CCO Amb28197919 [0,2,0,0,0,0|0,0,2]=4 4345 B9R0.5 [C-]#[N+]CCCC(=O)OCC Amb2235706 [0,2,0,0,0,0|2,0,0]=4 4346 B9R0.8 C=C(CCCC)[C@@H](O)CC Amb28138626 [0,2,0,0,0,0|1,0,1]=4 4347 B9R0.8 C=CC(Cl)C(O)\C=C\CC Amb27481642 [0,2,0,0,0,0|1,0,1]=4 4348 B9R0.8 C=C[C@@H](Cl)[C@H](O)\C=C\CC Amb27760396 [0,2,0,0,0,0|1,0,1]=4 4349 B9R0.8 CCC(=O)C(=O)CCCO Amb27618249 [0,2,0,0,0,0|0,0,0]=2 4350 B9R0.8 CCC(=O)C(C)CCCO Amb28314429 [0,2,0,0,0,0|0,0,1]=3 4351 B9R0.8 CCC(C)C(=O)CCCN Amb27170602 [0,2,0,0,0,0|1,0,1]=4 4352 B9R0.8 CCC(C)C(=O)OCCO Amb25677455 [0,2,0,0,0,0|1,0,1]=4 4353 B9R0.8 CCC(C)C(O)\C=C\CO Amb27196838 [0,2,0,0,0,0|2,0,0]=4 4354 B9R0.8 CCC(Cl)C(Cl)CCCO Amb27758675 [0,2,0,0,0,0|0,0,2]=4 4355 B9R0.8 CCC(O)C(C)\C=C\OC Amb28138490 [0,2,0,0,0,0|2,0,0]=4 4356 B9R0.8 CCC(S)C(=O)NCCO Amb27197046 [0,2,0,0,0,0|1,0,1]=4 4357 B9R0.8 CCCCC(=O)C(=O)OC Amb22755702 [0,2,0,0,0,0|2,0,0]=4 4358 B9R0.8 CCCCC(=O)C(N)CC Amb28341962 [0,2,0,0,0,0|1,0,1]=4 4359 B9R0.8 CCCCC(=O)N(C)CC Amb27255637 [0,2,0,0,0,0|2,0,0]=4 4360 B9R0.8 CCCCC(=O)[C@H](F)CC Amb28253956 [0,2,0,0,0,0|1,0,1]=4 4361 B9R0.8 CCCCC(C)C(=O)CC Amb25359211 [0,2,0,0,0,0|1,0,1]=4 4362 B9R0.8 CCCCC(C)C(F)CO Amb27261654 [0,2,0,0,0,0|0,0,2]=4 4363 B9R0.8 CCCCC(Cl)C(=O)CC Amb28322143 [0,2,0,0,0,0|1,0,1]=4 4364 B9R0.8 CCCCC(F)C(=O)CC Amb27212037 [0,2,0,0,0,0|1,0,1]=4 4365 B9R0.8 CCCCC(F)[C@@H](O)CO Amb24122595 [0,2,0,0,0,0|0,0,2]=4 4366 B9R0.8 CCCCC(O)C(N)CO Amb27862099 [0,2,0,0,0,0|0,0,2]=4 4367 B9R0.8 CCCCC(O)C(O)CO Amb8514775 [0,2,0,0,0,0|0,0,2]=4 4368 B9R0.8 CCCCN(N)C(=O)CC Amb33191485 [0,2,0,0,0,0|2,0,0]=4 4369 B9R0.8 CCCC[C@@H](Cl)[C@H](C)CO Amb27843309 [0,2,0,0,0,0|0,0,2]=4 4370 B9R0.8 CCCC[C@@H](O)[C@@H](C)CO Amb28125795 [0,2,0,0,0,0|0,0,2]=4 4371 B9R0.8 CCCC[C@@H](O)[C@@H](N)CO Amb28313946 [0,2,0,0,0,0|0,0,2]=4 4372 B9R0.8 CCCC[C@@H](O)[C@H](C)CO Amb27756413 [0,2,0,0,0,0|0,0,2]=4 4373 B9R0.8 CCCC[C@H](O)[C@@H](C)CO Amb27775544 [0,2,0,0,0,0|0,0,2]=4 4374 B9R0.8 CCCC\C(F)=C(/F)CO Amb28069334 [0,2,0,0,0,0|2,0,0]=4 4375 B9R0.8 CCC\C=C(\C)C(=O)CC Amb27854893 [0,2,0,0,0,0|1,0,1]=4 4376 B9R0.8 CCN(C)C(=O)CCCO Amb27766840 [0,2,0,0,0,0|1,0,0]=3 4377 B9R0.8 CCN(O)C(=O)CCCO Amb28422934 [0,2,0,0,0,0|1,0,0]=3 4378 B9R0.8 CCS(=O)N(C)CCCO Amb27617700 [0,2,0,0,0,0|2,0,0]=4 4379 B9R0.8 CC[C@@H](N)C(=O)NCCO Amb27273549 [0,2,0,0,0,0|1,0,1]=4 4380 B9R0.8 CC[C@H](N)C(=O)NCCO Amb28041840 [0,2,0,0,0,0|1,0,1]=4 4381 B9R0.8 CC[C@H](O)[C@@H](C)\C=C\OC Amb27839253 [0,2,0,0,0,0|2,0,0]=4 4382 B9R0.8 CC[C@H](O)[C@H](C)\C=C\OC Amb28344647 [0,2,0,0,0,0|2,0,0]=4 4383 B9R0.8 CC\C=C\C(=O)C(O)CC Amb24509139 [0,2,0,0,0,0|1,0,1]=4 4384 B9R0.8 CC\C=C\[C@@H](O)[C@@H](N)CO Amb17608091 [0,2,0,0,0,0|0,0,0]=2 4385 B9R0.8 CN(CCCO)C(=O)CS Amb27982262 [0,2,0,0,0,0|2,0,0]=4 4386 B9R0.8 CNC(=S)N(C)CCCO Amb28063677 [0,2,0,0,0,0|2,0,0]=4 4387 B9R0.8 COC(=O)C(=O)CCCBr Amb24440505 [0,2,0,0,0,0|2,0,0]=4 4388 B9R0.8 COC(=O)C(=O)CCCCl Amb28287936 [0,2,0,0,0,0|2,0,0]=4 4389 B9R0.8 COC(=O)C(=O)OCCO Amb27832192 [0,2,0,0,0,0|2,0,0]=4 4390 B9R0.8 COC(=O)C(N)CCCO Amb18644325 [0,2,0,0,0,0|1,0,1]=4 4391 B9R0.8 COC(=O)[C@@H](N)CCCO Amb27260220 [0,2,0,0,0,0|1,0,1]=4 4392 B9R0.8 COC(=O)[C@H](O)CCCO Amb27766582 [0,2,0,0,0,0|1,0,1]=4 4393 B9R0.8 C\C=C(/C)C(=O)CCCC Amb27614929 [0,2,0,0,0,0|1,0,1]=4 4394 B9R0.8 C\C=C(\C)C(=O)NCCO Amb27775653 [0,2,0,0,0,0|1,0,1]=4 4395 B9R0.8 C\C=C\C=C(/C)C(O)CO Amb27970548 [0,2,0,0,0,0|0,0,2]=4 4396 B9R0.8 O=C(CO)[C@H](O)CCCO Amb27427126 [0,2,0,0,0,0|1,0,1]=4 4397 B9R0.8 OC\C=C\C(O)C(O)CBr Amb28076773 [0,2,0,0,0,0|2,0,0]=4 4398 B9R0.8 OC\C=C\C(O)C(O)CO Amb27164230 [0,2,0,0,0,0|1,0,0]=3 4399 B9R0.8 OC\C=C\[C@H](O)[C@@H](O)CBr Amb27876279 [0,2,0,0,0,0|2,0,0]=4 4400 B9R0.18 C#CCC\C(C)=C\CCCl Amb28049615 [0,2,0,0,0,0|1,0,1]=4 4401 B9R0.18 C#CCC\C(C)=C\CCN Amb28049612 [0,2,0,0,0,0|1,0,1]=4 4402 B9R0.18 C=C(CCCC)CCCC Amb22641581 [0,2,0,0,0,0|1,0,1]=4 4403 B9R0.18 C=C(CCCC)CCCN Amb27168161 [0,2,0,0,0,0|1,0,1]=4 4404 B9R0.18 C=C(CCCC)CCCO Amb28318705 [0,2,0,0,0,0|0,0,1]=3 4405 B9R0.18 C=C(CCCO)CCCO Amb27451061 [0,2,0,0,0,0|0,0,1]=3 4406 B9R0.18 C=CCCC(=O)CCCO Amb28049909 [0,2,0,0,0,0|0,0,2]=4 4407 B9R0.18 C=CCCC(O)\C=C\CC Amb28064086 [0,2,0,0,0,0|1,0,0]=3 4408 B9R0.18 C=CCC\C(C)=C/CCCl Amb28323849 [0,2,0,0,0,0|1,0,1]=4 4409 B9R0.18 C=CC\C=C(\C)CCCN Amb27865880 [0,2,0,0,0,0|1,0,1]=4 4410 B9R0.18 C=CC\C=C(\C)CCCO Amb27435598 [0,2,0,0,0,0|0,0,1]=3 4411 B9R0.18 CC#CCC(=O)CCCO Amb28453794 [0,2,0,0,0,0|0,0,2]=4 4412 B9R0.18 CC#C\C=C(\C)CCCN Amb28246293 [0,2,0,0,0,0|1,0,1]=4 4413 B9R0.18 CCCCC(=O)CCCC Amb534166 [0,2,0,0,0,0|1,0,1]=4 4414 B9R0.18 CCCCC(=O)CCCCl Amb26353274 [0,2,0,0,0,0|1,0,1]=4 4415 B9R0.18 CCCCC(=O)CCCN Amb28050428 [0,2,0,0,0,0|1,0,1]=4 4416 B9R0.18 CCCCC(=O)CCCO Amb25146585 [0,2,0,0,0,0|0,0,1]=3 4417 B9R0.18 CCCCC(=O)CCNC Amb27771104 [0,2,0,0,0,0|1,0,1]=4 4418 B9R0.18 CCCCC(=O)COCC Amb26504310 [0,2,0,0,0,0|1,0,1]=4 4419 B9R0.18 CCCCC(=O)NOCC Amb10572674 [0,2,0,0,0,0|2,0,0]=4 4420 B9R0.18 CCCCC(=O)OCCBr Amb24709719 [0,2,0,0,0,0|2,0,0]=4 4421 B9R0.18 CCCCC(=O)OCCO Amb27218716 [0,2,0,0,0,0|1,0,1]=4 4422 B9R0.18 CCCCC(=O)\C=C\CCl Amb24688759 [0,2,0,0,0,0|1,0,1]=4 4423 B9R0.18 CCCCC(=O)\C=C\OC Amb26388254 [0,2,0,0,0,0|1,0,1]=4 4424 B9R0.18 CCCCC(C)CCCO Amb28256728 [0,2,0,0,0,0|0,0,2]=4 4425 B9R0.18 CCCCC(C)NCCO Amb9640301 [0,2,0,0,0,0|0,0,2]=4 4426 B9R0.18 CCCCC(Cl)CCCO Amb24482147 [0,2,0,0,0,0|0,0,2]=4 4427 B9R0.18 CCCCC(O)CCCO Amb27952639 [0,2,0,0,0,0|0,0,2]=4 4428 B9R0.18 CCCCC(O)CCOC Amb27410357 [0,2,0,0,0,0|0,0,2]=4 4429 B9R0.18 CCCCC(O)\C=C\CO Amb28050649 [0,2,0,0,0,0|2,0,0]=4 4430 B9R0.18 CCCC[C@@H](C)CCCO Amb27598602 [0,2,0,0,0,0|0,0,2]=4 4431 B9R0.18 CCCC[C@@H](C)\C=C\CO Amb28350350 [0,2,0,0,0,0|2,0,0]=4 4432 B9R0.18 CCCC[C@H](C)CCCO Amb27869929 [0,2,0,0,0,0|0,0,2]=4 4433 B9R0.18 CCCC[C@H](O)\C=C\CO Amb27213889 [0,2,0,0,0,0|2,0,0]=4 4434 B9R0.18 CCCC\C(C)=C\CCBr Amb27231454 [0,2,0,0,0,0|1,0,0]=3 4435 B9R0.18 CCCC\C(C)=C\CCCl Amb28064307 [0,2,0,0,0,0|1,0,0]=3 4436 B9R0.18 CCCC\C(C)=C\CCN Amb27864878 [0,2,0,0,0,0|1,0,0]=3 4437 B9R0.18 CCCC\C(C)=N\OCC Amb27649093 [0,2,0,0,0,0|2,0,0]=4 4438 B9R0.18 CCCNC(=O)CCCCl Amb1135964 [0,2,0,0,0,0|1,0,1]=4 4439 B9R0.18 CCCNC(=O)CCCS Amb27802904 [0,2,0,0,0,0|0,1,1]=4 4440 B9R0.18 CCCNC(=O)OCCO Amb27593341 [0,2,0,0,0,0|1,0,1]=4 4441 B9R0.18 CCCNC(C)CCOC Amb27768598 [0,2,0,0,0,0|1,0,1]=4 4442 B9R0.18 CCCOC(=O)CCCBr Amb28287770 [0,2,0,0,0,0|1,0,1]=4 4443 B9R0.18 CCCOC(=O)CCCS Amb27466699 [0,2,0,0,0,0|0,1,1]=4 4444 B9R0.18 CCCOC(=O)NCCO Amb28043117 [0,2,0,0,0,0|1,0,1]=4 4445 B9R0.18 CCC\C=C(C)/C=C/CO Amb28119581 [0,2,0,0,0,0|0,0,2]=4 4446 B9R0.18 CCNCC(C)CCCO Amb27255822 [0,2,0,0,0,0|0,0,2]=4 4447 B9R0.18 CCNCC(O)CCCO Amb25952361 [0,2,0,0,0,0|0,0,2]=4 4448 B9R0.18 CCOCC(=O)CCCCl Amb28323349 [0,2,0,0,0,0|1,0,1]=4 4449 B9R0.18 CCOCC(=O)OCCO Amb27839369 [0,2,0,0,0,0|1,0,1]=4 4450 B9R0.18 CCOCC(Br)CCCO Amb27617162 [0,2,0,0,0,0|0,0,2]=4 4451 B9R0.18 CCOCC(C)OCCO Amb27600580 [0,2,0,0,0,0|1,0,1]=4 4452 B9R0.18 CCOCC(N)CCOC Amb28204579 [0,2,0,0,0,0|1,0,1]=4 4453 B9R0.18 CCOCC(O)CCOC Amb27465405 [0,2,0,0,0,0|1,0,1]=4 4454 B9R0.18 CCONC(=O)CCCCl Amb27839066 [0,2,0,0,0,0|2,0,0]=4 4455 B9R0.18 CC\C=C\C(=O)CCC=O Amb18643586 [0,2,0,0,0,0|0,0,2]=4 4456 B9R0.18 CC\C=C\C(=O)CCCC Amb25219828 [0,2,0,0,0,0|1,0,0]=3 4457 B9R0.18 CC\C=C\C(=O)COCC Amb27839580 [0,2,0,0,0,0|1,0,1]=4 4458 B9R0.18 CC\C=C\C(=O)NCCN Amb26008017 [0,2,0,0,0,0|1,0,1]=4 4459 B9R0.18 CC\C=C\C(=O)NCCO Amb28293734 [0,2,0,0,0,0|0,0,1]=3 4460 B9R0.18 CC\C=C\C(=O)OCCF Amb27857751 [0,2,0,0,0,0|1,0,1]=4 4461 B9R0.18 CC\C=C\C(=O)OCOC Amb27598276 [0,2,0,0,0,0|1,0,1]=4 4462 B9R0.18 CC\C=C\C(O)COCC Amb27213918 [0,2,0,0,0,0|1,0,0]=3 4463 B9R0.18 CN(CCCN)CCCO Amb26327590 [0,2,0,0,0,0|1,0,1]=4 4464 B9R0.18 CNCCN(C)CCCO Amb27471059 [0,2,0,0,0,0|1,0,1]=4 4465 B9R0.18 COCCC(=O)NCCO Amb27604690 [0,2,0,0,0,0|1,0,1]=4 4466 B9R0.18 COCCC(=O)OCCO Amb25845430 [0,2,0,0,0,0|1,0,1]=4 4467 B9R0.18 COCCC(Br)CCCO Amb27753938 [0,2,0,0,0,0|0,0,2]=4 4468 B9R0.18 COCCC(C)CCCO Amb27663082 [0,2,0,0,0,0|0,0,2]=4 4469 B9R0.18 COCCN(C)CCCO Amb17334275 [0,2,0,0,0,0|1,0,1]=4 4470 B9R0.18 COCC[C@H](C)CCCO Amb27216439 [0,2,0,0,0,0|0,0,2]=4 4471 B9R0.18 COCOC(C)\C=C\CCl Amb26413606 [0,2,0,0,0,0|2,0,0]=4 4472 B9R0.18 COC\C=C(C)/C=C/CO Amb27775894 [0,2,0,0,0,0|0,0,2]=4 4473 B9R0.18 CO\C=C\C(C)CCCO Amb27431438 [0,2,0,0,0,0|1,0,0]=3 4474 B9R0.18 CO\C=C\[C@@H](C)CCC=O Amb27390146 [0,2,0,0,0,0|1,0,1]=4 4475 B9R0.18 CO\C=C\[C@@H](C)CCCO Amb27395954 [0,2,0,0,0,0|1,0,0]=3 4476 B9R0.18 CP(CCCO)CCCO Amb28050734 [0,2,0,0,0,0|1,0,1]=4 4477 B9R0.18 CS\C=C\C(=O)NCCO Amb25296903 [0,2,0,0,0,0|1,0,1]=4 4478 B9R0.18 CS\C=C\C(C)CCCO Amb27835868 [0,2,0,0,0,0|1,0,0]=3 4479 B9R0.18 C[C@@H](\C=C\C#N)OCCO Amb27589414 [0,2,0,0,0,0|1,0,1]=4 4480 B9R0.18 NCCOC(=O)CCCO Amb27811652 [0,2,0,0,0,0|1,0,0]=3 4481 B9R0.18 O=C(CCCBr)CCCBr Amb8394101 [0,2,0,0,0,0|1,0,1]=4 4482 B9R0.18 O=C(CCCCl)CCCCl Amb4020427 [0,2,0,0,0,0|1,0,1]=4 4483 B9R0.18 O=C(CCCO)NCCO Amb25147346 [0,2,0,0,0,0|1,0,0]=3 4484 B9R0.18 O=C(CCCS)NCCF Amb27765952 [0,2,0,0,0,0|1,1,0]=4 4485 B9R0.18 O=C(CCCS)NCCO Amb27872364 [0,2,0,0,0,0|1,0,1]=4 4486 B9R0.18 O=C(NCCO)NCCO Amb2798049 [0,2,0,0,0,0|2,0,0]=4 4487 B9R0.18 O=C(NCCO)OCCO Amb24661614 [0,2,0,0,0,0|2,0,0]=4 4488 B9R0.18 OCCCC(O)CCCCl Amb27873417 [0,2,0,0,0,0|0,0,2]=4 4489 B9R0.18 OCCC[C@@H](O)CCCCl Amb27391692 [0,2,0,0,0,0|0,0,2]=4 4490 B9R0.18 OCCC[C@H](O)CCCCl Amb27879294 [0,2,0,0,0,0|0,0,2]=4 4491 B9R0.18 OCCNC(=S)NCCF Amb33190544 [0,2,0,0,0,0|2,0,0]=4 4492 B9R0.18 OCCNC(=S)NCCO Amb28125305 [0,2,0,0,0,0|2,0,0]=4 4493 B9R0.18 OCCSC(=S)SCCO Amb28044416 [0,2,0,0,0,0|2,0,0]=4 4494 B9R0.18 OC\C=C\[C@@H](O)CCCO Amb28064019 [0,2,0,0,0,0|1,0,0]=3 4495 B9R0.34 C=C(CC)CC(Cl)CCC Amb27215882 [0,2,0,0,0,0|1,0,1]=4 4496 B9R0.34 C=C(CC)CC(N)CCC Amb28190409 [0,2,0,0,0,0|1,0,1]=4 4497 B9R0.34 C=C(CC)CN(C)CCO Amb27952083 [0,2,0,0,0,0|1,0,1]=4 4498 B9R0.34 CC(CCO)NC(=O)CBr Amb27229554 [0,2,0,0,0,0|2,0,0]=4 4499 B9R0.34 CCC(=O)CN(C)CCO Amb27776420 [0,2,0,0,0,0|1,0,1]=4 4500 B9R0.34 CCC(=O)NC(C)CCCl Amb27761060 [0,2,0,0,0,0|2,0,0]=4 4501 B9R0.34 CCC(=O)N[C@H](C)CCO Amb27487290 [0,2,0,0,0,0|1,0,0]=3 4502 B9R0.34 CCC(C)CC(N)CCO Amb28399464 [0,2,0,0,0,0|0,0,2]=4 4503 B9R0.34 CCC(N)CC(O)CCO Amb27866271 [0,2,0,0,0,0|0,0,2]=4 4504 B9R0.34 CCCC(=O)CC(C)CO Amb28381269 [0,2,0,0,0,0|0,0,1]=3 4505 B9R0.34 CCCC(=O)CC(Cl)CCl Amb27424779 [0,2,0,0,0,0|1,0,1]=4 4506 B9R0.34 CCCC(=O)CC(N)CC Amb27247540 [0,2,0,0,0,0|1,0,1]=4 4507 B9R0.34 CCCC(=O)CC(O)CBr Amb27841612 [0,2,0,0,0,0|1,0,1]=4 4508 B9R0.34 CCCC(=O)C[C@@H](C)CC Amb28351517 [0,2,0,0,0,0|1,0,1]=4 4509 B9R0.34 CCCC(=O)C[C@@H](O)CCl Amb27599956 [0,2,0,0,0,0|1,0,1]=4 4510 B9R0.34 CCCC(=O)C[C@H](O)CC Amb27434206 [0,2,0,0,0,0|1,0,1]=4 4511 B9R0.34 CCCC(=O)C[C@H](O)CCl Amb27815107 [0,2,0,0,0,0|1,0,1]=4 4512 B9R0.34 CCCC(=O)NC(C)CO Amb9275926 [0,2,0,0,0,0|1,0,1]=4 4513 B9R0.34 CCCC(=O)N[C@@H](C)CO Amb26490619 [0,2,0,0,0,0|1,0,1]=4 4514 B9R0.34 CCCC(=O)OC(C)CO Amb28206439 [0,2,0,0,0,0|1,0,1]=4 4515 B9R0.34 CCCC(=O)\C=C(\C)CC Amb27844093 [0,2,0,0,0,0|1,0,1]=4 4516 B9R0.34 CCCC(=O)\C=C(\O)CC Amb27854935 [0,2,0,0,0,0|1,0,1]=4 4517 B9R0.34 CCCC(C)CC(C)CO Amb27869680 [0,2,0,0,0,0|0,0,2]=4 4518 B9R0.34 CCCC(C)CC(N)CO Amb27770369 [0,2,0,0,0,0|0,0,2]=4 4519 B9R0.34 CCCC(C)\C=C(\C)CCl Amb27785145 [0,2,0,0,0,0|2,0,0]=4 4520 B9R0.34 CCCC(C)\C=C(\C)CO Amb27171160 [0,2,0,0,0,0|2,0,0]=4 4521 B9R0.34 CCCC(O)CC(=O)CC Amb28204050 [0,2,0,0,0,0|1,0,1]=4 4522 B9R0.34 CCCC(O)\C=C(\C)OC Amb27424758 [0,2,0,0,0,0|2,0,0]=4 4523 B9R0.34 CCC[C@@H](C)C[C@@H](C)CO Amb26920680 [0,2,0,0,0,0|0,0,2]=4 4524 B9R0.34 CCC[C@@H](C)C[C@H](C)CO Amb26632583 [0,2,0,0,0,0|0,0,2]=4 4525 B9R0.34 CCNC(=O)CC(C)CN Amb28291279 [0,2,0,0,0,0|2,0,0]=4 4526 B9R0.34 CCNC(=O)OC(C)CO Amb28252827 [0,2,0,0,0,0|2,0,0]=4 4527 B9R0.34 CCOC(=O)CC(=O)CO Amb25759916 [0,2,0,0,0,0|1,0,1]=4 4528 B9R0.34 CCOC(=O)CC(Br)CBr Amb28050307 [0,2,0,0,0,0|2,0,0]=4 4529 B9R0.34 CCOC(=O)CC(C)CBr Amb28315785 [0,2,0,0,0,0|2,0,0]=4 4530 B9R0.34 CCOC(=O)CC(C)CN Amb22059484 [0,2,0,0,0,0|2,0,0]=4 4531 B9R0.34 CCOC(=O)CC(C)CN Amb28555540 [0,2,0,0,0,0|2,0,0]=4 4532 B9R0.34 CCOC(=O)CC(F)CI Amb22738582 [0,2,0,0,0,0|2,0,0]=4 4533 B9R0.34 CCOC(=O)CC(N)CC Amb18644203 [0,2,0,0,0,0|2,0,0]=4 4534 B9R0.34 CCOC(=O)CC(N)CF Amb27788147 [0,2,0,0,0,0|2,0,0]=4 4535 B9R0.34 CCOC(=O)CC(N)CO Amb24477090 [0,2,0,0,0,0|1,0,0]=3 4536 B9R0.34 CCOC(=O)CC(N)CO Amb32652519 [0,2,0,0,0,0|1,0,0]=3 4537 B9R0.34 CCOC(=O)CC(O)CBr Amb22733258 [0,2,0,0,0,0|2,0,0]=4 4538 B9R0.34 CCOC(=O)CC(O)CC Amb24476858 [0,2,0,0,0,0|2,0,0]=4 4539 B9R0.34 CCOC(=O)CC(O)CCl Amb17594152 [0,2,0,0,0,0|2,0,0]=4 4540 B9R0.34 CCOC(=O)CC(O)CI Amb22736620 [0,2,0,0,0,0|2,0,0]=4 4541 B9R0.34 CCOC(=O)CC(O)CN Amb25095715 [0,2,0,0,0,0|2,0,0]=4 4542 B9R0.34 CCOC(=O)C[C@@H](C)CBr Amb27817654 [0,2,0,0,0,0|2,0,0]=4 4543 B9R0.34 CCOC(=O)C[C@@H](C)CN Amb32674505 [0,2,0,0,0,0|2,0,0]=4 4544 B9R0.34 CCOC(=O)C[C@@H](N)CC Amb26960441 [0,2,0,0,0,0|2,0,0]=4 4545 B9R0.34 CCOC(=O)C[C@@H](O)CC Amb27839424 [0,2,0,0,0,0|2,0,0]=4 4546 B9R0.34 CCOC(=O)C[C@@H](O)CCl Amb4166305 [0,2,0,0,0,0|2,0,0]=4 4547 B9R0.34 CCOC(=O)C[C@@H](O)CN Amb25224575 [0,2,0,0,0,0|2,0,0]=4 4548 B9R0.34 CCOC(=O)C[C@@H](O)CO Amb27839245 [0,2,0,0,0,0|1,0,0]=3 4549 B9R0.34 CCOC(=O)C[C@H](C)CN Amb33737746 [0,2,0,0,0,0|2,0,0]=4 4550 B9R0.34 CCOC(=O)C[C@H](N)CC Amb24351614 [0,2,0,0,0,0|2,0,0]=4 4551 B9R0.34 CCOC(=O)C[C@H](O)CBr Amb8386082 [0,2,0,0,0,0|2,0,0]=4 4552 B9R0.34 CCOC(=O)C[C@H](O)CCl Amb4166309 [0,2,0,0,0,0|2,0,0]=4 4553 B9R0.34 CCOC(=O)C[C@H](O)CI Amb26580575 [0,2,0,0,0,0|2,0,0]=4 4554 B9R0.34 CCOC(=O)C[C@H](O)CN Amb27424973 [0,2,0,0,0,0|2,0,0]=4 4555 B9R0.34 CCOC(=O)C[C@H](O)CO Amb28144865 [0,2,0,0,0,0|1,0,0]=3 4556 B9R0.34 CCOC(=O)N[C@@H](C)CO Amb25836094 [0,2,0,0,0,0|2,0,0]=4 4557 B9R0.34 CCOC(=O)OC(C)CO Amb28190260 [0,2,0,0,0,0|2,0,0]=4 4558 B9R0.34 CCOC(C)CC(N)CO Amb33425390 [0,2,0,0,0,0|1,0,1]=4 4559 B9R0.34 CCSC(=O)CC(O)CC Amb27662004 [0,2,0,0,0,0|2,0,0]=4 4560 B9R0.34 CC[C@H](C)C[C@@H](C)CCO Amb27197151 [0,2,0,0,0,0|0,0,2]=4 4561 B9R0.34 CC\C(C)=C/C(=O)CCO Amb27236279 [0,2,0,0,0,0|0,0,1]=3 4562 B9R0.34 CC\C=C(/C)CC(N)CC Amb27880616 [0,2,0,0,0,0|1,0,0]=3 4563 B9R0.34 CC\C=C(/C)CC(N)CO Amb27430465 [0,2,0,0,0,0|0,0,0]=2 4564 B9R0.34 CC\C=C(/C)C[C@@H](C)C=O Amb27838144 [0,2,0,0,0,0|0,0,2]=4 4565 B9R0.34 CC\C=C(\C)C[C@@H](C)CO Amb27448843 [0,2,0,0,0,0|0,0,0]=2 4566 B9R0.34 COC(=O)CC(N)CCO Amb27250761 [0,2,0,0,0,0|1,0,1]=4 4567 B9R0.34 COC(=O)C[C@@H](C)CCO Amb27946901 [0,2,0,0,0,0|1,0,1]=4 4568 B9R0.34 COC(=O)N[C@H](C)CCO Amb27261062 [0,2,0,0,0,0|2,0,0]=4 4569 B9R0.34 COC(=O)OC(C)CCO Amb28065268 [0,2,0,0,0,0|2,0,0]=4 4570 B9R0.34 COC(=O)\C=C(\C)CCO Amb28281735 [0,2,0,0,0,0|1,0,1]=4 4571 B9R0.34 C\C=C\C(=O)CC(C)CC Amb27839574 [0,2,0,0,0,0|1,0,1]=4 4572 B9R0.34 C\C=C\C(=O)N[C@@H](C)CO Amb28386277 [0,2,0,0,0,0|1,0,1]=4 4573 B9R0.35 C=C(CCC)C(O)CCC Amb27598582 [0,2,0,0,0,0|1,0,1]=4 4574 B9R0.35 C=CCC(O)\C(C)=C/CC Amb27472530 [0,2,0,0,0,0|1,0,1]=4 4575 B9R0.35 C=CC[C@@H](O)\C(C)=C/CC Amb27598523 [0,2,0,0,0,0|1,0,1]=4 4576 B9R0.35 C=CC[C@H](O)\C(C)=C/CC Amb27826838 [0,2,0,0,0,0|1,0,1]=4 4577 B9R0.35 CCCC(=O)C(C)CCC Amb22230010 [0,2,0,0,0,0|1,0,1]=4 4578 B9R0.35 CCCC(=O)C(Cl)CCC Amb28384164 [0,2,0,0,0,0|1,0,1]=4 4579 B9R0.35 CCCC(=O)C(O)CCC Amb2721183 [0,2,0,0,0,0|1,0,1]=4 4580 B9R0.35 CCCC(=O)[C@@H](O)CCC Amb27613184 [0,2,0,0,0,0|1,0,1]=4 4581 B9R0.35 CCCC(Br)C(=O)OCC Amb3939966 [0,2,0,0,0,0|2,0,0]=4 4582 B9R0.35 CCCC(C)C(=O)OCC Amb9273976 [0,2,0,0,0,0|2,0,0]=4 4583 B9R0.35 CCCC(Cl)C(=O)NCC Amb18800743 [0,2,0,0,0,0|2,0,0]=4 4584 B9R0.35 CCCC(Cl)C(=O)OCC Amb18800860 [0,2,0,0,0,0|2,0,0]=4 4585 B9R0.35 CCCC(N)C(=O)NCC Amb9514806 [0,2,0,0,0,0|2,0,0]=4 4586 B9R0.35 CCCC(N)C(=O)OCC Amb9494880 [0,2,0,0,0,0|2,0,0]=4 4587 B9R0.35 CCCC(O)C(=O)NCC Amb28348572 [0,2,0,0,0,0|2,0,0]=4 4588 B9R0.35 CCCC(O)C(=O)OCC Amb22350176 [0,2,0,0,0,0|2,0,0]=4 4589 B9R0.35 CCC[C@@H](C)[C@@H](O)CCO Amb27790262 [0,2,0,0,0,0|0,0,2]=4 4590 B9R0.35 CCC[C@@H](N)C(=O)OCC Amb8385904 [0,2,0,0,0,0|2,0,0]=4 4591 B9R0.35 CCC[C@H](N)C(=O)OCC Amb16233901 [0,2,0,0,0,0|2,0,0]=4 4592 B9R0.35 CCC[C@H](N)C(=O)OCC Amb22747761 [0,2,0,0,0,0|2,0,0]=4 4593 B9R0.35 CCC[C@H](O)C(=O)OCC Amb27750209 [0,2,0,0,0,0|2,0,0]=4 4594 B9R0.35 CCNC(=O)C(Br)CCBr Amb27397876 [0,2,0,0,0,0|2,0,0]=4 4595 B9R0.35 CCNC(=O)N(C)CCO Amb28342755 [0,2,0,0,0,0|2,0,0]=4 4596 B9R0.35 CCNC(=S)N(C)CCO Amb27752777 [0,2,0,0,0,0|2,0,0]=4 4597 B9R0.35 CCOC(=O)C(Br)CCBr Amb20621215 [0,2,0,0,0,0|2,0,0]=4 4598 B9R0.35 CCOC(=O)C(C)CCBr Amb27666471 [0,2,0,0,0,0|2,0,0]=4 4599 B9R0.35 CCOC(=O)C(C)CCN Amb25824172 [0,2,0,0,0,0|2,0,0]=4 4600 B9R0.35 CCOC(=O)C(C)CCO Amb28050604 [0,2,0,0,0,0|1,0,0]=3 4601 B9R0.35 CCOC(=O)C(F)CCBr Amb27800873 [0,2,0,0,0,0|2,0,0]=4 4602 B9R0.35 CCOC(=O)C(F)CCN Amb33741520 [0,2,0,0,0,0|2,0,0]=4 4603 B9R0.35 CCOC(=O)C(F)CCN Amb33743223 [0,2,0,0,0,0|2,0,0]=4 4604 B9R0.35 CCOC(=O)C(N)CCBr Amb27231542 [0,2,0,0,0,0|2,0,0]=4 4605 B9R0.35 CCOC(=O)C(N)CCF Amb27837851 [0,2,0,0,0,0|2,0,0]=4 4606 B9R0.35 CCOC(=O)C(N)CCN Amb27461329 [0,2,0,0,0,0|2,0,0]=4 4607 B9R0.35 CCOC(=O)C(N)CCO Amb25938154 [0,2,0,0,0,0|1,0,0]=3 4608 B9R0.35 CCOC(=O)C(O)CCBr Amb28207873 [0,2,0,0,0,0|2,0,0]=4 4609 B9R0.35 CCOC(=O)C(O)CCN Amb27474467 [0,2,0,0,0,0|2,0,0]=4 4610 B9R0.35 CCOC(=O)C(O)CNO Amb27856838 [0,2,0,0,0,0|2,0,0]=4 4611 B9R0.35 CCOC(=O)N(C)CCO Amb19408836 [0,2,0,0,0,0|2,0,0]=4 4612 B9R0.35 CCOC(=O)[C@@H](N)CCO Amb27200225 [0,2,0,0,0,0|1,0,0]=3 4613 B9R0.35 CCOC(=O)[C@@H](N)CSO Amb27597469 [0,2,0,0,0,0|2,0,0]=4 4614 B9R0.35 CCOC(=O)[C@@H](O)CCN Amb28120000 [0,2,0,0,0,0|2,0,0]=4 4615 B9R0.35 CCOC(=O)[C@@H](O)CCO Amb28050674 [0,2,0,0,0,0|1,0,0]=3 4616 B9R0.35 CCOC(=O)[C@H](N)CCO Amb25195256 [0,2,0,0,0,0|1,0,0]=3 4617 B9R0.35 CCOC(C)C(N)CCO Amb33425728 [0,2,0,0,0,0|1,0,1]=4 4618 B9R0.35 CCSC(=O)N(N)CCO Amb27396383 [0,2,0,0,0,0|2,0,0]=4 4619 B9R0.35 C\C=C\C(=O)N(C)CCO Amb27837584 [0,2,0,0,0,0|1,0,1]=4 4620 B9R0.35 C\C=C\C(O)C(C)CCO Amb27207425 [0,2,0,0,0,0|0,0,2]=4 4621 B9R0.40 CCCC(CO)CCCO Amb27424905 [0,2,0,0,0,0|0,0,2]=4 4622 B9R0.40 CCCC(\C=C\CCl)OC Amb27777907 [0,2,0,0,0,0|2,0,0]=4 4623 B9R0.40 CCCCC(CC)CCO Amb28293407 [0,2,0,0,0,0|0,0,2]=4 4624 B9R0.40 CCCCC(CO)CCO Amb27810571 [0,2,0,0,0,0|0,0,2]=4 4625 B9R0.40 CCCC[C@@H](CC)CCO Amb27829957 [0,2,0,0,0,0|0,0,2]=4 4626 B9R0.40 CCCC[C@@H](CO)CCO Amb27665485 [0,2,0,0,0,0|0,0,2]=4 4627 B9R0.40 CCCC\C(=C\CO)CO Amb27761569 [0,2,0,0,0,0|2,0,0]=4 4628 B9R0.40 CCCC\C(C=O)=C\OC Amb27841072 [0,2,0,0,0,0|2,0,0]=4 4629 B9R0.40 CCC\C=C(\CO)CCO Amb27471088 [0,2,0,0,0,0|0,0,2]=4 4630 B9R0.40 CCNC(CO)CCCO Amb27838837 [0,2,0,0,0,0|1,0,1]=4 4631 B9R0.40 CCNCC(CC)CCO Amb27837793 [0,2,0,0,0,0|1,0,1]=4 4632 B9R0.40 CCOC(C=O)CCCO Amb28050007 [0,2,0,0,0,0|1,0,1]=4 4633 B9R0.40 CCSCC(CCO)NC Amb28141426 [0,2,0,0,0,0|1,0,1]=4 4634 B9R0.40 CC\C=C(/C=C/CO)CC Amb27838935 [0,2,0,0,0,0|0,0,2]=4 4635 B9R0.40 CC\C=C(/C=O)CCCC Amb27966532 [0,2,0,0,0,0|1,0,0]=3 4636 B9R0.40 CC\C=C(/CC)CCC=O Amb27877467 [0,2,0,0,0,0|0,0,2]=4 4637 B9R0.40 CC\C=C(\C=O)CCCO Amb28399203 [0,2,0,0,0,0|0,0,0]=2 4638 B9R0.40 CC\C=C(\CC)SCCO Amb27833631 [0,2,0,0,0,0|1,0,0]=3 4639 B9R0.40 CC\C=C(\CCl)CCCO Amb26397191 [0,2,0,0,0,0|0,0,0]=2 4640 B9R0.40 CC\C=C\C(CO)CCC Amb27775503 [0,2,0,0,0,0|1,0,0]=3 4641 B9R0.40 C\C=C\C(CO)CCCO Amb28344982 [0,2,0,0,0,0|0,0,2]=4 4642 B9R0.48 C=C(CCC)CCC(=O)O Amb27475552 [0,2,0,0,0,0|0,0,2]=4 4643 B9R0.48 CC(=O)\C=C\N(C)CCO Amb26847094 [0,2,0,0,0,0|1,0,1]=4 4644 B9R0.48 CC(C)CN[C@H](C)CCO Amb27802244 [0,2,0,0,0,0|1,0,1]=4 4645 B9R0.48 CC(C)OCC(N)CCO Amb32946597 [0,2,0,0,0,0|1,0,1]=4 4646 B9R0.48 CC(C)\C=C\C(C)CCO Amb27651668 [0,2,0,0,0,0|0,0,0]=2 4647 B9R0.48 CC(C)\C=C\C(N)CCO Amb26459702 [0,2,0,0,0,0|0,0,0]=2 4648 B9R0.48 CC(C)\C=C\[C@H](C)CCBr Amb27591897 [0,2,0,0,0,0|1,0,0]=3 4649 B9R0.48 CC(\C=C\C(=O)O)CCO Amb27646330 [0,2,0,0,0,0|1,0,1]=4 4650 B9R0.48 CCCC(=O)CCB(O)O Amb28049896 [0,2,0,0,0,0|1,0,1]=4 4651 B9R0.48 CCCC(=O)CCC(C)C Amb9031590 [0,2,0,0,0,0|1,0,1]=4 4652 B9R0.48 CCCC(=O)CCC(C)N Amb27866591 [0,2,0,0,0,0|1,0,1]=4 4653 B9R0.48 CCCC(=O)CCC(Cl)Cl Amb27658976 [0,2,0,0,0,0|1,0,1]=4 4654 B9R0.48 CCCC(=O)NCC(C)O Amb9275481 [0,2,0,0,0,0|1,0,1]=4 4655 B9R0.48 CCCC(=O)OCC(C)O Amb26603876 [0,2,0,0,0,0|1,0,1]=4 4656 B9R0.48 CCCC(Br)\C=C\C(C)=O Amb27463361 [0,2,0,0,0,0|1,0,1]=4 4657 B9R0.48 CCCC(C)CCC(C)O Amb26868390 [0,2,0,0,0,0|0,0,2]=4 4658 B9R0.48 CCCC(C)CC[C@@H](C)O Amb33321144 [0,2,0,0,0,0|0,0,2]=4 4659 B9R0.48 CCCC(C)CC[C@H](C)O Amb33321145 [0,2,0,0,0,0|0,0,2]=4 4660 B9R0.48 CCCC(C)\C=C\C(C)=O Amb24686480 [0,2,0,0,0,0|1,0,1]=4 4661 B9R0.48 CCCC(C)\C=C\C(C)Br Amb27491169 [0,2,0,0,0,0|1,0,0]=3 4662 B9R0.48 CCCC(C)\C=C\C(C)N Amb33321293 [0,2,0,0,0,0|1,0,0]=3 4663 B9R0.48 CCCC(C)\C=C\C(C)O Amb27262557 [0,2,0,0,0,0|1,0,0]=3 4664 B9R0.48 CCC[C@@H](O)\C=C\S(C)=O Amb27833711 [0,2,0,0,0,0|2,0,0]=4 4665 B9R0.48 CCNC(=N)CCC(C)C Amb27255688 [0,2,0,0,0,0|2,0,0]=4 4666 B9R0.48 CCNC(=O)CCC(=O)O Amb2967295 [0,2,0,0,0,0|1,0,1]=4 4667 B9R0.48 CCNC(=O)CCC(C)N Amb28195386 [0,2,0,0,0,0|2,0,0]=4 4668 B9R0.48 CCNC(=O)CCC(C)O Amb17334243 [0,2,0,0,0,0|1,0,0]=3 4669 B9R0.48 CCNC(=O)CCC(Cl)Cl Amb32672000 [0,2,0,0,0,0|2,0,0]=4 4670 B9R0.48 CCNC(=O)NCC(C)O Amb9361473 [0,2,0,0,0,0|2,0,0]=4 4671 B9R0.48 CCNC(=S)NC[C@H](C)O Amb27210586 [0,2,0,0,0,0|2,0,0]=4 4672 B9R0.48 CCNC(C)\C=C\C(C)C Amb28207672 [0,2,0,0,0,0|2,0,0]=4 4673 B9R0.48 CCN\C(N)=N\C[C@H](C)O Amb28189831 [0,2,0,0,0,0|2,0,0]=4 4674 B9R0.48 CCOC(=O)CCB(O)O Amb25244100 [0,2,0,0,0,0|2,0,0]=4 4675 B9R0.48 CCOC(=O)CCC(=O)O Amb1151260 [0,2,0,0,0,0|1,0,1]=4 4676 B9R0.48 CCOC(=O)CCC(C)Br Amb20618752 [0,2,0,0,0,0|2,0,0]=4 4677 B9R0.48 CCOC(=O)CCC(C)C Amb9273760 [0,2,0,0,0,0|2,0,0]=4 4678 B9R0.48 CCOC(=O)CCC(C)N Amb25690130 [0,2,0,0,0,0|2,0,0]=4 4679 B9R0.48 CCOC(=O)CCC(C)N Amb33552104 [0,2,0,0,0,0|2,0,0]=4 4680 B9R0.48 CCOC(=O)CCC(C)O Amb26877286 [0,2,0,0,0,0|1,0,0]=3 4681 B9R0.48 CCOC(=O)CCC(F)F Amb22896370 [0,2,0,0,0,0|2,0,0]=4 4682 B9R0.48 CCOC(=O)CCS(=O)O Amb24551974 [0,2,0,0,0,0|2,0,0]=4 4683 B9R0.48 CCOC(=O)CC[C@@H](C)O Amb27486190 [0,2,0,0,0,0|1,0,0]=3 4684 B9R0.48 CCOC(=O)CC[C@H](C)O Amb28370101 [0,2,0,0,0,0|1,0,0]=3 4685 B9R0.48 CCOC(=O)NCC(C)O Amb9285612 [0,2,0,0,0,0|2,0,0]=4 4686 B9R0.48 CCOC(=O)NC[C@@H](C)O Amb27786644 [0,2,0,0,0,0|2,0,0]=4 4687 B9R0.48 CCOC(=O)OCC(C)O Amb27763424 [0,2,0,0,0,0|2,0,0]=4 4688 B9R0.48 CCOC(C)CCC(C)O Amb33425313 [0,2,0,0,0,0|1,0,1]=4 4689 B9R0.48 CCOC(C)CC[C@@H](C)O Amb33425310 [0,2,0,0,0,0|1,0,1]=4 4690 B9R0.48 CCOC(C)CC[C@H](C)O Amb33425312 [0,2,0,0,0,0|1,0,1]=4 4691 B9R0.48 CCOC(C)\C=C\C(C)N Amb33424976 [0,2,0,0,0,0|2,0,0]=4 4692 B9R0.48 CC\C=C(/C)CCC(=O)O Amb27832037 [0,2,0,0,0,0|0,0,1]=3 4693 B9R0.48 CC\C=C(/C)CCC(C)=O Amb27464326 [0,2,0,0,0,0|0,0,2]=4 4694 B9R0.48 CC\C=C(\C)CCC(=O)O Amb27811548 [0,2,0,0,0,0|0,0,1]=3 4695 B9R0.48 COCC(C)\C=C\C(C)Br Amb27596313 [0,2,0,0,0,0|2,0,0]=4 4696 B9R0.48 C[C@H](\C=C\C(=O)O)CCO Amb28050109 [0,2,0,0,0,0|1,0,1]=4 4697 B9R0.48 C\C(=C/C#N)CCC(C)O Amb28281198 [0,2,0,0,0,0|1,0,1]=4 4698 B9R0.48 C\C(=C/CCl)CCC(C)C Amb28340951 [0,2,0,0,0,0|2,0,0]=4 4699 B9R0.48 C\C(=C/CO)CCC(=O)O Amb27630663 [0,2,0,0,0,0|1,0,1]=4 4700 B9R0.48 C\C=C\C(=O)NC[C@@H](C)O Amb27836661 [0,2,0,0,0,0|1,0,1]=4 4701 B9R0.48 C\C=C\C(=O)OCC(C)O Amb28050689 [0,2,0,0,0,0|1,0,1]=4 4702 B9R0.66 CCCCC(C)(C)CCO Amb27472532 [0,2,0,0,0,0|0,0,2]=4 4703 B9R0.66 CCCS(=O)(=O)CCCO Amb17138615 [0,2,0,0,0,0|1,0,1]=4 4704 B9R0.66 CCOC(C)(C)CCCO Amb28453453 [0,2,0,0,0,0|1,0,1]=4 4705 B9R0.66 CCOP(=O)(O)CCCO Amb27839399 [0,2,0,0,0,0|2,0,0]=4 4706 B9R0.66 CCO[Si](C)(C)CCCO Amb27197088 [0,2,0,0,0,0|1,1,0]=4 4707 B9R0.66 CC\C=C\C(C)(C)CCN Amb33268278 [0,2,0,0,0,0|1,0,0]=3 4708 B9R0.66 CC\C=C\C(C)(C)CON Amb33268244 [0,2,0,0,0,0|2,0,0]=4 4709 B9R0.66 CC\C=C\C(F)(F)CCN Amb33409716 [0,2,0,0,0,0|1,0,0]=3 4710 B9R0.66 CC\C=C\C(F)(F)CCO Amb33409719 [0,2,0,0,0,0|0,0,0]=2 4711 B9R0.2 C#CCCC\C=C\C(C)=O Amb25205680 [0,2,0,0,0,0|1,0,1]=4 4712 B9R0.2 C#CCC\C=C\CC(C)=O Amb26626728 [0,2,0,0,0,0|1,0,1]=4 4713 B9R0.2 C#C\C=C\CCCC(=O)O Amb27227921 [0,2,0,0,0,0|0,0,2]=4 4714 B9R0.2 C=C(C)CC#CCCCO Amb27753081 [0,2,0,0,0,0|0,0,2]=4 4715 B9R0.2 C=C(C)C\C=C\CCCO Amb27661168 [0,2,0,0,0,0|0,0,0]=2 4716 B9R0.2 C=C(C)\C=C\CCCC=O Amb18643329 [0,2,0,0,0,0|0,0,2]=4 4717 B9R0.2 C=C(C)\C=C\OCCCO Amb27647918 [0,2,0,0,0,0|0,0,1]=3 4718 B9R0.2 C=C(Cl)CNC\C=C\CC Amb27422836 [0,2,0,0,0,0|1,0,1]=4 4719 B9R0.2 C=CCCC\C=C\C(C)=O Amb27628550 [0,2,0,0,0,0|1,0,1]=4 4720 B9R0.2 C=CC\C=C\CCC(=O)O Amb18643540 [0,2,0,0,0,0|0,0,2]=4 4721 B9R0.2 C=C\C=C\CCCC(C)O Amb27835919 [0,2,0,0,0,0|0,0,2]=4 4722 B9R0.2 CC(=O)\C=C\CCCCBr Amb24477141 [0,2,0,0,0,0|1,0,1]=4 4723 B9R0.2 CC(=O)\C=C\CCCCCl Amb27599396 [0,2,0,0,0,0|1,0,1]=4 4724 B9R0.2 CC(=O)\C=C\CCCCO Amb24518640 [0,2,0,0,0,0|0,0,1]=3 4725 B9R0.2 CC(=O)\N=C\CCCCO Amb27169910 [0,2,0,0,0,0|0,0,2]=4 4726 B9R0.2 CC(C)=CC\C=C\CCO Amb27257215 [0,2,0,0,0,0|0,0,2]=4 4727 B9R0.2 CC(C)C=C=CCCCO Amb28189165 [0,2,0,0,0,0|0,0,0]=2 4728 B9R0.2 CC(C)CC=C=CCCO Amb27427142 [0,2,0,0,0,0|0,0,2]=4 4729 B9R0.2 CC(C)CCC\C=C/CBr Amb27258137 [0,2,0,0,0,0|2,0,0]=4 4730 B9R0.2 CC(C)CCC\C=C\CBr Amb27435416 [0,2,0,0,0,0|2,0,0]=4 4731 B9R0.2 CC(C)CCC\C=C\CN Amb24560072 [0,2,0,0,0,0|2,0,0]=4 4732 B9R0.2 CC(C)CCC\C=C\CO Amb27427814 [0,2,0,0,0,0|2,0,0]=4 4733 B9R0.2 CC(C)CCNCCCO Amb6733599 [0,2,0,0,0,0|0,0,2]=4 4734 B9R0.2 CC(C)CCSCCCO Amb17502843 [0,2,0,0,0,0|0,0,2]=4 4735 B9R0.2 CC(C)CCS\C=C\CO Amb27839319 [0,2,0,0,0,0|2,0,0]=4 4736 B9R0.2 CC(C)CC\C=C\CCCl Amb27489237 [0,2,0,0,0,0|1,0,0]=3 4737 B9R0.2 CC(C)CC\C=C\CCN Amb27590783 [0,2,0,0,0,0|1,0,0]=3 4738 B9R0.2 CC(C)CNCCCCO Amb17334252 [0,2,0,0,0,0|0,0,2]=4 4739 B9R0.2 CC(C)CNC\C=C\CCl Amb27458184 [0,2,0,0,0,0|2,0,0]=4 4740 B9R0.2 CC(C)COCCCCO Amb27617219 [0,2,0,0,0,0|0,0,2]=4 4741 B9R0.2 CC(C)COCCCON Amb27420849 [0,2,0,0,0,0|1,0,1]=4 4742 B9R0.2 CC(C)CSC\C=C\CCl Amb27213342 [0,2,0,0,0,0|2,0,0]=4 4743 B9R0.2 CC(C)C\C=N\NCCO Amb28321549 [0,2,0,0,0,0|1,0,1]=4 4744 B9R0.2 CC(C)NCCCCCO Amb17334255 [0,2,0,0,0,0|0,0,2]=4 4745 B9R0.2 CC(C)NCCOCCO Amb28555415 [0,2,0,0,0,0|1,0,1]=4 4746 B9R0.2 CC(C)NCCOCCO Amb6736183 [0,2,0,0,0,0|1,0,1]=4 4747 B9R0.2 CC(C)OCCOCCO Amb26512332 [0,2,0,0,0,0|1,0,1]=4 4748 B9R0.2 CC(C)OCCSCCO Amb18800853 [0,2,0,0,0,0|1,0,1]=4 4749 B9R0.2 CC(C)OCC\C=C\CO Amb27169927 [0,2,0,0,0,0|2,0,0]=4 4750 B9R0.2 CC(C)OCOCCCO Amb27805428 [0,2,0,0,0,0|1,0,1]=4 4751 B9R0.2 CC(C)SCCOCCO Amb18180082 [0,2,0,0,0,0|1,0,1]=4 4752 B9R0.2 CC(C)SCCSCCO Amb27603017 [0,2,0,0,0,0|1,0,1]=4 4753 B9R0.2 CC(C)\C=C\C=C\CCBr Amb27481567 [0,2,0,0,0,0|1,0,1]=4 4754 B9R0.2 CC(C)\C=C\C=C\CCO Amb27839295 [0,2,0,0,0,0|0,0,1]=3 4755 B9R0.2 CC(C)\C=N\NCCCO Amb27396289 [0,2,0,0,0,0|1,0,0]=3 4756 B9R0.2 CC(N)CSCCCCO Amb27801506 [0,2,0,0,0,0|0,0,2]=4 4757 B9R0.2 CC(N)CSC\C=C\CN Amb27263552 [0,2,0,0,0,0|2,0,0]=4 4758 B9R0.2 CC(N)C\C=C\CCCN Amb27420122 [0,2,0,0,0,0|1,0,0]=3 4759 B9R0.2 CC(O)CC#CCCCO Amb28050415 [0,2,0,0,0,0|0,0,2]=4 4760 B9R0.2 CC(O)CCCCCCO Amb27272851 [0,2,0,0,0,0|0,0,2]=4 4761 B9R0.2 CC(O)CCCNCCN Amb27253160 [0,2,0,0,0,0|1,0,1]=4 4762 B9R0.2 CC(O)CCCNCCO Amb28343143 [0,2,0,0,0,0|0,0,2]=4 4763 B9R0.2 CC(O)CCC\C=C\CCl Amb24502312 [0,2,0,0,0,0|1,0,0]=3 4764 B9R0.2 CC(O)CCC\C=C\CO Amb27604113 [0,2,0,0,0,0|1,0,0]=3 4765 B9R0.2 CC(O)CCNCCCF Amb27817504 [0,2,0,0,0,0|1,0,1]=4 4766 B9R0.2 CC(O)CC\C=C\CC#N Amb28281357 [0,2,0,0,0,0|0,0,1]=3 4767 B9R0.2 CC(S)\C=C\CCCCO Amb27486620 [0,2,0,0,0,0|0,0,0]=2 4768 B9R0.2 CC=C=CCCCC(C)O Amb27465759 [0,2,0,0,0,0|0,0,2]=4 4769 B9R0.2 CCC#CCCCC(=O)O Amb27628844 [0,2,0,0,0,0|0,0,2]=4 4770 B9R0.2 CCCC=C=CCC(C)O Amb27826112 [0,2,0,0,0,0|0,0,2]=4 4771 B9R0.2 CCCCCCCB(O)O Amb13890611 [0,2,0,0,0,0|0,0,2]=4 4772 B9R0.2 CCCCCCCC(=O)O Amb3940371 [0,2,0,0,0,0|0,0,2]=4 4773 B9R0.2 CCCCCCCP(O)O Amb28042243 [0,2,0,0,0,0|0,0,2]=4 4774 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [0,2,0,0,0,0|0,0,2]=4 4775 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [0,2,0,0,0,0|0,0,2]=4 4776 B9R0.2 CCCCCCOC(C)O Amb28347016 [0,2,0,0,0,0|0,0,2]=4 4777 B9R0.2 CCCCCOC[C@H](C)O Amb27620605 [0,2,0,0,0,0|0,0,2]=4 4778 B9R0.2 CCCCC\C=C/C(C)C Amb22546691 [0,2,0,0,0,0|1,0,0]=3 4779 B9R0.2 CCCCC\C=C\C(C)C Amb22546757 [0,2,0,0,0,0|1,0,0]=3 4780 B9R0.2 CCCCC\C=C\C(C)O Amb27472596 [0,2,0,0,0,0|1,0,0]=3 4781 B9R0.2 CCCCC\C=C\[C@H](C)O Amb27852185 [0,2,0,0,0,0|1,0,0]=3 4782 B9R0.2 CCCCNCCC(C)O Amb27986026 [0,2,0,0,0,0|0,0,2]=4 4783 B9R0.2 CCCCN\C=C\C(C)=O Amb25147404 [0,2,0,0,0,0|1,0,1]=4 4784 B9R0.2 CCCCN\N=C\C(C)C Amb27857808 [0,2,0,0,0,0|2,0,0]=4 4785 B9R0.2 CCCCS\C=C/C(C)=O Amb27945160 [0,2,0,0,0,0|1,0,1]=4 4786 B9R0.2 CCCCS\C=C\C(C)=O Amb26410917 [0,2,0,0,0,0|1,0,1]=4 4787 B9R0.2 CCCC\C=C/CC(C)=O Amb26493143 [0,2,0,0,0,0|1,0,0]=3 4788 B9R0.2 CCCC\C=C\CC(=O)O Amb6297257 [0,2,0,0,0,0|1,0,1]=4 4789 B9R0.2 CCCC\C=C\CC(C)O Amb27839464 [0,2,0,0,0,0|1,0,0]=3 4790 B9R0.2 CCCC\C=C\CC(N)=O Amb1815461 [0,2,0,0,0,0|1,0,1]=4 4791 B9R0.2 CCCC\C=C\NC(C)=O Amb24674131 [0,2,0,0,0,0|1,0,1]=4 4792 B9R0.2 CCCC\C=C\OC(C)=O Amb25293926 [0,2,0,0,0,0|1,0,1]=4 4793 B9R0.2 CCCNCCCC(=O)O Amb1109953 [0,2,0,0,0,0|1,0,1]=4 4794 B9R0.2 CCCOCCCC(=O)O Amb8874517 [0,2,0,0,0,0|1,0,1]=4 4795 B9R0.2 CCCONCCC(C)O Amb27244555 [0,2,0,0,0,0|1,0,1]=4 4796 B9R0.2 CCCSCCCC(=O)O Amb6680215 [0,2,0,0,0,0|1,0,1]=4 4797 B9R0.2 CCC\C=C/CCC(=O)O Amb26566880 [0,2,0,0,0,0|0,0,1]=3 4798 B9R0.2 CCC\C=C\C=C\C(C)N Amb33373727 [0,2,0,0,0,0|1,0,1]=4 4799 B9R0.2 CCC\C=C\CCC(=O)O Amb25378821 [0,2,0,0,0,0|0,0,1]=3 4800 B9R0.2 CCC\C=C\CCC(C)=O Amb33359154 [0,2,0,0,0,0|0,0,2]=4 4801 B9R0.2 CCC\C=C\CCC(C)N Amb33424850 [0,2,0,0,0,0|1,0,0]=3 4802 B9R0.2 CCC\C=C\CCC(C)O Amb33424849 [0,2,0,0,0,0|0,0,0]=2 4803 B9R0.2 CCC\C=C\CCC(N)=O Amb27493443 [0,2,0,0,0,0|0,0,2]=4 4804 B9R0.2 CCC\C=C\CC[C@@H](C)N Amb33424844 [0,2,0,0,0,0|1,0,0]=3 4805 B9R0.2 CCC\C=C\CC[C@@H](C)O Amb33424845 [0,2,0,0,0,0|0,0,0]=2 4806 B9R0.2 CCC\C=C\CC[C@H](C)N Amb33424843 [0,2,0,0,0,0|1,0,0]=3 4807 B9R0.2 CCC\C=C\CC[C@H](C)O Amb33424847 [0,2,0,0,0,0|0,0,0]=2 4808 B9R0.2 CCC\C=C\CC[N+](=O)[O-] Amb33424827 [0,2,0,0,0,0|1,0,1]=4 4809 B9R0.2 CCNCCCCC(=O)O Amb24385094 [0,2,0,0,0,0|1,0,1]=4 4810 B9R0.2 CCNCCCCC(=O)O Amb32686610 [0,2,0,0,0,0|1,0,1]=4 4811 B9R0.2 CCNCC\C=C\C(C)C Amb27251097 [0,2,0,0,0,0|1,0,0]=3 4812 B9R0.2 CCOCCCCC(=O)O Amb9207786 [0,2,0,0,0,0|1,0,1]=4 4813 B9R0.2 CCOCCOCC(C)O Amb9787531 [0,2,0,0,0,0|1,0,1]=4 4814 B9R0.2 CCONCCCC(=O)O Amb27839067 [0,2,0,0,0,0|2,0,0]=4 4815 B9R0.2 CCSCCCCC(=O)O Amb7782874 [0,2,0,0,0,0|1,0,1]=4 4816 B9R0.2 CCSCCNC[C@H](C)O Amb27972582 [0,2,0,0,0,0|1,0,1]=4 4817 B9R0.2 CC\C=C\C=C\CC(C)N Amb27759906 [0,2,0,0,0,0|1,0,1]=4 4818 B9R0.2 CC\C=C\CCCC(C)N Amb28247293 [0,2,0,0,0,0|1,0,0]=3 4819 B9R0.2 CC\C=C\CCNC(C)C Amb28250456 [0,2,0,0,0,0|1,0,0]=3 4820 B9R0.2 CC\C=C\CCOC(C)=O Amb9134795 [0,2,0,0,0,0|0,0,2]=4 4821 B9R0.2 CC\C=C\CNCC(=O)O Amb27422845 [0,2,0,0,0,0|0,0,1]=3 4822 B9R0.2 CC\C=C\CNCC(C)O Amb27226293 [0,2,0,0,0,0|0,0,0]=2 4823 B9R0.2 CN(C)CC#CCCCO Amb28398960 [0,2,0,0,0,0|0,0,2]=4 4824 B9R0.2 CN(C)CC=C=CCCO Amb27839331 [0,2,0,0,0,0|0,0,2]=4 4825 B9R0.2 CN(C)CCCCCCO Amb17613201 [0,2,0,0,0,0|0,0,2]=4 4826 B9R0.2 CN(C)C\C=C\CCCO Amb28050571 [0,2,0,0,0,0|0,0,0]=2 4827 B9R0.2 CNCC\C=C/CC(C)C Amb27413055 [0,2,0,0,0,0|2,0,0]=4 4828 B9R0.2 COCCCNCC(C)C Amb6730181 [0,2,0,0,0,0|1,0,1]=4 4829 B9R0.2 COCCCNCC(C)N Amb28281327 [0,2,0,0,0,0|1,0,1]=4 4830 B9R0.2 COCCCNCC(C)O Amb17138417 [0,2,0,0,0,0|1,0,1]=4 4831 B9R0.2 COCCCOCC(C)N Amb27837579 [0,2,0,0,0,0|1,0,1]=4 4832 B9R0.2 COCCCOCC(C)O Amb27600623 [0,2,0,0,0,0|1,0,1]=4 4833 B9R0.2 COCCCOC[C@@H](C)N Amb28382568 [0,2,0,0,0,0|1,0,1]=4 4834 B9R0.2 COCCCSC[C@H](C)N Amb28344655 [0,2,0,0,0,0|1,0,1]=4 4835 B9R0.2 COCC\C=C\CN(C)C Amb27481767 [0,2,0,0,0,0|2,0,0]=4 4836 B9R0.2 COCC\C=C\C[C@H](C)O Amb28044299 [0,2,0,0,0,0|0,0,2]=4 4837 B9R0.2 COCOC\C=C\C(C)=O Amb26404277 [0,2,0,0,0,0|1,0,1]=4 4838 B9R0.2 COC\C=C\CCC(C)O Amb28065896 [0,2,0,0,0,0|0,0,0]=2 4839 B9R0.2 CS(=O)CCCCCCO Amb27771220 [0,2,0,0,0,0|0,0,2]=4 4840 B9R0.2 CS\C=C\CCCC(C)=O Amb28054428 [0,2,0,0,0,0|1,0,1]=4 4841 B9R0.2 C[C@@H](O)CCCCCCO Amb27406493 [0,2,0,0,0,0|0,0,2]=4 4842 B9R0.2 C[C@@H](O)CC\C=C\CC#N Amb27397051 [0,2,0,0,0,0|0,0,1]=3 4843 B9R0.2 C[C@@H](O)CNCCCCO Amb27235176 [0,2,0,0,0,0|0,0,2]=4 4844 B9R0.2 C[C@H](O)CC#CCCCO Amb28344979 [0,2,0,0,0,0|0,0,2]=4 4845 B9R0.2 C[C@H](O)CCC\C=C\C=O Amb27261384 [0,2,0,0,0,0|1,0,1]=4 4846 B9R0.2 C\C=C\C=C\CCC(=O)O Amb18643576 [0,2,0,0,0,0|0,0,2]=4 4847 B9R0.2 C\C=C\CCCCB(O)O Amb22167778 [0,2,0,0,0,0|0,0,2]=4 4848 B9R0.2 C\C=C\CCCCC(=O)O Amb18643887 [0,2,0,0,0,0|0,0,2]=4 4849 B9R0.2 C\C=C\CCNCC(C)O Amb27823058 [0,2,0,0,0,0|0,0,2]=4 4850 B9R0.2 FC(F)CNC\C=C\CCl Amb27666618 [0,2,0,0,0,0|2,0,0]=4 4851 B9R0.2 NC\C=C\CNCC(F)F Amb27412861 [0,2,0,0,0,0|2,0,0]=4 4852 B9R0.2 NC\C=C\COCC(F)F Amb28123664 [0,2,0,0,0,0|2,0,0]=4 4853 B9R0.2 O=C(O)CCC\C=C/CO Amb27425001 [0,2,0,0,0,0|1,0,0]=3 4854 B9R0.2 O=C(O)\C=C\CSCCO Amb27205770 [0,2,0,0,0,0|1,0,1]=4 4855 B9R0.2 OCCCC\C=C\B(O)O Amb24478495 [0,2,0,0,0,0|2,0,0]=4 4856 B9R0.45 C#CCCCCCCCO Amb10563785 [0,2,0,0,0,0|0,0,2]=4 4857 B9R0.45 C#CCCC\C=C\CCN Amb27851983 [0,2,0,0,0,0|1,0,0]=3 4858 B9R0.45 C#CCC\C=C\C=C\CO Amb27978390 [0,2,0,0,0,0|0,0,2]=4 4859 B9R0.45 C#CCC\C=C\CCCC Amb24505097 [0,2,0,0,0,0|1,0,0]=3 4860 B9R0.45 C#CCOCC\C=C\CO Amb27945361 [0,2,0,0,0,0|2,0,0]=4 4861 B9R0.45 C#CCSCC\C=C\CC Amb27833434 [0,2,0,0,0,0|1,0,0]=3 4862 B9R0.45 C#CC\C=C\CCCCCl Amb27421973 [0,2,0,0,0,0|1,0,1]=4 4863 B9R0.45 C#CC\C=C\CCCCO Amb27405043 [0,2,0,0,0,0|0,0,1]=3 4864 B9R0.45 C#C\C=C\CCCCCO Amb28050732 [0,2,0,0,0,0|0,0,2]=4 4865 B9R0.45 C=CCCCCCCCO Amb22733549 [0,2,0,0,0,0|0,0,2]=4 4866 B9R0.45 C=CCCCC\C=C\CO Amb8389620 [0,2,0,0,0,0|2,0,0]=4 4867 B9R0.45 C=CCCC\C=C\CCO Amb27835106 [0,2,0,0,0,0|1,0,0]=3 4868 B9R0.45 C=CCCNCCCCO Amb28141464 [0,2,0,0,0,0|1,0,1]=4 4869 B9R0.45 C=CCC\C=C\CCC=O Amb25770517 [0,2,0,0,0,0|0,0,2]=4 4870 B9R0.45 C=CCC\C=C\CCCO Amb27485402 [0,2,0,0,0,0|0,0,0]=2 4871 B9R0.45 C=CC\C=C/CCCCC Amb27423727 [0,2,0,0,0,0|1,0,1]=4 4872 B9R0.45 C=CC\C=C\CCCC=C Amb4035041 [0,2,0,0,0,0|1,0,1]=4 4873 B9R0.45 C=CC\C=C\CCCCC Amb27629643 [0,2,0,0,0,0|1,0,1]=4 4874 B9R0.45 C=CC\C=C\CCCCO Amb28050717 [0,2,0,0,0,0|0,0,1]=3 4875 B9R0.45 C=CC\C=C\CNCCS Amb27789950 [0,2,0,0,0,0|0,1,1]=4 4876 B9R0.45 C=CC\C=C\C\C=C\CO Amb28050671 [0,2,0,0,0,0|0,0,2]=4 4877 B9R0.45 C=C\C=C\CCCCCO Amb27242542 [0,2,0,0,0,0|0,0,2]=4 4878 B9R0.45 CC#CCCCCCCO Amb27478697 [0,2,0,0,0,0|0,0,2]=4 4879 B9R0.45 CC#CCCC\C=C\CBr Amb25327836 [0,2,0,0,0,0|2,0,0]=4 4880 B9R0.45 CC#CCCSCCCO Amb28383676 [0,2,0,0,0,0|1,0,1]=4 4881 B9R0.45 CC#CCC\C=C\CCN Amb27799476 [0,2,0,0,0,0|1,0,1]=4 4882 B9R0.45 CC#CCNC\C=C\CC Amb27198885 [0,2,0,0,0,0|1,0,1]=4 4883 B9R0.45 CC#CC\C=C\CCCO Amb28201954 [0,2,0,0,0,0|0,0,0]=2 4884 B9R0.45 CC#CC\C=C\CCNC Amb28046470 [0,2,0,0,0,0|2,0,0]=4 4885 B9R0.45 CC#C\C=C\CCCCO Amb28138689 [0,2,0,0,0,0|0,0,1]=3 4886 B9R0.45 CCC#CCCCCCO Amb28050678 [0,2,0,0,0,0|0,0,2]=4 4887 B9R0.45 CCC#CCCOCCO Amb4016675 [0,2,0,0,0,0|0,0,2]=4 4888 B9R0.45 CCC#C\C=C\C=C\CO Amb28050712 [0,2,0,0,0,0|0,0,2]=4 4889 B9R0.45 CCC#C\C=C\CCCBr Amb24639636 [0,2,0,0,0,0|1,0,0]=3 4890 B9R0.45 CCC#C\C=C\CCCO Amb27485320 [0,2,0,0,0,0|0,0,0]=2 4891 B9R0.45 CCC=C=CCCCCO Amb28248694 [0,2,0,0,0,0|0,0,0]=2 4892 B9R0.45 CCCC=C=CC#CCO Amb27833654 [0,2,0,0,0,0|0,0,2]=4 4893 B9R0.45 CCCC=C=CCCCO Amb27839599 [0,2,0,0,0,0|0,0,0]=2 4894 B9R0.45 CCCCC#C\C=C\CO Amb28293235 [0,2,0,0,0,0|2,0,0]=4 4895 B9R0.45 CCCCCC#CCCO Amb2721746 [0,2,0,0,0,0|0,0,2]=4 4896 B9R0.45 CCCCCC=C=CCCl Amb27211387 [0,2,0,0,0,0|2,0,0]=4 4897 B9R0.45 CCCCCCC#CCO Amb2721748 [0,2,0,0,0,0|0,0,2]=4 4898 B9R0.45 CCCCCCCCCO Amb3940342 [0,2,0,0,0,0|0,0,2]=4 4899 B9R0.45 CCCCCCCCNO Amb28069968 [0,2,0,0,0,0|0,0,2]=4 4900 B9R0.45 CCCCCCCCON Amb2818885 [0,2,0,0,0,0|0,0,2]=4 4901 B9R0.45 CCCCCCCOC=O Amb9787223 [0,2,0,0,0,0|0,0,2]=4 4902 B9R0.45 CCCCCCCOCC Amb26332517 [0,2,0,0,0,0|0,0,2]=4 4903 B9R0.45 CCCCCCNCCO Amb2720857 [0,2,0,0,0,0|0,0,2]=4 4904 B9R0.45 CCCCCCOCCO Amb9787183 [0,2,0,0,0,0|0,0,2]=4 4905 B9R0.45 CCCCCC\C=C/CO Amb10807383 [0,2,0,0,0,0|0,0,2]=4 4906 B9R0.45 CCCCCC\C=C\CO Amb22168300 [0,2,0,0,0,0|0,0,2]=4 4907 B9R0.45 CCCCCC\C=C\OC Amb30621739 [0,2,0,0,0,0|2,0,0]=4 4908 B9R0.45 CCCCCNCCCO Amb6733807 [0,2,0,0,0,0|0,0,2]=4 4909 B9R0.45 CCCCCNCCOC Amb6708081 [0,2,0,0,0,0|0,0,2]=4 4910 B9R0.45 CCCCCSCCCO Amb17502837 [0,2,0,0,0,0|0,0,2]=4 4911 B9R0.45 CCCCC\C=C/CCBr Amb27781314 [0,2,0,0,0,0|1,0,0]=3 4912 B9R0.45 CCCCC\C=C/CCO Amb9825885 [0,2,0,0,0,0|1,0,0]=3 4913 B9R0.45 CCCCC\C=C\CCBr Amb27864879 [0,2,0,0,0,0|1,0,0]=3 4914 B9R0.45 CCCCC\C=C\CCN Amb25123460 [0,2,0,0,0,0|1,0,0]=3 4915 B9R0.45 CCCCC\C=C\CCO Amb27953070 [0,2,0,0,0,0|1,0,0]=3 4916 B9R0.45 CCCCC\C=C\OCC Amb27590195 [0,2,0,0,0,0|1,0,0]=3 4917 B9R0.45 CCCCNCCCOC Amb6730310 [0,2,0,0,0,0|0,0,2]=4 4918 B9R0.45 CCCCNC\C=C\CN Amb27391026 [0,2,0,0,0,0|2,0,0]=4 4919 B9R0.45 CCCCOCCCCO Amb19375051 [0,2,0,0,0,0|0,0,2]=4 4920 B9R0.45 CCCCOCCCON Amb27212384 [0,2,0,0,0,0|0,0,2]=4 4921 B9R0.45 CCCCOC\C=C/CBr Amb27798436 [0,2,0,0,0,0|2,0,0]=4 4922 B9R0.45 CCCCOC\C=C\CBr Amb28318470 [0,2,0,0,0,0|2,0,0]=4 4923 B9R0.45 CCCCOC\C=C\CN Amb27877410 [0,2,0,0,0,0|2,0,0]=4 4924 B9R0.45 CCCCOC\C=C\CO Amb28453524 [0,2,0,0,0,0|2,0,0]=4 4925 B9R0.45 CCCCOC\C=C\CS Amb27809829 [0,2,0,0,0,0|2,0,0]=4 4926 B9R0.45 CCCCSCCCOC Amb27651352 [0,2,0,0,0,0|0,0,2]=4 4927 B9R0.45 CCCCSC\C=C\CO Amb28205928 [0,2,0,0,0,0|2,0,0]=4 4928 B9R0.45 CCCCSC\C=C\CS Amb27632116 [0,2,0,0,0,0|2,0,0]=4 4929 B9R0.45 CCCC\C=C/CCCC Amb27196227 [0,2,0,0,0,0|1,0,0]=3 4930 B9R0.45 CCCC\C=C\C=C\CCl Amb27204911 [0,2,0,0,0,0|1,0,1]=4 4931 B9R0.45 CCCC\C=C\C=C\CO Amb27445447 [0,2,0,0,0,0|0,0,2]=4 4932 B9R0.45 CCCC\C=C\CCC=O Amb27966384 [0,2,0,0,0,0|1,0,0]=3 4933 B9R0.45 CCCC\C=C\CCCC Amb2721542 [0,2,0,0,0,0|1,0,0]=3 4934 B9R0.45 CCCC\C=C\CN=[N+]=[N-] Amb26421411 [0,2,0,0,0,0|2,0,0]=4 4935 B9R0.45 CCCNCCCCCO Amb17334254 [0,2,0,0,0,0|0,0,2]=4 4936 B9R0.45 CCCNCCNCCO Amb24644910 [0,2,0,0,0,0|0,0,2]=4 4937 B9R0.45 CCCNCCOCCO Amb6736235 [0,2,0,0,0,0|0,0,2]=4 4938 B9R0.45 CCCOCCC#CCO Amb27763825 [0,2,0,0,0,0|1,0,1]=4 4939 B9R0.45 CCCOCCOCCO Amb22351569 [0,2,0,0,0,0|0,0,2]=4 4940 B9R0.45 CCCOC\C=C\CCBr Amb27621713 [0,2,0,0,0,0|1,0,0]=3 4941 B9R0.45 CCCO\N=C\CCCO Amb27604558 [0,2,0,0,0,0|0,0,1]=3 4942 B9R0.45 CCCSCCNCCO Amb27618844 [0,2,0,0,0,0|0,0,2]=4 4943 B9R0.45 CCCSCCSCCO Amb27433297 [0,2,0,0,0,0|0,0,2]=4 4944 B9R0.45 CCCS\C=C\SCCC Amb24634666 [0,2,0,0,0,0|2,0,0]=4 4945 B9R0.45 CCC\C=C\C#CCCO Amb27485438 [0,2,0,0,0,0|0,0,1]=3 4946 B9R0.45 CCC\C=C\C=C\CCC Amb22641685 [0,2,0,0,0,0|1,0,1]=4 4947 B9R0.45 CCC\C=C\C=C\CCN Amb27656349 [0,2,0,0,0,0|1,0,1]=4 4948 B9R0.45 CCC\C=C\C=C\CNC Amb28429325 [0,2,0,0,0,0|1,0,1]=4 4949 B9R0.45 CCC\C=C\CC#CCO Amb27838882 [0,2,0,0,0,0|0,0,1]=3 4950 B9R0.45 CCC\C=C\CCCC=O Amb33361614 [0,2,0,0,0,0|0,0,1]=3 4951 B9R0.45 CCC\C=C\CCCCC Amb22231673 [0,2,0,0,0,0|1,0,0]=3 4952 B9R0.45 CCC\C=C\CCCCN Amb33373745 [0,2,0,0,0,0|1,0,0]=3 4953 B9R0.45 CCC\C=C\CCN=C=O Amb33327158 [0,2,0,0,0,0|0,0,2]=4 4954 B9R0.45 CCC\C=C\CCN=[N+]=[N-] Amb33373716 [0,2,0,0,0,0|2,0,0]=4 4955 B9R0.45 CCC\C=N\NCCCO Amb27396709 [0,2,0,0,0,0|0,0,1]=3 4956 B9R0.45 CCNCCCCCOC Amb28186272 [0,2,0,0,0,0|0,0,2]=4 4957 B9R0.45 CCNCCCNCCO Amb27770477 [0,2,0,0,0,0|0,0,2]=4 4958 B9R0.45 CCNCCOCCOC Amb24672932 [0,2,0,0,0,0|1,0,1]=4 4959 B9R0.45 CCNCCSCCOC Amb18788239 [0,2,0,0,0,0|1,0,1]=4 4960 B9R0.45 CCN\N=C\CCCCO Amb27457985 [0,2,0,0,0,0|0,0,1]=3 4961 B9R0.45 CCOCCCCOCC Amb10807403 [0,2,0,0,0,0|1,0,1]=4 4962 B9R0.45 CCOCCCNOCC Amb27949833 [0,2,0,0,0,0|2,0,0]=4 4963 B9R0.45 CCOCCOCCOC Amb8394637 [0,2,0,0,0,0|1,0,1]=4 4964 B9R0.45 CCOCCSCCCO Amb27830336 [0,2,0,0,0,0|0,0,2]=4 4965 B9R0.45 CCONCCCCCO Amb28245082 [0,2,0,0,0,0|0,0,2]=4 4966 B9R0.45 CCSCCNCCCO Amb27797112 [0,2,0,0,0,0|0,0,2]=4 4967 B9R0.45 CCSCCSCCCO Amb27489348 [0,2,0,0,0,0|0,0,2]=4 4968 B9R0.45 CCS\C=C\C#CCCO Amb27969113 [0,2,0,0,0,0|0,0,1]=3 4969 B9R0.45 CC\C=C/CCCN=[N+]=[N-] Amb27794716 [0,2,0,0,0,0|1,0,0]=3 4970 B9R0.45 CC\C=C/CCOCC=O Amb25127965 [0,2,0,0,0,0|0,0,1]=3 4971 B9R0.45 CC\C=C/CC\C=C\C=O Amb2720527 [0,2,0,0,0,0|0,0,2]=4 4972 B9R0.45 CC\C=C/CC\C=C\CO Amb8515211 [0,2,0,0,0,0|0,0,0]=2 4973 B9R0.45 CC\C=C/C\C=C/CC=O Amb18643319 [0,2,0,0,0,0|0,0,2]=4 4974 B9R0.45 CC\C=C/C\C=C/CCO Amb22226805 [0,2,0,0,0,0|0,0,0]=2 4975 B9R0.45 CC\C=C\C#CCCCO Amb28050570 [0,2,0,0,0,0|0,0,0]=2 4976 B9R0.45 CC\C=C\C=C\C=C\CO Amb28050682 [0,2,0,0,0,0|0,0,2]=4 4977 B9R0.45 CC\C=C\C=C\CCC=O Amb27841138 [0,2,0,0,0,0|0,0,2]=4 4978 B9R0.45 CC\C=C\CCCCCC Amb22231672 [0,2,0,0,0,0|1,0,0]=3 4979 B9R0.45 CC\C=C\CC\C=C\C#N Amb26607477 [0,2,0,0,0,0|1,0,1]=4 4980 B9R0.45 CC\C=C\CC\C=C\C=O Amb18124509 [0,2,0,0,0,0|0,0,2]=4 4981 B9R0.45 CC\C=C\CC\C=C\CBr Amb26333018 [0,2,0,0,0,0|1,0,0]=3 4982 B9R0.45 CC\C=C\CC\C=C\CC Amb24558322 [0,2,0,0,0,0|1,0,0]=3 4983 B9R0.45 CC\C=C\CNCCOC Amb27432873 [0,2,0,0,0,0|0,0,0]=2 4984 B9R0.45 CC\C=C\COCCCC Amb25912010 [0,2,0,0,0,0|1,0,0]=3 4985 B9R0.45 CC\C=C\C\C=C\CC=O Amb28255687 [0,2,0,0,0,0|0,0,2]=4 4986 B9R0.45 CC\C=C\C\C=C\CCO Amb27982236 [0,2,0,0,0,0|0,0,0]=2 4987 B9R0.45 CC\N=N\CCCCCO Amb27631929 [0,2,0,0,0,0|0,0,2]=4 4988 B9R0.45 CNCCCCNCCO Amb27630866 [0,2,0,0,0,0|0,0,2]=4 4989 B9R0.45 CNCCOCCCOC Amb21954035 [0,2,0,0,0,0|1,0,1]=4 4990 B9R0.45 CNCCSCCCCO Amb28193864 [0,2,0,0,0,0|0,0,2]=4 4991 B9R0.45 COCCCCCCCCl Amb28066514 [0,2,0,0,0,0|0,0,2]=4 4992 B9R0.45 COCCCCCCOC Amb10807404 [0,2,0,0,0,0|0,0,2]=4 4993 B9R0.45 COCCCCNCCBr Amb27847371 [0,2,0,0,0,0|1,0,1]=4 4994 B9R0.45 COCCCCNCCO Amb28368980 [0,2,0,0,0,0|0,0,2]=4 4995 B9R0.45 COCCCCOCCN Amb28047109 [0,2,0,0,0,0|1,0,1]=4 4996 B9R0.45 COCCCCSCCN Amb27951686 [0,2,0,0,0,0|1,0,1]=4 4997 B9R0.45 COCCCNCCCN Amb17315264 [0,2,0,0,0,0|1,0,1]=4 4998 B9R0.45 COCCCNCCCO Amb17308606 [0,2,0,0,0,0|0,0,2]=4 4999 B9R0.45 COCCCNCCOC Amb8841615 [0,2,0,0,0,0|1,0,1]=4 5000 B9R0.45 COCCCNCCSC Amb18800727 [0,2,0,0,0,0|1,0,1]=4 5001 B9R0.45 COCCCOCCCN Amb28196278 [0,2,0,0,0,0|1,0,1]=4 5002 B9R0.45 COCCCOCCCO Amb20242414 [0,2,0,0,0,0|0,0,2]=4 5003 B9R0.45 COCCCSCCCCl Amb27393495 [0,2,0,0,0,0|1,0,1]=4 5004 B9R0.45 COCCCSCCCS Amb28058832 [0,2,0,0,0,0|1,0,1]=4 5005 B9R0.45 COCCCSCCOC Amb28064860 [0,2,0,0,0,0|1,0,1]=4 5006 B9R0.45 COCCNC\C=C\CN Amb27489500 [0,2,0,0,0,0|1,0,0]=3 5007 B9R0.45 COCCOCOCCO Amb28189033 [0,2,0,0,0,0|1,0,1]=4 5008 B9R0.45 COCCOC\C=C\CN Amb27459640 [0,2,0,0,0,0|1,0,0]=3 5009 B9R0.45 COCCONCCCO Amb27477812 [0,2,0,0,0,0|1,0,1]=4 5010 B9R0.45 COCCSCCCON Amb27199029 [0,2,0,0,0,0|1,0,1]=4 5011 B9R0.45 COCCSC\C=C\CCl Amb28075250 [0,2,0,0,0,0|1,0,0]=3 5012 B9R0.45 COCOCCCCCO Amb27839456 [0,2,0,0,0,0|0,0,2]=4 5013 B9R0.45 COCOCCOCCO Amb28205950 [0,2,0,0,0,0|1,0,1]=4 5014 B9R0.45 CONCCCCCCO Amb27952629 [0,2,0,0,0,0|0,0,2]=4 5015 B9R0.45 CO\C=C\CCCNC=O Amb27223364 [0,2,0,0,0,0|1,0,1]=4 5016 B9R0.45 CO\N=C\CNCCCO Amb27260617 [0,2,0,0,0,0|1,0,1]=4 5017 B9R0.45 CSCCCC\C=C\CO Amb27604531 [0,2,0,0,0,0|1,1,0]=4 5018 B9R0.45 CSCCCSCCCO Amb28132547 [0,2,0,0,0,0|0,0,2]=4 5019 B9R0.45 CSCCOC\C=C\CCl Amb28369177 [0,2,0,0,0,0|1,1,0]=4 5020 B9R0.45 CSCCOC\C=C\CS Amb27188248 [0,2,0,0,0,0|1,1,0]=4 5021 B9R0.45 CSCCSC\C=C\CCl Amb28186041 [0,2,0,0,0,0|1,1,0]=4 5022 B9R0.45 CSC\C=C\CCCCO Amb27603346 [0,2,0,0,0,0|0,0,0]=2 5023 B9R0.45 C\C=C/C=C\CCCCC Amb22641684 [0,2,0,0,0,0|1,0,1]=4 5024 B9R0.45 C\C=C\C=C\CCCCBr Amb28137170 [0,2,0,0,0,0|1,0,1]=4 5025 B9R0.45 C\C=C\C=C\COCOC Amb28185052 [0,2,0,0,0,0|0,0,2]=4 5026 B9R0.45 C\C=C\CCCCCCO Amb27980554 [0,2,0,0,0,0|0,0,2]=4 5027 B9R0.45 C\C=C\CC\C=C\CCBr Amb25232259 [0,2,0,0,0,0|1,0,1]=4 5028 B9R0.45 C\C=C\CC\C=C\CCCl Amb28072597 [0,2,0,0,0,0|1,0,1]=4 5029 B9R0.45 C\C=C\CC\C=C\CCO Amb27210858 [0,2,0,0,0,0|0,0,2]=4 5030 B9R0.45 C\C=C\CNCCCOC Amb28254436 [0,2,0,0,0,0|0,0,2]=4 5031 B9R0.45 C\C=C\CNC\C=C\CC Amb28201963 [0,2,0,0,0,0|1,0,1]=4 5032 B9R0.45 C\C=C\C\C=C\CCC=O Amb27646624 [0,2,0,0,0,0|0,0,2]=4 5033 B9R0.45 C\C=C\C\C=C\CCCO Amb27977518 [0,2,0,0,0,0|0,0,0]=2 5034 B9R0.45 C\C=C\OCCCCCO Amb28350349 [0,2,0,0,0,0|0,0,2]=4 5035 B9R0.45 ClCOC\C=C\COCCl Amb27657378 [0,2,0,0,0,0|2,0,0]=4 5036 B9R0.45 N#CCCCC\C=C\CBr Amb27450252 [0,2,0,0,0,0|2,0,0]=4 5037 B9R0.45 N#CCCCC\C=C\CCl Amb24505139 [0,2,0,0,0,0|2,0,0]=4 5038 B9R0.45 N#CCCCC\C=C\CO Amb27770521 [0,2,0,0,0,0|2,0,0]=4 5039 B9R0.45 N#CCCC\C=C\CCO Amb28050627 [0,2,0,0,0,0|1,0,0]=3 5040 B9R0.45 N#CCC\C=C\CCC#N Amb18124437 [0,2,0,0,0,0|1,0,1]=4 5041 B9R0.45 NCCCCCCCCO Amb24116967 [0,2,0,0,0,0|0,0,2]=4 5042 B9R0.45 NCCCCCNCCO Amb8394909 [0,2,0,0,0,0|0,0,2]=4 5043 B9R0.45 NCCCCNCCCO Amb27473423 [0,2,0,0,0,0|0,0,2]=4 5044 B9R0.45 NCCCCSCCCO Amb17500966 [0,2,0,0,0,0|0,0,2]=4 5045 B9R0.45 NCCCNCCCON Amb27629053 [0,2,0,0,0,0|1,0,1]=4 5046 B9R0.45 NCCCOCCCCO Amb28454517 [0,2,0,0,0,0|0,0,2]=4 5047 B9R0.45 NCCCSCCCON Amb27857566 [0,2,0,0,0,0|1,0,1]=4 5048 B9R0.45 NCCC\C=C\CCCN Amb25075576 [0,2,0,0,0,0|1,0,0]=3 5049 B9R0.45 NCCNCCNCCO Amb17593677 [0,2,0,0,0,0|1,0,1]=4 5050 B9R0.45 NCCNCCOCCO Amb24376947 [0,2,0,0,0,0|1,0,1]=4 5051 B9R0.45 NCCOCCOCCO Amb10604950 [0,2,0,0,0,0|1,0,1]=4 5052 B9R0.45 NCCOCCSCCO Amb17501998 [0,2,0,0,0,0|1,0,1]=4 5053 B9R0.45 NCCSCCOCCO Amb18792709 [0,2,0,0,0,0|1,0,1]=4 5054 B9R0.45 NCC\C=C\C=C\CCN Amb28349159 [0,2,0,0,0,0|1,0,1]=4 5055 B9R0.45 NC\C=C\CC\C=C\CN Amb18643656 [0,2,0,0,0,0|2,0,0]=4 5056 B9R0.45 NC\C=C\CNCCCF Amb27881245 [0,2,0,0,0,0|2,0,0]=4 5057 B9R0.45 NC\C=C\CSCCCO Amb27669770 [0,2,0,0,0,0|1,0,0]=3 5058 B9R0.45 O=CCCCCCCCO Amb25765567 [0,2,0,0,0,0|0,0,2]=4 5059 B9R0.45 O=CCCCC\C=C\CF Amb27435440 [0,2,0,0,0,0|1,0,1]=4 5060 B9R0.45 O=CCC\C=C/CCC=O Amb27794668 [0,2,0,0,0,0|0,0,2]=4 5061 B9R0.45 O=CCC\C=C\CCC=O Amb25984364 [0,2,0,0,0,0|0,0,2]=4 5062 B9R0.45 O=CNCCC\C=C\CO Amb26994607 [0,2,0,0,0,0|1,0,1]=4 5063 B9R0.45 OCC#CC=C=CCCO Amb28435829 [0,2,0,0,0,0|0,0,2]=4 5064 B9R0.45 OCCC=C=CCCCO Amb28188308 [0,2,0,0,0,0|0,0,0]=2 5065 B9R0.45 OCCCC#CCCCO Amb26558079 [0,2,0,0,0,0|0,0,2]=4 5066 B9R0.45 OCCCCCCCCBr Amb4296902 [0,2,0,0,0,0|0,0,2]=4 5067 B9R0.45 OCCCCCCCCCl Amb6366711 [0,2,0,0,0,0|0,0,2]=4 5068 B9R0.45 OCCCCCCCCF Amb25330666 [0,2,0,0,0,0|0,0,2]=4 5069 B9R0.45 OCCCCCCCCI Amb32411246 [0,2,0,0,0,0|0,0,2]=4 5070 B9R0.45 OCCCCCCCCO Amb8383419 [0,2,0,0,0,0|0,0,2]=4 5071 B9R0.45 OCCCCCCCCS Amb28046913 [0,2,0,0,0,0|0,0,2]=4 5072 B9R0.45 OCCCCCOCCCl Amb28321747 [0,2,0,0,0,0|0,0,2]=4 5073 B9R0.45 OCCCCCOCCO Amb27847385 [0,2,0,0,0,0|0,0,2]=4 5074 B9R0.45 OCCCCCSCCO Amb18800854 [0,2,0,0,0,0|0,0,2]=4 5075 B9R0.45 OCCCCOCCCO Amb27218138 [0,2,0,0,0,0|0,0,2]=4 5076 B9R0.45 OCCCC\C=C\CCBr Amb27646614 [0,2,0,0,0,0|0,0,0]=2 5077 B9R0.45 OCCCC\C=C\CCI Amb22364697 [0,2,0,0,0,0|0,0,0]=2 5078 B9R0.45 OCCCNCCCCF Amb27752581 [0,2,0,0,0,0|0,0,2]=4 5079 B9R0.45 OCCCSCCCCF Amb28204584 [0,2,0,0,0,0|0,0,2]=4 5080 B9R0.45 OCCCSCCCCS Amb27452872 [0,2,0,0,0,0|0,0,2]=4 5081 B9R0.45 OCCCSSCCCO Amb24573663 [0,2,0,0,0,0|1,0,1]=4 5082 B9R0.45 OCCC\C=C/CCCCl Amb27437510 [0,2,0,0,0,0|0,0,0]=2 5083 B9R0.45 OCCNCCCCCF Amb27805496 [0,2,0,0,0,0|0,0,2]=4 5084 B9R0.45 OCCNCCNCCO Amb3986551 [0,2,0,0,0,0|1,0,1]=4 5085 B9R0.45 OCCNCCOCCO Amb9787082 [0,2,0,0,0,0|1,0,1]=4 5086 B9R0.45 OCCOCCOCCBr Amb24057506 [0,2,0,0,0,0|1,0,1]=4 5087 B9R0.45 OCCOCCOCCCl Amb9787115 [0,2,0,0,0,0|1,0,1]=4 5088 B9R0.45 OCCOCCOCCF Amb24082372 [0,2,0,0,0,0|1,0,1]=4 5089 B9R0.45 OCCOCCOCCI Amb22497537 [0,2,0,0,0,0|1,0,1]=4 5090 B9R0.45 OCCOCCOCCO Amb33820646 [0,2,0,0,0,0|1,0,1]=4 5091 B9R0.45 OCCOCCOCCO Amb34915482 [0,2,0,0,0,0|1,0,1]=4 5092 B9R0.45 OCCOCCOCCO Amb6608820 [0,2,0,0,0,0|1,0,1]=4 5093 B9R0.45 OCCOCCOCCS Amb17613418 [0,2,0,0,0,0|1,0,1]=4 5094 B9R0.45 OCCOCCSCCO Amb18180098 [0,2,0,0,0,0|1,0,1]=4 5095 B9R0.45 OCCSCCOCCCl Amb28118946 [0,2,0,0,0,0|1,0,1]=4 5096 B9R0.45 OCCSCCOCCS Amb28050612 [0,2,0,0,0,0|1,0,1]=4 5097 B9R0.45 OCCSCCSCCCl Amb27455143 [0,2,0,0,0,0|1,0,1]=4 5098 B9R0.45 OCCSCCSCCO Amb1200412 [0,2,0,0,0,0|1,0,1]=4 5099 B9R0.45 OC\C=C\C=C=CCCO Amb27260215 [0,2,0,0,0,0|0,0,2]=4 5100 B9R0.45 OC\C=C\CCCCCBr Amb24666213 [0,2,0,0,0,0|2,0,0]=4 5101 B9R0.45 OC\C=C\CCCCCO Amb27204813 [0,2,0,0,0,0|1,0,0]=3 5102 B9R0.45 OC\C=C\CC\C=C\CO Amb27255256 [0,2,0,0,0,0|1,0,0]=3 5103 B9R0.45 [N-]=[N+]=NCCC\C=C\CBr Amb28135784 [0,2,0,0,0,0|2,0,0]=4 5104 B9R0.45 [N-]=[N+]=NCCC\C=C\CO Amb28368619 [0,2,0,0,0,0|2,0,0]=4 5105 B9R0.46 C#CC(C)NCCCCO Amb27228684 [0,2,0,0,0,0|1,0,1]=4 5106 B9R0.46 C#CC(O)CCCCCC Amb27838900 [0,2,0,0,0,0|0,0,2]=4 5107 B9R0.46 C#CC(O)CCCOCC Amb28401329 [0,2,0,0,0,0|1,0,1]=4 5108 B9R0.46 C#CC(O)\C=C\CCCC Amb28050685 [0,2,0,0,0,0|1,0,1]=4 5109 B9R0.46 C#C[C@H](O)CCCCCC Amb27970533 [0,2,0,0,0,0|0,0,2]=4 5110 B9R0.46 C#C\C=C\SCC(O)CO Amb27197542 [0,2,0,0,0,0|0,0,2]=4 5111 B9R0.46 C=C(C=O)CC\C=C/CC Amb26462856 [0,2,0,0,0,0|0,0,2]=4 5112 B9R0.46 C=C(C=O)CC\C=C\CC Amb27422502 [0,2,0,0,0,0|0,0,2]=4 5113 B9R0.46 C=C(CC)CNCCCN Amb27452800 [0,2,0,0,0,0|1,0,1]=4 5114 B9R0.46 C=C(CC)COCCCN Amb28064279 [0,2,0,0,0,0|1,0,1]=4 5115 B9R0.46 C=C(CC)CSCCCC Amb28370393 [0,2,0,0,0,0|1,0,1]=4 5116 B9R0.46 C=C(CC)CSCCCF Amb27424941 [0,2,0,0,0,0|1,0,1]=4 5117 B9R0.46 C=C(CC)C\C=C\CCCl Amb27476635 [0,2,0,0,0,0|1,0,1]=4 5118 B9R0.46 C=C(CO)CCC\C=C\C Amb27603280 [0,2,0,0,0,0|0,0,2]=4 5119 B9R0.46 C=CC(=O)CC\C=C/CC Amb27945136 [0,2,0,0,0,0|0,0,2]=4 5120 B9R0.46 C=CC(C)ONCCCO Amb27621289 [0,2,0,0,0,0|2,0,0]=4 5121 B9R0.46 C=CC(O)CCCCCC Amb8515213 [0,2,0,0,0,0|0,0,2]=4 5122 B9R0.46 C=CC(O)CCCOCC Amb27766080 [0,2,0,0,0,0|1,0,1]=4 5123 B9R0.46 C=CC(O)CC\C=C\CO Amb27839272 [0,2,0,0,0,0|1,0,0]=3 5124 B9R0.46 C=CCCCNC(=O)CC Amb27835179 [0,2,0,0,0,0|2,0,0]=4 5125 B9R0.46 C=CCCC\C=C(/C)CBr Amb27816467 [0,2,0,0,0,0|2,0,0]=4 5126 B9R0.46 C=CCCC\C=C(/C)CCl Amb27832391 [0,2,0,0,0,0|2,0,0]=4 5127 B9R0.46 C=CC\C=C\CC(C)CO Amb28401075 [0,2,0,0,0,0|0,0,1]=3 5128 B9R0.46 C=C[C@@H](O)CCCCCC Amb27197186 [0,2,0,0,0,0|0,0,2]=4 5129 B9R0.46 C=C[C@H](C)CCCCCO Amb28138710 [0,2,0,0,0,0|0,0,2]=4 5130 B9R0.46 CC(C#N)NCCCCO Amb28435975 [0,2,0,0,0,0|1,0,1]=4 5131 B9R0.46 CC(CN)CNCCCO Amb27262382 [0,2,0,0,0,0|1,0,1]=4 5132 B9R0.46 CC(CO)CNCCCO Amb27866214 [0,2,0,0,0,0|1,0,1]=4 5133 B9R0.46 CC(CO)SC\C=C\CN Amb27776593 [0,2,0,0,0,0|1,0,0]=3 5134 B9R0.46 CCC(=O)CCCCC#N Amb27170911 [0,2,0,0,0,0|1,0,1]=4 5135 B9R0.46 CCC(=O)CCCCCO Amb27627259 [0,2,0,0,0,0|0,0,1]=3 5136 B9R0.46 CCC(=O)NCCCC#N Amb28186659 [0,2,0,0,0,0|2,0,0]=4 5137 B9R0.46 CCC(=O)NCCCCF Amb28313877 [0,2,0,0,0,0|1,0,1]=4 5138 B9R0.46 CCC(=O)NCCCCI Amb27839559 [0,2,0,0,0,0|1,0,1]=4 5139 B9R0.46 CCC(=O)NCCCCN Amb17053701 [0,2,0,0,0,0|1,0,1]=4 5140 B9R0.46 CCC(=O)NCCCNC Amb9464380 [0,2,0,0,0,0|2,0,0]=4 5141 B9R0.46 CCC(=O)NCCCOC Amb17775258 [0,2,0,0,0,0|1,0,0]=3 5142 B9R0.46 CCC(=O)NCCCON Amb17138412 [0,2,0,0,0,0|1,0,0]=3 5143 B9R0.46 CCC(=O)NCCCSC Amb28201200 [0,2,0,0,0,0|1,1,0]=4 5144 B9R0.46 CCC(=O)OCCCCBr Amb28120684 [0,2,0,0,0,0|1,0,1]=4 5145 B9R0.46 CCC(=O)OCCCCCl Amb27494048 [0,2,0,0,0,0|1,0,1]=4 5146 B9R0.46 CCC(=O)OCCCCO Amb26485117 [0,2,0,0,0,0|0,0,1]=3 5147 B9R0.46 CCC(=O)OCCCSC Amb28070380 [0,2,0,0,0,0|1,1,0]=4 5148 B9R0.46 CCC(=O)OCSCCO Amb27466870 [0,2,0,0,0,0|1,0,0]=3 5149 B9R0.46 CCC(=O)OC\C=C\CO Amb27448767 [0,2,0,0,0,0|1,0,1]=4 5150 B9R0.46 CCC(=S)SCCCCCl Amb27477889 [0,2,0,0,0,0|1,0,1]=4 5151 B9R0.46 CCC(C)CCCCCO Amb21963913 [0,2,0,0,0,0|0,0,2]=4 5152 B9R0.46 CCC(C)CCNCCO Amb28050561 [0,2,0,0,0,0|0,0,2]=4 5153 B9R0.46 CCC(C)C\C=C\CCN Amb27835226 [0,2,0,0,0,0|1,0,0]=3 5154 B9R0.46 CCC(C)NCCCOC Amb6730317 [0,2,0,0,0,0|1,0,1]=4 5155 B9R0.46 CCC(C)NC\C=C\CCl Amb27425069 [0,2,0,0,0,0|2,0,0]=4 5156 B9R0.46 CCC(C)OCCCON Amb28062345 [0,2,0,0,0,0|1,0,1]=4 5157 B9R0.46 CCC(C)SCCCOC Amb28400490 [0,2,0,0,0,0|1,0,1]=4 5158 B9R0.46 CCC(C)SCCCON Amb28193724 [0,2,0,0,0,0|1,0,1]=4 5159 B9R0.46 CCC(C)\C=C\CCCCl Amb26918358 [0,2,0,0,0,0|1,0,0]=3 5160 B9R0.46 CCC(Cl)CCCCOC Amb18800866 [0,2,0,0,0,0|0,0,2]=4 5161 B9R0.46 CCC(N)CCCCCO Amb26865511 [0,2,0,0,0,0|0,0,2]=4 5162 B9R0.46 CCC(N)CSCCCO Amb28344434 [0,2,0,0,0,0|0,0,2]=4 5163 B9R0.46 CCC(O)\C=C\CCCCl Amb24610794 [0,2,0,0,0,0|1,0,0]=3 5164 B9R0.46 CCCCCCC(=O)CC Amb2720775 [0,2,0,0,0,0|1,0,1]=4 5165 B9R0.46 CCCCCCC(=O)CO Amb28254622 [0,2,0,0,0,0|0,0,2]=4 5166 B9R0.46 CCCCCCC(Br)CO Amb28126801 [0,2,0,0,0,0|0,0,2]=4 5167 B9R0.46 CCCCCCC(C)CO Amb22728084 [0,2,0,0,0,0|0,0,2]=4 5168 B9R0.46 CCCCCCC(N)CO Amb27770563 [0,2,0,0,0,0|0,0,2]=4 5169 B9R0.46 CCCCCCC(O)CC Amb10068521 [0,2,0,0,0,0|0,0,2]=4 5170 B9R0.46 CCCCCCC(O)CF Amb22325236 [0,2,0,0,0,0|0,0,2]=4 5171 B9R0.46 CCCCCCC(O)CO Amb8514191 [0,2,0,0,0,0|0,0,2]=4 5172 B9R0.46 CCCCCCC(O)CS Amb27823218 [0,2,0,0,0,0|0,0,2]=4 5173 B9R0.46 CCCCCC[C@@H](F)CO Amb27213919 [0,2,0,0,0,0|0,0,2]=4 5174 B9R0.46 CCCCCC[C@@H](N)CO Amb27812823 [0,2,0,0,0,0|0,0,2]=4 5175 B9R0.46 CCCCCC[C@@H](O)CBr Amb27214043 [0,2,0,0,0,0|0,0,2]=4 5176 B9R0.46 CCCCCC[C@@H](O)CCl Amb27630055 [0,2,0,0,0,0|0,0,2]=4 5177 B9R0.46 CCCCCC[C@@H](O)CF Amb22225126 [0,2,0,0,0,0|0,0,2]=4 5178 B9R0.46 CCCCCC[C@@H](O)CO Amb22225132 [0,2,0,0,0,0|0,0,2]=4 5179 B9R0.46 CCCCCC[C@H](N)CO Amb28126944 [0,2,0,0,0,0|0,0,2]=4 5180 B9R0.46 CCCCCC[C@H](O)C#N Amb28256387 [0,2,0,0,0,0|0,0,2]=4 5181 B9R0.46 CCCCCC[C@H](O)CF Amb27480605 [0,2,0,0,0,0|0,0,2]=4 5182 B9R0.46 CCCCCC[C@H](O)CN Amb27413021 [0,2,0,0,0,0|0,0,2]=4 5183 B9R0.46 CCCCCNC(=O)CC Amb17736727 [0,2,0,0,0,0|1,0,1]=4 5184 B9R0.46 CCCCCOC(C)CO Amb27857498 [0,2,0,0,0,0|0,0,2]=4 5185 B9R0.46 CCCCCO[C@@H](C)CO Amb27394892 [0,2,0,0,0,0|0,0,2]=4 5186 B9R0.46 CCCCC\C=C(\C)CN Amb27249901 [0,2,0,0,0,0|2,0,0]=4 5187 B9R0.46 CCCCC\C=C(\Cl)CCl Amb27632425 [0,2,0,0,0,0|2,0,0]=4 5188 B9R0.46 CCCCC\C=C(\F)CO Amb27406000 [0,2,0,0,0,0|2,0,0]=4 5189 B9R0.46 CCCCNCC(O)CO Amb17308645 [0,2,0,0,0,0|0,0,2]=4 5190 B9R0.46 CCCCOCC(N)CO Amb27839156 [0,2,0,0,0,0|0,0,2]=4 5191 B9R0.46 CCCCOC[C@H](N)CO Amb28130815 [0,2,0,0,0,0|0,0,2]=4 5192 B9R0.46 CCCCSCC(N)CO Amb24480393 [0,2,0,0,0,0|0,0,2]=4 5193 B9R0.46 CCCCSCC(O)CO Amb10669577 [0,2,0,0,0,0|0,0,2]=4 5194 B9R0.46 CCCC\C=C\C(=O)OC Amb25339041 [0,2,0,0,0,0|1,0,1]=4 5195 B9R0.46 CCCC\C=C\C(O)C#N Amb28455022 [0,2,0,0,0,0|1,0,1]=4 5196 B9R0.46 CCCC\C=C\[C@@H](O)C#N Amb27972574 [0,2,0,0,0,0|1,0,1]=4 5197 B9R0.46 CCCC\C=C\[C@H](O)CCl Amb27617086 [0,2,0,0,0,0|1,0,0]=3 5198 B9R0.46 CCCC\N=C\C(O)CC Amb28050660 [0,2,0,0,0,0|1,0,1]=4 5199 B9R0.46 CCCNCCC(O)CO Amb32645150 [0,2,0,0,0,0|0,0,2]=4 5200 B9R0.46 CCCNCC[C@H](O)CC Amb27770360 [0,2,0,0,0,0|1,0,1]=4 5201 B9R0.46 CCCNC\C=C(\C)CO Amb18644033 [0,2,0,0,0,0|2,0,0]=4 5202 B9R0.46 CCCOCCC(=O)CO Amb27616444 [0,2,0,0,0,0|1,0,1]=4 5203 B9R0.46 CCCOCCC(O)CN Amb27454686 [0,2,0,0,0,0|1,0,1]=4 5204 B9R0.46 CCCSCCC(N)CO Amb27839116 [0,2,0,0,0,0|0,0,2]=4 5205 B9R0.46 CCC\C=C\CC(=O)CC Amb26948943 [0,2,0,0,0,0|1,0,1]=4 5206 B9R0.46 CCC\C=C\CC(N)CC Amb27198430 [0,2,0,0,0,0|1,0,0]=3 5207 B9R0.46 CCC\C=C\CC(N)CO Amb26848586 [0,2,0,0,0,0|0,0,0]=2 5208 B9R0.46 CCC\C=C\CC(O)CN Amb33422858 [0,2,0,0,0,0|1,0,0]=3 5209 B9R0.46 CCC\C=C\C[C@@H](O)CO Amb27484703 [0,2,0,0,0,0|0,0,0]=2 5210 B9R0.46 CCC\C=N\NC(C)CO Amb28063652 [0,2,0,0,0,0|1,0,1]=4 5211 B9R0.46 CCN(C)CCNCCO Amb25071808 [0,2,0,0,0,0|1,0,1]=4 5212 B9R0.46 CCN(C)CCOCCO Amb24616704 [0,2,0,0,0,0|1,0,1]=4 5213 B9R0.46 CCN(N)CCOCCO Amb27832473 [0,2,0,0,0,0|1,0,1]=4 5214 B9R0.46 CCNCCCC(C)OC Amb25738781 [0,2,0,0,0,0|1,0,1]=4 5215 B9R0.46 CCNCCCC(O)CC Amb27618908 [0,2,0,0,0,0|1,0,1]=4 5216 B9R0.46 CCNCCSC(C)CO Amb28079466 [0,2,0,0,0,0|1,0,1]=4 5217 B9R0.46 CCNC\C=C\C(C)OC Amb28133976 [0,2,0,0,0,0|2,0,0]=4 5218 B9R0.46 CCOCCCC(=O)CC Amb9316826 [0,2,0,0,0,0|1,0,1]=4 5219 B9R0.46 CCOCCCC(O)CO Amb27813119 [0,2,0,0,0,0|0,0,2]=4 5220 B9R0.46 CCOCCC[C@H](N)CO Amb27175345 [0,2,0,0,0,0|0,0,2]=4 5221 B9R0.46 CCOCCOC(C)CO Amb27661033 [0,2,0,0,0,0|1,0,1]=4 5222 B9R0.46 CCOCCSC(C)CO Amb27771669 [0,2,0,0,0,0|1,0,1]=4 5223 B9R0.46 CCOCOCC(N)CO Amb27398859 [0,2,0,0,0,0|1,0,1]=4 5224 B9R0.46 CCSCCCC(C)CO Amb27967129 [0,2,0,0,0,0|0,0,2]=4 5225 B9R0.46 CCSCCCC(N)CO Amb27779485 [0,2,0,0,0,0|0,0,2]=4 5226 B9R0.46 CCSCCCC(O)CN Amb28401101 [0,2,0,0,0,0|1,0,1]=4 5227 B9R0.46 CCSCCSC(C)CO Amb27620222 [0,2,0,0,0,0|1,0,1]=4 5228 B9R0.46 CCSCSCC(O)CO Amb27432512 [0,2,0,0,0,0|1,0,1]=4 5229 B9R0.46 CC[C@@H](C)\C=C\C=C\CO Amb27588775 [0,2,0,0,0,0|0,0,2]=4 5230 B9R0.46 CC[C@@H](O)CNCCCO Amb27256818 [0,2,0,0,0,0|0,0,2]=4 5231 B9R0.46 CC[C@H](C)CCCCCO Amb19944689 [0,2,0,0,0,0|0,0,2]=4 5232 B9R0.46 CC[C@H](C)CC\C=C\CO Amb27410556 [0,2,0,0,0,0|2,0,0]=4 5233 B9R0.46 CC\C(C)=C\CCCCBr Amb27253547 [0,2,0,0,0,0|1,0,0]=3 5234 B9R0.46 CC\C(C)=N\OCCOC Amb27485231 [0,2,0,0,0,0|2,0,0]=4 5235 B9R0.46 CC\C(N)=N\OCCCF Amb28065432 [0,2,0,0,0,0|2,0,0]=4 5236 B9R0.46 CC\C=C/CCC(=O)CC Amb27192561 [0,2,0,0,0,0|1,0,0]=3 5237 B9R0.46 CC\C=C/CCC(C)C=O Amb27797306 [0,2,0,0,0,0|0,0,1]=3 5238 B9R0.46 CC\C=C/CCC(N)CC Amb27429546 [0,2,0,0,0,0|1,0,0]=3 5239 B9R0.46 CC\C=C/CC[C@@H](Cl)C=O Amb27268394 [0,2,0,0,0,0|0,0,1]=3 5240 B9R0.46 CC\C=C\C=C\C(O)C#N Amb27471650 [0,2,0,0,0,0|0,0,2]=4 5241 B9R0.46 CC\C=C\C=C\C(O)CCl Amb28286156 [0,2,0,0,0,0|0,0,2]=4 5242 B9R0.46 CC\C=C\C=C\[C@H](O)C#N Amb27980535 [0,2,0,0,0,0|0,0,2]=4 5243 B9R0.46 CC\C=C\C=C\[C@H](O)CCl Amb27265863 [0,2,0,0,0,0|0,0,2]=4 5244 B9R0.46 CC\C=C\CCC(=O)CC Amb28198289 [0,2,0,0,0,0|1,0,0]=3 5245 B9R0.46 CC\C=C\CCC(=O)NC Amb28133852 [0,2,0,0,0,0|0,0,2]=4 5246 B9R0.46 CC\C=C\CCC(=O)OC Amb25350136 [0,2,0,0,0,0|0,0,1]=3 5247 B9R0.46 CC\C=C\CCN(C)OC Amb27649053 [0,2,0,0,0,0|1,0,0]=3 5248 B9R0.46 CC\C=C\CNC(=O)CBr Amb27422866 [0,2,0,0,0,0|1,0,1]=4 5249 B9R0.46 CC\C=C\CNC(=O)CS Amb27874552 [0,2,0,0,0,0|0,1,1]=4 5250 B9R0.46 CC\C=C\CNC(C)CO Amb28200613 [0,2,0,0,0,0|0,0,0]=2 5251 B9R0.46 CC\C=C\COC(=O)CC Amb27150578 [0,2,0,0,0,0|1,0,1]=4 5252 B9R0.46 CC\C=C\COC(=O)CO Amb27479358 [0,2,0,0,0,0|0,0,1]=3 5253 B9R0.46 CC\C=C\C\C=C(/C)CO Amb27839246 [0,2,0,0,0,0|0,0,1]=3 5254 B9R0.46 CC\C=C\OCC(O)CO Amb28070548 [0,2,0,0,0,0|0,0,0]=2 5255 B9R0.46 CNC(=N)SCCCCO Amb27812506 [0,2,0,0,0,0|1,0,1]=4 5256 B9R0.46 CNC(=O)CCCCCO Amb27592471 [0,2,0,0,0,0|1,0,1]=4 5257 B9R0.46 CNC(=O)NCCCOC Amb2132785 [0,2,0,0,0,0|2,0,0]=4 5258 B9R0.46 CNC(=O)OCCCON Amb28132676 [0,2,0,0,0,0|2,0,0]=4 5259 B9R0.46 COC(=O)C#CCCCO Amb22230916 [0,2,0,0,0,0|1,0,1]=4 5260 B9R0.46 COC(=O)CCCCCO Amb22002577 [0,2,0,0,0,0|1,0,1]=4 5261 B9R0.46 COC(=O)CCNCCO Amb9243303 [0,2,0,0,0,0|1,0,1]=4 5262 B9R0.46 COC(=O)CCOCCO Amb33986072 [0,2,0,0,0,0|1,0,1]=4 5263 B9R0.46 COC(=O)CNCCCO Amb9247002 [0,2,0,0,0,0|1,0,1]=4 5264 B9R0.46 COC(=O)C\C=C\CCO Amb28292442 [0,2,0,0,0,0|1,0,1]=4 5265 B9R0.46 COC(=O)NCCCCO Amb27251899 [0,2,0,0,0,0|1,0,1]=4 5266 B9R0.46 COC(=O)SSCCCO Amb28065222 [0,2,0,0,0,0|2,0,0]=4 5267 B9R0.46 COC(C)\C=N\NCCO Amb27953919 [0,2,0,0,0,0|2,0,0]=4 5268 B9R0.46 COCCCCC(=O)CO Amb28254576 [0,2,0,0,0,0|1,0,1]=4 5269 B9R0.46 COCCCNC(=O)CBr Amb17323752 [0,2,0,0,0,0|2,0,0]=4 5270 B9R0.46 COCCCNC(=O)CCl Amb1150989 [0,2,0,0,0,0|2,0,0]=4 5271 B9R0.46 COCCCNC(=O)CI Amb27839141 [0,2,0,0,0,0|2,0,0]=4 5272 B9R0.46 COCCCNC(=O)CN Amb5783035 [0,2,0,0,0,0|2,0,0]=4 5273 B9R0.46 COCCCNC(=O)CO Amb9421653 [0,2,0,0,0,0|2,0,0]=4 5274 B9R0.46 COCCCNC(=O)CS Amb27203369 [0,2,0,0,0,0|2,0,0]=4 5275 B9R0.46 COCCCNC(=S)SC Amb27823572 [0,2,0,0,0,0|2,0,0]=4 5276 B9R0.46 COCCCOC(=O)CN Amb27848859 [0,2,0,0,0,0|2,0,0]=4 5277 B9R0.46 COCCCOC(=O)CO Amb27207808 [0,2,0,0,0,0|2,0,0]=4 5278 B9R0.46 COCCCOC(=O)CS Amb27648593 [0,2,0,0,0,0|2,0,0]=4 5279 B9R0.46 COCCC\C=C(/C)C=O Amb28320361 [0,2,0,0,0,0|1,0,1]=4 5280 B9R0.46 COCCNCC(C)CO Amb27606270 [0,2,0,0,0,0|1,0,1]=4 5281 B9R0.46 COCCNCC(O)CO Amb17308972 [0,2,0,0,0,0|1,0,1]=4 5282 B9R0.46 COCCOCC(O)CO Amb27630246 [0,2,0,0,0,0|1,0,1]=4 5283 B9R0.46 COCCOC[C@@H](N)CO Amb28410598 [0,2,0,0,0,0|1,0,1]=4 5284 B9R0.46 COCOCCC(C)CO Amb27480403 [0,2,0,0,0,0|1,0,1]=4 5285 B9R0.46 COCOCC[C@@H](C)CO Amb27472642 [0,2,0,0,0,0|1,0,1]=4 5286 B9R0.46 COCOCC[C@H](C)CO Amb28138711 [0,2,0,0,0,0|1,0,1]=4 5287 B9R0.46 CSC(=O)NCCCCO Amb27614137 [0,2,0,0,0,0|1,0,1]=4 5288 B9R0.46 CSCCNC[C@H](O)CO Amb27389888 [0,2,0,0,0,0|1,0,1]=4 5289 B9R0.46 CSCCOC[C@@H](N)CO Amb28255955 [0,2,0,0,0,0|1,0,1]=4 5290 B9R0.46 CSCCSCC(O)CO Amb27817441 [0,2,0,0,0,0|1,0,1]=4 5291 B9R0.46 C\C(=C/CCCCCl)CCl Amb28247217 [0,2,0,0,0,0|2,0,0]=4 5292 B9R0.46 C\C=C\C=C\CC(N)CC Amb27843463 [0,2,0,0,0,0|1,0,1]=4 5293 B9R0.46 C\C=C\CCCC(O)CC Amb27969085 [0,2,0,0,0,0|0,0,2]=4 5294 B9R0.46 C\C=C\CCNC(C)CO Amb27641704 [0,2,0,0,0,0|0,0,2]=4 5295 B9R0.46 NC(CO)COCCCO Amb28410875 [0,2,0,0,0,0|1,0,1]=4 5296 B9R0.46 NCC(=O)OCCCCO Amb27657505 [0,2,0,0,0,0|1,0,1]=4 5297 B9R0.46 NCC(O)CNCCCO Amb28072645 [0,2,0,0,0,0|1,0,1]=4 5298 B9R0.46 NCCCNCC(N)CO Amb27815029 [0,2,0,0,0,0|1,0,1]=4 5299 B9R0.46 NCCCNC[C@H](O)CO Amb27779433 [0,2,0,0,0,0|1,0,1]=4 5300 B9R0.46 NCCCOCC(O)CO Amb24654813 [0,2,0,0,0,0|1,0,1]=4 5301 B9R0.46 NCCCSCC(O)CO Amb27486689 [0,2,0,0,0,0|1,0,1]=4 5302 B9R0.46 N[C@@H](CO)COCCCF Amb27755335 [0,2,0,0,0,0|1,0,1]=4 5303 B9R0.46 O=C(CBr)NCCCCO Amb27839557 [0,2,0,0,0,0|1,0,1]=4 5304 B9R0.46 O=C(CBr)OCCCCO Amb28208349 [0,2,0,0,0,0|1,0,1]=4 5305 B9R0.46 O=C(CCl)CCCCCO Amb27799874 [0,2,0,0,0,0|1,0,1]=4 5306 B9R0.46 OCC(O)CCCCCBr Amb27252942 [0,2,0,0,0,0|0,0,2]=4 5307 B9R0.46 OCCCCCC(Cl)CCl Amb28244982 [0,2,0,0,0,0|0,0,2]=4 5308 B9R0.46 OCCCCCC(O)CO Amb22731576 [0,2,0,0,0,0|0,0,2]=4 5309 B9R0.46 OCCCSCC(O)CCl Amb28385596 [0,2,0,0,0,0|1,0,1]=4 5310 B9R0.46 OCCCSCC(O)CO Amb27390520 [0,2,0,0,0,0|1,0,1]=4 5311 B9R0.46 OC\C=C\C=C\C(O)CO Amb27969508 [0,2,0,0,0,0|0,0,2]=4 5312 B9R0.1 CC(C)=CCC[C@H](C)CO Amb27603484 [0,2,0,0,0,0|0,0,2]=4 5313 B9R0.1 CC(C)=CCC[C@H](O)CO Amb28050222 [0,2,0,0,0,0|0,0,2]=4 5314 B9R0.1 CC(C)=C\C=C\C(C)CO Amb27588854 [0,2,0,0,0,0|0,0,2]=4 5315 B9R0.1 CC(C)C=C=C[C@@H](C)CO Amb27826387 [0,2,0,0,0,0|0,0,2]=4 5316 B9R0.1 CC(C)CCCC(C)CO Amb24082368 [0,2,0,0,0,0|0,0,2]=4 5317 B9R0.1 CC(C)CCCC(N)CO Amb27233021 [0,2,0,0,0,0|0,0,2]=4 5318 B9R0.1 CC(C)CCC[C@@H](C)CO Amb26336716 [0,2,0,0,0,0|0,0,2]=4 5319 B9R0.1 CC(C)CCC[C@H](C)CO Amb33730882 [0,2,0,0,0,0|0,0,2]=4 5320 B9R0.1 CC(C)CNCC(C)CO Amb28323127 [0,2,0,0,0,0|1,0,1]=4 5321 B9R0.1 CC(C)CNCC(O)CO Amb17308639 [0,2,0,0,0,0|1,0,1]=4 5322 B9R0.1 CC(C)CNC[C@@H](O)CO Amb33041847 [0,2,0,0,0,0|1,0,1]=4 5323 B9R0.1 CC(C)CNC[C@H](O)CO Amb27837587 [0,2,0,0,0,0|1,0,1]=4 5324 B9R0.1 CC(C)COCC(N)CO Amb27976629 [0,2,0,0,0,0|1,0,1]=4 5325 B9R0.1 CC(C)COCC(O)CO Amb9787114 [0,2,0,0,0,0|1,0,1]=4 5326 B9R0.1 CC(C)CSCC(N)CO Amb27799380 [0,2,0,0,0,0|1,0,1]=4 5327 B9R0.1 CC(C)OCCC(N)CO Amb24592118 [0,2,0,0,0,0|1,0,1]=4 5328 B9R0.1 CC(C)ONCC(O)CO Amb27979482 [0,2,0,0,0,0|2,0,0]=4 5329 B9R0.1 CC(C)PCCC(N)CO Amb27617153 [0,2,0,0,0,0|1,0,1]=4 5330 B9R0.1 CC(C)\C=N\CC(Cl)CCl Amb28239758 [0,2,0,0,0,0|2,0,0]=4 5331 B9R0.1 CC(CO)CCOC(C)C Amb28434553 [0,2,0,0,0,0|1,0,1]=4 5332 B9R0.1 CC(N)CCCC(C)CO Amb27226928 [0,2,0,0,0,0|0,0,2]=4 5333 B9R0.1 CC(N)CSCC(O)CO Amb28248541 [0,2,0,0,0,0|1,0,1]=4 5334 B9R0.1 CC(O)CCNC(=O)CS Amb28120401 [0,2,0,0,0,0|2,0,0]=4 5335 B9R0.1 CC(O)CNC[C@H](O)CO Amb27412288 [0,2,0,0,0,0|1,0,1]=4 5336 B9R0.1 CC(O)CSCC(C)CO Amb27425054 [0,2,0,0,0,0|1,0,1]=4 5337 B9R0.1 CCC(=O)CCCC(C)C Amb9031663 [0,2,0,0,0,0|1,0,1]=4 5338 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,2,0,0,0,0|1,0,1]=4 5339 B9R0.1 CCC(=O)OCCC(=O)O Amb26597385 [0,2,0,0,0,0|1,0,1]=4 5340 B9R0.1 CCC(=O)OCCC(C)F Amb28293863 [0,2,0,0,0,0|2,0,0]=4 5341 B9R0.1 CCC(=O)SCCC(=O)O Amb27657281 [0,2,0,0,0,0|1,0,1]=4 5342 B9R0.1 CCC(=S)NCCC(C)C Amb27866037 [0,2,0,0,0,0|2,0,0]=4 5343 B9R0.1 CCC(N)C\C=C\C(C)C Amb27429544 [0,2,0,0,0,0|1,0,0]=3 5344 B9R0.1 CC\C(C)=C\CCC(=O)O Amb27474810 [0,2,0,0,0,0|0,0,1]=3 5345 B9R0.1 CC\C(C)=C\CCC(C)=O Amb2721172 [0,2,0,0,0,0|0,0,2]=4 5346 B9R0.1 CC\C(C)=C\CCC(C)Br Amb28287338 [0,2,0,0,0,0|1,0,0]=3 5347 B9R0.1 CC\C(C)=N\NCC(C)O Amb27854499 [0,2,0,0,0,0|2,0,0]=4 5348 B9R0.1 CNC(=O)NCCC(C)O Amb27971912 [0,2,0,0,0,0|2,0,0]=4 5349 B9R0.1 COC(=O)CCCC(C)O Amb24414468 [0,2,0,0,0,0|1,0,1]=4 5350 B9R0.1 COC(=O)CCC[C@H](C)O Amb27839593 [0,2,0,0,0,0|1,0,1]=4 5351 B9R0.1 COC(=O)NCC[C@H](C)O Amb27663109 [0,2,0,0,0,0|2,0,0]=4 5352 B9R0.1 C[C@H](N)CSCC(O)CO Amb27809787 [0,2,0,0,0,0|1,0,1]=4 5353 B9R0.1 C[C@H](O)CNCC(O)CO Amb27469837 [0,2,0,0,0,0|1,0,1]=4 5354 B9R0.1 C\C(=C\CCC(C)C)CN Amb28145079 [0,2,0,0,0,0|2,0,0]=4 5355 B9R0.1 C\C(C=O)=C/CCC(C)O Amb27598642 [0,2,0,0,0,0|1,0,1]=4 5356 B9R0.1 C\C(C=O)=C\CCC(C)O Amb27841297 [0,2,0,0,0,0|1,0,1]=4 5357 B9R0.1 C\C=C(\C)CCCC(C)O Amb28050786 [0,2,0,0,0,0|0,0,2]=4 5358 B9R0.20 CCCCCC(C)(C)CO Amb26369679 [0,2,0,0,0,0|0,0,2]=4 5359 B9R0.20 CCCCCC(C)(N)CO Amb28049699 [0,2,0,0,0,0|0,0,2]=4 5360 B9R0.20 CCCNCC(C)(C)CO Amb28049341 [0,2,0,0,0,0|1,0,1]=4 5361 B9R0.20 CCCOCC(C)(C)CO Amb28315855 [0,2,0,0,0,0|1,0,1]=4 5362 B9R0.20 CCCOCC(C)(N)CO Amb27262138 [0,2,0,0,0,0|1,0,1]=4 5363 B9R0.20 CCCSCC(C)(N)CO Amb27851558 [0,2,0,0,0,0|1,0,1]=4 5364 B9R0.20 CCC\C=C\C(C)(C)CO Amb28138688 [0,2,0,0,0,0|0,0,2]=4 5365 B9R0.20 CCC\C=C\C(C)(N)CO Amb33424823 [0,2,0,0,0,0|0,0,2]=4 5366 B9R0.20 CCC\C=C\C(F)(F)CO Amb32745549 [0,2,0,0,0,0|0,0,2]=4 5367 B9R0.20 CCOCCC(C)(N)CO Amb27168833 [0,2,0,0,0,0|1,0,1]=4 5368 B9R0.20 CCONCC(C)(C)CO Amb27164830 [0,2,0,0,0,0|2,0,0]=4 5369 B9R0.20 CCS(=O)(=O)NCCCO Amb9361729 [0,2,0,0,0,0|2,0,0]=4 5370 B9R0.20 CCSCCC(C)(C)CO Amb24335083 [0,2,0,0,0,0|1,0,1]=4 5371 B9R0.20 CCSCCC(C)(N)CO Amb25785411 [0,2,0,0,0,0|1,0,1]=4 5372 B9R0.20 CC[Si](C)(C)CCCCO Amb27752358 [0,2,0,0,0,0|0,1,1]=4 5373 B9R0.20 CC\C=C\CC(C)(C)CBr Amb33009099 [0,2,0,0,0,0|1,0,0]=3 5374 B9R0.20 CC\C=C\CC(C)(C)CN Amb33361616 [0,2,0,0,0,0|1,0,0]=3 5375 B9R0.20 CC\C=C\CC(C)(C)CO Amb33267525 [0,2,0,0,0,0|0,0,0]=2 5376 B9R0.20 CC\C=C\CC(C)(C)NC Amb33267526 [0,2,0,0,0,0|2,0,0]=4 5377 B9R0.20 CC\C=C\CC(C)(N)CO Amb33267570 [0,2,0,0,0,0|0,0,0]=2 5378 B9R0.20 CC\C=C\CC(Cl)(Cl)C=O Amb27268557 [0,2,0,0,0,0|0,0,2]=4 5379 B9R0.20 CC\C=C\CC(F)(F)CN Amb33227893 [0,2,0,0,0,0|1,0,0]=3 5380 B9R0.24 CC(CO)CNC(=O)CBr Amb27175197 [0,2,0,0,0,0|2,0,0]=4 5381 B9R0.24 CC(CO)CNC(=O)CCl Amb27833178 [0,2,0,0,0,0|2,0,0]=4 5382 B9R0.24 CC(CO)CNC(=O)CN Amb27197708 [0,2,0,0,0,0|2,0,0]=4 5383 B9R0.24 CC(CO)CNC(=O)CS Amb27401279 [0,2,0,0,0,0|2,0,0]=4 5384 B9R0.24 CCC(=O)CCC(C)CC Amb28348884 [0,2,0,0,0,0|1,0,1]=4 5385 B9R0.24 CCC(=O)CCC(C)CN Amb28060686 [0,2,0,0,0,0|1,0,1]=4 5386 B9R0.24 CCC(=O)CCC(N)CC Amb27454005 [0,2,0,0,0,0|1,0,1]=4 5387 B9R0.24 CCC(=O)CCC(O)CF Amb28437142 [0,2,0,0,0,0|1,0,1]=4 5388 B9R0.24 CCC(=O)NCC(Br)CC Amb27971757 [0,2,0,0,0,0|2,0,0]=4 5389 B9R0.24 CCC(=O)NCC(C)CBr Amb28249686 [0,2,0,0,0,0|2,0,0]=4 5390 B9R0.24 CCC(=O)NCC(C)CCl Amb28049464 [0,2,0,0,0,0|2,0,0]=4 5391 B9R0.24 CCC(=O)NCC(C)CN Amb19027064 [0,2,0,0,0,0|2,0,0]=4 5392 B9R0.24 CCC(=O)NCC(N)CC Amb27663327 [0,2,0,0,0,0|2,0,0]=4 5393 B9R0.24 CCC(=O)NCC(O)CC Amb27426269 [0,2,0,0,0,0|2,0,0]=4 5394 B9R0.24 CCC(=O)NC[C@@H](O)CO Amb33041812 [0,2,0,0,0,0|1,0,0]=3 5395 B9R0.24 CCC(=O)OCC(Br)CC Amb33276519 [0,2,0,0,0,0|2,0,0]=4 5396 B9R0.24 CCC(=O)OCC(C)CBr Amb27603933 [0,2,0,0,0,0|2,0,0]=4 5397 B9R0.24 CCC(=O)OCC(O)CCl Amb27959738 [0,2,0,0,0,0|2,0,0]=4 5398 B9R0.24 CCC(=O)OCC(O)CO Amb24740407 [0,2,0,0,0,0|1,0,0]=3 5399 B9R0.24 CCC(=O)OC[C@@H](O)CBr Amb28208346 [0,2,0,0,0,0|2,0,0]=4 5400 B9R0.24 CCC(C)OCC(O)CO Amb27978502 [0,2,0,0,0,0|1,0,1]=4 5401 B9R0.24 CCC(C)SCC(O)CO Amb28049667 [0,2,0,0,0,0|1,0,1]=4 5402 B9R0.24 CCS(=O)NCC(O)CO Amb27212752 [0,2,0,0,0,0|2,0,0]=4 5403 B9R0.24 CC[C@H](C)\C=C\[C@@H](O)CO Amb28050738 [0,2,0,0,0,0|0,0,2]=4 5404 B9R0.24 CNC(=N)NCC(C)CO Amb28064537 [0,2,0,0,0,0|2,0,0]=4 5405 B9R0.24 CNC(=O)NCC(C)CO Amb28363662 [0,2,0,0,0,0|2,0,0]=4 5406 B9R0.24 COC(=O)CCC(C)CO Amb28319952 [0,2,0,0,0,0|1,0,1]=4 5407 B9R0.24 COC(=O)CC[C@@H](C)CO Amb28050698 [0,2,0,0,0,0|1,0,1]=4 5408 B9R0.24 COC(=O)CC[C@@H](O)CO Amb27761525 [0,2,0,0,0,0|1,0,1]=4 5409 B9R0.24 COC(=O)NCC(C)CO Amb28286586 [0,2,0,0,0,0|2,0,0]=4 5410 B9R0.24 COC(=O)NCC(N)CO Amb27598507 [0,2,0,0,0,0|2,0,0]=4 5411 B9R0.24 COC(=O)NCC(O)CO Amb27876174 [0,2,0,0,0,0|2,0,0]=4 5412 B9R0.24 COC(=O)\C=C\C(C)CO Amb28454593 [0,2,0,0,0,0|1,0,1]=4 5413 B9R0.24 COC(=O)\C=C\[C@@H](Br)CO Amb28050001 [0,2,0,0,0,0|1,0,1]=4 5414 B9R0.24 COC(=O)\C=C\[C@@H](O)CO Amb27775775 [0,2,0,0,0,0|1,0,1]=4 5415 B9R0.24 COC(=S)SCC(O)CO Amb27762116 [0,2,0,0,0,0|2,0,0]=4 5416 B9R0.24 O=C(CBr)OC[C@@H](O)CO Amb27488630 [0,2,0,0,0,0|2,0,0]=4 5417 B9R0.24 O=C(CCl)NCC(O)CO Amb22754889 [0,2,0,0,0,0|2,0,0]=4 5418 B9R0.24 O=C(CCl)NC[C@H](O)CO Amb28072856 [0,2,0,0,0,0|2,0,0]=4 5419 B9R0.24 O=C(CCl)OCC(O)CO Amb27599954 [0,2,0,0,0,0|2,0,0]=4 5420 B9R0.24 O=C(CF)OCC(O)CO Amb27879504 [0,2,0,0,0,0|2,0,0]=4 5421 B9R0.24 O=C(CS)OC[C@@H](O)CO Amb33872511 [0,2,0,0,0,0|2,0,0]=4 5422 B9R0.24 O=C(\C=C\C(O)CO)CO Amb26531357 [0,2,0,0,0,0|1,0,1]=4 5423 B9R0.47 C#CCC\C=C(/C)C(C)N Amb27816977 [0,2,0,0,0,0|1,0,1]=4 5424 B9R0.47 C=C(C)C(=O)OCCCO Amb22338752 [0,2,0,0,0,0|1,0,1]=4 5425 B9R0.47 C=C(CCCCC)[C@H](C)O Amb27406775 [0,2,0,0,0,0|1,0,1]=4 5426 B9R0.47 CC(=O)C(=O)NCCCO Amb27589399 [0,2,0,0,0,0|1,0,1]=4 5427 B9R0.47 CC(Br)C(=O)NCCCO Amb17333283 [0,2,0,0,0,0|1,0,0]=3 5428 B9R0.47 CC(C)=C(C)CCCCO Amb26895794 [0,2,0,0,0,0|0,0,2]=4 5429 B9R0.47 CC(C)C(=N)NCCCF Amb27471589 [0,2,0,0,0,0|2,0,0]=4 5430 B9R0.47 CC(C)C(=O)C=C=CCO Amb27973053 [0,2,0,0,0,0|0,0,2]=4 5431 B9R0.47 CC(C)C(=O)CCCCF Amb27833045 [0,2,0,0,0,0|1,0,1]=4 5432 B9R0.47 CC(C)C(=O)NCCCCl Amb3886658 [0,2,0,0,0,0|2,0,0]=4 5433 B9R0.47 CC(C)C(=O)NCCCN Amb32686908 [0,2,0,0,0,0|2,0,0]=4 5434 B9R0.47 CC(C)C(=O)NCCCN Amb6275650 [0,2,0,0,0,0|2,0,0]=4 5435 B9R0.47 CC(C)C(=O)NCCCO Amb5797625 [0,2,0,0,0,0|1,0,0]=3 5436 B9R0.47 CC(C)C(=O)OCCCO Amb24396987 [0,2,0,0,0,0|1,0,0]=3 5437 B9R0.47 CC(C)C(C)NCCCO Amb6733655 [0,2,0,0,0,0|1,0,1]=4 5438 B9R0.47 CC(C)C(C)OCCCO Amb27621610 [0,2,0,0,0,0|1,0,1]=4 5439 B9R0.47 CC(C)C(N)C\C=C\CO Amb27838023 [0,2,0,0,0,0|2,0,0]=4 5440 B9R0.47 CC(C)N(C)CCCCO Amb9370173 [0,2,0,0,0,0|1,0,1]=4 5441 B9R0.47 CC(C)\C(N)=N\OCCO Amb27836461 [0,2,0,0,0,0|2,0,0]=4 5442 B9R0.47 CC(Cl)C(=O)NCCCO Amb17600137 [0,2,0,0,0,0|1,0,0]=3 5443 B9R0.47 CC(N)C(=O)NCCCS Amb24741609 [0,2,0,0,0,0|1,1,0]=4 5444 B9R0.47 CC(N)C(C)SCCCO Amb27471461 [0,2,0,0,0,0|1,0,1]=4 5445 B9R0.47 CC(O)C(=O)CCCCF Amb27457078 [0,2,0,0,0,0|1,0,1]=4 5446 B9R0.47 CC(O)C(=O)OCCCCl Amb26979833 [0,2,0,0,0,0|2,0,0]=4 5447 B9R0.47 CC(O)C(=O)OCCCI Amb28062159 [0,2,0,0,0,0|2,0,0]=4 5448 B9R0.47 CC(O)C(C)C\C=C\CO Amb28050669 [0,2,0,0,0,0|1,0,0]=3 5449 B9R0.47 CC(O)C(O)C\C=C\CO Amb27807724 [0,2,0,0,0,0|1,0,0]=3 5450 B9R0.47 CC(S)C(=O)NCCCN Amb27772358 [0,2,0,0,0,0|2,0,0]=4 5451 B9R0.47 CCCCCC(=O)C(C)C Amb9024776 [0,2,0,0,0,0|1,0,1]=4 5452 B9R0.47 CCCCCC(=O)C(C)Cl Amb27214156 [0,2,0,0,0,0|1,0,1]=4 5453 B9R0.47 CCCCCC(=O)C(C)F Amb27802661 [0,2,0,0,0,0|1,0,1]=4 5454 B9R0.47 CCCCCC(Br)C(C)O Amb28049966 [0,2,0,0,0,0|0,0,2]=4 5455 B9R0.47 CCCCCC(F)C(C)O Amb27769908 [0,2,0,0,0,0|0,0,2]=4 5456 B9R0.47 CCCCCC(O)C(C)O Amb27835134 [0,2,0,0,0,0|0,0,2]=4 5457 B9R0.47 CCCCC[C@H](Br)[C@H](C)O Amb27830165 [0,2,0,0,0,0|0,0,2]=4 5458 B9R0.47 CCCCC[C@H](N)[C@H](C)O Amb28250851 [0,2,0,0,0,0|0,0,2]=4 5459 B9R0.47 CCCCC[C@H](O)[C@@H](C)O Amb27979805 [0,2,0,0,0,0|0,0,2]=4 5460 B9R0.47 CCCCNC(=O)C(C)Br Amb17333014 [0,2,0,0,0,0|2,0,0]=4 5461 B9R0.47 CCCCNC(=O)C(C)Cl Amb6279272 [0,2,0,0,0,0|2,0,0]=4 5462 B9R0.47 CCCCNC(=O)C(C)I Amb28365859 [0,2,0,0,0,0|2,0,0]=4 5463 B9R0.47 CCCCNC(=O)C(C)N Amb6274939 [0,2,0,0,0,0|2,0,0]=4 5464 B9R0.47 CCCCNC(=O)C(C)O Amb9421393 [0,2,0,0,0,0|2,0,0]=4 5465 B9R0.47 CCCCNC(=O)[C@@H](C)Br Amb27799880 [0,2,0,0,0,0|2,0,0]=4 5466 B9R0.47 CCCCNC(=O)[C@@H](C)N Amb18014636 [0,2,0,0,0,0|2,0,0]=4 5467 B9R0.47 CCCCNC(=O)[C@@H](C)O Amb25740293 [0,2,0,0,0,0|2,0,0]=4 5468 B9R0.47 CCCCNC(=O)[C@H](C)Br Amb27617159 [0,2,0,0,0,0|2,0,0]=4 5469 B9R0.47 CCCCNC(=O)[C@H](C)O Amb27259099 [0,2,0,0,0,0|2,0,0]=4 5470 B9R0.47 CCCCOC(=O)C(C)Br Amb3939973 [0,2,0,0,0,0|2,0,0]=4 5471 B9R0.47 CCCCOC(=O)C(C)Cl Amb9786084 [0,2,0,0,0,0|2,0,0]=4 5472 B9R0.47 CCCCOC(=O)C(C)F Amb27816837 [0,2,0,0,0,0|2,0,0]=4 5473 B9R0.47 CCCCOC(=O)C(C)N Amb8894984 [0,2,0,0,0,0|2,0,0]=4 5474 B9R0.47 CCCCOC(=O)C(C)O Amb3939678 [0,2,0,0,0,0|2,0,0]=4 5475 B9R0.47 CCCCOC(=O)[C@H](C)N Amb26979455 [0,2,0,0,0,0|2,0,0]=4 5476 B9R0.47 CCCCOC(=O)[C@H](C)O Amb3939703 [0,2,0,0,0,0|2,0,0]=4 5477 B9R0.47 CCCC\C=C(/Cl)C(C)=O Amb27822638 [0,2,0,0,0,0|1,0,1]=4 5478 B9R0.47 CCCC\C=C(\C)C(C)N Amb27617843 [0,2,0,0,0,0|1,0,0]=3 5479 B9R0.47 CCC\C=C\C(=O)C(C)N Amb33327185 [0,2,0,0,0,0|1,0,1]=4 5480 B9R0.47 CCSCCC(C)C(C)O Amb27762859 [0,2,0,0,0,0|1,0,1]=4 5481 B9R0.47 CC\C=C\CC(=O)C(=O)O Amb33268699 [0,2,0,0,0,0|0,0,2]=4 5482 B9R0.47 CC\C=C\CC(C)C(=O)O Amb27838058 [0,2,0,0,0,0|0,0,1]=3 5483 B9R0.47 CC\C=C\CC(N)C(=O)O Amb25255710 [0,2,0,0,0,0|0,0,1]=3 5484 B9R0.47 CC\C=C\CC(N)C(=O)O Amb30666656 [0,2,0,0,0,0|0,0,1]=3 5485 B9R0.47 CC\C=C\CC(N)C(F)F Amb33410066 [0,2,0,0,0,0|1,0,0]=3 5486 B9R0.47 CN(C)C(=O)CCCCO Amb17232000 [0,2,0,0,0,0|1,0,1]=4 5487 B9R0.47 CN(C)C(=S)SCCCO Amb24704775 [0,2,0,0,0,0|2,0,0]=4 5488 B9R0.47 CNCC\C=C(\C)C(C)C Amb27390524 [0,2,0,0,0,0|2,0,0]=4 5489 B9R0.47 CO\C=C\CC(O)C(=O)O Amb28050044 [0,2,0,0,0,0|1,0,1]=4 5490 B9R0.47 C[C@@H](N)C(=O)NCCCN Amb28325305 [0,2,0,0,0,0|2,0,0]=4 5491 B9R0.47 C[C@@H](O)C(=O)NCCCO Amb28316044 [0,2,0,0,0,0|1,0,0]=3 5492 B9R0.47 C[C@@H](O)[C@@H](O)C\C=C\CO Amb27650524 [0,2,0,0,0,0|1,0,0]=3 5493 B9R0.47 C[C@H](N)C(=O)NCCCF Amb27602949 [0,2,0,0,0,0|2,0,0]=4 5494 B9R0.47 C\C(=C/CCCO)C(C)C Amb28065297 [0,2,0,0,0,0|0,0,0]=2 5495 B9R0.47 C\C(=N/NCCO)C(C)C Amb24509163 [0,2,0,0,0,0|2,0,0]=4 5496 B9R0.47 C\C(=N/OCCO)C(C)C Amb27171866 [0,2,0,0,0,0|2,0,0]=4 5497 B9R0.47 C\C=C\C=C\C(O)C(C)O Amb27190820 [0,2,0,0,0,0|0,0,2]=4 5498 B9R0.47 NC(C\C=C/CO)C(=O)O Amb28046143 [0,2,0,0,0,0|1,0,1]=4 5499 B9R0.47 NC\C=C\CC(N)C(=O)O Amb22800680 [0,2,0,0,0,0|1,0,1]=4 5500 B9R0.47 O=C(NCCCO)C(Cl)Cl Amb17665128 [0,2,0,0,0,0|2,0,0]=4 5501 B9R0.50 C=C=C(CC)CCCCO Amb27614980 [0,2,0,0,0,0|0,0,1]=3 5502 B9R0.50 C=C=C(CC)COCCO Amb27662187 [0,2,0,0,0,0|1,0,1]=4 5503 B9R0.50 C=CC(C=C)=CCCCO Amb27452399 [0,2,0,0,0,0|0,0,2]=4 5504 B9R0.50 C=CC(CO)CCCCC Amb27977343 [0,2,0,0,0,0|0,0,2]=4 5505 B9R0.50 C=CC(CO)CC\C=C\C Amb27615147 [0,2,0,0,0,0|0,0,2]=4 5506 B9R0.50 C=C\C(=C/CCCO)CO Amb28050645 [0,2,0,0,0,0|1,0,0]=3 5507 B9R0.50 C=C\C=C\CC(C=C)CO Amb28185034 [0,2,0,0,0,0|0,0,2]=4 5508 B9R0.50 CCC(=CCCC=O)CC Amb28123663 [0,2,0,0,0,0|0,0,2]=4 5509 B9R0.50 CCC(C#N)SCCCO Amb28386291 [0,2,0,0,0,0|1,0,1]=4 5510 B9R0.50 CCC(CC)CCCCO Amb26581149 [0,2,0,0,0,0|0,0,2]=4 5511 B9R0.50 CCC(CC)SCCCO Amb28364480 [0,2,0,0,0,0|1,0,1]=4 5512 B9R0.50 CCC(CCCCO)OC Amb27617717 [0,2,0,0,0,0|0,0,2]=4 5513 B9R0.50 CCC(CN)OCCCO Amb24750188 [0,2,0,0,0,0|1,0,1]=4 5514 B9R0.50 CCC(CO)CCCCO Amb27770514 [0,2,0,0,0,0|0,0,2]=4 5515 B9R0.50 CCC(C\C=C\CCl)OC Amb26968678 [0,2,0,0,0,0|2,0,0]=4 5516 B9R0.50 CCC(OC)OCCCO Amb27605448 [0,2,0,0,0,0|1,0,1]=4 5517 B9R0.50 CCC(\C=C\CCO)CO Amb27220507 [0,2,0,0,0,0|0,0,2]=4 5518 B9R0.50 CCCCC=C(CC)CC Amb22229299 [0,2,0,0,0,0|1,0,0]=3 5519 B9R0.50 CCCCCC(CC)CO Amb27831173 [0,2,0,0,0,0|0,0,2]=4 5520 B9R0.50 CCCCCC(CN)CO Amb27465223 [0,2,0,0,0,0|0,0,2]=4 5521 B9R0.50 CCCCCC(CO)CS Amb27839186 [0,2,0,0,0,0|0,0,2]=4 5522 B9R0.50 CCCCCC(CO)SC Amb27457183 [0,2,0,0,0,0|0,0,2]=4 5523 B9R0.50 CCCCC[C@@H](CC)CO Amb28050752 [0,2,0,0,0,0|0,0,2]=4 5524 B9R0.50 CCCCN\C(CC)=N\O Amb28189780 [0,2,0,0,0,0|2,0,0]=4 5525 B9R0.50 CCCC\C=C(/C=O)CCl Amb28319228 [0,2,0,0,0,0|2,0,0]=4 5526 B9R0.50 CCCC\C=C(/C=O)SC Amb25324111 [0,2,0,0,0,0|2,0,0]=4 5527 B9R0.50 CCCC\C=C(\CC)CBr Amb24477337 [0,2,0,0,0,0|1,0,0]=3 5528 B9R0.50 CCCOCC(CO)NC Amb27448150 [0,2,0,0,0,0|1,0,1]=4 5529 B9R0.50 CCCSCC(CO)NC Amb27839117 [0,2,0,0,0,0|1,0,1]=4 5530 B9R0.50 CCC\C=C\C(CN)CO Amb33424868 [0,2,0,0,0,0|0,0,2]=4 5531 B9R0.50 CCN(CC)CCCCO Amb4313869 [0,2,0,0,0,0|1,0,1]=4 5532 B9R0.50 CCOCCC(CO)NC Amb27615062 [0,2,0,0,0,0|1,0,1]=4 5533 B9R0.50 CCSCCC(CO)NC Amb27839120 [0,2,0,0,0,0|1,0,1]=4 5534 B9R0.50 CC\C(C=O)=C\SCCO Amb27268556 [0,2,0,0,0,0|1,0,0]=3 5535 B9R0.50 CC\C=C\CC(OC)OC Amb27191693 [0,2,0,0,0,0|2,0,0]=4 5536 B9R0.50 CO\C=C\CC(CO)OC Amb28205930 [0,2,0,0,0,0|1,0,0]=3 5537 B9R0.50 C\C=C\C=N\C(CC)CO Amb27753031 [0,2,0,0,0,0|1,0,1]=4 5538 B9R0.50 C\C=C\CCC(C=O)CO Amb24721770 [0,2,0,0,0,0|0,0,2]=4 5539 B9R0.50 C\N=C(/NC)NCCCO Amb27787754 [0,2,0,0,0,0|2,0,0]=4 5540 B9R0.38 CC(C)(C)C#CCCCO Amb25848427 [0,2,0,0,0,0|0,0,2]=4 5541 B9R0.38 CC(C)(C)C=C=CCCO Amb17593550 [0,2,0,0,0,0|0,0,2]=4 5542 B9R0.38 CC(C)(C)CCCCCO Amb27880910 [0,2,0,0,0,0|0,0,2]=4 5543 B9R0.38 CC(C)(C)CNCCCO Amb19373346 [0,2,0,0,0,0|1,0,1]=4 5544 B9R0.38 CC(C)(C)N\C=N\CCO Amb25339934 [0,2,0,0,0,0|2,0,0]=4 5545 B9R0.38 CC(C)(C)O\C=C\CCO Amb27775452 [0,2,0,0,0,0|1,0,1]=4 5546 B9R0.38 CC(C)(C)SSCCCO Amb27790389 [0,2,0,0,0,0|2,0,0]=4 5547 B9R0.38 CC(C)(C)\C=C\C#CCO Amb27652961 [0,2,0,0,0,0|0,0,2]=4 5548 B9R0.38 CC(C)(C)\C=C\C=C\CO Amb27164465 [0,2,0,0,0,0|0,0,2]=4 5549 B9R0.38 CC(C)(N)CNCCCO Amb28321691 [0,2,0,0,0,0|1,0,1]=4 5550 B9R0.38 CC(C)(O)C#CCCCO Amb27832253 [0,2,0,0,0,0|0,0,2]=4 5551 B9R0.38 CC(C)(O)CC\C=C\CO Amb27839190 [0,2,0,0,0,0|1,0,0]=3 5552 B9R0.38 CC(C)(O)CNCCCO Amb22723314 [0,2,0,0,0,0|1,0,1]=4 5553 B9R0.38 CC(C)(S)CCCCCO Amb27853563 [0,2,0,0,0,0|0,0,2]=4 5554 B9R0.38 CC(F)(F)CCCCCO Amb27827320 [0,2,0,0,0,0|0,0,2]=4 5555 B9R0.38 CCCC\C=C/C(F)(F)Br Amb26566878 [0,2,0,0,0,0|2,0,0]=4 5556 B9R0.38 CCCC\C=C\C(F)(F)Br Amb2685106 [0,2,0,0,0,0|2,0,0]=4 5557 B9R0.38 CCCC\C=C\C(F)(F)F Amb10838531 [0,2,0,0,0,0|2,0,0]=4 5558 B9R0.38 CCCC\N=C\C(C)(C)C Amb27430144 [0,2,0,0,0,0|2,0,0]=4 5559 B9R0.38 CCCNCCC(C)(C)O Amb27786325 [0,2,0,0,0,0|1,0,1]=4 5560 B9R0.38 CCCSCCC(C)(C)O Amb28254020 [0,2,0,0,0,0|1,0,1]=4 5561 B9R0.38 CCC\C=C\CC(C)(C)O Amb33327140 [0,2,0,0,0,0|0,0,2]=4 5562 B9R0.38 CC\C=C\CCC(C)(C)N Amb33269452 [0,2,0,0,0,0|1,0,0]=3 5563 B9R0.38 CC\C=C\CCC(C)(C)O Amb25685694 [0,2,0,0,0,0|0,0,0]=2 5564 B9R0.38 C[Si](C)(C)\C=C\CCCN Amb28436827 [0,2,0,0,0,0|1,1,0]=4 5565 B9R0.38 C[Si](C)(C)\C=C\CCCO Amb27427698 [0,2,0,0,0,0|0,1,0]=3 5566 B9R0.38 NC\C=C\CCC(F)(F)F Amb33401003 [0,2,0,0,0,0|2,0,0]=4 5567 B9R0.38 OC\C=C\CCC(F)(F)F Amb33338728 [0,2,0,0,0,0|2,0,0]=4 5568 B9R0.55 CC(=O)\C=C\CCC(C)C Amb25111718 [0,2,0,0,0,0|1,0,1]=4 5569 B9R0.55 CC(C)=COCCC(C)O Amb28281210 [0,2,0,0,0,0|1,0,1]=4 5570 B9R0.55 CC(C)CCCCC(O)O Amb27761556 [0,2,0,0,0,0|0,0,2]=4 5571 B9R0.55 CC(C)C\C=C\CC(C)O Amb27968433 [0,2,0,0,0,0|0,0,2]=4 5572 B9R0.55 CC(C)OCCC[C@@H](C)O Amb33274398 [0,2,0,0,0,0|1,0,1]=4 5573 B9R0.55 CC(C)OCCC[C@H](C)O Amb33274415 [0,2,0,0,0,0|1,0,1]=4 5574 B9R0.55 CC(C)\C=N\CCC(=O)O Amb27759498 [0,2,0,0,0,0|1,0,1]=4 5575 B9R0.55 CC(C)\C=N\NCC(C)O Amb28201669 [0,2,0,0,0,0|2,0,0]=4 5576 B9R0.55 CC(N)\C=C\CCN(C)C Amb33271636 [0,2,0,0,0,0|2,0,0]=4 5577 B9R0.55 CC(N)\C=C\COC(C)C Amb33274069 [0,2,0,0,0,0|2,0,0]=4 5578 B9R0.55 CC(O)CCCCC(C)O Amb27839243 [0,2,0,0,0,0|0,0,2]=4 5579 B9R0.55 CC(O)CCCOC(C)C Amb24450979 [0,2,0,0,0,0|1,0,1]=4 5580 B9R0.55 CC(O)CCCSC(C)C Amb27472017 [0,2,0,0,0,0|1,0,1]=4 5581 B9R0.55 CC(O)CCNCC(C)O Amb28382659 [0,2,0,0,0,0|1,0,1]=4 5582 B9R0.55 CC(O)CC\C=C\B(O)O Amb27234901 [0,2,0,0,0,0|2,0,0]=4 5583 B9R0.55 CC(O)\C=C\CCC(=O)O Amb24453133 [0,2,0,0,0,0|0,0,1]=3 5584 B7R1.1 BrC=C1CCCC1 Amb27592183 [1,0,0,1,0,0|2,0,0]=4 5585 B7R1.1 BrC=C1OCCO1 Amb25697137 [1,0,0,1,0,0|2,0,0]=4 5586 B7R1.1 BrCC1=CCCC1 Amb23439168 [1,0,0,1,0,0|1,0,0]=3 5587 B7R1.1 BrCC1C=CCC1 Amb28385457 [1,0,0,1,0,0|1,0,0]=3 5588 B7R1.1 BrCC1CC=CC1 Amb25216921 [1,0,0,1,0,0|1,0,0]=3 5589 B7R1.1 BrCC1CCCC1 Amb8631537 [1,0,0,1,0,0|1,0,1]=4 5590 B7R1.1 BrCC1CCCO1 Amb9703505 [1,0,0,1,0,0|1,0,1]=4 5591 B7R1.1 BrCC1CCNC1 Amb20618587 [1,0,0,1,0,0|2,0,0]=4 5592 B7R1.1 BrCC1CCNC1 Amb22229236 [1,0,0,1,0,0|2,0,0]=4 5593 B7R1.1 BrCC1CCNC1 Amb33483362 [1,0,0,1,0,0|2,0,0]=4 5594 B7R1.1 BrCC1CCOC1 Amb8835455 [1,0,0,1,0,0|2,0,0]=4 5595 B7R1.1 BrCC1CCSC1 Amb27630698 [1,0,0,1,0,0|2,0,0]=4 5596 B7R1.1 BrC[C@@H]1C=CCC1 Amb27233396 [1,0,0,1,0,0|1,0,0]=3 5597 B7R1.1 BrC[C@@H]1CCCO1 Amb24046261 [1,0,0,1,0,0|1,0,1]=4 5598 B7R1.1 BrC[C@H]1CCCO1 Amb26844489 [1,0,0,1,0,0|1,0,1]=4 5599 B7R1.1 Br\C=C1\COCO1 Amb27656799 [1,0,0,1,0,0|2,0,0]=4 5600 B7R1.1 C#CC1=CCCC1 Amb17689255 [1,0,0,1,0,0|0,0,2]=4 5601 B7R1.1 C=CC1=NCCO1 Amb28399250 [1,0,0,1,0,0|1,0,1]=4 5602 B7R1.1 C=CC1CCCO1 Amb28137321 [1,0,0,1,0,0|0,0,2]=4 5603 B7R1.1 CC=C1CCCC1 Amb4035880 [1,0,0,1,0,0|1,0,0]=3 5604 B7R1.1 CCC1=CCCC1 Amb4035875 [1,0,0,1,0,0|0,0,0]=2 5605 B7R1.1 CCC1=NCCC1 Amb22055207 [1,0,0,1,0,0|1,0,0]=3 5606 B7R1.1 CCC1=NCCN1 Amb17670469 [1,0,0,1,0,0|2,0,0]=4 5607 B7R1.1 CCC1=NCCO1 Amb8513557 [1,0,0,1,0,0|1,0,0]=3 5608 B7R1.1 CCC1=NCCS1 Amb28141823 [1,0,0,1,0,0|1,1,0]=4 5609 B7R1.1 CCC1C=CC=C1 Amb2227637 [1,0,0,1,0,0|0,0,2]=4 5610 B7R1.1 CCC1C=CCC1 Amb4020582 [1,0,0,1,0,0|0,0,0]=2 5611 B7R1.1 CCC1C=CCN1 Amb10608188 [1,0,0,1,0,0|1,0,0]=3 5612 B7R1.1 CCC1C=CCN1 Amb22587170 [1,0,0,1,0,0|1,0,0]=3 5613 B7R1.1 CCC1C=NNC1 Amb27844457 [1,0,0,1,0,0|2,0,0]=4 5614 B7R1.1 CCC1CC=CC1 Amb30033009 [1,0,0,1,0,0|1,0,0]=3 5615 B7R1.1 CCC1CCCC1 Amb22053788 [1,0,0,1,0,0|0,0,2]=4 5616 B7R1.1 CCC1CCCN1 Amb19515009 [1,0,0,1,0,0|1,0,1]=4 5617 B7R1.1 CCC1CCCN1 Amb3788096 [1,0,0,1,0,0|1,0,1]=4 5618 B7R1.1 CCC1CCCS1 Amb17939242 [1,0,0,1,0,0|0,1,1]=4 5619 B7R1.1 CCC1CCC[Cl+]1 Amb28076649 [1,0,0,1,0,0|1,0,1]=4 5620 B7R1.1 CCC1CCNC1 Amb18946548 [1,0,0,1,0,0|1,0,1]=4 5621 B7R1.1 CCC1CCNC1 Amb20630619 [1,0,0,1,0,0|1,0,1]=4 5622 B7R1.1 CCC1COCO1 Amb24567580 [1,0,0,1,0,0|1,0,1]=4 5623 B7R1.1 CCC1NCCO1 Amb17506183 [1,0,0,1,0,0|1,0,1]=4 5624 B7R1.1 CCC1OCCO1 Amb19892413 [1,0,0,1,0,0|1,0,1]=4 5625 B7R1.1 CCN1C=NCC1 Amb29888710 [1,0,0,1,0,0|2,0,0]=4 5626 B7R1.1 CCN1CCCC1 Amb17938866 [1,0,0,1,0,0|1,0,1]=4 5627 B7R1.1 CCN1CCCN1 Amb27776139 [1,0,0,1,0,0|2,0,0]=4 5628 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [1,0,0,1,0,0|1,0,1]=4 5629 B7R1.1 CC[C@@H]1CCNC1 Amb33801216 [1,0,0,1,0,0|1,0,1]=4 5630 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [1,0,0,1,0,0|1,0,1]=4 5631 B7R1.1 CC[C@H]1CCNC1 Amb27458282 [1,0,0,1,0,0|1,0,1]=4 5632 B7R1.1 CC[C@H]1CCNC1 Amb30594227 [1,0,0,1,0,0|1,0,1]=4 5633 B7R1.1 CCc1ccco1 Amb8393153 [1,0,0,1,0,0|0,0,2]=4 5634 B7R1.1 CCc1cnco1 Amb22490969 [1,0,0,1,0,0|1,0,1]=4 5635 B7R1.1 CNC1=NCCC1 Amb33249673 [1,0,0,1,0,0|2,0,0]=4 5636 B7R1.1 CNC1=NCCC1 Amb4136373 [1,0,0,1,0,0|2,0,0]=4 5637 B7R1.1 CNC1=NCCO1 Amb28187093 [1,0,0,1,0,0|2,0,0]=4 5638 B7R1.1 CNC1CCCO1 Amb27254048 [1,0,0,1,0,0|1,0,1]=4 5639 B7R1.1 COC1=CCCN1 Amb19883801 [1,0,0,1,0,0|2,0,0]=4 5640 B7R1.1 COC1=NCCC1 Amb1694184 [1,0,0,1,0,0|2,0,0]=4 5641 B7R1.1 COC1C=CCC1 Amb4016570 [1,0,0,1,0,0|1,0,0]=3 5642 B7R1.1 COC1CC=CC1 Amb27421499 [1,0,0,1,0,0|2,0,0]=4 5643 B7R1.1 COC1CCCO1 Amb22505257 [1,0,0,1,0,0|1,0,1]=4 5644 B7R1.1 CSC1C=NCC1 Amb27466721 [1,0,0,1,0,0|2,0,0]=4 5645 B7R1.1 C\C=C1/CCNC1 Amb31161498 [1,0,0,1,0,0|2,0,0]=4 5646 B7R1.1 C\C=C1/CCNC1 Amb33611505 [1,0,0,1,0,0|2,0,0]=4 5647 B7R1.1 ClC=C1CCCC1 Amb28118913 [1,0,0,1,0,0|2,0,0]=4 5648 B7R1.1 ClCC1=NCCO1 Amb24599141 [1,0,0,1,0,0|2,0,0]=4 5649 B7R1.1 ClCC1CC=CC1 Amb25059951 [1,0,0,1,0,0|1,0,0]=3 5650 B7R1.1 ClCC1CCCC1 Amb9004338 [1,0,0,1,0,0|1,0,1]=4 5651 B7R1.1 ClCC1CCCO1 Amb5716848 [1,0,0,1,0,0|1,0,1]=4 5652 B7R1.1 ClCC1CCOC1 Amb9754529 [1,0,0,1,0,0|2,0,0]=4 5653 B7R1.1 ClCC1CCSC1 Amb28423424 [1,0,0,1,0,0|2,0,0]=4 5654 B7R1.1 ClC[C@@H]1CCNC1 Amb26551071 [1,0,0,1,0,0|2,0,0]=4 5655 B7R1.1 ClC[C@H]1CCNC1 Amb25064501 [1,0,0,1,0,0|2,0,0]=4 5656 B7R1.1 FCC1CCNC1 Amb24423478 [1,0,0,1,0,0|2,0,0]=4 5657 B7R1.1 FCC1CCNC1 Amb32676678 [1,0,0,1,0,0|2,0,0]=4 5658 B7R1.1 FC[C@@H]1CCNC1 Amb27246397 [1,0,0,1,0,0|2,0,0]=4 5659 B7R1.1 FC[C@@H]1CCNC1 Amb33874890 [1,0,0,1,0,0|2,0,0]=4 5660 B7R1.1 FC[C@H]1CCNC1 Amb24184002 [1,0,0,1,0,0|2,0,0]=4 5661 B7R1.1 FC[C@H]1CCNC1 Amb28435036 [1,0,0,1,0,0|2,0,0]=4 5662 B7R1.1 ICC1=CCCC1 Amb27838217 [1,0,0,1,0,0|1,0,0]=3 5663 B7R1.1 ICC1CCCC1 Amb8517132 [1,0,0,1,0,0|1,0,1]=4 5664 B7R1.1 ICC1CCCO1 Amb24060886 [1,0,0,1,0,0|1,0,1]=4 5665 B7R1.1 ICC1CCOC1 Amb23439064 [1,0,0,1,0,0|2,0,0]=4 5666 B7R1.1 N#CC1=CCCC1 Amb2720765 [1,0,0,1,0,0|1,0,1]=4 5667 B7R1.1 N#CC1=CCCO1 Amb19149010 [1,0,0,1,0,0|1,0,1]=4 5668 B7R1.1 NCC1=CCCC1 Amb18120760 [1,0,0,1,0,0|1,0,0]=3 5669 B7R1.1 NCC1=CCNC1 Amb24714742 [1,0,0,1,0,0|2,0,0]=4 5670 B7R1.1 NCC1=CCSC1 Amb35743801 [1,0,0,1,0,0|2,0,0]=4 5671 B7R1.1 NCC1=NCCO1 Amb25938147 [1,0,0,1,0,0|2,0,0]=4 5672 B7R1.1 NCC1C=CCC1 Amb18119742 [1,0,0,1,0,0|1,0,0]=3 5673 B7R1.1 NCC1C=CCC1 Amb30584689 [1,0,0,1,0,0|1,0,0]=3 5674 B7R1.1 NCC1CC=CC1 Amb22301490 [1,0,0,1,0,0|1,0,0]=3 5675 B7R1.1 NCC1CCCC1 Amb1127194 [1,0,0,1,0,0|1,0,1]=4 5676 B7R1.1 NCC1CCCC1 Amb13951760 [1,0,0,1,0,0|1,0,1]=4 5677 B7R1.1 NCC1CCCC1 Amb6892868 [1,0,0,1,0,0|1,0,1]=4 5678 B7R1.1 NCC1CCCO1 Amb2568046 [1,0,0,1,0,0|1,0,1]=4 5679 B7R1.1 NCC1CCCO1 Amb3903680 [1,0,0,1,0,0|1,0,1]=4 5680 B7R1.1 NCC1CCOC1 Amb33536658 [1,0,0,1,0,0|2,0,0]=4 5681 B7R1.1 NCC1CCOC1 Amb7969615 [1,0,0,1,0,0|2,0,0]=4 5682 B7R1.1 NCC1CCSC1 Amb18198289 [1,0,0,1,0,0|2,0,0]=4 5683 B7R1.1 NC[C@@H]1CCCO1 Amb32661832 [1,0,0,1,0,0|1,0,1]=4 5684 B7R1.1 NC[C@@H]1CCCO1 Amb3940181 [1,0,0,1,0,0|1,0,1]=4 5685 B7R1.1 NC[C@@H]1CCOC1 Amb26870648 [1,0,0,1,0,0|2,0,0]=4 5686 B7R1.1 NC[C@@H]1CCOC1 Amb31204704 [1,0,0,1,0,0|2,0,0]=4 5687 B7R1.1 NC[C@H]1CCCO1 Amb33859030 [1,0,0,1,0,0|1,0,1]=4 5688 B7R1.1 NC[C@H]1CCCO1 Amb3940188 [1,0,0,1,0,0|1,0,1]=4 5689 B7R1.1 NC[C@H]1CCNC1 Amb25079280 [1,0,0,1,0,0|2,0,0]=4 5690 B7R1.1 NC[C@H]1CCOC1 Amb23439065 [1,0,0,1,0,0|2,0,0]=4 5691 B7R1.1 NC[C@H]1CCOC1 Amb23439174 [1,0,0,1,0,0|2,0,0]=4 5692 B7R1.1 NNC1=CCCO1 Amb27461530 [1,0,0,1,0,0|2,0,0]=4 5693 B7R1.1 O=CC1=CCCC1 Amb17138358 [1,0,0,1,0,0|1,0,1]=4 5694 B7R1.1 O=CC1=CCCO1 Amb18120782 [1,0,0,1,0,0|1,0,1]=4 5695 B7R1.1 O=CC1C=CCC1 Amb27229924 [1,0,0,1,0,0|0,0,2]=4 5696 B7R1.1 O=CC1CC=CC1 Amb18638871 [1,0,0,1,0,0|0,0,2]=4 5697 B7R1.1 O=CC1CCCO1 Amb3939388 [1,0,0,1,0,0|1,0,1]=4 5698 B7R1.1 OCC1=CC=CC1 Amb27457780 [1,0,0,1,0,0|0,0,2]=4 5699 B7R1.1 OCC1=CCCC1 Amb24479891 [1,0,0,1,0,0|1,0,0]=3 5700 B7R1.1 OCC1=CCSC1 Amb35606324 [1,0,0,1,0,0|2,0,0]=4 5701 B7R1.1 OCC1=COCC1 Amb27827039 [1,0,0,1,0,0|1,0,1]=4 5702 B7R1.1 OCC1=CSCC1 Amb28345026 [1,0,0,1,0,0|1,0,1]=4 5703 B7R1.1 OCC1C=CCC1 Amb23455253 [1,0,0,1,0,0|0,0,0]=2 5704 B7R1.1 OCC1C=CCN1 Amb15701263 [1,0,0,1,0,0|1,0,0]=3 5705 B7R1.1 OCC1C=CCN1 Amb32412123 [1,0,0,1,0,0|1,0,0]=3 5706 B7R1.1 OCC1CC=CC1 Amb2695403 [1,0,0,1,0,0|0,0,0]=2 5707 B7R1.1 OCC1CCCC1 Amb2721271 [1,0,0,1,0,0|0,0,1]=3 5708 B7R1.1 OCC1CCCN1 Amb2237182 [1,0,0,1,0,0|1,0,1]=4 5709 B7R1.1 OCC1CCCO1 Amb3939084 [1,0,0,1,0,0|1,0,1]=4 5710 B7R1.1 OCC1CCCS1 Amb33545363 [1,0,0,1,0,0|1,0,1]=4 5711 B7R1.1 OCC1CCNC1 Amb20240954 [1,0,0,1,0,0|1,0,0]=3 5712 B7R1.1 OCC1CCNC1 Amb21858960 [1,0,0,1,0,0|1,0,0]=3 5713 B7R1.1 OCC1CCNC1 Amb9782649 [1,0,0,1,0,0|1,0,0]=3 5714 B7R1.1 OCC1CCOC1 Amb9748290 [1,0,0,1,0,0|1,0,0]=3 5715 B7R1.1 OCC1CCON1 Amb25888553 [1,0,0,1,0,0|2,0,0]=4 5716 B7R1.1 OCC1CCON1 Amb33483283 [1,0,0,1,0,0|2,0,0]=4 5717 B7R1.1 OCC1CCSC1 Amb18203349 [1,0,0,1,0,0|1,0,0]=3 5718 B7R1.1 OCC1CNOC1 Amb27867600 [1,0,0,1,0,0|2,0,0]=4 5719 B7R1.1 OCC1COCO1 Amb8393650 [1,0,0,1,0,0|2,0,0]=4 5720 B7R1.1 OCC1CSC=N1 Amb27206093 [1,0,0,1,0,0|2,0,0]=4 5721 B7R1.1 OC[C@@H]1C=CCS1 Amb27594771 [1,0,0,1,0,0|1,0,0]=3 5722 B7R1.1 OC[C@@H]1CCCN1 Amb22748614 [1,0,0,1,0,0|1,0,1]=4 5723 B7R1.1 OC[C@@H]1CCCN1 Amb3938965 [1,0,0,1,0,0|1,0,1]=4 5724 B7R1.1 OC[C@@H]1CCCO1 Amb10601543 [1,0,0,1,0,0|1,0,1]=4 5725 B7R1.1 OC[C@@H]1CCNC1 Amb34916128 [1,0,0,1,0,0|1,0,0]=3 5726 B7R1.1 OC[C@@H]1CCNC1 Amb6893877 [1,0,0,1,0,0|1,0,0]=3 5727 B7R1.1 OC[C@@H]1CCNC1 Amb8630261 [1,0,0,1,0,0|1,0,0]=3 5728 B7R1.1 OC[C@@H]1CCOC1 Amb28189753 [1,0,0,1,0,0|1,0,0]=3 5729 B7R1.1 OC[C@H]1CCCN1 Amb2235512 [1,0,0,1,0,0|1,0,1]=4 5730 B7R1.1 OC[C@H]1CCCN1 Amb30874072 [1,0,0,1,0,0|1,0,1]=4 5731 B7R1.1 OC[C@H]1CCCO1 Amb16185506 [1,0,0,1,0,0|1,0,1]=4 5732 B7R1.1 OC[C@H]1CCNC1 Amb10067155 [1,0,0,1,0,0|1,0,0]=3 5733 B7R1.1 OC[C@H]1CCNC1 Amb6893876 [1,0,0,1,0,0|1,0,0]=3 5734 B7R1.1 OC[C@H]1CCOC1 Amb22746669 [1,0,0,1,0,0|1,0,0]=3 5735 B7R1.1 ONC1CCCC1 Amb27467457 [1,0,0,1,0,0|1,0,1]=4 5736 B7R1.1 ONC1CCCC1 Amb30625652 [1,0,0,1,0,0|1,0,1]=4 5737 B7R1.1 ONC1CCOC1 Amb25888397 [1,0,0,1,0,0|2,0,0]=4 5738 B7R1.1 ONC1CCOC1 Amb32653528 [1,0,0,1,0,0|2,0,0]=4 5739 B7R1.1 O\N=C1/C=CCC1 Amb27838262 [1,0,0,1,0,0|1,0,1]=4 5740 B7R1.1 SCC1=CCSC1 Amb32788040 [1,0,0,1,0,0|2,0,0]=4 5741 B7R1.1 SCC1CC=CC1 Amb30032288 [1,0,0,1,0,0|0,1,0]=3 5742 B7R1.1 SCC1CCCC1 Amb19514712 [1,0,0,1,0,0|0,1,1]=4 5743 B7R1.1 SCC1CCCO1 Amb33531279 [1,0,0,1,0,0|1,0,1]=4 5744 B7R1.1 SCC1CCOC1 Amb26919281 [1,0,0,1,0,0|1,1,0]=4 5745 B7R1.1 SCC1CCSC1 Amb32788496 [1,0,0,1,0,0|1,1,0]=4 5746 B7R1.3 BrC1=CCCCC1 Amb21856761 [1,0,0,1,0,0|2,0,0]=4 5747 B7R1.3 BrC1=CCCCO1 Amb24322651 [1,0,0,1,0,0|1,0,0]=3 5748 B7R1.3 BrC1=COCCO1 Amb24322806 [1,0,0,1,0,0|2,0,0]=4 5749 B7R1.3 BrC1C=CCCC1 Amb2720845 [1,0,0,1,0,0|1,0,0]=3 5750 B7R1.3 BrC1C=NCCC1 Amb24322652 [1,0,0,1,0,0|2,0,0]=4 5751 B7R1.3 BrC1CC=CCC1 Amb22229671 [1,0,0,1,0,0|1,0,0]=3 5752 B7R1.3 BrC1CCCCC1 Amb3940351 [1,0,0,1,0,0|1,0,1]=4 5753 B7R1.3 BrC1CCCCO1 Amb24322575 [1,0,0,1,0,0|1,0,1]=4 5754 B7R1.3 BrC1CCNCC1 Amb22229718 [1,0,0,1,0,0|2,0,0]=4 5755 B7R1.3 BrC1CCNCC1 Amb2778981 [1,0,0,1,0,0|2,0,0]=4 5756 B7R1.3 BrC1CCNCC1 Amb3941704 [1,0,0,1,0,0|2,0,0]=4 5757 B7R1.3 BrC1CCOCC1 Amb9472764 [1,0,0,1,0,0|2,0,0]=4 5758 B7R1.3 BrC1CCSCC1 Amb18181050 [1,0,0,1,0,0|2,0,0]=4 5759 B7R1.3 Br[C@H]1C=CCCC1 Amb27442441 [1,0,0,1,0,0|1,0,0]=3 5760 B7R1.3 C=C1CCCCO1 Amb28345156 [1,0,0,1,0,0|0,0,2]=4 5761 B7R1.3 C=C1OCCCO1 Amb25734089 [1,0,0,1,0,0|1,0,1]=4 5762 B7R1.3 CC1=CCCCC1 Amb8513524 [1,0,0,1,0,0|1,0,0]=3 5763 B7R1.3 CC1=CCCCO1 Amb24480530 [1,0,0,1,0,0|0,0,0]=2 5764 B7R1.3 CC1=CCCNC1 Amb23439963 [1,0,0,1,0,0|2,0,0]=4 5765 B7R1.3 CC1=CCCNC1 Amb25063349 [1,0,0,1,0,0|2,0,0]=4 5766 B7R1.3 CC1=CCNCC1 Amb18639053 [1,0,0,1,0,0|2,0,0]=4 5767 B7R1.3 CC1=CCNCC1 Amb21961140 [1,0,0,1,0,0|2,0,0]=4 5768 B7R1.3 CC1=CCOCC1 Amb24070517 [1,0,0,1,0,0|2,0,0]=4 5769 B7R1.3 CC1=NCCCC1 Amb27459940 [1,0,0,1,0,0|1,0,1]=4 5770 B7R1.3 CC1=NCCCN1 Amb3650246 [1,0,0,1,0,0|2,0,0]=4 5771 B7R1.3 CC1=NCCCS1 Amb25808748 [1,0,0,1,0,0|1,1,0]=4 5772 B7R1.3 CC1C=CCCC1 Amb8515346 [1,0,0,1,0,0|0,0,0]=2 5773 B7R1.3 CC1C=CCCN1 Amb27461298 [1,0,0,1,0,0|1,0,0]=3 5774 B7R1.3 CC1C=CCCO1 Amb33715160 [1,0,0,1,0,0|0,0,0]=2 5775 B7R1.3 CC1C=CCNC1 Amb27170704 [1,0,0,1,0,0|1,0,0]=3 5776 B7R1.3 CC1C=COCC1 Amb27985265 [1,0,0,1,0,0|1,0,0]=3 5777 B7R1.3 CC1CC=CCN1 Amb27460532 [1,0,0,1,0,0|1,0,0]=3 5778 B7R1.3 CC1CC=NCC1 Amb27453017 [1,0,0,1,0,0|1,0,0]=3 5779 B7R1.3 CC1CCCCN1 Amb2792828 [1,0,0,1,0,0|1,0,1]=4 5780 B7R1.3 CC1CCCCO1 Amb4035049 [1,0,0,1,0,0|0,0,1]=3 5781 B7R1.3 CC1CCCCS1 Amb17666899 [1,0,0,1,0,0|0,1,1]=4 5782 B7R1.3 CC1CCCNC1 Amb22491688 [1,0,0,1,0,0|1,0,1]=4 5783 B7R1.3 CC1CCCNC1 Amb9703089 [1,0,0,1,0,0|1,0,1]=4 5784 B7R1.3 CC1CCCOC1 Amb22347806 [1,0,0,1,0,0|1,0,1]=4 5785 B7R1.3 CC1CCNCC1 Amb2689655 [1,0,0,1,0,0|1,0,1]=4 5786 B7R1.3 CC1CCOCC1 Amb22043825 [1,0,0,1,0,0|1,0,1]=4 5787 B7R1.3 CC1CCOCO1 Amb17776591 [1,0,0,1,0,0|1,0,1]=4 5788 B7R1.3 CC1CCSCC1 Amb27436849 [1,0,0,1,0,0|1,0,1]=4 5789 B7R1.3 CC1CN=CNC1 Amb27626010 [1,0,0,1,0,0|2,0,0]=4 5790 B7R1.3 CC1CNCCO1 Amb20621613 [1,0,0,1,0,0|1,0,1]=4 5791 B7R1.3 CC1CNCCO1 Amb32666325 [1,0,0,1,0,0|1,0,1]=4 5792 B7R1.3 CC1CNCCO1 Amb9703073 [1,0,0,1,0,0|1,0,1]=4 5793 B7R1.3 CC1NCCCN1 Amb24381838 [1,0,0,1,0,0|2,0,0]=4 5794 B7R1.3 CC1NCCCO1 Amb17506191 [1,0,0,1,0,0|1,0,0]=3 5795 B7R1.3 CC1OCCCO1 Amb26557606 [1,0,0,1,0,0|1,0,0]=3 5796 B7R1.3 CC1SCCCS1 Amb10071965 [1,0,0,1,0,0|1,1,0]=4 5797 B7R1.3 CN1C=NCCC1 Amb30010877 [1,0,0,1,0,0|2,0,0]=4 5798 B7R1.3 CN1CC=CCC1 Amb22734271 [1,0,0,1,0,0|1,0,0]=3 5799 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [1,0,0,1,0,0|1,0,1]=4 5800 B7R1.3 C[C@@H]1CCCCN1 Amb3939006 [1,0,0,1,0,0|1,0,1]=4 5801 B7R1.3 C[C@@H]1CCCNC1 Amb24461444 [1,0,0,1,0,0|1,0,1]=4 5802 B7R1.3 C[C@@H]1CCCNC1 Amb33801279 [1,0,0,1,0,0|1,0,1]=4 5803 B7R1.3 C[C@@H]1CNCCO1 Amb10603219 [1,0,0,1,0,0|1,0,1]=4 5804 B7R1.3 C[C@@H]1CNCCO1 Amb15690754 [1,0,0,1,0,0|1,0,1]=4 5805 B7R1.3 C[C@H]1CCCCN1 Amb8387006 [1,0,0,1,0,0|1,0,1]=4 5806 B7R1.3 C[C@H]1CCCNC1 Amb22745835 [1,0,0,1,0,0|1,0,1]=4 5807 B7R1.3 C[C@H]1CCCNC1 Amb8387001 [1,0,0,1,0,0|1,0,1]=4 5808 B7R1.3 C[C@H]1CNCCO1 Amb10603261 [1,0,0,1,0,0|1,0,1]=4 5809 B7R1.3 C[C@H]1CNCCO1 Amb20241673 [1,0,0,1,0,0|1,0,1]=4 5810 B7R1.3 C[C@H]1CNCCO1 Amb32661569 [1,0,0,1,0,0|1,0,1]=4 5811 B7R1.3 C[C@H]1CNCCO1 Amb34916143 [1,0,0,1,0,0|1,0,1]=4 5812 B7R1.3 C[SiH]1CCCCO1 Amb26582586 [1,0,0,1,0,0|0,1,1]=4 5813 B7R1.3 ClC1=CCCCC1 Amb9785147 [1,0,0,1,0,0|2,0,0]=4 5814 B7R1.3 ClC1=CCCCO1 Amb27449514 [1,0,0,1,0,0|1,0,0]=3 5815 B7R1.3 ClC1=COCCO1 Amb27826498 [1,0,0,1,0,0|2,0,0]=4 5816 B7R1.3 ClC1C=CCCC1 Amb22229267 [1,0,0,1,0,0|1,0,0]=3 5817 B7R1.3 ClC1C=CCNC1 Amb32679264 [1,0,0,1,0,0|2,0,0]=4 5818 B7R1.3 ClC1C=CCNC1 Amb32679265 [1,0,0,1,0,0|2,0,0]=4 5819 B7R1.3 ClC1C=CCOC1 Amb27955246 [1,0,0,1,0,0|2,0,0]=4 5820 B7R1.3 ClC1CC=CCC1 Amb22229749 [1,0,0,1,0,0|1,0,0]=3 5821 B7R1.3 ClC1CC=COC1 Amb27400096 [1,0,0,1,0,0|2,0,0]=4 5822 B7R1.3 ClC1CCCCC1 Amb3940352 [1,0,0,1,0,0|1,0,1]=4 5823 B7R1.3 ClC1CCCCO1 Amb17673285 [1,0,0,1,0,0|1,0,1]=4 5824 B7R1.3 ClC1CCNCC1 Amb8009567 [1,0,0,1,0,0|2,0,0]=4 5825 B7R1.3 ClC1CCNCC1 Amb8629021 [1,0,0,1,0,0|2,0,0]=4 5826 B7R1.3 ClC1CCOCC1 Amb6760778 [1,0,0,1,0,0|2,0,0]=4 5827 B7R1.3 FC1C=CCCC1 Amb27164038 [1,0,0,1,0,0|1,0,0]=3 5828 B7R1.3 FC1CCCCC1 Amb2688084 [1,0,0,1,0,0|1,0,1]=4 5829 B7R1.3 FC1CCCCO1 Amb24322826 [1,0,0,1,0,0|1,0,1]=4 5830 B7R1.3 FC1CCNCC1 Amb13885425 [1,0,0,1,0,0|2,0,0]=4 5831 B7R1.3 FC1CCNCC1 Amb2688405 [1,0,0,1,0,0|2,0,0]=4 5832 B7R1.3 FC1CCOCC1 Amb22296909 [1,0,0,1,0,0|2,0,0]=4 5833 B7R1.3 IC1=CCCCC1 Amb27750996 [1,0,0,1,0,0|2,0,0]=4 5834 B7R1.3 IC1=COCCO1 Amb24322818 [1,0,0,1,0,0|2,0,0]=4 5835 B7R1.3 IC1CC=CCC1 Amb27446684 [1,0,0,1,0,0|1,0,0]=3 5836 B7R1.3 IC1CCCCC1 Amb6608670 [1,0,0,1,0,0|1,0,1]=4 5837 B7R1.3 IC1CCOCC1 Amb2723453 [1,0,0,1,0,0|2,0,0]=4 5838 B7R1.3 IC1CCSCC1 Amb2724105 [1,0,0,1,0,0|2,0,0]=4 5839 B7R1.3 N=C1NCCCO1 Amb23597225 [1,0,0,1,0,0|2,0,0]=4 5840 B7R1.3 N=C1NCCCO1 Amb28990985 [1,0,0,1,0,0|2,0,0]=4 5841 B7R1.3 NC1=CCCCC1 Amb28456773 [1,0,0,1,0,0|2,0,0]=4 5842 B7R1.3 NC1C=CCCC1 Amb20668839 [1,0,0,1,0,0|1,0,0]=3 5843 B7R1.3 NC1C=CCCC1 Amb23385297 [1,0,0,1,0,0|1,0,0]=3 5844 B7R1.3 NC1C=CCNO1 Amb25268953 [1,0,0,1,0,0|2,0,0]=4 5845 B7R1.3 NC1CC=CCC1 Amb18639038 [1,0,0,1,0,0|1,0,0]=3 5846 B7R1.3 NC1CC=CCC1 Amb19515491 [1,0,0,1,0,0|1,0,0]=3 5847 B7R1.3 NC1CCCCC1 Amb2792843 [1,0,0,1,0,0|1,0,1]=4 5848 B7R1.3 NC1CCCCC1 Amb4035820 [1,0,0,1,0,0|1,0,1]=4 5849 B7R1.3 NC1CCCCC1 Amb6366094 [1,0,0,1,0,0|1,0,1]=4 5850 B7R1.3 NC1CCNCC1 Amb17943826 [1,0,0,1,0,0|2,0,0]=4 5851 B7R1.3 NC1CCNCC1 Amb6270512 [1,0,0,1,0,0|2,0,0]=4 5852 B7R1.3 NC1CCOCC1 Amb1102242 [1,0,0,1,0,0|2,0,0]=4 5853 B7R1.3 NC1CCOCC1 Amb8503255 [1,0,0,1,0,0|2,0,0]=4 5854 B7R1.3 NC1CCSCC1 Amb13952147 [1,0,0,1,0,0|2,0,0]=4 5855 B7R1.3 NC1CCSCC1 Amb2724106 [1,0,0,1,0,0|2,0,0]=4 5856 B7R1.3 N[C@@H]1C=CCCC1 Amb24640515 [1,0,0,1,0,0|1,0,0]=3 5857 B7R1.3 N[C@@H]1CC=CCC1 Amb27975676 [1,0,0,1,0,0|1,0,0]=3 5858 B7R1.3 N[C@H]1CC=CCC1 Amb26609127 [1,0,0,1,0,0|1,0,0]=3 5859 B7R1.3 N[C@H]1CCCCO1 Amb27655590 [1,0,0,1,0,0|1,0,1]=4 5860 B7R1.3 O=C1C=CCCC1 Amb17843126 [1,0,0,1,0,0|1,0,1]=4 5861 B7R1.3 O=C1C=CCCO1 Amb15693457 [1,0,0,1,0,0|1,0,1]=4 5862 B7R1.3 O=C1CCCCO1 Amb8513592 [1,0,0,1,0,0|1,0,1]=4 5863 B7R1.3 O=C1NCCCO1 Amb10608499 [1,0,0,1,0,0|2,0,0]=4 5864 B7R1.3 O=C1OCCCO1 Amb4034896 [1,0,0,1,0,0|2,0,0]=4 5865 B7R1.3 OC1C=CCCC1 Amb4605824 [1,0,0,1,0,0|1,0,0]=3 5866 B7R1.3 OC1C=CCNC1 Amb24426687 [1,0,0,1,0,0|2,0,0]=4 5867 B7R1.3 OC1C=CCNC1 Amb31291592 [1,0,0,1,0,0|2,0,0]=4 5868 B7R1.3 OC1C=CCOC1 Amb25662556 [1,0,0,1,0,0|2,0,0]=4 5869 B7R1.3 OC1C=CCSC1 Amb25832664 [1,0,0,1,0,0|2,0,0]=4 5870 B7R1.3 OC1CCCCC1 Amb4605832 [1,0,0,1,0,0|0,0,1]=3 5871 B7R1.3 OC1CCCCN1 Amb8393085 [1,0,0,1,0,0|1,0,1]=4 5872 B7R1.3 OC1CCCCO1 Amb8517292 [1,0,0,1,0,0|1,0,1]=4 5873 B7R1.3 OC1CCCNC1 Amb3939221 [1,0,0,1,0,0|1,0,1]=4 5874 B7R1.3 OC1CCCNC1 Amb4036802 [1,0,0,1,0,0|1,0,1]=4 5875 B7R1.3 OC1CCCOC1 Amb16192108 [1,0,0,1,0,0|1,0,1]=4 5876 B7R1.3 OC1CCCSC1 Amb4034626 [1,0,0,1,0,0|1,0,1]=4 5877 B7R1.3 OC1CCNCC1 Amb1152974 [1,0,0,1,0,0|1,0,0]=3 5878 B7R1.3 OC1CCNCC1 Amb2720309 [1,0,0,1,0,0|1,0,0]=3 5879 B7R1.3 OC1CCNCC1 Amb32679563 [1,0,0,1,0,0|1,0,0]=3 5880 B7R1.3 OC1CCNOC1 Amb32698233 [1,0,0,1,0,0|2,0,0]=4 5881 B7R1.3 OC1CCOCC1 Amb2723454 [1,0,0,1,0,0|1,0,0]=3 5882 B7R1.3 OC1CCONC1 Amb33017243 [1,0,0,1,0,0|2,0,0]=4 5883 B7R1.3 OC1CCSCC1 Amb2610612 [1,0,0,1,0,0|1,0,0]=3 5884 B7R1.3 ON1CCCCC1 Amb6468702 [1,0,0,1,0,0|1,0,1]=4 5885 B7R1.3 ON1CCOCC1 Amb25243510 [1,0,0,1,0,0|2,0,0]=4 5886 B7R1.3 O[C@@H]1CCCNC1 Amb20241315 [1,0,0,1,0,0|1,0,1]=4 5887 B7R1.3 O[C@@H]1CCCNC1 Amb8628462 [1,0,0,1,0,0|1,0,1]=4 5888 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [1,0,0,1,0,0|1,0,1]=4 5889 B7R1.3 O[C@H]1C=CCCC1 Amb10601567 [1,0,0,1,0,0|1,0,0]=3 5890 B7R1.3 O[C@H]1C=CCOC1 Amb8393976 [1,0,0,1,0,0|2,0,0]=4 5891 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [1,0,0,1,0,0|1,0,1]=4 5892 B7R1.3 O[C@H]1CCCNC1 Amb2688784 [1,0,0,1,0,0|1,0,1]=4 5893 B7R1.3 O[C@H]1CCCOC1 Amb20241306 [1,0,0,1,0,0|1,0,1]=4 5894 B7R1.3 S=C1NCCCO1 Amb22524560 [1,0,0,1,0,0|2,0,0]=4 5895 B7R1.3 SC1CC=CCC1 Amb33318612 [1,0,0,1,0,0|0,1,0]=3 5896 B7R1.3 SC1CCCCC1 Amb6608750 [1,0,0,1,0,0|0,1,1]=4 5897 B7R1.3 SC1CCNCC1 Amb17502200 [1,0,0,1,0,0|1,1,0]=4 5898 B7R1.3 SC1CCNCC1 Amb22371055 [1,0,0,1,0,0|1,1,0]=4 5899 B7R1.3 SC1CCOCC1 Amb9472951 [1,0,0,1,0,0|1,1,0]=4 5900 B7R1.3 SC1CCSCC1 Amb26045860 [1,0,0,1,0,0|1,1,0]=4 5901 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [1,0,0,1,0,0|1,0,1]=4 5902 B7R1.3 [NH3+]C1CCOCC1 Amb22008598 [1,0,0,1,0,0|2,0,0]=4 5903 B7R1.4 CC1=CCCC1=O Amb8514958 [1,0,0,1,0,0|0,0,2]=4 5904 B7R1.4 CC1=CCCC1C Amb24479857 [1,0,0,1,0,0|1,0,0]=3 5905 B7R1.4 CC1=CCCC1O Amb25220686 [1,0,0,1,0,0|0,0,0]=2 5906 B7R1.4 CC1=CCCN1C Amb17938859 [1,0,0,1,0,0|2,0,0]=4 5907 B7R1.4 CC1=CCNC1C Amb27975662 [1,0,0,1,0,0|2,0,0]=4 5908 B7R1.4 CC1C=CCC1C Amb27454828 [1,0,0,1,0,0|0,0,0]=2 5909 B7R1.4 CC1C=CCC1O Amb28324626 [1,0,0,1,0,0|0,0,0]=2 5910 B7R1.4 CC1CCCC1Br Amb18180261 [1,0,0,1,0,0|1,0,1]=4 5911 B7R1.4 CC1CCCC1C Amb4019559 [1,0,0,1,0,0|0,0,2]=4 5912 B7R1.4 CC1CCCC1Cl Amb27853965 [1,0,0,1,0,0|1,0,1]=4 5913 B7R1.4 CC1CCCC1N Amb33548666 [1,0,0,1,0,0|1,0,1]=4 5914 B7R1.4 CC1CCCC1N Amb9776219 [1,0,0,1,0,0|1,0,1]=4 5915 B7R1.4 CC1CCCC1O Amb22052652 [1,0,0,1,0,0|0,0,1]=3 5916 B7R1.4 CC1CCCC1S Amb26021537 [1,0,0,1,0,0|0,1,1]=4 5917 B7R1.4 CC1CCNC1C Amb18277375 [1,0,0,1,0,0|1,0,1]=4 5918 B7R1.4 CC1CCNC1C Amb20623813 [1,0,0,1,0,0|1,0,1]=4 5919 B7R1.4 CC1CN=CN1C Amb29888704 [1,0,0,1,0,0|2,0,0]=4 5920 B7R1.4 CC1CNCC1C Amb18121224 [1,0,0,1,0,0|1,0,1]=4 5921 B7R1.4 CC1CNCC1C Amb19149226 [1,0,0,1,0,0|1,0,1]=4 5922 B7R1.4 CC1CNCC1O Amb22886911 [1,0,0,1,0,0|1,0,1]=4 5923 B7R1.4 CC1CNCC1O Amb25792196 [1,0,0,1,0,0|1,0,1]=4 5924 B7R1.4 CC1COCC1O Amb26864629 [1,0,0,1,0,0|1,0,1]=4 5925 B7R1.4 CC1NCCC1O Amb27838277 [1,0,0,1,0,0|1,0,0]=3 5926 B7R1.4 CC1NCCC1O Amb32882554 [1,0,0,1,0,0|1,0,0]=3 5927 B7R1.4 CC1OCCC1Br Amb25073861 [1,0,0,1,0,0|2,0,0]=4 5928 B7R1.4 CC1OCCC1Cl Amb24470094 [1,0,0,1,0,0|2,0,0]=4 5929 B7R1.4 CC1OCCC1N Amb22058722 [1,0,0,1,0,0|2,0,0]=4 5930 B7R1.4 CC1OCCC1N Amb32660981 [1,0,0,1,0,0|2,0,0]=4 5931 B7R1.4 CC1OCCC1O Amb25888399 [1,0,0,1,0,0|1,0,0]=3 5932 B7R1.4 CC1OCCC1S Amb8515792 [1,0,0,1,0,0|1,1,0]=4 5933 B7R1.4 CC1SCCC1Cl Amb28144167 [1,0,0,1,0,0|2,0,0]=4 5934 B7R1.4 CC1SCCC1N Amb20623835 [1,0,0,1,0,0|2,0,0]=4 5935 B7R1.4 CC1SCCC1N Amb28827634 [1,0,0,1,0,0|2,0,0]=4 5936 B7R1.4 CC1SCCC1O Amb20623836 [1,0,0,1,0,0|1,0,0]=3 5937 B7R1.4 CC1SCCC1S Amb26335064 [1,0,0,1,0,0|1,1,0]=4 5938 B7R1.4 CC1SCC[C@@H]1O Amb20623838 [1,0,0,1,0,0|1,0,0]=3 5939 B7R1.4 CC1SCC[C@H]1O Amb20623837 [1,0,0,1,0,0|1,0,0]=3 5940 B7R1.4 CN1=NCCC1O Amb21952741 [1,0,0,1,0,0|2,0,0]=4 5941 B7R1.4 C[C@@H]1C=CC[C@H]1C Amb25957944 [1,0,0,1,0,0|0,0,0]=2 5942 B7R1.4 C[C@@H]1C=CC[C@H]1O Amb27486253 [1,0,0,1,0,0|0,0,0]=2 5943 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb22886234 [1,0,0,1,0,0|1,0,1]=4 5944 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb24540316 [1,0,0,1,0,0|1,0,1]=4 5945 B7R1.4 C[C@@H]1CCC[C@@H]1O Amb22886799 [1,0,0,1,0,0|0,0,1]=3 5946 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [1,0,0,1,0,0|0,0,2]=4 5947 B7R1.4 C[C@@H]1CCC[C@H]1N Amb27858497 [1,0,0,1,0,0|1,0,1]=4 5948 B7R1.4 C[C@@H]1CCC[C@H]1O Amb8513780 [1,0,0,1,0,0|0,0,1]=3 5949 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [1,0,0,1,0,0|1,0,1]=4 5950 B7R1.4 C[C@@H]1CCOC1O Amb28074771 [1,0,0,1,0,0|1,0,1]=4 5951 B7R1.4 C[C@@H]1CCO[C@H]1O Amb27857930 [1,0,0,1,0,0|1,0,1]=4 5952 B7R1.4 C[C@@H]1CNC[C@@H]1C Amb22757862 [1,0,0,1,0,0|1,0,1]=4 5953 B7R1.4 C[C@@H]1CNC[C@@H]1O Amb22886215 [1,0,0,1,0,0|1,0,1]=4 5954 B7R1.4 C[C@@H]1CNC[C@H]1C Amb22757861 [1,0,0,1,0,0|1,0,1]=4 5955 B7R1.4 C[C@@H]1CNC[C@H]1O Amb22886846 [1,0,0,1,0,0|1,0,1]=4 5956 B7R1.4 C[C@@H]1CNC[C@H]1O Amb25110287 [1,0,0,1,0,0|1,0,1]=4 5957 B7R1.4 C[C@@H]1COC[C@@H]1O Amb22886816 [1,0,0,1,0,0|1,0,1]=4 5958 B7R1.4 C[C@@H]1COC[C@H]1O Amb22886616 [1,0,0,1,0,0|1,0,1]=4 5959 B7R1.4 C[C@@H]1CSC[C@@H]1O Amb27422447 [1,0,0,1,0,0|1,0,1]=4 5960 B7R1.4 C[C@@H]1N=CN[C@H]1C Amb28129367 [1,0,0,1,0,0|2,0,0]=4 5961 B7R1.4 C[C@@H]1NCCC1N Amb18202992 [1,0,0,1,0,0|2,0,0]=4 5962 B7R1.4 C[C@@H]1NCCC1O Amb18202778 [1,0,0,1,0,0|1,0,0]=3 5963 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb24425021 [1,0,0,1,0,0|1,0,0]=3 5964 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb32412686 [1,0,0,1,0,0|1,0,0]=3 5965 B7R1.4 C[C@@H]1NCC[C@H]1C Amb32412685 [1,0,0,1,0,0|1,0,1]=4 5966 B7R1.4 C[C@@H]1NCC[C@H]1N Amb28250867 [1,0,0,1,0,0|2,0,0]=4 5967 B7R1.4 C[C@@H]1NCC[C@H]1O Amb26412930 [1,0,0,1,0,0|1,0,0]=3 5968 B7R1.4 C[C@@H]1NCC[C@H]1O Amb32412687 [1,0,0,1,0,0|1,0,0]=3 5969 B7R1.4 C[C@@H]1OCC[C@@H]1I Amb27962293 [1,0,0,1,0,0|2,0,0]=4 5970 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [1,0,0,1,0,0|2,0,0]=4 5971 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [1,0,0,1,0,0|2,0,0]=4 5972 B7R1.4 C[C@@H]1OCC[C@H]1I Amb27664288 [1,0,0,1,0,0|2,0,0]=4 5973 B7R1.4 C[C@@H]1OCC[C@H]1N Amb27435305 [1,0,0,1,0,0|2,0,0]=4 5974 B7R1.4 C[C@@H]1OCC[C@H]1N Amb34915721 [1,0,0,1,0,0|2,0,0]=4 5975 B7R1.4 C[C@@H]1SCC[C@@H]1O Amb28144028 [1,0,0,1,0,0|1,0,0]=3 5976 B7R1.4 C[C@@H]1SCC[C@H]1O Amb27853254 [1,0,0,1,0,0|1,0,0]=3 5977 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [1,0,0,1,0,0|0,0,2]=4 5978 B7R1.4 C[C@H]1CCC[C@@H]1O Amb10844719 [1,0,0,1,0,0|0,0,1]=3 5979 B7R1.4 C[C@H]1CCC[C@H]1C Amb22230410 [1,0,0,1,0,0|0,0,2]=4 5980 B7R1.4 C[C@H]1CCC[C@H]1I Amb28135188 [1,0,0,1,0,0|1,0,1]=4 5981 B7R1.4 C[C@H]1CCC[C@H]1O Amb26012367 [1,0,0,1,0,0|0,0,1]=3 5982 B7R1.4 C[C@H]1CCN[C@H]1C Amb27879886 [1,0,0,1,0,0|1,0,1]=4 5983 B7R1.4 C[C@H]1CCO[C@H]1O Amb27642053 [1,0,0,1,0,0|1,0,1]=4 5984 B7R1.4 C[C@H]1CNC[C@@H]1O Amb33805301 [1,0,0,1,0,0|1,0,1]=4 5985 B7R1.4 C[C@H]1CNC[C@H]1O Amb27203947 [1,0,0,1,0,0|1,0,1]=4 5986 B7R1.4 C[C@H]1CNC[C@H]1O Amb33871574 [1,0,0,1,0,0|1,0,1]=4 5987 B7R1.4 C[C@H]1COC[C@@H]1O Amb24609705 [1,0,0,1,0,0|1,0,1]=4 5988 B7R1.4 C[C@H]1COC[C@H]1O Amb26400701 [1,0,0,1,0,0|1,0,1]=4 5989 B7R1.4 C[C@H]1CSC[C@H]1O Amb27448475 [1,0,0,1,0,0|1,0,1]=4 5990 B7R1.4 C[C@H]1NCC[C@@H]1O Amb28322208 [1,0,0,1,0,0|1,0,0]=3 5991 B7R1.4 C[C@H]1OCC[C@@H]1O Amb28388631 [1,0,0,1,0,0|1,0,0]=3 5992 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [1,0,0,1,0,0|2,0,0]=4 5993 B7R1.4 C[C@H]1SCC[C@@H]1O Amb27441450 [1,0,0,1,0,0|1,0,0]=3 5994 B7R1.4 ClC1=CCCC1Cl Amb27262105 [1,0,0,1,0,0|2,0,0]=4 5995 B7R1.4 Cl[C@@H]1C=CC[C@H]1Br Amb28195658 [1,0,0,1,0,0|2,0,0]=4 5996 B7R1.4 Cl[C@H]1C=CC[C@H]1Cl Amb27202572 [1,0,0,1,0,0|2,0,0]=4 5997 B7R1.4 Cl[C@H]1CC=C[C@H]1Cl Amb28247222 [1,0,0,1,0,0|2,0,0]=4 5998 B7R1.4 NC1C=CCC1O Amb18639380 [1,0,0,1,0,0|1,0,0]=3 5999 B7R1.4 NC1CCC=C1Br Amb33295394 [1,0,0,1,0,0|2,0,0]=4 6000 B7R1.4 NC1CCC=C1Br Amb33484034 [1,0,0,1,0,0|2,0,0]=4 6001 B7R1.4 NC1CCCC1O Amb13951342 [1,0,0,1,0,0|1,0,1]=4 6002 B7R1.4 NC1CCCC1O Amb8385206 [1,0,0,1,0,0|1,0,1]=4 6003 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993810 [1,0,0,1,0,0|1,0,1]=4 6004 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993921 [1,0,0,1,0,0|1,0,1]=4 6005 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993811 [1,0,0,1,0,0|1,0,1]=4 6006 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993922 [1,0,0,1,0,0|1,0,1]=4 6007 B7R1.4 N[C@@H]1CCC[C@H]1O Amb30451169 [1,0,0,1,0,0|1,0,1]=4 6008 B7R1.4 N[C@@H]1CCC[C@H]1O Amb33714404 [1,0,0,1,0,0|1,0,1]=4 6009 B7R1.4 N[C@H]1CCC[C@@H]1O Amb10604100 [1,0,0,1,0,0|1,0,1]=4 6010 B7R1.4 N[C@H]1CCC[C@@H]1O Amb3941725 [1,0,0,1,0,0|1,0,1]=4 6011 B7R1.4 N[C@H]1CCC[C@H]1O Amb10603107 [1,0,0,1,0,0|1,0,1]=4 6012 B7R1.4 N[C@H]1CCC[C@H]1O Amb28133706 [1,0,0,1,0,0|1,0,1]=4 6013 B7R1.4 O=C1CCCC1O Amb17593081 [1,0,0,1,0,0|1,0,1]=4 6014 B7R1.4 O=C1NCCC1O Amb10603089 [1,0,0,1,0,0|2,0,0]=4 6015 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [1,0,0,1,0,0|2,0,0]=4 6016 B7R1.4 O=C1NCC[C@H]1O Amb22225343 [1,0,0,1,0,0|2,0,0]=4 6017 B7R1.4 O=C1OCCC1O Amb5718058 [1,0,0,1,0,0|2,0,0]=4 6018 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [1,0,0,1,0,0|2,0,0]=4 6019 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [1,0,0,1,0,0|2,0,0]=4 6020 B7R1.4 OC1C=CCC1O Amb17593080 [1,0,0,1,0,0|1,0,0]=3 6021 B7R1.4 OC1CCC=C1Br Amb24429462 [1,0,0,1,0,0|1,0,0]=3 6022 B7R1.4 OC1CCC=C1Cl Amb25202022 [1,0,0,1,0,0|1,0,0]=3 6023 B7R1.4 OC1CCCC1Br Amb27201322 [1,0,0,1,0,0|1,0,1]=4 6024 B7R1.4 OC1CCCC1Cl Amb9787194 [1,0,0,1,0,0|1,0,1]=4 6025 B7R1.4 OC1CCCC1F Amb25746323 [1,0,0,1,0,0|1,0,1]=4 6026 B7R1.4 OC1CCCC1I Amb27478744 [1,0,0,1,0,0|1,0,1]=4 6027 B7R1.4 OC1CCCC1O Amb17935884 [1,0,0,1,0,0|1,0,1]=4 6028 B7R1.4 OC1CCOC1O Amb28291442 [1,0,0,1,0,0|2,0,0]=4 6029 B7R1.4 O[C@@H]1C=CC[C@H]1O Amb28139433 [1,0,0,1,0,0|1,0,0]=3 6030 B7R1.4 O[C@@H]1CCC=C1Cl Amb28340922 [1,0,0,1,0,0|1,0,0]=3 6031 B7R1.4 O[C@@H]1CCC[C@@H]1Br Amb24470331 [1,0,0,1,0,0|1,0,1]=4 6032 B7R1.4 O[C@@H]1CCC[C@@H]1F Amb34916184 [1,0,0,1,0,0|1,0,1]=4 6033 B7R1.4 O[C@@H]1CCC[C@H]1Br Amb26427919 [1,0,0,1,0,0|1,0,1]=4 6034 B7R1.4 O[C@@H]1CCC[C@H]1Cl Amb17938993 [1,0,0,1,0,0|1,0,1]=4 6035 B7R1.4 O[C@@H]1CCC[C@H]1Cl Amb30628647 [1,0,0,1,0,0|1,0,1]=4 6036 B7R1.4 O[C@@H]1CCC[C@H]1F Amb26891974 [1,0,0,1,0,0|1,0,1]=4 6037 B7R1.4 O[C@@H]1CCC[C@H]1O Amb33524011 [1,0,0,1,0,0|1,0,1]=4 6038 B7R1.4 O[C@H]1C=CC[C@H]1O Amb24622453 [1,0,0,1,0,0|1,0,0]=3 6039 B7R1.4 O[C@H]1CCC[C@@H]1F Amb24612635 [1,0,0,1,0,0|1,0,1]=4 6040 B7R1.4 O[C@H]1CCC[C@@H]1I Amb27857258 [1,0,0,1,0,0|1,0,1]=4 6041 B7R1.4 O[C@H]1CCC[C@@H]1O Amb22350708 [1,0,0,1,0,0|1,0,1]=4 6042 B7R1.4 O[C@H]1CCC[C@H]1Br Amb8394047 [1,0,0,1,0,0|1,0,1]=4 6043 B7R1.4 O[C@H]1CCC[C@H]1Cl Amb8394048 [1,0,0,1,0,0|1,0,1]=4 6044 B7R1.4 O[C@H]1CCC[C@H]1O Amb2721263 [1,0,0,1,0,0|1,0,1]=4 6045 B7R1.5 C=CCC1CC1O Amb26478050 [1,0,0,1,0,0|0,0,2]=4 6046 B7R1.5 C=CC[C@@H]1C[C@@H]1O Amb28053769 [1,0,0,1,0,0|0,0,2]=4 6047 B7R1.5 CC1CC1CCBr Amb26055211 [1,0,0,1,0,0|1,0,1]=4 6048 B7R1.5 CC1CC1CCN Amb27835415 [1,0,0,1,0,0|1,0,1]=4 6049 B7R1.5 CC1CC1CCO Amb25026465 [1,0,0,1,0,0|0,0,1]=3 6050 B7R1.5 CC1CC1CCS Amb33143846 [1,0,0,1,0,0|0,1,1]=4 6051 B7R1.5 CC1CC1CNO Amb32954149 [1,0,0,1,0,0|1,0,1]=4 6052 B7R1.5 CCCC1CC1Cl Amb28193341 [1,0,0,1,0,0|1,0,1]=4 6053 B7R1.5 CCCC1CC1N Amb18523756 [1,0,0,1,0,0|1,0,1]=4 6054 B7R1.5 CCCC1CC1N Amb20623324 [1,0,0,1,0,0|1,0,1]=4 6055 B7R1.5 CCC[C@@H]1C[C@@H]1N Amb34915319 [1,0,0,1,0,0|1,0,1]=4 6056 B7R1.5 CCC[C@@H]1C[C@H]1N Amb27488941 [1,0,0,1,0,0|1,0,1]=4 6057 B7R1.5 CCC[C@@H]1C[C@H]1N Amb33032253 [1,0,0,1,0,0|1,0,1]=4 6058 B7R1.5 CCOC1CC1Br Amb24650022 [1,0,0,1,0,0|2,0,0]=4 6059 B7R1.5 CCOC1CC1F Amb27969430 [1,0,0,1,0,0|2,0,0]=4 6060 B7R1.5 CCOC1CC1N Amb19515720 [1,0,0,1,0,0|2,0,0]=4 6061 B7R1.5 CCOC1CC1N Amb32718753 [1,0,0,1,0,0|2,0,0]=4 6062 B7R1.5 CCO[C@@H]1C[C@@H]1Br Amb27966858 [1,0,0,1,0,0|2,0,0]=4 6063 B7R1.5 CCO[C@@H]1C[C@H]1Br Amb25362288 [1,0,0,1,0,0|2,0,0]=4 6064 B7R1.5 CCO[C@@H]1C[C@H]1N Amb32992425 [1,0,0,1,0,0|2,0,0]=4 6065 B7R1.5 CCO[C@@H]1C[C@H]1N Amb32992585 [1,0,0,1,0,0|2,0,0]=4 6066 B7R1.5 CCO[C@H]1C[C@H]1Cl Amb28246620 [1,0,0,1,0,0|2,0,0]=4 6067 B7R1.5 C[C@@H]1C[C@@H]1CCBr Amb27454257 [1,0,0,1,0,0|1,0,1]=4 6068 B7R1.5 C[C@@H]1C[C@@H]1CCO Amb26012892 [1,0,0,1,0,0|0,0,1]=3 6069 B7R1.5 C[C@@H]1O[C@H]1CCO Amb27184243 [1,0,0,1,0,0|1,0,0]=3 6070 B7R1.5 C[C@H]1C[C@H]1CCCl Amb27630412 [1,0,0,1,0,0|1,0,1]=4 6071 B7R1.5 C[C@H]1O[C@H]1CCBr Amb27454808 [1,0,0,1,0,0|2,0,0]=4 6072 B7R1.5 N[C@@H]1C[C@H]1CCO Amb28074110 [1,0,0,1,0,0|1,0,1]=4 6073 B7R1.5 O=C1C=C1CCO Amb33330739 [1,0,0,1,0,0|1,0,1]=4 6074 B7R1.5 OCCC1CC1F Amb27238848 [1,0,0,1,0,0|1,0,1]=4 6075 B7R1.6 BrCC=C1CCC1 Amb25139355 [1,0,0,1,0,0|1,0,0]=3 6076 B7R1.6 BrCCC1CCC1 Amb25930029 [1,0,0,1,0,0|1,0,1]=4 6077 B7R1.6 BrCCC1CCN1 Amb27392177 [1,0,0,1,0,0|2,0,0]=4 6078 B7R1.6 Br\C=C\C1CCC1 Amb33135163 [1,0,0,1,0,0|2,0,0]=4 6079 B7R1.6 CCC=C1CCC1 Amb28120199 [1,0,0,1,0,0|0,0,0]=2 6080 B7R1.6 CCC=C1CNC1 Amb28050055 [1,0,0,1,0,0|1,0,0]=3 6081 B7R1.6 CCCC1CCN1 Amb33543494 [1,0,0,1,0,0|1,0,1]=4 6082 B7R1.6 CCCC1CCS1 Amb26614197 [1,0,0,1,0,0|0,1,1]=4 6083 B7R1.6 CCNC1CCC1 Amb18960935 [1,0,0,1,0,0|1,0,1]=4 6084 B7R1.6 CCNC1CCC1 Amb19515593 [1,0,0,1,0,0|1,0,1]=4 6085 B7R1.6 COC=C1COC1 Amb21960982 [1,0,0,1,0,0|2,0,0]=4 6086 B7R1.6 ClCC=C1COC1 Amb27806867 [1,0,0,1,0,0|2,0,0]=4 6087 B7R1.6 ClCCC1CCC1 Amb27831996 [1,0,0,1,0,0|1,0,1]=4 6088 B7R1.6 FCCC1CCN1 Amb25377475 [1,0,0,1,0,0|2,0,0]=4 6089 B7R1.6 N#CC=C1CCC1 Amb16231358 [1,0,0,1,0,0|1,0,1]=4 6090 B7R1.6 NCC=C1COC1 Amb35659249 [1,0,0,1,0,0|2,0,0]=4 6091 B7R1.6 NCCC1CCC1 Amb19516795 [1,0,0,1,0,0|1,0,1]=4 6092 B7R1.6 NCCC1CCC1 Amb20667967 [1,0,0,1,0,0|1,0,1]=4 6093 B7R1.6 NCCC1CCO1 Amb27843371 [1,0,0,1,0,0|1,0,1]=4 6094 B7R1.6 NCC[C@H]1CCO1 Amb25920109 [1,0,0,1,0,0|1,0,1]=4 6095 B7R1.6 O=CC=C1CCC1 Amb27827363 [1,0,0,1,0,0|1,0,1]=4 6096 B7R1.6 O=CCC1CCO1 Amb26626501 [1,0,0,1,0,0|1,0,1]=4 6097 B7R1.6 OCC=C1CCC1 Amb28346163 [1,0,0,1,0,0|1,0,0]=3 6098 B7R1.6 OCCC1=CCC1 Amb28189596 [1,0,0,1,0,0|0,0,0]=2 6099 B7R1.6 OCCC1CCC1 Amb33543947 [1,0,0,1,0,0|0,0,1]=3 6100 B7R1.6 OCCC1CCN1 Amb25350591 [1,0,0,1,0,0|1,0,0]=3 6101 B7R1.6 OCCC1CCO1 Amb25780445 [1,0,0,1,0,0|1,0,0]=3 6102 B7R1.6 OCCC1CNC1 Amb22737370 [1,0,0,1,0,0|1,0,1]=4 6103 B7R1.6 OCCC1CNC1 Amb30869764 [1,0,0,1,0,0|1,0,1]=4 6104 B7R1.6 OCCC1COC1 Amb20671348 [1,0,0,1,0,0|1,0,1]=4 6105 B7R1.6 OCCC1CSC1 Amb24574115 [1,0,0,1,0,0|1,0,1]=4 6106 B7R1.6 OCCN1CCC1 Amb22002602 [1,0,0,1,0,0|1,0,1]=4 6107 B7R1.6 OCC[C@@H]1CCN1 Amb24479867 [1,0,0,1,0,0|1,0,0]=3 6108 B7R1.6 OCC[C@@H]1CCO1 Amb26009491 [1,0,0,1,0,0|1,0,0]=3 6109 B7R1.6 OCC[C@H]1CCO1 Amb25129832 [1,0,0,1,0,0|1,0,0]=3 6110 B7R1.6 ONCC1CCC1 Amb25888398 [1,0,0,1,0,0|1,0,1]=4 6111 B7R1.6 SCCC1CCC1 Amb24581445 [1,0,0,1,0,0|0,1,1]=4 6112 B7R1.7 BrCCCC1CC1 Amb24606733 [1,0,0,1,0,0|1,0,1]=4 6113 B7R1.7 BrCCCC1CO1 Amb27407723 [1,0,0,1,0,0|1,0,1]=4 6114 B7R1.7 BrC\C=C\C1CO1 Amb26864708 [1,0,0,1,0,0|1,0,0]=3 6115 B7R1.7 C=CCCC1CO1 Amb3940512 [1,0,0,1,0,0|0,0,2]=4 6116 B7R1.7 C=CCC[C@@H]1CO1 Amb28050706 [1,0,0,1,0,0|0,0,2]=4 6117 B7R1.7 C=CCC[C@H]1CO1 Amb24429350 [1,0,0,1,0,0|0,0,2]=4 6118 B7R1.7 CCCCC1CO1 Amb17771532 [1,0,0,1,0,0|0,0,1]=3 6119 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [1,0,0,1,0,0|0,0,1]=3 6120 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [1,0,0,1,0,0|0,0,1]=3 6121 B7R1.7 CCCNC1CC1 Amb1135100 [1,0,0,1,0,0|1,0,1]=4 6122 B7R1.7 CCCNC1CC1 Amb32644830 [1,0,0,1,0,0|1,0,1]=4 6123 B7R1.7 CCNCC1CC1 Amb30584675 [1,0,0,1,0,0|1,0,1]=4 6124 B7R1.7 CCNCC1CC1 Amb6686877 [1,0,0,1,0,0|1,0,1]=4 6125 B7R1.7 CCOCC1CO1 Amb9709641 [1,0,0,1,0,0|1,0,0]=3 6126 B7R1.7 CCOC[C@@H]1CO1 Amb25954691 [1,0,0,1,0,0|1,0,0]=3 6127 B7R1.7 CCOC[C@H]1CO1 Amb25888471 [1,0,0,1,0,0|1,0,0]=3 6128 B7R1.7 CCSCC1CC1 Amb27206075 [1,0,0,1,0,0|1,0,1]=4 6129 B7R1.7 CCSCC1CO1 Amb6680858 [1,0,0,1,0,0|1,0,0]=3 6130 B7R1.7 CCSC[C@@H]1CO1 Amb25721898 [1,0,0,1,0,0|1,0,0]=3 6131 B7R1.7 CCSC[C@H]1CO1 Amb24747272 [1,0,0,1,0,0|1,0,0]=3 6132 B7R1.7 CC\C=C\C1CO1 Amb33449783 [1,0,0,1,0,0|0,0,0]=2 6133 B7R1.7 CC\C=C\[C@@H]1CO1 Amb33272599 [1,0,0,1,0,0|0,0,0]=2 6134 B7R1.7 CC\C=C\[C@H]1CO1 Amb33272601 [1,0,0,1,0,0|0,0,0]=2 6135 B7R1.7 COCCC1CO1 Amb27984185 [1,0,0,1,0,0|1,0,1]=4 6136 B7R1.7 COCC[C@@H]1CO1 Amb33377003 [1,0,0,1,0,0|1,0,1]=4 6137 B7R1.7 COCC[C@H]1CO1 Amb33377005 [1,0,0,1,0,0|1,0,1]=4 6138 B7R1.7 CO\C=C\C1CC1 Amb25367957 [1,0,0,1,0,0|1,0,0]=3 6139 B7R1.7 CSCCC1CO1 Amb25241000 [1,0,0,1,0,0|1,0,1]=4 6140 B7R1.7 CSCC[C@@H]1CO1 Amb33203333 [1,0,0,1,0,0|1,0,1]=4 6141 B7R1.7 CSCC[C@H]1CO1 Amb33203334 [1,0,0,1,0,0|1,0,1]=4 6142 B7R1.7 C\C=C\CC1CO1 Amb25285825 [1,0,0,1,0,0|0,0,0]=2 6143 B7R1.7 FCCCC1CO1 Amb33196122 [1,0,0,1,0,0|1,0,1]=4 6144 B7R1.7 ICCCC1CC1 Amb35720662 [1,0,0,1,0,0|1,0,1]=4 6145 B7R1.7 ICCCC1CO1 Amb27838220 [1,0,0,1,0,0|1,0,1]=4 6146 B7R1.7 N#C\C=C\C1CC1 Amb25168920 [1,0,0,1,0,0|1,0,1]=4 6147 B7R1.7 NCCCC1CC1 Amb18296303 [1,0,0,1,0,0|1,0,1]=4 6148 B7R1.7 NCCCC1CC1 Amb33548306 [1,0,0,1,0,0|1,0,1]=4 6149 B7R1.7 NCCCC1CO1 Amb27816302 [1,0,0,1,0,0|1,0,1]=4 6150 B7R1.7 NC\C=C\C1CC1 Amb32661239 [1,0,0,1,0,0|1,0,0]=3 6151 B7R1.7 NC\C=C\C1CC1 Amb33538361 [1,0,0,1,0,0|1,0,0]=3 6152 B7R1.7 O=CCC=C1CC1 Amb27799822 [1,0,0,1,0,0|0,0,2]=4 6153 B7R1.7 O=COCC1CO1 Amb24632689 [1,0,0,1,0,0|2,0,0]=4 6154 B7R1.7 O=C\C=C\C1CC1 Amb32664515 [1,0,0,1,0,0|1,0,1]=4 6155 B7R1.7 OCCCC1CC1 Amb19888792 [1,0,0,1,0,0|0,0,1]=3 6156 B7R1.7 OCCCC1CO1 Amb28294234 [1,0,0,1,0,0|1,0,1]=4 6157 B7R1.7 OCCC[C@@H]1CO1 Amb27394788 [1,0,0,1,0,0|1,0,1]=4 6158 B7R1.7 OCCNC1CC1 Amb6251502 [1,0,0,1,0,0|1,0,1]=4 6159 B7R1.7 OCCOC1CC1 Amb26852318 [1,0,0,1,0,0|1,0,1]=4 6160 B7R1.7 OC\C=C/C1CC1 Amb33483698 [1,0,0,1,0,0|1,0,0]=3 6161 B7R1.7 OC\C=C\C1CC1 Amb26963162 [1,0,0,1,0,0|1,0,0]=3 6162 B7R1.7 ONCCC1CC1 Amb33361506 [1,0,0,1,0,0|1,0,1]=4 6163 B7R1.7 SCCCC1CC1 Amb28244922 [1,0,0,1,0,0|0,1,1]=4 6164 B7R1.8 C=CC1CCC1O Amb25848177 [1,0,0,1,0,0|0,0,2]=4 6165 B7R1.8 C=C[C@@H]1CC[C@@H]1O Amb27184314 [1,0,0,1,0,0|0,0,2]=4 6166 B7R1.8 C=C[C@@H]1CC[C@H]1O Amb27780489 [1,0,0,1,0,0|0,0,2]=4 6167 B7R1.8 CC1CCC1CBr Amb28076923 [1,0,0,1,0,0|1,0,1]=4 6168 B7R1.8 CC1CCC1CCl Amb28436122 [1,0,0,1,0,0|1,0,1]=4 6169 B7R1.8 CC1CCC1CI Amb27792871 [1,0,0,1,0,0|1,0,1]=4 6170 B7R1.8 CC1CCC1CN Amb23512778 [1,0,0,1,0,0|1,0,1]=4 6171 B7R1.8 CC1CCC1CO Amb23512661 [1,0,0,1,0,0|0,0,1]=3 6172 B7R1.8 CC1CCC1NO Amb27425045 [1,0,0,1,0,0|1,0,1]=4 6173 B7R1.8 CCC1CCC1N Amb28135225 [1,0,0,1,0,0|1,0,1]=4 6174 B7R1.8 CCC1CCC1O Amb27249737 [1,0,0,1,0,0|0,0,1]=3 6175 B7R1.8 CC[C@@H]1CC[C@@H]1O Amb27268529 [1,0,0,1,0,0|0,0,1]=3 6176 B7R1.8 CC[C@@H]1CC[C@H]1O Amb27798172 [1,0,0,1,0,0|0,0,1]=3 6177 B7R1.8 CN1CCC1CO Amb27161390 [1,0,0,1,0,0|1,0,1]=4 6178 B7R1.8 CN1CC[C@@H]1CO Amb23401423 [1,0,0,1,0,0|1,0,1]=4 6179 B7R1.8 CN1CC[C@H]1CO Amb28239653 [1,0,0,1,0,0|1,0,1]=4 6180 B7R1.8 COC1C=CC1Cl Amb27755072 [1,0,0,1,0,0|2,0,0]=4 6181 B7R1.8 CO[C@@H]1CC[C@H]1O Amb33495612 [1,0,0,1,0,0|1,0,1]=4 6182 B7R1.8 C[C@@H]1CC[C@@H]1CBr Amb27484113 [1,0,0,1,0,0|1,0,1]=4 6183 B7R1.8 C[C@@H]1CC[C@H]1CBr Amb27424101 [1,0,0,1,0,0|1,0,1]=4 6184 B7R1.8 C[C@H]1CC[C@H]1CBr Amb28429571 [1,0,0,1,0,0|1,0,1]=4 6185 B7R1.8 C[C@H]1CC[C@H]1CCl Amb28387678 [1,0,0,1,0,0|1,0,1]=4 6186 B7R1.8 C[C@H]1CC[C@H]1CO Amb27196739 [1,0,0,1,0,0|0,0,1]=3 6187 B7R1.8 C\C=C1\CCC1=O Amb24512730 [1,0,0,1,0,0|0,0,2]=4 6188 B7R1.8 C\C=C1\CCC1O Amb27595035 [1,0,0,1,0,0|0,0,0]=2 6189 B7R1.8 N#CC1=CCC1O Amb27651810 [1,0,0,1,0,0|1,0,1]=4 6190 B7R1.8 N[C@H]1CC[C@H]1CO Amb25327109 [1,0,0,1,0,0|1,0,1]=4 6191 B7R1.8 O=C1CCC1CO Amb24722181 [1,0,0,1,0,0|1,0,1]=4 6192 B7R1.8 O=C1NCC1CO Amb28196532 [1,0,0,1,0,0|2,0,0]=4 6193 B7R1.8 OCC1CCC1F Amb32943809 [1,0,0,1,0,0|1,0,1]=4 6194 B7R1.8 OCC1CCC1O Amb26956761 [1,0,0,1,0,0|1,0,1]=4 6195 B7R1.8 OC[C@@H]1CC[C@H]1O Amb34160319 [1,0,0,1,0,0|1,0,1]=4 6196 B7R1.8 OC[C@H]1CC[C@H]1O Amb25662759 [1,0,0,1,0,0|1,0,1]=4 6197 B7R1.9 C=C[C@@H]1C[C@H]1CO Amb27481145 [1,0,0,1,0,0|0,0,2]=4 6198 B7R1.9 CCC1=C(CO)C1 Amb28365928 [1,0,0,1,0,0|0,0,1]=3 6199 B7R1.9 CCC1CC1CBr Amb28050452 [1,0,0,1,0,0|1,0,1]=4 6200 B7R1.9 CCC1CC1CC Amb27445028 [1,0,0,1,0,0|0,0,2]=4 6201 B7R1.9 CCC1CC1CN Amb18963643 [1,0,0,1,0,0|1,0,1]=4 6202 B7R1.9 CCC1CC1CN Amb32662776 [1,0,0,1,0,0|1,0,1]=4 6203 B7R1.9 CCC1OC1CC Amb27407235 [1,0,0,1,0,0|1,0,1]=4 6204 B7R1.9 CC[C@@H]1C[C@@H]1CN Amb34916256 [1,0,0,1,0,0|1,0,1]=4 6205 B7R1.9 CC[C@@H]1C[C@@H]1CO Amb24519658 [1,0,0,1,0,0|0,0,1]=3 6206 B7R1.9 CC[C@@H]1C[C@H]1CBr Amb24545997 [1,0,0,1,0,0|1,0,1]=4 6207 B7R1.9 CC[C@@H]1C[C@H]1CCl Amb28284868 [1,0,0,1,0,0|1,0,1]=4 6208 B7R1.9 CC[C@@H]1C[C@H]1CN Amb26431153 [1,0,0,1,0,0|1,0,1]=4 6209 B7R1.9 CC[C@@H]1C[C@H]1CN Amb28920814 [1,0,0,1,0,0|1,0,1]=4 6210 B7R1.9 CC[C@@H]1C[C@H]1CO Amb24586149 [1,0,0,1,0,0|0,0,1]=3 6211 B7R1.9 CC[C@@H]1O[C@@H]1CO Amb28198173 [1,0,0,1,0,0|1,0,1]=4 6212 B7R1.9 CC[C@H]1C[C@H]1CC Amb27391419 [1,0,0,1,0,0|0,0,2]=4 6213 B7R1.9 CC[S+]1CC1CO Amb27970929 [1,0,0,1,0,0|1,0,0]=3 6214 B7R1.9 CNC1CC1CO Amb27838268 [1,0,0,1,0,0|1,0,1]=4 6215 B7R1.9 COC1CC1CO Amb28137240 [1,0,0,1,0,0|1,0,1]=4 6216 B7R1.9 CO[C@H]1C[C@@H]1CO Amb27632061 [1,0,0,1,0,0|1,0,1]=4 6217 B7R1.9 NCC1CC1CO Amb22499310 [1,0,0,1,0,0|1,0,1]=4 6218 B7R1.9 NC[C@@H]1C[C@@H]1CO Amb22746714 [1,0,0,1,0,0|1,0,1]=4 6219 B7R1.9 NC[C@@H]1C[C@H]1CO Amb22746972 [1,0,0,1,0,0|1,0,1]=4 6220 B7R1.9 NC[C@H]1C[C@@H]1CO Amb22224716 [1,0,0,1,0,0|1,0,1]=4 6221 B7R1.9 NC[C@H]1C[C@H]1CO Amb25217566 [1,0,0,1,0,0|1,0,1]=4 6222 B7R1.9 OCC1CC1CBr Amb27831384 [1,0,0,1,0,0|1,0,1]=4 6223 B7R1.9 OCC1CC1CCl Amb27965811 [1,0,0,1,0,0|1,0,1]=4 6224 B7R1.9 OCC1CC1CO Amb27172961 [1,0,0,1,0,0|1,0,1]=4 6225 B7R1.9 OC[C@H]1C[C@H]1CO Amb28193489 [1,0,0,1,0,0|1,0,1]=4 6226 B7R1.24 C1=CCCC=CC1 Amb22365118 [1,0,0,1,0,0|0,0,2]=4 6227 B7R1.24 C1=CCCCC=C1 Amb22002708 [1,0,0,1,0,0|0,0,2]=4 6228 B7R1.24 C1=CCCCCC1 Amb8515344 [1,0,0,1,0,0|0,0,0]=2 6229 B7R1.24 C1=CCCNCC1 Amb22169408 [1,0,0,1,0,0|1,0,0]=3 6230 B7R1.24 C1=CCCNCC1 Amb24530335 [1,0,0,1,0,0|1,0,0]=3 6231 B7R1.24 C1=CCNCCC1 Amb25104535 [1,0,0,1,0,0|1,0,0]=3 6232 B7R1.24 C1=CCNCCC1 Amb33330391 [1,0,0,1,0,0|1,0,0]=3 6233 B7R1.24 C1=CCOCOC1 Amb6600543 [1,0,0,1,0,0|1,0,0]=3 6234 B7R1.24 C1=COCCCC1 Amb28254269 [1,0,0,1,0,0|1,0,0]=3 6235 B7R1.24 C1=NCCCCC1 Amb27445210 [1,0,0,1,0,0|1,0,0]=3 6236 B7R1.24 C1CCCNCC1 Amb2792842 [1,0,0,1,0,0|1,0,1]=4 6237 B7R1.24 C1CCCOCC1 Amb22045221 [1,0,0,1,0,0|0,0,1]=3 6238 B7R1.24 C1CCNNCC1 Amb18061998 [1,0,0,1,0,0|2,0,0]=4 6239 B7R1.24 C1CCNOCC1 Amb28769693 [1,0,0,1,0,0|1,0,1]=4 6240 B7R1.24 C1CNCCNC1 Amb2688726 [1,0,0,1,0,0|2,0,0]=4 6241 B7R1.24 C1CNCCNC1 Amb29844598 [1,0,0,1,0,0|2,0,0]=4 6242 B7R1.24 C1CNCCOC1 Amb19889085 [1,0,0,1,0,0|1,0,0]=3 6243 B7R1.24 C1CNCCOC1 Amb7094907 [1,0,0,1,0,0|1,0,0]=3 6244 B7R1.24 C1CNCCSC1 Amb13951191 [1,0,0,1,0,0|1,1,0]=4 6245 B7R1.24 C1CNCCSC1 Amb9176341 [1,0,0,1,0,0|1,1,0]=4 6246 B7R1.24 C1COCCNN1 Amb18559514 [1,0,0,1,0,0|2,0,0]=4 6247 B7R1.24 C1COCCNN1 Amb22728775 [1,0,0,1,0,0|2,0,0]=4 6248 B7R1.24 C1COCCNN1 Amb22739942 [1,0,0,1,0,0|2,0,0]=4 6249 B7R1.24 C1COCCON1 Amb28071736 [1,0,0,1,0,0|2,0,0]=4 6250 B7R1.24 C1COCCON1 Amb32650187 [1,0,0,1,0,0|2,0,0]=4 6251 B7R1.24 C1CSSCCO1 Amb10565588 [1,0,0,1,0,0|2,0,0]=4 6252 B9R1.2 C=CC1=CCCC(O)C1 Amb28315534 [0,1,0,1,0,0|0,0,2]=4 6253 B9R1.2 C=CC1CC=CC(O)C1 Amb27956505 [0,1,0,1,0,0|1,0,1]=4 6254 B9R1.2 C=C[C@@H]1CC=C[C@@H](O)C1 Amb27981632 [0,1,0,1,0,0|1,0,1]=4 6255 B9R1.2 CC1=CCO[C@H](CO)C1 Amb27980482 [0,1,0,1,0,0|1,0,0]=3 6256 B9R1.2 CC1CC(CO)CCN1 Amb25921106 [0,1,0,1,0,0|1,0,1]=4 6257 B9R1.2 CC1CC(CO)CCN1 Amb32653256 [0,1,0,1,0,0|1,0,1]=4 6258 B9R1.2 CC1CC(CO)CCO1 Amb24679585 [0,1,0,1,0,0|1,0,1]=4 6259 B9R1.2 CC1CCCC(CO)C1 Amb20248640 [0,1,0,1,0,0|0,0,2]=4 6260 B9R1.2 CC1CCCC(CO)N1 Amb20090381 [0,1,0,1,0,0|0,0,2]=4 6261 B9R1.2 CC1CNCC(CO)C1 Amb24554370 [0,1,0,1,0,0|1,0,1]=4 6262 B9R1.2 CC1CNCC(CO)O1 Amb25139435 [0,1,0,1,0,0|1,0,1]=4 6263 B9R1.2 CC1CSCC(CO)O1 Amb27969010 [0,1,0,1,0,0|1,0,1]=4 6264 B9R1.2 CCC1=CC(=O)CCC1 Amb27599813 [0,1,0,1,0,0|1,0,1]=4 6265 B9R1.2 CCC1=CC(=O)CCN1 Amb27595544 [0,1,0,1,0,0|1,0,1]=4 6266 B9R1.2 CCC1=CC(Cl)CNC1 Amb32989063 [0,1,0,1,0,0|2,0,0]=4 6267 B9R1.2 CCC1=CC(N)CCC1 Amb27173637 [0,1,0,1,0,0|1,0,0]=3 6268 B9R1.2 CCC1=CC(N)CNC1 Amb32989563 [0,1,0,1,0,0|2,0,0]=4 6269 B9R1.2 CCC1=CC(O)CNC1 Amb32989172 [0,1,0,1,0,0|1,0,1]=4 6270 B9R1.2 CCC1=C[C@H](O)CCC1 Amb28064187 [0,1,0,1,0,0|0,0,1]=3 6271 B9R1.2 CCC1CC(Cl)CCO1 Amb28458111 [0,1,0,1,0,0|0,0,2]=4 6272 B9R1.2 CCC1CC(N)CCO1 Amb19373927 [0,1,0,1,0,0|0,0,2]=4 6273 B9R1.2 CCC1CC(O)CCO1 Amb24391236 [0,1,0,1,0,0|0,0,2]=4 6274 B9R1.2 CCC1CC(S)CCO1 Amb25724681 [0,1,0,1,0,0|0,0,2]=4 6275 B9R1.2 CCC1CCCC(=O)C1 Amb19335038 [0,1,0,1,0,0|1,0,1]=4 6276 B9R1.2 CCC1CCCC(O)C1 Amb17593352 [0,1,0,1,0,0|0,0,2]=4 6277 B9R1.2 CCC1CCN=C(N)C1 Amb25779626 [0,1,0,1,0,0|2,0,0]=4 6278 B9R1.2 CCC1CCNC(=O)C1 Amb25791122 [0,1,0,1,0,0|2,0,0]=4 6279 B9R1.2 CCC1NC(C)CCO1 Amb33194316 [0,1,0,1,0,0|1,0,1]=4 6280 B9R1.2 CCC1NCCC(C)O1 Amb33193306 [0,1,0,1,0,0|1,0,1]=4 6281 B9R1.2 CCN1CCCC(O)C1 Amb9703152 [0,1,0,1,0,0|1,0,1]=4 6282 B9R1.2 CCN1CCC[C@@H](O)C1 Amb27949660 [0,1,0,1,0,0|1,0,1]=4 6283 B9R1.2 CCN1CCC[C@H](O)C1 Amb28049184 [0,1,0,1,0,0|1,0,1]=4 6284 B9R1.2 CC[C@@H]1CC=CC(=O)C1 Amb27828949 [0,1,0,1,0,0|1,0,1]=4 6285 B9R1.2 CC[C@@H]1CCC[C@@H](O)C1 Amb28319548 [0,1,0,1,0,0|0,0,2]=4 6286 B9R1.2 CC[C@@H]1CCC[C@H](O)C1 Amb27491475 [0,1,0,1,0,0|0,0,2]=4 6287 B9R1.2 CC[C@@H]1C[C@@H](O)CCN1 Amb32434781 [0,1,0,1,0,0|1,0,1]=4 6288 B9R1.2 CC[C@@H]1C[C@H](N)CCO1 Amb27248320 [0,1,0,1,0,0|0,0,2]=4 6289 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb27460205 [0,1,0,1,0,0|1,0,1]=4 6290 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb32434779 [0,1,0,1,0,0|1,0,1]=4 6291 B9R1.2 CC[C@H]1CC=CC(=O)C1 Amb28461147 [0,1,0,1,0,0|1,0,1]=4 6292 B9R1.2 CC[C@H]1CCCC(O)O1 Amb27180648 [0,1,0,1,0,0|0,0,2]=4 6293 B9R1.2 CC[C@H]1CCC[C@H](O)C1 Amb28207111 [0,1,0,1,0,0|0,0,2]=4 6294 B9R1.2 CC[C@H]1C[C@H](O)CCS1 Amb27451909 [0,1,0,1,0,0|1,0,1]=4 6295 B9R1.2 CN1CCCC(CO)C1 Amb615876 [0,1,0,1,0,0|1,0,1]=4 6296 B9R1.2 CN1CCC[C@@H](CO)C1 Amb10068404 [0,1,0,1,0,0|1,0,1]=4 6297 B9R1.2 CN1CCC[C@H](CO)C1 Amb10068405 [0,1,0,1,0,0|1,0,1]=4 6298 B9R1.2 CNC1CCC=C(C)C1 Amb27752187 [0,1,0,1,0,0|2,0,0]=4 6299 B9R1.2 COC1=CC(O)CCC1 Amb28194168 [0,1,0,1,0,0|1,0,1]=4 6300 B9R1.2 C[C@@H]1CCCC(CO)N1 Amb27413400 [0,1,0,1,0,0|0,0,2]=4 6301 B9R1.2 C[C@@H]1CCC[C@@H](CO)O1 Amb27213296 [0,1,0,1,0,0|0,0,2]=4 6302 B9R1.2 C[C@@H]1CCC[C@H](CO)N1 Amb24647659 [0,1,0,1,0,0|0,0,2]=4 6303 B9R1.2 C[C@@H]1CNC[C@@H](CO)O1 Amb24682877 [0,1,0,1,0,0|1,0,1]=4 6304 B9R1.2 C[C@@H]1CNC[C@@H](CO)O1 Amb33677246 [0,1,0,1,0,0|1,0,1]=4 6305 B9R1.2 C[C@@H]1CNC[C@H](CO)O1 Amb33677245 [0,1,0,1,0,0|1,0,1]=4 6306 B9R1.2 C[C@@H]1COC[C@H](CO)O1 Amb27853934 [0,1,0,1,0,0|1,0,1]=4 6307 B9R1.2 C[C@@H]1C[C@@H](CO)CCO1 Amb33484246 [0,1,0,1,0,0|1,0,1]=4 6308 B9R1.2 C[C@@H]1C[C@H](CO)CCN1 Amb26849936 [0,1,0,1,0,0|1,0,1]=4 6309 B9R1.2 C[C@@H]1C[C@H](CO)CCN1 Amb32653271 [0,1,0,1,0,0|1,0,1]=4 6310 B9R1.2 C[C@@H]1OCC[C@H](CO)O1 Amb27448605 [0,1,0,1,0,0|1,0,1]=4 6311 B9R1.2 C[C@H]1CNC[C@@H](CO)O1 Amb24549804 [0,1,0,1,0,0|1,0,1]=4 6312 B9R1.2 C[C@H]1CNC[C@@H](CO)O1 Amb33299353 [0,1,0,1,0,0|1,0,1]=4 6313 B9R1.2 C[C@H]1CSC[C@@H](CO)O1 Amb27775963 [0,1,0,1,0,0|1,0,1]=4 6314 B9R1.2 C[C@H]1C[C@@H](CO)CCN1 Amb24558717 [0,1,0,1,0,0|1,0,1]=4 6315 B9R1.2 C[C@H]1C[C@@H](CO)CCN1 Amb28577880 [0,1,0,1,0,0|1,0,1]=4 6316 B9R1.2 N#CC1=CCCC(O)C1 Amb24682186 [0,1,0,1,0,0|1,0,1]=4 6317 B9R1.2 N#CC1=CCC[C@@H](O)C1 Amb28321626 [0,1,0,1,0,0|1,0,1]=4 6318 B9R1.2 NC1CCCC(CO)C1 Amb33532803 [0,1,0,1,0,0|0,0,2]=4 6319 B9R1.2 NCC1CCNC(=O)C1 Amb18832611 [0,1,0,1,0,0|2,0,0]=4 6320 B9R1.2 NCC1CCNC(=O)C1 Amb22405878 [0,1,0,1,0,0|2,0,0]=4 6321 B9R1.2 NCC1CCNC(=O)C1 Amb35747931 [0,1,0,1,0,0|2,0,0]=4 6322 B9R1.2 N[C@@H]1CCC[C@@H](CO)C1 Amb25973785 [0,1,0,1,0,0|0,0,2]=4 6323 B9R1.2 N[C@@H]1CCC[C@H](CO)C1 Amb27791190 [0,1,0,1,0,0|0,0,2]=4 6324 B9R1.2 N[C@H]1C=CC[C@@H](CO)C1 Amb25290992 [0,1,0,1,0,0|0,0,0]=2 6325 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb23385323 [0,1,0,1,0,0|0,0,2]=4 6326 B9R1.2 N[C@H]1CCC[C@@H](CO)C1 Amb30526953 [0,1,0,1,0,0|0,0,2]=4 6327 B9R1.2 N[C@H]1CCC[C@H](CO)C1 Amb28399575 [0,1,0,1,0,0|0,0,2]=4 6328 B9R1.2 N[C@H]1CSC[C@@H](CO)C1 Amb27787680 [0,1,0,1,0,0|1,0,1]=4 6329 B9R1.2 O=C1C=CCC(CO)O1 Amb28049087 [0,1,0,1,0,0|1,0,1]=4 6330 B9R1.2 O=C1C=CNC(CO)C1 Amb27875190 [0,1,0,1,0,0|1,0,1]=4 6331 B9R1.2 O=C1CC(CBr)CCN1 Amb27980511 [0,1,0,1,0,0|2,0,0]=4 6332 B9R1.2 O=C1CC(CCl)CCO1 Amb27482669 [0,1,0,1,0,0|2,0,0]=4 6333 B9R1.2 O=C1CC(CO)CCN1 Amb21960758 [0,1,0,1,0,0|1,0,0]=3 6334 B9R1.2 O=C1CCCC(CBr)C1 Amb28396522 [0,1,0,1,0,0|1,0,1]=4 6335 B9R1.2 O=C1CCCC(CCl)C1 Amb17593666 [0,1,0,1,0,0|1,0,1]=4 6336 B9R1.2 O=C1CCCC(CO)C1 Amb16231079 [0,1,0,1,0,0|0,0,1]=3 6337 B9R1.2 O=C1CCCC(CO)N1 Amb13886257 [0,1,0,1,0,0|1,0,1]=4 6338 B9R1.2 O=C1CCCC(CO)O1 Amb27980552 [0,1,0,1,0,0|1,0,1]=4 6339 B9R1.2 O=C1CCC[C@@H](CO)C1 Amb26479307 [0,1,0,1,0,0|0,0,1]=3 6340 B9R1.2 O=C1CCC[C@H](CO)N1 Amb25187085 [0,1,0,1,0,0|1,0,1]=4 6341 B9R1.2 O=C1CNCC(CO)C1 Amb27621654 [0,1,0,1,0,0|1,0,1]=4 6342 B9R1.2 O=C1C[C@H](CCl)CCO1 Amb27656328 [0,1,0,1,0,0|2,0,0]=4 6343 B9R1.2 O=C[C@@H]1CC=C[C@@H](O)C1 Amb28143998 [0,1,0,1,0,0|0,0,2]=4 6344 B9R1.2 O=C[C@@H]1CC=C[C@H](O)C1 Amb28130446 [0,1,0,1,0,0|0,0,2]=4 6345 B9R1.2 OC1C=CCC(CCl)O1 Amb27403015 [0,1,0,1,0,0|2,0,0]=4 6346 B9R1.2 OCC1=CC(O)CCC1 Amb28315569 [0,1,0,1,0,0|1,0,1]=4 6347 B9R1.2 OCC1CC(O)C=CO1 Amb27185678 [0,1,0,1,0,0|1,0,0]=3 6348 B9R1.2 OCC1CCCC(F)C1 Amb24518717 [0,1,0,1,0,0|0,0,2]=4 6349 B9R1.2 OCC1CCNC(=S)N1 Amb27955922 [0,1,0,1,0,0|2,0,0]=4 6350 B9R1.2 OCC1CNCC(F)C1 Amb13889103 [0,1,0,1,0,0|1,0,1]=4 6351 B9R1.2 OCC1CNCC(F)C1 Amb22886258 [0,1,0,1,0,0|1,0,1]=4 6352 B9R1.2 OCC1CNCC(O)C1 Amb27199658 [0,1,0,1,0,0|1,0,1]=4 6353 B9R1.2 OC[C@@H]1CC=CC(=S)N1 Amb27468983 [0,1,0,1,0,0|1,0,1]=4 6354 B9R1.2 OC[C@@H]1CC=C[C@H](O)C1 Amb22756427 [0,1,0,1,0,0|0,0,0]=2 6355 B9R1.2 OC[C@@H]1CCC[C@@H](O)C1 Amb28076813 [0,1,0,1,0,0|0,0,2]=4 6356 B9R1.2 OC[C@@H]1CCC[C@H](O)C1 Amb28344623 [0,1,0,1,0,0|0,0,2]=4 6357 B9R1.2 OC[C@@H]1CCNC(=S)N1 Amb28423747 [0,1,0,1,0,0|2,0,0]=4 6358 B9R1.2 OC[C@@H]1C[C@@H](O)C=CO1 Amb27969105 [0,1,0,1,0,0|1,0,0]=3 6359 B9R1.2 OC[C@H]1CC=C[C@@H](O)C1 Amb28248697 [0,1,0,1,0,0|0,0,0]=2 6360 B9R1.2 OC[C@H]1CCC[C@@H](O)C1 Amb26435184 [0,1,0,1,0,0|0,0,2]=4 6361 B9R1.7 C=CCC1C=CC(O)C1 Amb28315556 [0,1,0,1,0,0|1,0,1]=4 6362 B9R1.7 CC1=CC(CC=O)CC1 Amb27644034 [0,1,0,1,0,0|0,0,2]=4 6363 B9R1.7 CC1CC(CCO)CN1 Amb27607763 [0,1,0,1,0,0|1,0,1]=4 6364 B9R1.7 CC1CCC(CCO)C1 Amb28206116 [0,1,0,1,0,0|0,0,2]=4 6365 B9R1.7 CC1CCC(CCO)O1 Amb24420913 [0,1,0,1,0,0|0,0,2]=4 6366 B9R1.7 CC1CC\C(=C/CO)C1 Amb27204469 [0,1,0,1,0,0|2,0,0]=4 6367 B9R1.7 CC1NC(CCO)CS1 Amb32946459 [0,1,0,1,0,0|1,0,1]=4 6368 B9R1.7 CC1OC[C@H](CCO)O1 Amb27978209 [0,1,0,1,0,0|1,0,1]=4 6369 B9R1.7 CCCC1=CC(=O)CC1 Amb25337676 [0,1,0,1,0,0|1,0,1]=4 6370 B9R1.7 CCCC1=CCC(O)C1 Amb28453475 [0,1,0,1,0,0|0,0,2]=4 6371 B9R1.7 CCCC1=C[C@@H](O)CC1 Amb27424842 [0,1,0,1,0,0|0,0,1]=3 6372 B9R1.7 CCCC1CC(N)CO1 Amb35584876 [0,1,0,1,0,0|0,0,2]=4 6373 B9R1.7 CCCC1CC(O)CO1 Amb35584946 [0,1,0,1,0,0|0,0,2]=4 6374 B9R1.7 CCCC1CCC(=O)C1 Amb24087435 [0,1,0,1,0,0|1,0,1]=4 6375 B9R1.7 CCCC1CCC(=O)O1 Amb8517544 [0,1,0,1,0,0|2,0,0]=4 6376 B9R1.7 CCCC1CCC(Cl)O1 Amb27424623 [0,1,0,1,0,0|0,0,2]=4 6377 B9R1.7 CCCC1CCC(O)O1 Amb27589536 [0,1,0,1,0,0|0,0,2]=4 6378 B9R1.7 CCC[C@H]1CCC(=O)O1 Amb28397464 [0,1,0,1,0,0|2,0,0]=4 6379 B9R1.7 CCOC1C=CC(Cl)C1 Amb27392362 [0,1,0,1,0,0|2,0,0]=4 6380 B9R1.7 CN1CCC(CCO)C1 Amb22585688 [0,1,0,1,0,0|1,0,1]=4 6381 B9R1.7 CN1CCC(CCO)C1 Amb32665383 [0,1,0,1,0,0|1,0,1]=4 6382 B9R1.7 COCC1C=CC(Cl)C1 Amb28342295 [0,1,0,1,0,0|2,0,0]=4 6383 B9R1.7 C[C@@H]1CCC(CCO)O1 Amb33423278 [0,1,0,1,0,0|0,0,2]=4 6384 B9R1.7 C[C@@H]1CC[C@@H](CCO)N1 Amb27438106 [0,1,0,1,0,0|0,0,2]=4 6385 B9R1.7 C[C@@H]1CC[C@H](CCO)N1 Amb32946591 [0,1,0,1,0,0|0,0,2]=4 6386 B9R1.7 C[C@H]1CC[C@@H](CCO)N1 Amb27439132 [0,1,0,1,0,0|0,0,2]=4 6387 B9R1.7 C[n+]1ccn(CCO)c1 Amb24324940 [0,1,0,1,0,0|2,0,0]=4 6388 B9R1.7 C\C=C\C1CCC(O)O1 Amb28065178 [0,1,0,1,0,0|0,0,2]=4 6389 B9R1.7 Cc1ccc(CCO)o1 Amb24496246 [0,1,0,1,0,0|0,0,2]=4 6390 B9R1.7 Cc1ccc(CCO)s1 Amb27981032 [0,1,0,1,0,0|0,0,2]=4 6391 B9R1.7 Cc1ccn(CCO)n1 Amb33483686 [0,1,0,1,0,0|1,0,1]=4 6392 B9R1.7 Cc1ccn(CCO)n1 Amb9766451 [0,1,0,1,0,0|1,0,1]=4 6393 B9R1.7 Cn1cc[n+](CCO)c1 Amb24524531 [0,1,0,1,0,0|2,0,0]=4 6394 B9R1.7 Cn1ccc(CCO)c1 Amb18860516 [0,1,0,1,0,0|1,0,1]=4 6395 B9R1.7 Cn1ccc(CCO)n1 Amb33553108 [0,1,0,1,0,0|1,0,1]=4 6396 B9R1.7 N#CC[C@@H]1C=C[C@@H](O)C1 Amb27432118 [0,1,0,1,0,0|1,0,1]=4 6397 B9R1.7 NC1=NN(CCO)CC1 Amb27179866 [0,1,0,1,0,0|2,0,0]=4 6398 B9R1.7 NC1CCC(CCO)C1 Amb26889980 [0,1,0,1,0,0|0,0,2]=4 6399 B9R1.7 NCCC1CCC(=O)N1 Amb18832609 [0,1,0,1,0,0|2,0,0]=4 6400 B9R1.7 NCCC1CCC(=O)N1 Amb32652430 [0,1,0,1,0,0|2,0,0]=4 6401 B9R1.7 NCC[C@@H]1CCC(=O)N1 Amb26588427 [0,1,0,1,0,0|2,0,0]=4 6402 B9R1.7 NCC[C@@H]1CCC(=O)N1 Amb32664350 [0,1,0,1,0,0|2,0,0]=4 6403 B9R1.7 N[C@@H]1CC[C@H](CCO)C1 Amb33803500 [0,1,0,1,0,0|0,0,2]=4 6404 B9R1.7 N[C@H]1C=C[C@H](CCO)C1 Amb27204910 [0,1,0,1,0,0|0,0,0]=2 6405 B9R1.7 O=C1C=CC(CCO)C1 Amb27256296 [0,1,0,1,0,0|0,0,1]=3 6406 B9R1.7 O=C1C=CC(CCO)O1 Amb18832646 [0,1,0,1,0,0|1,0,1]=4 6407 B9R1.7 O=C1C=CC(CCO)S1 Amb28143598 [0,1,0,1,0,0|1,0,1]=4 6408 B9R1.7 O=C1C=C[C@H](CCO)O1 Amb27486246 [0,1,0,1,0,0|1,0,1]=4 6409 B9R1.7 O=C1CC(CCO)CN1 Amb23598230 [0,1,0,1,0,0|1,0,1]=4 6410 B9R1.7 O=C1CCC(CCBr)C1 Amb27592180 [0,1,0,1,0,0|1,0,1]=4 6411 B9R1.7 O=C1CCC(CCBr)O1 Amb27657784 [0,1,0,1,0,0|2,0,0]=4 6412 B9R1.7 O=C1CCC(CCO)N1 Amb8392541 [0,1,0,1,0,0|1,0,0]=3 6413 B9R1.7 O=C1CCC(CCS)O1 Amb28285189 [0,1,0,1,0,0|1,1,0]=4 6414 B9R1.7 O=C1CC[C@@H](CCO)N1 Amb24761403 [0,1,0,1,0,0|1,0,0]=3 6415 B9R1.7 O=C1CC[C@H](CCBr)O1 Amb27791548 [0,1,0,1,0,0|2,0,0]=4 6416 B9R1.7 O=C1CC[C@H](CCO)N1 Amb26403176 [0,1,0,1,0,0|1,0,0]=3 6417 B9R1.7 O=C1NCC(CCO)N1 Amb26597295 [0,1,0,1,0,0|2,0,0]=4 6418 B9R1.7 OCCC1C=CC(O)C1 Amb27486502 [0,1,0,1,0,0|0,0,0]=2 6419 B9R1.7 OCC[C@@H]1CC[C@H](O)C1 Amb28070933 [0,1,0,1,0,0|0,0,2]=4 6420 B9R1.7 OCC[C@@H]1CNC(=S)O1 Amb28315502 [0,1,0,1,0,0|2,0,0]=4 6421 B9R1.8 BrCC=C1CCCCC1 Amb27841870 [0,1,0,1,0,0|2,0,0]=4 6422 B9R1.8 BrCC=C1CCOCC1 Amb27858686 [0,1,0,1,0,0|2,0,0]=4 6423 B9R1.8 BrCCC1=CCCCC1 Amb26032382 [0,1,0,1,0,0|1,0,0]=3 6424 B9R1.8 BrCCC1=COCCC1 Amb33335769 [0,1,0,1,0,0|1,0,1]=4 6425 B9R1.8 BrCCC1CC=CCC1 Amb24711406 [0,1,0,1,0,0|1,0,0]=3 6426 B9R1.8 BrCCC1CCCCO1 Amb24480305 [0,1,0,1,0,0|0,0,2]=4 6427 B9R1.8 BrCCC1OCCCO1 Amb3940418 [0,1,0,1,0,0|1,0,1]=4 6428 B9R1.8 Br\C=C\C1CC=CCC1 Amb33134827 [0,1,0,1,0,0|1,0,1]=4 6429 B9R1.8 C#CCC1CC=CCC1 Amb33203478 [0,1,0,1,0,0|1,0,0]=3 6430 B9R1.8 C=CCC1=CCCCC1 Amb26318373 [0,1,0,1,0,0|1,0,1]=4 6431 B9R1.8 CCCC1=NCCCC1 Amb27266018 [0,1,0,1,0,0|1,0,1]=4 6432 B9R1.8 CCCC1=NCCCS1 Amb27830709 [0,1,0,1,0,0|0,1,1]=4 6433 B9R1.8 CCCC1C=CCCC1 Amb27644637 [0,1,0,1,0,0|1,0,0]=3 6434 B9R1.8 CCCC1CC=CCN1 Amb27195040 [0,1,0,1,0,0|2,0,0]=4 6435 B9R1.8 CCCC1CCC=CO1 Amb27423642 [0,1,0,1,0,0|1,0,0]=3 6436 B9R1.8 CCCC1CNCCO1 Amb22059500 [0,1,0,1,0,0|0,0,2]=4 6437 B9R1.8 CCCN1CC=CCC1 Amb32455985 [0,1,0,1,0,0|1,0,0]=3 6438 B9R1.8 CCCN1CCCOC1 Amb27628068 [0,1,0,1,0,0|1,0,1]=4 6439 B9R1.8 CCC[C@@H]1CNCCO1 Amb27974093 [0,1,0,1,0,0|0,0,2]=4 6440 B9R1.8 CCC[C@H]1CNCCO1 Amb28385328 [0,1,0,1,0,0|0,0,2]=4 6441 B9R1.8 CCNC1CC=CCC1 Amb27648453 [0,1,0,1,0,0|1,0,0]=3 6442 B9R1.8 CCNC1CCCOC1 Amb27837490 [0,1,0,1,0,0|1,0,1]=4 6443 B9R1.8 CCNC1CCCOC1 Amb28934972 [0,1,0,1,0,0|1,0,1]=4 6444 B9R1.8 CCOC1=CCCCC1 Amb8471211 [0,1,0,1,0,0|1,0,0]=3 6445 B9R1.8 CCOC1=COCCO1 Amb27827629 [0,1,0,1,0,0|1,0,0]=3 6446 B9R1.8 CCOC1=NCCCC1 Amb19889297 [0,1,0,1,0,0|1,0,1]=4 6447 B9R1.8 CCOC1=NCCCN1 Amb27181190 [0,1,0,1,0,0|2,0,0]=4 6448 B9R1.8 CCOC1CCC=CO1 Amb6600548 [0,1,0,1,0,0|2,0,0]=4 6449 B9R1.8 CCOC1CCCCO1 Amb4016388 [0,1,0,1,0,0|0,0,2]=4 6450 B9R1.8 CCOC1CNCCO1 Amb25146119 [0,1,0,1,0,0|1,0,1]=4 6451 B9R1.8 CCSC1=NCCCN1 Amb25715885 [0,1,0,1,0,0|2,0,0]=4 6452 B9R1.8 CNCC1=CCCCC1 Amb28246319 [0,1,0,1,0,0|1,0,0]=3 6453 B9R1.8 CNCC1=CCCOC1 Amb24329063 [0,1,0,1,0,0|2,0,0]=4 6454 B9R1.8 CNCC1=COCCC1 Amb26568553 [0,1,0,1,0,0|1,0,1]=4 6455 B9R1.8 CNCC1=COCCO1 Amb29866239 [0,1,0,1,0,0|1,0,0]=3 6456 B9R1.8 CNCC1CC=CCC1 Amb6718986 [0,1,0,1,0,0|1,0,0]=3 6457 B9R1.8 CNCC1CCCCO1 Amb8503254 [0,1,0,1,0,0|0,0,2]=4 6458 B9R1.8 CNCC1CCCCO1 Amb9258705 [0,1,0,1,0,0|0,0,2]=4 6459 B9R1.8 CNCC1OCCCO1 Amb18663858 [0,1,0,1,0,0|1,0,1]=4 6460 B9R1.8 COC=C1CCOCC1 Amb28285266 [0,1,0,1,0,0|2,0,0]=4 6461 B9R1.8 COCC1=CCNCC1 Amb27592399 [0,1,0,1,0,0|2,0,0]=4 6462 B9R1.8 COCC1=CCNCC1 Amb33292470 [0,1,0,1,0,0|2,0,0]=4 6463 B9R1.8 COCC1=NCCCN1 Amb27424640 [0,1,0,1,0,0|2,0,0]=4 6464 B9R1.8 COCC1CCCCC1 Amb27858995 [0,1,0,1,0,0|0,0,2]=4 6465 B9R1.8 COCC1CCCNC1 Amb2140573 [0,1,0,1,0,0|1,0,1]=4 6466 B9R1.8 COCC1CCCNC1 Amb9719115 [0,1,0,1,0,0|1,0,1]=4 6467 B9R1.8 COCC1CCNCC1 Amb2235515 [0,1,0,1,0,0|1,0,1]=4 6468 B9R1.8 COCC1CCNCC1 Amb33528889 [0,1,0,1,0,0|1,0,1]=4 6469 B9R1.8 COC[C@@H]1CCCNC1 Amb34158327 [0,1,0,1,0,0|1,0,1]=4 6470 B9R1.8 COC[C@H]1CCCNC1 Amb34155960 [0,1,0,1,0,0|1,0,1]=4 6471 B9R1.8 C\C=C\C1=NCCCC1 Amb27435806 [0,1,0,1,0,0|1,0,1]=4 6472 B9R1.8 C\C=C\C1OCCCO1 Amb17334099 [0,1,0,1,0,0|0,0,2]=4 6473 B9R1.8 ClCCC1=NCCCN1 Amb26629241 [0,1,0,1,0,0|2,0,0]=4 6474 B9R1.8 ClCCC1=NCCCN1 Amb33072446 [0,1,0,1,0,0|2,0,0]=4 6475 B9R1.8 ClCCC1C=CCCC1 Amb17672831 [0,1,0,1,0,0|1,0,0]=3 6476 B9R1.8 ClCCC1CCCCO1 Amb27168293 [0,1,0,1,0,0|0,0,2]=4 6477 B9R1.8 ClCCC1OCCCO1 Amb26613554 [0,1,0,1,0,0|1,0,1]=4 6478 B9R1.8 ICCC1CCCCO1 Amb35655392 [0,1,0,1,0,0|0,0,2]=4 6479 B9R1.8 N#CCC1=CCCCC1 Amb2686628 [0,1,0,1,0,0|1,0,1]=4 6480 B9R1.8 N#CCC1C=CCCC1 Amb18642023 [0,1,0,1,0,0|1,0,1]=4 6481 B9R1.8 N#CCC1CC=CCC1 Amb18642018 [0,1,0,1,0,0|1,0,0]=3 6482 B9R1.8 N#CNC1CC=CCC1 Amb27790571 [0,1,0,1,0,0|1,0,1]=4 6483 B9R1.8 N#C\C=C1\CCCOC1 Amb27391587 [0,1,0,1,0,0|1,0,1]=4 6484 B9R1.8 NCC=C1CCCCC1 Amb17605580 [0,1,0,1,0,0|2,0,0]=4 6485 B9R1.8 NCC=C1CCSCC1 Amb27438417 [0,1,0,1,0,0|2,0,0]=4 6486 B9R1.8 NCC=C1CCSCC1 Amb33483611 [0,1,0,1,0,0|2,0,0]=4 6487 B9R1.8 NCCC1=CCCCC1 Amb3939984 [0,1,0,1,0,0|1,0,0]=3 6488 B9R1.8 NCCC1=CCCOC1 Amb27873995 [0,1,0,1,0,0|2,0,0]=4 6489 B9R1.8 NCCC1=CCNCC1 Amb27860430 [0,1,0,1,0,0|2,0,0]=4 6490 B9R1.8 NCCC1=CCOCC1 Amb25078353 [0,1,0,1,0,0|2,0,0]=4 6491 B9R1.8 NCCC1=CCOCC1 Amb30585218 [0,1,0,1,0,0|2,0,0]=4 6492 B9R1.8 NCCC1=COCCC1 Amb26588888 [0,1,0,1,0,0|1,0,1]=4 6493 B9R1.8 NCCC1=NCCCN1 Amb27209828 [0,1,0,1,0,0|2,0,0]=4 6494 B9R1.8 NCCC1=NCCCS1 Amb28051709 [0,1,0,1,0,0|1,1,0]=4 6495 B9R1.8 NCCC1C=CCCC1 Amb25707655 [0,1,0,1,0,0|1,0,0]=3 6496 B9R1.8 NCCC1CC=CCC1 Amb26355165 [0,1,0,1,0,0|1,0,0]=3 6497 B9R1.8 NCCC1CC=CCC1 Amb32434790 [0,1,0,1,0,0|1,0,0]=3 6498 B9R1.8 NCCC1CCC=CO1 Amb25743698 [0,1,0,1,0,0|1,0,0]=3 6499 B9R1.8 NCCC1CCCCO1 Amb10067654 [0,1,0,1,0,0|0,0,2]=4 6500 B9R1.8 NCCC1CCCCO1 Amb2607669 [0,1,0,1,0,0|0,0,2]=4 6501 B9R1.8 NCCC1OCCCO1 Amb17226715 [0,1,0,1,0,0|1,0,1]=4 6502 B9R1.8 NCCN1CC=CCC1 Amb18636668 [0,1,0,1,0,0|1,0,0]=3 6503 B9R1.8 NCCN1CC=CCC1 Amb28935015 [0,1,0,1,0,0|1,0,0]=3 6504 B9R1.8 NCCN1CCCCO1 Amb22886181 [0,1,0,1,0,0|1,0,1]=4 6505 B9R1.8 NCCN1CCCCO1 Amb8010469 [0,1,0,1,0,0|1,0,1]=4 6506 B9R1.8 NNCC1CC=CCC1 Amb24501458 [0,1,0,1,0,0|1,0,0]=3 6507 B9R1.8 NOCC1CC=CCC1 Amb33316325 [0,1,0,1,0,0|0,0,0]=2 6508 B9R1.8 NOCC1CCCCC1 Amb10976085 [0,1,0,1,0,0|0,0,2]=4 6509 B9R1.8 NOCC1CCCOC1 Amb33079004 [0,1,0,1,0,0|1,0,1]=4 6510 B9R1.8 NOCC1CCCSC1 Amb33224513 [0,1,0,1,0,0|1,0,1]=4 6511 B9R1.8 NOCC1CCOCC1 Amb24477835 [0,1,0,1,0,0|1,0,1]=4 6512 B9R1.8 NOCC1CCSCC1 Amb27613139 [0,1,0,1,0,0|1,0,1]=4 6513 B9R1.8 O=C=NC1CC=CCC1 Amb19148065 [0,1,0,1,0,0|0,0,2]=4 6514 B9R1.8 O=CCC1=CCCCC1 Amb17593283 [0,1,0,1,0,0|1,0,1]=4 6515 B9R1.8 O=CCC1CC=CCC1 Amb18642222 [0,1,0,1,0,0|0,0,1]=3 6516 B9R1.8 OCC=C1CCCCC1 Amb25783847 [0,1,0,1,0,0|2,0,0]=4 6517 B9R1.8 OCC=C1CCNCC1 Amb33465522 [0,1,0,1,0,0|2,0,0]=4 6518 B9R1.8 OCC=C1CCNCC1 Amb33465523 [0,1,0,1,0,0|2,0,0]=4 6519 B9R1.8 OCC=C1CCOCC1 Amb25994306 [0,1,0,1,0,0|2,0,0]=4 6520 B9R1.8 OCC=C1SCCCS1 Amb28315539 [0,1,0,1,0,0|1,1,0]=4 6521 B9R1.8 OCCC1=CCCCC1 Amb17593322 [0,1,0,1,0,0|1,0,0]=3 6522 B9R1.8 OCCC1=CCCCO1 Amb25266822 [0,1,0,1,0,0|0,0,0]=2 6523 B9R1.8 OCCC1=CCOCC1 Amb26022368 [0,1,0,1,0,0|0,0,2]=4 6524 B9R1.8 OCCC1=COCCC1 Amb32944531 [0,1,0,1,0,0|0,0,2]=4 6525 B9R1.8 OCCC1=CSCCS1 Amb28455291 [0,1,0,1,0,0|1,0,1]=4 6526 B9R1.8 OCCC1=NCCCN1 Amb28240607 [0,1,0,1,0,0|2,0,0]=4 6527 B9R1.8 OCCC1C=CCCC1 Amb17593314 [0,1,0,1,0,0|0,0,0]=2 6528 B9R1.8 OCCC1C=COCO1 Amb28049220 [0,1,0,1,0,0|1,0,0]=3 6529 B9R1.8 OCCC1CC=CCC1 Amb17593319 [0,1,0,1,0,0|0,0,0]=2 6530 B9R1.8 OCCC1CCC=CO1 Amb24481996 [0,1,0,1,0,0|0,0,0]=2 6531 B9R1.8 OCCC1CCCCC1 Amb3939314 [0,1,0,1,0,0|0,0,2]=4 6532 B9R1.8 OCCC1CCCCN1 Amb22492461 [0,1,0,1,0,0|0,0,2]=4 6533 B9R1.8 OCCC1CCCCN1 Amb9702818 [0,1,0,1,0,0|0,0,2]=4 6534 B9R1.8 OCCC1CCCCO1 Amb5846625 [0,1,0,1,0,0|0,0,2]=4 6535 B9R1.8 OCCC1CCCNC1 Amb19308093 [0,1,0,1,0,0|0,0,2]=4 6536 B9R1.8 OCCC1CCCNC1 Amb2694770 [0,1,0,1,0,0|0,0,2]=4 6537 B9R1.8 OCCC1CCCOC1 Amb33544109 [0,1,0,1,0,0|0,0,2]=4 6538 B9R1.8 OCCC1CCCSC1 Amb18202274 [0,1,0,1,0,0|0,0,2]=4 6539 B9R1.8 OCCC1CCNCC1 Amb22234816 [0,1,0,1,0,0|0,0,2]=4 6540 B9R1.8 OCCC1CCNCC1 Amb2690382 [0,1,0,1,0,0|0,0,2]=4 6541 B9R1.8 OCCC1CCOCC1 Amb6572393 [0,1,0,1,0,0|0,0,2]=4 6542 B9R1.8 OCCC1CCOCO1 Amb28429878 [0,1,0,1,0,0|1,0,1]=4 6543 B9R1.8 OCCC1CCSCC1 Amb18831400 [0,1,0,1,0,0|0,0,2]=4 6544 B9R1.8 OCCC1CNCCN1 Amb20241013 [0,1,0,1,0,0|1,0,1]=4 6545 B9R1.8 OCCC1CNCCN1 Amb2696390 [0,1,0,1,0,0|1,0,1]=4 6546 B9R1.8 OCCC1CNCCN1 Amb33321526 [0,1,0,1,0,0|1,0,1]=4 6547 B9R1.8 OCCC1CNCCO1 Amb22228173 [0,1,0,1,0,0|1,0,1]=4 6548 B9R1.8 OCCC1CNCCO1 Amb8630774 [0,1,0,1,0,0|1,0,1]=4 6549 B9R1.8 OCCC1COCCN1 Amb21858855 [0,1,0,1,0,0|1,0,1]=4 6550 B9R1.8 OCCC1COCCN1 Amb22276154 [0,1,0,1,0,0|1,0,1]=4 6551 B9R1.8 OCCC1COCCO1 Amb25328496 [0,1,0,1,0,0|1,0,1]=4 6552 B9R1.8 OCCC1CSCCN1 Amb20667793 [0,1,0,1,0,0|1,0,1]=4 6553 B9R1.8 OCCC1NCCCS1 Amb27185552 [0,1,0,1,0,0|1,0,1]=4 6554 B9R1.8 OCCN1CCCCC1 Amb2793063 [0,1,0,1,0,0|0,0,2]=4 6555 B9R1.8 OCCN1CCCCO1 Amb22886802 [0,1,0,1,0,0|1,0,1]=4 6556 B9R1.8 OCCN1CCNCC1 Amb932811 [0,1,0,1,0,0|1,0,1]=4 6557 B9R1.8 OCCN1CCOCC1 Amb535388 [0,1,0,1,0,0|1,0,1]=4 6558 B9R1.8 OCCN1CCSCC1 Amb6307185 [0,1,0,1,0,0|1,0,1]=4 6559 B9R1.8 OCC[C@@H]1CCCCN1 Amb22168885 [0,1,0,1,0,0|0,0,2]=4 6560 B9R1.8 OCC[C@@H]1CCCCN1 Amb8628480 [0,1,0,1,0,0|0,0,2]=4 6561 B9R1.8 OCC[C@@H]1CNCCN1 Amb22288654 [0,1,0,1,0,0|1,0,1]=4 6562 B9R1.8 OCC[C@@H]1CNCCN1 Amb27776309 [0,1,0,1,0,0|1,0,1]=4 6563 B9R1.8 OCC[C@@H]1COCCN1 Amb20242174 [0,1,0,1,0,0|1,0,1]=4 6564 B9R1.8 OCC[C@H]1CCCCN1 Amb17619440 [0,1,0,1,0,0|0,0,2]=4 6565 B9R1.8 OCC[C@H]1CCCCN1 Amb33788981 [0,1,0,1,0,0|0,0,2]=4 6566 B9R1.8 OCC[C@H]1CCCNC1 Amb26629279 [0,1,0,1,0,0|0,0,2]=4 6567 B9R1.8 OCC[C@H]1CNCCN1 Amb15692003 [0,1,0,1,0,0|1,0,1]=4 6568 B9R1.8 OCC[C@H]1CNCCN1 Amb22265555 [0,1,0,1,0,0|1,0,1]=4 6569 B9R1.8 OCC[C@H]1COCCN1 Amb20242185 [0,1,0,1,0,0|1,0,1]=4 6570 B9R1.8 OCC[C@H]1COCCN1 Amb20242980 [0,1,0,1,0,0|1,0,1]=4 6571 B9R1.8 OC\C=C1\CSCCN1 Amb27215466 [0,1,0,1,0,0|2,0,0]=4 6572 B9R1.8 ONCC1CC=CCC1 Amb24529066 [0,1,0,1,0,0|0,0,0]=2 6573 B9R1.8 ONCC1CCCCC1 Amb25251761 [0,1,0,1,0,0|0,0,2]=4 6574 B9R1.8 ONCC1CCCNC1 Amb27249317 [0,1,0,1,0,0|1,0,1]=4 6575 B9R1.8 ONCC1CCCOC1 Amb25084814 [0,1,0,1,0,0|1,0,1]=4 6576 B9R1.8 ONCC1CCCSC1 Amb26652449 [0,1,0,1,0,0|1,0,1]=4 6577 B9R1.8 ONCC1CCOCC1 Amb25736560 [0,1,0,1,0,0|1,0,1]=4 6578 B9R1.8 SCCC1=COCCC1 Amb33319968 [0,1,0,1,0,0|1,0,1]=4 6579 B9R1.8 SCCC1CC=CCC1 Amb33318637 [0,1,0,1,0,0|0,1,0]=3 6580 B9R1.8 SCCC1CCCCO1 Amb33377389 [0,1,0,1,0,0|0,0,2]=4 6581 B9R1.8 SCCC1OCCCO1 Amb27200333 [0,1,0,1,0,0|1,0,1]=4 6582 B9R1.8 [C-]#[N+]CC1CC=CCC1 Amb33314395 [0,1,0,1,0,0|1,0,0]=3 6583 B9R1.9 CC1CC(CCCO)C1 Amb23456207 [0,1,0,1,0,0|0,0,2]=4 6584 B9R1.9 CCCCC1=CC(=O)C1 Amb28199849 [0,1,0,1,0,0|1,0,1]=4 6585 B9R1.9 CCCCC1CC(O)C1 Amb27956599 [0,1,0,1,0,0|0,0,2]=4 6586 B9R1.9 CCCSC1CC(O)C1 Amb32753276 [0,1,0,1,0,0|1,0,1]=4 6587 B9R1.9 CCCS[C@H]1C[C@@H](O)C1 Amb32674541 [0,1,0,1,0,0|1,0,1]=4 6588 B9R1.9 CCNCC1CC(O)C1 Amb27423766 [0,1,0,1,0,0|1,0,1]=4 6589 B9R1.9 OCCCN1CC(O)C1 Amb27837478 [0,1,0,1,0,0|1,0,1]=4 6590 B9R1.12 BrCCCC1=CCCC1 Amb24415910 [0,1,0,1,0,0|1,0,0]=3 6591 B9R1.12 BrCCCC1CCCO1 Amb18324625 [0,1,0,1,0,0|0,0,2]=4 6592 B9R1.12 BrCCC[C@@H]1CCCO1 Amb32688086 [0,1,0,1,0,0|0,0,2]=4 6593 B9R1.12 BrCCC[C@H]1CCCO1 Amb32688084 [0,1,0,1,0,0|0,0,2]=4 6594 B9R1.12 BrCCSC1C=CCS1 Amb27405116 [0,1,0,1,0,0|2,0,0]=4 6595 B9R1.12 BrC\C=C\C1CCCC1 Amb28057257 [0,1,0,1,0,0|2,0,0]=4 6596 B9R1.12 C#CCCC1C=CCN1 Amb28137723 [0,1,0,1,0,0|2,0,0]=4 6597 B9R1.12 C#CCNC1C=CCC1 Amb35672227 [0,1,0,1,0,0|1,0,1]=4 6598 B9R1.12 C=CCCC1=CCCO1 Amb35680300 [0,1,0,1,0,0|1,0,1]=4 6599 B9R1.12 C=CCCC1=COCC1 Amb35680301 [0,1,0,1,0,0|1,0,1]=4 6600 B9R1.12 C=CCNC1C=CCC1 Amb35713400 [0,1,0,1,0,0|1,0,1]=4 6601 B9R1.12 CCC#CC1OCCO1 Amb24741178 [0,1,0,1,0,0|0,0,2]=4 6602 B9R1.12 CCCCC1=CCCC1 Amb22227915 [0,1,0,1,0,0|1,0,0]=3 6603 B9R1.12 CCCCC1=NCCC1 Amb24053774 [0,1,0,1,0,0|1,0,1]=4 6604 B9R1.12 CCCCC1=NCCN1 Amb27639210 [0,1,0,1,0,0|2,0,0]=4 6605 B9R1.12 CCCCC1=NCCO1 Amb27244810 [0,1,0,1,0,0|1,0,1]=4 6606 B9R1.12 CCCCC1=NCCS1 Amb26872627 [0,1,0,1,0,0|2,0,0]=4 6607 B9R1.12 CCCCC1C=CCN1 Amb10608225 [0,1,0,1,0,0|2,0,0]=4 6608 B9R1.12 CCCCC1C=CCN1 Amb22587190 [0,1,0,1,0,0|2,0,0]=4 6609 B9R1.12 CCCCC1CCCO1 Amb25238477 [0,1,0,1,0,0|0,0,2]=4 6610 B9R1.12 CCCCC1OCCO1 Amb28364546 [0,1,0,1,0,0|0,0,2]=4 6611 B9R1.12 CCCCN1CCCO1 Amb28049539 [0,1,0,1,0,0|0,0,2]=4 6612 B9R1.12 CCCC[N+]1=CSCC1 Amb28315749 [0,1,0,1,0,0|2,0,0]=4 6613 B9R1.12 CCCNC1C=CCC1 Amb35672230 [0,1,0,1,0,0|1,0,0]=3 6614 B9R1.12 CCNCC1=CCSC1 Amb35743804 [0,1,0,1,0,0|2,0,0]=4 6615 B9R1.12 CCNCC1=COCC1 Amb28073542 [0,1,0,1,0,0|2,0,0]=4 6616 B9R1.12 CCNCC1CCCO1 Amb10610065 [0,1,0,1,0,0|0,0,2]=4 6617 B9R1.12 CCNCC1CCCO1 Amb9712607 [0,1,0,1,0,0|0,0,2]=4 6618 B9R1.12 CCNCC1CCOC1 Amb32410098 [0,1,0,1,0,0|1,0,1]=4 6619 B9R1.12 CCNCC1CCOC1 Amb9721559 [0,1,0,1,0,0|1,0,1]=4 6620 B9R1.12 CCNCC1OCCO1 Amb28322917 [0,1,0,1,0,0|1,0,1]=4 6621 B9R1.12 CCOCC1CCCO1 Amb4034438 [0,1,0,1,0,0|0,0,2]=4 6622 B9R1.12 CCOCC1OCCO1 Amb27830509 [0,1,0,1,0,0|1,0,1]=4 6623 B9R1.12 CC\C=C\C1=NCCC1 Amb24563609 [0,1,0,1,0,0|1,0,0]=3 6624 B9R1.12 CC\C=C\C1CCCC1 Amb27267419 [0,1,0,1,0,0|1,0,0]=3 6625 B9R1.12 CC\C=C\C1CCCN1 Amb32954065 [0,1,0,1,0,0|1,0,0]=3 6626 B9R1.12 CC\C=C\C1CCNC1 Amb33474220 [0,1,0,1,0,0|1,0,0]=3 6627 B9R1.12 CC\C=C\C1OCCO1 Amb24359824 [0,1,0,1,0,0|0,0,0]=2 6628 B9R1.12 CC\C=C\N1CCCC1 Amb22266071 [0,1,0,1,0,0|1,0,0]=3 6629 B9R1.12 CNCCC1=CCCC1 Amb27603103 [0,1,0,1,0,0|1,0,1]=4 6630 B9R1.12 CNCCC1CCCO1 Amb18300050 [0,1,0,1,0,0|0,0,2]=4 6631 B9R1.12 CNCCC1CCCO1 Amb33553009 [0,1,0,1,0,0|0,0,2]=4 6632 B9R1.12 COCCC1=CC=CC1 Amb27806849 [0,1,0,1,0,0|0,0,2]=4 6633 B9R1.12 COCCC1C=CCN1 Amb27838554 [0,1,0,1,0,0|1,0,0]=3 6634 B9R1.12 COCCC1CC=CC1 Amb30031560 [0,1,0,1,0,0|0,0,2]=4 6635 B9R1.12 COCCC1CCCN1 Amb17436678 [0,1,0,1,0,0|1,0,1]=4 6636 B9R1.12 COCCC1CCNC1 Amb21959195 [0,1,0,1,0,0|1,0,1]=4 6637 B9R1.12 COCC[C@@H]1CCCN1 Amb26917553 [0,1,0,1,0,0|1,0,1]=4 6638 B9R1.12 CO\N=C\C1CCOC1 Amb27837662 [0,1,0,1,0,0|2,0,0]=4 6639 B9R1.12 ClCCCC1=CCCC1 Amb25689736 [0,1,0,1,0,0|1,0,0]=3 6640 B9R1.12 ClCCCC1CCCO1 Amb27852668 [0,1,0,1,0,0|0,0,2]=4 6641 B9R1.12 ClCCC[C@@H]1CCCO1 Amb32688085 [0,1,0,1,0,0|0,0,2]=4 6642 B9R1.12 ClCCC[C@H]1CCCO1 Amb32688083 [0,1,0,1,0,0|0,0,2]=4 6643 B9R1.12 ClCCNC1=NCCC1 Amb10976568 [0,1,0,1,0,0|2,0,0]=4 6644 B9R1.12 ClC\C=C\C1CCCC1 Amb27410192 [0,1,0,1,0,0|2,0,0]=4 6645 B9R1.12 FCCNC1C=CCC1 Amb35713401 [0,1,0,1,0,0|1,0,0]=3 6646 B9R1.12 N#CCCN1C=CCC1 Amb27646673 [0,1,0,1,0,0|1,0,1]=4 6647 B9R1.12 N#CCNC1C=CCC1 Amb35713399 [0,1,0,1,0,0|1,0,1]=4 6648 B9R1.12 N#C\C=C\C1CCCO1 Amb27185671 [0,1,0,1,0,0|1,0,1]=4 6649 B9R1.12 N#C\C=C\C1CCOC1 Amb27196333 [0,1,0,1,0,0|1,0,1]=4 6650 B9R1.12 NCCC=C1CCCC1 Amb27248131 [0,1,0,1,0,0|1,0,0]=3 6651 B9R1.12 NCCCC1C=CCC1 Amb26386566 [0,1,0,1,0,0|1,0,0]=3 6652 B9R1.12 NCCCC1CCCO1 Amb18301442 [0,1,0,1,0,0|0,0,2]=4 6653 B9R1.12 NCCC[C@@H]1CCCO1 Amb33620903 [0,1,0,1,0,0|0,0,2]=4 6654 B9R1.12 NCCC[C@@H]1CCCO1 Amb33747126 [0,1,0,1,0,0|0,0,2]=4 6655 B9R1.12 NCCC[C@H]1CCCO1 Amb33620902 [0,1,0,1,0,0|0,0,2]=4 6656 B9R1.12 NCCC[C@H]1CCCO1 Amb33736454 [0,1,0,1,0,0|0,0,2]=4 6657 B9R1.12 NCCNC1C=CCC1 Amb30008520 [0,1,0,1,0,0|1,0,0]=3 6658 B9R1.12 NCCOB1CCCO1 Amb27597284 [0,1,0,1,0,0|2,0,0]=4 6659 B9R1.12 NCCOC1CCCO1 Amb18203179 [0,1,0,1,0,0|1,0,1]=4 6660 B9R1.12 NCC\C=C1\CCSC1 Amb27867188 [0,1,0,1,0,0|2,0,0]=4 6661 B9R1.12 NC\C=C\C1CCCC1 Amb27869342 [0,1,0,1,0,0|2,0,0]=4 6662 B9R1.12 NC\C=C\C1CCCO1 Amb33449857 [0,1,0,1,0,0|1,0,0]=3 6663 B9R1.12 NC\C=C\C1CCCS1 Amb33414473 [0,1,0,1,0,0|1,1,0]=4 6664 B9R1.12 NC\C=C\C1CCOC1 Amb33429161 [0,1,0,1,0,0|1,0,0]=3 6665 B9R1.12 NC\C=C\C1CCSC1 Amb33080075 [0,1,0,1,0,0|1,1,0]=4 6666 B9R1.12 NOCCC1CCCC1 Amb27617248 [0,1,0,1,0,0|0,0,2]=4 6667 B9R1.12 NOCCC1CCCO1 Amb25269925 [0,1,0,1,0,0|1,0,1]=4 6668 B9R1.12 NOCCC1CCCS1 Amb33415856 [0,1,0,1,0,0|1,0,1]=4 6669 B9R1.12 NOCCC1CCOC1 Amb24538931 [0,1,0,1,0,0|1,0,1]=4 6670 B9R1.12 NOCCC1CCSC1 Amb33141529 [0,1,0,1,0,0|1,0,1]=4 6671 B9R1.12 O=C=NCC1C=CCC1 Amb24481865 [0,1,0,1,0,0|0,0,2]=4 6672 B9R1.12 O=C\C=C\C1CCCO1 Amb26992295 [0,1,0,1,0,0|1,0,1]=4 6673 B9R1.12 O=C\C=C\C1CCOC1 Amb33079631 [0,1,0,1,0,0|1,0,1]=4 6674 B9R1.12 OCCCC1=CCCC1 Amb24457013 [0,1,0,1,0,0|0,0,0]=2 6675 B9R1.12 OCCCC1=NCCC1 Amb24558706 [0,1,0,1,0,0|0,0,1]=3 6676 B9R1.12 OCCCC1CC=CC1 Amb28315438 [0,1,0,1,0,0|0,0,2]=4 6677 B9R1.12 OCCCC1CCCC1 Amb3939088 [0,1,0,1,0,0|0,0,2]=4 6678 B9R1.12 OCCCC1CCCN1 Amb8630848 [0,1,0,1,0,0|0,0,2]=4 6679 B9R1.12 OCCCC1CCCO1 Amb17939196 [0,1,0,1,0,0|0,0,2]=4 6680 B9R1.12 OCCCC1CCCS1 Amb33416795 [0,1,0,1,0,0|0,0,2]=4 6681 B9R1.12 OCCCC1CCNC1 Amb24674180 [0,1,0,1,0,0|0,0,2]=4 6682 B9R1.12 OCCCC1CCSC1 Amb33141523 [0,1,0,1,0,0|0,0,2]=4 6683 B9R1.12 OCCCC1CNC=N1 Amb28133730 [0,1,0,1,0,0|1,0,1]=4 6684 B9R1.12 OCCCC1OCCO1 Amb26873836 [0,1,0,1,0,0|1,0,1]=4 6685 B9R1.12 OCCCN1CCCC1 Amb8387818 [0,1,0,1,0,0|0,0,2]=4 6686 B9R1.12 OCCC[C@@H]1CCCN1 Amb25145987 [0,1,0,1,0,0|0,0,2]=4 6687 B9R1.12 OCCC[C@@H]1CCCN1 Amb33309673 [0,1,0,1,0,0|0,0,2]=4 6688 B9R1.12 OCCC[C@@H]1CCCO1 Amb27631987 [0,1,0,1,0,0|0,0,2]=4 6689 B9R1.12 OCCC[C@H]1CCCN1 Amb27879933 [0,1,0,1,0,0|0,0,2]=4 6690 B9R1.12 OCCC[C@H]1CCCN1 Amb33309582 [0,1,0,1,0,0|0,0,2]=4 6691 B9R1.12 OCCC[C@H]1CCCO1 Amb27617649 [0,1,0,1,0,0|0,0,2]=4 6692 B9R1.12 OCCCc1ccco1 Amb8860560 [0,1,0,1,0,0|0,0,2]=4 6693 B9R1.12 OCCCc1cccs1 Amb17089493 [0,1,0,1,0,0|0,0,2]=4 6694 B9R1.12 OCCCc1ccns1 Amb27787342 [0,1,0,1,0,0|1,0,1]=4 6695 B9R1.12 OCCCc1ccoc1 Amb26505336 [0,1,0,1,0,0|0,0,2]=4 6696 B9R1.12 OCCCc1ccon1 Amb28399013 [0,1,0,1,0,0|1,0,1]=4 6697 B9R1.12 OCCCc1ccsc1 Amb17605794 [0,1,0,1,0,0|0,0,2]=4 6698 B9R1.12 OCCCc1cnco1 Amb27833401 [0,1,0,1,0,0|1,0,1]=4 6699 B9R1.12 OCCCc1cncs1 Amb26017292 [0,1,0,1,0,0|1,0,1]=4 6700 B9R1.12 OCCCc1cnoc1 Amb3941163 [0,1,0,1,0,0|1,0,1]=4 6701 B9R1.12 OCCCc1cnsc1 Amb30017333 [0,1,0,1,0,0|1,0,1]=4 6702 B9R1.12 OCCCc1cnsn1 Amb27785943 [0,1,0,1,0,0|2,0,0]=4 6703 B9R1.12 OCCCc1cocn1 Amb27762837 [0,1,0,1,0,0|1,0,1]=4 6704 B9R1.12 OCCCc1cscn1 Amb24099813 [0,1,0,1,0,0|1,0,1]=4 6705 B9R1.12 OCCCc1csnn1 Amb24700420 [0,1,0,1,0,0|2,0,0]=4 6706 B9R1.12 OCCCc1nccs1 Amb25887194 [0,1,0,1,0,0|1,0,1]=4 6707 B9R1.12 OCCCn1cccc1 Amb17593298 [0,1,0,1,0,0|0,0,2]=4 6708 B9R1.12 OCCCn1cccn1 Amb33531607 [0,1,0,1,0,0|1,0,1]=4 6709 B9R1.12 OCCCn1ccnc1 Amb11012596 [0,1,0,1,0,0|1,0,1]=4 6710 B9R1.12 OCCCn1ccnc1 Amb33531544 [0,1,0,1,0,0|1,0,1]=4 6711 B9R1.12 OCCNC1=NCCC1 Amb10976567 [0,1,0,1,0,0|1,0,1]=4 6712 B9R1.12 OCCNC1=NCCN1 Amb576326 [0,1,0,1,0,0|2,0,0]=4 6713 B9R1.12 OCCNC1CCCC1 Amb10609474 [0,1,0,1,0,0|0,0,2]=4 6714 B9R1.12 OCCNC1CCCC1 Amb6707359 [0,1,0,1,0,0|0,0,2]=4 6715 B9R1.12 OCCN[C@@H]1CCNC1 Amb28325934 [0,1,0,1,0,0|1,0,1]=4 6716 B9R1.12 OCCN[C@H]1CCNC1 Amb29892386 [0,1,0,1,0,0|1,0,1]=4 6717 B9R1.12 OCCOC1CCCC1 Amb6893052 [0,1,0,1,0,0|0,0,2]=4 6718 B9R1.12 OCCOC1CCCO1 Amb28315545 [0,1,0,1,0,0|1,0,1]=4 6719 B9R1.12 OCCOC1CCNC1 Amb23570376 [0,1,0,1,0,0|1,0,1]=4 6720 B9R1.12 OCCOC1CCNC1 Amb35753116 [0,1,0,1,0,0|1,0,1]=4 6721 B9R1.12 OCCOC1CCOC1 Amb25338417 [0,1,0,1,0,0|1,0,1]=4 6722 B9R1.12 OCCSC1=NCCS1 Amb26913368 [0,1,0,1,0,0|2,0,0]=4 6723 B9R1.12 OCCSC1CCCC1 Amb9362979 [0,1,0,1,0,0|0,0,2]=4 6724 B9R1.12 OCCSC1CCNC1 Amb18988573 [0,1,0,1,0,0|1,0,1]=4 6725 B9R1.12 OCCSC1CCSC1 Amb29863338 [0,1,0,1,0,0|1,0,1]=4 6726 B9R1.12 OC\C=C\C1CCCC1 Amb33428704 [0,1,0,1,0,0|2,0,0]=4 6727 B9R1.12 OC\C=C\C1CCCO1 Amb33226990 [0,1,0,1,0,0|1,0,0]=3 6728 B9R1.12 OC\C=C\C1CCCS1 Amb33414579 [0,1,0,1,0,0|1,1,0]=4 6729 B9R1.12 OC\C=C\C1CCOC1 Amb33359633 [0,1,0,1,0,0|1,0,0]=3 6730 B9R1.12 OC\C=C\C1CCSC1 Amb32953834 [0,1,0,1,0,0|1,1,0]=4 6731 B9R1.12 OC\C=C\C1OCCO1 Amb27484833 [0,1,0,1,0,0|1,0,0]=3 6732 B9R1.12 ONCCC1CCCC1 Amb27785800 [0,1,0,1,0,0|0,0,2]=4 6733 B9R1.12 SCCCC1CCCO1 Amb26321954 [0,1,0,1,0,0|0,0,2]=4 6734 B9R1.12 SCCNC1=NCCC1 Amb10976571 [0,1,0,1,0,0|2,0,0]=4 6735 B9R1.15 C=C1CCCCC1CC Amb27952112 [0,1,0,1,0,0|1,0,1]=4 6736 B9R1.15 C=C[C@@H]1CCC=C[C@@H]1O Amb28053736 [0,1,0,1,0,0|1,0,1]=4 6737 B9R1.15 CC1=C(CO)CCCC1 Amb27969811 [0,1,0,1,0,0|2,0,0]=4 6738 B9R1.15 CC1C=CCCC1CCl Amb27805564 [0,1,0,1,0,0|1,0,0]=3 6739 B9R1.15 CC1C=CCCC1CN Amb28046907 [0,1,0,1,0,0|1,0,0]=3 6740 B9R1.15 CC1CC=CCC1C=O Amb4034578 [0,1,0,1,0,0|0,0,2]=4 6741 B9R1.15 CC1CC=CCC1CO Amb3939090 [0,1,0,1,0,0|0,0,0]=2 6742 B9R1.15 CC1CCCCC1CO Amb25804856 [0,1,0,1,0,0|0,0,2]=4 6743 B9R1.15 CC1CCCNC1CO Amb22886363 [0,1,0,1,0,0|0,0,2]=4 6744 B9R1.15 CC1CCCNC1CO Amb32658045 [0,1,0,1,0,0|0,0,2]=4 6745 B9R1.15 CC1CCNCC1CO Amb24117064 [0,1,0,1,0,0|0,0,2]=4 6746 B9R1.15 CC1CNCCC1CO Amb27766043 [0,1,0,1,0,0|0,0,2]=4 6747 B9R1.15 CC1CNCCC1NO Amb28350547 [0,1,0,1,0,0|1,0,1]=4 6748 B9R1.15 CC1NCCCC1CO Amb22886280 [0,1,0,1,0,0|0,0,2]=4 6749 B9R1.15 CC1NCCNC1CO Amb32669056 [0,1,0,1,0,0|1,0,1]=4 6750 B9R1.15 CC1OCCNC1CO Amb24693650 [0,1,0,1,0,0|1,0,1]=4 6751 B9R1.15 CCC1=C(C)CCNC1 Amb24556041 [0,1,0,1,0,0|2,0,0]=4 6752 B9R1.15 CCC1=CCCCC1=O Amb27838623 [0,1,0,1,0,0|0,0,1]=3 6753 B9R1.15 CCC1=CCCCC1O Amb27808543 [0,1,0,1,0,0|0,0,0]=2 6754 B9R1.15 CCC1=NCCN=C1C Amb27794302 [0,1,0,1,0,0|2,0,0]=4 6755 B9R1.15 CCC1=[N+]([O-])CCCC1 Amb27201291 [0,1,0,1,0,0|0,0,2]=4 6756 B9R1.15 CCC1CC=CCC1N Amb27237513 [0,1,0,1,0,0|1,0,0]=3 6757 B9R1.15 CCC1CCCCC1=O Amb22002104 [0,1,0,1,0,0|1,0,1]=4 6758 B9R1.15 CCC1CCCCC1O Amb6608702 [0,1,0,1,0,0|0,0,2]=4 6759 B9R1.15 CCC1CCCCN1O Amb27483076 [0,1,0,1,0,0|0,0,2]=4 6760 B9R1.15 CCC1NCCCC1=O Amb19888368 [0,1,0,1,0,0|1,0,1]=4 6761 B9R1.15 CCC1NCCCC1=O Amb28055859 [0,1,0,1,0,0|1,0,1]=4 6762 B9R1.15 CCC1OCCCC1Br Amb27490966 [0,1,0,1,0,0|0,0,2]=4 6763 B9R1.15 CCN1CCCCC1=N Amb27242284 [0,1,0,1,0,0|2,0,0]=4 6764 B9R1.15 CC[C@@H]1C=CCC[C@H]1O Amb27632001 [0,1,0,1,0,0|0,0,0]=2 6765 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [0,1,0,1,0,0|1,0,1]=4 6766 B9R1.15 CC[C@@H]1CCCC[C@H]1O Amb24671850 [0,1,0,1,0,0|0,0,2]=4 6767 B9R1.15 CC[C@H]1CCCC[C@@H]1O Amb27852810 [0,1,0,1,0,0|0,0,2]=4 6768 B9R1.15 CC[C@H]1CCCC[C@H]1O Amb28061782 [0,1,0,1,0,0|0,0,2]=4 6769 B9R1.15 CN1CC=CCC1C#N Amb18642069 [0,1,0,1,0,0|1,0,1]=4 6770 B9R1.15 CN1CC=CCC1CO Amb27805167 [0,1,0,1,0,0|0,0,0]=2 6771 B9R1.15 CN1CCCCC1CO Amb607577 [0,1,0,1,0,0|0,0,2]=4 6772 B9R1.15 CN1CCCC[C@@H]1CO Amb22744972 [0,1,0,1,0,0|0,0,2]=4 6773 B9R1.15 CN1CCCC[C@H]1CO Amb26917816 [0,1,0,1,0,0|0,0,2]=4 6774 B9R1.15 CN1CCNCC1CO Amb17578109 [0,1,0,1,0,0|1,0,1]=4 6775 B9R1.15 CN1CCNCC1CO Amb22587293 [0,1,0,1,0,0|1,0,1]=4 6776 B9R1.15 CN1CCOCC1CO Amb27664360 [0,1,0,1,0,0|1,0,1]=4 6777 B9R1.15 CN1CCOCC1CO Amb30867931 [0,1,0,1,0,0|1,0,1]=4 6778 B9R1.15 CN1CCOC[C@@H]1CO Amb26026394 [0,1,0,1,0,0|1,0,1]=4 6779 B9R1.15 CN1CCOC[C@@H]1CO Amb34916358 [0,1,0,1,0,0|1,0,1]=4 6780 B9R1.15 CN1CCOC[C@H]1CO Amb28429680 [0,1,0,1,0,0|1,0,1]=4 6781 B9R1.15 CN1CCOC[C@H]1CO Amb33743375 [0,1,0,1,0,0|1,0,1]=4 6782 B9R1.15 CNC1=CCCCC1=O Amb25743372 [0,1,0,1,0,0|1,0,1]=4 6783 B9R1.15 CNC1C=CCCC1O Amb27954422 [0,1,0,1,0,0|0,0,0]=2 6784 B9R1.15 CNC1CCCCC1O Amb2607700 [0,1,0,1,0,0|0,0,2]=4 6785 B9R1.15 CNC1CNCCC1O Amb32753118 [0,1,0,1,0,0|1,0,1]=4 6786 B9R1.15 CN[C@@H]1CCCC[C@@H]1O Amb1993808 [0,1,0,1,0,0|0,0,2]=4 6787 B9R1.15 CN[C@@H]1CCCC[C@H]1O Amb1993807 [0,1,0,1,0,0|0,0,2]=4 6788 B9R1.15 CN[C@@H]1CCCC[C@H]1O Amb1993918 [0,1,0,1,0,0|0,0,2]=4 6789 B9R1.15 CN[C@H]1CCCC[C@@H]1O Amb5562396 [0,1,0,1,0,0|0,0,2]=4 6790 B9R1.15 CN[C@H]1CCCC[C@H]1O Amb2786031 [0,1,0,1,0,0|0,0,2]=4 6791 B9R1.15 CN[C@H]1CNCC[C@@H]1O Amb32657883 [0,1,0,1,0,0|1,0,1]=4 6792 B9R1.15 COC1=CCCCC1=O Amb22755964 [0,1,0,1,0,0|1,0,1]=4 6793 B9R1.15 COC1=CCCCC1O Amb26050792 [0,1,0,1,0,0|1,0,0]=3 6794 B9R1.15 COC1C=CCCC1O Amb27632601 [0,1,0,1,0,0|0,0,0]=2 6795 B9R1.15 COC1CCC=CC1N Amb27491501 [0,1,0,1,0,0|1,0,0]=3 6796 B9R1.15 COC1CCCCC1O Amb9283578 [0,1,0,1,0,0|0,0,2]=4 6797 B9R1.15 COC1CCNCC1C Amb22755833 [0,1,0,1,0,0|1,0,1]=4 6798 B9R1.15 COC1CCNCC1C Amb28934978 [0,1,0,1,0,0|1,0,1]=4 6799 B9R1.15 COC1CNCCC1O Amb24624663 [0,1,0,1,0,0|1,0,1]=4 6800 B9R1.15 COC1COCCC1O Amb25733031 [0,1,0,1,0,0|1,0,1]=4 6801 B9R1.15 COC1OCC=CC1Br Amb27596909 [0,1,0,1,0,0|2,0,0]=4 6802 B9R1.15 COC1OCCCC1=O Amb27838671 [0,1,0,1,0,0|1,0,1]=4 6803 B9R1.15 COC1OCCCC1O Amb25284546 [0,1,0,1,0,0|1,0,1]=4 6804 B9R1.15 CO[C@@H]1CCCC[C@@H]1O Amb24671865 [0,1,0,1,0,0|0,0,2]=4 6805 B9R1.15 CO[C@@H]1CCCC[C@H]1O Amb17940177 [0,1,0,1,0,0|0,0,2]=4 6806 B9R1.15 CO[C@@H]1CCCN[C@@H]1C Amb33744863 [0,1,0,1,0,0|1,0,1]=4 6807 B9R1.15 CO[C@@H]1OCCC[C@@H]1O Amb27844176 [0,1,0,1,0,0|1,0,1]=4 6808 B9R1.15 CO[C@H]1CCCC[C@@H]1O Amb22047253 [0,1,0,1,0,0|0,0,2]=4 6809 B9R1.15 CO[C@H]1CCCN[C@H]1C Amb33621063 [0,1,0,1,0,0|1,0,1]=4 6810 B9R1.15 CO[C@H]1CNCC[C@@H]1O Amb34913075 [0,1,0,1,0,0|1,0,1]=4 6811 B9R1.15 CO[C@H]1CNCC[C@H]1O Amb34912825 [0,1,0,1,0,0|1,0,1]=4 6812 B9R1.15 CO[C@H]1OCCC[C@@H]1O Amb27221641 [0,1,0,1,0,0|1,0,1]=4 6813 B9R1.15 CSC1=CCCCC1=O Amb27255244 [0,1,0,1,0,0|1,0,1]=4 6814 B9R1.15 CSC1=CCCCN1C Amb28285265 [0,1,0,1,0,0|2,0,0]=4 6815 B9R1.15 CSC1CCC=CC1F Amb27864051 [0,1,0,1,0,0|1,1,0]=4 6816 B9R1.15 CSC1CCCCC1O Amb27810883 [0,1,0,1,0,0|0,0,2]=4 6817 B9R1.15 CS[C@@H]1CCC=C[C@H]1F Amb25093019 [0,1,0,1,0,0|1,1,0]=4 6818 B9R1.15 CS[C@@H]1CCCC[C@H]1O Amb27822799 [0,1,0,1,0,0|0,0,2]=4 6819 B9R1.15 CS[C@H]1CCCC[C@@H]1O Amb24424734 [0,1,0,1,0,0|0,0,2]=4 6820 B9R1.15 C[C@@H]1C=CCC[C@H]1C=O Amb28246398 [0,1,0,1,0,0|0,0,1]=3 6821 B9R1.15 C[C@@H]1CC=CO[C@@H]1CO Amb27215397 [0,1,0,1,0,0|1,0,0]=3 6822 B9R1.15 C[C@@H]1CCCC[C@H]1CO Amb27205665 [0,1,0,1,0,0|0,0,2]=4 6823 B9R1.15 C[C@@H]1CCCN[C@@H]1CO Amb28247947 [0,1,0,1,0,0|0,0,2]=4 6824 B9R1.15 C[C@@H]1CCCN[C@@H]1CO Amb32658745 [0,1,0,1,0,0|0,0,2]=4 6825 B9R1.15 C[C@@H]1CCCN[C@H]1CO Amb28456652 [0,1,0,1,0,0|0,0,2]=4 6826 B9R1.15 C[C@H]1C=CCC[C@H]1CN Amb27420782 [0,1,0,1,0,0|1,0,0]=3 6827 B9R1.15 C[C@H]1CC=CC[C@@H]1CO Amb27853895 [0,1,0,1,0,0|0,0,0]=2 6828 B9R1.15 C[C@H]1CC=CC[C@H]1C=O Amb27467799 [0,1,0,1,0,0|0,0,2]=4 6829 B9R1.15 C[C@H]1CC=CC[C@H]1CO Amb27422301 [0,1,0,1,0,0|0,0,0]=2 6830 B9R1.15 C[C@H]1CCCC[C@H]1CO Amb28250858 [0,1,0,1,0,0|0,0,2]=4 6831 B9R1.15 C[C@H]1CCCN[C@@H]1CO Amb34915744 [0,1,0,1,0,0|0,0,2]=4 6832 B9R1.15 C[C@H]1OCCN[C@@H]1CO Amb26894037 [0,1,0,1,0,0|1,0,1]=4 6833 B9R1.15 C\C=C1/CCCCC1=O Amb10558348 [0,1,0,1,0,0|1,0,1]=4 6834 B9R1.15 C\C=C1\CCCCC1=O Amb24571944 [0,1,0,1,0,0|1,0,1]=4 6835 B9R1.15 ClCC1=C(Cl)CCCC1 Amb27595204 [0,1,0,1,0,0|2,0,0]=4 6836 B9R1.15 ClCC1=CCCCC1Cl Amb27493133 [0,1,0,1,0,0|2,0,0]=4 6837 B9R1.15 N#CC1=CCCCC1O Amb18642103 [0,1,0,1,0,0|1,0,1]=4 6838 B9R1.15 N#CC1=CCOCC1O Amb27447482 [0,1,0,1,0,0|1,0,1]=4 6839 B9R1.15 N#CC1CCC=CC1O Amb27204585 [0,1,0,1,0,0|1,0,1]=4 6840 B9R1.15 N#C[C@H]1CCC=C[C@H]1N Amb27785481 [0,1,0,1,0,0|1,0,1]=4 6841 B9R1.15 N#C[C@H]1CCC=C[C@H]1O Amb27978517 [0,1,0,1,0,0|1,0,1]=4 6842 B9R1.15 NC1C=CCCC1CO Amb27841059 [0,1,0,1,0,0|0,0,0]=2 6843 B9R1.15 NC1CC=CCC1CO Amb26335299 [0,1,0,1,0,0|0,0,0]=2 6844 B9R1.15 NC1CCCCC1CO Amb19515684 [0,1,0,1,0,0|0,0,2]=4 6845 B9R1.15 NC1CCCCC1CO Amb29083407 [0,1,0,1,0,0|0,0,2]=4 6846 B9R1.15 NC1CCOCC1CO Amb22491259 [0,1,0,1,0,0|1,0,1]=4 6847 B9R1.15 NCC1=C(Cl)CCCC1 Amb18251295 [0,1,0,1,0,0|2,0,0]=4 6848 B9R1.15 NCC1=C(Cl)CCCO1 Amb27817875 [0,1,0,1,0,0|1,0,0]=3 6849 B9R1.15 NCC1CC=CCC1N Amb25860567 [0,1,0,1,0,0|1,0,0]=3 6850 B9R1.15 NCC1CCCCC1O Amb22228582 [0,1,0,1,0,0|0,0,2]=4 6851 B9R1.15 NCC1CCCCC1O Amb9277099 [0,1,0,1,0,0|0,0,2]=4 6852 B9R1.15 NCC1CNCCC1O Amb33166212 [0,1,0,1,0,0|1,0,1]=4 6853 B9R1.15 NCC1COCCC1O Amb18561401 [0,1,0,1,0,0|1,0,1]=4 6854 B9R1.15 NCC1CSCCC1O Amb18202213 [0,1,0,1,0,0|1,0,1]=4 6855 B9R1.15 NCC1OCCCC1O Amb18203183 [0,1,0,1,0,0|1,0,1]=4 6856 B9R1.15 NC[C@@H]1CC=CC[C@H]1N Amb1993786 [0,1,0,1,0,0|1,0,0]=3 6857 B9R1.15 NC[C@@H]1CCCCC1O Amb28120033 [0,1,0,1,0,0|0,0,2]=4 6858 B9R1.15 NC[C@@H]1CCCC[C@@H]1O Amb1993771 [0,1,0,1,0,0|0,0,2]=4 6859 B9R1.15 NC[C@@H]1CCCC[C@H]1O Amb1993738 [0,1,0,1,0,0|0,0,2]=4 6860 B9R1.15 NC[C@@H]1CCCC[C@H]1O Amb32662843 [0,1,0,1,0,0|0,0,2]=4 6861 B9R1.15 NC[C@H]1CCCC[C@@H]1O Amb27267791 [0,1,0,1,0,0|0,0,2]=4 6862 B9R1.15 NC[C@H]1CCCC[C@@H]1O Amb32662911 [0,1,0,1,0,0|0,0,2]=4 6863 B9R1.15 NC[C@H]1CCCC[C@H]1O Amb28134233 [0,1,0,1,0,0|0,0,2]=4 6864 B9R1.15 NC[C@H]1CCCC[C@H]1O Amb33774712 [0,1,0,1,0,0|0,0,2]=4 6865 B9R1.15 N[C@@H]1C=CCC[C@H]1CO Amb26464134 [0,1,0,1,0,0|0,0,0]=2 6866 B9R1.15 N[C@@H]1CC=CC[C@H]1CO Amb1993795 [0,1,0,1,0,0|0,0,0]=2 6867 B9R1.15 N[C@@H]1CCCC[C@@H]1CO Amb26867016 [0,1,0,1,0,0|0,0,2]=4 6868 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb1993740 [0,1,0,1,0,0|0,0,2]=4 6869 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb1993773 [0,1,0,1,0,0|0,0,2]=4 6870 B9R1.15 N[C@@H]1CCCC[C@H]1CO Amb30640024 [0,1,0,1,0,0|0,0,2]=4 6871 B9R1.15 N[C@H]1C=CCC[C@H]1CO Amb25231204 [0,1,0,1,0,0|0,0,0]=2 6872 B9R1.15 N[C@H]1CC=CC[C@@H]1CO Amb28195328 [0,1,0,1,0,0|0,0,0]=2 6873 B9R1.15 N[C@H]1CCCC[C@H]1CO Amb1993772 [0,1,0,1,0,0|0,0,2]=4 6874 B9R1.15 O=C1CC=COC1CO Amb28202375 [0,1,0,1,0,0|1,0,1]=4 6875 B9R1.15 O=C1CCCC=C1CBr Amb27180223 [0,1,0,1,0,0|1,0,1]=4 6876 B9R1.15 O=C1CCCC=C1CCl Amb27424688 [0,1,0,1,0,0|1,0,1]=4 6877 B9R1.15 O=C1CCCC=C1CO Amb24453147 [0,1,0,1,0,0|1,0,1]=4 6878 B9R1.15 O=C[C@H]1CCC=C[C@H]1O Amb27854577 [0,1,0,1,0,0|0,0,2]=4 6879 B9R1.15 OC1CCCC=C1CCl Amb28060583 [0,1,0,1,0,0|1,0,0]=3 6880 B9R1.15 OC1CCCCC1CBr Amb26848173 [0,1,0,1,0,0|0,0,2]=4 6881 B9R1.15 OC1CCNCC1CF Amb27853580 [0,1,0,1,0,0|1,0,1]=4 6882 B9R1.15 OC1CCSCC1CBr Amb28133902 [0,1,0,1,0,0|1,0,1]=4 6883 B9R1.15 OCC1=C(Cl)CCCC1 Amb28061885 [0,1,0,1,0,0|2,0,0]=4 6884 B9R1.15 OCC1CCCCC1Br Amb25320883 [0,1,0,1,0,0|0,0,2]=4 6885 B9R1.15 OCC1CCCCC1Cl Amb26054589 [0,1,0,1,0,0|0,0,2]=4 6886 B9R1.15 OCC1CCCCC1F Amb25216302 [0,1,0,1,0,0|0,0,2]=4 6887 B9R1.15 OCC1CCCCC1O Amb2695584 [0,1,0,1,0,0|0,0,2]=4 6888 B9R1.15 OCC1CCCCC1S Amb28186091 [0,1,0,1,0,0|0,0,2]=4 6889 B9R1.15 OCC1CCCOC1O Amb28315461 [0,1,0,1,0,0|1,0,1]=4 6890 B9R1.15 OCC1CCNCC1O Amb22298269 [0,1,0,1,0,0|1,0,1]=4 6891 B9R1.15 OCC1CCNCC1O Amb22886290 [0,1,0,1,0,0|1,0,1]=4 6892 B9R1.15 OCC1CCOCC1F Amb27789057 [0,1,0,1,0,0|1,0,1]=4 6893 B9R1.15 OCC1CCOCC1O Amb4358572 [0,1,0,1,0,0|1,0,1]=4 6894 B9R1.15 OCC1CNCCC1F Amb27147945 [0,1,0,1,0,0|1,0,1]=4 6895 B9R1.15 OCC1CNCCC1O Amb22727975 [0,1,0,1,0,0|1,0,1]=4 6896 B9R1.15 OCC1CNCCC1O Amb8630932 [0,1,0,1,0,0|1,0,1]=4 6897 B9R1.15 OCC1COCCC1O Amb26859481 [0,1,0,1,0,0|1,0,1]=4 6898 B9R1.15 OCC1CSCC[C@@H]1O Amb27806578 [0,1,0,1,0,0|1,0,1]=4 6899 B9R1.15 OCC1NCC=CC1O Amb28343160 [0,1,0,1,0,0|1,0,0]=3 6900 B9R1.15 OCC1SCC=CC1O Amb27780179 [0,1,0,1,0,0|1,0,0]=3 6901 B9R1.15 OC[C@@H]1CC=CC[C@@H]1Cl Amb27634878 [0,1,0,1,0,0|0,0,0]=2 6902 B9R1.15 OC[C@@H]1CC=CC[C@H]1O Amb27857923 [0,1,0,1,0,0|0,0,0]=2 6903 B9R1.15 OC[C@@H]1CCC=C[C@@H]1O Amb27215271 [0,1,0,1,0,0|0,0,0]=2 6904 B9R1.15 OC[C@@H]1CCCC[C@@H]1O Amb27428210 [0,1,0,1,0,0|0,0,2]=4 6905 B9R1.15 OC[C@@H]1CCNC[C@@H]1F Amb23439393 [0,1,0,1,0,0|1,0,1]=4 6906 B9R1.15 OC[C@@H]1CCNC[C@@H]1F Amb24077308 [0,1,0,1,0,0|1,0,1]=4 6907 B9R1.15 OC[C@@H]1CCNC[C@@H]1O Amb26015650 [0,1,0,1,0,0|1,0,1]=4 6908 B9R1.15 OC[C@@H]1CCNC[C@@H]1O Amb33871492 [0,1,0,1,0,0|1,0,1]=4 6909 B9R1.15 OC[C@@H]1CCNC[C@H]1O Amb22757887 [0,1,0,1,0,0|1,0,1]=4 6910 B9R1.15 OC[C@@H]1CCNC[C@H]1O Amb22757970 [0,1,0,1,0,0|1,0,1]=4 6911 B9R1.15 OC[C@@H]1NCCC[C@@H]1O Amb25960753 [0,1,0,1,0,0|1,0,1]=4 6912 B9R1.15 OC[C@@H]1OCC=C[C@H]1O Amb27632773 [0,1,0,1,0,0|1,0,0]=3 6913 B9R1.15 OC[C@H]1CCC=C[C@H]1O Amb27218905 [0,1,0,1,0,0|0,0,0]=2 6914 B9R1.15 OC[C@H]1CCCC[C@@H]1Cl Amb28429613 [0,1,0,1,0,0|0,0,2]=4 6915 B9R1.15 OC[C@H]1CCCC[C@@H]1O Amb28384576 [0,1,0,1,0,0|0,0,2]=4 6916 B9R1.15 OC[C@H]1CCCC[C@@H]1S Amb27652987 [0,1,0,1,0,0|0,0,2]=4 6917 B9R1.15 OC[C@H]1CCCC[C@H]1O Amb28430751 [0,1,0,1,0,0|0,0,2]=4 6918 B9R1.15 OC[C@H]1CCNC[C@@H]1F Amb34915606 [0,1,0,1,0,0|1,0,1]=4 6919 B9R1.15 OC[C@H]1CCNC[C@@H]1O Amb26594171 [0,1,0,1,0,0|1,0,1]=4 6920 B9R1.15 OC[C@H]1CCNC[C@@H]1O Amb33813228 [0,1,0,1,0,0|1,0,1]=4 6921 B9R1.15 OC[C@H]1CCNC[C@H]1F Amb26561651 [0,1,0,1,0,0|1,0,1]=4 6922 B9R1.15 OC[C@H]1CCNC[C@H]1F Amb33801718 [0,1,0,1,0,0|1,0,1]=4 6923 B9R1.15 OC[C@H]1CCNC[C@H]1O Amb22750649 [0,1,0,1,0,0|1,0,1]=4 6924 B9R1.15 OC[C@H]1CCNC[C@H]1O Amb22757875 [0,1,0,1,0,0|1,0,1]=4 6925 B9R1.15 OC[C@H]1CNCC[C@@H]1O Amb27195007 [0,1,0,1,0,0|1,0,1]=4 6926 B9R1.15 OC[C@H]1OCC=C[C@@H]1O Amb28318872 [0,1,0,1,0,0|1,0,0]=3 6927 B9R1.15 OC[C@H]1OCCCC1O Amb27768573 [0,1,0,1,0,0|1,0,1]=4 6928 B9R1.15 OC[C@H]1OCCC[C@H]1O Amb27445056 [0,1,0,1,0,0|1,0,1]=4 6929 B9R1.15 O[C@@H]1CCCC[C@H]1CCl Amb27420171 [0,1,0,1,0,0|0,0,2]=4 6930 B9R1.15 O[C@@H]1CCCC[C@H]1CS Amb27962214 [0,1,0,1,0,0|0,0,2]=4 6931 B9R1.15 O[C@H]1CCCC[C@H]1CCl Amb27962958 [0,1,0,1,0,0|0,0,2]=4 6932 B9R1.18 CCCC1OC1CCO Amb28455016 [0,1,0,1,0,0|0,0,2]=4 6933 B9R1.18 CCC[C@H]1O[C@H]1CCO Amb27667122 [0,1,0,1,0,0|0,0,2]=4 6934 B9R1.18 OCCC1CC1CCO Amb27807200 [0,1,0,1,0,0|0,0,2]=4 6935 B9R1.18 OCC[C@@H]1C[C@H]1CCO Amb27851514 [0,1,0,1,0,0|0,0,2]=4 6936 B9R1.20 C=C\C=C\C1CC1CO Amb27164470 [0,1,0,1,0,0|0,0,2]=4 6937 B9R1.20 CCC1CC1CCCO Amb32951059 [0,1,0,1,0,0|0,0,2]=4 6938 B9R1.20 CCC1OC1CCOC Amb27433793 [0,1,0,1,0,0|1,0,1]=4 6939 B9R1.20 CCCCC1OC1CO Amb28069435 [0,1,0,1,0,0|0,0,2]=4 6940 B9R1.20 CCCC[C@@H]1C[C@H]1CO Amb27857307 [0,1,0,1,0,0|0,0,2]=4 6941 B9R1.20 CCCC[C@H]1C[C@@H]1CO Amb27457988 [0,1,0,1,0,0|0,0,2]=4 6942 B9R1.20 CCCC[C@H]1O[C@@H]1CO Amb27446723 [0,1,0,1,0,0|0,0,2]=4 6943 B9R1.20 CCC\C=C1\CC1CO Amb27858002 [0,1,0,1,0,0|0,0,0]=2 6944 B9R1.20 CC[C@@H]1C[C@H]1CCCO Amb33213083 [0,1,0,1,0,0|0,0,2]=4 6945 B9R1.20 CC\C=C\C1CC1CN Amb33267542 [0,1,0,1,0,0|1,0,0]=3 6946 B9R1.20 CC\C=C\C1OC1C=O Amb28194116 [0,1,0,1,0,0|0,0,2]=4 6947 B9R1.20 CC\C=C\C1OC1CO Amb27207668 [0,1,0,1,0,0|0,0,0]=2 6948 B9R1.20 CC\C=C\[C@@H]1C[C@H]1CN Amb33267543 [0,1,0,1,0,0|1,0,0]=3 6949 B9R1.20 CC\C=C\[C@H]1O[C@@H]1CO Amb27207853 [0,1,0,1,0,0|0,0,0]=2 6950 B9R1.20 C\C=C\C[C@@H]1O[C@@H]1CO Amb27452017 [0,1,0,1,0,0|0,0,2]=4 6951 B9R1.20 C\C=C\C[C@@H]1O[C@H]1CO Amb27205917 [0,1,0,1,0,0|0,0,2]=4 6952 B9R1.22 C#CC1=CC(O)CC1O Amb27456550 [0,1,0,1,0,0|0,0,2]=4 6953 B9R1.22 CC1=CC(=O)O[C@H]1CO Amb27399693 [0,1,0,1,0,0|1,0,1]=4 6954 B9R1.22 CC1CC(=O)OC1CO Amb28049216 [0,1,0,1,0,0|1,0,1]=4 6955 B9R1.22 CC1CC(=O)O[C@@H]1CO Amb27956619 [0,1,0,1,0,0|1,0,1]=4 6956 B9R1.22 CC1CN(C)CC1CO Amb27875887 [0,1,0,1,0,0|1,0,1]=4 6957 B9R1.22 CC1NC(=O)OC1CO Amb27438567 [0,1,0,1,0,0|2,0,0]=4 6958 B9R1.22 CC1OC(=O)OC1CO Amb28315510 [0,1,0,1,0,0|2,0,0]=4 6959 B9R1.22 CCC1=CC(=O)OC1O Amb25221620 [0,1,0,1,0,0|1,0,1]=4 6960 B9R1.22 CCC1=CC(C)CC1=O Amb28285166 [0,1,0,1,0,0|0,0,2]=4 6961 B9R1.22 CCC1=CC(O)CC1=O Amb27954205 [0,1,0,1,0,0|0,0,2]=4 6962 B9R1.22 CCC1CC(=O)NC1C Amb27391224 [0,1,0,1,0,0|2,0,0]=4 6963 B9R1.22 CC[C@H]1OC(O)C[C@@H]1O Amb27853549 [0,1,0,1,0,0|1,0,1]=4 6964 B9R1.22 CN1NC(=O)CC1CO Amb27667146 [0,1,0,1,0,0|2,0,0]=4 6965 B9R1.22 C[C@@H]1CC(=O)C[C@@H]1CO Amb27260485 [0,1,0,1,0,0|0,0,1]=3 6966 B9R1.22 C[C@@H]1CC(=O)O[C@H]1CO Amb28053667 [0,1,0,1,0,0|1,0,1]=4 6967 B9R1.22 C[C@@H]1OC(=O)C[C@@H]1CO Amb27662143 [0,1,0,1,0,0|1,0,0]=3 6968 B9R1.22 C[C@@H]1OC(=O)O[C@H]1CO Amb27204022 [0,1,0,1,0,0|2,0,0]=4 6969 B9R1.22 C[C@H]1CC(=O)O[C@@H]1CO Amb27450606 [0,1,0,1,0,0|1,0,1]=4 6970 B9R1.22 C[C@H]1C[C@@H](C)C=C1CO Amb27488142 [0,1,0,1,0,0|2,0,0]=4 6971 B9R1.22 C[C@H]1C[C@@H](C)CC1CO Amb28319916 [0,1,0,1,0,0|0,0,2]=4 6972 B9R1.22 C[C@H]1OC(=O)N[C@@H]1CO Amb27237045 [0,1,0,1,0,0|2,0,0]=4 6973 B9R1.22 C[C@H]1OC(=O)N[C@H]1CO Amb27440525 [0,1,0,1,0,0|2,0,0]=4 6974 B9R1.27 CC1=C(CCl)[C@H](C)CC1 Amb27231081 [0,1,0,1,0,0|2,0,0]=4 6975 B9R1.27 CC1=C(CO)[C@H](C)CC1 Amb27806087 [0,1,0,1,0,0|2,0,0]=4 6976 B9R1.27 CC1CCC(N)C1CO Amb20623115 [0,1,0,1,0,0|0,0,2]=4 6977 B9R1.27 CC1CCC(O)C1CO Amb27617054 [0,1,0,1,0,0|0,0,2]=4 6978 B9R1.27 CCC1=C(Cl)CCC1=O Amb27836883 [0,1,0,1,0,0|0,0,2]=4 6979 B9R1.27 CCC1=C(O)CCC1=O Amb27838731 [0,1,0,1,0,0|0,0,1]=3 6980 B9R1.27 CCC1=C(O)COC1=O Amb27483102 [0,1,0,1,0,0|1,0,1]=4 6981 B9R1.27 CCC1C(=O)C=CC1C Amb28199783 [0,1,0,1,0,0|1,0,1]=4 6982 B9R1.27 CCC1C(O)CCC1O Amb28049245 [0,1,0,1,0,0|0,0,2]=4 6983 B9R1.27 CCN1C(=O)CCC1O Amb26435226 [0,1,0,1,0,0|1,0,0]=3 6984 B9R1.27 CCN1C(=O)OCC1O Amb28134794 [0,1,0,1,0,0|2,0,0]=4 6985 B9R1.27 CC[C@@H]1C(=O)C=C[C@@H]1C Amb28052276 [0,1,0,1,0,0|1,0,1]=4 6986 B9R1.27 CC[C@@H]1C(=O)CC[C@H]1C Amb27256164 [0,1,0,1,0,0|1,0,1]=4 6987 B9R1.27 CC[C@@H]1C(=O)OC[C@H]1O Amb27456703 [0,1,0,1,0,0|1,0,1]=4 6988 B9R1.33 C#CCC1C=CCC1O Amb27204248 [0,1,0,1,0,0|1,0,1]=4 6989 B9R1.33 C=CCC1CC=CC1O Amb28401040 [0,1,0,1,0,0|2,0,0]=4 6990 B9R1.33 CC1=C(CCO)CC=C1 Amb27761613 [0,1,0,1,0,0|0,0,1]=3 6991 B9R1.33 CC1=NC=CC1CCN Amb27440770 [0,1,0,1,0,0|1,0,1]=4 6992 B9R1.33 CC1CC=NN1CCO Amb27662434 [0,1,0,1,0,0|1,0,1]=4 6993 B9R1.33 CC1CCCC1NCO Amb28429256 [0,1,0,1,0,0|0,0,2]=4 6994 B9R1.33 CC1CCC\C1=C/CN Amb27185789 [0,1,0,1,0,0|2,0,0]=4 6995 B9R1.33 CC1CCNC1CCO Amb25865855 [0,1,0,1,0,0|0,0,2]=4 6996 B9R1.33 CC1CCOC1CCO Amb33741891 [0,1,0,1,0,0|0,0,2]=4 6997 B9R1.33 CC1COC\C1=C/CN Amb35646789 [0,1,0,1,0,0|2,0,0]=4 6998 B9R1.33 CC1N=CC=N1CCN Amb20414404 [0,1,0,1,0,0|2,0,0]=4 6999 B9R1.33 CC1NCSC1CCO Amb27185591 [0,1,0,1,0,0|1,0,1]=4 7000 B9R1.33 CC1OCCC1CCO Amb33427650 [0,1,0,1,0,0|0,0,2]=4 7001 B9R1.33 CC1OCCC1CNO Amb33428024 [0,1,0,1,0,0|1,0,1]=4 7002 B9R1.33 CC1OCCC1CON Amb33427223 [0,1,0,1,0,0|1,0,1]=4 7003 B9R1.33 CC1SCC\C1=C/CN Amb27250058 [0,1,0,1,0,0|2,0,0]=4 7004 B9R1.33 CCCC1CC=CC1=O Amb27838711 [0,1,0,1,0,0|1,0,1]=4 7005 B9R1.33 CCCC1CCCC1=O Amb8503562 [0,1,0,1,0,0|1,0,1]=4 7006 B9R1.33 CCCC1CCCC1O Amb26922499 [0,1,0,1,0,0|0,0,2]=4 7007 B9R1.33 CCCC1CNCC1O Amb27407775 [0,1,0,1,0,0|0,0,2]=4 7008 B9R1.33 CCCC1COCC1O Amb33213638 [0,1,0,1,0,0|0,0,2]=4 7009 B9R1.33 CCCC1OCCC1Cl Amb28320772 [0,1,0,1,0,0|0,0,2]=4 7010 B9R1.33 CCCC1SCCC1O Amb27171321 [0,1,0,1,0,0|0,0,2]=4 7011 B9R1.33 CCC[C@@H]1CCCC1=O Amb28054357 [0,1,0,1,0,0|1,0,1]=4 7012 B9R1.33 CCC[C@@H]1CCC[C@H]1O Amb24519919 [0,1,0,1,0,0|0,0,2]=4 7013 B9R1.33 CCC[C@@H]1CNC[C@H]1O Amb27639284 [0,1,0,1,0,0|0,0,2]=4 7014 B9R1.33 CCC[C@@H]1COC[C@H]1O Amb32950257 [0,1,0,1,0,0|0,0,2]=4 7015 B9R1.33 CCC[C@@H]1OCC[C@H]1Cl Amb27626973 [0,1,0,1,0,0|0,0,2]=4 7016 B9R1.33 CCC[C@@H]1SCC[C@@H]1O Amb27443600 [0,1,0,1,0,0|0,0,2]=4 7017 B9R1.33 CCC[C@@H]1SCC[C@H]1O Amb28206535 [0,1,0,1,0,0|0,0,2]=4 7018 B9R1.33 CCC[C@H]1CCNC1=O Amb27624920 [0,1,0,1,0,0|2,0,0]=4 7019 B9R1.33 CCNC1COCC1O Amb18281482 [0,1,0,1,0,0|1,0,1]=4 7020 B9R1.33 CCN[C@@H]1COC[C@H]1O Amb22748740 [0,1,0,1,0,0|1,0,1]=4 7021 B9R1.33 CCN[C@H]1COC[C@@H]1O Amb10608161 [0,1,0,1,0,0|1,0,1]=4 7022 B9R1.33 CCN[C@H]1COC[C@H]1O Amb34916488 [0,1,0,1,0,0|1,0,1]=4 7023 B9R1.33 CCOC1=CCCC1=O Amb27256367 [0,1,0,1,0,0|0,0,2]=4 7024 B9R1.33 CCOC1=NCCC1Br Amb27793751 [0,1,0,1,0,0|2,0,0]=4 7025 B9R1.33 CCOC1CC=CC1Br Amb28070964 [0,1,0,1,0,0|2,0,0]=4 7026 B9R1.33 CCOC1CC=CC1Cl Amb28244731 [0,1,0,1,0,0|2,0,0]=4 7027 B9R1.33 CCOC1CCCC1O Amb27837436 [0,1,0,1,0,0|0,0,2]=4 7028 B9R1.33 CCOC1CCOC1O Amb28315494 [0,1,0,1,0,0|1,0,1]=4 7029 B9R1.33 CCO[C@@H]1CCC[C@H]1O Amb24595865 [0,1,0,1,0,0|0,0,2]=4 7030 B9R1.33 CCO[C@@H]1COC[C@H]1O Amb28350070 [0,1,0,1,0,0|1,0,1]=4 7031 B9R1.33 CCSC1=CCCC1=O Amb27861411 [0,1,0,1,0,0|0,0,2]=4 7032 B9R1.33 CCS[C@@H]1CC=C[C@H]1Cl Amb27233004 [0,1,0,1,0,0|2,0,0]=4 7033 B9R1.33 CCS[C@@H]1COC[C@H]1O Amb35632202 [0,1,0,1,0,0|1,0,1]=4 7034 B9R1.33 CC\C=C1/CCCC1=O Amb27235548 [0,1,0,1,0,0|0,0,1]=3 7035 B9R1.33 CC\C=C1\CCCC1=O Amb26408836 [0,1,0,1,0,0|0,0,1]=3 7036 B9R1.33 CC\C=C1\CCOC1=O Amb25225082 [0,1,0,1,0,0|0,0,2]=4 7037 B9R1.33 CN1CCCC1CCO Amb3939053 [0,1,0,1,0,0|0,0,2]=4 7038 B9R1.33 CN1CCC[C@@H]1CCO Amb22755468 [0,1,0,1,0,0|0,0,2]=4 7039 B9R1.33 CN1CCC[C@H]1CCO Amb28366574 [0,1,0,1,0,0|0,0,2]=4 7040 B9R1.33 CNCC1CCCC1O Amb18642712 [0,1,0,1,0,0|0,0,2]=4 7041 B9R1.33 CN\C=C1\CCCC1=O Amb24477752 [0,1,0,1,0,0|1,0,1]=4 7042 B9R1.33 COCC1CCCC1O Amb25223631 [0,1,0,1,0,0|0,0,2]=4 7043 B9R1.33 COCC1CNCC1C Amb29083431 [0,1,0,1,0,0|1,0,1]=4 7044 B9R1.33 COC[C@@H]1CCC[C@H]1O Amb32950893 [0,1,0,1,0,0|0,0,2]=4 7045 B9R1.33 COC[C@H]1C=CC[C@@H]1O Amb27652492 [0,1,0,1,0,0|0,0,2]=4 7046 B9R1.33 CO\C=C1\CCCC1=O Amb27640557 [0,1,0,1,0,0|1,0,1]=4 7047 B9R1.33 CO\N=C1\CNC[C@@H]1O Amb27422775 [0,1,0,1,0,0|2,0,0]=4 7048 B9R1.33 CS\C=C1/CCCC1=O Amb27185670 [0,1,0,1,0,0|1,0,1]=4 7049 B9R1.33 CS\C=C1\CCCC1O Amb28315538 [0,1,0,1,0,0|1,0,0]=3 7050 B9R1.33 C[C@@H]1CCC[C@H]1CCO Amb27207721 [0,1,0,1,0,0|0,0,2]=4 7051 B9R1.33 C[C@H]1NCC[C@@H]1CCO Amb27632925 [0,1,0,1,0,0|0,0,2]=4 7052 B9R1.33 C\C=C\C1CCCC1O Amb32944936 [0,1,0,1,0,0|0,0,2]=4 7053 B9R1.33 C\C=C\C1CNCC1O Amb32944799 [0,1,0,1,0,0|0,0,2]=4 7054 B9R1.33 C\C=C\C1COCC1O Amb33213646 [0,1,0,1,0,0|0,0,2]=4 7055 B9R1.33 C\C=C\[C@@H]1CCC[C@@H]1O Amb28069459 [0,1,0,1,0,0|0,0,2]=4 7056 B9R1.33 C\C=C\[C@@H]1CCC[C@H]1O Amb27196803 [0,1,0,1,0,0|0,0,2]=4 7057 B9R1.33 C\C=C\[C@@H]1CNC[C@H]1O Amb33212922 [0,1,0,1,0,0|0,0,2]=4 7058 B9R1.33 C\C=C\[C@@H]1COC[C@H]1O Amb32944441 [0,1,0,1,0,0|0,0,2]=4 7059 B9R1.33 Cc1ccnn1CCO Amb7089061 [0,1,0,1,0,0|1,0,1]=4 7060 B9R1.33 Cc1ccoc1CCO Amb25300068 [0,1,0,1,0,0|0,0,2]=4 7061 B9R1.33 Cc1ccsc1CCO Amb25935748 [0,1,0,1,0,0|0,0,2]=4 7062 B9R1.33 Cc1cocc1CCO Amb26918329 [0,1,0,1,0,0|0,0,2]=4 7063 B9R1.33 Cc1cscc1CCO Amb33147729 [0,1,0,1,0,0|0,0,2]=4 7064 B9R1.33 Cc1nccn1CCO Amb6307699 [0,1,0,1,0,0|1,0,1]=4 7065 B9R1.33 Cc1occc1CCO Amb25104148 [0,1,0,1,0,0|0,0,2]=4 7066 B9R1.33 Cc1sccc1CCO Amb24738484 [0,1,0,1,0,0|0,0,2]=4 7067 B9R1.33 Cn1cccc1CCO Amb19957346 [0,1,0,1,0,0|0,0,2]=4 7068 B9R1.33 Cn1ccnc1CCO Amb17593312 [0,1,0,1,0,0|1,0,1]=4 7069 B9R1.33 Cn1cncc1CCO Amb25111555 [0,1,0,1,0,0|1,0,1]=4 7070 B9R1.33 Cn1nccc1CCO Amb19957348 [0,1,0,1,0,0|1,0,1]=4 7071 B9R1.33 NC1CCCC1CCO Amb25888622 [0,1,0,1,0,0|0,0,2]=4 7072 B9R1.33 NCCC1CCCC1=O Amb18832679 [0,1,0,1,0,0|1,0,1]=4 7073 B9R1.33 NCCC1CCCC1O Amb18832551 [0,1,0,1,0,0|0,0,2]=4 7074 B9R1.33 NCCC1CCNC1=O Amb18832608 [0,1,0,1,0,0|2,0,0]=4 7075 B9R1.33 NCC[C@@H]1CCC[C@H]1O Amb33209494 [0,1,0,1,0,0|0,0,2]=4 7076 B9R1.33 NCC[C@@H]1CCC[C@H]1O Amb33482662 [0,1,0,1,0,0|0,0,2]=4 7077 B9R1.33 NN1CCCC1CCO Amb27809143 [0,1,0,1,0,0|1,0,1]=4 7078 B9R1.33 N[C@H]1CCO[C@@H]1CCO Amb27215516 [0,1,0,1,0,0|1,0,1]=4 7079 B9R1.33 O=C1C=CCC1CCO Amb27260839 [0,1,0,1,0,0|0,0,1]=3 7080 B9R1.33 O=C1CC=CN1CCO Amb27186780 [0,1,0,1,0,0|1,0,1]=4 7081 B9R1.33 O=C1CCCC1CCBr Amb20623655 [0,1,0,1,0,0|1,0,1]=4 7082 B9R1.33 O=C1CCCC1CCF Amb33551119 [0,1,0,1,0,0|1,0,1]=4 7083 B9R1.33 O=C1CCCC1CCO Amb27221111 [0,1,0,1,0,0|0,0,1]=3 7084 B9R1.33 O=C1CCCN1CCO Amb3939173 [0,1,0,1,0,0|1,0,1]=4 7085 B9R1.33 O=C1CCOC1CCO Amb27838611 [0,1,0,1,0,0|1,0,1]=4 7086 B9R1.33 O=C1NCCC1CCBr Amb27956490 [0,1,0,1,0,0|2,0,0]=4 7087 B9R1.33 O=C1NCCC1CCCl Amb25946315 [0,1,0,1,0,0|2,0,0]=4 7088 B9R1.33 O=C1NCCC1CCO Amb33531266 [0,1,0,1,0,0|1,0,0]=3 7089 B9R1.33 O=C1NCCN1CCO Amb2721114 [0,1,0,1,0,0|2,0,0]=4 7090 B9R1.33 O=C1NCC[C@@H]1CCO Amb27593854 [0,1,0,1,0,0|1,0,0]=3 7091 B9R1.33 O=C1OCCC1CCBr Amb20667717 [0,1,0,1,0,0|2,0,0]=4 7092 B9R1.33 O=C1OCCC1CCCl Amb27201250 [0,1,0,1,0,0|2,0,0]=4 7093 B9R1.33 O=C1OCCC1CCO Amb25293532 [0,1,0,1,0,0|1,0,0]=3 7094 B9R1.33 O=C1OCCN1CCO Amb2720764 [0,1,0,1,0,0|2,0,0]=4 7095 B9R1.33 O=CCC1C=CCC1O Amb28061425 [0,1,0,1,0,0|0,0,2]=4 7096 B9R1.33 O=CC[C@@H]1CC=C[C@H]1O Amb27210535 [0,1,0,1,0,0|1,0,1]=4 7097 B9R1.33 O=CC[C@H]1C=CC[C@H]1O Amb28287670 [0,1,0,1,0,0|0,0,2]=4 7098 B9R1.33 OC1CCCC1CCF Amb27838511 [0,1,0,1,0,0|0,0,2]=4 7099 B9R1.33 OCCC1=C(Br)CCC1 Amb27826576 [0,1,0,1,0,0|0,0,2]=4 7100 B9R1.33 OCCC1C=CCC1O Amb27642147 [0,1,0,1,0,0|0,0,0]=2 7101 B9R1.33 OCCC1CCCC1F Amb27224301 [0,1,0,1,0,0|0,0,2]=4 7102 B9R1.33 OCCC1CCCC1O Amb25888928 [0,1,0,1,0,0|0,0,2]=4 7103 B9R1.33 OCCC1CCNC1=S Amb27783161 [0,1,0,1,0,0|1,0,0]=3 7104 B9R1.33 OCCC1CSCC1O Amb27663939 [0,1,0,1,0,0|1,0,1]=4 7105 B9R1.33 OCCN1CCSC1=S Amb24745554 [0,1,0,1,0,0|2,0,0]=4 7106 B9R1.33 OCC[C@@H]1C=CC[C@@H]1O Amb27207047 [0,1,0,1,0,0|0,0,0]=2 7107 B9R1.33 OCC[C@@H]1CCC[C@@H]1O Amb27843176 [0,1,0,1,0,0|0,0,2]=4 7108 B9R1.33 OCC[C@@H]1CCC[C@H]1O Amb28292507 [0,1,0,1,0,0|0,0,2]=4 7109 B9R1.33 OCC[C@H]1CC=C[C@H]1O Amb27218968 [0,1,0,1,0,0|1,0,0]=3 7110 B9R1.48 C=C1C=CCCC(O)C1 Amb28065207 [0,1,0,1,0,0|0,0,1]=3 7111 B9R1.48 CC1=CC(=O)CCCC1 Amb17593284 [0,1,0,1,0,0|1,0,1]=4 7112 B9R1.48 CC1=CC(=O)NCCO1 Amb24451309 [0,1,0,1,0,0|1,0,1]=4 7113 B9R1.48 CC1=CC(Cl)CCCC1 Amb27469441 [0,1,0,1,0,0|2,0,0]=4 7114 B9R1.48 CC1=CC(N)CCCC1 Amb28040829 [0,1,0,1,0,0|2,0,0]=4 7115 B9R1.48 CC1=CCCCC(C)=C1 Amb22365190 [0,1,0,1,0,0|1,0,1]=4 7116 B9R1.48 CC1CC(=O)NCCO1 Amb27244386 [0,1,0,1,0,0|1,0,1]=4 7117 B9R1.48 CC1CCC=CC(=O)C1 Amb28460736 [0,1,0,1,0,0|1,0,1]=4 7118 B9R1.48 CC1CCC=CC(O)C1 Amb28400665 [0,1,0,1,0,0|1,0,0]=3 7119 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [0,1,0,1,0,0|1,0,1]=4 7120 B9R1.48 CC1CCCCC(=O)N1 Amb22434912 [0,1,0,1,0,0|2,0,0]=4 7121 B9R1.48 CC1CCCCC(=O)O1 Amb27792220 [0,1,0,1,0,0|2,0,0]=4 7122 B9R1.48 CC1CCCCC(O)C1 Amb28051128 [0,1,0,1,0,0|0,0,2]=4 7123 B9R1.48 CC1CCNCC(C)O1 Amb32666605 [0,1,0,1,0,0|1,0,1]=4 7124 B9R1.48 CC1COCCC(O)O1 Amb27771498 [0,1,0,1,0,0|1,0,1]=4 7125 B9R1.48 C[C@@H]1CCCCC(=O)C1 Amb26030783 [0,1,0,1,0,0|1,0,1]=4 7126 B9R1.48 C[C@H]1CCNC[C@@H](C)O1 Amb32667163 [0,1,0,1,0,0|1,0,1]=4 7127 B9R1.48 N[C@@H]1CCCC[C@H](O)C1 Amb27188377 [0,1,0,1,0,0|0,0,2]=4 7128 B9R1.48 O=C1C=CCC[C@H](O)C1 Amb27838758 [0,1,0,1,0,0|0,0,1]=3 7129 B9R1.48 OC1C=C(Br)CCCC1 Amb28455049 [0,1,0,1,0,0|2,0,0]=4 7130 B9R1.48 OC1C=CC=CC(O)C1 Amb27770332 [0,1,0,1,0,0|0,0,2]=4 7131 B9R1.49 C=C1CCCC(C)CC1 Amb22364866 [0,1,0,1,0,0|1,0,1]=4 7132 B9R1.49 CC1=CCC(O)CC=C1 Amb28123967 [0,1,0,1,0,0|0,0,2]=4 7133 B9R1.49 CC1=CCCC(=O)CC1 Amb27948552 [0,1,0,1,0,0|0,0,2]=4 7134 B9R1.49 CC1C=CC(Cl)CCC1 Amb27179881 [0,1,0,1,0,0|1,0,0]=3 7135 B9R1.49 CC1C=CC(O)CCC1 Amb27599988 [0,1,0,1,0,0|1,0,0]=3 7136 B9R1.49 CC1CC=CC(=O)CC1 Amb27838660 [0,1,0,1,0,0|1,0,1]=4 7137 B9R1.49 CC1CCCC(=O)CC1 Amb27265770 [0,1,0,1,0,0|1,0,1]=4 7138 B9R1.49 CC1CCCC(O)CC1 Amb25146901 [0,1,0,1,0,0|0,0,2]=4 7139 B9R1.49 CC1CCNC(=O)CC1 Amb9316850 [0,1,0,1,0,0|2,0,0]=4 7140 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,1,0,1,0,0|2,0,0]=4 7141 B9R1.49 CC1CCOC(C)CN1 Amb27641711 [0,1,0,1,0,0|1,0,1]=4 7142 B9R1.49 CN1CCCC(O)CC1 Amb18832552 [0,1,0,1,0,0|1,0,1]=4 7143 B9R1.49 CN1CCCC(O)CC1 Amb22751622 [0,1,0,1,0,0|1,0,1]=4 7144 B9R1.49 C[C@@H]1C=C[C@@H](O)CCC1 Amb27220561 [0,1,0,1,0,0|1,0,0]=3 7145 B9R1.49 C[C@@H]1CC=C[C@@H](Cl)CC1 Amb27472012 [0,1,0,1,0,0|2,0,0]=4 7146 B9R1.49 C[C@@H]1CC=C[C@H](Cl)CC1 Amb27232720 [0,1,0,1,0,0|2,0,0]=4 7147 B9R1.49 C[C@@H]1CCCC(=O)CC1 Amb26483475 [0,1,0,1,0,0|1,0,1]=4 7148 B9R1.49 C[C@@H]1CCO[C@H](C)CN1 Amb31156635 [0,1,0,1,0,0|1,0,1]=4 7149 B9R1.49 C[C@@H]1CCO[C@H](C)CN1 Amb33276620 [0,1,0,1,0,0|1,0,1]=4 7150 B9R1.49 C[C@H]1C=C[C@H](Cl)CCC1 Amb27629772 [0,1,0,1,0,0|1,0,0]=3 7151 B9R1.49 C[C@H]1CCCC(=O)CC1 Amb28199901 [0,1,0,1,0,0|1,0,1]=4 7152 B9R1.49 C[C@H]1CCC[C@@H](O)CC1 Amb27661374 [0,1,0,1,0,0|0,0,2]=4 7153 B9R1.49 C[C@H]1CCC[C@H](O)CC1 Amb27220545 [0,1,0,1,0,0|0,0,2]=4 7154 B9R1.49 NC1=NCC(O)CCN1 Amb27211660 [0,1,0,1,0,0|2,0,0]=4 7155 B9R1.49 NC1CCNC(=O)CC1 Amb24689800 [0,1,0,1,0,0|2,0,0]=4 7156 B9R1.49 NC1CCNC(=O)CC1 Amb32663578 [0,1,0,1,0,0|2,0,0]=4 7157 B9R1.49 NC1CCNC(=O)CC1 Amb32663872 [0,1,0,1,0,0|2,0,0]=4 7158 B9R1.49 N[C@@H]1CCC[C@H](O)CC1 Amb27221049 [0,1,0,1,0,0|0,0,2]=4 7159 B9R1.49 O=C1CCC(Cl)CCN1 Amb27768772 [0,1,0,1,0,0|2,0,0]=4 7160 B9R1.49 O=C1CCC(O)CCN1 Amb26443713 [0,1,0,1,0,0|1,0,0]=3 7161 B9R1.49 O=C1CCC(O)CCO1 Amb23598292 [0,1,0,1,0,0|1,0,0]=3 7162 B9R1.49 O=C1CCCC(O)CN1 Amb22491274 [0,1,0,1,0,0|1,0,1]=4 7163 B9R1.49 O=C1CCCC(O)CO1 Amb28138759 [0,1,0,1,0,0|1,0,1]=4 7164 B9R1.49 O=C1CCC[C@H](O)CC1 Amb27838657 [0,1,0,1,0,0|0,0,1]=3 7165 B9R1.49 O=C1CC[C@@H](Br)CCO1 Amb27447872 [0,1,0,1,0,0|2,0,0]=4 7166 B9R1.49 O=C1CC[C@H](Br)CCO1 Amb28458370 [0,1,0,1,0,0|2,0,0]=4 7167 B9R1.49 O[C@@H]1CCC[C@@H](O)CC1 Amb27647850 [0,1,0,1,0,0|0,0,2]=4 7168 B9R1.50 BrC1=CCCC=CCC1 Amb27171357 [0,1,0,1,0,0|1,0,1]=4 7169 B9R1.50 BrC1=CCCCCCC1 Amb23590920 [0,1,0,1,0,0|1,0,0]=3 7170 B9R1.50 BrC1C=CCC=CCC1 Amb25088467 [0,1,0,1,0,0|1,0,1]=4 7171 B9R1.50 BrC1C=CCCC=CC1 Amb26844237 [0,1,0,1,0,0|1,0,1]=4 7172 B9R1.50 BrC1C=CCCCC=C1 Amb27865465 [0,1,0,1,0,0|1,0,1]=4 7173 B9R1.50 BrC1C=CCCCCC1 Amb24480205 [0,1,0,1,0,0|1,0,0]=3 7174 B9R1.50 BrC1CCC=CCCC1 Amb24355370 [0,1,0,1,0,0|1,0,0]=3 7175 B9R1.50 CC1C=CCCC=CC1 Amb22347896 [0,1,0,1,0,0|1,0,1]=4 7176 B9R1.50 CC1OCCCCCO1 Amb28367128 [0,1,0,1,0,0|0,0,2]=4 7177 B9R1.50 ClC1C=CCCCCC1 Amb27484094 [0,1,0,1,0,0|1,0,0]=3 7178 B9R1.50 ClC1CCC=CCCC1 Amb28118846 [0,1,0,1,0,0|1,0,0]=3 7179 B9R1.50 ClC1CCCCOCC1 Amb27984820 [0,1,0,1,0,0|0,0,2]=4 7180 B9R1.50 N=C1NCCOCCN1 Amb28043133 [0,1,0,1,0,0|2,0,0]=4 7181 B9R1.50 NC1C=CCCCCC1 Amb22410845 [0,1,0,1,0,0|1,0,0]=3 7182 B9R1.50 NC1C=CCCCCC1 Amb32652668 [0,1,0,1,0,0|1,0,0]=3 7183 B9R1.50 NC1CCC=CCCC1 Amb27814669 [0,1,0,1,0,0|1,0,0]=3 7184 B9R1.50 NC1CCC=CCCC1 Amb33307000 [0,1,0,1,0,0|1,0,0]=3 7185 B9R1.50 N[C@@H]1C=CCCCCC1 Amb27423065 [0,1,0,1,0,0|1,0,0]=3 7186 B9R1.50 O=C1C=CCCCCC1 Amb3987503 [0,1,0,1,0,0|1,0,1]=4 7187 B9R1.50 O=C1C=CCCOCC1 Amb27838783 [0,1,0,1,0,0|0,0,1]=3 7188 B9R1.50 O=C1CC=CCCOC1 Amb22364797 [0,1,0,1,0,0|0,0,1]=3 7189 B9R1.50 O=C1CCCCCCC1 Amb2721546 [0,1,0,1,0,0|1,0,1]=4 7190 B9R1.50 O=C1CCCCCCN1 Amb2780498 [0,1,0,1,0,0|2,0,0]=4 7191 B9R1.50 O=C1CCCCCCO1 Amb27468239 [0,1,0,1,0,0|2,0,0]=4 7192 B9R1.50 O=C1CCCNCCN1 Amb27165283 [0,1,0,1,0,0|2,0,0]=4 7193 B9R1.50 O=C1CCCSCCC1 Amb17593637 [0,1,0,1,0,0|0,1,1]=4 7194 B9R1.50 O=C1CCNCCCN1 Amb22263665 [0,1,0,1,0,0|2,0,0]=4 7195 B9R1.50 O=C1CCNCCCN1 Amb23403551 [0,1,0,1,0,0|2,0,0]=4 7196 B9R1.50 OC1C=CCC=CCC1 Amb27825906 [0,1,0,1,0,0|0,0,1]=3 7197 B9R1.50 OC1C=CCCCC=C1 Amb27958555 [0,1,0,1,0,0|1,0,1]=4 7198 B9R1.50 OC1C=CCCCCC1 Amb22364937 [0,1,0,1,0,0|1,0,0]=3 7199 B9R1.50 OC1C=CCCCOC1 Amb27452486 [0,1,0,1,0,0|0,0,0]=2 7200 B9R1.50 OC1CC=CCCOC1 Amb22364794 [0,1,0,1,0,0|0,0,0]=2 7201 B9R1.50 OC1CCC=CCCC1 Amb21858009 [0,1,0,1,0,0|0,0,0]=2 7202 B9R1.50 OC1CCCCCCC1 Amb6608643 [0,1,0,1,0,0|0,0,2]=4 7203 B9R1.50 OC1CCCCCCO1 Amb27970488 [0,1,0,1,0,0|0,0,2]=4 7204 B9R1.50 OC1CCCCCOC1 Amb22364795 [0,1,0,1,0,0|0,0,2]=4 7205 B9R1.50 OC1CCCCSCC1 Amb28315547 [0,1,0,1,0,0|0,0,2]=4 7206 B9R1.50 OC1CCCOCOC1 Amb27598449 [0,1,0,1,0,0|1,0,1]=4 7207 B9R1.50 O[C@@H]1C=CC=CCCC1 Amb27841912 [0,1,0,1,0,0|0,0,2]=4 7208 B9R1.50 O[C@@H]1C=CCC=CCC1 Amb28315535 [0,1,0,1,0,0|0,0,1]=3 7209 B9R1.50 O[C@@H]1C=CCCCCC1 Amb27826413 [0,1,0,1,0,0|1,0,0]=3 7210 B9R1.50 O[C@@H]1CCC=CCCC1 Amb25781269 [0,1,0,1,0,0|0,0,0]=2 7211 B9R1.50 O[C@@H]1CCCOCOC1 Amb27481202 [0,1,0,1,0,0|1,0,1]=4 7212 B9R1.50 O[C@H]1C=CC=CCCC1 Amb28315480 [0,1,0,1,0,0|0,0,2]=4 7213 B9R1.50 O[C@H]1CCC=CCCC1 Amb24481888 [0,1,0,1,0,0|0,0,0]=2 7214 B9R1.57 CCCC1C(Cl)C1CO Amb27764896 [0,1,0,1,0,0|0,0,2]=4 7215 B9R1.57 CCCC1C(F)C1CO Amb27651625 [0,1,0,1,0,0|0,0,2]=4 7216 B9R1.58 CCN=C1CC(CCl)C1 Amb27468903 [0,1,0,1,0,0|2,0,0]=4 7217 B9R1.58 CCOC1CC(CO)C1 Amb28077103 [0,1,0,1,0,0|1,0,1]=4 7218 B9R1.69 CC1=CC(=O)C(O)CC1 Amb27838713 [0,1,0,1,0,0|1,0,1]=4 7219 B9R1.69 CC1=CC(=O)CC[C@H]1C Amb27838729 [0,1,0,1,0,0|1,0,1]=4 7220 B9R1.69 CC1=CC(=O)OCC1O Amb28457807 [0,1,0,1,0,0|1,0,1]=4 7221 B9R1.69 CC1=CC(C)C(C)CC1 Amb25048711 [0,1,0,1,0,0|1,0,0]=3 7222 B9R1.69 CC1=CC(C)C(O)CC1 Amb27664856 [0,1,0,1,0,0|0,0,0]=2 7223 B9R1.69 CC1=CC(Cl)C(C)CC1 Amb27483834 [0,1,0,1,0,0|2,0,0]=4 7224 B9R1.69 CC1=CC(O)[C@H](C)CC1 Amb28049248 [0,1,0,1,0,0|2,0,0]=4 7225 B9R1.69 CC1=CCC(C)CC1O Amb27842013 [0,1,0,1,0,0|0,0,2]=4 7226 B9R1.69 CC1=CCC(O)C(C)C1 Amb27977995 [0,1,0,1,0,0|0,0,2]=4 7227 B9R1.69 CC1=CC[C@@H](C)C[C@H]1O Amb28401379 [0,1,0,1,0,0|0,0,2]=4 7228 B9R1.69 CC1=CC[C@@H](O)C(C)C1 Amb27956617 [0,1,0,1,0,0|0,0,2]=4 7229 B9R1.69 CC1=C[C@@H](O)CC[C@H]1O Amb27970996 [0,1,0,1,0,0|0,0,2]=4 7230 B9R1.69 CC1=C[C@@H](O)[C@H](O)CC1 Amb27255140 [0,1,0,1,0,0|1,0,0]=3 7231 B9R1.69 CC1=C[C@H](O)[C@H](O)CC1 Amb28321435 [0,1,0,1,0,0|1,0,0]=3 7232 B9R1.69 CC1=NC(C)C(O)CC1 Amb28319717 [0,1,0,1,0,0|1,0,0]=3 7233 B9R1.69 CC1C=CC(Br)CC1C Amb27401853 [0,1,0,1,0,0|1,0,0]=3 7234 B9R1.69 CC1C=CC(C)C(O)C1 Amb27395845 [0,1,0,1,0,0|0,0,0]=2 7235 B9R1.69 CC1C=CC(O)C(O)C1 Amb27394816 [0,1,0,1,0,0|1,0,0]=3 7236 B9R1.69 CC1C=CC(O)CC1C Amb27808814 [0,1,0,1,0,0|1,0,0]=3 7237 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,1,0,1,0,0|0,0,1]=3 7238 B9R1.69 CC1CC(=O)CC[C@H]1C Amb28141697 [0,1,0,1,0,0|1,0,1]=4 7239 B9R1.69 CC1CC(=O)NCC1O Amb27257393 [0,1,0,1,0,0|1,0,1]=4 7240 B9R1.69 CC1CC(=O)OCC1O Amb27956456 [0,1,0,1,0,0|1,0,1]=4 7241 B9R1.69 CC1CC(N)CCC1O Amb24624100 [0,1,0,1,0,0|0,0,2]=4 7242 B9R1.69 CC1CC(O)C(C)CN1 Amb21867988 [0,1,0,1,0,0|1,0,1]=4 7243 B9R1.69 CC1CC(O)C(C)CN1 Amb596542 [0,1,0,1,0,0|1,0,1]=4 7244 B9R1.69 CC1CC(O)C=CC1O Amb27978689 [0,1,0,1,0,0|2,0,0]=4 7245 B9R1.69 CC1CC(O)CCC1O Amb24726092 [0,1,0,1,0,0|0,0,2]=4 7246 B9R1.69 CC1CCC(=O)CC1C Amb22732216 [0,1,0,1,0,0|1,0,1]=4 7247 B9R1.69 CC1CCC(C)C(O)C1 Amb3941490 [0,1,0,1,0,0|0,0,2]=4 7248 B9R1.69 CC1CCC(O)C(C)C1 Amb4034595 [0,1,0,1,0,0|0,0,2]=4 7249 B9R1.69 CC1CN(C)CCC1O Amb4362743 [0,1,0,1,0,0|1,0,1]=4 7250 B9R1.69 CC1NC(=O)CCC1Cl Amb27397322 [0,1,0,1,0,0|2,0,0]=4 7251 B9R1.69 CC1NC(=O)CCC1N Amb25276175 [0,1,0,1,0,0|2,0,0]=4 7252 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [0,1,0,1,0,0|1,0,0]=3 7253 B9R1.69 CC1OC(=O)CCC1Br Amb27875143 [0,1,0,1,0,0|2,0,0]=4 7254 B9R1.69 C[C@@H]1CC(=O)CC[C@H]1O Amb34913315 [0,1,0,1,0,0|0,0,1]=3 7255 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](O)C1 Amb27184906 [0,1,0,1,0,0|0,0,2]=4 7256 B9R1.69 C[C@@H]1CN(C)CC[C@@H]1O Amb27962392 [0,1,0,1,0,0|1,0,1]=4 7257 B9R1.69 C[C@@H]1CN(C)CC[C@H]1O Amb27218249 [0,1,0,1,0,0|1,0,1]=4 7258 B9R1.69 C[C@@H]1C[C@@H](O)[C@H](C)CN1 Amb27817873 [0,1,0,1,0,0|1,0,1]=4 7259 B9R1.69 C[C@@H]1C[C@H](N)CC[C@@H]1O Amb27968631 [0,1,0,1,0,0|0,0,2]=4 7260 B9R1.69 C[C@@H]1C[C@H](N)CC[C@H]1O Amb28346268 [0,1,0,1,0,0|0,0,2]=4 7261 B9R1.69 C[C@@H]1OC(O)CC[C@@H]1O Amb27441416 [0,1,0,1,0,0|1,0,1]=4 7262 B9R1.69 C[C@H]1CC(=O)CC[C@H]1C Amb25363978 [0,1,0,1,0,0|1,0,1]=4 7263 B9R1.69 C[C@H]1CC(=O)NC[C@H]1O Amb28365998 [0,1,0,1,0,0|1,0,1]=4 7264 B9R1.69 C[C@H]1CCC(=O)C[C@@H]1C Amb26440377 [0,1,0,1,0,0|1,0,1]=4 7265 B9R1.69 C[C@H]1CCC(=O)C[C@H]1C Amb26910681 [0,1,0,1,0,0|1,0,1]=4 7266 B9R1.69 C[C@H]1CC[C@@H](C)C[C@@H]1O Amb27221189 [0,1,0,1,0,0|0,0,2]=4 7267 B9R1.69 C[C@H]1CC[C@@H](C)C[C@H]1O Amb27848128 [0,1,0,1,0,0|0,0,2]=4 7268 B9R1.69 C[C@H]1CC[C@H](C)[C@@H](O)C1 Amb27849642 [0,1,0,1,0,0|0,0,2]=4 7269 B9R1.69 C[C@H]1NC(=O)CC[C@@H]1O Amb28128446 [0,1,0,1,0,0|1,0,0]=3 7270 B9R1.69 O=C1C=C(Br)C(O)CC1 Amb28049179 [0,1,0,1,0,0|1,0,1]=4 7271 B9R1.69 O=C1C=CC(O)C(O)C1 Amb27984020 [0,1,0,1,0,0|1,0,1]=4 7272 B9R1.69 O=C1C=CC(O)[C@H](O)C1 Amb27836776 [0,1,0,1,0,0|1,0,1]=4 7273 B9R1.69 O[C@H]1C=C[C@@H](O)[C@H](O)C1 Amb27812560 [0,1,0,1,0,0|1,0,0]=3 7274 B9R1.69 O[C@H]1C=C[C@H](O)C[C@H]1O Amb27261720 [0,1,0,1,0,0|1,0,0]=3 7275 B9R1.69 O[C@H]1CCC(Br)=C[C@H]1O Amb27981973 [0,1,0,1,0,0|1,0,0]=3 7276 B9R1.69 O[C@H]1C[C@@H](O)C=C[C@H]1O Amb28350425 [0,1,0,1,0,0|1,0,0]=3 7277 B9R1.73 CC(CCO)C1CCS1 Amb28202624 [0,1,0,1,0,0|1,0,1]=4 7278 B9R1.73 CCCC(=O)C1CCC1 Amb24390209 [0,1,0,1,0,0|1,0,1]=4 7279 B9R1.73 CCNC(=O)C1CCN1 Amb28286340 [0,1,0,1,0,0|2,0,0]=4 7280 B9R1.73 CCNC(=O)[C@H]1CCN1 Amb28316090 [0,1,0,1,0,0|2,0,0]=4 7281 B9R1.73 CCOC(=N)C1CCC1 Amb24478005 [0,1,0,1,0,0|2,0,0]=4 7282 B9R1.73 CCOC(=N)C1CCC1 Amb32405903 [0,1,0,1,0,0|2,0,0]=4 7283 B9R1.73 CCOC(=O)C1CCC1 Amb9242915 [0,1,0,1,0,0|2,0,0]=4 7284 B9R1.73 CCOC(=O)C1CCN1 Amb22234769 [0,1,0,1,0,0|2,0,0]=4 7285 B9R1.73 CCOC(=O)C1CCN1 Amb8010550 [0,1,0,1,0,0|2,0,0]=4 7286 B9R1.73 CCOC(=O)C1CCO1 Amb22737247 [0,1,0,1,0,0|1,0,0]=3 7287 B9R1.73 CCOC(=O)[C@@H]1CCN1 Amb22745574 [0,1,0,1,0,0|2,0,0]=4 7288 B9R1.73 CCOC(=O)[C@@H]1CCN1 Amb24105820 [0,1,0,1,0,0|2,0,0]=4 7289 B9R1.73 CCOC(=O)[C@H]1CCN1 Amb27429927 [0,1,0,1,0,0|2,0,0]=4 7290 B9R1.73 NC(CCO)C1CCC1 Amb27974903 [0,1,0,1,0,0|0,0,2]=4 7291 B9R1.73 NC(CCO)C1CCC1 Amb33482936 [0,1,0,1,0,0|0,0,2]=4 7292 B9R1.73 N[C@@H](CCO)C1CCC1 Amb28072891 [0,1,0,1,0,0|0,0,2]=4 7293 B9R1.73 OCCC(O)C1CCC1 Amb23512730 [0,1,0,1,0,0|0,0,2]=4 7294 B9R1.75 CCCC(=O)CC1CC1 Amb28285122 [0,1,0,1,0,0|1,0,1]=4 7295 B9R1.75 CCCC(C)CC1CO1 Amb25769573 [0,1,0,1,0,0|0,0,2]=4 7296 B9R1.75 CCCN(C)C[C@@H]1CO1 Amb27656674 [0,1,0,1,0,0|1,0,1]=4 7297 B9R1.75 CCCN(C)C[C@H]1CO1 Amb27175073 [0,1,0,1,0,0|1,0,1]=4 7298 B9R1.75 CCCS(=O)CC1CO1 Amb27838502 [0,1,0,1,0,0|1,0,1]=4 7299 B9R1.75 CCCS(=O)C[C@H]1CO1 Amb27872919 [0,1,0,1,0,0|1,0,1]=4 7300 B9R1.75 CCOC(=N)CC1CC1 Amb27246564 [0,1,0,1,0,0|2,0,0]=4 7301 B9R1.75 CCOC(=O)CC1CC1 Amb22728965 [0,1,0,1,0,0|2,0,0]=4 7302 B9R1.75 CCOC(=O)CC1CO1 Amb22733457 [0,1,0,1,0,0|1,0,0]=3 7303 B9R1.75 CCOC(=O)C[C@@H]1CO1 Amb10070787 [0,1,0,1,0,0|1,0,0]=3 7304 B9R1.75 CCOC(=O)C[C@H]1CO1 Amb22285055 [0,1,0,1,0,0|1,0,0]=3 7305 B9R1.75 CCOC(C)CC1CO1 Amb33225078 [0,1,0,1,0,0|1,0,1]=4 7306 B9R1.75 NC(CCO)CC1CC1 Amb24358108 [0,1,0,1,0,0|0,0,2]=4 7307 B9R1.75 OCCC(O)CC1CC1 Amb27664147 [0,1,0,1,0,0|0,0,2]=4 7308 B9R1.90 CC1=C(CN)C(CN)C1 Amb27873943 [0,1,0,1,0,0|2,0,0]=4 7309 B9R1.90 CC1=C(CO)C(CO)C1 Amb28188227 [0,1,0,1,0,0|1,0,0]=3 7310 B9R1.90 CCC1C(=O)NC1CO Amb27445041 [0,1,0,1,0,0|1,0,1]=4 7311 B9R1.90 CC[C@H]1C(=O)N[C@H]1CO Amb27222345 [0,1,0,1,0,0|1,0,1]=4 7312 B9R1.90 O=C1CC(CO)C1CO Amb28200044 [0,1,0,1,0,0|1,0,1]=4 7313 B9R1.90 O=C1C[C@H](CO)[C@H]1CO Amb25328887 [0,1,0,1,0,0|1,0,1]=4 7314 B9R1.100 CC(CCCO)C1CC1 Amb26614838 [0,1,0,1,0,0|0,0,2]=4 7315 B9R1.100 CCCCC(=O)N1CC1 Amb28138225 [0,1,0,1,0,0|2,0,0]=4 7316 B9R1.100 CCCCC(O)C1CO1 Amb28048180 [0,1,0,1,0,0|0,0,2]=4 7317 B9R1.100 CCCC[C@@H](O)[C@@H]1CO1 Amb27186933 [0,1,0,1,0,0|0,0,2]=4 7318 B9R1.100 CCCC[C@@H](O)[C@H]1CO1 Amb27219813 [0,1,0,1,0,0|0,0,2]=4 7319 B9R1.100 CCCC[C@H](O)[C@H]1CO1 Amb27197461 [0,1,0,1,0,0|0,0,2]=4 7320 B9R1.100 CN(CCCO)C1CC1 Amb9370243 [0,1,0,1,0,0|1,0,1]=4 7321 B9R1.100 NCCCC(=O)C1CC1 Amb18203258 [0,1,0,1,0,0|1,0,1]=4 7322 B9R1.100 O=C(NCCO)C1CC1 Amb6537762 [0,1,0,1,0,0|1,0,1]=4 7323 B9R1.100 O=C(OCCO)C1CC1 Amb28256582 [0,1,0,1,0,0|1,0,1]=4 7324 B9R1.117 CC\C=C\C1(N)CCC1 Amb33272609 [0,1,0,1,0,0|1,0,0]=3 7325 B9R1.117 CC\C=C\C1(O)CNC1 Amb33267544 [0,1,0,1,0,0|2,0,0]=4 7326 B9R1.117 NC1(CCCO)CCC1 Amb30030884 [0,1,0,1,0,0|0,0,2]=4 7327 B9R1.117 OCCCC1(F)CCC1 Amb25285193 [0,1,0,1,0,0|0,0,2]=4 7328 B9R1.117 OCCCC1(O)CCC1 Amb25032198 [0,1,0,1,0,0|0,0,2]=4 7329 B9R1.134 CC1(CC=O)C=CCC1 Amb28434598 [0,1,0,1,0,0|0,0,2]=4 7330 B9R1.134 CC1(CCO)C=CCC1 Amb27978216 [0,1,0,1,0,0|0,0,0]=2 7331 B9R1.134 CC1(CCO)CCCC1 Amb27472477 [0,1,0,1,0,0|0,0,2]=4 7332 B9R1.134 CC1(CCO)CCCN1 Amb32946718 [0,1,0,1,0,0|1,0,1]=4 7333 B9R1.134 NC1(CCO)CC=CC1 Amb29870249 [0,1,0,1,0,0|0,0,2]=4 7334 B9R1.134 NC1(CCO)CCCC1 Amb27865768 [0,1,0,1,0,0|0,0,2]=4 7335 B9R1.134 NC1(CCO)CCOC1 Amb25349777 [0,1,0,1,0,0|1,0,1]=4 7336 B9R1.134 NC1(CCO)CCSC1 Amb26896245 [0,1,0,1,0,0|1,0,1]=4 7337 B9R1.134 OCCC1(O)CCCC1 Amb21961004 [0,1,0,1,0,0|0,0,2]=4 7338 B9R1.154 CCCC1C(=O)CC1C Amb27838721 [0,1,0,1,0,0|1,0,1]=4 7339 B9R1.154 CCC[C@@H]1C(=O)C[C@H]1C Amb27261959 [0,1,0,1,0,0|1,0,1]=4 7340 B9R1.183 CC1CC1C(N)CCO Amb27862891 [0,1,0,1,0,0|0,0,2]=4 7341 B9R1.183 CCOC(=O)C1CC1Br Amb22748767 [0,1,0,1,0,0|2,0,0]=4 7342 B9R1.183 CCOC(=O)C1CC1C Amb33531522 [0,1,0,1,0,0|2,0,0]=4 7343 B9R1.183 CCOC(=O)C1CC1F Amb26625378 [0,1,0,1,0,0|2,0,0]=4 7344 B9R1.183 CCOC(=O)C1CC1I Amb27883077 [0,1,0,1,0,0|2,0,0]=4 7345 B9R1.183 CCOC(=O)C1CC1N Amb27849855 [0,1,0,1,0,0|2,0,0]=4 7346 B9R1.183 CCOC(=O)[C@@H]1C[C@@H]1Br Amb27968070 [0,1,0,1,0,0|2,0,0]=4 7347 B9R1.183 CCOC(=O)[C@@H]1C[C@@H]1I Amb27783548 [0,1,0,1,0,0|2,0,0]=4 7348 B9R1.183 CCOC(=O)[C@@H]1C[C@H]1C Amb24514988 [0,1,0,1,0,0|2,0,0]=4 7349 B9R1.183 CCOC(=O)[C@@H]1C[C@H]1F Amb27947343 [0,1,0,1,0,0|2,0,0]=4 7350 B9R1.183 CCOC(=O)[C@H]1C[C@@H]1C Amb27236057 [0,1,0,1,0,0|2,0,0]=4 7351 B9R1.183 C\C(=C/CN)C1CC1C Amb27492817 [0,1,0,1,0,0|2,0,0]=4 7352 B9R1.4 CCC1CCN1CCO Amb27973516 [0,1,0,1,0,0|0,0,2]=4 7353 B9R1.4 CCC[C@H]1CN[C@@H]1CO Amb27194660 [0,1,0,1,0,0|0,0,2]=4 7354 B9R1.4 CCOC1CCC1CO Amb27456621 [0,1,0,1,0,0|0,0,2]=4 7355 B9R1.4 CC[C@@H]1CC[C@H]1CCO Amb27981762 [0,1,0,1,0,0|0,0,2]=4 7356 B9R1.4 CC[C@H]1CC[C@H]1CCO Amb27632068 [0,1,0,1,0,0|0,0,2]=4 7357 B9R1.5 C=C1CCCCCC1C Amb35681188 [0,1,0,1,0,0|1,0,1]=4 7358 B9R1.5 CC1=CCC=CCC1O Amb27653215 [0,1,0,1,0,0|0,0,2]=4 7359 B9R1.5 CC1=CCCCCC1O Amb27184844 [0,1,0,1,0,0|0,0,2]=4 7360 B9R1.5 CC1C=CCCCC1=O Amb27600759 [0,1,0,1,0,0|0,0,1]=3 7361 B9R1.5 CC1CCCC=CC1=O Amb27838624 [0,1,0,1,0,0|1,0,1]=4 7362 B9R1.5 CC1CCCCCC1=O Amb26348270 [0,1,0,1,0,0|1,0,1]=4 7363 B9R1.5 CC1CCCCCC1O Amb27243169 [0,1,0,1,0,0|0,0,2]=4 7364 B9R1.5 CC1CCNCCC1O Amb22886251 [0,1,0,1,0,0|0,0,2]=4 7365 B9R1.5 CC1CCNCCC1O Amb27430480 [0,1,0,1,0,0|0,0,2]=4 7366 B9R1.5 CC1CNCCCC1O Amb22886276 [0,1,0,1,0,0|0,0,2]=4 7367 B9R1.5 CC1CNCCCC1O Amb25959907 [0,1,0,1,0,0|0,0,2]=4 7368 B9R1.5 CC1NCCCNC1=O Amb33545017 [0,1,0,1,0,0|2,0,0]=4 7369 B9R1.5 CC1SCCCCC1=O Amb28048147 [0,1,0,1,0,0|0,1,1]=4 7370 B9R1.5 C[C@@H]1CCCCC[C@H]1O Amb28248774 [0,1,0,1,0,0|0,0,2]=4 7371 B9R1.5 C[C@@H]1CCCCNC1=O Amb28072473 [0,1,0,1,0,0|2,0,0]=4 7372 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [0,1,0,1,0,0|2,0,0]=4 7373 B9R1.5 C[C@H]1C=CCCC[C@@H]1O Amb27852529 [0,1,0,1,0,0|0,0,0]=2 7374 B9R1.5 C[C@H]1CCCCC[C@@H]1O Amb27844354 [0,1,0,1,0,0|0,0,2]=4 7375 B9R1.5 C[C@H]1CCCCC[C@H]1O Amb28139666 [0,1,0,1,0,0|0,0,2]=4 7376 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [0,1,0,1,0,0|2,0,0]=4 7377 B9R1.5 ClC1=COCCOC1Cl Amb28366955 [0,1,0,1,0,0|2,0,0]=4 7378 B9R1.5 NC1CCCC=CC1O Amb27209173 [0,1,0,1,0,0|2,0,0]=4 7379 B9R1.5 NC1CCCCC=C1Br Amb27747172 [0,1,0,1,0,0|2,0,0]=4 7380 B9R1.5 NC1CCCCCC1O Amb8855257 [0,1,0,1,0,0|0,0,2]=4 7381 B9R1.5 NC1CNCCCC1O Amb25230992 [0,1,0,1,0,0|1,0,1]=4 7382 B9R1.5 N[C@@H]1CCCCC[C@@H]1O Amb1994010 [0,1,0,1,0,0|0,0,2]=4 7383 B9R1.5 N[C@@H]1CCCCC[C@H]1O Amb1994009 [0,1,0,1,0,0|0,0,2]=4 7384 B9R1.5 N[C@@H]1CSCCC[C@H]1O Amb27231398 [0,1,0,1,0,0|1,0,1]=4 7385 B9R1.5 N[C@H]1CCCCC[C@@H]1O Amb26551623 [0,1,0,1,0,0|0,0,2]=4 7386 B9R1.5 O=C1C=CCCCC1O Amb27838742 [0,1,0,1,0,0|1,0,1]=4 7387 B9R1.5 OC1CCCCC=C1Br Amb27604372 [0,1,0,1,0,0|2,0,0]=4 7388 B9R1.5 OC1CCCCC=C1Cl Amb28185035 [0,1,0,1,0,0|2,0,0]=4 7389 B9R1.5 OC1CCCCCC1Br Amb24480058 [0,1,0,1,0,0|0,0,2]=4 7390 B9R1.5 OC1CCCCCC1Cl Amb27974196 [0,1,0,1,0,0|0,0,2]=4 7391 B9R1.5 OC1CCCCCC1I Amb27640772 [0,1,0,1,0,0|0,0,2]=4 7392 B9R1.5 OC1CCCCCC1O Amb2196454 [0,1,0,1,0,0|0,0,2]=4 7393 B9R1.5 OC1CCNCCC1F Amb22886248 [0,1,0,1,0,0|1,0,1]=4 7394 B9R1.5 OC1CCOCCC1O Amb28249062 [0,1,0,1,0,0|1,0,1]=4 7395 B9R1.5 O[C@@H]1C=CCCC[C@H]1O Amb27184263 [0,1,0,1,0,0|1,0,0]=3 7396 B9R1.5 O[C@@H]1CC=CCC[C@H]1O Amb27873382 [0,1,0,1,0,0|0,0,0]=2 7397 B9R1.5 O[C@@H]1CCCCC[C@H]1F Amb27853128 [0,1,0,1,0,0|0,0,2]=4 7398 B9R1.5 O[C@@H]1CCCCC[C@H]1O Amb22225422 [0,1,0,1,0,0|0,0,2]=4 7399 B9R1.5 O[C@@H]1CCNCC[C@H]1O Amb27796106 [0,1,0,1,0,0|1,0,1]=4 7400 B9R1.5 O[C@H]1C=CCC=C[C@H]1O Amb28064031 [0,1,0,1,0,0|1,0,1]=4 7401 B9R1.5 O[C@H]1C=CCCC[C@@H]1O Amb28428672 [0,1,0,1,0,0|1,0,0]=3 7402 B9R1.5 O[C@H]1CCCCC[C@@H]1Cl Amb27440550 [0,1,0,1,0,0|0,0,2]=4 7403 B9R1.5 O[C@H]1CCCCC[C@@H]1F Amb28344995 [0,1,0,1,0,0|0,0,2]=4 7404 B9R1.5 O[C@H]1CCCCC[C@@H]1O Amb22226791 [0,1,0,1,0,0|0,0,2]=4 7405 B9R1.5 O[C@H]1CCCCC[C@H]1Br Amb28051852 [0,1,0,1,0,0|0,0,2]=4 7406 B9R1.5 O[C@H]1CCCCC[C@H]1Cl Amb27657604 [0,1,0,1,0,0|0,0,2]=4 7407 B9R1.5 O[C@H]1CCCNC[C@@H]1O Amb27231520 [0,1,0,1,0,0|1,0,1]=4 7408 B9R1.5 O[C@H]1CCCNC[C@H]1O Amb28059995 [0,1,0,1,0,0|1,0,1]=4 7409 B9R1.14 C=CC1CC=CC1CBr Amb27861459 [0,1,0,1,0,0|1,0,1]=4 7410 B9R1.14 C=CC1CC=CC1CO Amb27197092 [0,1,0,1,0,0|1,0,1]=4 7411 B9R1.14 C=C[C@@H]1CC=C[C@@H]1CO Amb28196952 [0,1,0,1,0,0|1,0,1]=4 7412 B9R1.14 C=C[C@H]1CC=C[C@H]1CO Amb27632634 [0,1,0,1,0,0|1,0,1]=4 7413 B9R1.14 CCC1=C(CO)CCC1 Amb27978212 [0,1,0,1,0,0|0,0,1]=3 7414 B9R1.14 CCC1CCC=C1CO Amb28049264 [0,1,0,1,0,0|2,0,0]=4 7415 B9R1.14 CCC1CNCC1CO Amb27441323 [0,1,0,1,0,0|0,0,2]=4 7416 B9R1.14 CCC1COCC1CO Amb35651599 [0,1,0,1,0,0|0,0,2]=4 7417 B9R1.14 CCC1NCCC1CO Amb26643148 [0,1,0,1,0,0|0,0,2]=4 7418 B9R1.14 CCC1OCCC1CO Amb27975537 [0,1,0,1,0,0|0,0,2]=4 7419 B9R1.14 CCN1CCCC1CO Amb6537970 [0,1,0,1,0,0|0,0,2]=4 7420 B9R1.14 CCN1CCCC1CO Amb6537973 [0,1,0,1,0,0|0,0,2]=4 7421 B9R1.14 CCN1CCC[C@@H]1CO Amb24678478 [0,1,0,1,0,0|0,0,2]=4 7422 B9R1.14 CCN1CCC[C@H]1CO Amb19517075 [0,1,0,1,0,0|0,0,2]=4 7423 B9R1.14 CC[C@@H]1NCC[C@@H]1CO Amb27800143 [0,1,0,1,0,0|0,0,2]=4 7424 B9R1.14 CC[C@H]1CNC[C@@H]1CO Amb33871489 [0,1,0,1,0,0|0,0,2]=4 7425 B9R1.14 CCc1ccsc1CO Amb24352853 [0,1,0,1,0,0|0,0,2]=4 7426 B9R1.14 CCc1occc1CO Amb27444076 [0,1,0,1,0,0|0,0,2]=4 7427 B9R1.14 CCc1ocnc1CO Amb28366815 [0,1,0,1,0,0|1,0,1]=4 7428 B9R1.14 CCc1sccc1CO Amb27752318 [0,1,0,1,0,0|0,0,2]=4 7429 B9R1.14 CCn1cccc1CO Amb837266 [0,1,0,1,0,0|0,0,2]=4 7430 B9R1.14 CCn1ccnc1CO Amb7093337 [0,1,0,1,0,0|1,0,1]=4 7431 B9R1.14 CNC1CNCC1CO Amb27229840 [0,1,0,1,0,0|1,0,1]=4 7432 B9R1.14 CN[C@H]1C=CC[C@H]1NC Amb27468623 [0,1,0,1,0,0|2,0,0]=4 7433 B9R1.14 COC1C=COC1CO Amb27755993 [0,1,0,1,0,0|1,0,0]=3 7434 B9R1.14 COC1CCCC1CO Amb27977996 [0,1,0,1,0,0|0,0,2]=4 7435 B9R1.14 COC1CNCC1CO Amb27440384 [0,1,0,1,0,0|1,0,1]=4 7436 B9R1.14 CO[C@@H]1CCC[C@@H]1CO Amb27420276 [0,1,0,1,0,0|0,0,2]=4 7437 B9R1.14 C\C=C1\OC=CC1CO Amb28315503 [0,1,0,1,0,0|0,0,2]=4 7438 B9R1.14 OCC1CCCC1CF Amb27185976 [0,1,0,1,0,0|0,0,2]=4 7439 B9R1.14 OCC1CCCC1CO Amb27484587 [0,1,0,1,0,0|0,0,2]=4 7440 B9R1.14 OCC1CCNC1CO Amb24617756 [0,1,0,1,0,0|1,0,1]=4 7441 B9R1.14 OCC1CNCC1CO Amb27191993 [0,1,0,1,0,0|1,0,1]=4 7442 B9R1.14 OCC1CNCC1CO Amb32752685 [0,1,0,1,0,0|1,0,1]=4 7443 B9R1.14 OC[C@@H]1CCC[C@H]1CO Amb28053551 [0,1,0,1,0,0|0,0,2]=4 7444 B9R1.14 OC[C@@H]1CNC[C@@H]1CO Amb13883446 [0,1,0,1,0,0|1,0,1]=4 7445 B9R1.14 OC[C@@H]1CNC[C@@H]1CO Amb22230441 [0,1,0,1,0,0|1,0,1]=4 7446 B9R1.14 OC[C@@H]1CNC[C@H]1CO Amb17621969 [0,1,0,1,0,0|1,0,1]=4 7447 B9R1.14 OC[C@@H]1CNC[C@H]1CO Amb22757866 [0,1,0,1,0,0|1,0,1]=4 7448 B9R1.14 OC[C@H]1C=CC[C@@H]1CO Amb27206819 [0,1,0,1,0,0|0,0,0]=2 7449 B9R1.14 OC[C@H]1CCC[C@@H]1CO Amb27783101 [0,1,0,1,0,0|0,0,2]=4 7450 B9R1.14 OC[C@H]1CCC[C@H]1CCl Amb27196244 [0,1,0,1,0,0|0,0,2]=4 7451 B9R1.14 OC[C@H]1CCC[C@H]1CO Amb28187775 [0,1,0,1,0,0|0,0,2]=4 7452 B9R1.14 OC[C@H]1CCN[C@H]1CO Amb25180858 [0,1,0,1,0,0|1,0,1]=4 7453 B9R1.16 CC1CC1CNCCO Amb27948476 [0,1,0,1,0,0|0,0,2]=4 7454 B9R1.16 CC1CC1NCCCO Amb19022443 [0,1,0,1,0,0|0,0,2]=4 7455 B9R1.16 CCCCCC1OC1C Amb25888870 [0,1,0,1,0,0|0,0,2]=4 7456 B9R1.16 CCCCC[C@H]1C[C@H]1O Amb28292777 [0,1,0,1,0,0|0,0,2]=4 7457 B9R1.16 CCCC\C=C1/CC1Br Amb27232659 [0,1,0,1,0,0|1,0,0]=3 7458 B9R1.16 CCC\C=C\C1CC1N Amb33327143 [0,1,0,1,0,0|1,0,0]=3 7459 B9R1.16 CCC\C=C\[C@@H]1C[C@H]1N Amb33327154 [0,1,0,1,0,0|1,0,0]=3 7460 B9R1.16 C\C=C\CCC1OC1C Amb27791225 [0,1,0,1,0,0|0,0,2]=4 7461 B9R1.17 C=CCCC=C1CNC1 Amb28313998 [0,1,0,1,0,0|1,0,1]=4 7462 B9R1.17 CCC\C=C\C1CCN1 Amb33327127 [0,1,0,1,0,0|1,0,0]=3 7463 B9R1.17 CCC\C=C\C1CNC1 Amb33327128 [0,1,0,1,0,0|2,0,0]=4 7464 B9R1.17 CC\C=C\CC1CNC1 Amb33268266 [0,1,0,1,0,0|1,0,0]=3 7465 B9R1.17 OCCCCC1CCC1 Amb32945992 [0,1,0,1,0,0|0,0,2]=4 7466 B9R1.17 OCCCCC1CCN1 Amb27186139 [0,1,0,1,0,0|0,0,2]=4 7467 B9R1.17 OCCCCC1CCO1 Amb27486325 [0,1,0,1,0,0|0,0,2]=4 7468 B9R1.17 OCCCCC1CNC1 Amb27186138 [0,1,0,1,0,0|0,0,2]=4 7469 B9R1.17 OCCCCC1COC1 Amb25187833 [0,1,0,1,0,0|0,0,2]=4 7470 B9R1.17 OCCCC[C@H]1CCO1 Amb27807122 [0,1,0,1,0,0|0,0,2]=4 7471 B9R1.17 OCCCNC1CCC1 Amb22229279 [0,1,0,1,0,0|0,0,2]=4 7472 B9R1.17 OCCCNC1COC1 Amb25265104 [0,1,0,1,0,0|1,0,1]=4 7473 B9R1.17 OCCCOC1CCC1 Amb27948159 [0,1,0,1,0,0|0,0,2]=4 7474 B9R1.17 OCCCOC1CNC1 Amb26934686 [0,1,0,1,0,0|1,0,1]=4 7475 B9R1.17 OCCCOC1COC1 Amb25889519 [0,1,0,1,0,0|1,0,1]=4 7476 B9R1.17 OCCCSC1COC1 Amb27982347 [0,1,0,1,0,0|1,0,1]=4 7477 B9R1.17 OCCNCC1CCC1 Amb8929462 [0,1,0,1,0,0|0,0,2]=4 7478 B9R1.17 OCCOCC1CCC1 Amb27246167 [0,1,0,1,0,0|0,0,2]=4 7479 B9R1.17 OCCON=C1CCC1 Amb27455920 [0,1,0,1,0,0|1,0,1]=4 7480 B9R1.39 CC1=C(C#CCO)CC1 Amb28453484 [0,1,0,1,0,0|0,0,2]=4 7481 B9R1.39 CCCCC1CCC1O Amb32950020 [0,1,0,1,0,0|0,0,2]=4 7482 B9R1.39 CCCO[C@@H]1CC[C@H]1O Amb33495605 [0,1,0,1,0,0|0,0,2]=4 7483 B9R1.39 CCOCC1CCC1O Amb33213410 [0,1,0,1,0,0|0,0,2]=4 7484 B9R1.39 NCCCC1CCC1O Amb25784142 [0,1,0,1,0,0|0,0,2]=4 7485 B9R1.39 NCCCN1CCC1=O Amb27209792 [0,1,0,1,0,0|2,0,0]=4 7486 B9R1.39 O=C1CCC1CCCCl Amb32684692 [0,1,0,1,0,0|1,0,1]=4 7487 B9R1.39 OCCCC1CCC1O Amb28138520 [0,1,0,1,0,0|0,0,2]=4 7488 B9R1.83 BrCCCCC=C1CC1 Amb28141873 [0,1,0,1,0,0|1,0,0]=3 7489 B9R1.83 CCCCCCC1CO1 Amb17771533 [0,1,0,1,0,0|0,0,2]=4 7490 B9R1.83 CCCCCC[C@@H]1CO1 Amb22225139 [0,1,0,1,0,0|0,0,2]=4 7491 B9R1.83 CCCCCC[C@H]1CO1 Amb24529260 [0,1,0,1,0,0|0,0,2]=4 7492 B9R1.83 CCCCNCC1CO1 Amb27950731 [0,1,0,1,0,0|0,0,2]=4 7493 B9R1.83 CCCCOCC1CO1 Amb534220 [0,1,0,1,0,0|0,0,2]=4 7494 B9R1.83 CCCCOC[C@@H]1CO1 Amb16185838 [0,1,0,1,0,0|0,0,2]=4 7495 B9R1.83 CCCCOC[C@H]1CO1 Amb26926784 [0,1,0,1,0,0|0,0,2]=4 7496 B9R1.83 CCCCSC[C@H]1CO1 Amb27753323 [0,1,0,1,0,0|0,0,2]=4 7497 B9R1.83 CCCSCCC1CO1 Amb27256622 [0,1,0,1,0,0|0,0,2]=4 7498 B9R1.83 CCC\C=C\CC1CO1 Amb33424832 [0,1,0,1,0,0|0,0,0]=2 7499 B9R1.83 COCCCNC1CC1 Amb17231857 [0,1,0,1,0,0|1,0,1]=4 7500 B9R1.83 COCCOCC1CO1 Amb6243026 [0,1,0,1,0,0|1,0,1]=4 7501 B9R1.83 COCC\C=C\C1CC1 Amb22365293 [0,1,0,1,0,0|0,0,2]=4 7502 B9R1.83 C\C=C\CNCC1CO1 Amb27422891 [0,1,0,1,0,0|0,0,2]=4 7503 B9R1.83 ClCCCOCC1CO1 Amb27254191 [0,1,0,1,0,0|1,0,1]=4 7504 B9R1.83 ClCC\C=C\CC1CC1 Amb27606139 [0,1,0,1,0,0|1,0,0]=3 7505 B9R1.83 O=CCCCC=C1CC1 Amb27636935 [0,1,0,1,0,0|0,0,1]=3 7506 B9R1.83 O=CCC\C=C\C1CC1 Amb26067487 [0,1,0,1,0,0|0,0,2]=4 7507 B9R1.83 OCCCC#CC1CC1 Amb32950253 [0,1,0,1,0,0|0,0,2]=4 7508 B9R1.83 OCCCCC=C1CC1 Amb25889566 [0,1,0,1,0,0|0,0,0]=2 7509 B9R1.83 OCCCCCC1CO1 Amb28189365 [0,1,0,1,0,0|0,0,2]=4 7510 B9R1.83 OCCCCNC1CC1 Amb17334108 [0,1,0,1,0,0|0,0,2]=4 7511 B9R1.83 OCCCNCC1CC1 Amb9423145 [0,1,0,1,0,0|0,0,2]=4 7512 B9R1.83 OCCCOCC1CC1 Amb27622883 [0,1,0,1,0,0|0,0,2]=4 7513 B9R1.83 OCCCSCC1CC1 Amb24478768 [0,1,0,1,0,0|0,0,2]=4 7514 B9R1.83 OCCOCCC1CC1 Amb28049210 [0,1,0,1,0,0|0,0,2]=4 7515 B9R1.89 BrCC1C=CCCCC1 Amb33329273 [0,1,0,1,0,0|1,0,0]=3 7516 B9R1.89 BrCC1CCC=CCC1 Amb25258005 [0,1,0,1,0,0|1,0,0]=3 7517 B9R1.89 BrCC1COCCCO1 Amb28400157 [0,1,0,1,0,0|1,0,1]=4 7518 B9R1.89 BrCC1OCC=CCO1 Amb22226798 [0,1,0,1,0,0|2,0,0]=4 7519 B9R1.89 BrCC1OCCCCO1 Amb534476 [0,1,0,1,0,0|1,0,1]=4 7520 B9R1.89 CCC1=NCCCCN1 Amb27627181 [0,1,0,1,0,0|1,0,1]=4 7521 B9R1.89 CCC1CCNCCO1 Amb25367816 [0,1,0,1,0,0|0,0,2]=4 7522 B9R1.89 CCC1CCNCCO1 Amb33482722 [0,1,0,1,0,0|0,0,2]=4 7523 B9R1.89 CCC1CNCCCO1 Amb9358448 [0,1,0,1,0,0|0,0,2]=4 7524 B9R1.89 CCC1COCCCN1 Amb18106727 [0,1,0,1,0,0|1,0,1]=4 7525 B9R1.89 COC1=CCCCCC1 Amb26014503 [0,1,0,1,0,0|2,0,0]=4 7526 B9R1.89 COC1CCCNCC1 Amb22405875 [0,1,0,1,0,0|1,0,1]=4 7527 B9R1.89 COC1CCCNCC1 Amb22405876 [0,1,0,1,0,0|1,0,1]=4 7528 B9R1.89 CSC1=CCCCCN1 Amb27395313 [0,1,0,1,0,0|2,0,0]=4 7529 B9R1.89 ClCC1CCC=CCC1 Amb32688179 [0,1,0,1,0,0|1,0,0]=3 7530 B9R1.89 FCC1CNCCCO1 Amb26864262 [0,1,0,1,0,0|1,0,1]=4 7531 B9R1.89 FCC1CNCCCO1 Amb28920737 [0,1,0,1,0,0|1,0,1]=4 7532 B9R1.89 ICC1CCCCCO1 Amb22489614 [0,1,0,1,0,0|0,0,2]=4 7533 B9R1.89 NCC1=CCCCCC1 Amb27403312 [0,1,0,1,0,0|2,0,0]=4 7534 B9R1.89 NCC1C=CCCCC1 Amb28184480 [0,1,0,1,0,0|1,0,0]=3 7535 B9R1.89 NCC1C=CCCCC1 Amb33744094 [0,1,0,1,0,0|1,0,0]=3 7536 B9R1.89 NCC1CCC=CCC1 Amb25319588 [0,1,0,1,0,0|1,0,0]=3 7537 B9R1.89 NCC1CCC=CCC1 Amb30585194 [0,1,0,1,0,0|1,0,0]=3 7538 B9R1.89 OCC1=CCC=CCC1 Amb28315414 [0,1,0,1,0,0|0,0,1]=3 7539 B9R1.89 OCC1=CCCCCC1 Amb27424682 [0,1,0,1,0,0|2,0,0]=4 7540 B9R1.89 OCC1C=CCCCC1 Amb27662352 [0,1,0,1,0,0|1,0,0]=3 7541 B9R1.89 OCC1CCC=CCC1 Amb25100187 [0,1,0,1,0,0|0,0,0]=2 7542 B9R1.89 OCC1CCCCCC1 Amb20240529 [0,1,0,1,0,0|0,0,2]=4 7543 B9R1.89 OCC1CCCCCC1 Amb34916703 [0,1,0,1,0,0|0,0,2]=4 7544 B9R1.89 OCC1CCCCCN1 Amb33551226 [0,1,0,1,0,0|0,0,2]=4 7545 B9R1.89 OCC1CCCCCN1 Amb8009310 [0,1,0,1,0,0|0,0,2]=4 7546 B9R1.89 OCC1CCCCCO1 Amb25687959 [0,1,0,1,0,0|0,0,2]=4 7547 B9R1.89 OCC1CCCCNC1 Amb19149352 [0,1,0,1,0,0|0,0,2]=4 7548 B9R1.89 OCC1CCCCNC1 Amb8630389 [0,1,0,1,0,0|0,0,2]=4 7549 B9R1.89 OCC1CCCNCC1 Amb22886282 [0,1,0,1,0,0|0,0,2]=4 7550 B9R1.89 OCC1CCCNCC1 Amb33545032 [0,1,0,1,0,0|0,0,2]=4 7551 B9R1.89 OCC1CCCOCC1 Amb18203196 [0,1,0,1,0,0|0,0,2]=4 7552 B9R1.89 OCC1CCCSCC1 Amb18202263 [0,1,0,1,0,0|0,0,2]=4 7553 B9R1.89 OCC1CCNCCN1 Amb27413110 [0,1,0,1,0,0|1,0,1]=4 7554 B9R1.89 OCC1CCNCCO1 Amb26354139 [0,1,0,1,0,0|1,0,1]=4 7555 B9R1.89 OCC1CCNCCO1 Amb33482558 [0,1,0,1,0,0|1,0,1]=4 7556 B9R1.89 OCC1CCOCCN1 Amb26354772 [0,1,0,1,0,0|1,0,1]=4 7557 B9R1.89 OCC1CCOCCN1 Amb33744058 [0,1,0,1,0,0|1,0,1]=4 7558 B9R1.89 OCC1CCOCCO1 Amb27838550 [0,1,0,1,0,0|1,0,1]=4 7559 B9R1.89 OCC1CCSCCN1 Amb27778584 [0,1,0,1,0,0|1,0,1]=4 7560 B9R1.89 OCC1CNCCCO1 Amb17935876 [0,1,0,1,0,0|1,0,1]=4 7561 B9R1.89 OCC1CNCCCO1 Amb22497000 [0,1,0,1,0,0|1,0,1]=4 7562 B9R1.89 OCC1CNCCNC1 Amb22224806 [0,1,0,1,0,0|1,0,1]=4 7563 B9R1.89 OCC1CNCCOC1 Amb24481995 [0,1,0,1,0,0|1,0,1]=4 7564 B9R1.89 OCC1CNCCOC1 Amb33483671 [0,1,0,1,0,0|1,0,1]=4 7565 B9R1.89 OCC1COCCCO1 Amb25229839 [0,1,0,1,0,0|1,0,1]=4 7566 B9R1.89 OCC1COCCOC1 Amb27253103 [0,1,0,1,0,0|1,0,1]=4 7567 B9R1.89 OC[C@@H]1C=CCC=CC1 Amb27418283 [0,1,0,1,0,0|0,0,1]=3 7568 B9R1.89 OC[C@@H]1CCCCCN1 Amb24117101 [0,1,0,1,0,0|0,0,2]=4 7569 B9R1.89 OC[C@@H]1CCCCNC1 Amb28315456 [0,1,0,1,0,0|0,0,2]=4 7570 B9R1.89 OC[C@H]1C=CCC=CC1 Amb27653026 [0,1,0,1,0,0|0,0,1]=3 7571 B9R1.89 ONC1CCCSCC1 Amb35692798 [0,1,0,1,0,0|1,0,1]=4 7572 B9R1.103 C1=CCOCCCCC1 Amb29838311 [0,1,0,1,0,0|1,0,0]=3 7573 B9R1.103 C1COCCOCCN1 Amb26437554 [0,1,0,1,0,0|1,0,1]=4 7574 B9R1.103 C1COCCOCCN1 Amb33743596 [0,1,0,1,0,0|1,0,1]=4 7575 B9R1.103 C1CSCCSCCO1 Amb24647700 [0,1,0,1,0,0|1,0,1]=4 7576 B9R1.1 C=C1CCC(CBr)CC1 Amb15695263 [0,1,0,1,0,0|1,0,1]=4 7577 B9R1.1 C=C1CCC(CN)CC1 Amb13882965 [0,1,0,1,0,0|1,0,1]=4 7578 B9R1.1 C=C1CCC(CN)CC1 Amb30585185 [0,1,0,1,0,0|1,0,1]=4 7579 B9R1.1 C=C1CCC(CO)CC1 Amb10975464 [0,1,0,1,0,0|0,0,1]=3 7580 B9R1.1 CC1=CCC(C=O)CC1 Amb614508 [0,1,0,1,0,0|0,0,2]=4 7581 B9R1.1 CC1=CCC(CO)CC1 Amb2699906 [0,1,0,1,0,0|0,0,0]=2 7582 B9R1.1 CC1=NOC(CO)CC1 Amb27192019 [0,1,0,1,0,0|2,0,0]=4 7583 B9R1.1 CC1CCC(CO)CC1 Amb22229834 [0,1,0,1,0,0|0,0,2]=4 7584 B9R1.1 CC1CCC(CO)CN1 Amb22886321 [0,1,0,1,0,0|1,0,1]=4 7585 B9R1.1 CC1CCC(CO)CO1 Amb35678925 [0,1,0,1,0,0|1,0,1]=4 7586 B9R1.1 CCC1=CCC(N)CC1 Amb27229710 [0,1,0,1,0,0|1,0,0]=3 7587 B9R1.1 CCC1=CCC(O)CC1 Amb27618200 [0,1,0,1,0,0|1,0,0]=3 7588 B9R1.1 CCC1C=CC(=O)CC1 Amb26870913 [0,1,0,1,0,0|1,0,1]=4 7589 B9R1.1 CCC1CCC(=O)CC1 Amb6296028 [0,1,0,1,0,0|1,0,1]=4 7590 B9R1.1 CN1CCC(CO)CC1 Amb1099350 [0,1,0,1,0,0|1,0,1]=4 7591 B9R1.1 CN1CCC(CO)CC1 Amb32410101 [0,1,0,1,0,0|1,0,1]=4 7592 B9R1.1 CN[C@@H]1CC=C(C)CC1 Amb28049919 [0,1,0,1,0,0|2,0,0]=4 7593 B9R1.1 COC1=CCC(O)CC1 Amb21858056 [0,1,0,1,0,0|2,0,0]=4 7594 B9R1.1 COC1CC=C(C)CC1 Amb25279365 [0,1,0,1,0,0|2,0,0]=4 7595 B9R1.1 C[C@@H]1CCC(CO)CN1 Amb27424728 [0,1,0,1,0,0|1,0,1]=4 7596 B9R1.1 C[C@@H]1CC[C@@H](CO)CN1 Amb24062957 [0,1,0,1,0,0|1,0,1]=4 7597 B9R1.1 C[C@@H]1CC[C@@H](CO)CN1 Amb24515133 [0,1,0,1,0,0|1,0,1]=4 7598 B9R1.1 C[C@@H]1CC[C@H](CO)CN1 Amb27986119 [0,1,0,1,0,0|1,0,1]=4 7599 B9R1.1 C[C@@H]1CC[C@H](CO)CN1 Amb30869370 [0,1,0,1,0,0|1,0,1]=4 7600 B9R1.1 C[C@H]1CC[C@@H](CO)CC1 Amb26407994 [0,1,0,1,0,0|0,0,2]=4 7601 B9R1.1 C[C@H]1CC[C@@H](CO)CN1 Amb33801087 [0,1,0,1,0,0|1,0,1]=4 7602 B9R1.1 C[C@H]1CC[C@H](CO)CC1 Amb22886817 [0,1,0,1,0,0|0,0,2]=4 7603 B9R1.1 N#CC1CC=C(F)CC1 Amb22753713 [0,1,0,1,0,0|1,0,1]=4 7604 B9R1.1 NC1CCC(CO)CC1 Amb6740014 [0,1,0,1,0,0|0,0,2]=4 7605 B9R1.1 NCC1CCC(=O)CC1 Amb31307747 [0,1,0,1,0,0|1,0,1]=4 7606 B9R1.1 NCC1CCC(=O)NC1 Amb18832607 [0,1,0,1,0,0|2,0,0]=4 7607 B9R1.1 NCC1CCC(=O)NC1 Amb32653087 [0,1,0,1,0,0|2,0,0]=4 7608 B9R1.1 NCC1CCC(=O)NC1 Amb32653107 [0,1,0,1,0,0|2,0,0]=4 7609 B9R1.1 NCC1CCC(=O)NC1 Amb35748141 [0,1,0,1,0,0|2,0,0]=4 7610 B9R1.1 NN1CCC(CO)CC1 Amb27476119 [0,1,0,1,0,0|1,0,1]=4 7611 B9R1.1 N[C@@H]1C=C[C@H](CO)CC1 Amb24649717 [0,1,0,1,0,0|0,0,2]=4 7612 B9R1.1 N[C@H]1C=C[C@@H](CO)CC1 Amb24443345 [0,1,0,1,0,0|0,0,2]=4 7613 B9R1.1 N[C@H]1CC[C@@H](CO)CC1 Amb20668772 [0,1,0,1,0,0|0,0,2]=4 7614 B9R1.1 N[C@H]1CC[C@@H](CO)CC1 Amb22899692 [0,1,0,1,0,0|0,0,2]=4 7615 B9R1.1 N[C@H]1CC[C@H](CO)CC1 Amb17607961 [0,1,0,1,0,0|0,0,2]=4 7616 B9R1.1 N[C@H]1CC[C@H](CO)CC1 Amb22747955 [0,1,0,1,0,0|0,0,2]=4 7617 B9R1.1 O=C1C=C[C@@H](CO)CC1 Amb27838659 [0,1,0,1,0,0|0,0,1]=3 7618 B9R1.1 O=C1CCC(CBr)CC1 Amb26583100 [0,1,0,1,0,0|1,0,1]=4 7619 B9R1.1 O=C1CCC(CBr)CN1 Amb23597460 [0,1,0,1,0,0|2,0,0]=4 7620 B9R1.1 O=C1CCC(CCl)CC1 Amb27196238 [0,1,0,1,0,0|1,0,1]=4 7621 B9R1.1 O=C1CCC(CO)CC1 Amb10071596 [0,1,0,1,0,0|0,0,1]=3 7622 B9R1.1 O=C1CCC(CO)CN1 Amb19958990 [0,1,0,1,0,0|1,0,0]=3 7623 B9R1.1 O=C1COC(CO)CN1 Amb22236094 [0,1,0,1,0,0|2,0,0]=4 7624 B9R1.1 O=C1COC(CO)CO1 Amb28315509 [0,1,0,1,0,0|2,0,0]=4 7625 B9R1.1 O=C1CO[C@H](CO)CN1 Amb10067153 [0,1,0,1,0,0|2,0,0]=4 7626 B9R1.1 O=CC1CC=C(Cl)CC1 Amb18124712 [0,1,0,1,0,0|0,0,2]=4 7627 B9R1.1 OCC1=CCC(O)CC1 Amb28206504 [0,1,0,1,0,0|2,0,0]=4 7628 B9R1.1 OCC1CC=C(O)CC1 Amb27465669 [0,1,0,1,0,0|0,0,0]=2 7629 B9R1.1 OCC1CCC(F)CC1 Amb24122685 [0,1,0,1,0,0|0,0,2]=4 7630 B9R1.1 OCC1CCC(O)CC1 Amb13883568 [0,1,0,1,0,0|0,0,2]=4 7631 B9R1.1 OC[C@H]1CC[C@@H](F)CC1 Amb34163407 [0,1,0,1,0,0|0,0,2]=4 7632 B9R1.1 OC[C@H]1CC[C@@H](O)CC1 Amb26345146 [0,1,0,1,0,0|0,0,2]=4 7633 B9R1.1 OC[C@H]1CC[C@H](F)CC1 Amb34165509 [0,1,0,1,0,0|0,0,2]=4 7634 B9R1.1 OC[C@H]1CC[C@H](O)CC1 Amb25320791 [0,1,0,1,0,0|0,0,2]=4 7635 B9R1.3 C=C1C=CC[C@@H](O)[C@@H]1O Amb28248512 [0,1,0,1,0,0|0,0,2]=4 7636 B9R1.3 C=C1CCCC(C)C1C Amb27262099 [0,1,0,1,0,0|1,0,1]=4 7637 B9R1.3 CC1=C(C)C(O)CCC1 Amb27450753 [0,1,0,1,0,0|0,0,2]=4 7638 B9R1.3 CC1=C(C)[C@H](O)CCC1 Amb27399340 [0,1,0,1,0,0|0,0,2]=4 7639 B9R1.3 CC1=C(Cl)CCCC1O Amb10552852 [0,1,0,1,0,0|0,0,2]=4 7640 B9R1.3 CC1=CCC[C@@H](C)C1Br Amb27407012 [0,1,0,1,0,0|2,0,0]=4 7641 B9R1.3 CC1=CCC[C@@H](O)[C@@H]1O Amb27422504 [0,1,0,1,0,0|1,0,0]=3 7642 B9R1.3 CC1C(=O)CCC[C@H]1C Amb27951545 [0,1,0,1,0,0|1,0,1]=4 7643 B9R1.3 CC1C(=O)NCCC1O Amb27836723 [0,1,0,1,0,0|1,0,0]=3 7644 B9R1.3 CC1C(O)CCCN1C Amb27481456 [0,1,0,1,0,0|1,0,1]=4 7645 B9R1.3 CC1C=CCC(=O)C1C Amb28245024 [0,1,0,1,0,0|1,0,1]=4 7646 B9R1.3 CC1C=CCC(C)C1C Amb26068926 [0,1,0,1,0,0|1,0,0]=3 7647 B9R1.3 CC1C=CCC(C)N1C Amb27793646 [0,1,0,1,0,0|2,0,0]=4 7648 B9R1.3 CC1C=CCC(O)C1O Amb27756031 [0,1,0,1,0,0|0,0,0]=2 7649 B9R1.3 CC1CC=CC(=O)C1C Amb27838646 [0,1,0,1,0,0|1,0,1]=4 7650 B9R1.3 CC1CC=CC(O)C1O Amb27466712 [0,1,0,1,0,0|1,0,0]=3 7651 B9R1.3 CC1CCCC(=O)C1C Amb27593439 [0,1,0,1,0,0|1,0,1]=4 7652 B9R1.3 CC1CCCC(Br)C1O Amb24601208 [0,1,0,1,0,0|0,0,2]=4 7653 B9R1.3 CC1CCCC(C)C1O Amb2227580 [0,1,0,1,0,0|0,0,2]=4 7654 B9R1.3 CC1CCCC(Cl)C1O Amb24539273 [0,1,0,1,0,0|0,0,2]=4 7655 B9R1.3 CC1CCCC(O)C1C Amb9825841 [0,1,0,1,0,0|0,0,2]=4 7656 B9R1.3 CC1CCC[C@@H](O)[C@@H]1O Amb28318183 [0,1,0,1,0,0|0,0,2]=4 7657 B9R1.3 CC1CCC[C@H](O)[C@@H]1O Amb27844355 [0,1,0,1,0,0|0,0,2]=4 7658 B9R1.3 CC1CNCC(C)C1O Amb22299424 [0,1,0,1,0,0|1,0,1]=4 7659 B9R1.3 CC1CNCC(C)C1O Amb28555619 [0,1,0,1,0,0|1,0,1]=4 7660 B9R1.3 CC1CNCC(N)C1O Amb27651624 [0,1,0,1,0,0|1,0,1]=4 7661 B9R1.3 CC1CNC[C@@H](O)[C@@H]1O Amb27810800 [0,1,0,1,0,0|1,0,1]=4 7662 B9R1.3 CC1CNC[C@H](O)[C@H]1O Amb28128453 [0,1,0,1,0,0|1,0,1]=4 7663 B9R1.3 CC1COCC(C)C1O Amb22299419 [0,1,0,1,0,0|1,0,1]=4 7664 B9R1.3 CC1CSCC(O)C1O Amb28069518 [0,1,0,1,0,0|1,0,1]=4 7665 B9R1.3 CC1NNCC(O)C1O Amb28138736 [0,1,0,1,0,0|2,0,0]=4 7666 B9R1.3 CC1OC=CC(N)C1O Amb27965411 [0,1,0,1,0,0|1,0,1]=4 7667 B9R1.3 CC1OCCC(N)C1O Amb27623875 [0,1,0,1,0,0|1,0,1]=4 7668 B9R1.3 CC1OCCC(O)C1O Amb25147154 [0,1,0,1,0,0|1,0,1]=4 7669 B9R1.3 CC1ONCC(O)C1O Amb28400716 [0,1,0,1,0,0|2,0,0]=4 7670 B9R1.3 C[C@@H]1C(=O)C=CC[C@H]1C Amb28054028 [0,1,0,1,0,0|1,0,1]=4 7671 B9R1.3 C[C@@H]1C(=O)CCC[C@@H]1N Amb27818101 [0,1,0,1,0,0|1,0,1]=4 7672 B9R1.3 C[C@@H]1C(O)CCC[C@H]1C Amb27451971 [0,1,0,1,0,0|0,0,2]=4 7673 B9R1.3 C[C@@H]1C=CC[C@@H](O)[C@@H]1O Amb28127362 [0,1,0,1,0,0|0,0,0]=2 7674 B9R1.3 C[C@@H]1CCCC(O)[C@@H]1C Amb27664284 [0,1,0,1,0,0|0,0,2]=4 7675 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1C Amb27876256 [0,1,0,1,0,0|0,0,2]=4 7676 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1O Amb28320895 [0,1,0,1,0,0|0,0,2]=4 7677 B9R1.3 C[C@@H]1CCC[C@H](O)C1O Amb27198139 [0,1,0,1,0,0|0,0,2]=4 7678 B9R1.3 C[C@@H]1CNC[C@@H](N)[C@H]1O Amb27422127 [0,1,0,1,0,0|1,0,1]=4 7679 B9R1.3 C[C@@H]1CNC[C@@H](O)[C@H]1O Amb32410906 [0,1,0,1,0,0|1,0,1]=4 7680 B9R1.3 C[C@@H]1CNC[C@H](O)[C@@H]1O Amb32410907 [0,1,0,1,0,0|1,0,1]=4 7681 B9R1.3 C[C@@H]1CSC[C@H](O)[C@@H]1O Amb27662365 [0,1,0,1,0,0|1,0,1]=4 7682 B9R1.3 C[C@@H]1NNC[C@@H](O)[C@H]1O Amb27486378 [0,1,0,1,0,0|2,0,0]=4 7683 B9R1.3 C[C@@H]1NNC[C@H](O)[C@@H]1O Amb27219053 [0,1,0,1,0,0|2,0,0]=4 7684 B9R1.3 C[C@@H]1OC=C[C@@H](N)[C@H]1O Amb27439224 [0,1,0,1,0,0|1,0,1]=4 7685 B9R1.3 C[C@@H]1OC=C[C@@H](O)[C@H]1O Amb27650162 [0,1,0,1,0,0|1,0,1]=4 7686 B9R1.3 C[C@@H]1OCC[C@H](O)[C@H]1O Amb27422278 [0,1,0,1,0,0|1,0,1]=4 7687 B9R1.3 C[C@@H]1[C@@H](O)CCC[C@H]1O Amb27805899 [0,1,0,1,0,0|0,0,2]=4 7688 B9R1.3 C[C@H]1C=CCC(=O)[C@H]1C Amb27441703 [0,1,0,1,0,0|1,0,1]=4 7689 B9R1.3 C[C@H]1C=CC[C@@H](O)[C@@H]1O Amb27197562 [0,1,0,1,0,0|0,0,0]=2 7690 B9R1.3 C[C@H]1CC=CC(=O)[C@H]1C Amb27441720 [0,1,0,1,0,0|1,0,1]=4 7691 B9R1.3 C[C@H]1CCCC(=O)[C@@H]1C Amb27432624 [0,1,0,1,0,0|1,0,1]=4 7692 B9R1.3 C[C@H]1CCC[C@@H](C)[C@H]1O Amb28350332 [0,1,0,1,0,0|0,0,2]=4 7693 B9R1.3 C[C@H]1CCC[C@@H](N)[C@@H]1O Amb28252463 [0,1,0,1,0,0|0,0,2]=4 7694 B9R1.3 C[C@H]1CCC[C@@H](O)[C@@H]1O Amb27186925 [0,1,0,1,0,0|0,0,2]=4 7695 B9R1.3 C[C@H]1CCC[C@@H](O)[C@H]1C Amb27980719 [0,1,0,1,0,0|0,0,2]=4 7696 B9R1.3 C[C@H]1CCC[C@@H](O)[C@H]1O Amb27647956 [0,1,0,1,0,0|0,0,2]=4 7697 B9R1.3 C[C@H]1CCC[C@H](C)C1O Amb27196772 [0,1,0,1,0,0|0,0,2]=4 7698 B9R1.3 C[C@H]1CCC[C@H](O)[C@@H]1O Amb27844257 [0,1,0,1,0,0|0,0,2]=4 7699 B9R1.3 C[C@H]1CNC[C@@H](N)[C@@H]1O Amb27422190 [0,1,0,1,0,0|1,0,1]=4 7700 B9R1.3 C[C@H]1CNC[C@H](O)[C@@H]1O Amb28411321 [0,1,0,1,0,0|1,0,1]=4 7701 B9R1.3 C[C@H]1NNC[C@@H](O)[C@@H]1O Amb24719811 [0,1,0,1,0,0|2,0,0]=4 7702 B9R1.3 C[C@H]1OC=C[C@@H](O)[C@H]1O Amb27211078 [0,1,0,1,0,0|1,0,1]=4 7703 B9R1.3 C[C@H]1OC=C[C@H](N)[C@@H]1O Amb27621379 [0,1,0,1,0,0|1,0,1]=4 7704 B9R1.3 C[C@H]1OC=C[C@H](O)[C@@H]1O Amb27196693 [0,1,0,1,0,0|1,0,1]=4 7705 B9R1.3 C[C@H]1OC=C[C@H](O)[C@H]1O Amb27853565 [0,1,0,1,0,0|1,0,1]=4 7706 B9R1.3 C[C@H]1OCC[C@@H](O)[C@@H]1O Amb27969001 [0,1,0,1,0,0|1,0,1]=4 7707 B9R1.3 C[C@H]1OCC[C@H](O)[C@H]1O Amb27471300 [0,1,0,1,0,0|1,0,1]=4 7708 B9R1.3 C[C@H]1[C@@H](O)CCC[C@H]1O Amb27665271 [0,1,0,1,0,0|0,0,2]=4 7709 B9R1.3 C[C@H]1[C@H](O)CCCN1C Amb27197524 [0,1,0,1,0,0|1,0,1]=4 7710 B9R1.3 Cl[C@H]1CC=C[C@@H](Cl)[C@@H]1Cl Amb27776693 [0,1,0,1,0,0|2,0,0]=4 7711 B9R1.3 O=C1NCC[C@@H](O)[C@@H]1O Amb28057700 [0,1,0,1,0,0|2,0,0]=4 7712 B9R1.3 O=C1NCC[C@H](O)[C@@H]1O Amb27202725 [0,1,0,1,0,0|2,0,0]=4 7713 B9R1.3 OC1CCC=C(Br)C1O Amb27758755 [0,1,0,1,0,0|1,0,0]=3 7714 B9R1.3 OC1CCC=C(Cl)C1Cl Amb27665376 [0,1,0,1,0,0|1,0,0]=3 7715 B9R1.3 OC1CCC=C(F)C1O Amb27604467 [0,1,0,1,0,0|1,0,0]=3 7716 B9R1.3 O[C@H]1C=CC[C@H](O)[C@@H]1O Amb27207844 [0,1,0,1,0,0|1,0,0]=3 7717 B9R1.3 O[C@H]1C=NC[C@@H](O)[C@H]1O Amb27457783 [0,1,0,1,0,0|2,0,0]=4 7718 B9R1.3 O[C@H]1CCC=C(Cl)[C@@H]1Cl Amb27440459 [0,1,0,1,0,0|1,0,0]=3 7719 B9R1.11 C=C(CBr)C1CCCO1 Amb33388747 [0,1,0,1,0,0|1,0,1]=4 7720 B9R1.11 C=C(CC)C1CCCC1 Amb27452572 [0,1,0,1,0,0|1,0,1]=4 7721 B9R1.11 C=C(CC)C1CCCN1 Amb23536671 [0,1,0,1,0,0|1,0,1]=4 7722 B9R1.11 C=C(CCl)C1CCCO1 Amb33261558 [0,1,0,1,0,0|1,0,1]=4 7723 B9R1.11 C=C(CN)C1CCCO1 Amb33318652 [0,1,0,1,0,0|1,0,1]=4 7724 B9R1.11 C=CC(O)C1C=CCC1 Amb27856849 [0,1,0,1,0,0|1,0,1]=4 7725 B9R1.11 CC(CN)=C1CCCC1 Amb27807756 [0,1,0,1,0,0|2,0,0]=4 7726 B9R1.11 CC(CN)C1C=CCO1 Amb27873293 [0,1,0,1,0,0|2,0,0]=4 7727 B9R1.11 CC(CO)C1=CCC=C1 Amb27981767 [0,1,0,1,0,0|0,0,2]=4 7728 B9R1.11 CC(CO)C1C=CCO1 Amb27768526 [0,1,0,1,0,0|1,0,0]=3 7729 B9R1.11 CC(CO)C1CCCC1 Amb25997168 [0,1,0,1,0,0|0,0,2]=4 7730 B9R1.11 CC(CO)C1CCCO1 Amb27397022 [0,1,0,1,0,0|1,0,1]=4 7731 B9R1.11 CC(CO)C1CCOC1 Amb26637248 [0,1,0,1,0,0|1,0,1]=4 7732 B9R1.11 CCC(=O)C1=CCCC1 Amb23558951 [0,1,0,1,0,0|1,0,0]=3 7733 B9R1.11 CCC(=O)C1=NCCS1 Amb22227614 [0,1,0,1,0,0|1,1,0]=4 7734 B9R1.11 CCC(=O)C1CCCC1 Amb33534974 [0,1,0,1,0,0|1,0,1]=4 7735 B9R1.11 CCC(=O)C1CCCN1 Amb17231849 [0,1,0,1,0,0|1,0,1]=4 7736 B9R1.11 CCC(=O)C1CCCN1 Amb32666386 [0,1,0,1,0,0|1,0,1]=4 7737 B9R1.11 CCC(=O)N1CCCC1 Amb3886543 [0,1,0,1,0,0|2,0,0]=4 7738 B9R1.11 CCC(=O)N1CCCO1 Amb28381452 [0,1,0,1,0,0|1,0,0]=3 7739 B9R1.11 CCC(=O)[C@@H]1CCCN1 Amb26856430 [0,1,0,1,0,0|1,0,1]=4 7740 B9R1.11 CCC(=O)[C@@H]1CCCN1 Amb32663156 [0,1,0,1,0,0|1,0,1]=4 7741 B9R1.11 CCC(=O)[C@H]1CCCN1 Amb33132117 [0,1,0,1,0,0|1,0,1]=4 7742 B9R1.11 CCC(C)C1=NCCC1 Amb27482646 [0,1,0,1,0,0|1,0,1]=4 7743 B9R1.11 CCC(C)C1C=CCN1 Amb27830943 [0,1,0,1,0,0|2,0,0]=4 7744 B9R1.11 CCC(N)C1=CCCC1 Amb18965361 [0,1,0,1,0,0|1,0,1]=4 7745 B9R1.11 CCC(N)C1CCCO1 Amb22059669 [0,1,0,1,0,0|0,0,2]=4 7746 B9R1.11 CCC(O)C1=CCCC1 Amb27257752 [0,1,0,1,0,0|1,0,1]=4 7747 B9R1.11 CCC(O)[C@H]1CCCO1 Amb28435654 [0,1,0,1,0,0|0,0,2]=4 7748 B9R1.11 CC[C@@H](N)C1CCCO1 Amb27838765 [0,1,0,1,0,0|0,0,2]=4 7749 B9R1.11 CC[C@@H](O)[C@@H]1CCCO1 Amb27463124 [0,1,0,1,0,0|0,0,2]=4 7750 B9R1.11 CC[C@@H](O)[C@H]1CCCO1 Amb27980675 [0,1,0,1,0,0|0,0,2]=4 7751 B9R1.11 CC[C@H](O)C1=CCCC1 Amb27765409 [0,1,0,1,0,0|1,0,1]=4 7752 B9R1.11 CC[C@H](O)C1CCCO1 Amb27815999 [0,1,0,1,0,0|0,0,2]=4 7753 B9R1.11 CC[C@H](O)[C@H]1CCCO1 Amb27432283 [0,1,0,1,0,0|0,0,2]=4 7754 B9R1.11 CC\C(C)=C1\CCNC1 Amb27838558 [0,1,0,1,0,0|2,0,0]=4 7755 B9R1.11 CNC(=O)C1=CCCC1 Amb28423727 [0,1,0,1,0,0|2,0,0]=4 7756 B9R1.11 CNC(=O)C1CCCO1 Amb3445623 [0,1,0,1,0,0|1,0,1]=4 7757 B9R1.11 CNC(=O)N1CCCO1 Amb27836494 [0,1,0,1,0,0|2,0,0]=4 7758 B9R1.11 CNC(=O)[C@@H]1CCCO1 Amb25864777 [0,1,0,1,0,0|1,0,1]=4 7759 B9R1.11 COC(=O)C1=CCCC1 Amb8385478 [0,1,0,1,0,0|2,0,0]=4 7760 B9R1.11 COC(=O)C1=CCCO1 Amb27265911 [0,1,0,1,0,0|1,0,1]=4 7761 B9R1.11 COC(=O)C1=NCCC1 Amb21964254 [0,1,0,1,0,0|2,0,0]=4 7762 B9R1.11 COC(=O)C1CCCO1 Amb8392933 [0,1,0,1,0,0|1,0,1]=4 7763 B9R1.11 COC(=O)N1CCCO1 Amb27981531 [0,1,0,1,0,0|2,0,0]=4 7764 B9R1.11 COC(=O)[C@@H]1CCCO1 Amb25113406 [0,1,0,1,0,0|1,0,1]=4 7765 B9R1.11 C[C@@H](CO)C1=CCC=C1 Amb27959624 [0,1,0,1,0,0|0,0,2]=4 7766 B9R1.11 C[C@@H](CO)C1CCCC1 Amb33741046 [0,1,0,1,0,0|0,0,2]=4 7767 B9R1.11 C[C@@H](CO)C1CCCO1 Amb33743091 [0,1,0,1,0,0|1,0,1]=4 7768 B9R1.11 C[C@@H](CO)C1CCOC1 Amb33735554 [0,1,0,1,0,0|1,0,1]=4 7769 B9R1.11 C[C@H](CO)C1CCCC1 Amb33748466 [0,1,0,1,0,0|0,0,2]=4 7770 B9R1.11 C[C@H](CO)C1CCCO1 Amb33738163 [0,1,0,1,0,0|1,0,1]=4 7771 B9R1.11 C[C@H](CO)C1CCOC1 Amb33730457 [0,1,0,1,0,0|1,0,1]=4 7772 B9R1.11 NC(CO)C1CCCC1 Amb18958311 [0,1,0,1,0,0|0,0,2]=4 7773 B9R1.11 NC(CO)C1CCCN1 Amb27631593 [0,1,0,1,0,0|1,0,1]=4 7774 B9R1.11 NC(CO)C1CCCO1 Amb24480307 [0,1,0,1,0,0|1,0,1]=4 7775 B9R1.11 NC(CO)C1CCCS1 Amb27185967 [0,1,0,1,0,0|1,0,1]=4 7776 B9R1.11 NC(CO)C1CCOC1 Amb20628792 [0,1,0,1,0,0|1,0,1]=4 7777 B9R1.11 NC(CO)C1CCOC1 Amb2683375 [0,1,0,1,0,0|1,0,1]=4 7778 B9R1.11 NC(CO)C1CCSC1 Amb28049181 [0,1,0,1,0,0|1,0,1]=4 7779 B9R1.11 NCC(=O)C1=CCCO1 Amb25978766 [0,1,0,1,0,0|1,0,1]=4 7780 B9R1.11 NCC(=O)C1CCCO1 Amb24398393 [0,1,0,1,0,0|1,0,1]=4 7781 B9R1.11 NCC(=O)N1CCCO1 Amb24481678 [0,1,0,1,0,0|2,0,0]=4 7782 B9R1.11 NCC(=O)N1CCCO1 Amb28555387 [0,1,0,1,0,0|2,0,0]=4 7783 B9R1.11 NCC(F)C1C=CCN1 Amb27875512 [0,1,0,1,0,0|2,0,0]=4 7784 B9R1.11 NCC(O)C1C=CCN1 Amb28076261 [0,1,0,1,0,0|2,0,0]=4 7785 B9R1.11 NCC(O)C1C=CCO1 Amb27756819 [0,1,0,1,0,0|2,0,0]=4 7786 B9R1.11 NC[C@@H](O)[C@@H]1C=CCO1 Amb27205075 [0,1,0,1,0,0|2,0,0]=4 7787 B9R1.11 N[C@@H](CO)C1CCCC1 Amb25757877 [0,1,0,1,0,0|0,0,2]=4 7788 B9R1.11 N[C@@H](CO)C1CCCO1 Amb33318723 [0,1,0,1,0,0|1,0,1]=4 7789 B9R1.11 N[C@@H](CO)C1CCCS1 Amb33416835 [0,1,0,1,0,0|1,0,1]=4 7790 B9R1.11 N[C@@H](CO)C1CCOC1 Amb33420758 [0,1,0,1,0,0|1,0,1]=4 7791 B9R1.11 N[C@@H](CO)C1CCSC1 Amb33141543 [0,1,0,1,0,0|1,0,1]=4 7792 B9R1.11 N[C@H](CO)C1CCCC1 Amb25324301 [0,1,0,1,0,0|0,0,2]=4 7793 B9R1.11 N[C@H](CO)C1CCCC1 Amb33872225 [0,1,0,1,0,0|0,0,2]=4 7794 B9R1.11 N[C@H](CO)C1CCCO1 Amb33318724 [0,1,0,1,0,0|1,0,1]=4 7795 B9R1.11 N[C@H](CO)C1CCCS1 Amb33416836 [0,1,0,1,0,0|1,0,1]=4 7796 B9R1.11 N[C@H](CO)C1CCOC1 Amb33420759 [0,1,0,1,0,0|1,0,1]=4 7797 B9R1.11 N[C@H](CO)C1CCSC1 Amb33141544 [0,1,0,1,0,0|1,0,1]=4 7798 B9R1.11 O=C(CBr)C1CCCO1 Amb24104046 [0,1,0,1,0,0|1,0,1]=4 7799 B9R1.11 O=C(CBr)[C@@H]1CCCO1 Amb26860082 [0,1,0,1,0,0|1,0,1]=4 7800 B9R1.11 O=C(CCl)C1CCCO1 Amb24751558 [0,1,0,1,0,0|1,0,1]=4 7801 B9R1.11 OCC(Br)C1C=CCO1 Amb28285282 [0,1,0,1,0,0|1,0,0]=3 7802 B9R1.11 OCC(F)=C1CCCC1 Amb27852389 [0,1,0,1,0,0|2,0,0]=4 7803 B9R1.11 OCC(O)C1=CCCC1 Amb28206820 [0,1,0,1,0,0|0,0,2]=4 7804 B9R1.11 OCC(O)C1C=CCO1 Amb27405165 [0,1,0,1,0,0|1,0,0]=3 7805 B9R1.11 OCC(O)C1CCCC1 Amb26463836 [0,1,0,1,0,0|0,0,2]=4 7806 B9R1.11 OCC(O)C1CCCO1 Amb26943467 [0,1,0,1,0,0|1,0,1]=4 7807 B9R1.11 OCC(O)C1CCCS1 Amb33415617 [0,1,0,1,0,0|1,0,1]=4 7808 B9R1.11 OCC(O)C1CCOC1 Amb24379358 [0,1,0,1,0,0|1,0,1]=4 7809 B9R1.11 OCC(O)C1CCSC1 Amb28078057 [0,1,0,1,0,0|1,0,1]=4 7810 B9R1.11 OC[C@@H](O)[C@@H]1C=CCO1 Amb27857586 [0,1,0,1,0,0|1,0,0]=3 7811 B9R1.11 OC[C@H](Br)[C@@H]1C=CCO1 Amb27657467 [0,1,0,1,0,0|1,0,0]=3 7812 B9R1.11 OC[C@H](O)C1CCCC1 Amb28049189 [0,1,0,1,0,0|0,0,2]=4 7813 B9R1.11 OC[C@H](O)[C@@H]1CCNC1 Amb27489715 [0,1,0,1,0,0|1,0,1]=4 7814 B9R1.21 CCC1=COC(CO)C1 Amb27660962 [0,1,0,1,0,0|1,0,0]=3 7815 B9R1.21 CCC1=CO[C@H](CN)C1 Amb27810822 [0,1,0,1,0,0|2,0,0]=4 7816 B9R1.21 CCC1=NC(CC)CS1 Amb25244083 [0,1,0,1,0,0|2,0,0]=4 7817 B9R1.21 CCC1=NCC(CC)S1 Amb27621120 [0,1,0,1,0,0|2,0,0]=4 7818 B9R1.21 CCC1=NOC(CO)C1 Amb28340543 [0,1,0,1,0,0|2,0,0]=4 7819 B9R1.21 CCC1CC(CO)CN1 Amb27621656 [0,1,0,1,0,0|1,0,1]=4 7820 B9R1.21 CCC1CC(CO)CO1 Amb29882990 [0,1,0,1,0,0|1,0,1]=4 7821 B9R1.21 CCC1CCC(CO)C1 Amb26929311 [0,1,0,1,0,0|0,0,2]=4 7822 B9R1.21 CCC1NC(CO)CS1 Amb28071194 [0,1,0,1,0,0|1,0,1]=4 7823 B9R1.21 CCN1CCC(CO)C1 Amb5494202 [0,1,0,1,0,0|1,0,1]=4 7824 B9R1.21 CC[C@@H]1CC[C@H](CO)N1 Amb27641256 [0,1,0,1,0,0|0,0,2]=4 7825 B9R1.21 CCc1ccc(CO)s1 Amb8846379 [0,1,0,1,0,0|0,0,2]=4 7826 B9R1.21 CCc1cnc(CO)o1 Amb32685453 [0,1,0,1,0,0|1,0,1]=4 7827 B9R1.21 CCc1cnc(CO)s1 Amb24271105 [0,1,0,1,0,0|1,0,1]=4 7828 B9R1.21 CCc1csc(CO)n1 Amb26420361 [0,1,0,1,0,0|1,0,1]=4 7829 B9R1.21 CSC1=N[C@H](CO)CC1 Amb27757240 [0,1,0,1,0,0|1,0,1]=4 7830 B9R1.21 OCC1COC(CF)=N1 Amb28436146 [0,1,0,1,0,0|2,0,0]=4 7831 B9R1.78 CC1CC1CC(N)CO Amb33144903 [0,1,0,1,0,0|0,0,2]=4 7832 B9R1.79 CC(CO)CC1CCC1 Amb24402725 [0,1,0,1,0,0|0,0,2]=4 7833 B9R1.79 CC(CO)CC1CCO1 Amb33740150 [0,1,0,1,0,0|1,0,1]=4 7834 B9R1.79 CCC(=N)NC1CCC1 Amb28049541 [0,1,0,1,0,0|2,0,0]=4 7835 B9R1.79 CCC(=O)CC1CCC1 Amb28145122 [0,1,0,1,0,0|1,0,1]=4 7836 B9R1.79 C[C@@H](CO)CC1CCC1 Amb33743097 [0,1,0,1,0,0|0,0,2]=4 7837 B9R1.79 C[C@@H](CO)CC1CCO1 Amb33748029 [0,1,0,1,0,0|1,0,1]=4 7838 B9R1.79 C[C@H](CO)CC1CCC1 Amb33738446 [0,1,0,1,0,0|0,0,2]=4 7839 B9R1.79 C[C@H](CO)CC1CCO1 Amb33730585 [0,1,0,1,0,0|1,0,1]=4 7840 B9R1.79 C\C(=C/C1CCC1)CBr Amb28320107 [0,1,0,1,0,0|2,0,0]=4 7841 B9R1.79 C\C(=C/C1CCC1)CO Amb27838424 [0,1,0,1,0,0|2,0,0]=4 7842 B9R1.79 NC(CO)CC1CCC1 Amb32660961 [0,1,0,1,0,0|0,0,2]=4 7843 B9R1.79 NC(CO)CC1CCC1 Amb33548648 [0,1,0,1,0,0|0,0,2]=4 7844 B9R1.79 NC(CO)CN1CCC1 Amb27849096 [0,1,0,1,0,0|1,0,1]=4 7845 B9R1.79 N[C@@H](CO)CC1CCC1 Amb28199933 [0,1,0,1,0,0|0,0,2]=4 7846 B9R1.79 N[C@H](CO)CC1CCC1 Amb26547301 [0,1,0,1,0,0|0,0,2]=4 7847 B9R1.80 CC(CO)CCC1CC1 Amb33749212 [0,1,0,1,0,0|0,0,2]=4 7848 B9R1.80 CC(CO)CNC1CC1 Amb27164376 [0,1,0,1,0,0|1,0,1]=4 7849 B9R1.80 CC(CO)CSC1CC1 Amb27825875 [0,1,0,1,0,0|1,0,1]=4 7850 B9R1.80 CCC(=O)OCC1CO1 Amb28123280 [0,1,0,1,0,0|1,0,0]=3 7851 B9R1.80 CCC(C)NCC1CO1 Amb27162537 [0,1,0,1,0,0|1,0,1]=4 7852 B9R1.80 CCC(C)OC[C@H]1CO1 Amb27956616 [0,1,0,1,0,0|1,0,1]=4 7853 B9R1.80 CCC(C)SCC1CO1 Amb6680857 [0,1,0,1,0,0|1,0,1]=4 7854 B9R1.80 CCC(C)SC[C@H]1CO1 Amb27801672 [0,1,0,1,0,0|1,0,1]=4 7855 B9R1.80 CCS(=O)CCC1CO1 Amb27956481 [0,1,0,1,0,0|1,0,1]=4 7856 B9R1.80 COC(=O)CCC1CO1 Amb25377501 [0,1,0,1,0,0|1,0,1]=4 7857 B9R1.80 C[C@@H](CO)CCC1CC1 Amb33747154 [0,1,0,1,0,0|0,0,2]=4 7858 B9R1.80 C[C@H](CO)CCC1CC1 Amb33748163 [0,1,0,1,0,0|0,0,2]=4 7859 B9R1.80 NC(CO)CCC1CC1 Amb24715971 [0,1,0,1,0,0|0,0,2]=4 7860 B9R1.80 NCC(=O)CCC1CO1 Amb33307827 [0,1,0,1,0,0|1,0,1]=4 7861 B9R1.80 OCC(O)CCC1CC1 Amb27444259 [0,1,0,1,0,0|0,0,2]=4 7862 B9R1.80 OCC(O)CNC1CC1 Amb8854825 [0,1,0,1,0,0|1,0,1]=4 7863 B9R1.80 OCC(O)COC1CC1 Amb27467067 [0,1,0,1,0,0|1,0,1]=4 7864 B9R1.80 OCC(O)CSC1CC1 Amb27593987 [0,1,0,1,0,0|1,0,1]=4 7865 B9R1.81 CCC(C)C1CCC1O Amb32945398 [0,1,0,1,0,0|0,0,2]=4 7866 B9R1.88 CCC(=O)C1CC1CN Amb33132450 [0,1,0,1,0,0|1,0,1]=4 7867 B9R1.88 CCC(=O)[C@@H]1C[C@@H]1CN Amb33132472 [0,1,0,1,0,0|1,0,1]=4 7868 B9R1.88 CCC(=O)[C@@H]1C[C@H]1CC Amb27261616 [0,1,0,1,0,0|1,0,1]=4 7869 B9R1.88 CCC(C)C1CC1CO Amb27838522 [0,1,0,1,0,0|0,0,2]=4 7870 B9R1.88 CCC(O)C1CC1CO Amb27770342 [0,1,0,1,0,0|0,0,2]=4 7871 B9R1.88 CCC(O)[C@H]1C[C@H]1CO Amb27981681 [0,1,0,1,0,0|0,0,2]=4 7872 B9R1.88 CCN(C)C1CC1CO Amb27826274 [0,1,0,1,0,0|1,0,1]=4 7873 B9R1.88 COC(=O)C1CC1CO Amb25185377 [0,1,0,1,0,0|1,0,1]=4 7874 B9R1.88 COC(=O)[C@@H]1C[C@@H]1CO Amb24575289 [0,1,0,1,0,0|1,0,1]=4 7875 B9R1.88 COC(=O)[C@@H]1C[C@H]1CO Amb26035468 [0,1,0,1,0,0|1,0,1]=4 7876 B9R1.88 COC(=O)[C@H]1C[C@@H]1CO Amb27451981 [0,1,0,1,0,0|1,0,1]=4 7877 B9R1.97 CCC1CCC1(C)CO Amb27947036 [0,1,0,1,0,0|0,0,2]=4 7878 B9R1.99 CCCCCC1(C)CO1 Amb27760064 [0,1,0,1,0,0|0,0,2]=4 7879 B9R1.99 CCCSCC1(C)CO1 Amb28399684 [0,1,0,1,0,0|1,0,1]=4 7880 B9R1.99 CCC\C=C\C1(C)CO1 Amb33424825 [0,1,0,1,0,0|0,0,2]=4 7881 B9R1.99 CC\C=C\CC1(N)CC1 Amb33268204 [0,1,0,1,0,0|1,0,0]=3 7882 B9R1.99 CC\C=C\CC1(O)CC1 Amb33267523 [0,1,0,1,0,0|1,0,0]=3 7883 B9R1.99 NC1(CCCCO)CC1 Amb27185968 [0,1,0,1,0,0|0,0,2]=4 7884 B9R1.118 CC1(C=O)CC=CCC1 Amb18642238 [0,1,0,1,0,0|0,0,2]=4 7885 B9R1.118 CC1(CBr)CC=CCC1 Amb24726294 [0,1,0,1,0,0|1,0,0]=3 7886 B9R1.118 CC1(CCl)CC=CCC1 Amb27645876 [0,1,0,1,0,0|1,0,0]=3 7887 B9R1.118 CC1(CN)CC=CCC1 Amb26489090 [0,1,0,1,0,0|1,0,0]=3 7888 B9R1.118 CC1(CN)CC=CCC1 Amb33803667 [0,1,0,1,0,0|1,0,0]=3 7889 B9R1.118 CC1(CO)C=CCCC1 Amb28049165 [0,1,0,1,0,0|0,0,2]=4 7890 B9R1.118 CC1(CO)CCCCC1 Amb2694689 [0,1,0,1,0,0|0,0,2]=4 7891 B9R1.118 CC1(CO)CCCNC1 Amb10607790 [0,1,0,1,0,0|1,0,1]=4 7892 B9R1.118 CC1(CO)CCCNC1 Amb22406108 [0,1,0,1,0,0|1,0,1]=4 7893 B9R1.118 CC1(CO)CCCOC1 Amb25325793 [0,1,0,1,0,0|1,0,1]=4 7894 B9R1.118 CC1(CO)CCNCC1 Amb33543968 [0,1,0,1,0,0|1,0,1]=4 7895 B9R1.118 CC1(CO)CCNCC1 Amb33552165 [0,1,0,1,0,0|1,0,1]=4 7896 B9R1.118 CC1(CO)CCOCC1 Amb33547495 [0,1,0,1,0,0|1,0,1]=4 7897 B9R1.118 CC1(CO)CCSCC1 Amb28324287 [0,1,0,1,0,0|1,0,1]=4 7898 B9R1.118 CCP1(=S)OCCCO1 Amb32863654 [0,1,0,1,0,0|2,0,0]=4 7899 B9R1.118 C[C@@]1(CO)CCCOC1 Amb27981643 [0,1,0,1,0,0|1,0,1]=4 7900 B9R1.118 NC1(CO)CC=CCC1 Amb29869963 [0,1,0,1,0,0|0,0,0]=2 7901 B9R1.118 NC1(CO)CCCCC1 Amb10608249 [0,1,0,1,0,0|0,0,2]=4 7902 B9R1.118 NC1(CO)CCCCC1 Amb8631827 [0,1,0,1,0,0|0,0,2]=4 7903 B9R1.118 NC1(CO)CCCOC1 Amb24476680 [0,1,0,1,0,0|1,0,1]=4 7904 B9R1.118 NC1(CO)CCNCC1 Amb18944649 [0,1,0,1,0,0|1,0,1]=4 7905 B9R1.118 NC1(CO)CCNCC1 Amb20623937 [0,1,0,1,0,0|1,0,1]=4 7906 B9R1.118 NC1(CO)CCOCC1 Amb23440142 [0,1,0,1,0,0|1,0,1]=4 7907 B9R1.118 NC1(CO)CCOCC1 Amb2683366 [0,1,0,1,0,0|1,0,1]=4 7908 B9R1.118 NC1(CO)CCSCC1 Amb2683367 [0,1,0,1,0,0|1,0,1]=4 7909 B9R1.118 NC1(CO)CCSCC1 Amb28934950 [0,1,0,1,0,0|1,0,1]=4 7910 B9R1.118 O=CC1(Cl)CC=CCC1 Amb27224727 [0,1,0,1,0,0|0,0,2]=4 7911 B9R1.118 O=C[C@@]1(Br)CC=CCC1 Amb28350499 [0,1,0,1,0,0|0,0,2]=4 7912 B9R1.118 O=C[C@]1(Br)CC=CCC1 Amb28186624 [0,1,0,1,0,0|0,0,2]=4 7913 B9R1.118 OCC1(Cl)CCCCC1 Amb27804982 [0,1,0,1,0,0|0,0,2]=4 7914 B9R1.118 OCC1(Cl)CCCOC1 Amb27616460 [0,1,0,1,0,0|1,0,1]=4 7915 B9R1.118 OCC1(Cl)CCOCC1 Amb27404896 [0,1,0,1,0,0|1,0,1]=4 7916 B9R1.118 OCC1(F)CCCCC1 Amb10603424 [0,1,0,1,0,0|0,0,2]=4 7917 B9R1.118 OCC1(F)CCCNC1 Amb26429182 [0,1,0,1,0,0|1,0,1]=4 7918 B9R1.118 OCC1(F)CCCNC1 Amb30647438 [0,1,0,1,0,0|1,0,1]=4 7919 B9R1.118 OCC1(F)CCCOC1 Amb25953959 [0,1,0,1,0,0|1,0,1]=4 7920 B9R1.118 OCC1(F)CCNCC1 Amb22001985 [0,1,0,1,0,0|1,0,1]=4 7921 B9R1.118 OCC1(F)CCNCC1 Amb22234785 [0,1,0,1,0,0|1,0,1]=4 7922 B9R1.118 OCC1(F)CCOCC1 Amb22500945 [0,1,0,1,0,0|1,0,1]=4 7923 B9R1.118 OCC1(O)CCCCC1 Amb10552888 [0,1,0,1,0,0|0,0,2]=4 7924 B9R1.118 OCC1(O)CCCNC1 Amb19516807 [0,1,0,1,0,0|1,0,1]=4 7925 B9R1.118 OCC1(O)CCCNC1 Amb22406180 [0,1,0,1,0,0|1,0,1]=4 7926 B9R1.118 OCC1(O)CCNCC1 Amb15701357 [0,1,0,1,0,0|1,0,1]=4 7927 B9R1.118 OCC1(O)CCNCC1 Amb22405951 [0,1,0,1,0,0|1,0,1]=4 7928 B9R1.118 OCC1(O)CCOCC1 Amb24116825 [0,1,0,1,0,0|1,0,1]=4 7929 B9R1.118 OCC1(O)CCSCC1 Amb24116829 [0,1,0,1,0,0|1,0,1]=4 7930 B9R1.118 OCC1(S)CCCCC1 Amb25084707 [0,1,0,1,0,0|0,0,2]=4 7931 B9R1.118 OC[C@@]1(O)CC=CCC1 Amb28315551 [0,1,0,1,0,0|0,0,0]=2 7932 B9R1.132 CC1C(=O)CNC1CO Amb27629033 [0,1,0,1,0,0|1,0,1]=4 7933 B9R1.132 CC1C(=O)NNC1CO Amb35692243 [0,1,0,1,0,0|2,0,0]=4 7934 B9R1.132 CC1C(=O)OCC1CO Amb27853141 [0,1,0,1,0,0|1,0,0]=3 7935 B9R1.132 CC1C(Br)=NOC1CO Amb27198105 [0,1,0,1,0,0|2,0,0]=4 7936 B9R1.132 CC1C(CO)CCN1C Amb32752568 [0,1,0,1,0,0|1,0,1]=4 7937 B9R1.132 CC1NCC(CO)C1C Amb27403724 [0,1,0,1,0,0|1,0,1]=4 7938 B9R1.132 CC1OCC(CO)C1C Amb35732623 [0,1,0,1,0,0|1,0,1]=4 7939 B9R1.132 CC[C@@H]1NC[C@@H](O)[C@H]1O Amb27621501 [0,1,0,1,0,0|1,0,1]=4 7940 B9R1.132 CN1C(=O)CCC1CO Amb26447781 [0,1,0,1,0,0|1,0,1]=4 7941 B9R1.132 CN1C(=O)CC[C@@H]1CO Amb25032258 [0,1,0,1,0,0|1,0,1]=4 7942 B9R1.132 CN1C(=O)OCC1CO Amb22504497 [0,1,0,1,0,0|2,0,0]=4 7943 B9R1.132 C[C@@H]1C(=O)OC[C@H]1CO Amb28065887 [0,1,0,1,0,0|1,0,0]=3 7944 B9R1.132 C[C@@H]1[C@H](CO)CCN1C Amb28722267 [0,1,0,1,0,0|1,0,1]=4 7945 B9R1.132 C[C@H]1C(=O)NC[C@@H]1CO Amb27805447 [0,1,0,1,0,0|1,0,0]=3 7946 B9R1.132 C[C@H]1[C@H](CO)CCN1C Amb27981620 [0,1,0,1,0,0|1,0,1]=4 7947 B9R1.132 NC1C(=O)NCC1CO Amb28125787 [0,1,0,1,0,0|2,0,0]=4 7948 B9R1.132 NC1C(=O)OCC1CO Amb27804109 [0,1,0,1,0,0|2,0,0]=4 7949 B9R1.132 O=C1OCC(CO)C1O Amb27197070 [0,1,0,1,0,0|2,0,0]=4 7950 B9R1.135 CC1C\C(=C/CN)C1C Amb27868950 [0,1,0,1,0,0|2,0,0]=4 7951 B9R1.135 CCCC1NC(=O)C1C Amb27193222 [0,1,0,1,0,0|2,0,0]=4 7952 B9R1.135 CCC[C@@H]1NC(=O)[C@@H]1C Amb28320522 [0,1,0,1,0,0|2,0,0]=4 7953 B9R1.135 CCC[C@@H]1NC(=O)[C@H]1C Amb27229291 [0,1,0,1,0,0|2,0,0]=4 7954 B9R1.202 CC1CNCC1(C)CO Amb27862293 [0,1,0,1,0,0|1,0,1]=4 7955 B9R1.202 CC1CNCC1(C)CO Amb32667607 [0,1,0,1,0,0|1,0,1]=4 7956 B9R1.202 CC1COCC1(N)CO Amb35636179 [0,1,0,1,0,0|1,0,1]=4 7957 B9R1.202 CC1COCC1(O)CO Amb35608147 [0,1,0,1,0,0|1,0,1]=4 7958 B9R1.202 CC1CSCC1(N)CO Amb27492811 [0,1,0,1,0,0|1,0,1]=4 7959 B9R1.202 CC1SCCC1(N)CO Amb27164786 [0,1,0,1,0,0|1,0,1]=4 7960 B9R1.202 CCC1(C)CCCC1O Amb27956477 [0,1,0,1,0,0|0,0,2]=4 7961 B9R1.202 CC[C@]1(C)CCC[C@@H]1O Amb28138775 [0,1,0,1,0,0|0,0,2]=4 7962 B9R1.202 CC[C@]1(O)CCC[C@@H]1O Amb27255135 [0,1,0,1,0,0|0,0,2]=4 7963 B9R1.202 C[C@@H]1CCC[C@]1(O)CO Amb27630888 [0,1,0,1,0,0|0,0,2]=4 7964 B9R1.202 C[C@H]1CNC[C@]1(C)CO Amb27221497 [0,1,0,1,0,0|1,0,1]=4 7965 B9R1.6 CC(=O)C1=CCCCC1 Amb8513050 [0,1,0,1,0,0|1,0,1]=4 7966 B9R1.6 CC(=O)C1=CCCCN1 Amb27234616 [0,1,0,1,0,0|1,0,1]=4 7967 B9R1.6 CC(=O)C1=COCCO1 Amb20669275 [0,1,0,1,0,0|1,0,1]=4 7968 B9R1.6 CC(=O)C1CC=CCC1 Amb27643727 [0,1,0,1,0,0|0,0,2]=4 7969 B9R1.6 CC(=O)[C@@H]1CC=CCC1 Amb26643097 [0,1,0,1,0,0|0,0,2]=4 7970 B9R1.6 CC(Br)C1OCCCO1 Amb25045267 [0,1,0,1,0,0|1,0,1]=4 7971 B9R1.6 CC(C)C1=CCCCC1 Amb22227968 [0,1,0,1,0,0|1,0,0]=3 7972 B9R1.6 CC(C)C1=CCCNC1 Amb27465723 [0,1,0,1,0,0|2,0,0]=4 7973 B9R1.6 CC(C)C1=CCNCC1 Amb27799101 [0,1,0,1,0,0|2,0,0]=4 7974 B9R1.6 CC(C)C1NCCCO1 Amb17506193 [0,1,0,1,0,0|1,0,1]=4 7975 B9R1.6 CC(Cl)C1=NCCCN1 Amb27965179 [0,1,0,1,0,0|2,0,0]=4 7976 B9R1.6 CC(N)C1=CCCCC1 Amb10607848 [0,1,0,1,0,0|1,0,0]=3 7977 B9R1.6 CC(N)C1=CCCCC1 Amb22587030 [0,1,0,1,0,0|1,0,0]=3 7978 B9R1.6 CC(N)C1=COCCC1 Amb27412503 [0,1,0,1,0,0|2,0,0]=4 7979 B9R1.6 CC(N)C1CC=CCC1 Amb33316363 [0,1,0,1,0,0|1,0,0]=3 7980 B9R1.6 CC(N)C1CCCCO1 Amb27596555 [0,1,0,1,0,0|0,0,2]=4 7981 B9R1.6 CC(N)C1CCCCO1 Amb32666314 [0,1,0,1,0,0|0,0,2]=4 7982 B9R1.6 CC(N)C1OCCCO1 Amb33748303 [0,1,0,1,0,0|1,0,1]=4 7983 B9R1.6 CC(O)C1=CCCCC1 Amb25747240 [0,1,0,1,0,0|1,0,0]=3 7984 B9R1.6 CC(O)C1=CCCCO1 Amb25349292 [0,1,0,1,0,0|0,0,0]=2 7985 B9R1.6 CC(O)C1C=CCCC1 Amb22365214 [0,1,0,1,0,0|0,0,2]=4 7986 B9R1.6 CC(O)C1CC=CCC1 Amb26633109 [0,1,0,1,0,0|0,0,0]=2 7987 B9R1.6 CC(O)C1CCCCC1 Amb9283574 [0,1,0,1,0,0|0,0,2]=4 7988 B9R1.6 CC(O)C1CCCCO1 Amb23585663 [0,1,0,1,0,0|0,0,2]=4 7989 B9R1.6 CC(O)C1CCCNC1 Amb17593363 [0,1,0,1,0,0|1,0,1]=4 7990 B9R1.6 CC(O)C1CCCNC1 Amb32412170 [0,1,0,1,0,0|1,0,1]=4 7991 B9R1.6 CC(O)C1CCNCC1 Amb21955698 [0,1,0,1,0,0|1,0,1]=4 7992 B9R1.6 CC(O)C1CCNCC1 Amb22587101 [0,1,0,1,0,0|1,0,1]=4 7993 B9R1.6 CC(O)C1CCNCC1 Amb22899459 [0,1,0,1,0,0|1,0,1]=4 7994 B9R1.6 CC(O)C1CCNCC1 Amb9173665 [0,1,0,1,0,0|1,0,1]=4 7995 B9R1.6 CC(O)C1CCOCC1 Amb20667854 [0,1,0,1,0,0|1,0,1]=4 7996 B9R1.6 CC(O)C1CCSCC1 Amb35698333 [0,1,0,1,0,0|1,0,1]=4 7997 B9R1.6 CC(O)C1OCCCS1 Amb27589005 [0,1,0,1,0,0|1,0,1]=4 7998 B9R1.6 CC(O)[C@@H]1CCCNC1 Amb35588431 [0,1,0,1,0,0|1,0,1]=4 7999 B9R1.6 CC(O)[C@H]1CCCNC1 Amb35617453 [0,1,0,1,0,0|1,0,1]=4 8000 B9R1.6 CC(S)C1CCCCO1 Amb32788899 [0,1,0,1,0,0|0,0,2]=4 8001 B9R1.6 C[C@@H](N)C1=COCCC1 Amb33415715 [0,1,0,1,0,0|2,0,0]=4 8002 B9R1.6 C[C@@H](N)C1CC=CCC1 Amb33314944 [0,1,0,1,0,0|1,0,0]=3 8003 B9R1.6 C[C@@H](N)C1CCCCO1 Amb26000516 [0,1,0,1,0,0|0,0,2]=4 8004 B9R1.6 C[C@@H](N)C1CCCCO1 Amb31291420 [0,1,0,1,0,0|0,0,2]=4 8005 B9R1.6 C[C@@H](N)C1OCCCO1 Amb33743259 [0,1,0,1,0,0|1,0,1]=4 8006 B9R1.6 C[C@@H](O)C1=COCCC1 Amb33415677 [0,1,0,1,0,0|2,0,0]=4 8007 B9R1.6 C[C@@H](O)C1CC=CCC1 Amb33314942 [0,1,0,1,0,0|0,0,0]=2 8008 B9R1.6 C[C@@H](O)C1CCCCO1 Amb33375690 [0,1,0,1,0,0|0,0,2]=4 8009 B9R1.6 C[C@@H](O)C1CCCOC1 Amb26634197 [0,1,0,1,0,0|1,0,1]=4 8010 B9R1.6 C[C@@H](O)C1CCCSC1 Amb32726246 [0,1,0,1,0,0|1,0,1]=4 8011 B9R1.6 C[C@@H](O)C1CCNCC1 Amb27392755 [0,1,0,1,0,0|1,0,1]=4 8012 B9R1.6 C[C@@H](O)C1CCNCC1 Amb32671192 [0,1,0,1,0,0|1,0,1]=4 8013 B9R1.6 C[C@@H](O)C1CCOCC1 Amb25121022 [0,1,0,1,0,0|1,0,1]=4 8014 B9R1.6 C[C@@H](O)C1OCCCO1 Amb27396190 [0,1,0,1,0,0|1,0,1]=4 8015 B9R1.6 C[C@H](N)C1=COCCC1 Amb33415688 [0,1,0,1,0,0|2,0,0]=4 8016 B9R1.6 C[C@H](N)C1CC=CCC1 Amb33314943 [0,1,0,1,0,0|1,0,0]=3 8017 B9R1.6 C[C@H](N)C1CCCCO1 Amb33171840 [0,1,0,1,0,0|0,0,2]=4 8018 B9R1.6 C[C@H](N)C1OCCCO1 Amb33745262 [0,1,0,1,0,0|1,0,1]=4 8019 B9R1.6 C[C@H](O)C1=COCCC1 Amb33415714 [0,1,0,1,0,0|2,0,0]=4 8020 B9R1.6 C[C@H](O)C1CC=CCC1 Amb33314845 [0,1,0,1,0,0|0,0,0]=2 8021 B9R1.6 C[C@H](O)C1CCCCC1 Amb13952949 [0,1,0,1,0,0|0,0,2]=4 8022 B9R1.6 C[C@H](O)C1CCCCO1 Amb33375689 [0,1,0,1,0,0|0,0,2]=4 8023 B9R1.6 C[C@H](O)C1CCCOC1 Amb26324174 [0,1,0,1,0,0|1,0,1]=4 8024 B9R1.6 C[C@H](O)C1CCCSC1 Amb32726302 [0,1,0,1,0,0|1,0,1]=4 8025 B9R1.6 C[C@H](O)C1CCNCC1 Amb25951129 [0,1,0,1,0,0|1,0,1]=4 8026 B9R1.6 C[C@H](O)C1CCNCC1 Amb32671190 [0,1,0,1,0,0|1,0,1]=4 8027 B9R1.6 C[C@H](O)C1CCOCC1 Amb25077475 [0,1,0,1,0,0|1,0,1]=4 8028 B9R1.6 ClC(Cl)C1=CCCCO1 Amb28458292 [0,1,0,1,0,0|1,0,0]=3 8029 B9R1.6 N=C(N)C1CC=CCC1 Amb25143265 [0,1,0,1,0,0|1,0,1]=4 8030 B9R1.6 N=C(N)C1CC=CCC1 Amb8630598 [0,1,0,1,0,0|1,0,1]=4 8031 B9R1.6 NC(=O)C1CC=CCC1 Amb16231370 [0,1,0,1,0,0|0,0,2]=4 8032 B9R1.6 NC(=O)[C@@H]1CC=CCC1 Amb24182044 [0,1,0,1,0,0|0,0,2]=4 8033 B9R1.6 NC(=S)C1CC=CCC1 Amb33318647 [0,1,0,1,0,0|0,1,1]=4 8034 B9R1.6 O=C(Cl)C1CC=CCC1 Amb10844648 [0,1,0,1,0,0|0,0,2]=4 8035 B9R1.6 O=C(O)C1=CCCCO1 Amb2700341 [0,1,0,1,0,0|1,0,1]=4 8036 B9R1.6 O=C(O)C1CC=CCC1 Amb2695197 [0,1,0,1,0,0|0,0,1]=3 8037 B9R1.6 O=C(O)C1CC=CCN1 Amb2698158 [0,1,0,1,0,0|1,0,1]=4 8038 B9R1.6 O=C(O)C1CC=CCO1 Amb18642584 [0,1,0,1,0,0|1,0,1]=4 8039 B9R1.6 O=C(O)[C@@H]1CC=CCC1 Amb19131346 [0,1,0,1,0,0|0,0,1]=3 8040 B9R1.6 O=C(O)[C@@H]1CCC=CN1 Amb19888332 [0,1,0,1,0,0|1,0,1]=4 8041 B9R1.6 O=C(O)[C@H]1CC=CCC1 Amb17611453 [0,1,0,1,0,0|0,0,1]=3 8042 B9R1.6 O=C(O)[C@H]1CCC=CO1 Amb28070479 [0,1,0,1,0,0|1,0,1]=4 8043 B9R1.6 O=S([O-])C1CC=CCC1 Amb32754514 [0,1,0,1,0,0|1,0,1]=4 8044 B9R1.6 OB(O)C1=CCCCO1 Amb27760353 [0,1,0,1,0,0|2,0,0]=4 8045 B9R1.13 CC(=N)\C=C1\CCCN1 Amb27817764 [0,1,0,1,0,0|1,0,1]=4 8046 B9R1.13 CC(=O)C=C1CCCC1 Amb2699510 [0,1,0,1,0,0|1,0,1]=4 8047 B9R1.13 CC(=O)CC1C=CCC1 Amb2721318 [0,1,0,1,0,0|0,0,2]=4 8048 B9R1.13 CC(=O)\C=C1/NCCO1 Amb26893283 [0,1,0,1,0,0|1,0,1]=4 8049 B9R1.13 CC(=O)\C=C1\CCCN1 Amb17593301 [0,1,0,1,0,0|1,0,1]=4 8050 B9R1.13 CC(=O)\C=C1\CCCO1 Amb25241353 [0,1,0,1,0,0|0,0,1]=3 8051 B9R1.13 CC(Br)CC1CCCO1 Amb29857136 [0,1,0,1,0,0|0,0,2]=4 8052 B9R1.13 CC(C)C=C1CCCC1 Amb28366569 [0,1,0,1,0,0|1,0,0]=3 8053 B9R1.13 CC(C)CC1=CCCC1 Amb27436258 [0,1,0,1,0,0|1,0,1]=4 8054 B9R1.13 CC(C)NC1=NCCC1 Amb28345703 [0,1,0,1,0,0|2,0,0]=4 8055 B9R1.13 CC(C)OC1=CCCC1 Amb28348551 [0,1,0,1,0,0|2,0,0]=4 8056 B9R1.13 CC(Cl)CC1CCCO1 Amb29857074 [0,1,0,1,0,0|0,0,2]=4 8057 B9R1.13 CC(Cl)\N=C1\CCCN1 Amb25250223 [0,1,0,1,0,0|2,0,0]=4 8058 B9R1.13 CC(N)C=C1CCCC1 Amb27645291 [0,1,0,1,0,0|1,0,0]=3 8059 B9R1.13 CC(N)CC1=NCCO1 Amb27438596 [0,1,0,1,0,0|1,0,1]=4 8060 B9R1.13 CC(N)CC1CCCO1 Amb13952622 [0,1,0,1,0,0|0,0,2]=4 8061 B9R1.13 CC(N)CN1CCCO1 Amb28188827 [0,1,0,1,0,0|1,0,1]=4 8062 B9R1.13 CC(O)CC1=CCCC1 Amb28345352 [0,1,0,1,0,0|0,0,2]=4 8063 B9R1.13 CC(O)CC1=NCCC1 Amb27244692 [0,1,0,1,0,0|1,0,1]=4 8064 B9R1.13 CC(O)CC1C=CCO1 Amb27191727 [0,1,0,1,0,0|1,0,0]=3 8065 B9R1.13 CC(O)CC1CC=CC1 Amb30032965 [0,1,0,1,0,0|0,0,2]=4 8066 B9R1.13 CC(O)CC1CCCC1 Amb26484484 [0,1,0,1,0,0|0,0,2]=4 8067 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [0,1,0,1,0,0|1,0,1]=4 8068 B9R1.13 CC(O)CC1CCCO1 Amb27979742 [0,1,0,1,0,0|0,0,2]=4 8069 B9R1.13 CC(O)CC1CCCS1 Amb25206716 [0,1,0,1,0,0|1,0,1]=4 8070 B9R1.13 CC(O)CC1CCNC1 Amb27258166 [0,1,0,1,0,0|1,0,1]=4 8071 B9R1.13 CC(O)CC1CCOC1 Amb25888927 [0,1,0,1,0,0|1,0,1]=4 8072 B9R1.13 CC(O)CC1CCSC1 Amb33345807 [0,1,0,1,0,0|1,0,1]=4 8073 B9R1.13 CC(O)\C=C1\CCSC1 Amb27657381 [0,1,0,1,0,0|2,0,0]=4 8074 B9R1.13 CC(S)CC1CCCO1 Amb29857287 [0,1,0,1,0,0|0,0,2]=4 8075 B9R1.13 CN(C)C=C1CCCC1 Amb25237852 [0,1,0,1,0,0|2,0,0]=4 8076 B9R1.13 C[C@@H](N)CC1CCCO1 Amb25048917 [0,1,0,1,0,0|0,0,2]=4 8077 B9R1.13 C[C@@H](O)CC1=CCCC1 Amb28315475 [0,1,0,1,0,0|0,0,2]=4 8078 B9R1.13 C[C@@H](O)CC1CCCC1 Amb33315749 [0,1,0,1,0,0|0,0,2]=4 8079 B9R1.13 C[C@@H](O)CC1CCCO1 Amb33318696 [0,1,0,1,0,0|0,0,2]=4 8080 B9R1.13 C[C@@H](O)CC1CCCS1 Amb33415844 [0,1,0,1,0,0|1,0,1]=4 8081 B9R1.13 C[C@@H](O)CC1CCOC1 Amb33420739 [0,1,0,1,0,0|1,0,1]=4 8082 B9R1.13 C[C@@H](O)CC1CCSC1 Amb33141518 [0,1,0,1,0,0|1,0,1]=4 8083 B9R1.13 C[C@@H](O)C[C@@H]1C=CCO1 Amb28346422 [0,1,0,1,0,0|1,0,0]=3 8084 B9R1.13 C[C@@H](O)C[C@@H]1CCCO1 Amb27196849 [0,1,0,1,0,0|0,0,2]=4 8085 B9R1.13 C[C@H](N)CC1CCCO1 Amb27804405 [0,1,0,1,0,0|0,0,2]=4 8086 B9R1.13 C[C@H](O)CC1=CC=CC1 Amb27770335 [0,1,0,1,0,0|0,0,2]=4 8087 B9R1.13 C[C@H](O)CC1=CCC=C1 Amb28049106 [0,1,0,1,0,0|0,0,2]=4 8088 B9R1.13 C[C@H](O)CC1CCCC1 Amb33315750 [0,1,0,1,0,0|0,0,2]=4 8089 B9R1.13 C[C@H](O)CC1CCCO1 Amb24735204 [0,1,0,1,0,0|0,0,2]=4 8090 B9R1.13 C[C@H](O)CC1CCCS1 Amb33415845 [0,1,0,1,0,0|1,0,1]=4 8091 B9R1.13 C[C@H](O)CC1CCOC1 Amb33420740 [0,1,0,1,0,0|1,0,1]=4 8092 B9R1.13 C[C@H](O)CC1CCSC1 Amb33141519 [0,1,0,1,0,0|1,0,1]=4 8093 B9R1.13 C[C@H](O)C[C@@H]1CCCN1 Amb28428898 [0,1,0,1,0,0|1,0,1]=4 8094 B9R1.13 C[C@H](O)C[C@H]1CCCN1 Amb27786187 [0,1,0,1,0,0|1,0,1]=4 8095 B9R1.13 C[C@H](O)C[C@H]1CCCO1 Amb28206139 [0,1,0,1,0,0|0,0,2]=4 8096 B9R1.13 C\C(N)=C/C1=NCCC1 Amb27779214 [0,1,0,1,0,0|1,0,1]=4 8097 B9R1.13 C\C(N)=C\C1=NCCC1 Amb28285250 [0,1,0,1,0,0|1,0,1]=4 8098 B9R1.13 NC(=O)CC1C=CCC1 Amb16233726 [0,1,0,1,0,0|0,0,2]=4 8099 B9R1.13 O=C(O)CC1C=CCC1 Amb9703199 [0,1,0,1,0,0|0,0,1]=3 8100 B9R1.24 CC1(C)CCCC1CO Amb25698070 [0,1,0,1,0,0|0,0,2]=4 8101 B9R1.24 CC1(C)NCCC1CO Amb31260961 [0,1,0,1,0,0|1,0,1]=4 8102 B9R1.24 CC1(C)OCCC1CO Amb25823110 [0,1,0,1,0,0|1,0,1]=4 8103 B9R1.24 CC1(C)SCCC1CO Amb27978375 [0,1,0,1,0,0|1,0,1]=4 8104 B9R1.24 CC1(O)C=CCC1CO Amb27448821 [0,1,0,1,0,0|0,0,0]=2 8105 B9R1.24 CC1(O)CCC=C1C=O Amb27598645 [0,1,0,1,0,0|1,0,1]=4 8106 B9R1.24 CC1(O)CCCC1CO Amb28315472 [0,1,0,1,0,0|0,0,2]=4 8107 B9R1.24 CSC1=CCCC1(C)C Amb27248648 [0,1,0,1,0,0|2,0,0]=4 8108 B9R1.24 C[C@@]1(N)CCC[C@@H]1CO Amb25685488 [0,1,0,1,0,0|0,0,2]=4 8109 B9R1.24 C[C@@]1(N)CCC[C@H]1CO Amb28055666 [0,1,0,1,0,0|0,0,2]=4 8110 B9R1.24 C[C@]1(N)CCC[C@H]1CO Amb1993801 [0,1,0,1,0,0|0,0,2]=4 8111 B9R1.40 CC1(Br)CCCCC1O Amb28064001 [0,1,0,1,0,0|0,0,2]=4 8112 B9R1.40 CC1(C)C=CCCC1=O Amb27838775 [0,1,0,1,0,0|0,0,2]=4 8113 B9R1.40 CC1(C)C=CCCC1O Amb27485684 [0,1,0,1,0,0|0,0,0]=2 8114 B9R1.40 CC1(C)CCC=C[C@@H]1O Amb28454457 [0,1,0,1,0,0|2,0,0]=4 8115 B9R1.40 CC1(C)CCCCC1O Amb22748701 [0,1,0,1,0,0|0,0,2]=4 8116 B9R1.40 CC1(C)CCCC[C@@H]1O Amb28318455 [0,1,0,1,0,0|0,0,2]=4 8117 B9R1.40 CC1(C)CCCC[C@H]1O Amb28256801 [0,1,0,1,0,0|0,0,2]=4 8118 B9R1.40 CC1(C)CNCCC1O Amb10602172 [0,1,0,1,0,0|1,0,1]=4 8119 B9R1.40 CC1(C)COCCC1O Amb33496010 [0,1,0,1,0,0|1,0,1]=4 8120 B9R1.40 CC1(C)NCCCC1O Amb27849638 [0,1,0,1,0,0|1,0,1]=4 8121 B9R1.40 CC1(C)SOCCC1O Amb27771471 [0,1,0,1,0,0|2,0,0]=4 8122 B9R1.40 CC1(Cl)CCCCC1O Amb28315439 [0,1,0,1,0,0|0,0,2]=4 8123 B9R1.40 CC1(N)CCCCC1O Amb28436950 [0,1,0,1,0,0|0,0,2]=4 8124 B9R1.40 CC1(O)OCCCC1O Amb27946770 [0,1,0,1,0,0|1,0,1]=4 8125 B9R1.40 CC1C=CCCC1(C)C Amb27837567 [0,1,0,1,0,0|1,0,0]=3 8126 B9R1.40 CC1CCCCC1(C)O Amb9675954 [0,1,0,1,0,0|0,0,2]=4 8127 B9R1.40 CC1CNCCC1(C)O Amb22886361 [0,1,0,1,0,0|1,0,1]=4 8128 B9R1.40 CC1SCCCC1(C)O Amb27978912 [0,1,0,1,0,0|1,0,1]=4 8129 B9R1.40 CN1CCC=CC1(C)C Amb26854256 [0,1,0,1,0,0|2,0,0]=4 8130 B9R1.40 C[C@@H]1CCCC[C@@]1(C)O Amb32945290 [0,1,0,1,0,0|0,0,2]=4 8131 B9R1.40 C[C@@]1(Br)CCCC[C@@H]1O Amb27978301 [0,1,0,1,0,0|0,0,2]=4 8132 B9R1.40 C[C@@]1(Cl)CCCC[C@@H]1O Amb17844354 [0,1,0,1,0,0|0,0,2]=4 8133 B9R1.40 C[C@@]1(Cl)CCCC[C@H]1O Amb27463688 [0,1,0,1,0,0|0,0,2]=4 8134 B9R1.40 C[C@@]1(F)CCCC[C@H]1O Amb28205454 [0,1,0,1,0,0|0,0,2]=4 8135 B9R1.40 C[C@@]1(N)CCCC[C@H]1O Amb24744684 [0,1,0,1,0,0|0,0,2]=4 8136 B9R1.40 C[C@@]1(O)CCCC[C@H]1O Amb25176382 [0,1,0,1,0,0|0,0,2]=4 8137 B9R1.40 C[C@@]1(O)CNCC[C@@H]1O Amb34913312 [0,1,0,1,0,0|1,0,1]=4 8138 B9R1.40 C[C@@]1(O)CNCC[C@H]1O Amb34913314 [0,1,0,1,0,0|1,0,1]=4 8139 B9R1.40 C[C@]1(N)CCCC[C@H]1O Amb28061920 [0,1,0,1,0,0|0,0,2]=4 8140 B9R1.40 C[C@]1(O)C=CC=C[C@@H]1O Amb27441472 [0,1,0,1,0,0|0,0,2]=4 8141 B9R1.40 C[C@]1(O)CCCC[C@@H]1O Amb27427705 [0,1,0,1,0,0|0,0,2]=4 8142 B9R1.41 C=C(C)C1=CCCC1O Amb27261731 [0,1,0,1,0,0|0,0,1]=3 8143 B9R1.41 CC(=O)C1=CCCC1O Amb27634181 [0,1,0,1,0,0|0,0,1]=3 8144 B9R1.41 CC(=O)C1=CCC[C@@H]1C Amb27668819 [0,1,0,1,0,0|1,0,1]=4 8145 B9R1.41 CC(C)C1=CCC[C@H]1O Amb27969079 [0,1,0,1,0,0|0,0,0]=2 8146 B9R1.41 CC(C)C1=NCCC1C Amb24711818 [0,1,0,1,0,0|2,0,0]=4 8147 B9R1.41 CC(C)C1CCCC1O Amb25749420 [0,1,0,1,0,0|0,0,2]=4 8148 B9R1.41 CC(C)C1NCCC1O Amb25888819 [0,1,0,1,0,0|1,0,1]=4 8149 B9R1.41 CC(C)C1NCCC1O Amb32411998 [0,1,0,1,0,0|1,0,1]=4 8150 B9R1.41 CC(C)[C@@H]1CCC[C@H]1O Amb25998901 [0,1,0,1,0,0|0,0,2]=4 8151 B9R1.41 CC(C)[C@@H]1NCCC1O Amb18832556 [0,1,0,1,0,0|1,0,1]=4 8152 B9R1.41 CC(C)[C@@H]1NCC[C@@H]1O Amb32664266 [0,1,0,1,0,0|1,0,1]=4 8153 B9R1.41 CC(C)[C@@H]1NCC[C@H]1O Amb24366323 [0,1,0,1,0,0|1,0,1]=4 8154 B9R1.41 CC(C)[C@@H]1NCC[C@H]1O Amb33379055 [0,1,0,1,0,0|1,0,1]=4 8155 B9R1.41 CC(C)[C@H]1CCC[C@@H]1O Amb27238582 [0,1,0,1,0,0|0,0,2]=4 8156 B9R1.41 CC(C)[C@H]1CCC[C@H]1O Amb28053553 [0,1,0,1,0,0|0,0,2]=4 8157 B9R1.41 CC(C)[C@H]1SCC[C@H]1O Amb28350076 [0,1,0,1,0,0|1,0,1]=4 8158 B9R1.41 CC(N)C1OCCC1O Amb28240319 [0,1,0,1,0,0|1,0,1]=4 8159 B9R1.41 CC(N)[C@@H]1CCC[C@@H]1O Amb27654093 [0,1,0,1,0,0|0,0,2]=4 8160 B9R1.41 CC(O)C1CCNC1C Amb35584409 [0,1,0,1,0,0|1,0,1]=4 8161 B9R1.41 CC(O)C1CNCC1C Amb29849500 [0,1,0,1,0,0|1,0,1]=4 8162 B9R1.41 CC(O)C1COCC1C Amb35651587 [0,1,0,1,0,0|1,0,1]=4 8163 B9R1.41 CC(O)C1OCCC1O Amb27757203 [0,1,0,1,0,0|1,0,1]=4 8164 B9R1.41 CC1CCCC1[C@@H](C)O Amb28322680 [0,1,0,1,0,0|0,0,2]=4 8165 B9R1.41 CC1OCCC1[C@@H](C)O Amb33427681 [0,1,0,1,0,0|1,0,1]=4 8166 B9R1.41 CC1OCCC1[C@H](C)O Amb33225339 [0,1,0,1,0,0|1,0,1]=4 8167 B9R1.41 C[C@@H](N)[C@@H]1CCC[C@@H]1O Amb35752723 [0,1,0,1,0,0|0,0,2]=4 8168 B9R1.41 C[C@@H](N)[C@H]1CCC[C@H]1O Amb28072273 [0,1,0,1,0,0|0,0,2]=4 8169 B9R1.41 C[C@@H](O)[C@H]1CC=CC1=O Amb27854025 [0,1,0,1,0,0|1,0,1]=4 8170 B9R1.41 C[C@@H](O)[C@H]1OCC[C@H]1O Amb27185774 [0,1,0,1,0,0|1,0,1]=4 8171 B9R1.41 NC1C=CCC1C(=O)O Amb25723511 [0,1,0,1,0,0|1,0,1]=4 8172 B9R1.41 N[C@@H]1C=CC[C@@H]1C(=O)O Amb33716093 [0,1,0,1,0,0|1,0,1]=4 8173 B9R1.41 N[C@H]1C=CC[C@H]1C(=O)O Amb26425593 [0,1,0,1,0,0|1,0,1]=4 8174 B9R1.41 N[C@H]1C=CC[C@H]1C(=O)O Amb31307611 [0,1,0,1,0,0|1,0,1]=4 8175 B9R1.41 O=C(O)C1=CCCC1O Amb27251744 [0,1,0,1,0,0|1,0,1]=4 8176 B9R1.46 CC(=O)\C=C\C1CC1C Amb33143910 [0,1,0,1,0,0|1,0,1]=4 8177 B9R1.46 CC(N)\C=C\C1CC1C Amb33143908 [0,1,0,1,0,0|1,0,0]=3 8178 B9R1.46 CC(O)CCC1CC1C Amb33172627 [0,1,0,1,0,0|0,0,2]=4 8179 B9R1.46 CC(O)\C=C\C1OC1C Amb27956506 [0,1,0,1,0,0|2,0,0]=4 8180 B9R1.46 CC(O)\C=C\[C@H]1O[C@@H]1C Amb28350347 [0,1,0,1,0,0|2,0,0]=4 8181 B9R1.46 CC1CC1CC[C@@H](C)O Amb33144245 [0,1,0,1,0,0|0,0,2]=4 8182 B9R1.46 CC1CC1CC[C@H](C)O Amb33144246 [0,1,0,1,0,0|0,0,2]=4 8183 B9R1.56 CC1(C)CCC1CCO Amb27953782 [0,1,0,1,0,0|0,0,2]=4 8184 B9R1.56 CC1(C)CNC1CCO Amb32946704 [0,1,0,1,0,0|1,0,1]=4 8185 B9R1.59 CC(C)[C@H]1C[C@H]1CCO Amb27429554 [0,1,0,1,0,0|0,0,2]=4 8186 B9R1.59 CCOC1CC1C(C)O Amb28049260 [0,1,0,1,0,0|1,0,1]=4 8187 B9R1.59 C\C=C\C1CC1C(C)O Amb27956457 [0,1,0,1,0,0|0,0,2]=4 8188 B9R1.59 C\C=C\[C@@H]1C[C@H]1[C@@H](C)O Amb28345383 [0,1,0,1,0,0|0,0,2]=4 8189 B9R1.67 CC(=O)\C=C1/CCC1C Amb28251863 [0,1,0,1,0,0|1,0,1]=4 8190 B9R1.67 CC(C)=CC1CCC1O Amb32944793 [0,1,0,1,0,0|0,0,2]=4 8191 B9R1.67 CC(C)CC1CCC1O Amb33213816 [0,1,0,1,0,0|0,0,2]=4 8192 B9R1.67 CC(C)O[C@@H]1CC[C@H]1O Amb33495614 [0,1,0,1,0,0|1,0,1]=4 8193 B9R1.67 CC(C)\C=C1\CCC1=O Amb35752264 [0,1,0,1,0,0|0,0,2]=4 8194 B9R1.77 CC1(C)CC1CCCO Amb24675490 [0,1,0,1,0,0|0,0,2]=4 8195 B9R1.77 CC1(C)CC1\C=C\CO Amb27165277 [0,1,0,1,0,0|2,0,0]=4 8196 B9R1.77 CC1(C)C[C@@H]1\C=C\CO Amb27195119 [0,1,0,1,0,0|2,0,0]=4 8197 B9R1.77 CC1(C)C\C1=C/CCO Amb28194214 [0,1,0,1,0,0|0,0,2]=4 8198 B9R1.77 CC1(C)NN1CCCO Amb27260225 [0,1,0,1,0,0|2,0,0]=4 8199 B9R1.84 CC(=O)\C=C\C1CCC1 Amb33448508 [0,1,0,1,0,0|1,0,1]=4 8200 B9R1.84 CC(N)\C=C\C1CCC1 Amb33172395 [0,1,0,1,0,0|1,0,0]=3 8201 B9R1.84 CC(O)CCC1CCC1 Amb27146306 [0,1,0,1,0,0|0,0,2]=4 8202 B9R1.84 CC(O)\C=C\C1CCC1 Amb27645263 [0,1,0,1,0,0|1,0,0]=3 8203 B9R1.84 C[C@@H](O)CCC1CCC1 Amb33314114 [0,1,0,1,0,0|0,0,2]=4 8204 B9R1.84 C[C@H](O)CCC1CCC1 Amb33195478 [0,1,0,1,0,0|0,0,2]=4 8205 B9R1.85 CC(=O)\C=C\CC1CC1 Amb33361179 [0,1,0,1,0,0|1,0,1]=4 8206 B9R1.85 CC(C)=CCCC1CO1 Amb28207204 [0,1,0,1,0,0|0,0,2]=4 8207 B9R1.85 CC(C)CCCC1CO1 Amb27232305 [0,1,0,1,0,0|0,0,2]=4 8208 B9R1.85 CC(C)COCC1CO1 Amb6600577 [0,1,0,1,0,0|1,0,1]=4 8209 B9R1.85 CC(C)COC[C@H]1CO1 Amb27833842 [0,1,0,1,0,0|1,0,1]=4 8210 B9R1.85 CC(C)CSC[C@@H]1CO1 Amb27956612 [0,1,0,1,0,0|1,0,1]=4 8211 B9R1.85 CC(C)OCCC1CO1 Amb25138542 [0,1,0,1,0,0|1,0,1]=4 8212 B9R1.85 CC(C)SCCC1CO1 Amb27981259 [0,1,0,1,0,0|1,0,1]=4 8213 B9R1.85 CC(N)\C=C\CC1CC1 Amb33361163 [0,1,0,1,0,0|1,0,0]=3 8214 B9R1.85 CC(O)CCCC1CC1 Amb27780444 [0,1,0,1,0,0|0,0,2]=4 8215 B9R1.85 C[C@@H](O)CCCC1CC1 Amb33361223 [0,1,0,1,0,0|0,0,2]=4 8216 B9R1.85 C[C@H](O)CCCC1CC1 Amb33224926 [0,1,0,1,0,0|0,0,2]=4 8217 B9R1.86 CC(C)NC1CC1CO Amb28063375 [0,1,0,1,0,0|1,0,1]=4 8218 B9R1.86 CC(C)N[C@@H]1C[C@H]1CO Amb27978182 [0,1,0,1,0,0|1,0,1]=4 8219 B9R1.86 CCC1OC1CC(C)O Amb28285301 [0,1,0,1,0,0|1,0,1]=4 8220 B9R1.86 CCC1OC1CC(O)O Amb27980594 [0,1,0,1,0,0|1,0,1]=4 8221 B9R1.86 CC[C@H]1O[C@H]1C[C@@H](C)O Amb27196630 [0,1,0,1,0,0|1,0,1]=4 8222 B9R1.86 CC[C@H]1O[C@H]1C[C@H](C)O Amb28430621 [0,1,0,1,0,0|1,0,1]=4 8223 B9R1.96 C[C@@H](O)[C@@H]1C=C[C@@H]1CO Amb27660278 [0,1,0,1,0,0|0,0,2]=4 8224 B9R1.148 CC1(C)C=COCCO1 Amb30621781 [0,1,0,1,0,0|1,0,0]=3 8225 B9R1.148 CC1(C)CNCCCO1 Amb33547983 [0,1,0,1,0,0|1,0,1]=4 8226 B9R1.148 CC1(C)CNCCCO1 Amb9455116 [0,1,0,1,0,0|1,0,1]=4 8227 B9R1.148 CC1(O)CCCCCC1 Amb4017691 [0,1,0,1,0,0|0,0,2]=4 8228 B9R1.148 CC1(O)CCCNCC1 Amb19516809 [0,1,0,1,0,0|1,0,1]=4 8229 B9R1.148 CC1(O)CCCNCC1 Amb22886914 [0,1,0,1,0,0|1,0,1]=4 8230 B9R1.148 CC1(O)CCCNCC1 Amb32409389 [0,1,0,1,0,0|1,0,1]=4 8231 B9R1.148 CC1(O)CCCOCC1 Amb20669018 [0,1,0,1,0,0|1,0,1]=4 8232 B9R1.148 CC1(O)CCCSCC1 Amb35692681 [0,1,0,1,0,0|1,0,1]=4 8233 B9R2.24 OC1C2C=CC1CC2 Amb24745608 [0,0,0,2,0,0|0,0,2]=4 8234 B9R2.24 OC1C2CCC1CC2 Amb28292506 [0,0,0,2,0,0|0,0,2]=4 8235 B9R2.24 OC1C2CCC1NC2 Amb32412678 [0,0,0,2,0,0|1,0,1]=4 8236 B9R2.24 OC1[C@@H]2CC[C@H]1NC2 Amb28131683 [0,0,0,2,0,0|1,0,1]=4 8237 B9R2.47 OCC1CC2CC2C1 Amb25809340 [0,0,0,2,0,0|0,0,2]=4 8238 B9R2.47 OCC1C[C@@H]2C[C@@H]2C1 Amb34915367 [0,0,0,2,0,0|0,0,2]=4 8239 B9R2.47 OC[C@@H]1C[C@@H]2C[C@@H]2C1 Amb28454137 [0,0,0,2,0,0|0,0,2]=4 8240 B9R2.47 OC[C@@H]1C[C@@H]2O[C@@H]2C1 Amb25854390 [0,0,0,2,0,0|1,0,1]=4 8241 B9R2.47 OC[C@H]1C[C@@H]2O[C@@H]2C1 Amb28120562 [0,0,0,2,0,0|1,0,1]=4 8242 B9R2.50 C1=CC[C@H]2NC[C@H]2C1 Amb33804561 [0,0,0,2,0,0|1,0,0]=3 8243 B9R2.50 C1CC2COC2CN1 Amb23597837 [0,0,0,2,0,0|1,0,1]=4 8244 B9R2.50 C1CC2NCC2CO1 Amb27838366 [0,0,0,2,0,0|1,0,1]=4 8245 B9R2.50 C1CC2OCC2CN1 Amb23597836 [0,0,0,2,0,0|1,0,1]=4 8246 B9R2.50 C1C[C@@H]2CO[C@@H]2CN1 Amb32667389 [0,0,0,2,0,0|1,0,1]=4 8247 B9R2.50 C1C[C@@H]2OC[C@@H]2CN1 Amb25938204 [0,0,0,2,0,0|1,0,1]=4 8248 B9R2.50 C1C[C@H]2CO[C@H]2CN1 Amb27445082 [0,0,0,2,0,0|1,0,1]=4 8249 B9R2.53 OC1C2CNCC1C2 Amb19148665 [0,0,0,2,0,0|1,0,1]=4 8250 B9R2.53 OC1C2CNCC1C2 Amb22899728 [0,0,0,2,0,0|1,0,1]=4 8251 B9R2.56 OCC12CCCC1C2 Amb28077781 [0,0,0,2,0,0|0,0,2]=4 8252 B9R2.56 OCC12CNCC1C2 Amb23440140 [0,0,0,2,0,0|1,0,1]=4 8253 B9R2.56 OCC12CNCC1C2 Amb23440141 [0,0,0,2,0,0|1,0,1]=4 8254 B9R2.56 OCC12COCC1C2 Amb25847035 [0,0,0,2,0,0|1,0,1]=4 8255 B9R2.56 OC[C@@]12CNC[C@@H]1C2 Amb22757897 [0,0,0,2,0,0|1,0,1]=4 8256 B9R2.56 OC[C@]12CCC[C@H]1C2 Amb32679249 [0,0,0,2,0,0|0,0,2]=4 8257 B9R2.56 OC[C@]12CNC[C@H]1C2 Amb27631383 [0,0,0,2,0,0|1,0,1]=4 8258 B9R2.56 OC[C@]12COC[C@H]1C2 Amb25954636 [0,0,0,2,0,0|1,0,1]=4 8259 B9R2.65 O=C[C@H]1[C@@H]2C=CC[C@@H]21 Amb27818200 [0,0,0,2,0,0|0,0,2]=4 8260 B9R2.65 O=C[C@H]1[C@H]2C=CC[C@@H]12 Amb28131428 [0,0,0,2,0,0|0,0,2]=4 8261 B9R2.65 OCC1C2CCCC12 Amb26542427 [0,0,0,2,0,0|0,0,2]=4 8262 B9R2.65 OCC1C2CCSC12 Amb28122980 [0,0,0,2,0,0|1,0,1]=4 8263 B9R2.65 OCC1C2CNCC12 Amb24112955 [0,0,0,2,0,0|1,0,1]=4 8264 B9R2.65 OCC1C2COCC12 Amb26564535 [0,0,0,2,0,0|1,0,1]=4 8265 B9R2.65 OCC1C2CSCC12 Amb27782205 [0,0,0,2,0,0|1,0,1]=4 8266 B9R2.65 OCC1[C@@H]2COC[C@@H]12 Amb33715904 [0,0,0,2,0,0|1,0,1]=4 8267 B9R2.65 OCC1[C@@H]2COC[C@H]12 Amb26398320 [0,0,0,2,0,0|1,0,1]=4 8268 B9R2.65 OCC1[C@H]2CNC[C@@H]12 Amb22745856 [0,0,0,2,0,0|1,0,1]=4 8269 B9R2.65 OCC1[C@H]2CNC[C@H]12 Amb34915265 [0,0,0,2,0,0|1,0,1]=4 8270 B9R2.65 OCC1[C@H]2COC[C@H]12 Amb25981071 [0,0,0,2,0,0|1,0,1]=4 8271 B9R2.65 OC[C@@H]1[C@@H]2COC[C@@H]21 Amb23439355 [0,0,0,2,0,0|1,0,1]=4 8272 B9R2.65 OC[C@@H]1[C@H]2CNC[C@H]21 Amb7970109 [0,0,0,2,0,0|1,0,1]=4 8273 B9R2.65 OC[C@H]1[C@@H]2COC[C@H]12 Amb27980393 [0,0,0,2,0,0|1,0,1]=4 8274 B9R2.65 OC[C@H]1[C@H]2CCC[C@@H]12 Amb27753115 [0,0,0,2,0,0|0,0,2]=4 8275 B9R2.65 OC[C@H]1[C@H]2CNC[C@@H]12 Amb25976432 [0,0,0,2,0,0|1,0,1]=4 8276 B9R2.65 OC[C@H]1[C@H]2CNC[C@@H]12 Amb32643979 [0,0,0,2,0,0|1,0,1]=4 8277 B9R2.68 C1=CC2CC(C1)CN2 Amb35789168 [0,0,0,2,0,0|1,0,0]=3 8278 B9R2.68 C1=CC2CC(C1)CN2 Amb35789832 [0,0,0,2,0,0|1,0,0]=3 8279 B9R2.68 C1=CC2CCC(C1)N2 Amb18123991 [0,0,0,2,0,0|2,0,0]=4 8280 B9R2.68 C1=CC2CCC(C1)N2 Amb28934858 [0,0,0,2,0,0|2,0,0]=4 8281 B9R2.68 C1=CC2CCCC1N2 Amb27838404 [0,0,0,2,0,0|2,0,0]=4 8282 B9R2.68 C1=C[C@H]2CC[C@@H](C1)C2 Amb26925899 [0,0,0,2,0,0|1,0,0]=3 8283 B9R2.68 C1CC2CCC(C1)O2 Amb22364980 [0,0,0,2,0,0|0,0,2]=4 8284 B9R2.68 C1C[C@H]2CON(C1)C2 Amb27435263 [0,0,0,2,0,0|1,0,1]=4 8285 B9R2.68 C1NCC2CC1CO2 Amb19515653 [0,0,0,2,0,0|1,0,1]=4 8286 B9R2.68 C1NCC2CC1CO2 Amb28934885 [0,0,0,2,0,0|1,0,1]=4 8287 B9R2.70 OCC1CCC2CC12 Amb27606531 [0,0,0,2,0,0|0,0,2]=4 8288 B9R2.70 OC[C@@H]1CC[C@@H]2C[C@H]12 Amb27665513 [0,0,0,2,0,0|0,0,2]=4 8289 B9R2.123 BrC1C2CC=CCC12 Amb27393026 [0,0,0,2,0,0|1,0,0]=3 8290 B9R2.123 BrC1[C@H]2CCC=C[C@@H]12 Amb27488925 [0,0,0,2,0,0|1,0,0]=3 8291 B9R2.123 Br[C@@H]1[C@H]2CC=CC[C@H]21 Amb28342981 [0,0,0,2,0,0|1,0,0]=3 8292 B9R2.123 CC1C2CC=CCC12 Amb22356563 [0,0,0,2,0,0|1,0,0]=3 8293 B9R2.123 Cl[C@H]1[C@H]2CCC=C[C@@H]12 Amb27433961 [0,0,0,2,0,0|1,0,0]=3 8294 B9R2.123 OC1C2CCCCC12 Amb17593167 [0,0,0,2,0,0|0,0,2]=4 8295 B9R2.174 C1=CCC2(CC1)CC2 Amb22365309 [0,0,0,2,0,0|1,0,0]=3 8296 B9R2.174 C1CC2(CCO1)CO2 Amb10976057 [0,0,0,2,0,0|1,0,1]=4 8297 B9R2.174 C1CC2(CCS1)CO2 Amb22896493 [0,0,0,2,0,0|1,0,1]=4 8298 B9R2.174 C1CCC2(CC1)CO2 Amb6892810 [0,0,0,2,0,0|0,0,2]=4 8299 B9R2.174 C1COCC2(C1)CO2 Amb27630068 [0,0,0,2,0,0|1,0,1]=4 8300 B9R2.6 CC12CC=CCC1O2 Amb22365024 [0,0,0,2,0,0|0,0,2]=4 8301 B9R2.6 CC12CCCCC1O2 Amb17939278 [0,0,0,2,0,0|0,0,2]=4 8302 B9R2.6 OC12CCNCC1C2 Amb19149081 [0,0,0,2,0,0|1,0,1]=4 8303 B9R2.6 OC12CCNCC1C2 Amb32662017 [0,0,0,2,0,0|1,0,1]=4 8304 B9R2.6 O[C@]12CCNC[C@H]1C2 Amb32667224 [0,0,0,2,0,0|1,0,1]=4 8305 B9R2.6 O[C@]12CCNC[C@H]1C2 Amb32667225 [0,0,0,2,0,0|1,0,1]=4 8306 B9R2.17 CC12CC1CCC2O Amb28285220 [0,0,0,2,0,0|0,0,2]=4 8307 B9R2.17 CC12OC1CCC2O Amb28043386 [0,0,0,2,0,0|1,0,1]=4 8308 B9R2.17 C[C@@]12C[C@@H]1CC[C@@H]2O Amb28321277 [0,0,0,2,0,0|0,0,2]=4 8309 B9R2.17 C[C@@]12O[C@@H]1CC[C@@H]2O Amb28061892 [0,0,0,2,0,0|1,0,1]=4 8310 B9R2.19 ClC1C=CC2CC1C2 Amb27657218 [0,0,0,2,0,0|2,0,0]=4 8311 B9R2.19 NC1C=CC2CC1C2 Amb28077632 [0,0,0,2,0,0|2,0,0]=4 8312 B9R2.19 OC1C=CC2CC1C2 Amb28207135 [0,0,0,2,0,0|2,0,0]=4 8313 B9R2.19 OC1CCC2CC1C2 Amb27423100 [0,0,0,2,0,0|0,0,2]=4 8314 B9R2.19 O[C@@H]1CCC2CC1C2 Amb27461153 [0,0,0,2,0,0|0,0,2]=4 8315 B9R2.37 C[C@H]1[C@@H](O)C[C@H]2O[C@@H]12 Amb27234395 [0,0,0,2,0,0|1,0,1]=4 8316 B9R2.39 BrC1CC2C=CC1C2 Amb27243334 [0,0,0,2,0,0|1,0,0]=3 8317 B9R2.39 C=C1CC2C=CC1C2 Amb21855937 [0,0,0,2,0,0|1,0,1]=4 8318 B9R2.39 C=C1C[C@@H]2C=C[C@H]1C2 Amb27261461 [0,0,0,2,0,0|1,0,1]=4 8319 B9R2.39 C=C1C[C@H]2C=C[C@@H]1C2 Amb33523586 [0,0,0,2,0,0|1,0,1]=4 8320 B9R2.39 CC1CC2CCC1O2 Amb27202757 [0,0,0,2,0,0|0,0,2]=4 8321 B9R2.39 ClC1C[C@@H]2C=C[C@H]1C2 Amb27477159 [0,0,0,2,0,0|1,0,0]=3 8322 B9R2.39 Cl[C@H]1C[C@@H]2C=C[C@H]1C2 Amb28286185 [0,0,0,2,0,0|1,0,0]=3 8323 B9R2.39 Cl[C@H]1C[C@H]2C=C[C@H]1C2 Amb28073803 [0,0,0,2,0,0|1,0,0]=3 8324 B9R2.39 NC1CC2C=CC1C2 Amb22546323 [0,0,0,2,0,0|1,0,0]=3 8325 B9R2.39 NC1CC2C=CC1C2 Amb23592193 [0,0,0,2,0,0|1,0,0]=3 8326 B9R2.39 NC1CC2C=CC1O2 Amb28136333 [0,0,0,2,0,0|2,0,0]=4 8327 B9R2.39 NC1CC2C=CC1O2 Amb30585132 [0,0,0,2,0,0|2,0,0]=4 8328 B9R2.39 N[C@H]1C[C@@H]2C=C[C@H]1C2 Amb27799274 [0,0,0,2,0,0|1,0,0]=3 8329 B9R2.39 O=C1CC2C=CC1C2 Amb4477237 [0,0,0,2,0,0|0,0,2]=4 8330 B9R2.39 O=C1C[C@@H]2C=C[C@H]1C2 Amb28385475 [0,0,0,2,0,0|0,0,2]=4 8331 B9R2.39 O=C1C[C@H]2C=C[C@@H]1C2 Amb25061616 [0,0,0,2,0,0|0,0,2]=4 8332 B9R2.39 OC1CC2C=CC1C2 Amb19958337 [0,0,0,2,0,0|0,0,0]=2 8333 B9R2.39 OC1CC2CC1CN2 Amb27461305 [0,0,0,2,0,0|1,0,1]=4 8334 B9R2.39 OC1CC2CC1CN2 Amb30633713 [0,0,0,2,0,0|1,0,1]=4 8335 B9R2.39 OC1CC2CCC1C2 Amb2780727 [0,0,0,2,0,0|0,0,2]=4 8336 B9R2.39 OC1CC2CCC1N2 Amb24482057 [0,0,0,2,0,0|1,0,1]=4 8337 B9R2.39 OC1CC2CCC1O2 Amb3428664 [0,0,0,2,0,0|1,0,1]=4 8338 B9R2.39 OC1CC2CC[C@H]1C2 Amb28079100 [0,0,0,2,0,0|0,0,2]=4 8339 B9R2.39 OC1CC2CNC1C2 Amb27229775 [0,0,0,2,0,0|1,0,1]=4 8340 B9R2.39 OC1CC2CNC1C2 Amb30869322 [0,0,0,2,0,0|1,0,1]=4 8341 B9R2.39 OC1C[C@@H]2C=C[C@H]1C2 Amb26920676 [0,0,0,2,0,0|0,0,0]=2 8342 B9R2.39 OC1C[C@@H]2CC[C@H]1C2 Amb27962782 [0,0,0,2,0,0|0,0,2]=4 8343 B9R2.39 OC1C[C@H]2C=C[C@@H]1C2 Amb33524064 [0,0,0,2,0,0|0,0,0]=2 8344 B9R2.39 OC1C[C@H]2C=C[C@H]1C2 Amb28428493 [0,0,0,2,0,0|0,0,0]=2 8345 B9R2.39 OC1C[C@H]2CC[C@@H]1O2 Amb27197696 [0,0,0,2,0,0|1,0,1]=4 8346 B9R2.39 OC1C[C@H]2C[C@@H]1CN2 Amb27790833 [0,0,0,2,0,0|1,0,1]=4 8347 B9R2.39 OC1N[C@H]2C=C[C@@H]1C2 Amb27216764 [0,0,0,2,0,0|1,0,0]=3 8348 B9R2.39 O[C@@H]1CC2C=C[C@@H]1C2 Amb28069705 [0,0,0,2,0,0|0,0,0]=2 8349 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1C2 Amb27481081 [0,0,0,2,0,0|0,0,2]=4 8350 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1N2 Amb25222600 [0,0,0,2,0,0|1,0,1]=4 8351 B9R2.39 O[C@@H]1C[C@@H]2CC[C@@H]1N2 Amb34915143 [0,0,0,2,0,0|1,0,1]=4 8352 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 Amb23439253 [0,0,0,2,0,0|1,0,1]=4 8353 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 Amb31291918 [0,0,0,2,0,0|1,0,1]=4 8354 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1O2 Amb33328659 [0,0,0,2,0,0|1,0,1]=4 8355 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CN2 Amb24682880 [0,0,0,2,0,0|1,0,1]=4 8356 B9R2.39 O[C@@H]1C[C@H]2C=C[C@@H]1C2 Amb28369855 [0,0,0,2,0,0|0,0,0]=2 8357 B9R2.39 O[C@@H]1C[C@H]2C=C[C@@H]1O2 Amb28345331 [0,0,0,2,0,0|1,0,0]=3 8358 B9R2.39 O[C@@H]1C[C@H]2C=C[C@H]1C2 Amb28053800 [0,0,0,2,0,0|0,0,0]=2 8359 B9R2.39 O[C@@H]1C[C@H]2CCC1C2 Amb28455166 [0,0,0,2,0,0|0,0,2]=4 8360 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1C2 Amb10844941 [0,0,0,2,0,0|0,0,2]=4 8361 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1N2 Amb23439252 [0,0,0,2,0,0|1,0,1]=4 8362 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1N2 Amb25970068 [0,0,0,2,0,0|1,0,1]=4 8363 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1O2 Amb26972146 [0,0,0,2,0,0|1,0,1]=4 8364 B9R2.39 O[C@@H]1C[C@H]2CC[C@H]1N2 Amb26918517 [0,0,0,2,0,0|1,0,1]=4 8365 B9R2.39 O[C@@H]1C[C@H]2CN[C@@H]1C2 Amb27850501 [0,0,0,2,0,0|1,0,1]=4 8366 B9R2.39 O[C@@H]1C[C@H]2CN[C@@H]1C2 Amb33210366 [0,0,0,2,0,0|1,0,1]=4 8367 B9R2.39 O[C@H]1CC2CC[C@@H]1C2 Amb27853961 [0,0,0,2,0,0|0,0,2]=4 8368 B9R2.39 O[C@H]1C[C@@H]2C=C[C@H]1C2 Amb27428377 [0,0,0,2,0,0|0,0,0]=2 8369 B9R2.39 O[C@H]1C[C@@H]2CC[C@@H]1N2 Amb27201459 [0,0,0,2,0,0|1,0,1]=4 8370 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1C2 Amb24567063 [0,0,0,2,0,0|0,0,2]=4 8371 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 Amb27626546 [0,0,0,2,0,0|1,0,1]=4 8372 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 Amb33801109 [0,0,0,2,0,0|1,0,1]=4 8373 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1O2 Amb25332128 [0,0,0,2,0,0|1,0,1]=4 8374 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 Amb26892014 [0,0,0,2,0,0|1,0,1]=4 8375 B9R2.39 O[C@H]1C[C@@H]2CO[C@H]1C2 Amb27650456 [0,0,0,2,0,0|1,0,1]=4 8376 B9R2.39 O[C@H]1C[C@@H]2CS[C@@H]1C2 Amb27472437 [0,0,0,2,0,0|1,0,1]=4 8377 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CN2 Amb27194950 [0,0,0,2,0,0|1,0,1]=4 8378 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CO2 Amb28064083 [0,0,0,2,0,0|1,0,1]=4 8379 B9R2.39 O[C@H]1C[C@H]2C=C[C@@H]1C2 Amb27635724 [0,0,0,2,0,0|0,0,0]=2 8380 B9R2.39 O[C@H]1C[C@H]2CC[C@@H]1C2 Amb3940163 [0,0,0,2,0,0|0,0,2]=4 8381 B9R2.39 O[C@H]1C[C@H]2CN[C@@H]1C2 Amb27447299 [0,0,0,2,0,0|1,0,1]=4 8382 B9R2.39 O[C@H]1C[C@H]2CO[C@@H]1C2 Amb27805102 [0,0,0,2,0,0|1,0,1]=4 8383 B9R2.39 O[C@H]1C[C@H]2CO[C@H]1C2 Amb27221642 [0,0,0,2,0,0|1,0,1]=4 8384 B9R2.39 SC1CC2C=CC1C2 Amb32788481 [0,0,0,2,0,0|0,1,0]=3 8385 B9R2.39 SC1C[C@H]2C=C[C@@H]1C2 Amb32788701 [0,0,0,2,0,0|0,1,0]=3 8386 B9R2.109 CC1=CCCC2OC12 Amb27875404 [0,0,0,2,0,0|0,0,2]=4 8387 B9R2.109 Cl[C@@H]1C=CC[C@H]2O[C@@H]12 Amb27232851 [0,0,0,2,0,0|1,0,0]=3 8388 B9R2.109 OC1CCCC2CC12 Amb26963531 [0,0,0,2,0,0|0,0,2]=4 8389 B9R2.109 OC1CCC[C@@H]2C[C@H]12 Amb27659888 [0,0,0,2,0,0|0,0,2]=4 8390 B9R2.109 O[C@@H]1C=CC[C@H]2C[C@@H]12 Amb27790188 [0,0,0,2,0,0|2,0,0]=4 8391 B9R2.109 O[C@@H]1C=CC[C@H]2O[C@@H]12 Amb27422316 [0,0,0,2,0,0|1,0,0]=3 8392 B9R2.109 O[C@@H]1CCC[C@H]2C[C@H]21 Amb27432134 [0,0,0,2,0,0|0,0,2]=4 8393 B9R2.109 O[C@H]1C=CC[C@H]2C[C@H]21 Amb27219001 [0,0,0,2,0,0|2,0,0]=4 8394 B9R2.109 O[C@H]1CCC[C@@H]2C[C@H]12 Amb27261725 [0,0,0,2,0,0|0,0,2]=4 8395 B9R2.109 O[C@H]1CCC[C@H]2C[C@@H]12 Amb27805079 [0,0,0,2,0,0|0,0,2]=4 8396 B9R2.2 C1CC(C2CO2)CO1 Amb22757940 [0,0,0,2,0,0|1,0,1]=4 8397 B9R2.2 C1CC(C2CO2)CS1 Amb33141333 [0,0,0,2,0,0|1,0,1]=4 8398 B9R2.2 C1CC([C@@H]2CO2)CO1 Amb33420427 [0,0,0,2,0,0|1,0,1]=4 8399 B9R2.2 C1CC([C@@H]2CO2)CS1 Amb33344951 [0,0,0,2,0,0|1,0,1]=4 8400 B9R2.2 C1CC([C@H]2CO2)CO1 Amb33420409 [0,0,0,2,0,0|1,0,1]=4 8401 B9R2.2 C1CC([C@H]2CO2)CS1 Amb33344952 [0,0,0,2,0,0|1,0,1]=4 8402 B9R2.2 C1CCC(C2CO2)C1 Amb27655529 [0,0,0,2,0,0|0,0,2]=4 8403 B9R2.2 C1CCC([C@@H]2CO2)C1 Amb33315082 [0,0,0,2,0,0|0,0,2]=4 8404 B9R2.2 C1CCC([C@H]2CO2)C1 Amb33315083 [0,0,0,2,0,0|0,0,2]=4 8405 B9R2.2 C1CN=C(C2CC2)C1 Amb24053736 [0,0,0,2,0,0|1,0,1]=4 8406 B9R2.2 C1COC(C2CO2)C1 Amb28346667 [0,0,0,2,0,0|1,0,1]=4 8407 B9R2.2 C1COC([C@@H]2CO2)C1 Amb33317957 [0,0,0,2,0,0|1,0,1]=4 8408 B9R2.2 C1COC([C@H]2CO2)C1 Amb33317995 [0,0,0,2,0,0|1,0,1]=4 8409 B9R2.2 C1CSC(C2CO2)C1 Amb33416209 [0,0,0,2,0,0|1,0,1]=4 8410 B9R2.2 C1CSC([C@@H]2CO2)C1 Amb33415035 [0,0,0,2,0,0|1,0,1]=4 8411 B9R2.2 C1CSC([C@H]2CO2)C1 Amb33415036 [0,0,0,2,0,0|1,0,1]=4 8412 B9R2.3 C1=C2CNCC2CC1 Amb35788406 [0,0,0,2,0,0|2,0,0]=4 8413 B9R2.3 C1=C2CNCC2CC1 Amb35789050 [0,0,0,2,0,0|2,0,0]=4 8414 B9R2.3 C1=CC2CC=CC2C1 Amb22356309 [0,0,0,2,0,0|1,0,1]=4 8415 B9R2.3 C1=C[C@H]2CCO[C@H]2O1 Amb27852857 [0,0,0,2,0,0|1,0,0]=3 8416 B9R2.3 C1=NCC2CCCC12 Amb25957455 [0,0,0,2,0,0|2,0,0]=4 8417 B9R2.3 C1=NOC2OCCC12 Amb26498222 [0,0,0,2,0,0|2,0,0]=4 8418 B9R2.3 C1CC2=NCCN2C1 Amb26059972 [0,0,0,2,0,0|2,0,0]=4 8419 B9R2.3 C1CC2CNCC2O1 Amb25743923 [0,0,0,2,0,0|1,0,1]=4 8420 B9R2.3 C1CC2CNCC2O1 Amb32661473 [0,0,0,2,0,0|1,0,1]=4 8421 B9R2.3 C1CC2COCC2N1 Amb22295819 [0,0,0,2,0,0|1,0,1]=4 8422 B9R2.3 C1CC2OCCC2N1 Amb24411464 [0,0,0,2,0,0|1,0,1]=4 8423 B9R2.3 C1CC2OCCC2O1 Amb28204365 [0,0,0,2,0,0|1,0,1]=4 8424 B9R2.3 C1C[C@@H]2CNC[C@@H]2O1 Amb22757949 [0,0,0,2,0,0|1,0,1]=4 8425 B9R2.3 C1C[C@@H]2CNC[C@@H]2O1 Amb25168863 [0,0,0,2,0,0|1,0,1]=4 8426 B9R2.3 C1C[C@@H]2COC[C@H]2N1 Amb27871467 [0,0,0,2,0,0|1,0,1]=4 8427 B9R2.3 C1C[C@@H]2OCC[C@@H]2N1 Amb22757961 [0,0,0,2,0,0|1,0,1]=4 8428 B9R2.3 C1C[C@@H]2OCC[C@@H]2N1 Amb26603053 [0,0,0,2,0,0|1,0,1]=4 8429 B9R2.3 C1C[C@H]2COC[C@@H]2N1 Amb18833060 [0,0,0,2,0,0|1,0,1]=4 8430 B9R2.3 C1C[C@H]2OCC[C@H]2N1 Amb27630968 [0,0,0,2,0,0|1,0,1]=4 8431 B9R2.3 C1C[C@H]2OCC[C@H]2N1 Amb33715419 [0,0,0,2,0,0|1,0,1]=4 8432 B9R2.3 C1NCC2COCC12 Amb18833061 [0,0,0,2,0,0|1,0,1]=4 8433 B9R2.3 C1NCC2COCC12 Amb22493837 [0,0,0,2,0,0|1,0,1]=4 8434 B9R2.3 C1NC[C@@H]2COC[C@@H]12 Amb31308558 [0,0,0,2,0,0|1,0,1]=4 8435 B9R2.3 C1NC[C@@H]2COC[C@H]12 Amb22746773 [0,0,0,2,0,0|1,0,1]=4 8436 B9R2.3 C1NC[C@@H]2COC[C@H]12 Amb22747277 [0,0,0,2,0,0|1,0,1]=4 8437 B9R2.3 C1NO[C@@H]2COC[C@H]12 Amb33098626 [0,0,0,2,0,0|2,0,0]=4 8438 B9R2.7 O=C1CC2C=CCC12 Amb8631505 [0,0,0,2,0,0|0,0,2]=4 8439 B9R2.7 O=C1C[C@@H]2C=CC[C@H]12 Amb22735988 [0,0,0,2,0,0|0,0,2]=4 8440 B9R2.7 O=C1C[C@H]2C=CC[C@H]12 Amb25962489 [0,0,0,2,0,0|0,0,2]=4 8441 B9R2.7 OC1CC2=C1CCC2 Amb27481033 [0,0,0,2,0,0|0,0,2]=4 8442 B9R2.7 OC1CC2CCOC12 Amb27404596 [0,0,0,2,0,0|1,0,1]=4 8443 B9R2.7 OC1CC2CNCC12 Amb25376641 [0,0,0,2,0,0|1,0,1]=4 8444 B9R2.7 OC1CC2NCCC12 Amb27837982 [0,0,0,2,0,0|1,0,1]=4 8445 B9R2.7 OC1CC2OCCC12 Amb27830109 [0,0,0,2,0,0|1,0,1]=4 8446 B9R2.7 OC1C[C@@H]2CCO[C@H]12 Amb27970982 [0,0,0,2,0,0|1,0,1]=4 8447 B9R2.7 OC1C[C@H]2C=CC[C@@H]12 Amb27652871 [0,0,0,2,0,0|0,0,0]=2 8448 B9R2.7 O[C@@H]1C[C@@H]2CCO[C@@H]21 Amb27194431 [0,0,0,2,0,0|1,0,1]=4 8449 B9R2.7 O[C@@H]1C[C@@H]2CNC[C@@H]21 Amb30526947 [0,0,0,2,0,0|1,0,1]=4 8450 B9R2.7 O[C@@H]1C[C@@H]2NCC[C@@H]21 Amb30526945 [0,0,0,2,0,0|1,0,1]=4 8451 B9R2.7 O[C@@H]1C[C@H]2C=CC[C@H]21 Amb27488639 [0,0,0,2,0,0|0,0,0]=2 8452 B9R2.7 O[C@@H]1C[C@H]2CCC[C@@H]12 Amb27184164 [0,0,0,2,0,0|0,0,2]=4 8453 B9R2.7 O[C@@H]1C[C@H]2CNC[C@@H]12 Amb30526948 [0,0,0,2,0,0|1,0,1]=4 8454 B9R2.7 O[C@@H]1C[C@H]2NCC[C@@H]12 Amb27632497 [0,0,0,2,0,0|1,0,1]=4 8455 B9R2.7 O[C@@H]1C[C@H]2NCC[C@@H]12 Amb30526946 [0,0,0,2,0,0|1,0,1]=4 8456 B9R2.7 O[C@H]1C[C@H]2C=CC[C@@H]12 Amb28065322 [0,0,0,2,0,0|0,0,0]=2 8457 B9R2.7 O[C@H]1C[C@H]2CC=C[C@@H]12 Amb27205200 [0,0,0,2,0,0|0,0,2]=4 8458 B9R2.7 O[C@H]1C[C@H]2CCC[C@@H]12 Amb27652942 [0,0,0,2,0,0|0,0,2]=4 8459 B9R2.80 OCC1C2CNC1C2 Amb27759371 [0,0,0,2,0,0|1,0,1]=4 8460 B9R2.173 C1=CC2(CCC2)NC1 Amb32667430 [0,0,0,2,0,0|2,0,0]=4 8461 B9R2.173 C1CC2(CCO2)CN1 Amb21856698 [0,0,0,2,0,0|1,0,1]=4 8462 B9R2.173 C1CC2(CCO2)CN1 Amb22406281 [0,0,0,2,0,0|1,0,1]=4 8463 B9R2.173 C1CC2(CCO2)CN1 Amb28989531 [0,0,0,2,0,0|1,0,1]=4 8464 B9R2.173 C1CC2(CCO2)CN1 Amb32409426 [0,0,0,2,0,0|1,0,1]=4 8465 B9R2.173 C1CC2(CCO2)CN1 Amb33329470 [0,0,0,2,0,0|1,0,1]=4 8466 B9R2.12 CC1CC1CC2CO2 Amb33144969 [0,0,0,2,0,0|0,0,2]=4 8467 B9R2.18 CC1[C@@H]2CC[C@H](O)[C@H]12 Amb28052862 [0,0,0,2,0,0|0,0,2]=4 8468 B9R2.18 C[C@H]1[C@@H]2CC[C@@H](O)[C@H]12 Amb28345451 [0,0,0,2,0,0|0,0,2]=4 8469 B9R2.18 ClC1C2C=CC(Br)C12 Amb27873510 [0,0,0,2,0,0|2,0,0]=4 8470 B9R2.18 Cl[C@@H]1C=C[C@H]2[C@H](Br)[C@@H]12 Amb27791794 [0,0,0,2,0,0|2,0,0]=4 8471 B9R2.18 Cl[C@@H]1[C@H]2[C@H](Br)C=C[C@@H]12 Amb27793667 [0,0,0,2,0,0|2,0,0]=4 8472 B9R2.18 OC1C=CC2C(Br)C12 Amb28240461 [0,0,0,2,0,0|2,0,0]=4 8473 B9R2.21 OC1C=C[C@@H]2C[C@@H]2C1 Amb27197544 [0,0,0,2,0,0|2,0,0]=4 8474 B9R2.21 OC1CC[C@@H]2C[C@@H]2C1 Amb27857686 [0,0,0,2,0,0|0,0,2]=4 8475 B9R2.21 OC1CC[C@@H]2O[C@@H]2C1 Amb27775498 [0,0,0,2,0,0|1,0,1]=4 8476 B9R2.21 OC1CC[C@@H]2O[C@H]2C1 Amb27422479 [0,0,0,2,0,0|1,0,1]=4 8477 B9R2.21 O[C@@H]1C=C[C@H]2C[C@H]2C1 Amb28202543 [0,0,0,2,0,0|2,0,0]=4 8478 B9R2.21 O[C@@H]1CC[C@@H]2O[C@@H]2C1 Amb27448393 [0,0,0,2,0,0|1,0,1]=4 8479 B9R2.21 O[C@H]1CC[C@H]2C[C@H]2C1 Amb27978320 [0,0,0,2,0,0|0,0,2]=4 8480 B9R2.44 C[C@@H]1C[C@@]12CC2CO Amb27202583 [0,0,0,2,0,0|0,0,2]=4 8481 B9R2.44 C[C@H]1C[C@@]12C[C@@H]2CO Amb28206047 [0,0,0,2,0,0|0,0,2]=4 8482 B9R2.44 C[C@H]1C[C@@]12C[C@H]2CO Amb27422318 [0,0,0,2,0,0|0,0,2]=4 8483 B9R2.52 C1CCC2OC2CC1 Amb9708770 [0,0,0,2,0,0|0,0,2]=4 8484 B9R2.20 ClC1C=CC2CCC12 Amb27267998 [0,0,0,2,0,0|2,0,0]=4 8485 B9R2.20 O[C@@H]1C=C[C@@H]2CC[C@H]12 Amb25252536 [0,0,0,2,0,0|2,0,0]=4 8486 B9R2.20 O[C@@H]1CC[C@@H]2C=C[C@H]12 Amb28435644 [0,0,0,2,0,0|0,0,2]=4 8487 B9R2.20 O[C@@H]1CC[C@H]2CC[C@@H]12 Amb27420440 [0,0,0,2,0,0|0,0,2]=4 8488 B9R2.20 O[C@H]1C=CC2CCC21 Amb26641999 [0,0,0,2,0,0|2,0,0]=4 8489 B9R2.20 O[C@H]1C=C[C@@H]2CC[C@@H]21 Amb24648863 [0,0,0,2,0,0|2,0,0]=4 8490 B9R2.20 O[C@H]1CC[C@@H]2CC[C@H]12 Amb28256395 [0,0,0,2,0,0|0,0,2]=4 8491 B9R2.20 O[C@H]1CC[C@H]2CC[C@@H]12 Amb27653200 [0,0,0,2,0,0|0,0,2]=4 8492 B9R2.140 OC1CCC12CCC2 Amb26539171 [0,0,0,2,0,0|0,0,2]=4 8493 B9R2.153 OCC1CC12CCC2 Amb26942513 [0,0,0,2,0,0|0,0,2]=4 8494 B9R2.157 C1CC(CC2CO2)C1 Amb26390615 [0,0,0,2,0,0|0,0,2]=4 8495 B9R2.5 CC1CCCC12CO2 Amb24533573 [0,0,0,2,0,0|0,0,2]=4 8496 B9R2.5 CC1COCC12CO2 Amb29882957 [0,0,0,2,0,0|1,0,1]=4 8497 B9R2.5 CC1CSCC12CO2 Amb33731417 [0,0,0,2,0,0|1,0,1]=4 8498 B9R2.5 CC1OCCC12CO2 Amb25946071 [0,0,0,2,0,0|1,0,1]=4 8499 B9R2.5 CC1SCCC12CO2 Amb33745268 [0,0,0,2,0,0|1,0,1]=4 8500 B9R2.5 OC1CCCC12CC2 Amb27484590 [0,0,0,2,0,0|0,0,2]=4 8501 B9R2.5 OC1CCNC12CC2 Amb26026452 [0,0,0,2,0,0|1,0,1]=4 8502 B9R2.5 OC1CCNC12CC2 Amb35751154 [0,0,0,2,0,0|1,0,1]=4 8503 B9R2.31 C[C@@H]1[C@@H]2C[C@H](O)[C@H]1C2 Amb27190682 [0,0,0,2,0,0|0,0,2]=4 8504 B9R2.33 O=C1CC2C=CC2C1 Amb28059971 [0,0,0,2,0,0|0,0,2]=4 8505 B9R2.33 OC1CC2CCC2C1 Amb28292645 [0,0,0,2,0,0|0,0,2]=4 8506 B9R2.33 OC1C[C@H]2CC[C@@H]2C1 Amb27208215 [0,0,0,2,0,0|0,0,2]=4 8507 B9R2.33 O[C@@H]1C[C@@H]2C=C[C@@H]2C1 Amb27595179 [0,0,0,2,0,0|0,0,0]=2 8508 B9R2.33 O[C@H]1C[C@@H]2CC[C@@H]2C1 Amb27836254 [0,0,0,2,0,0|0,0,2]=4 8509 B9R2.36 OC1CCC1C2CC2 Amb24711940 [0,0,0,2,0,0|0,0,2]=4 8510 B9R2.28 OCCC1CC12CC2 Amb22727912 [0,0,0,2,0,0|0,0,2]=4 8511 B9R2.28 OC\C=C1\CC12CC2 Amb28065337 [0,0,0,2,0,0|2,0,0]=4 8512 B9R2.79 OCC1CC1C2CC2 Amb28124151 [0,0,0,2,0,0|0,0,2]=4 8513 B9R2.79 OC[C@@H]1CC1=C2CC2 Amb27631965 [0,0,0,2,0,0|0,0,0]=2 8514 B9R2.79 OC[C@@H]1C[C@H]1C2CC2 Amb32657995 [0,0,0,2,0,0|0,0,2]=4 8515 B9R2.69 C1CC1CCC2CO2 Amb27427391 [0,0,0,2,0,0|0,0,2]=4