0 B7R0.1 BrCCCCCCBr Amb2686735 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.1 BrCCSSCCBr Amb27876631 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.1 BrCC\C=C\CCBr Amb17612549 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.1 C#CCCCCCC Amb3940499 [0,0,0,0,0,0|2,0,2]=4 4 B7R0.1 C#CCCSCCC Amb27410296 [0,0,0,0,0,0|1,0,2]=3 5 B7R0.1 C#CCCSCCN Amb6258722 [0,0,0,0,0,0|2,0,2]=4 6 B7R0.1 C#CCSCCCC Amb26066454 [0,0,0,0,0,0|1,0,2]=3 7 B7R0.1 C#CCSCCCN Amb17500721 [0,0,0,0,0,0|2,0,2]=4 8 B7R0.1 C#CCSCCCO Amb17502862 [0,0,0,0,0,0|2,0,2]=4 9 B7R0.1 C#CC\C=C\CCC Amb33424838 [0,0,0,0,0,0|2,0,2]=4 10 B7R0.1 C=CCCCCCC Amb3940500 [0,0,0,0,0,0|2,0,2]=4 11 B7R0.1 C=CCCNCCC Amb27796644 [0,0,0,0,0,0|2,0,2]=4 12 B7R0.1 C=CCCSCCC Amb27806215 [0,0,0,0,0,0|1,0,2]=3 13 B7R0.1 C=CCCSCCN Amb25889820 [0,0,0,0,0,0|2,0,2]=4 14 B7R0.1 C=CCCSCCO Amb28283935 [0,0,0,0,0,0|2,0,2]=4 15 B7R0.1 C=CCNOCCC Amb28077176 [0,0,0,0,0,0|1,1,2]=4 16 B7R0.1 C=CCOCCCC Amb3940494 [0,0,0,0,0,0|1,1,2]=4 17 B7R0.1 C=CCSCCCBr Amb27228626 [0,0,0,0,0,0|2,0,2]=4 18 B7R0.1 C=CCSCCCN Amb17500693 [0,0,0,0,0,0|2,0,2]=4 19 B7R0.1 C=CCSCCCS Amb28293414 [0,0,0,0,0,0|2,0,2]=4 20 B7R0.1 C=CCSCCNC Amb27594788 [0,0,0,0,0,0|2,0,2]=4 21 B7R0.1 C=CCSCCOC Amb17799422 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.1 C=CCSCCSC Amb27594231 [0,0,0,0,0,0|2,0,2]=4 23 B7R0.1 C=CCSSCC=C Amb8393146 [0,0,0,0,0,0|0,0,4]=4 24 B7R0.1 C=CCSSCCC Amb8393142 [0,0,0,0,0,0|0,0,2]=2 25 B7R0.1 C=CC\C=C\CCC Amb4035888 [0,0,0,0,0,0|2,0,2]=4 26 B7R0.1 CC#CCCCCC Amb9134714 [0,0,0,0,0,0|2,0,2]=4 27 B7R0.1 CC#CCSCCN Amb27482457 [0,0,0,0,0,0|2,0,2]=4 28 B7R0.1 CC=C=CCCCC Amb28284500 [0,0,0,0,0,0|2,0,2]=4 29 B7R0.1 CCC#CC#CCC Amb17673895 [0,0,0,0,0,0|2,0,2]=4 30 B7R0.1 CCC#CCCCBr Amb24443559 [0,0,0,0,0,0|3,0,1]=4 31 B7R0.1 CCC#CCCCC Amb4017968 [0,0,0,0,0,0|2,0,1]=3 32 B7R0.1 CCC#CCCCCl Amb28188357 [0,0,0,0,0,0|3,0,1]=4 33 B7R0.1 CCC#CCCCN Amb27838381 [0,0,0,0,0,0|3,0,1]=4 34 B7R0.1 CCC#CCCNC Amb27838421 [0,0,0,0,0,0|3,0,1]=4 35 B7R0.1 CCC#CSCCCl Amb27597938 [0,0,0,0,0,0|2,0,1]=3 36 B7R0.1 CCCC#CCCC Amb8514642 [0,0,0,0,0,0|2,0,0]=2 37 B7R0.1 CCCC#CCCO Amb2721487 [0,0,0,0,0,0|3,0,0]=3 38 B7R0.1 CCCC#CCNC Amb27815061 [0,0,0,0,0,0|3,0,0]=3 39 B7R0.1 CCCC=C=CCN Amb27838307 [0,0,0,0,0,0|3,0,1]=4 40 B7R0.1 CCCCC#CCBr Amb17670640 [0,0,0,0,0,0|3,0,1]=4 41 B7R0.1 CCCCCCC#N Amb7764659 [0,0,0,0,0,0|3,0,1]=4 42 B7R0.1 CCCCCCC=O Amb3939948 [0,0,0,0,0,0|3,0,1]=4 43 B7R0.1 CCCCCCCBr Amb3941482 [0,0,0,0,0,0|3,0,0]=3 44 B7R0.1 CCCCCCCC Amb8513274 [0,0,0,0,0,0|2,0,0]=2 45 B7R0.1 CCCCCCCCl Amb6608669 [0,0,0,0,0,0|3,0,0]=3 46 B7R0.1 CCCCCCCI Amb3940283 [0,0,0,0,0,0|3,0,0]=3 47 B7R0.1 CCCCCCCN Amb3940125 [0,0,0,0,0,0|3,0,0]=3 48 B7R0.1 CCCCCCCO Amb6608791 [0,0,0,0,0,0|3,0,0]=3 49 B7R0.1 CCCCCCC[Mg+] Amb22351260 [0,0,0,0,0,0|3,0,0]=3 50 B7R0.1 CCCCCCNC Amb4037010 [0,0,0,0,0,0|3,0,0]=3 51 B7R0.1 CCCCCCNN Amb7786617 [0,0,0,0,0,0|4,0,0]=4 52 B7R0.1 CCCCCCNO Amb24591654 [0,0,0,0,0,0|4,0,0]=4 53 B7R0.1 CCCCCCNO Amb32687464 [0,0,0,0,0,0|4,0,0]=4 54 B7R0.1 CCCCCCON Amb18641933 [0,0,0,0,0,0|4,0,0]=4 55 B7R0.1 CCCCCCSC Amb22359692 [0,0,0,0,0,0|3,0,0]=3 56 B7R0.1 CCCCCC[Mg]Br Amb22337740 [0,0,0,0,0,0|4,0,0]=4 57 B7R0.1 CCCCCC[Mg]Cl Amb22337541 [0,0,0,0,0,0|4,0,0]=4 58 B7R0.1 CCCCCNCC Amb6243353 [0,0,0,0,0,0|3,0,0]=3 59 B7R0.1 CCCCCNCN Amb28388761 [0,0,0,0,0,0|4,0,0]=4 60 B7R0.1 CCCCCNCO Amb28133981 [0,0,0,0,0,0|4,0,0]=4 61 B7R0.1 CCCCCOCC Amb22733705 [0,0,0,0,0,0|3,0,0]=3 62 B7R0.1 CCCCCSSC Amb25679654 [0,0,0,0,0,0|4,0,0]=4 63 B7R0.1 CCCCNCC#N Amb3997177 [0,0,0,0,0,0|3,0,1]=4 64 B7R0.1 CCCCNCCC Amb3939261 [0,0,0,0,0,0|2,0,0]=2 65 B7R0.1 CCCCNCCF Amb27597327 [0,0,0,0,0,0|3,0,0]=3 66 B7R0.1 CCCCNCCN Amb4020675 [0,0,0,0,0,0|3,0,0]=3 67 B7R0.1 CCCCNCCO Amb2685641 [0,0,0,0,0,0|3,0,0]=3 68 B7R0.1 CCCCNCCS Amb22232390 [0,0,0,0,0,0|3,0,0]=3 69 B7R0.1 CCCCOCC=O Amb26515709 [0,0,0,0,0,0|2,1,1]=4 70 B7R0.1 CCCCOCCBr Amb2720768 [0,0,0,0,0,0|2,1,0]=3 71 B7R0.1 CCCCOCCCl Amb8873731 [0,0,0,0,0,0|2,1,0]=3 72 B7R0.1 CCCCOCCI Amb24474438 [0,0,0,0,0,0|2,1,0]=3 73 B7R0.1 CCCCOCCN Amb8895131 [0,0,0,0,0,0|2,1,0]=3 74 B7R0.1 CCCCOCCO Amb3939290 [0,0,0,0,0,0|2,1,0]=3 75 B7R0.1 CCCCPCCN Amb27831609 [0,0,0,0,0,0|3,0,0]=3 76 B7R0.1 CCCCSCC#N Amb6760935 [0,0,0,0,0,0|2,0,1]=3 77 B7R0.1 CCCCSCC=O Amb28189740 [0,0,0,0,0,0|2,0,1]=3 78 B7R0.1 CCCCSCCC Amb4017586 [0,0,0,0,0,0|1,0,0]=1 79 B7R0.1 CCCCSCCCl Amb9479748 [0,0,0,0,0,0|2,0,0]=2 80 B7R0.1 CCCCSCCN Amb2209242 [0,0,0,0,0,0|2,0,0]=2 81 B7R0.1 CCCCSCCO Amb1032995 [0,0,0,0,0,0|2,0,0]=2 82 B7R0.1 CCCCSSCC Amb26515761 [0,0,0,0,0,0|2,0,0]=2 83 B7R0.1 CCCCS\C=C/Cl Amb28048891 [0,0,0,0,0,0|2,0,2]=4 84 B7R0.1 CCCC\C=C\CN Amb25175053 [0,0,0,0,0,0|3,0,1]=4 85 B7R0.1 CCCC\C=C\CO Amb8514979 [0,0,0,0,0,0|3,0,1]=4 86 B7R0.1 CCCC\C=N\OC Amb27969362 [0,0,0,0,0,0|4,0,0]=4 87 B7R0.1 CCCC\N=C\CCl Amb28141548 [0,0,0,0,0,0|3,0,1]=4 88 B7R0.1 CCCNCCC#N Amb2690405 [0,0,0,0,0,0|3,0,1]=4 89 B7R0.1 CCCNCCC=O Amb27838403 [0,0,0,0,0,0|3,0,1]=4 90 B7R0.1 CCCNCCCCl Amb27593175 [0,0,0,0,0,0|3,0,0]=3 91 B7R0.1 CCCNCCCN Amb8515464 [0,0,0,0,0,0|3,0,0]=3 92 B7R0.1 CCCNCCCO Amb6733725 [0,0,0,0,0,0|3,0,0]=3 93 B7R0.1 CCCNCCSC Amb27162672 [0,0,0,0,0,0|3,0,0]=3 94 B7R0.1 CCCNNCCC Amb27818086 [0,0,0,0,0,0|2,0,0]=2 95 B7R0.1 CCCNOCCC Amb27792152 [0,0,0,0,0,0|1,1,0]=2 96 B7R0.1 CCCNOCCO Amb28139467 [0,0,0,0,0,0|2,1,0]=3 97 B7R0.1 CCCOCCCBr Amb8874784 [0,0,0,0,0,0|2,1,0]=3 98 B7R0.1 CCCOCCCCl Amb8874785 [0,0,0,0,0,0|2,1,0]=3 99 B7R0.1 CCCOCCCN Amb3940017 [0,0,0,0,0,0|2,1,0]=3 100 B7R0.1 CCCOCCCO Amb19962968 [0,0,0,0,0,0|2,1,0]=3 101 B7R0.1 CCCOCCCS Amb27212962 [0,0,0,0,0,0|2,1,0]=3 102 B7R0.1 CCCONCCN Amb27838359 [0,0,0,0,0,0|2,1,0]=3 103 B7R0.1 CCCONCCO Amb27455527 [0,0,0,0,0,0|2,1,0]=3 104 B7R0.1 CCCSC#CCO Amb27835121 [0,0,0,0,0,0|2,0,1]=3 105 B7R0.1 CCCSCCC#N Amb6680722 [0,0,0,0,0,0|2,0,1]=3 106 B7R0.1 CCCSCCCN Amb6680225 [0,0,0,0,0,0|2,0,0]=2 107 B7R0.1 CCCSCCCO Amb9370793 [0,0,0,0,0,0|2,0,0]=2 108 B7R0.1 CCCSCCON Amb27262198 [0,0,0,0,0,0|3,0,0]=3 109 B7R0.1 CCCSCCSC Amb27837913 [0,0,0,0,0,0|2,0,0]=2 110 B7R0.1 CCCSSCCO Amb27185480 [0,0,0,0,0,0|1,0,0]=1 111 B7R0.1 CCCSSSCC Amb26415260 [0,0,0,0,0,0|1,0,0]=1 112 B7R0.1 CCC[SiH2]CCCCl Amb28208530 [0,0,0,0,0,0|3,0,0]=3 113 B7R0.1 CCC\C=C/CCC Amb27838401 [0,0,0,0,0,0|2,0,0]=2 114 B7R0.1 CCC\C=C/CCO Amb22052625 [0,0,0,0,0,0|3,0,0]=3 115 B7R0.1 CCC\C=C\CC#N Amb33172503 [0,0,0,0,0,0|3,0,1]=4 116 B7R0.1 CCC\C=C\CC=O Amb32954538 [0,0,0,0,0,0|3,0,1]=4 117 B7R0.1 CCC\C=C\CCBr Amb33242599 [0,0,0,0,0,0|3,0,0]=3 118 B7R0.1 CCC\C=C\CCC Amb9134769 [0,0,0,0,0,0|2,0,0]=2 119 B7R0.1 CCC\C=C\CCCl Amb32686957 [0,0,0,0,0,0|3,0,0]=3 120 B7R0.1 CCC\C=C\CCN Amb25221747 [0,0,0,0,0,0|3,0,0]=3 121 B7R0.1 CCC\C=C\CCO Amb22730273 [0,0,0,0,0,0|3,0,0]=3 122 B7R0.1 CCC\C=C\CCS Amb33373718 [0,0,0,0,0,0|3,0,0]=3 123 B7R0.1 CCC\C=C\CNC Amb33172653 [0,0,0,0,0,0|3,0,0]=3 124 B7R0.1 CCC\C=C\CNN Amb33425693 [0,0,0,0,0,0|4,0,0]=4 125 B7R0.1 CCC\C=C\CNO Amb33327497 [0,0,0,0,0,0|4,0,0]=4 126 B7R0.1 CCC\C=C\CON Amb33424912 [0,0,0,0,0,0|4,0,0]=4 127 B7R0.1 CCC\C=C\OCC Amb25074036 [0,0,0,0,0,0|3,0,0]=3 128 B7R0.1 CCC\C=N\CCO Amb28207113 [0,0,0,0,0,0|3,0,0]=3 129 B7R0.1 CCC\C=N\OCC Amb27880086 [0,0,0,0,0,0|3,0,0]=3 130 B7R0.1 CCNCCCCO Amb3940019 [0,0,0,0,0,0|4,0,0]=4 131 B7R0.1 CCNCCCOC Amb6730311 [0,0,0,0,0,0|4,0,0]=4 132 B7R0.1 CCNCCNCC Amb9885560 [0,0,0,0,0,0|4,0,0]=4 133 B7R0.1 CCNCCOCC Amb33529222 [0,0,0,0,0,0|4,0,0]=4 134 B7R0.1 CCNOCCOC Amb28315578 [0,0,0,0,0,0|3,1,0]=4 135 B7R0.1 CCOCCCCBr Amb8855444 [0,0,0,0,0,0|4,0,0]=4 136 B7R0.1 CCOCCCCCl Amb20242741 [0,0,0,0,0,0|4,0,0]=4 137 B7R0.1 CCOCCCCN Amb6249686 [0,0,0,0,0,0|4,0,0]=4 138 B7R0.1 CCOCCCCO Amb19148112 [0,0,0,0,0,0|4,0,0]=4 139 B7R0.1 CCOCCOCC Amb8517552 [0,0,0,0,0,0|4,0,0]=4 140 B7R0.1 CCONCCCN Amb27244679 [0,0,0,0,0,0|4,0,0]=4 141 B7R0.1 CCONCCCO Amb28319900 [0,0,0,0,0,0|4,0,0]=4 142 B7R0.1 CCO\C=C/OCC Amb30621788 [0,0,0,0,0,0|4,0,0]=4 143 B7R0.1 CCO\C=C\CCO Amb28189265 [0,0,0,0,0,0|4,0,0]=4 144 B7R0.1 CCO\C=C\OCC Amb30621723 [0,0,0,0,0,0|4,0,0]=4 145 B7R0.1 CCSCCCCBr Amb9304999 [0,0,0,0,0,0|4,0,0]=4 146 B7R0.1 CCSCCCCCl Amb18796695 [0,0,0,0,0,0|4,0,0]=4 147 B7R0.1 CCSCCCCN Amb9391471 [0,0,0,0,0,0|4,0,0]=4 148 B7R0.1 CCSCCCCO Amb9370799 [0,0,0,0,0,0|4,0,0]=4 149 B7R0.1 CCSCCCCS Amb27223548 [0,0,0,0,0,0|4,0,0]=4 150 B7R0.1 CCSCCCNC Amb25044529 [0,0,0,0,0,0|4,0,0]=4 151 B7R0.1 CCSCCSCC Amb4017493 [0,0,0,0,0,0|4,0,0]=4 152 B7R0.1 CCSCSCCCl Amb27645434 [0,0,0,0,0,0|3,0,0]=3 153 B7R0.1 CCSSSSCC Amb26635324 [0,0,0,0,0,0|2,0,0]=2 154 B7R0.1 CC\C=C/CCCO Amb22053865 [0,0,0,0,0,0|3,0,1]=4 155 B7R0.1 CC\C=C\CCCBr Amb27232700 [0,0,0,0,0,0|3,0,1]=4 156 B7R0.1 CC\C=C\CCCC Amb19930202 [0,0,0,0,0,0|2,0,1]=3 157 B7R0.1 CC\C=C\CCCCl Amb28410595 [0,0,0,0,0,0|3,0,1]=4 158 B7R0.1 CC\C=C\CCCN Amb33474692 [0,0,0,0,0,0|3,0,1]=4 159 B7R0.1 CC\C=C\CCCO Amb33172698 [0,0,0,0,0,0|3,0,1]=4 160 B7R0.1 CC\C=C\CCCS Amb32882557 [0,0,0,0,0,0|3,0,1]=4 161 B7R0.1 CC\C=C\CCNC Amb32953435 [0,0,0,0,0,0|3,0,1]=4 162 B7R0.1 CC\C=C\CCSC Amb27397344 [0,0,0,0,0,0|3,0,1]=4 163 B7R0.1 CC\C=N\CCCC Amb27946052 [0,0,0,0,0,0|2,0,1]=3 164 B7R0.1 CC\C=N\OCCCl Amb27770489 [0,0,0,0,0,0|2,1,1]=4 165 B7R0.1 CNCC#CCCN Amb27839104 [0,0,0,0,0,0|4,0,0]=4 166 B7R0.1 CNCC#CCCO Amb26509827 [0,0,0,0,0,0|4,0,0]=4 167 B7R0.1 CNCC#CCNC Amb27838414 [0,0,0,0,0,0|4,0,0]=4 168 B7R0.1 CNCCCCCF Amb27595210 [0,0,0,0,0,0|4,0,0]=4 169 B7R0.1 CNCCCCCI Amb27953747 [0,0,0,0,0,0|4,0,0]=4 170 B7R0.1 CNCCCCCN Amb23448496 [0,0,0,0,0,0|4,0,0]=4 171 B7R0.1 CNCCCCCO Amb17334069 [0,0,0,0,0,0|4,0,0]=4 172 B7R0.1 CNCCCCCO Amb33551687 [0,0,0,0,0,0|4,0,0]=4 173 B7R0.1 CNCCCCNC Amb19374448 [0,0,0,0,0,0|4,0,0]=4 174 B7R0.1 CNCCCCOC Amb17569912 [0,0,0,0,0,0|4,0,0]=4 175 B7R0.1 CNCCCCSC Amb27433707 [0,0,0,0,0,0|4,0,0]=4 176 B7R0.1 CNCCNCCN Amb18641939 [0,0,0,0,0,0|4,0,0]=4 177 B7R0.1 CNCCNCCO Amb4020109 [0,0,0,0,0,0|4,0,0]=4 178 B7R0.1 CNCCNCCS Amb27424661 [0,0,0,0,0,0|4,0,0]=4 179 B7R0.1 CNCCOCCCl Amb25708208 [0,0,0,0,0,0|3,1,0]=4 180 B7R0.1 CNCCOCCCl Amb32659597 [0,0,0,0,0,0|3,1,0]=4 181 B7R0.1 CNCCOCCN Amb27246939 [0,0,0,0,0,0|3,1,0]=4 182 B7R0.1 CNCCOCCO Amb33536922 [0,0,0,0,0,0|3,1,0]=4 183 B7R0.1 CNCCSCC#N Amb27669176 [0,0,0,0,0,0|3,0,1]=4 184 B7R0.1 CNCCSCCO Amb27475549 [0,0,0,0,0,0|3,0,0]=3 185 B7R0.1 CNC\C=C\CNC Amb27838371 [0,0,0,0,0,0|4,0,0]=4 186 B7R0.1 COCC#CCCO Amb28069664 [0,0,0,0,0,0|4,0,0]=4 187 B7R0.1 COCC#CCOC Amb17670742 [0,0,0,0,0,0|4,0,0]=4 188 B7R0.1 COCCCCCBr Amb18182548 [0,0,0,0,0,0|4,0,0]=4 189 B7R0.1 COCCCCCCl Amb9001649 [0,0,0,0,0,0|4,0,0]=4 190 B7R0.1 COCCCCCI Amb27603403 [0,0,0,0,0,0|4,0,0]=4 191 B7R0.1 COCCCCCN Amb13951647 [0,0,0,0,0,0|4,0,0]=4 192 B7R0.1 COCCCCCO Amb19374978 [0,0,0,0,0,0|4,0,0]=4 193 B7R0.1 COCCCCCS Amb25138209 [0,0,0,0,0,0|4,0,0]=4 194 B7R0.1 COCCCCOC Amb6296783 [0,0,0,0,0,0|4,0,0]=4 195 B7R0.1 COCCCCSC Amb28193488 [0,0,0,0,0,0|4,0,0]=4 196 B7R0.1 COCCNCCF Amb25677392 [0,0,0,0,0,0|4,0,0]=4 197 B7R0.1 COCCNCCF Amb33552357 [0,0,0,0,0,0|4,0,0]=4 198 B7R0.1 COCCNCCN Amb17091020 [0,0,0,0,0,0|4,0,0]=4 199 B7R0.1 COCCNCCN Amb30585091 [0,0,0,0,0,0|4,0,0]=4 200 B7R0.1 COCCNCCO Amb3939014 [0,0,0,0,0,0|4,0,0]=4 201 B7R0.1 COCCNCCS Amb27405418 [0,0,0,0,0,0|4,0,0]=4 202 B7R0.1 COCCOCCBr Amb3938999 [0,0,0,0,0,0|3,1,0]=4 203 B7R0.1 COCCOCCCl Amb9209785 [0,0,0,0,0,0|3,1,0]=4 204 B7R0.1 COCCOCCI Amb22497515 [0,0,0,0,0,0|3,1,0]=4 205 B7R0.1 COCCOCCN Amb6244884 [0,0,0,0,0,0|3,1,0]=4 206 B7R0.1 COCCOCCN Amb7969459 [0,0,0,0,0,0|3,1,0]=4 207 B7R0.1 COCCOCCO Amb4605829 [0,0,0,0,0,0|3,1,0]=4 208 B7R0.1 COCCOCCS Amb9787645 [0,0,0,0,0,0|3,1,0]=4 209 B7R0.1 COCCSCCF Amb28142604 [0,0,0,0,0,0|3,0,0]=3 210 B7R0.1 COCCSCCO Amb9273918 [0,0,0,0,0,0|3,0,0]=3 211 B7R0.1 COCCSCOC Amb27883297 [0,0,0,0,0,0|3,0,0]=3 212 B7R0.1 COCOCCCBr Amb28385749 [0,0,0,0,0,0|3,1,0]=4 213 B7R0.1 COCOCCCCl Amb27194584 [0,0,0,0,0,0|3,1,0]=4 214 B7R0.1 COCOCCCN Amb25989339 [0,0,0,0,0,0|3,1,0]=4 215 B7R0.1 COCOCCCO Amb23591016 [0,0,0,0,0,0|3,1,0]=4 216 B7R0.1 COC\C=C\COC Amb22231654 [0,0,0,0,0,0|4,0,0]=4 217 B7R0.1 CSCCCCCBr Amb25052398 [0,0,0,0,0,0|4,0,0]=4 218 B7R0.1 CSCCCCCCl Amb18179464 [0,0,0,0,0,0|4,0,0]=4 219 B7R0.1 CSCCCCCF Amb28049310 [0,0,0,0,0,0|4,0,0]=4 220 B7R0.1 CSCCCCCN Amb24271082 [0,0,0,0,0,0|4,0,0]=4 221 B7R0.1 CSCCCCCO Amb24271084 [0,0,0,0,0,0|4,0,0]=4 222 B7R0.1 CSCCCCCS Amb24633807 [0,0,0,0,0,0|4,0,0]=4 223 B7R0.1 CSCCNCCBr Amb27833219 [0,0,0,0,0,0|4,0,0]=4 224 B7R0.1 CSCCNCCCl Amb27870606 [0,0,0,0,0,0|4,0,0]=4 225 B7R0.1 CSCCOCCBr Amb28321116 [0,0,0,0,0,0|3,1,0]=4 226 B7R0.1 CSCCOCCN Amb17501991 [0,0,0,0,0,0|3,1,0]=4 227 B7R0.1 CSCCOCCO Amb28368979 [0,0,0,0,0,0|3,1,0]=4 228 B7R0.1 CSCOCCCBr Amb27477765 [0,0,0,0,0,0|3,1,0]=4 229 B7R0.1 C\C=C/CCCCC Amb4035902 [0,0,0,0,0,0|2,0,2]=4 230 B7R0.1 C\C=C\C=C\CCC Amb27493119 [0,0,0,0,0,0|2,0,2]=4 231 B7R0.1 C\C=C\CCCCC Amb8513437 [0,0,0,0,0,0|2,0,2]=4 232 B7R0.1 C\C=C\CNCCC Amb28127654 [0,0,0,0,0,0|2,0,2]=4 233 B7R0.1 C\C=C\CSCCO Amb9362982 [0,0,0,0,0,0|2,0,2]=4 234 B7R0.1 C\C=C\SSCCC Amb25865705 [0,0,0,0,0,0|0,0,2]=2 235 B7R0.1 ClCCCCCCBr Amb10602445 [0,0,0,0,0,0|4,0,0]=4 236 B7R0.1 ClCCCCCCCl Amb8513108 [0,0,0,0,0,0|4,0,0]=4 237 B7R0.1 ClCCCCCCI Amb20670134 [0,0,0,0,0,0|4,0,0]=4 238 B7R0.1 ClCCCNCCCl Amb13952668 [0,0,0,0,0,0|4,0,0]=4 239 B7R0.1 ClCCCNCCCl Amb18125911 [0,0,0,0,0,0|4,0,0]=4 240 B7R0.1 ClCCCSCCCl Amb24426165 [0,0,0,0,0,0|3,0,0]=3 241 B7R0.1 ClCCSSCCCl Amb27232729 [0,0,0,0,0,0|2,0,0]=2 242 B7R0.1 ClCC\C=C\CCCl Amb24481434 [0,0,0,0,0,0|4,0,0]=4 243 B7R0.1 FCCCCCCCl Amb27817669 [0,0,0,0,0,0|4,0,0]=4 244 B7R0.1 FCCCCCCI Amb25080138 [0,0,0,0,0,0|4,0,0]=4 245 B7R0.1 FCCCCCCS Amb24569228 [0,0,0,0,0,0|4,0,0]=4 246 B7R0.1 FCCNCCCCl Amb27233248 [0,0,0,0,0,0|4,0,0]=4 247 B7R0.1 FCCSCCCCl Amb27172909 [0,0,0,0,0,0|3,0,0]=3 248 B7R0.1 ICCCCCCI Amb8514815 [0,0,0,0,0,0|4,0,0]=4 249 B7R0.1 ICCSSCCI Amb33352021 [0,0,0,0,0,0|2,0,0]=2 250 B7R0.1 N#CCCSCCO Amb3939502 [0,0,0,0,0,0|3,0,1]=4 251 B7R0.1 N#CCSCCCCl Amb20623081 [0,0,0,0,0,0|3,0,1]=4 252 B7R0.1 N#CCSCCCN Amb17500697 [0,0,0,0,0,0|3,0,1]=4 253 B7R0.1 NCCC#CCCO Amb27229366 [0,0,0,0,0,0|4,0,0]=4 254 B7R0.1 NCCCCCCBr Amb18648322 [0,0,0,0,0,0|4,0,0]=4 255 B7R0.1 NCCCCCCCl Amb31030966 [0,0,0,0,0,0|4,0,0]=4 256 B7R0.1 NCCCCCCF Amb28314228 [0,0,0,0,0,0|4,0,0]=4 257 B7R0.1 NCCCCCCN Amb2573303 [0,0,0,0,0,0|4,0,0]=4 258 B7R0.1 NCCCCCCN Amb8516658 [0,0,0,0,0,0|4,0,0]=4 259 B7R0.1 NCCCCCCO Amb2720515 [0,0,0,0,0,0|4,0,0]=4 260 B7R0.1 NCCCCCCS Amb18642745 [0,0,0,0,0,0|4,0,0]=4 261 B7R0.1 NCCCCCCS Amb24099361 [0,0,0,0,0,0|4,0,0]=4 262 B7R0.1 NCCCNCCBr Amb26319089 [0,0,0,0,0,0|4,0,0]=4 263 B7R0.1 NCCCNCCBr Amb8391138 [0,0,0,0,0,0|4,0,0]=4 264 B7R0.1 NCCCNCCF Amb28076267 [0,0,0,0,0,0|4,0,0]=4 265 B7R0.1 NCCCNCCN Amb2725582 [0,0,0,0,0,0|4,0,0]=4 266 B7R0.1 NCCCNCCO Amb4035734 [0,0,0,0,0,0|4,0,0]=4 267 B7R0.1 NCCCNCCS Amb17607860 [0,0,0,0,0,0|4,0,0]=4 268 B7R0.1 NCCCOCCCl Amb27199285 [0,0,0,0,0,0|3,1,0]=4 269 B7R0.1 NCCCOCCF Amb27169291 [0,0,0,0,0,0|3,1,0]=4 270 B7R0.1 NCCCOCCF Amb33299411 [0,0,0,0,0,0|3,1,0]=4 271 B7R0.1 NCCCOCCO Amb33534338 [0,0,0,0,0,0|3,1,0]=4 272 B7R0.1 NCCCSCCO Amb9481738 [0,0,0,0,0,0|3,0,0]=3 273 B7R0.1 NCCNCCCCl Amb27429827 [0,0,0,0,0,0|4,0,0]=4 274 B7R0.1 NCCNCCCO Amb22732348 [0,0,0,0,0,0|4,0,0]=4 275 B7R0.1 NCCOCCCBr Amb33804025 [0,0,0,0,0,0|3,1,0]=4 276 B7R0.1 NCCOCCCBr Amb33804759 [0,0,0,0,0,0|3,1,0]=4 277 B7R0.1 NCCOCCCCl Amb33803399 [0,0,0,0,0,0|3,1,0]=4 278 B7R0.1 NCCOCCCCl Amb33804230 [0,0,0,0,0,0|3,1,0]=4 279 B7R0.1 NCCOCCCO Amb33551903 [0,0,0,0,0,0|3,1,0]=4 280 B7R0.1 NCCOCCCO Amb9392883 [0,0,0,0,0,0|3,1,0]=4 281 B7R0.1 NCCSCCCF Amb28284467 [0,0,0,0,0,0|3,0,0]=3 282 B7R0.1 NCCSCCCO Amb8876329 [0,0,0,0,0,0|3,0,0]=3 283 B7R0.1 NCCSSCCN Amb22492440 [0,0,0,0,0,0|2,0,0]=2 284 B7R0.1 NCCSSCCN Amb2720039 [0,0,0,0,0,0|2,0,0]=2 285 B7R0.1 NCCSSCCN Amb33716969 [0,0,0,0,0,0|2,0,0]=2 286 B7R0.1 NCCSSCCN Amb534126 [0,0,0,0,0,0|2,0,0]=2 287 B7R0.1 NCCSSCCN Amb9825357 [0,0,0,0,0,0|2,0,0]=2 288 B7R0.1 NCC[Se][Se]CCN Amb31292471 [0,0,0,0,0,0|2,2,0]=4 289 B7R0.1 NOCCSCCO Amb27198425 [0,0,0,0,0,0|4,0,0]=4 290 B7R0.1 O=CCSCCCO Amb27871143 [0,0,0,0,0,0|3,0,1]=4 291 B7R0.1 O=CCSSCC=O Amb27169089 [0,0,0,0,0,0|2,0,2]=4 292 B7R0.1 OCCC#CCCO Amb2721707 [0,0,0,0,0,0|4,0,0]=4 293 B7R0.1 OCCCCCCBr Amb24063183 [0,0,0,0,0,0|4,0,0]=4 294 B7R0.1 OCCCCCCBr Amb8514955 [0,0,0,0,0,0|4,0,0]=4 295 B7R0.1 OCCCCCCCl Amb2686112 [0,0,0,0,0,0|4,0,0]=4 296 B7R0.1 OCCCCCCF Amb24428671 [0,0,0,0,0,0|4,0,0]=4 297 B7R0.1 OCCCCCCI Amb28048917 [0,0,0,0,0,0|4,0,0]=4 298 B7R0.1 OCCCCCCO Amb6869970 [0,0,0,0,0,0|4,0,0]=4 299 B7R0.1 OCCCCCCS Amb9786744 [0,0,0,0,0,0|4,0,0]=4 300 B7R0.1 OCCCNCCCl Amb27599845 [0,0,0,0,0,0|4,0,0]=4 301 B7R0.1 OCCCNCCO Amb4034437 [0,0,0,0,0,0|4,0,0]=4 302 B7R0.1 OCCCOCCCl Amb28194887 [0,0,0,0,0,0|3,1,0]=4 303 B7R0.1 OCCCSCCO Amb33531539 [0,0,0,0,0,0|3,0,0]=3 304 B7R0.1 OCCNCCCCl Amb27655296 [0,0,0,0,0,0|4,0,0]=4 305 B7R0.1 OCCOCCCCl Amb28128414 [0,0,0,0,0,0|3,1,0]=4 306 B7R0.1 OCCOCCCF Amb22008105 [0,0,0,0,0,0|3,1,0]=4 307 B7R0.1 OCCSSCCO Amb8513773 [0,0,0,0,0,0|2,0,0]=2 308 B7R0.1 OCC\C=C/CCCl Amb27424782 [0,0,0,0,0,0|4,0,0]=4 309 B7R0.1 OCC\C=C\CCO Amb17614949 [0,0,0,0,0,0|4,0,0]=4 310 B7R0.1 SCCCSCCS Amb27656809 [0,0,0,0,0,0|3,0,0]=3 311 B7R0.1 [C-]#[N+]CCCCCC Amb2235425 [0,0,0,0,0,0|3,0,1]=4 312 B7R0.1 [C-]#[N+]CCOCCC Amb1981102 [0,0,0,0,0,0|2,1,1]=4 313 B7R0.1 [C-]#[N+]C\C=C\CCC Amb33327126 [0,0,0,0,0,0|3,0,1]=4 314 B6R0.6 BrCCCCCBr Amb6608668 [1,0,0,0,0,0|3,0,0]=4 315 B6R0.6 BrCCNCCBr Amb19869481 [1,0,0,0,0,0|3,0,0]=4 316 B6R0.6 BrCCOCCBr Amb2684741 [1,0,0,0,0,0|2,1,0]=4 317 B6R0.6 BrCCSCCBr Amb28468000 [1,0,0,0,0,0|2,0,0]=3 318 B6R0.6 BrCC[NH2+]CCBr Amb22166796 [1,0,0,0,0,0|3,0,0]=4 319 B6R0.6 C#CCCCCC Amb6297206 [1,0,0,0,0,0|1,0,2]=4 320 B6R0.6 C#CCCSCC Amb24670860 [1,0,0,0,0,0|1,0,2]=4 321 B6R0.6 C#CCNCCC Amb10610181 [1,0,0,0,0,0|1,0,2]=4 322 B6R0.6 C#CCNCCC Amb5262802 [1,0,0,0,0,0|1,0,2]=4 323 B6R0.6 C#CCSCCBr Amb28191261 [1,0,0,0,0,0|1,0,2]=4 324 B6R0.6 C#CCSCCN Amb33548267 [1,0,0,0,0,0|1,0,2]=4 325 B6R0.6 C#CCSCCN Amb6263724 [1,0,0,0,0,0|1,0,2]=4 326 B6R0.6 C#CCSCCO Amb33531540 [1,0,0,0,0,0|1,0,2]=4 327 B6R0.6 C=CCCCCC Amb3940498 [1,0,0,0,0,0|1,0,2]=4 328 B6R0.6 C=CCCSCC Amb27213772 [1,0,0,0,0,0|1,0,2]=4 329 B6R0.6 C=CCNCCC Amb22587187 [1,0,0,0,0,0|1,0,2]=4 330 B6R0.6 C=CCNCCC Amb6683949 [1,0,0,0,0,0|1,0,2]=4 331 B6R0.6 C=CCOCCC Amb3940491 [1,0,0,0,0,0|0,1,2]=4 332 B6R0.6 C=CCSCCCl Amb28042684 [1,0,0,0,0,0|1,0,2]=4 333 B6R0.6 C=CCSCCN Amb13951462 [1,0,0,0,0,0|1,0,2]=4 334 B6R0.6 C=CCSCCN Amb6273787 [1,0,0,0,0,0|1,0,2]=4 335 B6R0.6 CCC#CCCBr Amb24712364 [1,0,0,0,0,0|2,0,1]=4 336 B6R0.6 CCC#CCCC Amb9134713 [1,0,0,0,0,0|1,0,1]=3 337 B6R0.6 CCC#CCCCl Amb25147478 [1,0,0,0,0,0|2,0,1]=4 338 B6R0.6 CCC#CCCI Amb24636544 [1,0,0,0,0,0|2,0,1]=4 339 B6R0.6 CCC#CCCN Amb26415259 [1,0,0,0,0,0|2,0,1]=4 340 B6R0.6 CCC#CCCO Amb8514641 [1,0,0,0,0,0|2,0,1]=4 341 B6R0.6 CCC#COCC Amb6336486 [1,0,0,0,0,0|1,1,1]=4 342 B6R0.6 CCCC#CCBr Amb25061301 [1,0,0,0,0,0|2,0,1]=4 343 B6R0.6 CCCC#CCN Amb17593063 [1,0,0,0,0,0|2,0,1]=4 344 B6R0.6 CCCCBOC Amb22728871 [1,0,0,0,0,0|3,0,0]=4 345 B6R0.6 CCCCCC#N Amb6250301 [1,0,0,0,0,0|2,0,1]=4 346 B6R0.6 CCCCCC=O Amb3939522 [1,0,0,0,0,0|2,0,1]=4 347 B6R0.6 CCCCCCBr Amb3940085 [1,0,0,0,0,0|2,0,0]=3 348 B6R0.6 CCCCCCC Amb8513177 [1,0,0,0,0,0|1,0,0]=2 349 B6R0.6 CCCCCCCl Amb7764628 [1,0,0,0,0,0|2,0,0]=3 350 B6R0.6 CCCCCCF Amb8516643 [1,0,0,0,0,0|2,0,0]=3 351 B6R0.6 CCCCCCI Amb6608700 [1,0,0,0,0,0|2,0,0]=3 352 B6R0.6 CCCCCCN Amb2721179 [1,0,0,0,0,0|2,0,0]=3 353 B6R0.6 CCCCCCN Amb3940465 [1,0,0,0,0,0|2,0,0]=3 354 B6R0.6 CCCCCCO Amb3941500 [1,0,0,0,0,0|2,0,0]=3 355 B6R0.6 CCCCCCS Amb8514502 [1,0,0,0,0,0|2,0,0]=3 356 B6R0.6 CCCCCC[SiH3] Amb19893900 [1,0,0,0,0,0|1,1,0]=3 357 B6R0.6 CCCCCNC Amb3939381 [1,0,0,0,0,0|2,0,0]=3 358 B6R0.6 CCCCCNN Amb32693399 [1,0,0,0,0,0|3,0,0]=4 359 B6R0.6 CCCCCNN Amb6249376 [1,0,0,0,0,0|3,0,0]=4 360 B6R0.6 CCCCCNO Amb25067859 [1,0,0,0,0,0|3,0,0]=4 361 B6R0.6 CCCCCOC Amb9787609 [1,0,0,0,0,0|2,0,0]=3 362 B6R0.6 CCCCCON Amb18122095 [1,0,0,0,0,0|3,0,0]=4 363 B6R0.6 CCCCCSC Amb21618865 [1,0,0,0,0,0|2,0,0]=3 364 B6R0.6 CCCCNCC Amb3939842 [1,0,0,0,0,0|2,0,0]=3 365 B6R0.6 CCCCNOC Amb24479420 [1,0,0,0,0,0|3,0,0]=4 366 B6R0.6 CCCCOCC Amb2685642 [1,0,0,0,0,0|1,1,0]=3 367 B6R0.6 CCCCOCO Amb24480826 [1,0,0,0,0,0|2,1,0]=4 368 B6R0.6 CCCCSC#N Amb4035931 [1,0,0,0,0,0|2,0,1]=4 369 B6R0.6 CCCCSCC Amb9787545 [1,0,0,0,0,0|1,0,0]=2 370 B6R0.6 CCCCSCCl Amb25146885 [1,0,0,0,0,0|2,0,0]=3 371 B6R0.6 CCCCSCO Amb27623932 [1,0,0,0,0,0|2,0,0]=3 372 B6R0.6 CCCNCC#N Amb6714443 [1,0,0,0,0,0|2,0,1]=4 373 B6R0.6 CCCNCCC Amb3939352 [1,0,0,0,0,0|1,0,0]=2 374 B6R0.6 CCCNCCCl Amb17334074 [1,0,0,0,0,0|2,0,0]=3 375 B6R0.6 CCCNCCN Amb8515461 [1,0,0,0,0,0|2,0,0]=3 376 B6R0.6 CCCNCCO Amb3939869 [1,0,0,0,0,0|2,0,0]=3 377 B6R0.6 CCCNCOC Amb27830080 [1,0,0,0,0,0|2,0,0]=3 378 B6R0.6 CCCNNCC Amb27409240 [1,0,0,0,0,0|2,0,0]=3 379 B6R0.6 CCCOCC#N Amb8874819 [1,0,0,0,0,0|1,1,1]=4 380 B6R0.6 CCCOCCC Amb8513440 [1,0,0,0,0,0|0,1,0]=2 381 B6R0.6 CCCOCCCl Amb8514866 [1,0,0,0,0,0|1,1,0]=3 382 B6R0.6 CCCOCCI Amb27596856 [1,0,0,0,0,0|1,1,0]=3 383 B6R0.6 CCCOCCN Amb3939563 [1,0,0,0,0,0|1,1,0]=3 384 B6R0.6 CCCOCCO Amb3939227 [1,0,0,0,0,0|1,1,0]=3 385 B6R0.6 CCCSCC#N Amb6680723 [1,0,0,0,0,0|1,0,1]=3 386 B6R0.6 CCCSCCBr Amb9304990 [1,0,0,0,0,0|1,0,0]=2 387 B6R0.6 CCCSCCC Amb9787473 [1,0,0,0,0,0|0,0,0]=1 388 B6R0.6 CCCSCCCl Amb9304987 [1,0,0,0,0,0|1,0,0]=2 389 B6R0.6 CCCSCCN Amb19888435 [1,0,0,0,0,0|1,0,0]=2 390 B6R0.6 CCCSCCN Amb6268693 [1,0,0,0,0,0|1,0,0]=2 391 B6R0.6 CCCSCCS Amb28050075 [1,0,0,0,0,0|1,0,0]=2 392 B6R0.6 CCCSCNC Amb27879006 [1,0,0,0,0,0|1,0,0]=2 393 B6R0.6 CCCSSCC Amb24063527 [1,0,0,0,0,0|0,0,0]=1 394 B6R0.6 CCCSSSC Amb8392859 [1,0,0,0,0,0|1,0,0]=2 395 B6R0.6 CCC\C=C\CCl Amb27482813 [1,0,0,0,0,0|2,0,1]=4 396 B6R0.6 CCC\C=C\CN Amb33475254 [1,0,0,0,0,0|2,0,1]=4 397 B6R0.6 CCC\C=C\CO Amb32660968 [1,0,0,0,0,0|2,0,1]=4 398 B6R0.6 CCC\C=C\CS Amb33373719 [1,0,0,0,0,0|2,0,1]=4 399 B6R0.6 CCN=C=NCC Amb27664435 [1,0,0,0,0,0|3,0,0]=4 400 B6R0.6 CCNCCCBr Amb27265760 [1,0,0,0,0,0|3,0,0]=4 401 B6R0.6 CCNCCCF Amb28050218 [1,0,0,0,0,0|3,0,0]=4 402 B6R0.6 CCNCCCN Amb17315269 [1,0,0,0,0,0|3,0,0]=4 403 B6R0.6 CCNCCCO Amb6733726 [1,0,0,0,0,0|3,0,0]=4 404 B6R0.6 CCNCCOC Amb32653021 [1,0,0,0,0,0|3,0,0]=4 405 B6R0.6 CCNCCOC Amb3939818 [1,0,0,0,0,0|3,0,0]=4 406 B6R0.6 CCNCCSC Amb19024605 [1,0,0,0,0,0|3,0,0]=4 407 B6R0.6 CCNCCSC Amb28941534 [1,0,0,0,0,0|3,0,0]=4 408 B6R0.6 CCNCNCC Amb27174562 [1,0,0,0,0,0|3,0,0]=4 409 B6R0.6 CCNOCCO Amb28281707 [1,0,0,0,0,0|2,1,0]=4 410 B6R0.6 CCOCCCBr Amb8828206 [1,0,0,0,0,0|2,1,0]=4 411 B6R0.6 CCOCCCCl Amb6255304 [1,0,0,0,0,0|2,1,0]=4 412 B6R0.6 CCOCCCN Amb3939347 [1,0,0,0,0,0|2,1,0]=4 413 B6R0.6 CCOCCCO Amb3939322 [1,0,0,0,0,0|2,1,0]=4 414 B6R0.6 CCOCCNC Amb19959934 [1,0,0,0,0,0|2,1,0]=4 415 B6R0.6 CCOCCNC Amb33529221 [1,0,0,0,0,0|2,1,0]=4 416 B6R0.6 CCOCCOC Amb22052684 [1,0,0,0,0,0|2,1,0]=4 417 B6R0.6 CCOCOCC Amb8515183 [1,0,0,0,0,0|2,1,0]=4 418 B6R0.6 CCONOCC Amb27590258 [1,0,0,0,0,0|2,1,0]=4 419 B6R0.6 CCO[SiH2]OCC Amb27655870 [1,0,0,0,0,0|2,1,0]=4 420 B6R0.6 CCSCCC#N Amb6680683 [1,0,0,0,0,0|2,0,1]=4 421 B6R0.6 CCSCCC=O Amb27254551 [1,0,0,0,0,0|2,0,1]=4 422 B6R0.6 CCSCCCBr Amb9305000 [1,0,0,0,0,0|2,0,0]=3 423 B6R0.6 CCSCCCI Amb28461625 [1,0,0,0,0,0|2,0,0]=3 424 B6R0.6 CCSCCCN Amb6680223 [1,0,0,0,0,0|2,0,0]=3 425 B6R0.6 CCSCCCO Amb3939588 [1,0,0,0,0,0|2,0,0]=3 426 B6R0.6 CCSCCCS Amb26476929 [1,0,0,0,0,0|2,0,0]=3 427 B6R0.6 CCSCCNC Amb16186669 [1,0,0,0,0,0|2,0,0]=3 428 B6R0.6 CCSCCNN Amb27218047 [1,0,0,0,0,0|3,0,0]=4 429 B6R0.6 CCSCCNO Amb33324087 [1,0,0,0,0,0|3,0,0]=4 430 B6R0.6 CCSCCON Amb24414250 [1,0,0,0,0,0|3,0,0]=4 431 B6R0.6 CCSCSCC Amb17609604 [1,0,0,0,0,0|2,0,0]=3 432 B6R0.6 CCSSSCC Amb22168293 [1,0,0,0,0,0|1,0,0]=2 433 B6R0.6 CC\C=C/CCC Amb26600858 [1,0,0,0,0,0|1,0,1]=3 434 B6R0.6 CC\C=C/CCCl Amb27815138 [1,0,0,0,0,0|2,0,1]=4 435 B6R0.6 CC\C=C/CCI Amb28399922 [1,0,0,0,0,0|2,0,1]=4 436 B6R0.6 CC\C=C/CCO Amb2720771 [1,0,0,0,0,0|2,0,1]=4 437 B6R0.6 CC\C=C\CCBr Amb17570067 [1,0,0,0,0,0|2,0,1]=4 438 B6R0.6 CC\C=C\CCC Amb19930065 [1,0,0,0,0,0|1,0,1]=3 439 B6R0.6 CC\C=C\CCCl Amb27452933 [1,0,0,0,0,0|2,0,1]=4 440 B6R0.6 CC\C=C\CCN Amb17569886 [1,0,0,0,0,0|2,0,1]=4 441 B6R0.6 CC\C=C\CCO Amb3940339 [1,0,0,0,0,0|2,0,1]=4 442 B6R0.6 CC\C=C\CCS Amb32882654 [1,0,0,0,0,0|2,0,1]=4 443 B6R0.6 CC\C=C\CNC Amb26618015 [1,0,0,0,0,0|2,0,1]=4 444 B6R0.6 CC\C=C\OCC Amb33986090 [1,0,0,0,0,0|1,1,1]=4 445 B6R0.6 CNCCCCCl Amb34916601 [1,0,0,0,0,0|3,0,0]=4 446 B6R0.6 CNCCCCF Amb27231439 [1,0,0,0,0,0|3,0,0]=4 447 B6R0.6 CNCCCCN Amb17334048 [1,0,0,0,0,0|3,0,0]=4 448 B6R0.6 CNCCCCN Amb2698063 [1,0,0,0,0,0|3,0,0]=4 449 B6R0.6 CNCCCCO Amb33539277 [1,0,0,0,0,0|3,0,0]=4 450 B6R0.6 CNCCCNC Amb3940467 [1,0,0,0,0,0|3,0,0]=4 451 B6R0.6 CNCCCOC Amb33801534 [1,0,0,0,0,0|3,0,0]=4 452 B6R0.6 CNCCCOC Amb9204018 [1,0,0,0,0,0|3,0,0]=4 453 B6R0.6 CNCCCSC Amb6718995 [1,0,0,0,0,0|3,0,0]=4 454 B6R0.6 CNCCSSC Amb28146208 [1,0,0,0,0,0|3,0,0]=4 455 B6R0.6 COCCCCBr Amb8855443 [1,0,0,0,0,0|3,0,0]=4 456 B6R0.6 COCCCCCl Amb17942999 [1,0,0,0,0,0|3,0,0]=4 457 B6R0.6 COCCCCI Amb25933499 [1,0,0,0,0,0|3,0,0]=4 458 B6R0.6 COCCCCN Amb10610278 [1,0,0,0,0,0|3,0,0]=4 459 B6R0.6 COCCCCN Amb6251056 [1,0,0,0,0,0|3,0,0]=4 460 B6R0.6 COCCCCO Amb17666901 [1,0,0,0,0,0|3,0,0]=4 461 B6R0.6 COCCCCS Amb24654696 [1,0,0,0,0,0|3,0,0]=4 462 B6R0.6 COCCCOC Amb22168275 [1,0,0,0,0,0|3,0,0]=4 463 B6R0.6 COCCCSC Amb28139052 [1,0,0,0,0,0|3,0,0]=4 464 B6R0.6 COCCSCCl Amb33545127 [1,0,0,0,0,0|3,0,0]=4 465 B6R0.6 COCNCCO Amb18522071 [1,0,0,0,0,0|3,0,0]=4 466 B6R0.6 COCOCCCl Amb22546806 [1,0,0,0,0,0|2,1,0]=4 467 B6R0.6 COCOCCI Amb26443893 [1,0,0,0,0,0|2,1,0]=4 468 B6R0.6 COCOCCN Amb25314793 [1,0,0,0,0,0|2,1,0]=4 469 B6R0.6 COCOCCO Amb23590973 [1,0,0,0,0,0|2,1,0]=4 470 B6R0.6 COCSCC#N Amb18928019 [1,0,0,0,0,0|2,0,1]=4 471 B6R0.6 CSCCCCBr Amb19054837 [1,0,0,0,0,0|3,0,0]=4 472 B6R0.6 CSCCCCCl Amb25240444 [1,0,0,0,0,0|3,0,0]=4 473 B6R0.6 CSCCCCF Amb27620229 [1,0,0,0,0,0|3,0,0]=4 474 B6R0.6 CSCCCCN Amb17500948 [1,0,0,0,0,0|3,0,0]=4 475 B6R0.6 CSCCCCO Amb9825911 [1,0,0,0,0,0|3,0,0]=4 476 B6R0.6 CSCCCCS Amb27461555 [1,0,0,0,0,0|3,0,0]=4 477 B6R0.6 CSCCCSC Amb22043311 [1,0,0,0,0,0|3,0,0]=4 478 B6R0.6 CSCSCSC Amb25025600 [1,0,0,0,0,0|2,0,0]=3 479 B6R0.6 C\C=C/CCCC Amb24467666 [1,0,0,0,0,0|1,0,2]=4 480 B6R0.6 C\C=C\CCCC Amb8515158 [1,0,0,0,0,0|1,0,2]=4 481 B6R0.6 C\C=C\SCCC Amb22168314 [1,0,0,0,0,0|0,0,2]=3 482 B6R0.6 C\C=C\SSSC Amb26533859 [1,0,0,0,0,0|1,0,2]=4 483 B6R0.6 ClCCCCCBr Amb2724373 [1,0,0,0,0,0|3,0,0]=4 484 B6R0.6 ClCCCCCCl Amb6608828 [1,0,0,0,0,0|3,0,0]=4 485 B6R0.6 ClCCCCCI Amb10069913 [1,0,0,0,0,0|3,0,0]=4 486 B6R0.6 ClCCNCCCl Amb2583221 [1,0,0,0,0,0|3,0,0]=4 487 B6R0.6 ClCCNCCCl Amb6366187 [1,0,0,0,0,0|3,0,0]=4 488 B6R0.6 ClCCOCCCl Amb2684745 [1,0,0,0,0,0|2,1,0]=4 489 B6R0.6 ClCCOCCI Amb24055322 [1,0,0,0,0,0|2,1,0]=4 490 B6R0.6 ClCCSCCBr Amb27838203 [1,0,0,0,0,0|2,0,0]=3 491 B6R0.6 ClCCSCCCl Amb22731869 [1,0,0,0,0,0|2,0,0]=3 492 B6R0.6 FCCCCCBr Amb15701635 [1,0,0,0,0,0|3,0,0]=4 493 B6R0.6 FCCCCCF Amb27397467 [1,0,0,0,0,0|3,0,0]=4 494 B6R0.6 FCCCCCS Amb24409033 [1,0,0,0,0,0|3,0,0]=4 495 B6R0.6 FCCNCCBr Amb28041488 [1,0,0,0,0,0|3,0,0]=4 496 B6R0.6 FCCNCCF Amb27627389 [1,0,0,0,0,0|3,0,0]=4 497 B6R0.6 FCCSCCCl Amb28423486 [1,0,0,0,0,0|2,0,0]=3 498 B6R0.6 ICCCCCI Amb8514835 [1,0,0,0,0,0|3,0,0]=4 499 B6R0.6 ICCOCCI Amb2694690 [1,0,0,0,0,0|2,1,0]=4 500 B6R0.6 N#CCSCCN Amb6265754 [1,0,0,0,0,0|2,0,1]=4 501 B6R0.6 NCCCCCBr Amb26581378 [1,0,0,0,0,0|3,0,0]=4 502 B6R0.6 NCCCCCCl Amb17593241 [1,0,0,0,0,0|3,0,0]=4 503 B6R0.6 NCCCCCF Amb28383861 [1,0,0,0,0,0|3,0,0]=4 504 B6R0.6 NCCCCCF Amb35747648 [1,0,0,0,0,0|3,0,0]=4 505 B6R0.6 NCCCCCI Amb27596855 [1,0,0,0,0,0|3,0,0]=4 506 B6R0.6 NCCCCCN Amb22002397 [1,0,0,0,0,0|3,0,0]=4 507 B6R0.6 NCCCCCN Amb8513099 [1,0,0,0,0,0|3,0,0]=4 508 B6R0.6 NCCCCCO Amb3939337 [1,0,0,0,0,0|3,0,0]=4 509 B6R0.6 NCCCCCS Amb33362345 [1,0,0,0,0,0|3,0,0]=4 510 B6R0.6 NCCCCCS Amb33527075 [1,0,0,0,0,0|3,0,0]=4 511 B6R0.6 NCCNCCBr Amb27478238 [1,0,0,0,0,0|3,0,0]=4 512 B6R0.6 NCCNCCN Amb5722362 [1,0,0,0,0,0|3,0,0]=4 513 B6R0.6 NCCNCCO Amb6600573 [1,0,0,0,0,0|3,0,0]=4 514 B6R0.6 NCCNCCS Amb24763096 [1,0,0,0,0,0|3,0,0]=4 515 B6R0.6 NCCNCCS Amb33483741 [1,0,0,0,0,0|3,0,0]=4 516 B6R0.6 NCCOCCBr Amb25888513 [1,0,0,0,0,0|2,1,0]=4 517 B6R0.6 NCCOCCBr Amb35747990 [1,0,0,0,0,0|2,1,0]=4 518 B6R0.6 NCCOCCCl Amb22036609 [1,0,0,0,0,0|2,1,0]=4 519 B6R0.6 NCCOCCF Amb28320518 [1,0,0,0,0,0|2,1,0]=4 520 B6R0.6 NCCOCCF Amb33536623 [1,0,0,0,0,0|2,1,0]=4 521 B6R0.6 NCCOCCN Amb2583212 [1,0,0,0,0,0|2,1,0]=4 522 B6R0.6 NCCOCCN Amb8504888 [1,0,0,0,0,0|2,1,0]=4 523 B6R0.6 NCCOCCO Amb3939011 [1,0,0,0,0,0|2,1,0]=4 524 B6R0.6 NCCOCCS Amb17502015 [1,0,0,0,0,0|2,1,0]=4 525 B6R0.6 NCCOCCS Amb35789823 [1,0,0,0,0,0|2,1,0]=4 526 B6R0.6 NCCSCCN Amb32679817 [1,0,0,0,0,0|2,0,0]=3 527 B6R0.6 NCCSCCN Amb9695000 [1,0,0,0,0,0|2,0,0]=3 528 B6R0.6 NCCSCCO Amb2725559 [1,0,0,0,0,0|2,0,0]=3 529 B6R0.6 OCCCCCBr Amb10603824 [1,0,0,0,0,0|3,0,0]=4 530 B6R0.6 OCCCCCCl Amb8386939 [1,0,0,0,0,0|3,0,0]=4 531 B6R0.6 OCCCCCF Amb24479828 [1,0,0,0,0,0|3,0,0]=4 532 B6R0.6 OCCCCCO Amb6296608 [1,0,0,0,0,0|3,0,0]=4 533 B6R0.6 OCCNCCF Amb27468539 [1,0,0,0,0,0|3,0,0]=4 534 B6R0.6 OCCNCCO Amb22035219 [1,0,0,0,0,0|3,0,0]=4 535 B6R0.6 OCCNCCO Amb3997179 [1,0,0,0,0,0|3,0,0]=4 536 B6R0.6 OCCNCCS Amb18522180 [1,0,0,0,0,0|3,0,0]=4 537 B6R0.6 OCCOCCBr Amb24057456 [1,0,0,0,0,0|2,1,0]=4 538 B6R0.6 OCCOCCCl Amb3940337 [1,0,0,0,0,0|2,1,0]=4 539 B6R0.6 OCCOCCF Amb17593119 [1,0,0,0,0,0|2,1,0]=4 540 B6R0.6 OCCOCCI Amb27602214 [1,0,0,0,0,0|2,1,0]=4 541 B6R0.6 OCCOCCO Amb32671216 [1,0,0,0,0,0|2,1,0]=4 542 B6R0.6 OCCOCCO Amb6608789 [1,0,0,0,0,0|2,1,0]=4 543 B6R0.6 OCCOCCS Amb22008751 [1,0,0,0,0,0|2,1,0]=4 544 B6R0.6 OCCPCCO Amb27185495 [1,0,0,0,0,0|3,0,0]=4 545 B6R0.6 OCCSCCCl Amb27413860 [1,0,0,0,0,0|2,0,0]=3 546 B6R0.6 OCCSCCO Amb6891967 [1,0,0,0,0,0|2,0,0]=3 547 B6R0.6 OCCSCCS Amb27829564 [1,0,0,0,0,0|2,0,0]=3 548 B6R0.6 SCCCCCS Amb8514611 [1,0,0,0,0,0|3,0,0]=4 549 B6R0.6 SCCOCCS Amb9786765 [1,0,0,0,0,0|2,1,0]=4 550 B6R0.6 SCCSCCS Amb9826816 [1,0,0,0,0,0|2,0,0]=3 551 B6R0.6 [C-]#[N+]CCCCC Amb2684559 [1,0,0,0,0,0|2,0,1]=4 552 B6R0.6 [C-]#[N+]CCSCC Amb33324019 [1,0,0,0,0,0|2,0,1]=4 553 B8R0.1 C=C(CCN)CCCC Amb25883662 [0,1,0,0,0,0|3,0,0]=4 554 B8R0.1 CC(CCN)SCCF Amb28062736 [0,1,0,0,0,0|3,0,0]=4 555 B8R0.1 CC(CCO)SCCF Amb27164900 [0,1,0,0,0,0|3,0,0]=4 556 B8R0.1 CCC#CC(Br)CCC Amb27243978 [0,1,0,0,0,0|2,0,1]=4 557 B8R0.1 CCCC(=N)NCCF Amb28314727 [0,1,0,0,0,0|3,0,0]=4 558 B8R0.1 CCCC(=O)CCCF Amb28182770 [0,1,0,0,0,0|3,0,0]=4 559 B8R0.1 CCCC(=O)CCCN Amb27866597 [0,1,0,0,0,0|3,0,0]=4 560 B8R0.1 CCCC(=O)NCCCl Amb17103189 [0,1,0,0,0,0|3,0,0]=4 561 B8R0.1 CCCC(=O)NCCI Amb27225208 [0,1,0,0,0,0|3,0,0]=4 562 B8R0.1 CCCC(=O)NCCN Amb6242301 [0,1,0,0,0,0|3,0,0]=4 563 B8R0.1 CCCC(=O)NCCO Amb5797547 [0,1,0,0,0,0|3,0,0]=4 564 B8R0.1 CCCC(=O)OCCBr Amb25087679 [0,1,0,0,0,0|2,1,0]=4 565 B8R0.1 CCCC(=O)OCCF Amb27448709 [0,1,0,0,0,0|2,1,0]=4 566 B8R0.1 CCCC(=O)OCCO Amb25937003 [0,1,0,0,0,0|2,1,0]=4 567 B8R0.1 CCCC(=O)OCSC Amb8393187 [0,1,0,0,0,0|2,1,0]=4 568 B8R0.1 CCCC(=O)SCCBr Amb27264823 [0,1,0,0,0,0|2,0,0]=3 569 B8R0.1 CCCC(=O)SCCO Amb27841882 [0,1,0,0,0,0|2,0,0]=3 570 B8R0.1 CCCC(Br)CCCN Amb27645439 [0,1,0,0,0,0|3,0,0]=4 571 B8R0.1 CCCC(C)CCCBr Amb33533621 [0,1,0,0,0,0|3,0,0]=4 572 B8R0.1 CCCC(C)CCCCl Amb27859186 [0,1,0,0,0,0|3,0,0]=4 573 B8R0.1 CCCC(C)CCCN Amb27654811 [0,1,0,0,0,0|3,0,0]=4 574 B8R0.1 CCCC(C)CCCO Amb25135097 [0,1,0,0,0,0|3,0,0]=4 575 B8R0.1 CCCC(C)CCCS Amb33320795 [0,1,0,0,0,0|3,0,0]=4 576 B8R0.1 CCCC(C)CCNC Amb26948262 [0,1,0,0,0,0|3,0,0]=4 577 B8R0.1 CCCC(C)NCCCl Amb27801679 [0,1,0,0,0,0|3,0,0]=4 578 B8R0.1 CCCC(C)NCCF Amb27838496 [0,1,0,0,0,0|3,0,0]=4 579 B8R0.1 CCCC(C)NCCN Amb28049074 [0,1,0,0,0,0|3,0,0]=4 580 B8R0.1 CCCC(C)OCCBr Amb27812220 [0,1,0,0,0,0|2,1,0]=4 581 B8R0.1 CCCC(C)OCCCl Amb27663690 [0,1,0,0,0,0|2,1,0]=4 582 B8R0.1 CCCC(C)OCCN Amb27267655 [0,1,0,0,0,0|2,1,0]=4 583 B8R0.1 CCCC(C)OCCS Amb27812221 [0,1,0,0,0,0|2,1,0]=4 584 B8R0.1 CCCC(N)CCCN Amb27255552 [0,1,0,0,0,0|3,0,0]=4 585 B8R0.1 CCCC(N)CCNC Amb27196610 [0,1,0,0,0,0|3,0,0]=4 586 B8R0.1 CCCC(O)CCCBr Amb27591160 [0,1,0,0,0,0|3,0,0]=4 587 B8R0.1 CCCC(O)CCCO Amb4035231 [0,1,0,0,0,0|3,0,0]=4 588 B8R0.1 CCCC(O)CCCS Amb25740546 [0,1,0,0,0,0|3,0,0]=4 589 B8R0.1 CCCC(O)CCOC Amb28049045 [0,1,0,0,0,0|3,0,0]=4 590 B8R0.1 CCCC(O)CNCC Amb27175353 [0,1,0,0,0,0|3,0,0]=4 591 B8R0.1 CCCCC(=N)OCC Amb20673140 [0,1,0,0,0,0|3,0,0]=4 592 B8R0.1 CCCCC(=N)OCC Amb26549922 [0,1,0,0,0,0|3,0,0]=4 593 B8R0.1 CCCCC(=O)CCC Amb3940685 [0,1,0,0,0,0|2,0,0]=3 594 B8R0.1 CCCCC(=O)CCN Amb28186730 [0,1,0,0,0,0|3,0,0]=4 595 B8R0.1 CCCCC(=O)CNC Amb25824276 [0,1,0,0,0,0|3,0,0]=4 596 B8R0.1 CCCCC(=O)COC Amb19374627 [0,1,0,0,0,0|3,0,0]=4 597 B8R0.1 CCCCC(=O)CSC Amb27837495 [0,1,0,0,0,0|3,0,0]=4 598 B8R0.1 CCCCC(=O)OCC Amb6296060 [0,1,0,0,0,0|3,0,0]=4 599 B8R0.1 CCCCC(Br)CCC Amb13951105 [0,1,0,0,0,0|2,0,0]=3 600 B8R0.1 CCCCC(C)CCBr Amb25809503 [0,1,0,0,0,0|3,0,0]=4 601 B8R0.1 CCCCC(C)CCC Amb22229830 [0,1,0,0,0,0|2,0,0]=3 602 B8R0.1 CCCCC(C)CCN Amb27817638 [0,1,0,0,0,0|3,0,0]=4 603 B8R0.1 CCCCC(C)CCO Amb22229364 [0,1,0,0,0,0|3,0,0]=4 604 B8R0.1 CCCCC(Cl)CCC Amb22229751 [0,1,0,0,0,0|2,0,0]=3 605 B8R0.1 CCCCC(Cl)CCO Amb27791848 [0,1,0,0,0,0|3,0,0]=4 606 B8R0.1 CCCCC(F)CCN Amb28383115 [0,1,0,0,0,0|3,0,0]=4 607 B8R0.1 CCCCC(F)CCO Amb27664743 [0,1,0,0,0,0|3,0,0]=4 608 B8R0.1 CCCCC(I)CCC Amb25314282 [0,1,0,0,0,0|2,0,0]=3 609 B8R0.1 CCCCC(N)CCC Amb9031790 [0,1,0,0,0,0|2,0,0]=3 610 B8R0.1 CCCCC(N)CCO Amb18642854 [0,1,0,0,0,0|3,0,0]=4 611 B8R0.1 CCCCC(N)CCO Amb24117271 [0,1,0,0,0,0|3,0,0]=4 612 B8R0.1 CCCCC(N)COC Amb19374470 [0,1,0,0,0,0|3,0,0]=4 613 B8R0.1 CCCCC(O)CCN Amb25784846 [0,1,0,0,0,0|3,0,0]=4 614 B8R0.1 CCCCC(O)CNC Amb24351205 [0,1,0,0,0,0|3,0,0]=4 615 B8R0.1 CCCCN(C)CCF Amb28049439 [0,1,0,0,0,0|3,0,0]=4 616 B8R0.1 CCCCN(C)CCN Amb5357834 [0,1,0,0,0,0|3,0,0]=4 617 B8R0.1 CCCCN(C)CCO Amb3204758 [0,1,0,0,0,0|3,0,0]=4 618 B8R0.1 CCCCN(N)CCO Amb28398931 [0,1,0,0,0,0|3,0,0]=4 619 B8R0.1 CCCCS(=O)CCO Amb6752517 [0,1,0,0,0,0|2,0,1]=4 620 B8R0.1 CCCC[C@@H](C)CCO Amb24477883 [0,1,0,0,0,0|3,0,0]=4 621 B8R0.1 CCCC[C@@H](Cl)CCC Amb27185673 [0,1,0,0,0,0|2,0,0]=3 622 B8R0.1 CCCC[C@@H](N)CCO Amb22748774 [0,1,0,0,0,0|3,0,0]=4 623 B8R0.1 CCCC[C@@H](O)CCBr Amb28320766 [0,1,0,0,0,0|3,0,0]=4 624 B8R0.1 CCCC[C@@H](O)CCN Amb24716695 [0,1,0,0,0,0|3,0,0]=4 625 B8R0.1 CCCC[C@H](F)CCO Amb28049226 [0,1,0,0,0,0|3,0,0]=4 626 B8R0.1 CCCC[C@H](N)CCO Amb27947953 [0,1,0,0,0,0|3,0,0]=4 627 B8R0.1 CCCC[C@H](N)CNC Amb27853746 [0,1,0,0,0,0|3,0,0]=4 628 B8R0.1 CCCC[C@H](O)CCBr Amb27483780 [0,1,0,0,0,0|3,0,0]=4 629 B8R0.1 CCCC[C@H](O)CCN Amb26996017 [0,1,0,0,0,0|3,0,0]=4 630 B8R0.1 CCCN(C)CCCI Amb28318380 [0,1,0,0,0,0|3,0,0]=4 631 B8R0.1 CCCN(C)CCCN Amb6670577 [0,1,0,0,0,0|3,0,0]=4 632 B8R0.1 CCCNC(=N)COC Amb27454619 [0,1,0,0,0,0|3,0,0]=4 633 B8R0.1 CCCNC(=N)CSC Amb27438998 [0,1,0,0,0,0|3,0,0]=4 634 B8R0.1 CCCNC(=N)SCC Amb25162798 [0,1,0,0,0,0|3,0,0]=4 635 B8R0.1 CCCNC(=O)CCBr Amb17333407 [0,1,0,0,0,0|3,0,0]=4 636 B8R0.1 CCCNC(=O)CCCl Amb1128924 [0,1,0,0,0,0|3,0,0]=4 637 B8R0.1 CCCNC(=O)CCN Amb1133966 [0,1,0,0,0,0|3,0,0]=4 638 B8R0.1 CCCNC(=O)CCN Amb21957303 [0,1,0,0,0,0|3,0,0]=4 639 B8R0.1 CCCNC(=O)CCO Amb17334123 [0,1,0,0,0,0|3,0,0]=4 640 B8R0.1 CCCNC(=O)CNC Amb2370799 [0,1,0,0,0,0|3,0,0]=4 641 B8R0.1 CCCNC(=O)CNC Amb403043 [0,1,0,0,0,0|3,0,0]=4 642 B8R0.1 CCCNC(=O)NCC Amb3101998 [0,1,0,0,0,0|3,0,0]=4 643 B8R0.1 CCCNC(=O)OCC Amb17787091 [0,1,0,0,0,0|3,0,0]=4 644 B8R0.1 CCCNC(C)CCCl Amb28285307 [0,1,0,0,0,0|3,0,0]=4 645 B8R0.1 CCCNS(=O)CCC Amb28144943 [0,1,0,0,0,0|1,0,1]=3 646 B8R0.1 CCCOC(=N)CCO Amb27757381 [0,1,0,0,0,0|2,1,0]=4 647 B8R0.1 CCCOC(=O)CCC Amb8517637 [0,1,0,0,0,0|1,1,0]=3 648 B8R0.1 CCCOC(=O)CCN Amb19409653 [0,1,0,0,0,0|2,1,0]=4 649 B8R0.1 CCCOC(=O)CCN Amb8874764 [0,1,0,0,0,0|2,1,0]=4 650 B8R0.1 CCCOC(=O)CCO Amb22504631 [0,1,0,0,0,0|2,1,0]=4 651 B8R0.1 CCCOC(=O)CCS Amb22053845 [0,1,0,0,0,0|2,1,0]=4 652 B8R0.1 CCCOC(=O)NCC Amb26642760 [0,1,0,0,0,0|2,1,0]=4 653 B8R0.1 CCCOC(=S)NCC Amb28340500 [0,1,0,0,0,0|2,1,0]=4 654 B8R0.1 CCCOC(C)CNC Amb28397738 [0,1,0,0,0,0|2,1,0]=4 655 B8R0.1 CCCS(=O)CCCBr Amb27398529 [0,1,0,0,0,0|2,0,1]=4 656 B8R0.1 CCCS(=O)NOCC Amb28324206 [0,1,0,0,0,0|2,0,1]=4 657 B8R0.1 CCCSC(=O)NCC Amb27244385 [0,1,0,0,0,0|2,0,0]=3 658 B8R0.1 CCCSC(=S)NCC Amb24419019 [0,1,0,0,0,0|2,0,0]=3 659 B8R0.1 CCCSC(C)COC Amb27837602 [0,1,0,0,0,0|2,0,0]=3 660 B8R0.1 CCCSS(=O)CCC Amb28077285 [0,1,0,0,0,0|0,0,1]=2 661 B8R0.1 CCC[C@@H](C)CCCBr Amb27607669 [0,1,0,0,0,0|3,0,0]=4 662 B8R0.1 CCC[C@@H](C)CCCN Amb27488815 [0,1,0,0,0,0|3,0,0]=4 663 B8R0.1 CCC[C@@H](C)CCCO Amb28292905 [0,1,0,0,0,0|3,0,0]=4 664 B8R0.1 CCC[C@@H](O)CCOC Amb27660393 [0,1,0,0,0,0|3,0,0]=4 665 B8R0.1 CCC[C@H](C)CCCO Amb28065801 [0,1,0,0,0,0|3,0,0]=4 666 B8R0.1 CCC[C@H](N)CNCC Amb26957468 [0,1,0,0,0,0|3,0,0]=4 667 B8R0.1 CCC[C@H](N)CSCC Amb28369366 [0,1,0,0,0,0|3,0,0]=4 668 B8R0.1 CCC[C@H](O)CCCO Amb28049112 [0,1,0,0,0,0|3,0,0]=4 669 B8R0.1 CCC\C(C)=N\CCN Amb27784288 [0,1,0,0,0,0|3,0,0]=4 670 B8R0.1 CCC\N=C(/N)SCC Amb27829091 [0,1,0,0,0,0|3,0,0]=4 671 B8R0.1 CCC\N=C(/N)SCC Amb27956411 [0,1,0,0,0,0|3,0,0]=4 672 B8R0.1 CCC\N=[N+](/[O-])CCC Amb27173662 [0,1,0,0,0,0|2,0,0]=3 673 B8R0.1 CCOC(=O)SCCCl Amb27453639 [0,1,0,0,0,0|3,0,0]=4 674 B8R0.1 CC\C=C(\C)SCCO Amb27260247 [0,1,0,0,0,0|2,0,1]=4 675 B8R0.1 CC\C=C/C(=O)CCC Amb27838798 [0,1,0,0,0,0|2,0,1]=4 676 B8R0.1 COCC(C)SCCO Amb28200280 [0,1,0,0,0,0|3,0,0]=4 677 B8R0.1 COCSC(C)CCO Amb27180843 [0,1,0,0,0,0|3,0,0]=4 678 B8R0.1 NCCSS(=O)CCN Amb27858764 [0,1,0,0,0,0|2,0,1]=4 679 B8R0.4 BrCCCCCCCBr Amb10069015 [0,1,0,0,0,0|3,0,0]=4 680 B8R0.4 BrCCCOCCCBr Amb27206373 [0,1,0,0,0,0|2,1,0]=4 681 B8R0.4 C#CCCCCCCC Amb3940501 [0,1,0,0,0,0|2,0,1]=4 682 B8R0.4 C#CCCCSCCN Amb27970230 [0,1,0,0,0,0|2,0,1]=4 683 B8R0.4 C#CCCCSCCO Amb27242865 [0,1,0,0,0,0|2,0,1]=4 684 B8R0.4 C#CCCSCCCN Amb28422179 [0,1,0,0,0,0|1,0,2]=4 685 B8R0.4 C#CCCSCCOC Amb27979692 [0,1,0,0,0,0|1,0,2]=4 686 B8R0.4 C#CCC\C=C\CCC Amb33373746 [0,1,0,0,0,0|2,0,1]=4 687 B8R0.4 C#CCSCCCCF Amb27487103 [0,1,0,0,0,0|1,0,2]=4 688 B8R0.4 C#CCSCCCCN Amb17500974 [0,1,0,0,0,0|1,0,2]=4 689 B8R0.4 C=CCCCCCCC Amb3940502 [0,1,0,0,0,0|2,0,1]=4 690 B8R0.4 C=CCCCSCCO Amb28352314 [0,1,0,0,0,0|2,0,1]=4 691 B8R0.4 C=CCCSCCCC Amb28078650 [0,1,0,0,0,0|1,0,1]=3 692 B8R0.4 C=CCSCCCCBr Amb27465812 [0,1,0,0,0,0|1,0,2]=4 693 B8R0.4 C=CCSCCCCC Amb27837635 [0,1,0,0,0,0|1,0,2]=4 694 B8R0.4 C=CCSCCCCCl Amb27795958 [0,1,0,0,0,0|1,0,2]=4 695 B8R0.4 C=CCSCCCCF Amb28184818 [0,1,0,0,0,0|1,0,2]=4 696 B8R0.4 C=CCSCCCCN Amb17500942 [0,1,0,0,0,0|1,0,2]=4 697 B8R0.4 C=CCSCCCNC Amb27975525 [0,1,0,0,0,0|1,0,2]=4 698 B8R0.4 C=CCSCCCSC Amb27628484 [0,1,0,0,0,0|1,0,2]=4 699 B8R0.4 CC#CCCCCCC Amb9134715 [0,1,0,0,0,0|2,0,1]=4 700 B8R0.4 CC#CCCSCCC Amb27489037 [0,1,0,0,0,0|1,0,1]=3 701 B8R0.4 CC#CCCSCCN Amb27780539 [0,1,0,0,0,0|2,0,1]=4 702 B8R0.4 CC#CCSCCCC Amb27206321 [0,1,0,0,0,0|1,0,1]=3 703 B8R0.4 CC#CCSCCOC Amb27479460 [0,1,0,0,0,0|1,0,2]=4 704 B8R0.4 CCC#CCCCCC Amb9134716 [0,1,0,0,0,0|2,0,1]=4 705 B8R0.4 CCC#CCCCCN Amb28049876 [0,1,0,0,0,0|2,0,1]=4 706 B8R0.4 CCC#CCCCCO Amb26362942 [0,1,0,0,0,0|2,0,1]=4 707 B8R0.4 CCCC#CCCCC Amb9134717 [0,1,0,0,0,0|2,0,0]=3 708 B8R0.4 CCCC=C=CCCO Amb17593316 [0,1,0,0,0,0|2,0,1]=4 709 B8R0.4 CCCCBCCCC Amb27624537 [0,1,0,0,0,0|2,0,0]=3 710 B8R0.4 CCCCC#CCCCl Amb28050989 [0,1,0,0,0,0|2,0,1]=4 711 B8R0.4 CCCCC#CCCO Amb2721716 [0,1,0,0,0,0|2,0,1]=4 712 B8R0.4 CCCCCCCC#N Amb7764637 [0,1,0,0,0,0|2,0,1]=4 713 B8R0.4 CCCCCCCC=O Amb6891949 [0,1,0,0,0,0|2,0,1]=4 714 B8R0.4 CCCCCCCCBr Amb2689971 [0,1,0,0,0,0|2,0,0]=3 715 B8R0.4 CCCCCCCCC Amb8513269 [0,1,0,0,0,0|2,0,0]=3 716 B8R0.4 CCCCCCCCCl Amb7757832 [0,1,0,0,0,0|2,0,0]=3 717 B8R0.4 CCCCCCCCF Amb10840379 [0,1,0,0,0,0|2,0,0]=3 718 B8R0.4 CCCCCCCCI Amb637144 [0,1,0,0,0,0|2,0,0]=3 719 B8R0.4 CCCCCCCCN Amb2720240 [0,1,0,0,0,0|2,0,0]=3 720 B8R0.4 CCCCCCCCN Amb3940466 [0,1,0,0,0,0|2,0,0]=3 721 B8R0.4 CCCCCCCCO Amb6608788 [0,1,0,0,0,0|2,0,0]=3 722 B8R0.4 CCCCCCCCS Amb8513530 [0,1,0,0,0,0|2,0,0]=3 723 B8R0.4 CCCCCCCC[SiH3] Amb19893984 [0,1,0,0,0,0|2,0,0]=3 724 B8R0.4 CCCCCCCNC Amb7761453 [0,1,0,0,0,0|2,0,0]=3 725 B8R0.4 CCCCCCCNN Amb7794376 [0,1,0,0,0,0|3,0,0]=4 726 B8R0.4 CCCCCCCOC Amb24584912 [0,1,0,0,0,0|2,0,0]=3 727 B8R0.4 CCCCCCCSC Amb22359861 [0,1,0,0,0,0|2,0,0]=3 728 B8R0.4 CCCCCCNCC Amb6730567 [0,1,0,0,0,0|2,0,0]=3 729 B8R0.4 CCCCCCOCC Amb17672946 [0,1,0,0,0,0|2,0,0]=3 730 B8R0.4 CCCCCCOCCl Amb27473208 [0,1,0,0,0,0|3,0,0]=4 731 B8R0.4 CCCCCNCCC Amb6688182 [0,1,0,0,0,0|2,0,0]=3 732 B8R0.4 CCCCCNCCCl Amb17334288 [0,1,0,0,0,0|3,0,0]=4 733 B8R0.4 CCCCCNCCI Amb27411190 [0,1,0,0,0,0|3,0,0]=4 734 B8R0.4 CCCCCNCCN Amb17091049 [0,1,0,0,0,0|3,0,0]=4 735 B8R0.4 CCCCCNCCO Amb3940022 [0,1,0,0,0,0|3,0,0]=4 736 B8R0.4 CCCCCOCCCl Amb8902963 [0,1,0,0,0,0|2,1,0]=4 737 B8R0.4 CCCCCOCCO Amb22264988 [0,1,0,0,0,0|2,1,0]=4 738 B8R0.4 CCCCCOCCS Amb27752940 [0,1,0,0,0,0|2,1,0]=4 739 B8R0.4 CCCCCSCCCl Amb25887277 [0,1,0,0,0,0|2,0,0]=3 740 B8R0.4 CCCCCSCCN Amb6275043 [0,1,0,0,0,0|2,0,0]=3 741 B8R0.4 CCCCCSCCO Amb1032987 [0,1,0,0,0,0|2,0,0]=3 742 B8R0.4 CCCCCSCOC Amb27771414 [0,1,0,0,0,0|2,0,0]=3 743 B8R0.4 CCCCNCCC#N Amb2685599 [0,1,0,0,0,0|2,0,1]=4 744 B8R0.4 CCCCNCCCBr Amb28399869 [0,1,0,0,0,0|2,0,0]=3 745 B8R0.4 CCCCNCCCC Amb22348285 [0,1,0,0,0,0|2,0,0]=3 746 B8R0.4 CCCCNCCCC Amb3939027 [0,1,0,0,0,0|2,0,0]=3 747 B8R0.4 CCCCNCCCC Amb4017913 [0,1,0,0,0,0|2,0,0]=3 748 B8R0.4 CCCCNCCCCl Amb24529030 [0,1,0,0,0,0|2,0,0]=3 749 B8R0.4 CCCCNCCCCl Amb33164142 [0,1,0,0,0,0|2,0,0]=3 750 B8R0.4 CCCCNCCCN Amb17315267 [0,1,0,0,0,0|2,0,0]=3 751 B8R0.4 CCCCNCCCO Amb4304116 [0,1,0,0,0,0|2,0,0]=3 752 B8R0.4 CCCCNCCOC Amb6685727 [0,1,0,0,0,0|2,0,0]=3 753 B8R0.4 CCCCNOCCO Amb27956595 [0,1,0,0,0,0|2,1,0]=4 754 B8R0.4 CCCCOCCC#N Amb8873730 [0,1,0,0,0,0|1,1,1]=4 755 B8R0.4 CCCCOCCC=O Amb27880111 [0,1,0,0,0,0|1,1,1]=4 756 B8R0.4 CCCCOCCCBr Amb8895241 [0,1,0,0,0,0|1,1,0]=3 757 B8R0.4 CCCCOCCCC Amb8513426 [0,1,0,0,0,0|1,1,0]=3 758 B8R0.4 CCCCOCCCN Amb3939348 [0,1,0,0,0,0|1,1,0]=3 759 B8R0.4 CCCCOCCNN Amb27979085 [0,1,0,0,0,0|2,1,0]=4 760 B8R0.4 CCCCOCCOC Amb33847381 [0,1,0,0,0,0|1,1,0]=3 761 B8R0.4 CCCCPCCCC Amb22730293 [0,1,0,0,0,0|2,0,0]=3 762 B8R0.4 CCCCPCCCN Amb27217298 [0,1,0,0,0,0|2,0,0]=3 763 B8R0.4 CCCCSCCC#N Amb9479932 [0,1,0,0,0,0|1,0,1]=3 764 B8R0.4 CCCCSCCCF Amb27449027 [0,1,0,0,0,0|1,0,0]=2 765 B8R0.4 CCCCSCCCN Amb9261123 [0,1,0,0,0,0|1,0,0]=2 766 B8R0.4 CCCCSCCCS Amb28453845 [0,1,0,0,0,0|1,0,0]=2 767 B8R0.4 CCCCSCCOC Amb27827301 [0,1,0,0,0,0|1,0,0]=2 768 B8R0.4 CCCCSCNC=O Amb27656061 [0,1,0,0,0,0|2,0,1]=4 769 B8R0.4 CCCCS\C=C\CO Amb27219509 [0,1,0,0,0,0|1,0,2]=4 770 B8R0.4 CCCC[NH2+]CCCC Amb22732582 [0,1,0,0,0,0|2,0,0]=3 771 B8R0.4 CCCC[NH2+]CCCC Amb8516289 [0,1,0,0,0,0|2,0,0]=3 772 B8R0.4 CCCC[SnH4+2]CCCC Amb22045422 [0,1,0,0,0,0|2,0,0]=3 773 B8R0.4 CCCC[SnH4+2]CCCC Amb22045423 [0,1,0,0,0,0|2,0,0]=3 774 B8R0.4 CCCC\C=C/CCO Amb26586236 [0,1,0,0,0,0|2,0,1]=4 775 B8R0.4 CCCC\C=C\CCN Amb27788288 [0,1,0,0,0,0|2,0,1]=4 776 B8R0.4 CCCC\C=C\CCO Amb9134733 [0,1,0,0,0,0|2,0,1]=4 777 B8R0.4 CCCC\C=C\OCC Amb17674075 [0,1,0,0,0,0|2,0,1]=4 778 B8R0.4 CCCN=C=NCCC Amb28248732 [0,1,0,0,0,0|2,0,0]=3 779 B8R0.4 CCCNCCCCI Amb28072729 [0,1,0,0,0,0|2,0,0]=3 780 B8R0.4 CCCNCCCCN Amb17334115 [0,1,0,0,0,0|2,0,0]=3 781 B8R0.4 CCCNCCCCS Amb28349265 [0,1,0,0,0,0|2,0,0]=3 782 B8R0.4 CCCNCCCOC Amb6730309 [0,1,0,0,0,0|2,0,0]=3 783 B8R0.4 CCCNCCOCC Amb8841458 [0,1,0,0,0,0|2,0,0]=3 784 B8R0.4 CCCNCCSCC Amb27837542 [0,1,0,0,0,0|2,0,0]=3 785 B8R0.4 CCCNCNCCC Amb28250874 [0,1,0,0,0,0|2,0,0]=3 786 B8R0.4 CCCNCSCCC Amb27784117 [0,1,0,0,0,0|1,0,0]=2 787 B8R0.4 CCCOCCCC#N Amb8874818 [0,1,0,0,0,0|1,1,1]=4 788 B8R0.4 CCCOCCCC=O Amb27795367 [0,1,0,0,0,0|1,1,1]=4 789 B8R0.4 CCCOCCCCBr Amb8874783 [0,1,0,0,0,0|1,1,0]=3 790 B8R0.4 CCCOCCCCCl Amb18181651 [0,1,0,0,0,0|1,1,0]=3 791 B8R0.4 CCCOCCCCO Amb27395455 [0,1,0,0,0,0|1,1,0]=3 792 B8R0.4 CCCOCCCON Amb27420839 [0,1,0,0,0,0|2,1,0]=4 793 B8R0.4 CCCOCCNCC Amb28146663 [0,1,0,0,0,0|1,1,0]=3 794 B8R0.4 CCCOCCOCCl Amb28246338 [0,1,0,0,0,0|2,1,0]=4 795 B8R0.4 CCCOCOCCC Amb22230733 [0,1,0,0,0,0|0,2,0]=3 796 B8R0.4 CCCSCCCC#N Amb6680724 [0,1,0,0,0,0|1,0,1]=3 797 B8R0.4 CCCSCCCCCl Amb18798739 [0,1,0,0,0,0|1,0,0]=2 798 B8R0.4 CCCSCCCCN Amb9391521 [0,1,0,0,0,0|1,0,0]=2 799 B8R0.4 CCCSCCCCO Amb9370795 [0,1,0,0,0,0|1,0,0]=2 800 B8R0.4 CCCSCCCCS Amb27766901 [0,1,0,0,0,0|1,0,0]=2 801 B8R0.4 CCCSCCCOC Amb27837637 [0,1,0,0,0,0|1,0,0]=2 802 B8R0.4 CCCSCCNC=O Amb27630895 [0,1,0,0,0,0|2,0,1]=4 803 B8R0.4 CCCSCCOCC Amb27970679 [0,1,0,0,0,0|1,0,0]=2 804 B8R0.4 CCCSSSCCC Amb22002286 [0,1,0,0,0,0|0,0,0]=1 805 B8R0.4 CCC\C=C/CCCC Amb26023943 [0,1,0,0,0,0|2,0,0]=3 806 B8R0.4 CCC\C=C\CCC#N Amb33226017 [0,1,0,0,0,0|2,0,1]=4 807 B8R0.4 CCC\C=C\CCC=O Amb33172232 [0,1,0,0,0,0|2,0,1]=4 808 B8R0.4 CCC\C=C\CCCBr Amb26574256 [0,1,0,0,0,0|2,0,0]=3 809 B8R0.4 CCC\C=C\CCCC Amb2778543 [0,1,0,0,0,0|2,0,0]=3 810 B8R0.4 CCC\C=C\CCCN Amb33327176 [0,1,0,0,0,0|2,0,0]=3 811 B8R0.4 CCC\C=C\CCCS Amb33373717 [0,1,0,0,0,0|2,0,0]=3 812 B8R0.4 CCC\C=C\CCNC Amb33429318 [0,1,0,0,0,0|2,0,0]=3 813 B8R0.4 CCC\C=C\CCON Amb33424856 [0,1,0,0,0,0|3,0,0]=4 814 B8R0.4 CCC\C=C\CCSC Amb27810331 [0,1,0,0,0,0|2,0,0]=3 815 B8R0.4 CCC\C=N\CCCC Amb19375587 [0,1,0,0,0,0|2,0,0]=3 816 B8R0.4 CCNCCCCCF Amb27956469 [0,1,0,0,0,0|3,0,0]=4 817 B8R0.4 CCNCCCCCI Amb27761837 [0,1,0,0,0,0|3,0,0]=4 818 B8R0.4 CCNCCCCCN Amb27447573 [0,1,0,0,0,0|3,0,0]=4 819 B8R0.4 CCNCCCCCO Amb17334130 [0,1,0,0,0,0|3,0,0]=4 820 B8R0.4 CCNCCCCOC Amb27837458 [0,1,0,0,0,0|3,0,0]=4 821 B8R0.4 CCNCCCCSC Amb27837487 [0,1,0,0,0,0|3,0,0]=4 822 B8R0.4 CCNCCCNCC Amb20171936 [0,1,0,0,0,0|3,0,0]=4 823 B8R0.4 CCNCCCSCC Amb27647486 [0,1,0,0,0,0|3,0,0]=4 824 B8R0.4 CCNCCNCCF Amb27768816 [0,1,0,0,0,0|3,0,0]=4 825 B8R0.4 CCNCCNCCN Amb27411449 [0,1,0,0,0,0|3,0,0]=4 826 B8R0.4 CCNCCOCCBr Amb27208133 [0,1,0,0,0,0|2,1,0]=4 827 B8R0.4 CCNCCOCCN Amb25305457 [0,1,0,0,0,0|2,1,0]=4 828 B8R0.4 CCNCCOCCO Amb6736237 [0,1,0,0,0,0|2,1,0]=4 829 B8R0.4 CCN\C=C\CNCC Amb27627377 [0,1,0,0,0,0|3,0,0]=4 830 B8R0.4 CCN\N=C\CCCO Amb27662112 [0,1,0,0,0,0|3,0,0]=4 831 B8R0.4 CCOCCCCCBr Amb24502334 [0,1,0,0,0,0|3,0,0]=4 832 B8R0.4 CCOCCCCCCl Amb9001650 [0,1,0,0,0,0|3,0,0]=4 833 B8R0.4 CCOCCCCCS Amb27835597 [0,1,0,0,0,0|3,0,0]=4 834 B8R0.4 CCOCCCCNC Amb28049603 [0,1,0,0,0,0|3,0,0]=4 835 B8R0.4 CCOCCNCCBr Amb27629210 [0,1,0,0,0,0|3,0,0]=4 836 B8R0.4 CCOCCNCCCl Amb27801916 [0,1,0,0,0,0|3,0,0]=4 837 B8R0.4 CCOCCNCCN Amb27603963 [0,1,0,0,0,0|3,0,0]=4 838 B8R0.4 CCOCCNCCS Amb28048707 [0,1,0,0,0,0|3,0,0]=4 839 B8R0.4 CCOCCOCCCl Amb8828467 [0,1,0,0,0,0|2,1,0]=4 840 B8R0.4 CCOCCOCCN Amb30585145 [0,1,0,0,0,0|2,1,0]=4 841 B8R0.4 CCOCCOCCN Amb6243196 [0,1,0,0,0,0|2,1,0]=4 842 B8R0.4 CCOCCOCCO Amb8513162 [0,1,0,0,0,0|2,1,0]=4 843 B8R0.4 CCOCCSCCF Amb28122264 [0,1,0,0,0,0|2,0,0]=3 844 B8R0.4 CCOCCSCSC Amb27179570 [0,1,0,0,0,0|2,0,0]=3 845 B8R0.4 CCOCSCCCN Amb28143434 [0,1,0,0,0,0|2,0,0]=3 846 B8R0.4 CCOCSCCCO Amb27842168 [0,1,0,0,0,0|2,0,0]=3 847 B8R0.4 CCOC\C=C\CCO Amb27972232 [0,1,0,0,0,0|3,0,0]=4 848 B8R0.4 CCONCCCCO Amb28326276 [0,1,0,0,0,0|3,0,0]=4 849 B8R0.4 CCO\N=C\CSCC Amb27953958 [0,1,0,0,0,0|3,0,0]=4 850 B8R0.4 CCSCCCCCBr Amb25887441 [0,1,0,0,0,0|3,0,0]=4 851 B8R0.4 CCSCCCCCCl Amb9304998 [0,1,0,0,0,0|3,0,0]=4 852 B8R0.4 CCSCCCCCF Amb28207049 [0,1,0,0,0,0|3,0,0]=4 853 B8R0.4 CCSCCCCCN Amb28049047 [0,1,0,0,0,0|3,0,0]=4 854 B8R0.4 CCSCCCCNC Amb27837488 [0,1,0,0,0,0|3,0,0]=4 855 B8R0.4 CCSCCCCOC Amb27651458 [0,1,0,0,0,0|3,0,0]=4 856 B8R0.4 CCSCCNCCF Amb27241603 [0,1,0,0,0,0|3,0,0]=4 857 B8R0.4 CCSCCNCCO Amb27454287 [0,1,0,0,0,0|3,0,0]=4 858 B8R0.4 CCSCCOCCBr Amb27856710 [0,1,0,0,0,0|2,1,0]=4 859 B8R0.4 CCSCCOCCCl Amb27978105 [0,1,0,0,0,0|2,1,0]=4 860 B8R0.4 CCSCCOCCN Amb17501990 [0,1,0,0,0,0|2,1,0]=4 861 B8R0.4 CCSCCSCC#N Amb27617252 [0,1,0,0,0,0|2,0,1]=4 862 B8R0.4 CCSCCSCCF Amb27768840 [0,1,0,0,0,0|2,0,0]=3 863 B8R0.4 CC\C=C/CCCCC Amb25258581 [0,1,0,0,0,0|2,0,1]=4 864 B8R0.4 CC\C=C/CCCCN Amb28313712 [0,1,0,0,0,0|2,0,1]=4 865 B8R0.4 CC\C=C/CCCCO Amb22052636 [0,1,0,0,0,0|2,0,1]=4 866 B8R0.4 CC\C=C\CCCCC Amb22347893 [0,1,0,0,0,0|2,0,1]=4 867 B8R0.4 CC\C=C\CCCCN Amb33079175 [0,1,0,0,0,0|2,0,1]=4 868 B8R0.4 CC\C=C\CCNCC Amb27647277 [0,1,0,0,0,0|2,0,1]=4 869 B8R0.4 CC\C=C\CCSCC Amb27260956 [0,1,0,0,0,0|2,0,1]=4 870 B8R0.4 CNCCC#CCCN Amb27398662 [0,1,0,0,0,0|3,0,0]=4 871 B8R0.4 CNCCCCCCF Amb28137350 [0,1,0,0,0,0|3,0,0]=4 872 B8R0.4 CNCCCCCCN Amb22641938 [0,1,0,0,0,0|3,0,0]=4 873 B8R0.4 CNCCCCCCN Amb32667312 [0,1,0,0,0,0|3,0,0]=4 874 B8R0.4 CNCCCCCCO Amb2721293 [0,1,0,0,0,0|3,0,0]=4 875 B8R0.4 CNCCCCCOC Amb17569940 [0,1,0,0,0,0|3,0,0]=4 876 B8R0.4 CNCCCNCCF Amb27465811 [0,1,0,0,0,0|3,0,0]=4 877 B8R0.4 CNCCCNCCS Amb25146120 [0,1,0,0,0,0|3,0,0]=4 878 B8R0.4 CNCCCOCCO Amb27855882 [0,1,0,0,0,0|2,1,0]=4 879 B8R0.4 CNCCNCCCF Amb27768818 [0,1,0,0,0,0|3,0,0]=4 880 B8R0.4 CNCCNCCNC Amb8480392 [0,1,0,0,0,0|3,0,0]=4 881 B8R0.4 CNCCNCCSC Amb27639961 [0,1,0,0,0,0|3,0,0]=4 882 B8R0.4 CNCCOCCCF Amb27393733 [0,1,0,0,0,0|2,1,0]=4 883 B8R0.4 CNCCOCCNC Amb2583286 [0,1,0,0,0,0|2,1,0]=4 884 B8R0.4 CNCCOCCOC Amb25691167 [0,1,0,0,0,0|2,1,0]=4 885 B8R0.4 CNCCSCCCN Amb27768770 [0,1,0,0,0,0|2,0,0]=3 886 B8R0.4 CNCCSCCSC Amb27669026 [0,1,0,0,0,0|2,0,0]=3 887 B8R0.4 COCC#CCCCBr Amb27613532 [0,1,0,0,0,0|3,0,0]=4 888 B8R0.4 COCCCCCCBr Amb26928164 [0,1,0,0,0,0|3,0,0]=4 889 B8R0.4 COCCCCCCCl Amb18180174 [0,1,0,0,0,0|3,0,0]=4 890 B8R0.4 COCCCCCCN Amb27799019 [0,1,0,0,0,0|3,0,0]=4 891 B8R0.4 COCCCCCCO Amb28189816 [0,1,0,0,0,0|3,0,0]=4 892 B8R0.4 COCCCCCOC Amb22348093 [0,1,0,0,0,0|3,0,0]=4 893 B8R0.4 COCCCNCCCl Amb17334317 [0,1,0,0,0,0|3,0,0]=4 894 B8R0.4 COCCCNCCN Amb17091021 [0,1,0,0,0,0|3,0,0]=4 895 B8R0.4 COCCCNCCO Amb9213213 [0,1,0,0,0,0|3,0,0]=4 896 B8R0.4 COCCCOCCCl Amb18177244 [0,1,0,0,0,0|2,1,0]=4 897 B8R0.4 COCCCOCCI Amb27253165 [0,1,0,0,0,0|2,1,0]=4 898 B8R0.4 COCCCOCCN Amb27751129 [0,1,0,0,0,0|2,1,0]=4 899 B8R0.4 COCCCOCCO Amb26344833 [0,1,0,0,0,0|2,1,0]=4 900 B8R0.4 COCCCSCCBr Amb28049052 [0,1,0,0,0,0|2,0,0]=3 901 B8R0.4 COCCCSCCCl Amb28411442 [0,1,0,0,0,0|2,0,0]=3 902 B8R0.4 COCCCSCCS Amb27980898 [0,1,0,0,0,0|2,0,0]=3 903 B8R0.4 COCCNCCCN Amb17315289 [0,1,0,0,0,0|3,0,0]=4 904 B8R0.4 COCCNCCCO Amb9246587 [0,1,0,0,0,0|3,0,0]=4 905 B8R0.4 COCCNCCOC Amb6608693 [0,1,0,0,0,0|3,0,0]=4 906 B8R0.4 COCCNCCSC Amb27979037 [0,1,0,0,0,0|3,0,0]=4 907 B8R0.4 COCCOCCCBr Amb9204139 [0,1,0,0,0,0|2,1,0]=4 908 B8R0.4 COCCOCCCCl Amb6256006 [0,1,0,0,0,0|2,1,0]=4 909 B8R0.4 COCCOCCCN Amb1154665 [0,1,0,0,0,0|2,1,0]=4 910 B8R0.4 COCCOCCCO Amb26608683 [0,1,0,0,0,0|2,1,0]=4 911 B8R0.4 COCCOCCCS Amb27981281 [0,1,0,0,0,0|2,1,0]=4 912 B8R0.4 COCCOCCOC Amb6608783 [0,1,0,0,0,0|2,1,0]=4 913 B8R0.4 COCCONCCF Amb27470436 [0,1,0,0,0,0|2,1,0]=4 914 B8R0.4 COCCONCCO Amb27257086 [0,1,0,0,0,0|2,1,0]=4 915 B8R0.4 COCCSCCC=O Amb27837422 [0,1,0,0,0,0|2,0,1]=4 916 B8R0.4 COCCSCCCBr Amb9304977 [0,1,0,0,0,0|2,0,0]=3 917 B8R0.4 COCCSCCCF Amb28293660 [0,1,0,0,0,0|2,0,0]=3 918 B8R0.4 COCCSCCCS Amb27838576 [0,1,0,0,0,0|2,0,0]=3 919 B8R0.4 COCCSCCON Amb28062817 [0,1,0,0,0,0|3,0,0]=4 920 B8R0.4 COCOCCCCCl Amb22641569 [0,1,0,0,0,0|2,1,0]=4 921 B8R0.4 COCSCCCC#N Amb18927650 [0,1,0,0,0,0|2,0,1]=4 922 B8R0.4 CSCCCCCCN Amb24532830 [0,1,0,0,0,0|3,0,0]=4 923 B8R0.4 CSCCCCCCO Amb22367888 [0,1,0,0,0,0|3,0,0]=4 924 B8R0.4 CSCCCCCCS Amb27801758 [0,1,0,0,0,0|3,0,0]=4 925 B8R0.4 CSCCCCCSC Amb4020033 [0,1,0,0,0,0|3,0,0]=4 926 B8R0.4 CSCCCNCCBr Amb27217836 [0,1,0,0,0,0|3,0,0]=4 927 B8R0.4 CSCCCNCCCl Amb27869237 [0,1,0,0,0,0|3,0,0]=4 928 B8R0.4 CSCCCOCCS Amb27257161 [0,1,0,0,0,0|2,1,0]=4 929 B8R0.4 CSCCCSCCBr Amb28326052 [0,1,0,0,0,0|2,0,0]=3 930 B8R0.4 CSCCCSCCS Amb27666422 [0,1,0,0,0,0|2,0,0]=3 931 B8R0.4 CSCCNCCCBr Amb28137679 [0,1,0,0,0,0|3,0,0]=4 932 B8R0.4 CSCCNCCCCl Amb27599936 [0,1,0,0,0,0|3,0,0]=4 933 B8R0.4 CSCCNCCCF Amb28136726 [0,1,0,0,0,0|3,0,0]=4 934 B8R0.4 CSCCOCCCN Amb27146302 [0,1,0,0,0,0|2,1,0]=4 935 B8R0.4 CSCCOCCSC Amb27170781 [0,1,0,0,0,0|2,1,0]=4 936 B8R0.4 CSCCSCCC=O Amb27956184 [0,1,0,0,0,0|2,0,1]=4 937 B8R0.4 C\C=C/CCCCCC Amb27478896 [0,1,0,0,0,0|2,0,1]=4 938 B8R0.4 C\C=C\CCCCCC Amb19930200 [0,1,0,0,0,0|2,0,1]=4 939 B8R0.4 C\C=C\CSCCOC Amb27766159 [0,1,0,0,0,0|1,0,2]=4 940 B8R0.4 ClCCCCCCCBr Amb24323576 [0,1,0,0,0,0|3,0,0]=4 941 B8R0.4 ClCCCCCCCCl Amb22232563 [0,1,0,0,0,0|3,0,0]=4 942 B8R0.4 ClCCCNCCCCl Amb25147083 [0,1,0,0,0,0|3,0,0]=4 943 B8R0.4 ClCCCOCCCCl Amb2700587 [0,1,0,0,0,0|2,1,0]=4 944 B8R0.4 ClCCCSCCCCl Amb27808763 [0,1,0,0,0,0|2,0,0]=3 945 B8R0.4 FCCCCNCCBr Amb28457765 [0,1,0,0,0,0|3,0,0]=4 946 B8R0.4 FCCCCNCCCl Amb27255714 [0,1,0,0,0,0|3,0,0]=4 947 B8R0.4 FCCCCNCCF Amb27799430 [0,1,0,0,0,0|3,0,0]=4 948 B8R0.4 FCCCNCCCBr Amb27843825 [0,1,0,0,0,0|3,0,0]=4 949 B8R0.4 FCCCNCCCCl Amb27838497 [0,1,0,0,0,0|3,0,0]=4 950 B8R0.4 FCCCSCCCCl Amb27243197 [0,1,0,0,0,0|2,0,0]=3 951 B8R0.4 FCCCSCCCF Amb27977388 [0,1,0,0,0,0|2,0,0]=3 952 B8R0.4 N#CCCSCCCO Amb17502405 [0,1,0,0,0,0|2,0,1]=4 953 B8R0.4 N#CCSCCCCN Amb17500946 [0,1,0,0,0,0|2,0,1]=4 954 B8R0.4 NCCCCCCCBr Amb27817795 [0,1,0,0,0,0|3,0,0]=4 955 B8R0.4 NCCCCCCCBr Amb33321489 [0,1,0,0,0,0|3,0,0]=4 956 B8R0.4 NCCCCCCCF Amb25918508 [0,1,0,0,0,0|3,0,0]=4 957 B8R0.4 NCCCCCCCN Amb3370862 [0,1,0,0,0,0|3,0,0]=4 958 B8R0.4 NCCCCCCCO Amb24120448 [0,1,0,0,0,0|3,0,0]=4 959 B8R0.4 NCCCCCCCO Amb33544521 [0,1,0,0,0,0|3,0,0]=4 960 B8R0.4 NCCCCCCCS Amb25147209 [0,1,0,0,0,0|3,0,0]=4 961 B8R0.4 NCCCCNCCBr Amb27865413 [0,1,0,0,0,0|3,0,0]=4 962 B8R0.4 NCCCCNCCN Amb24117220 [0,1,0,0,0,0|3,0,0]=4 963 B8R0.4 NCCCCNCCN Amb25378773 [0,1,0,0,0,0|3,0,0]=4 964 B8R0.4 NCCCCNCCO Amb8394908 [0,1,0,0,0,0|3,0,0]=4 965 B8R0.4 NCCCCOCCO Amb6681146 [0,1,0,0,0,0|2,1,0]=4 966 B8R0.4 NCCCCSCCN Amb27872081 [0,1,0,0,0,0|2,0,0]=3 967 B8R0.4 NCCCCSCCO Amb17500958 [0,1,0,0,0,0|2,0,0]=3 968 B8R0.4 NCCCNCCCN Amb8513191 [0,1,0,0,0,0|3,0,0]=4 969 B8R0.4 NCCCNCCCO Amb19959935 [0,1,0,0,0,0|3,0,0]=4 970 B8R0.4 NCCCOCCCF Amb27391202 [0,1,0,0,0,0|2,1,0]=4 971 B8R0.4 NCCCOCCCN Amb17593392 [0,1,0,0,0,0|2,1,0]=4 972 B8R0.4 NCCCOCCCO Amb35788244 [0,1,0,0,0,0|2,1,0]=4 973 B8R0.4 NCCCOCCCO Amb9392882 [0,1,0,0,0,0|2,1,0]=4 974 B8R0.4 NCCCSCCCO Amb17500713 [0,1,0,0,0,0|2,0,0]=3 975 B8R0.4 NCCCSCCON Amb28319278 [0,1,0,0,0,0|3,0,0]=4 976 B8R0.4 NCCSCCCCF Amb27830248 [0,1,0,0,0,0|2,0,0]=3 977 B8R0.4 NCCSCCCCS Amb27878524 [0,1,0,0,0,0|2,0,0]=3 978 B8R0.4 NCCSCSCCN Amb25100916 [0,1,0,0,0,0|2,0,0]=3 979 B8R0.4 NCC\C=C/CCCN Amb28056104 [0,1,0,0,0,0|3,0,0]=4 980 B8R0.4 NCC\C=N\CCCN Amb28041352 [0,1,0,0,0,0|3,0,0]=4 981 B8R0.4 NOCCCSCCO Amb27420973 [0,1,0,0,0,0|3,0,0]=4 982 B8R0.4 OCCCCCCCBr Amb9787726 [0,1,0,0,0,0|3,0,0]=4 983 B8R0.4 OCCCCCCCF Amb25381297 [0,1,0,0,0,0|3,0,0]=4 984 B8R0.4 OCCCCCCCI Amb32411247 [0,1,0,0,0,0|3,0,0]=4 985 B8R0.4 OCCCCCCCO Amb8513178 [0,1,0,0,0,0|3,0,0]=4 986 B8R0.4 OCCCCNCCO Amb28049076 [0,1,0,0,0,0|3,0,0]=4 987 B8R0.4 OCCCCOCCO Amb25185198 [0,1,0,0,0,0|2,1,0]=4 988 B8R0.4 OCCCNCCCO Amb28984089 [0,1,0,0,0,0|3,0,0]=4 989 B8R0.4 OCCCNCCCO Amb8393926 [0,1,0,0,0,0|3,0,0]=4 990 B8R0.4 OCCCOCCCCl Amb28058754 [0,1,0,0,0,0|2,1,0]=4 991 B8R0.4 OCCCOCCCO Amb24626114 [0,1,0,0,0,0|2,1,0]=4 992 B8R0.4 OCCC\C=C\CCI Amb22364705 [0,1,0,0,0,0|3,0,0]=4 993 B8R0.4 [C-]#[N+]CCCCCCC Amb33747260 [0,1,0,0,0,0|2,0,1]=4 994 B8R0.4 [C-]#[N+]CC\C=C\CCC Amb33424871 [0,1,0,0,0,0|2,0,1]=4 995 B8R0.6 C#CCCSC(C)CC Amb27837528 [0,1,0,0,0,0|1,0,2]=4 996 B8R0.6 C#CCSCC(C)CC Amb27662850 [0,1,0,0,0,0|1,0,2]=4 997 B8R0.6 C#CCSCC(F)CC Amb27768839 [0,1,0,0,0,0|1,0,2]=4 998 B8R0.6 C=C(CC)CNCCC Amb27456809 [0,1,0,0,0,0|2,0,1]=4 999 B8R0.6 C=C(CC)CSCCN Amb27174810 [0,1,0,0,0,0|2,0,1]=4 1000 B8R0.6 C=C(CC)NCCCC Amb27230099 [0,1,0,0,0,0|2,0,1]=4 1001 B8R0.6 C=C(CN)CSCCC Amb27771737 [0,1,0,0,0,0|2,0,1]=4 1002 B8R0.6 C=CC(C)SCCCC Amb28190115 [0,1,0,0,0,0|1,0,2]=4 1003 B8R0.6 C=CC(O)CSCCC Amb28200246 [0,1,0,0,0,0|1,0,2]=4 1004 B8R0.6 C=CCSCC(C)CC Amb27760930 [0,1,0,0,0,0|1,0,2]=4 1005 B8R0.6 C=CCSCC(F)CC Amb28124203 [0,1,0,0,0,0|1,0,2]=4 1006 B8R0.6 C=CCSCC(O)CC Amb27805379 [0,1,0,0,0,0|1,0,2]=4 1007 B8R0.6 CC(CCl)SSCCCl Amb28045554 [0,1,0,0,0,0|2,0,0]=3 1008 B8R0.6 CC(CN)SCCCF Amb27851238 [0,1,0,0,0,0|3,0,0]=4 1009 B8R0.6 CC(CO)CSCCF Amb27861873 [0,1,0,0,0,0|3,0,0]=4 1010 B8R0.6 CC(CO)SCCCN Amb27755869 [0,1,0,0,0,0|3,0,0]=4 1011 B8R0.6 CCC(=O)CSCCCl Amb28399270 [0,1,0,0,0,0|2,0,1]=4 1012 B8R0.6 CCC(=O)CSCCO Amb4165967 [0,1,0,0,0,0|2,0,1]=4 1013 B8R0.6 CCC(C)CCCCN Amb25146190 [0,1,0,0,0,0|3,0,0]=4 1014 B8R0.6 CCC(C)CCCCO Amb25367714 [0,1,0,0,0,0|3,0,0]=4 1015 B8R0.6 CCC(C)CNCCO Amb3940071 [0,1,0,0,0,0|3,0,0]=4 1016 B8R0.6 CCC(C)COCCO Amb27198059 [0,1,0,0,0,0|2,1,0]=4 1017 B8R0.6 CCC(C)CSCCBr Amb27493953 [0,1,0,0,0,0|2,0,0]=3 1018 B8R0.6 CCC(C)CSCCF Amb27218787 [0,1,0,0,0,0|2,0,0]=3 1019 B8R0.6 CCC(C)CSCCN Amb27983415 [0,1,0,0,0,0|2,0,0]=3 1020 B8R0.6 CCC(C)CSCCS Amb27471047 [0,1,0,0,0,0|2,0,0]=3 1021 B8R0.6 CCC(C)CSCOC Amb27977816 [0,1,0,0,0,0|2,0,0]=3 1022 B8R0.6 CCC(C)NCCCBr Amb27838582 [0,1,0,0,0,0|3,0,0]=4 1023 B8R0.6 CCC(C)NCCCF Amb27838485 [0,1,0,0,0,0|3,0,0]=4 1024 B8R0.6 CCC(C)NCCCN Amb17315265 [0,1,0,0,0,0|3,0,0]=4 1025 B8R0.6 CCC(C)NCCCO Amb6733732 [0,1,0,0,0,0|3,0,0]=4 1026 B8R0.6 CCC(C)NCCOC Amb6685733 [0,1,0,0,0,0|3,0,0]=4 1027 B8R0.6 CCC(C)OCCCBr Amb18321256 [0,1,0,0,0,0|2,1,0]=4 1028 B8R0.6 CCC(C)OCCCCl Amb18176654 [0,1,0,0,0,0|2,1,0]=4 1029 B8R0.6 CCC(C)OCCCN Amb20076070 [0,1,0,0,0,0|2,1,0]=4 1030 B8R0.6 CCC(C)SCCC=O Amb28118733 [0,1,0,0,0,0|2,0,1]=4 1031 B8R0.6 CCC(C)SCCCO Amb9273773 [0,1,0,0,0,0|2,0,0]=3 1032 B8R0.6 CCC(C)SCCOC Amb27962134 [0,1,0,0,0,0|2,0,0]=3 1033 B8R0.6 CCC(C)S\C=C\CO Amb28074680 [0,1,0,0,0,0|2,0,1]=4 1034 B8R0.6 CCC(Cl)CCCOC Amb18180141 [0,1,0,0,0,0|3,0,0]=4 1035 B8R0.6 CCC(F)CSCCO Amb27757051 [0,1,0,0,0,0|2,0,0]=3 1036 B8R0.6 CCC(N)CCCNC Amb27231954 [0,1,0,0,0,0|3,0,0]=4 1037 B8R0.6 CCC(N)CNCCO Amb33230048 [0,1,0,0,0,0|3,0,0]=4 1038 B8R0.6 CCC(N)CSCC#N Amb28397055 [0,1,0,0,0,0|2,0,1]=4 1039 B8R0.6 CCC(N)CSCCO Amb28285128 [0,1,0,0,0,0|2,0,0]=3 1040 B8R0.6 CCC(N)CSCOC Amb28141151 [0,1,0,0,0,0|2,0,0]=3 1041 B8R0.6 CCC(O)CCCCCl Amb27786918 [0,1,0,0,0,0|3,0,0]=4 1042 B8R0.6 CCC(O)CCCCO Amb27762946 [0,1,0,0,0,0|3,0,0]=4 1043 B8R0.6 CCC(O)CCCNC Amb27655789 [0,1,0,0,0,0|3,0,0]=4 1044 B8R0.6 CCC(O)CCCOC Amb28249167 [0,1,0,0,0,0|3,0,0]=4 1045 B8R0.6 CCCBCC(C)CCl Amb27771247 [0,1,0,0,0,0|3,0,0]=4 1046 B8R0.6 CCCC#CC(Br)CC Amb28385620 [0,1,0,0,0,0|2,0,0]=3 1047 B8R0.6 CCCC#CC(C)CO Amb27662312 [0,1,0,0,0,0|3,0,0]=4 1048 B8R0.6 CCCC#CC(O)CCl Amb27212807 [0,1,0,0,0,0|3,0,0]=4 1049 B8R0.6 CCCCCC(=O)CC Amb8513554 [0,1,0,0,0,0|2,0,1]=4 1050 B8R0.6 CCCCCC(Br)CC Amb18324626 [0,1,0,0,0,0|2,0,0]=3 1051 B8R0.6 CCCCCC(C)CBr Amb26013045 [0,1,0,0,0,0|3,0,0]=4 1052 B8R0.6 CCCCCC(C)CC Amb22229361 [0,1,0,0,0,0|2,0,0]=3 1053 B8R0.6 CCCCCC(C)CCl Amb24401516 [0,1,0,0,0,0|3,0,0]=4 1054 B8R0.6 CCCCCC(C)CN Amb27624450 [0,1,0,0,0,0|3,0,0]=4 1055 B8R0.6 CCCCCC(C)CO Amb21618749 [0,1,0,0,0,0|3,0,0]=4 1056 B8R0.6 CCCCCC(C)NC Amb3939451 [0,1,0,0,0,0|3,0,0]=4 1057 B8R0.6 CCCCCC(Cl)CC Amb22229245 [0,1,0,0,0,0|2,0,0]=3 1058 B8R0.6 CCCCCC(Cl)CN Amb28410342 [0,1,0,0,0,0|3,0,0]=4 1059 B8R0.6 CCCCCC(F)CN Amb24117054 [0,1,0,0,0,0|3,0,0]=4 1060 B8R0.6 CCCCCC(N)CO Amb24524295 [0,1,0,0,0,0|3,0,0]=4 1061 B8R0.6 CCCCCC(O)CF Amb22546481 [0,1,0,0,0,0|3,0,0]=4 1062 B8R0.6 CCCCCC(O)CN Amb8630208 [0,1,0,0,0,0|3,0,0]=4 1063 B8R0.6 CCCCCC(O)CO Amb22227711 [0,1,0,0,0,0|3,0,0]=4 1064 B8R0.6 CCCCCC(O)CS Amb27404970 [0,1,0,0,0,0|3,0,0]=4 1065 B8R0.6 CCCCCC(S)CN Amb27469627 [0,1,0,0,0,0|3,0,0]=4 1066 B8R0.6 CCCCCN(C)CC Amb27809466 [0,1,0,0,0,0|3,0,0]=4 1067 B8R0.6 CCCCC[C@@H](C)CO Amb28318700 [0,1,0,0,0,0|3,0,0]=4 1068 B8R0.6 CCCCC[C@@H](O)CC Amb25708717 [0,1,0,0,0,0|2,0,0]=3 1069 B8R0.6 CCCCC[C@@H](O)CO Amb28281704 [0,1,0,0,0,0|3,0,0]=4 1070 B8R0.6 CCCCC[C@H](O)CC Amb25326807 [0,1,0,0,0,0|2,0,0]=3 1071 B8R0.6 CCCCC[C@H](O)CO Amb27762354 [0,1,0,0,0,0|3,0,0]=4 1072 B8R0.6 CCCCNC(=O)CC Amb3373336 [0,1,0,0,0,0|2,0,1]=4 1073 B8R0.6 CCCCNC(=S)CC Amb27975765 [0,1,0,0,0,0|2,0,1]=4 1074 B8R0.6 CCCCNC(C)CBr Amb27652350 [0,1,0,0,0,0|3,0,0]=4 1075 B8R0.6 CCCCNC(C)CC Amb6608873 [0,1,0,0,0,0|2,0,0]=3 1076 B8R0.6 CCCCN[C@@H](C)CN Amb27272617 [0,1,0,0,0,0|3,0,0]=4 1077 B8R0.6 CCCCN[C@H](C)CN Amb27236730 [0,1,0,0,0,0|3,0,0]=4 1078 B8R0.6 CCCCOC(C)CBr Amb27985886 [0,1,0,0,0,0|2,1,0]=4 1079 B8R0.6 CCCCOC(C)CCl Amb27777639 [0,1,0,0,0,0|2,1,0]=4 1080 B8R0.6 CCCCOC(C)CO Amb24712962 [0,1,0,0,0,0|2,1,0]=4 1081 B8R0.6 CCCCOC(O)CC Amb28429916 [0,1,0,0,0,0|1,1,0]=3 1082 B8R0.6 CCCCO[C@@H](C)CBr Amb28285274 [0,1,0,0,0,0|2,1,0]=4 1083 B8R0.6 CCCCO[C@@H](C)CO Amb27631909 [0,1,0,0,0,0|2,1,0]=4 1084 B8R0.6 CCCCSC(=O)CBr Amb27627822 [0,1,0,0,0,0|2,0,1]=4 1085 B8R0.6 CCCCSC(=O)CCl Amb27660104 [0,1,0,0,0,0|2,0,1]=4 1086 B8R0.6 CCCCSC(=S)NC Amb28119899 [0,1,0,0,0,0|2,0,1]=4 1087 B8R0.6 CCCCSC(C)CC Amb4017931 [0,1,0,0,0,0|1,0,0]=2 1088 B8R0.6 CCCNCC(C)CCl Amb27976521 [0,1,0,0,0,0|3,0,0]=4 1089 B8R0.6 CCCNCC(C)NC Amb27837459 [0,1,0,0,0,0|3,0,0]=4 1090 B8R0.6 CCCNCC(Cl)CC Amb27856521 [0,1,0,0,0,0|2,0,0]=3 1091 B8R0.6 CCCNCC(N)CC Amb25918794 [0,1,0,0,0,0|2,0,0]=3 1092 B8R0.6 CCCNCC(O)CCl Amb27267938 [0,1,0,0,0,0|3,0,0]=4 1093 B8R0.6 CCCNCC(O)CF Amb28254417 [0,1,0,0,0,0|3,0,0]=4 1094 B8R0.6 CCCNCC(O)CO Amb8854777 [0,1,0,0,0,0|3,0,0]=4 1095 B8R0.6 CCCNC[C@@H](O)CC Amb27662024 [0,1,0,0,0,0|2,0,0]=3 1096 B8R0.6 CCCNC[C@@H](O)CO Amb33041826 [0,1,0,0,0,0|3,0,0]=4 1097 B8R0.6 CCCOCC(=O)CC Amb27837457 [0,1,0,0,0,0|1,1,1]=4 1098 B8R0.6 CCCOCC(Br)CCl Amb28367013 [0,1,0,0,0,0|2,1,0]=4 1099 B8R0.6 CCCOCC(C)CBr Amb24370433 [0,1,0,0,0,0|2,1,0]=4 1100 B8R0.6 CCCOCC(C)CCl Amb26053445 [0,1,0,0,0,0|2,1,0]=4 1101 B8R0.6 CCCOCC(C)CS Amb27834985 [0,1,0,0,0,0|2,1,0]=4 1102 B8R0.6 CCCOCC(Cl)CBr Amb27391140 [0,1,0,0,0,0|2,1,0]=4 1103 B8R0.6 CCCOCC(Cl)CCl Amb27657524 [0,1,0,0,0,0|2,1,0]=4 1104 B8R0.6 CCCOCC(N)CC Amb17485992 [0,1,0,0,0,0|1,1,0]=3 1105 B8R0.6 CCCOCC(N)CN Amb28312993 [0,1,0,0,0,0|2,1,0]=4 1106 B8R0.6 CCCOCC(O)CCl Amb28144574 [0,1,0,0,0,0|2,1,0]=4 1107 B8R0.6 CCCOCC(O)CO Amb10071476 [0,1,0,0,0,0|2,1,0]=4 1108 B8R0.6 CCCOC[C@@H](N)CC Amb27804406 [0,1,0,0,0,0|1,1,0]=3 1109 B8R0.6 CCCOC[C@H](N)CC Amb28139029 [0,1,0,0,0,0|1,1,0]=3 1110 B8R0.6 CCCOC[C@H](O)CO Amb28049195 [0,1,0,0,0,0|2,1,0]=4 1111 B8R0.6 CCCSCC(=O)CC Amb27837484 [0,1,0,0,0,0|1,0,1]=3 1112 B8R0.6 CCCSCC(=O)NC Amb27162536 [0,1,0,0,0,0|2,0,1]=4 1113 B8R0.6 CCCSCC(=O)OC Amb7753194 [0,1,0,0,0,0|2,0,1]=4 1114 B8R0.6 CCCSCC(C)CBr Amb28122637 [0,1,0,0,0,0|2,0,0]=3 1115 B8R0.6 CCCSCC(C)CS Amb27981763 [0,1,0,0,0,0|2,0,0]=3 1116 B8R0.6 CCCSCC(F)CC Amb28190116 [0,1,0,0,0,0|1,0,0]=2 1117 B8R0.6 CCCSCC(N)CC Amb17485961 [0,1,0,0,0,0|1,0,0]=2 1118 B8R0.6 CCCSCC(N)CO Amb28364274 [0,1,0,0,0,0|2,0,0]=3 1119 B8R0.6 CCCSCC(O)CC Amb28049075 [0,1,0,0,0,0|1,0,0]=2 1120 B8R0.6 CCCSCC(O)CO Amb27858570 [0,1,0,0,0,0|2,0,0]=3 1121 B8R0.6 CCCSC[C@@H](O)CC Amb27956460 [0,1,0,0,0,0|1,0,0]=2 1122 B8R0.6 CCC\C=C\C(=O)CC Amb26400662 [0,1,0,0,0,0|2,0,1]=4 1123 B8R0.6 CCC\C=C\C(C)CBr Amb33335692 [0,1,0,0,0,0|3,0,0]=4 1124 B8R0.6 CCC\C=C\C(C)CN Amb33327177 [0,1,0,0,0,0|3,0,0]=4 1125 B8R0.6 CCC\C=C\C(F)CN Amb33424867 [0,1,0,0,0,0|3,0,0]=4 1126 B8R0.6 CCC\C=C\C(N)CO Amb33475098 [0,1,0,0,0,0|3,0,0]=4 1127 B8R0.6 CCC\C=C\C(O)CBr Amb33335721 [0,1,0,0,0,0|3,0,0]=4 1128 B8R0.6 CCC\C=C\C(O)CC Amb27247981 [0,1,0,0,0,0|2,0,0]=3 1129 B8R0.6 CCC\C=C\C(O)CF Amb33424833 [0,1,0,0,0,0|3,0,0]=4 1130 B8R0.6 CCC\C=C\C(O)CN Amb24565967 [0,1,0,0,0,0|3,0,0]=4 1131 B8R0.6 CCC\C=C\C(O)CO Amb28458069 [0,1,0,0,0,0|3,0,0]=4 1132 B8R0.6 CCC\C=C\[C@@H](N)CO Amb33429684 [0,1,0,0,0,0|3,0,0]=4 1133 B8R0.6 CCC\C=C\[C@@H](O)CN Amb33424865 [0,1,0,0,0,0|3,0,0]=4 1134 B8R0.6 CCC\C=C\[C@H](N)CO Amb33424863 [0,1,0,0,0,0|3,0,0]=4 1135 B8R0.6 CCC\C=C\[C@H](O)CN Amb33424864 [0,1,0,0,0,0|3,0,0]=4 1136 B8R0.6 CCC\C=N\N(C)CC Amb27242325 [0,1,0,0,0,0|3,0,0]=4 1137 B8R0.6 CCN=C=NC(C)CC Amb26366388 [0,1,0,0,0,0|3,0,0]=4 1138 B8R0.6 CCNCCC(O)CC Amb27483130 [0,1,0,0,0,0|3,0,0]=4 1139 B8R0.6 CCOCSC(C)CN Amb28245692 [0,1,0,0,0,0|3,0,0]=4 1140 B8R0.6 CCSCSC(C)CO Amb27255978 [0,1,0,0,0,0|3,0,0]=4 1141 B8R0.6 CC[C@@H](C)CCCCO Amb22801082 [0,1,0,0,0,0|3,0,0]=4 1142 B8R0.6 CC[C@@H](N)CCCOC Amb27180543 [0,1,0,0,0,0|3,0,0]=4 1143 B8R0.6 CC[C@@H](N)CNCCF Amb27187234 [0,1,0,0,0,0|3,0,0]=4 1144 B8R0.6 CC[C@H](C)CCCCO Amb22226718 [0,1,0,0,0,0|3,0,0]=4 1145 B8R0.6 CC[C@H](C)OCCCBr Amb27477872 [0,1,0,0,0,0|2,1,0]=4 1146 B8R0.6 CC[C@H](C)OCCCO Amb28315453 [0,1,0,0,0,0|2,1,0]=4 1147 B8R0.6 CC\C=C\C[C@H](O)CC Amb27164460 [0,1,0,0,0,0|2,0,1]=4 1148 B8R0.6 COCCSC(C)CN Amb28049082 [0,1,0,0,0,0|3,0,0]=4 1149 B8R0.6 COCCSC(C)CO Amb27174627 [0,1,0,0,0,0|3,0,0]=4 1150 B8R0.6 CSCSCC(O)CO Amb27212112 [0,1,0,0,0,0|3,0,0]=4 1151 B8R0.6 C\C=C\CSC(C)CC Amb27615013 [0,1,0,0,0,0|1,0,2]=4 1152 B8R0.6 OCCSCC(O)CCl Amb27180291 [0,1,0,0,0,0|3,0,0]=4 1153 B8R0.6 OCCSCC(O)CF Amb27778008 [0,1,0,0,0,0|3,0,0]=4 1154 B8R0.6 OCCSCC(O)CO Amb25945811 [0,1,0,0,0,0|3,0,0]=4 1155 B8R0.7 C#CCCSCC(C)N Amb28183141 [0,1,0,0,0,0|1,0,2]=4 1156 B8R0.7 C#CCSCCC(C)C Amb27493954 [0,1,0,0,0,0|1,0,2]=4 1157 B8R0.7 C=C(C)CCCCCC Amb6298939 [0,1,0,0,0,0|2,0,1]=4 1158 B8R0.7 C=C(C)CCNCCC Amb27813957 [0,1,0,0,0,0|2,0,1]=4 1159 B8R0.7 C=C(C)CCSCCN Amb28123809 [0,1,0,0,0,0|2,0,1]=4 1160 B8R0.7 C=C(C)CNCCCC Amb17308646 [0,1,0,0,0,0|2,0,1]=4 1161 B8R0.7 C=C(C)COCCCC Amb22641495 [0,1,0,0,0,0|1,1,1]=4 1162 B8R0.7 C=C(C)CONCCC Amb28074460 [0,1,0,0,0,0|1,1,1]=4 1163 B8R0.7 C=C(C)CSCCCC Amb9787751 [0,1,0,0,0,0|1,0,1]=3 1164 B8R0.7 C=C(C)CSCCNC Amb28250295 [0,1,0,0,0,0|2,0,1]=4 1165 B8R0.7 C=C(C)CSSCCO Amb28049272 [0,1,0,0,0,0|1,0,1]=3 1166 B8R0.7 C=CCCSCC(C)N Amb28060754 [0,1,0,0,0,0|1,0,2]=4 1167 B8R0.7 C=CCSCCC(C)O Amb28315462 [0,1,0,0,0,0|1,0,2]=4 1168 B8R0.7 C=CCSSCC(C)C Amb27782635 [0,1,0,0,0,0|0,0,2]=3 1169 B8R0.7 CC#CCSCC(C)C Amb27403321 [0,1,0,0,0,0|1,0,2]=4 1170 B8R0.7 CC(=O)CSCCCF Amb28065634 [0,1,0,0,0,0|2,0,1]=4 1171 B8R0.7 CC(C)CC#CCCN Amb28285174 [0,1,0,0,0,0|3,0,0]=4 1172 B8R0.7 CC(C)CC#CCCO Amb28206065 [0,1,0,0,0,0|3,0,0]=4 1173 B8R0.7 CC(C)CCCCCBr Amb16231055 [0,1,0,0,0,0|3,0,0]=4 1174 B8R0.7 CC(C)CCCCCCl Amb27592473 [0,1,0,0,0,0|3,0,0]=4 1175 B8R0.7 CC(C)CCCCCN Amb18124327 [0,1,0,0,0,0|3,0,0]=4 1176 B8R0.7 CC(C)CCCCCO Amb22055777 [0,1,0,0,0,0|3,0,0]=4 1177 B8R0.7 CC(C)CCNCCBr Amb25721799 [0,1,0,0,0,0|3,0,0]=4 1178 B8R0.7 CC(C)CCNCCBr Amb32653537 [0,1,0,0,0,0|3,0,0]=4 1179 B8R0.7 CC(C)CCNCCI Amb28188514 [0,1,0,0,0,0|3,0,0]=4 1180 B8R0.7 CC(C)CCNCCO Amb4034535 [0,1,0,0,0,0|3,0,0]=4 1181 B8R0.7 CC(C)CCOCCBr Amb6255121 [0,1,0,0,0,0|2,1,0]=4 1182 B8R0.7 CC(C)CCOCCCl Amb9209784 [0,1,0,0,0,0|2,1,0]=4 1183 B8R0.7 CC(C)CCOCCI Amb27446465 [0,1,0,0,0,0|2,1,0]=4 1184 B8R0.7 CC(C)CCOCCN Amb6245091 [0,1,0,0,0,0|2,1,0]=4 1185 B8R0.7 CC(C)CCOCCO Amb10609610 [0,1,0,0,0,0|2,1,0]=4 1186 B8R0.7 CC(C)CCSCC=O Amb27215189 [0,1,0,0,0,0|2,0,1]=4 1187 B8R0.7 CC(C)CCSCCCl Amb24080319 [0,1,0,0,0,0|2,0,0]=3 1188 B8R0.7 CC(C)CCSCCN Amb6260831 [0,1,0,0,0,0|2,0,0]=3 1189 B8R0.7 CC(C)CNCCCBr Amb27401785 [0,1,0,0,0,0|3,0,0]=4 1190 B8R0.7 CC(C)CNCCCN Amb17315266 [0,1,0,0,0,0|3,0,0]=4 1191 B8R0.7 CC(C)CNCCCO Amb534463 [0,1,0,0,0,0|3,0,0]=4 1192 B8R0.7 CC(C)COCCCBr Amb8828212 [0,1,0,0,0,0|2,1,0]=4 1193 B8R0.7 CC(C)COCCCCl Amb6255740 [0,1,0,0,0,0|2,1,0]=4 1194 B8R0.7 CC(C)COCCCN Amb1154609 [0,1,0,0,0,0|2,1,0]=4 1195 B8R0.7 CC(C)COCCCO Amb19317273 [0,1,0,0,0,0|2,1,0]=4 1196 B8R0.7 CC(C)COCCCS Amb27842108 [0,1,0,0,0,0|2,1,0]=4 1197 B8R0.7 CC(C)CONCCF Amb28385085 [0,1,0,0,0,0|2,1,0]=4 1198 B8R0.7 CC(C)CSCCC=O Amb28043178 [0,1,0,0,0,0|2,0,1]=4 1199 B8R0.7 CC(C)CSCCCCl Amb9304955 [0,1,0,0,0,0|2,0,0]=3 1200 B8R0.7 CC(C)CSCCCN Amb9203029 [0,1,0,0,0,0|2,0,0]=3 1201 B8R0.7 CC(C)CSCCCO Amb9273779 [0,1,0,0,0,0|2,0,0]=3 1202 B8R0.7 CC(C)CSCCNN Amb27632086 [0,1,0,0,0,0|3,0,0]=4 1203 B8R0.7 CC(C)CSCCON Amb27421064 [0,1,0,0,0,0|3,0,0]=4 1204 B8R0.7 CC(C)CS\C=C\CO Amb28051939 [0,1,0,0,0,0|2,0,1]=4 1205 B8R0.7 CC(C)C\C=C\CCCl Amb27255207 [0,1,0,0,0,0|3,0,0]=4 1206 B8R0.7 CC(C)C\C=C\CCO Amb24340184 [0,1,0,0,0,0|3,0,0]=4 1207 B8R0.7 CC(C)C\C=N\CCN Amb27653243 [0,1,0,0,0,0|3,0,0]=4 1208 B8R0.7 CC(C)OCSCCN Amb27841799 [0,1,0,0,0,0|3,0,0]=4 1209 B8R0.7 CC(Cl)CCCCCO Amb27656999 [0,1,0,0,0,0|3,0,0]=4 1210 B8R0.7 CC(Cl)CCOCCCl Amb27606700 [0,1,0,0,0,0|2,1,0]=4 1211 B8R0.7 CC(Cl)CNCCCCl Amb27637862 [0,1,0,0,0,0|3,0,0]=4 1212 B8R0.7 CC(Cl)C\C=C\CCO Amb26421608 [0,1,0,0,0,0|3,0,0]=4 1213 B8R0.7 CC(F)CCCCCBr Amb27781575 [0,1,0,0,0,0|3,0,0]=4 1214 B8R0.7 CC(F)CCSCCN Amb27848652 [0,1,0,0,0,0|2,0,0]=3 1215 B8R0.7 CC(F)CSCCCN Amb27209900 [0,1,0,0,0,0|2,0,0]=3 1216 B8R0.7 CC(N)CCCCCO Amb24386350 [0,1,0,0,0,0|3,0,0]=4 1217 B8R0.7 CC(N)CNCCCF Amb27162848 [0,1,0,0,0,0|3,0,0]=4 1218 B8R0.7 CC(N)COCCCO Amb27635056 [0,1,0,0,0,0|2,1,0]=4 1219 B8R0.7 CC(N)CSCCCF Amb27223251 [0,1,0,0,0,0|2,0,0]=3 1220 B8R0.7 CC(O)CCCCCF Amb27660009 [0,1,0,0,0,0|3,0,0]=4 1221 B8R0.7 CC(O)CCCCCO Amb27464322 [0,1,0,0,0,0|3,0,0]=4 1222 B8R0.7 CC(O)CCNCCN Amb27768810 [0,1,0,0,0,0|3,0,0]=4 1223 B8R0.7 CC(O)CNCCCF Amb27273615 [0,1,0,0,0,0|3,0,0]=4 1224 B8R0.7 CC(O)CNCCCO Amb17308669 [0,1,0,0,0,0|3,0,0]=4 1225 B8R0.7 CC(O)COCCCN Amb28318924 [0,1,0,0,0,0|2,1,0]=4 1226 B8R0.7 CC(O)CSCCCS Amb27956596 [0,1,0,0,0,0|2,0,0]=3 1227 B8R0.7 CCCC#CCC(C)C Amb26876551 [0,1,0,0,0,0|2,0,0]=3 1228 B8R0.7 CCCC#CC[C@@H](C)O Amb27652867 [0,1,0,0,0,0|2,0,0]=3 1229 B8R0.7 CCCCC#CC(C)Br Amb27645420 [0,1,0,0,0,0|2,0,1]=4 1230 B8R0.7 CCCCC#CC(C)C Amb28291437 [0,1,0,0,0,0|2,0,1]=4 1231 B8R0.7 CCCCC#CC(C)O Amb27231182 [0,1,0,0,0,0|2,0,1]=4 1232 B8R0.7 CCCCC#C[C@@H](C)O Amb27835165 [0,1,0,0,0,0|2,0,1]=4 1233 B8R0.7 CCCCCCC(Br)Br Amb33299433 [0,1,0,0,0,0|3,0,0]=4 1234 B8R0.7 CCCCCCC(C)=O Amb6891961 [0,1,0,0,0,0|2,0,1]=4 1235 B8R0.7 CCCCCCC(C)Br Amb8387237 [0,1,0,0,0,0|2,0,0]=3 1236 B8R0.7 CCCCCCC(C)C Amb6366318 [0,1,0,0,0,0|2,0,0]=3 1237 B8R0.7 CCCCCCC(C)Cl Amb7795644 [0,1,0,0,0,0|2,0,0]=3 1238 B8R0.7 CCCCCCC(C)I Amb3940584 [0,1,0,0,0,0|2,0,0]=3 1239 B8R0.7 CCCCCCC(C)N Amb3940458 [0,1,0,0,0,0|2,0,0]=3 1240 B8R0.7 CCCCCCC(C)O Amb3940385 [0,1,0,0,0,0|2,0,0]=3 1241 B8R0.7 CCCCCCC(C)S Amb7795225 [0,1,0,0,0,0|2,0,0]=3 1242 B8R0.7 CCCCCCC(O)O Amb27451028 [0,1,0,0,0,0|3,0,0]=4 1243 B8R0.7 CCCCCC[C@@H](C)Br Amb26563385 [0,1,0,0,0,0|2,0,0]=3 1244 B8R0.7 CCCCCC[C@@H](C)N Amb8516401 [0,1,0,0,0,0|2,0,0]=3 1245 B8R0.7 CCCCCC[C@@H](C)O Amb8513616 [0,1,0,0,0,0|2,0,0]=3 1246 B8R0.7 CCCCCC[C@H](C)Br Amb28401131 [0,1,0,0,0,0|2,0,0]=3 1247 B8R0.7 CCCCCC[C@H](C)N Amb8516350 [0,1,0,0,0,0|2,0,0]=3 1248 B8R0.7 CCCCCNC(C)C Amb6250709 [0,1,0,0,0,0|3,0,0]=4 1249 B8R0.7 CCCCCSC(C)C Amb27197323 [0,1,0,0,0,0|3,0,0]=4 1250 B8R0.7 CCCCCSC(C)Cl Amb27477698 [0,1,0,0,0,0|3,0,0]=4 1251 B8R0.7 CCCCNCC(C)C Amb6690984 [0,1,0,0,0,0|2,0,0]=3 1252 B8R0.7 CCCCNCC(C)O Amb9246458 [0,1,0,0,0,0|2,0,0]=3 1253 B8R0.7 CCCCOCC(C)Br Amb27390173 [0,1,0,0,0,0|1,1,0]=3 1254 B8R0.7 CCCCOCC(C)C Amb26035939 [0,1,0,0,0,0|1,1,0]=3 1255 B8R0.7 CCCCOCC(C)O Amb4019960 [0,1,0,0,0,0|1,1,0]=3 1256 B8R0.7 CCCCOC[C@@H](C)N Amb27838727 [0,1,0,0,0,0|1,1,0]=3 1257 B8R0.7 CCCCOC[C@H](C)N Amb28326216 [0,1,0,0,0,0|1,1,0]=3 1258 B8R0.7 CCCCSCC(=N)N Amb9479963 [0,1,0,0,0,0|2,0,1]=4 1259 B8R0.7 CCCCSCC(=O)O Amb1138789 [0,1,0,0,0,0|2,0,1]=4 1260 B8R0.7 CCCCSCC(C)C Amb4017929 [0,1,0,0,0,0|1,0,0]=2 1261 B8R0.7 CCCCSCC(C)N Amb27772074 [0,1,0,0,0,0|1,0,0]=2 1262 B8R0.7 CCCCSCC(C)O Amb27768766 [0,1,0,0,0,0|1,0,0]=2 1263 B8R0.7 CCCC\C=C\[C@H](C)O Amb27950980 [0,1,0,0,0,0|2,0,1]=4 1264 B8R0.7 CCCC\N=C\[C@H](C)Cl Amb27401792 [0,1,0,0,0,0|2,0,1]=4 1265 B8R0.7 CCCNCCC(C)=O Amb24700442 [0,1,0,0,0,0|2,0,1]=4 1266 B8R0.7 CCCNCCC(C)C Amb6279764 [0,1,0,0,0,0|2,0,0]=3 1267 B8R0.7 CCCNCCC(F)F Amb20667932 [0,1,0,0,0,0|3,0,0]=4 1268 B8R0.7 CCCNCCC(F)F Amb26012789 [0,1,0,0,0,0|3,0,0]=4 1269 B8R0.7 CCCNCCN(C)C Amb1131117 [0,1,0,0,0,0|3,0,0]=4 1270 B8R0.7 CCCNCCN(C)C Amb19515715 [0,1,0,0,0,0|3,0,0]=4 1271 B8R0.7 CCCNCC[C@@H](C)O Amb27251174 [0,1,0,0,0,0|2,0,0]=3 1272 B8R0.7 CCCNCNC(C)C Amb28367897 [0,1,0,0,0,0|3,0,0]=4 1273 B8R0.7 CCCOCCC(C)=O Amb8874915 [0,1,0,0,0,0|1,1,1]=4 1274 B8R0.7 CCCOCCC(C)Cl Amb27768653 [0,1,0,0,0,0|1,1,0]=3 1275 B8R0.7 CCCOCCC(C)O Amb27438490 [0,1,0,0,0,0|1,1,0]=3 1276 B8R0.7 CCCONCC(C)C Amb28326057 [0,1,0,0,0,0|1,1,0]=3 1277 B8R0.7 CCCSCCC(C)C Amb28400564 [0,1,0,0,0,0|1,0,0]=2 1278 B8R0.7 CCCSCCC(N)=S Amb17503250 [0,1,0,0,0,0|2,0,1]=4 1279 B8R0.7 CCCSCCN(C)C Amb27660717 [0,1,0,0,0,0|2,0,0]=3 1280 B8R0.7 CCC\C=C/CC(C)=O Amb27974039 [0,1,0,0,0,0|2,0,1]=4 1281 B8R0.7 CCC\C=C\CC(C)=O Amb33429740 [0,1,0,0,0,0|2,0,1]=4 1282 B8R0.7 CCC\C=C\CC(C)Br Amb26397126 [0,1,0,0,0,0|2,0,0]=3 1283 B8R0.7 CCC\C=C\CC(C)Cl Amb26636688 [0,1,0,0,0,0|2,0,0]=3 1284 B8R0.7 CCC\C=C\CC(C)O Amb27766099 [0,1,0,0,0,0|2,0,0]=3 1285 B8R0.7 CCC\C=C\CN(C)O Amb33224461 [0,1,0,0,0,0|3,0,0]=4 1286 B8R0.7 CCC\C=C\C[C@@H](C)N Amb33424842 [0,1,0,0,0,0|2,0,0]=3 1287 B8R0.7 CCC\C=C\C[C@@H](C)O Amb33424840 [0,1,0,0,0,0|2,0,0]=3 1288 B8R0.7 CCC\C=C\C[C@H](C)N Amb33424841 [0,1,0,0,0,0|2,0,0]=3 1289 B8R0.7 CCC\C=C\C[C@H](C)O Amb33358968 [0,1,0,0,0,0|2,0,0]=3 1290 B8R0.7 CCNCCCC(C)Cl Amb27768830 [0,1,0,0,0,0|3,0,0]=4 1291 B8R0.7 CCOC#CCC(C)O Amb27804467 [0,1,0,0,0,0|3,0,0]=4 1292 B8R0.7 CCONCCC(C)F Amb27617250 [0,1,0,0,0,0|3,0,0]=4 1293 B8R0.7 CCSCCCC(C)C Amb27588655 [0,1,0,0,0,0|3,0,0]=4 1294 B8R0.7 CCSCCCC(C)N Amb26049335 [0,1,0,0,0,0|3,0,0]=4 1295 B8R0.7 CCSCCCC(C)O Amb26319707 [0,1,0,0,0,0|3,0,0]=4 1296 B8R0.7 CCSCCC[C@@H](C)N Amb33323737 [0,1,0,0,0,0|3,0,0]=4 1297 B8R0.7 CCSCCC[C@@H](C)O Amb33323738 [0,1,0,0,0,0|3,0,0]=4 1298 B8R0.7 CCSCCC[C@H](C)N Amb33323735 [0,1,0,0,0,0|3,0,0]=4 1299 B8R0.7 CCSCCC[C@H](C)O Amb33323739 [0,1,0,0,0,0|3,0,0]=4 1300 B8R0.7 CC\C=C/SCC(C)=O Amb24615236 [0,1,0,0,0,0|1,0,2]=4 1301 B8R0.7 CC\C=C\CCC(C)C Amb25811237 [0,1,0,0,0,0|2,0,1]=4 1302 B8R0.7 CC\C=C\CCC(C)N Amb27875423 [0,1,0,0,0,0|2,0,1]=4 1303 B8R0.7 CC\C=C\CCC(C)O Amb33079835 [0,1,0,0,0,0|2,0,1]=4 1304 B8R0.7 CC\C=C\CC[C@@H](C)N Amb33267990 [0,1,0,0,0,0|2,0,1]=4 1305 B8R0.7 CC\C=C\CC[C@@H](C)O Amb33267991 [0,1,0,0,0,0|2,0,1]=4 1306 B8R0.7 CC\C=C\CC[C@H](C)N Amb33267989 [0,1,0,0,0,0|2,0,1]=4 1307 B8R0.7 CC\C=C\CC[C@H](C)O Amb33267992 [0,1,0,0,0,0|2,0,1]=4 1308 B8R0.7 CC\C=C\NCC(C)C Amb27655952 [0,1,0,0,0,0|2,0,1]=4 1309 B8R0.7 CC\C=C\SCC(C)=O Amb28245395 [0,1,0,0,0,0|1,0,2]=4 1310 B8R0.7 CN(C)CCSCCN Amb6281250 [0,1,0,0,0,0|3,0,0]=4 1311 B8R0.7 CN(C)CCSCCO Amb9247586 [0,1,0,0,0,0|3,0,0]=4 1312 B8R0.7 CN(C)CSCCCCl Amb28061090 [0,1,0,0,0,0|3,0,0]=4 1313 B8R0.7 CNCCCCC(C)C Amb25769955 [0,1,0,0,0,0|3,0,0]=4 1314 B8R0.7 CNCCCCC(C)O Amb17569923 [0,1,0,0,0,0|3,0,0]=4 1315 B8R0.7 CNCCOCC(C)C Amb28283736 [0,1,0,0,0,0|2,1,0]=4 1316 B8R0.7 CNCCSCC(C)N Amb27248798 [0,1,0,0,0,0|2,0,0]=3 1317 B8R0.7 COCCCCC(C)N Amb17569945 [0,1,0,0,0,0|3,0,0]=4 1318 B8R0.7 COCCCCC(C)O Amb25235448 [0,1,0,0,0,0|3,0,0]=4 1319 B8R0.7 COCCCC[C@@H](C)N Amb33377489 [0,1,0,0,0,0|3,0,0]=4 1320 B8R0.7 COCCCC[C@@H](C)O Amb33377490 [0,1,0,0,0,0|3,0,0]=4 1321 B8R0.7 COCCCC[C@H](C)N Amb33377488 [0,1,0,0,0,0|3,0,0]=4 1322 B8R0.7 COCCCC[C@H](C)O Amb33377491 [0,1,0,0,0,0|3,0,0]=4 1323 B8R0.7 COCCNCC(C)C Amb6685598 [0,1,0,0,0,0|3,0,0]=4 1324 B8R0.7 COCCOCC(C)N Amb19375047 [0,1,0,0,0,0|2,1,0]=4 1325 B8R0.7 COCCOCC(C)N Amb6661949 [0,1,0,0,0,0|2,1,0]=4 1326 B8R0.7 COCCOCC(C)O Amb25939469 [0,1,0,0,0,0|2,1,0]=4 1327 B8R0.7 COCCOC[C@@H](C)N Amb27862644 [0,1,0,0,0,0|2,1,0]=4 1328 B8R0.7 COCCSCC(C)C Amb27837668 [0,1,0,0,0,0|2,0,0]=3 1329 B8R0.7 COCCSCC(C)O Amb18179365 [0,1,0,0,0,0|2,0,0]=3 1330 B8R0.7 COCCSC[C@H](C)O Amb27977734 [0,1,0,0,0,0|2,0,0]=3 1331 B8R0.7 COCSCCN(C)C Amb27772042 [0,1,0,0,0,0|3,0,0]=4 1332 B8R0.7 CSCCCCC(C)N Amb27475432 [0,1,0,0,0,0|3,0,0]=4 1333 B8R0.7 CSCCCCC(C)O Amb27863049 [0,1,0,0,0,0|3,0,0]=4 1334 B8R0.7 CSCCCC[C@@H](C)N Amb33198290 [0,1,0,0,0,0|3,0,0]=4 1335 B8R0.7 CSCCCC[C@@H](C)O Amb33198291 [0,1,0,0,0,0|3,0,0]=4 1336 B8R0.7 CSCCCC[C@H](C)N Amb33198289 [0,1,0,0,0,0|3,0,0]=4 1337 B8R0.7 CSCCCC[C@H](C)O Amb33198292 [0,1,0,0,0,0|3,0,0]=4 1338 B8R0.7 CSCCNCC(C)C Amb27452217 [0,1,0,0,0,0|3,0,0]=4 1339 B8R0.7 CSCCNC[C@@H](C)O Amb27785175 [0,1,0,0,0,0|3,0,0]=4 1340 B8R0.7 CSCCSCC(C)C Amb28454546 [0,1,0,0,0,0|2,0,0]=3 1341 B8R0.7 CSCCSC[C@@H](C)N Amb27861407 [0,1,0,0,0,0|2,0,0]=3 1342 B8R0.7 C[C@@H](N)CNCCCF Amb27956501 [0,1,0,0,0,0|3,0,0]=4 1343 B8R0.7 C[C@@H](O)CC#CCCO Amb27618252 [0,1,0,0,0,0|3,0,0]=4 1344 B8R0.7 C[C@@H](O)CCCCCO Amb28461367 [0,1,0,0,0,0|3,0,0]=4 1345 B8R0.7 C[C@H](O)CNCCCN Amb27755469 [0,1,0,0,0,0|3,0,0]=4 1346 B8R0.7 C[SiH2]CCCCC(C)O Amb28049251 [0,1,0,0,0,0|2,1,0]=4 1347 B8R0.7 C\C=C\CSCC(C)C Amb28461126 [0,1,0,0,0,0|1,0,2]=4 1348 B8R0.7 NCCSSCC(=O)O Amb27658690 [0,1,0,0,0,0|2,0,1]=4 1349 B8R0.7 [C-]#[N+]CCSCC(C)C Amb27460033 [0,1,0,0,0,0|2,0,1]=4 1350 B8R1.2 BrCC1C=CCCC1 Amb25869978 [0,0,0,1,0,0|3,0,0]=4 1351 B8R1.2 BrCC1CCCCC1 Amb3940090 [0,0,0,1,0,0|3,0,0]=4 1352 B8R1.2 BrCC1CCCCN1 Amb18128036 [0,0,0,1,0,0|3,0,0]=4 1353 B8R1.2 BrCC1CCCCN1 Amb20171159 [0,0,0,1,0,0|3,0,0]=4 1354 B8R1.2 BrCC1CCCCO1 Amb1680201 [0,0,0,1,0,0|2,1,0]=4 1355 B8R1.2 BrCC1CCCNC1 Amb22229216 [0,0,0,1,0,0|3,0,0]=4 1356 B8R1.2 BrCC1CCCNC1 Amb6316208 [0,0,0,1,0,0|3,0,0]=4 1357 B8R1.2 BrCC1CCCOC1 Amb18178619 [0,0,0,1,0,0|2,1,0]=4 1358 B8R1.2 BrCC1CCCSC1 Amb28206709 [0,0,0,1,0,0|2,0,0]=3 1359 B8R1.2 BrC[C@@H]1CCCCO1 Amb27793586 [0,0,0,1,0,0|2,1,0]=4 1360 B8R1.2 C#CC1CCCCS1 Amb33169139 [0,0,0,1,0,0|1,0,2]=4 1361 B8R1.2 C#CC1CCCSC1 Amb33169131 [0,0,0,1,0,0|1,0,2]=4 1362 B8R1.2 C=CC1CCCSC1 Amb26633444 [0,0,0,1,0,0|1,0,2]=4 1363 B8R1.2 CCC1=CCCCC1 Amb25337001 [0,0,0,1,0,0|2,0,1]=4 1364 B8R1.2 CCC1=CNCCC1 Amb27404529 [0,0,0,1,0,0|2,0,1]=4 1365 B8R1.2 CCC1=CSCCN1 Amb27838422 [0,0,0,1,0,0|2,0,1]=4 1366 B8R1.2 CCC1=NCCCS1 Amb26526830 [0,0,0,1,0,0|2,0,1]=4 1367 B8R1.2 CCC1C=CCCC1 Amb27883191 [0,0,0,1,0,0|2,0,0]=3 1368 B8R1.2 CCC1CCCCC1 Amb6296025 [0,0,0,1,0,0|2,0,0]=3 1369 B8R1.2 CCC1CCCCN1 Amb10683459 [0,0,0,1,0,0|2,0,0]=3 1370 B8R1.2 CCC1CCCCN1 Amb5716839 [0,0,0,1,0,0|2,0,0]=3 1371 B8R1.2 CCC1CCCCO1 Amb2703732 [0,0,0,1,0,0|1,1,0]=3 1372 B8R1.2 CCC1CCCNC1 Amb19516506 [0,0,0,1,0,0|2,0,0]=3 1373 B8R1.2 CCC1CCCNC1 Amb7969496 [0,0,0,1,0,0|2,0,0]=3 1374 B8R1.2 CCC1CCNC=N1 Amb35656308 [0,0,0,1,0,0|3,0,0]=4 1375 B8R1.2 CCC1CCNCC1 Amb17760296 [0,0,0,1,0,0|3,0,0]=4 1376 B8R1.2 CCC1CCNCC1 Amb19272296 [0,0,0,1,0,0|3,0,0]=4 1377 B8R1.2 CCC1CNC=CS1 Amb27446999 [0,0,0,1,0,0|2,0,1]=4 1378 B8R1.2 CCC1CNCCN1 Amb10606910 [0,0,0,1,0,0|3,0,0]=4 1379 B8R1.2 CCC1CNCCN1 Amb20240995 [0,0,0,1,0,0|3,0,0]=4 1380 B8R1.2 CCC1CNCCN1 Amb6307247 [0,0,0,1,0,0|3,0,0]=4 1381 B8R1.2 CCC1CNCCO1 Amb13951287 [0,0,0,1,0,0|2,1,0]=4 1382 B8R1.2 CCC1CNCCO1 Amb6892218 [0,0,0,1,0,0|2,1,0]=4 1383 B8R1.2 CCC1CNCCS1 Amb19149092 [0,0,0,1,0,0|2,0,0]=3 1384 B8R1.2 CCC1COCCN1 Amb21864708 [0,0,0,1,0,0|2,1,0]=4 1385 B8R1.2 CCC1COCCN1 Amb22492291 [0,0,0,1,0,0|2,1,0]=4 1386 B8R1.2 CCC1COCCN1 Amb9028259 [0,0,0,1,0,0|2,1,0]=4 1387 B8R1.2 CCC1CSCCN1 Amb18124338 [0,0,0,1,0,0|2,0,0]=3 1388 B8R1.2 CCC1NCCCN1 Amb24445855 [0,0,0,1,0,0|3,0,0]=4 1389 B8R1.2 CCC1NCCCO1 Amb17506192 [0,0,0,1,0,0|2,1,0]=4 1390 B8R1.2 CCN1CCCCC1 Amb8387388 [0,0,0,1,0,0|3,0,0]=4 1391 B8R1.2 CCN1CCCCN1 Amb27473714 [0,0,0,1,0,0|3,0,0]=4 1392 B8R1.2 CCN1CCCNC1 Amb18641821 [0,0,0,1,0,0|3,0,0]=4 1393 B8R1.2 CCN1CSCSC1 Amb22904326 [0,0,0,1,0,0|3,0,0]=4 1394 B8R1.2 CC[C@@H]1CCCCN1 Amb22892832 [0,0,0,1,0,0|2,0,0]=3 1395 B8R1.2 CC[C@@H]1CCCNC1 Amb27166756 [0,0,0,1,0,0|2,0,0]=3 1396 B8R1.2 CC[C@@H]1CNCCN1 Amb15690747 [0,0,0,1,0,0|3,0,0]=4 1397 B8R1.2 CC[C@@H]1CNCCN1 Amb6307246 [0,0,0,1,0,0|3,0,0]=4 1398 B8R1.2 CC[C@@H]1CNCCO1 Amb22736874 [0,0,0,1,0,0|2,1,0]=4 1399 B8R1.2 CC[C@@H]1CNCCO1 Amb34144519 [0,0,0,1,0,0|2,1,0]=4 1400 B8R1.2 CC[C@@H]1COCCN1 Amb20242298 [0,0,0,1,0,0|2,1,0]=4 1401 B8R1.2 CC[C@@H]1COCCN1 Amb20242895 [0,0,0,1,0,0|2,1,0]=4 1402 B8R1.2 CC[C@@H]1CSCCN1 Amb27201741 [0,0,0,1,0,0|2,0,0]=3 1403 B8R1.2 CC[C@H]1CCCCN1 Amb20241520 [0,0,0,1,0,0|2,0,0]=3 1404 B8R1.2 CC[C@H]1CCCNC1 Amb27872130 [0,0,0,1,0,0|2,0,0]=3 1405 B8R1.2 CC[C@H]1CNCCN1 Amb20671343 [0,0,0,1,0,0|3,0,0]=4 1406 B8R1.2 CC[C@H]1CNCCN1 Amb8384867 [0,0,0,1,0,0|3,0,0]=4 1407 B8R1.2 CC[C@H]1CNCCO1 Amb20242973 [0,0,0,1,0,0|2,1,0]=4 1408 B8R1.2 CC[C@H]1CNCCO1 Amb22226505 [0,0,0,1,0,0|2,1,0]=4 1409 B8R1.2 CC[C@H]1COCCN1 Amb19516643 [0,0,0,1,0,0|2,1,0]=4 1410 B8R1.2 CC[C@H]1COCCN1 Amb22226455 [0,0,0,1,0,0|2,1,0]=4 1411 B8R1.2 CC[C@H]1CSCCN1 Amb27861044 [0,0,0,1,0,0|2,0,0]=3 1412 B8R1.2 CNC1CCCCC1 Amb2720339 [0,0,0,1,0,0|3,0,0]=4 1413 B8R1.2 CNC1CCCCO1 Amb26068497 [0,0,0,1,0,0|2,1,0]=4 1414 B8R1.2 CNC1CCCNC1 Amb18276901 [0,0,0,1,0,0|3,0,0]=4 1415 B8R1.2 CNC1CCCNC1 Amb8390243 [0,0,0,1,0,0|3,0,0]=4 1416 B8R1.2 CNC1CCCOC1 Amb18641845 [0,0,0,1,0,0|2,1,0]=4 1417 B8R1.2 CNC1CCCSC1 Amb18948508 [0,0,0,1,0,0|2,0,0]=3 1418 B8R1.2 CNC1CCCSC1 Amb24271087 [0,0,0,1,0,0|2,0,0]=3 1419 B8R1.2 CN[C@H]1CCCNC1 Amb24744577 [0,0,0,1,0,0|3,0,0]=4 1420 B8R1.2 CN[C@H]1CCCNC1 Amb32671254 [0,0,0,1,0,0|3,0,0]=4 1421 B8R1.2 CN[C@H]1CCCOC1 Amb26014588 [0,0,0,1,0,0|2,1,0]=4 1422 B8R1.2 COC1C=CCCC1 Amb9787273 [0,0,0,1,0,0|3,0,0]=4 1423 B8R1.2 COC1CCCCC1 Amb4035423 [0,0,0,1,0,0|3,0,0]=4 1424 B8R1.2 COC1CCCCN1 Amb24384593 [0,0,0,1,0,0|3,0,0]=4 1425 B8R1.2 COC1CCCCO1 Amb21955138 [0,0,0,1,0,0|2,1,0]=4 1426 B8R1.2 COC1CCCNC1 Amb22586710 [0,0,0,1,0,0|3,0,0]=4 1427 B8R1.2 COC1CCCNC1 Amb33528076 [0,0,0,1,0,0|3,0,0]=4 1428 B8R1.2 COC1CCCNC1 Amb9752773 [0,0,0,1,0,0|3,0,0]=4 1429 B8R1.2 COC1CSCSC1 Amb25869870 [0,0,0,1,0,0|3,0,0]=4 1430 B8R1.2 CO[C@@H]1CCCNC1 Amb22225358 [0,0,0,1,0,0|3,0,0]=4 1431 B8R1.2 CO[C@@H]1CCCNC1 Amb31204718 [0,0,0,1,0,0|3,0,0]=4 1432 B8R1.2 CO[C@H]1CCCNC1 Amb22226700 [0,0,0,1,0,0|3,0,0]=4 1433 B8R1.2 CO[C@H]1CCCNC1 Amb22756499 [0,0,0,1,0,0|3,0,0]=4 1434 B8R1.2 CSC1CCCNC1 Amb33801787 [0,0,0,1,0,0|3,0,0]=4 1435 B8R1.2 ClCC1C=CCCC1 Amb17672830 [0,0,0,1,0,0|3,0,0]=4 1436 B8R1.2 ClCC1CCCCC1 Amb6717235 [0,0,0,1,0,0|3,0,0]=4 1437 B8R1.2 ClCC1CCCCN1 Amb18124395 [0,0,0,1,0,0|3,0,0]=4 1438 B8R1.2 ClCC1CCCCN1 Amb4021742 [0,0,0,1,0,0|3,0,0]=4 1439 B8R1.2 ClCC1CCCCO1 Amb2723692 [0,0,0,1,0,0|2,1,0]=4 1440 B8R1.2 ClCC1CCCNC1 Amb20618020 [0,0,0,1,0,0|3,0,0]=4 1441 B8R1.2 ClCC1CCCNC1 Amb22229227 [0,0,0,1,0,0|3,0,0]=4 1442 B8R1.2 ClCC1CCCOC1 Amb1102676 [0,0,0,1,0,0|2,1,0]=4 1443 B8R1.2 ClCC1CCCSC1 Amb33223993 [0,0,0,1,0,0|2,0,0]=3 1444 B8R1.2 ClCC1CSCCN1 Amb27444300 [0,0,0,1,0,0|3,0,0]=4 1445 B8R1.2 ClCC1CSCCS1 Amb27656405 [0,0,0,1,0,0|3,0,0]=4 1446 B8R1.2 ClCC1SCCCS1 Amb27235460 [0,0,0,1,0,0|3,0,0]=4 1447 B8R1.2 ClC[C@H]1CCCCO1 Amb27879106 [0,0,0,1,0,0|2,1,0]=4 1448 B8R1.2 FCC1CCCCN1 Amb13953138 [0,0,0,1,0,0|3,0,0]=4 1449 B8R1.2 FCC1CCCCN1 Amb21960708 [0,0,0,1,0,0|3,0,0]=4 1450 B8R1.2 FCC1CCCNC1 Amb13885420 [0,0,0,1,0,0|3,0,0]=4 1451 B8R1.2 FCC1CCCNC1 Amb13889108 [0,0,0,1,0,0|3,0,0]=4 1452 B8R1.2 FC[C@@H]1CCCCN1 Amb23439341 [0,0,0,1,0,0|3,0,0]=4 1453 B8R1.2 FC[C@H]1CCCCN1 Amb27225654 [0,0,0,1,0,0|3,0,0]=4 1454 B8R1.2 ICC1CCCCC1 Amb22263046 [0,0,0,1,0,0|3,0,0]=4 1455 B8R1.2 ICC1CCCCN1 Amb22228857 [0,0,0,1,0,0|3,0,0]=4 1456 B8R1.2 ICC1CCCCO1 Amb24060887 [0,0,0,1,0,0|2,1,0]=4 1457 B8R1.2 N#CC1CCCCS1 Amb24483258 [0,0,0,1,0,0|2,0,1]=4 1458 B8R1.2 N#CC1CCCSC1 Amb25702736 [0,0,0,1,0,0|2,0,1]=4 1459 B8R1.2 NCC1C=CCCC1 Amb18641664 [0,0,0,1,0,0|3,0,0]=4 1460 B8R1.2 NCC1CCCCC1 Amb1158677 [0,0,0,1,0,0|3,0,0]=4 1461 B8R1.2 NCC1CCCCN1 Amb21964855 [0,0,0,1,0,0|3,0,0]=4 1462 B8R1.2 NCC1CCCCN1 Amb8385684 [0,0,0,1,0,0|3,0,0]=4 1463 B8R1.2 NCC1CCCCO1 Amb19372867 [0,0,0,1,0,0|2,1,0]=4 1464 B8R1.2 NCC1CCCCO1 Amb2723691 [0,0,0,1,0,0|2,1,0]=4 1465 B8R1.2 NCC1CCCCS1 Amb24443454 [0,0,0,1,0,0|2,0,0]=3 1466 B8R1.2 NCC1CCCNC1 Amb8393087 [0,0,0,1,0,0|3,0,0]=4 1467 B8R1.2 NCC1CCCNC1 Amb8631270 [0,0,0,1,0,0|3,0,0]=4 1468 B8R1.2 NCC1CCCOC1 Amb10603286 [0,0,0,1,0,0|2,1,0]=4 1469 B8R1.2 NCC1CCCOC1 Amb1092537 [0,0,0,1,0,0|2,1,0]=4 1470 B8R1.2 NCC1CCCOC1 Amb22492350 [0,0,0,1,0,0|2,1,0]=4 1471 B8R1.2 NCC1CCCSC1 Amb18831922 [0,0,0,1,0,0|2,0,0]=3 1472 B8R1.2 NCC1CSCCN1 Amb33532858 [0,0,0,1,0,0|3,0,0]=4 1473 B8R1.2 NCC1CSCCO1 Amb27852369 [0,0,0,1,0,0|3,0,0]=4 1474 B8R1.2 NCC1CSCCS1 Amb20667611 [0,0,0,1,0,0|3,0,0]=4 1475 B8R1.2 NCC1SCCCS1 Amb27655686 [0,0,0,1,0,0|3,0,0]=4 1476 B8R1.2 NC[C@@H]1CCCCN1 Amb24674195 [0,0,0,1,0,0|3,0,0]=4 1477 B8R1.2 NC[C@@H]1CCCCN1 Amb32660589 [0,0,0,1,0,0|3,0,0]=4 1478 B8R1.2 NC[C@@H]1CCCCO1 Amb22225424 [0,0,0,1,0,0|2,1,0]=4 1479 B8R1.2 NC[C@@H]1CCCCO1 Amb24062887 [0,0,0,1,0,0|2,1,0]=4 1480 B8R1.2 NC[C@@H]1CCCCS1 Amb27469696 [0,0,0,1,0,0|2,0,0]=3 1481 B8R1.2 NC[C@@H]1CCCNC1 Amb2699508 [0,0,0,1,0,0|3,0,0]=4 1482 B8R1.2 NC[C@@H]1CCCOC1 Amb25849361 [0,0,0,1,0,0|2,1,0]=4 1483 B8R1.2 NC[C@@H]1CCCOC1 Amb31028901 [0,0,0,1,0,0|2,1,0]=4 1484 B8R1.2 NC[C@H]1CCCCN1 Amb24434930 [0,0,0,1,0,0|3,0,0]=4 1485 B8R1.2 NC[C@H]1CCCCN1 Amb32657137 [0,0,0,1,0,0|3,0,0]=4 1486 B8R1.2 NC[C@H]1CCCCO1 Amb22225114 [0,0,0,1,0,0|2,1,0]=4 1487 B8R1.2 NC[C@H]1CCCCO1 Amb24061931 [0,0,0,1,0,0|2,1,0]=4 1488 B8R1.2 NC[C@H]1CCCNC1 Amb2699507 [0,0,0,1,0,0|3,0,0]=4 1489 B8R1.2 NC[C@H]1CCCNC1 Amb32660927 [0,0,0,1,0,0|3,0,0]=4 1490 B8R1.2 NC[C@H]1CCCOC1 Amb24483141 [0,0,0,1,0,0|2,1,0]=4 1491 B8R1.2 NC[C@H]1CCCOC1 Amb31028900 [0,0,0,1,0,0|2,1,0]=4 1492 B8R1.2 NNC1CCCSC1 Amb27800675 [0,0,0,1,0,0|3,0,0]=4 1493 B8R1.2 NNC1CCCSC1 Amb32680286 [0,0,0,1,0,0|3,0,0]=4 1494 B8R1.2 O=CC1CCCCS1 Amb18642816 [0,0,0,1,0,0|2,0,1]=4 1495 B8R1.2 O=CC1CCCSC1 Amb18642817 [0,0,0,1,0,0|2,0,1]=4 1496 B8R1.2 OCC1C=CCCC1 Amb17593156 [0,0,0,1,0,0|3,0,0]=4 1497 B8R1.2 OCC1CCCCC1 Amb3939316 [0,0,0,1,0,0|3,0,0]=4 1498 B8R1.2 OCC1CCCCN1 Amb6768986 [0,0,0,1,0,0|3,0,0]=4 1499 B8R1.2 OCC1CCCCN1 Amb9703110 [0,0,0,1,0,0|3,0,0]=4 1500 B8R1.2 OCC1CCCCO1 Amb9703167 [0,0,0,1,0,0|2,1,0]=4 1501 B8R1.2 OCC1CCCCS1 Amb20669084 [0,0,0,1,0,0|2,0,0]=3 1502 B8R1.2 OCC1CCCNC1 Amb22001796 [0,0,0,1,0,0|3,0,0]=4 1503 B8R1.2 OCC1CCCNC1 Amb2695684 [0,0,0,1,0,0|3,0,0]=4 1504 B8R1.2 OCC1CCCOC1 Amb1093253 [0,0,0,1,0,0|2,1,0]=4 1505 B8R1.2 OCC1CCCSC1 Amb18202835 [0,0,0,1,0,0|2,0,0]=3 1506 B8R1.2 OCC1CSCCN1 Amb4009237 [0,0,0,1,0,0|3,0,0]=4 1507 B8R1.2 OC[C@@H]1CCCCN1 Amb13886314 [0,0,0,1,0,0|3,0,0]=4 1508 B8R1.2 OC[C@@H]1CCCCO1 Amb24182043 [0,0,0,1,0,0|2,1,0]=4 1509 B8R1.2 OC[C@@H]1CCCNC1 Amb10603201 [0,0,0,1,0,0|3,0,0]=4 1510 B8R1.2 OC[C@@H]1CCCNC1 Amb22504548 [0,0,0,1,0,0|3,0,0]=4 1511 B8R1.2 OC[C@@H]1CCCNN1 Amb28138668 [0,0,0,1,0,0|3,0,0]=4 1512 B8R1.2 OC[C@@H]1CCCOC1 Amb27236984 [0,0,0,1,0,0|2,1,0]=4 1513 B8R1.2 OC[C@H]1CCCCN1 Amb13886286 [0,0,0,1,0,0|3,0,0]=4 1514 B8R1.2 OC[C@H]1CCCCO1 Amb25873825 [0,0,0,1,0,0|2,1,0]=4 1515 B8R1.2 OC[C@H]1CCCNC1 Amb10603243 [0,0,0,1,0,0|3,0,0]=4 1516 B8R1.2 OC[C@H]1CCCNC1 Amb22388477 [0,0,0,1,0,0|3,0,0]=4 1517 B8R1.2 OC[C@H]1CCCOC1 Amb24413844 [0,0,0,1,0,0|2,1,0]=4 1518 B8R1.2 SCC1CCCCC1 Amb6255606 [0,0,0,1,0,0|3,0,0]=4 1519 B8R1.2 SCC1CCCCN1 Amb26349710 [0,0,0,1,0,0|3,0,0]=4 1520 B8R1.2 SCC1CCCCO1 Amb23585661 [0,0,0,1,0,0|2,1,0]=4 1521 B8R1.2 SCC1CCCNC1 Amb17503130 [0,0,0,1,0,0|3,0,0]=4 1522 B8R1.2 SCC1CCCOC1 Amb26590340 [0,0,0,1,0,0|2,1,0]=4 1523 B8R1.2 SCC1CCCSC1 Amb32788278 [0,0,0,1,0,0|2,0,0]=3 1524 B8R1.2 SCC1CSCCN1 Amb27811622 [0,0,0,1,0,0|3,0,0]=4 1525 B8R1.2 [C-]#[N+]C1CCCCS1 Amb27872577 [0,0,0,1,0,0|2,0,1]=4 1526 B8R1.2 [C-]#[N+]C1CCCSC1 Amb32726266 [0,0,0,1,0,0|2,0,1]=4 1527 B8R1.2 [CH2-]CC1CCCCC1 Amb24117227 [0,0,0,1,0,0|2,0,1]=4 1528 B8R1.5 CC1CC=CCC1C Amb22364352 [0,0,0,1,0,0|2,0,0]=3 1529 B8R1.5 CC1CC=CCC1N Amb25975568 [0,0,0,1,0,0|3,0,0]=4 1530 B8R1.5 CC1CCCCC1Br Amb8835443 [0,0,0,1,0,0|3,0,0]=4 1531 B8R1.5 CC1CCCCC1C Amb8513143 [0,0,0,1,0,0|2,0,0]=3 1532 B8R1.5 CC1CCCCC1Cl Amb9205060 [0,0,0,1,0,0|3,0,0]=4 1533 B8R1.5 CC1CCCCC1N Amb9702773 [0,0,0,1,0,0|3,0,0]=4 1534 B8R1.5 CC1CCCCC1O Amb3940289 [0,0,0,1,0,0|3,0,0]=4 1535 B8R1.5 CC1CCCCC1S Amb9208050 [0,0,0,1,0,0|3,0,0]=4 1536 B8R1.5 CC1CCCCN1C Amb9787355 [0,0,0,1,0,0|3,0,0]=4 1537 B8R1.5 CC1CCCNC1C Amb1089738 [0,0,0,1,0,0|3,0,0]=4 1538 B8R1.5 CC1CCCNC1C Amb19338160 [0,0,0,1,0,0|3,0,0]=4 1539 B8R1.5 CC1CCNCC1C Amb22059495 [0,0,0,1,0,0|2,0,0]=3 1540 B8R1.5 CC1CCNCC1F Amb27476489 [0,0,0,1,0,0|3,0,0]=4 1541 B8R1.5 CC1CCNCC1F Amb32941869 [0,0,0,1,0,0|3,0,0]=4 1542 B8R1.5 CC1CCNCC1N Amb19374853 [0,0,0,1,0,0|3,0,0]=4 1543 B8R1.5 CC1CCNCC1O Amb22406220 [0,0,0,1,0,0|3,0,0]=4 1544 B8R1.5 CC1CCNCC1O Amb23440259 [0,0,0,1,0,0|3,0,0]=4 1545 B8R1.5 CC1CNCCC1Br Amb25125494 [0,0,0,1,0,0|3,0,0]=4 1546 B8R1.5 CC1CNCCC1F Amb26572956 [0,0,0,1,0,0|3,0,0]=4 1547 B8R1.5 CC1CNCCC1N Amb23440690 [0,0,0,1,0,0|3,0,0]=4 1548 B8R1.5 CC1CNCCC1O Amb33544532 [0,0,0,1,0,0|3,0,0]=4 1549 B8R1.5 CC1CNCCC1O Amb4362742 [0,0,0,1,0,0|3,0,0]=4 1550 B8R1.5 CC1CNCCC1S Amb26641892 [0,0,0,1,0,0|3,0,0]=4 1551 B8R1.5 CC1CNCCN1C Amb19148798 [0,0,0,1,0,0|3,0,0]=4 1552 B8R1.5 CC1CNCCN1C Amb22586682 [0,0,0,1,0,0|3,0,0]=4 1553 B8R1.5 CC1CNCCN1C Amb2694471 [0,0,0,1,0,0|3,0,0]=4 1554 B8R1.5 CC1COCCC1Br Amb27242904 [0,0,0,1,0,0|2,1,0]=4 1555 B8R1.5 CC1COCCC1N Amb18833016 [0,0,0,1,0,0|2,1,0]=4 1556 B8R1.5 CC1COCCC1N Amb28934837 [0,0,0,1,0,0|2,1,0]=4 1557 B8R1.5 CC1COCCC1O Amb22299437 [0,0,0,1,0,0|2,1,0]=4 1558 B8R1.5 CC1COCCC1S Amb22299438 [0,0,0,1,0,0|2,1,0]=4 1559 B8R1.5 CC1COCOC1C Amb25829514 [0,0,0,1,0,0|2,1,0]=4 1560 B8R1.5 CC1CSCCC1=O Amb26404796 [0,0,0,1,0,0|2,0,1]=4 1561 B8R1.5 CC1CSCCC1N Amb18202892 [0,0,0,1,0,0|2,0,0]=3 1562 B8R1.5 CC1CSCCC1O Amb26370414 [0,0,0,1,0,0|2,0,0]=3 1563 B8R1.5 C[C@@H]1CC=CC[C@@H]1N Amb27799251 [0,0,0,1,0,0|3,0,0]=4 1564 B8R1.5 C[C@@H]1CC=CC[C@H]1C Amb28061692 [0,0,0,1,0,0|2,0,0]=3 1565 B8R1.5 C[C@@H]1CC=CC[C@H]1N Amb24568280 [0,0,0,1,0,0|3,0,0]=4 1566 B8R1.5 C[C@@H]1CC=CC[C@H]1N Amb32721599 [0,0,0,1,0,0|3,0,0]=4 1567 B8R1.5 C[C@@H]1CC=CC[C@H]1O Amb28318165 [0,0,0,1,0,0|3,0,0]=4 1568 B8R1.5 C[C@@H]1CCCC[C@@H]1N Amb22746982 [0,0,0,1,0,0|3,0,0]=4 1569 B8R1.5 C[C@@H]1CCCC[C@@H]1N Amb22899193 [0,0,0,1,0,0|3,0,0]=4 1570 B8R1.5 C[C@@H]1CCCC[C@@H]1O Amb22801473 [0,0,0,1,0,0|3,0,0]=4 1571 B8R1.5 C[C@@H]1CCCC[C@H]1Br Amb27250883 [0,0,0,1,0,0|3,0,0]=4 1572 B8R1.5 C[C@@H]1CCCC[C@H]1C Amb22801359 [0,0,0,1,0,0|2,0,0]=3 1573 B8R1.5 C[C@@H]1CCCC[C@H]1N Amb8393225 [0,0,0,1,0,0|3,0,0]=4 1574 B8R1.5 C[C@@H]1CCCC[C@H]1O Amb2780856 [0,0,0,1,0,0|3,0,0]=4 1575 B8R1.5 C[C@@H]1CCCN[C@@H]1C Amb34912851 [0,0,0,1,0,0|3,0,0]=4 1576 B8R1.5 C[C@@H]1CCNC[C@@H]1F Amb33338925 [0,0,0,1,0,0|3,0,0]=4 1577 B8R1.5 C[C@@H]1CCNC[C@@H]1F Amb33338926 [0,0,0,1,0,0|3,0,0]=4 1578 B8R1.5 C[C@@H]1CCNC[C@@H]1N Amb32667966 [0,0,0,1,0,0|3,0,0]=4 1579 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb22886317 [0,0,0,1,0,0|3,0,0]=4 1580 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb24694415 [0,0,0,1,0,0|3,0,0]=4 1581 B8R1.5 C[C@@H]1CCNC[C@H]1N Amb26959701 [0,0,0,1,0,0|3,0,0]=4 1582 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb22886316 [0,0,0,1,0,0|3,0,0]=4 1583 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb24553941 [0,0,0,1,0,0|3,0,0]=4 1584 B8R1.5 C[C@@H]1CCOC[C@H]1O Amb28345042 [0,0,0,1,0,0|2,1,0]=4 1585 B8R1.5 C[C@@H]1CNCCN1C Amb18833029 [0,0,0,1,0,0|3,0,0]=4 1586 B8R1.5 C[C@@H]1CNCCN1C Amb22745842 [0,0,0,1,0,0|3,0,0]=4 1587 B8R1.5 C[C@@H]1CNCC[C@@H]1O Amb22232040 [0,0,0,1,0,0|3,0,0]=4 1588 B8R1.5 C[C@@H]1CNCC[C@@H]1O Amb31291752 [0,0,0,1,0,0|3,0,0]=4 1589 B8R1.5 C[C@@H]1CNCC[C@H]1O Amb22270263 [0,0,0,1,0,0|3,0,0]=4 1590 B8R1.5 C[C@@H]1CNCC[C@H]1O Amb22757834 [0,0,0,1,0,0|3,0,0]=4 1591 B8R1.5 C[C@@H]1COCC[C@@H]1N Amb22745852 [0,0,0,1,0,0|2,1,0]=4 1592 B8R1.5 C[C@@H]1COCC[C@H]1N Amb23440138 [0,0,0,1,0,0|2,1,0]=4 1593 B8R1.5 C[C@@H]1COCC[C@H]1N Amb25929881 [0,0,0,1,0,0|2,1,0]=4 1594 B8R1.5 C[C@@H]1COCN[C@H]1C Amb27469346 [0,0,0,1,0,0|2,1,0]=4 1595 B8R1.5 C[C@H]1CCCC[C@@H]1C Amb6298314 [0,0,0,1,0,0|2,0,0]=3 1596 B8R1.5 C[C@H]1CCCC[C@@H]1Cl Amb27198993 [0,0,0,1,0,0|3,0,0]=4 1597 B8R1.5 C[C@H]1CCCC[C@@H]1O Amb10842239 [0,0,0,1,0,0|3,0,0]=4 1598 B8R1.5 C[C@H]1CCCC[C@H]1Br Amb27656872 [0,0,0,1,0,0|3,0,0]=4 1599 B8R1.5 C[C@H]1CCCC[C@H]1C Amb6298877 [0,0,0,1,0,0|2,0,0]=3 1600 B8R1.5 C[C@H]1CCCC[C@H]1N Amb25911858 [0,0,0,1,0,0|3,0,0]=4 1601 B8R1.5 C[C@H]1CCCC[C@H]1N Amb33620881 [0,0,0,1,0,0|3,0,0]=4 1602 B8R1.5 C[C@H]1CCNC[C@@H]1O Amb26892110 [0,0,0,1,0,0|3,0,0]=4 1603 B8R1.5 C[C@H]1CCNC[C@@H]1O Amb33726126 [0,0,0,1,0,0|3,0,0]=4 1604 B8R1.5 C[C@H]1CCNC[C@H]1O Amb25339261 [0,0,0,1,0,0|3,0,0]=4 1605 B8R1.5 C[C@H]1CCNC[C@H]1O Amb32409390 [0,0,0,1,0,0|3,0,0]=4 1606 B8R1.5 C[C@H]1CCOC[C@H]1O Amb27484771 [0,0,0,1,0,0|2,1,0]=4 1607 B8R1.5 C[C@H]1CNCCN1C Amb22587566 [0,0,0,1,0,0|3,0,0]=4 1608 B8R1.5 C[C@H]1CNCCN1C Amb33725445 [0,0,0,1,0,0|3,0,0]=4 1609 B8R1.5 C[C@H]1CNCC[C@@H]1O Amb24059398 [0,0,0,1,0,0|3,0,0]=4 1610 B8R1.5 C[C@H]1COCC[C@@H]1N Amb27440842 [0,0,0,1,0,0|2,1,0]=4 1611 B8R1.5 C[C@H]1COCC[C@@H]1N Amb33726124 [0,0,0,1,0,0|2,1,0]=4 1612 B8R1.5 C[C@H]1COCC[C@H]1N Amb22736636 [0,0,0,1,0,0|2,1,0]=4 1613 B8R1.5 C[C@H]1COCC[C@H]1N Amb32409393 [0,0,0,1,0,0|2,1,0]=4 1614 B8R1.5 C[C@H]1CSCC[C@@H]1O Amb28286731 [0,0,0,1,0,0|2,0,0]=3 1615 B8R1.5 N[C@@H]1CCSC[C@@H]1O Amb27207385 [0,0,0,1,0,0|3,0,0]=4 1616 B8R1.5 N[C@@H]1CCSC[C@H]1O Amb27456499 [0,0,0,1,0,0|3,0,0]=4 1617 B8R1.5 N[C@H]1CCSC[C@@H]1O Amb28052492 [0,0,0,1,0,0|3,0,0]=4 1618 B8R1.5 N[C@H]1CSSC[C@@H]1N Amb27630989 [0,0,0,1,0,0|2,0,0]=3 1619 B8R1.5 OC1CCSCC1O Amb27211025 [0,0,0,1,0,0|3,0,0]=4 1620 B8R1.5 OC1CSSCC1O Amb26894783 [0,0,0,1,0,0|2,0,0]=3 1621 B8R1.5 O[C@@H]1CSSC[C@@H]1O Amb17621830 [0,0,0,1,0,0|2,0,0]=3 1622 B8R1.5 O[C@@H]1CSSC[C@H]1O Amb2747253 [0,0,0,1,0,0|2,0,0]=3 1623 B8R1.5 O[C@H]1CSSC[C@@H]1O Amb27974094 [0,0,0,1,0,0|2,0,0]=3 1624 B8R1.8 BrCCC1CCCC1 Amb18178329 [0,0,0,1,0,0|3,0,0]=4 1625 B8R1.8 BrCCC1CCCN1 Amb26066464 [0,0,0,1,0,0|3,0,0]=4 1626 B8R1.8 BrCCC1CCCN1 Amb32663240 [0,0,0,1,0,0|3,0,0]=4 1627 B8R1.8 BrCCC1CCCO1 Amb33547829 [0,0,0,1,0,0|2,1,0]=4 1628 B8R1.8 BrCCC1CCCS1 Amb33433092 [0,0,0,1,0,0|2,0,0]=3 1629 B8R1.8 BrCCC1OCCS1 Amb27634855 [0,0,0,1,0,0|3,0,0]=4 1630 B8R1.8 BrCCC1SCCS1 Amb25758690 [0,0,0,1,0,0|3,0,0]=4 1631 B8R1.8 BrCCN1CCCC1 Amb8387808 [0,0,0,1,0,0|3,0,0]=4 1632 B8R1.8 BrCCN1CCCC1 Amb8387809 [0,0,0,1,0,0|3,0,0]=4 1633 B8R1.8 BrCCN1CCCC1 Amb8631544 [0,0,0,1,0,0|3,0,0]=4 1634 B8R1.8 C#CCC1CCCS1 Amb33415830 [0,0,0,1,0,0|1,0,2]=4 1635 B8R1.8 CCCC1=NCCO1 Amb4034543 [0,0,0,1,0,0|2,1,0]=4 1636 B8R1.8 CCCC1=NCCS1 Amb9805517 [0,0,0,1,0,0|2,0,0]=3 1637 B8R1.8 CCCC1C=CCC1 Amb4019564 [0,0,0,1,0,0|2,0,1]=4 1638 B8R1.8 CCCC1CCCC1 Amb4019556 [0,0,0,1,0,0|2,0,0]=3 1639 B8R1.8 CCCC1CCCN1 Amb22587167 [0,0,0,1,0,0|2,0,0]=3 1640 B8R1.8 CCCC1CCCN1 Amb9714691 [0,0,0,1,0,0|2,0,0]=3 1641 B8R1.8 CCCC1CCNC1 Amb10607827 [0,0,0,1,0,0|3,0,0]=4 1642 B8R1.8 CCCC1CCNC1 Amb32414607 [0,0,0,1,0,0|3,0,0]=4 1643 B8R1.8 CCCC1CNCO1 Amb27391630 [0,0,0,1,0,0|2,1,0]=4 1644 B8R1.8 CCCC1NCCS1 Amb19515280 [0,0,0,1,0,0|2,0,0]=3 1645 B8R1.8 CCCC1NCCS1 Amb22059065 [0,0,0,1,0,0|2,0,0]=3 1646 B8R1.8 CCCC1OCCS1 Amb9786141 [0,0,0,1,0,0|2,0,0]=3 1647 B8R1.8 CCCN1CCCO1 Amb27589395 [0,0,0,1,0,0|1,1,0]=3 1648 B8R1.8 CCNB1CCCC1 Amb28072082 [0,0,0,1,0,0|3,0,0]=4 1649 B8R1.8 CCNC1CCCC1 Amb6250623 [0,0,0,1,0,0|3,0,0]=4 1650 B8R1.8 CCNC1CCCC1 Amb8503448 [0,0,0,1,0,0|3,0,0]=4 1651 B8R1.8 CCNC1CCCN1 Amb28133387 [0,0,0,1,0,0|3,0,0]=4 1652 B8R1.8 CCOC1=CCCC1 Amb22490985 [0,0,0,1,0,0|3,0,0]=4 1653 B8R1.8 CCOC1=NCCC1 Amb19943923 [0,0,0,1,0,0|3,0,0]=4 1654 B8R1.8 CCOC1CCCO1 Amb22228805 [0,0,0,1,0,0|2,1,0]=4 1655 B8R1.8 CCOC1OCCS1 Amb10569619 [0,0,0,1,0,0|3,0,0]=4 1656 B8R1.8 CCSC1CCCC1 Amb27764393 [0,0,0,1,0,0|3,0,0]=4 1657 B8R1.8 CNCC1=CCCC1 Amb28143077 [0,0,0,1,0,0|3,0,0]=4 1658 B8R1.8 CNCC1CCCC1 Amb13951600 [0,0,0,1,0,0|3,0,0]=4 1659 B8R1.8 CNCC1CCCC1 Amb8853677 [0,0,0,1,0,0|3,0,0]=4 1660 B8R1.8 CNCC1CCCN1 Amb17231816 [0,0,0,1,0,0|3,0,0]=4 1661 B8R1.8 CNCC1CCCN1 Amb32753028 [0,0,0,1,0,0|3,0,0]=4 1662 B8R1.8 CNCC1CCCO1 Amb33483486 [0,0,0,1,0,0|2,1,0]=4 1663 B8R1.8 CNCC1CCCO1 Amb9714028 [0,0,0,1,0,0|2,1,0]=4 1664 B8R1.8 CNCC1CCCS1 Amb27859030 [0,0,0,1,0,0|2,0,0]=3 1665 B8R1.8 CNC[C@@H]1CCCN1 Amb25189015 [0,0,0,1,0,0|3,0,0]=4 1666 B8R1.8 CNC[C@@H]1CCCN1 Amb32662530 [0,0,0,1,0,0|3,0,0]=4 1667 B8R1.8 CNC[C@@H]1CCCO1 Amb27153906 [0,0,0,1,0,0|2,1,0]=4 1668 B8R1.8 CNC[C@H]1CCCN1 Amb24763299 [0,0,0,1,0,0|3,0,0]=4 1669 B8R1.8 CNC[C@H]1CCCO1 Amb24526936 [0,0,0,1,0,0|2,1,0]=4 1670 B8R1.8 COCC1=NCCS1 Amb25761093 [0,0,0,1,0,0|3,0,0]=4 1671 B8R1.8 COCC1CCCC1 Amb25264349 [0,0,0,1,0,0|3,0,0]=4 1672 B8R1.8 COCC1CCCN1 Amb20622354 [0,0,0,1,0,0|3,0,0]=4 1673 B8R1.8 COCC1CCCN1 Amb2234472 [0,0,0,1,0,0|3,0,0]=4 1674 B8R1.8 COCN1CCCC1 Amb28281272 [0,0,0,1,0,0|3,0,0]=4 1675 B8R1.8 COC[C@@H]1CCCN1 Amb24182058 [0,0,0,1,0,0|3,0,0]=4 1676 B8R1.8 COC[C@@H]1CCCN1 Amb2713317 [0,0,0,1,0,0|3,0,0]=4 1677 B8R1.8 COC[C@H]1CCCN1 Amb22293917 [0,0,0,1,0,0|3,0,0]=4 1678 B8R1.8 COC[C@H]1CCCN1 Amb6298382 [0,0,0,1,0,0|3,0,0]=4 1679 B8R1.8 CSCC1CCCN1 Amb2237163 [0,0,0,1,0,0|3,0,0]=4 1680 B8R1.8 CSCC1CCCO1 Amb26894759 [0,0,0,1,0,0|2,1,0]=4 1681 B8R1.8 CSC[C@@H]1CCCN1 Amb27230855 [0,0,0,1,0,0|3,0,0]=4 1682 B8R1.8 ClCCC1CCCC1 Amb27452931 [0,0,0,1,0,0|3,0,0]=4 1683 B8R1.8 ClCCC1CCCO1 Amb25888267 [0,0,0,1,0,0|2,1,0]=4 1684 B8R1.8 ClCCN1CCCC1 Amb6608907 [0,0,0,1,0,0|3,0,0]=4 1685 B8R1.8 ClCCN1CCCC1 Amb8387807 [0,0,0,1,0,0|3,0,0]=4 1686 B8R1.8 ClCC[C@@H]1CCCN1 Amb27874071 [0,0,0,1,0,0|3,0,0]=4 1687 B8R1.8 ClCC[NH+]1CCCC1 Amb24113840 [0,0,0,1,0,0|3,0,0]=4 1688 B8R1.8 FCCC1CCCN1 Amb27798978 [0,0,0,1,0,0|3,0,0]=4 1689 B8R1.8 FCCN1CCCC1 Amb27837554 [0,0,0,1,0,0|3,0,0]=4 1690 B8R1.8 FCCN1CCCN1 Amb27960655 [0,0,0,1,0,0|3,0,0]=4 1691 B8R1.8 ICCC1CCCC1 Amb24383289 [0,0,0,1,0,0|3,0,0]=4 1692 B8R1.8 ICCC1CCCO1 Amb27860272 [0,0,0,1,0,0|2,1,0]=4 1693 B8R1.8 ICCN1CCCC1 Amb25057107 [0,0,0,1,0,0|3,0,0]=4 1694 B8R1.8 ICCN1CCCC1 Amb32669018 [0,0,0,1,0,0|3,0,0]=4 1695 B8R1.8 N#CCC1CCCS1 Amb33416220 [0,0,0,1,0,0|2,0,1]=4 1696 B8R1.8 NCCC1=CCCC1 Amb18641665 [0,0,0,1,0,0|3,0,0]=4 1697 B8R1.8 NCCC1=CCCC1 Amb32681165 [0,0,0,1,0,0|3,0,0]=4 1698 B8R1.8 NCCC1CCCC1 Amb1089736 [0,0,0,1,0,0|3,0,0]=4 1699 B8R1.8 NCCC1CCCC1 Amb2099819 [0,0,0,1,0,0|3,0,0]=4 1700 B8R1.8 NCCC1CCCC1 Amb7969704 [0,0,0,1,0,0|3,0,0]=4 1701 B8R1.8 NCCC1CCCN1 Amb18954128 [0,0,0,1,0,0|3,0,0]=4 1702 B8R1.8 NCCC1CCCN1 Amb32651929 [0,0,0,1,0,0|3,0,0]=4 1703 B8R1.8 NCCC1CCCO1 Amb13952618 [0,0,0,1,0,0|2,1,0]=4 1704 B8R1.8 NCCC1CCCO1 Amb9708331 [0,0,0,1,0,0|2,1,0]=4 1705 B8R1.8 NCCC1CCCS1 Amb32656287 [0,0,0,1,0,0|2,0,0]=3 1706 B8R1.8 NCCC1CCCS1 Amb32656288 [0,0,0,1,0,0|2,0,0]=3 1707 B8R1.8 NCCC1SCCS1 Amb25317389 [0,0,0,1,0,0|3,0,0]=4 1708 B8R1.8 NCCN1CCCC1 Amb10610085 [0,0,0,1,0,0|3,0,0]=4 1709 B8R1.8 NCCN1CCCC1 Amb2720335 [0,0,0,1,0,0|3,0,0]=4 1710 B8R1.8 NCCN1CCCN1 Amb27461471 [0,0,0,1,0,0|3,0,0]=4 1711 B8R1.8 NCCN1CCCO1 Amb27629498 [0,0,0,1,0,0|2,1,0]=4 1712 B8R1.8 NCC[C@@H]1CCCN1 Amb28341793 [0,0,0,1,0,0|3,0,0]=4 1713 B8R1.8 NCC[C@H]1CCCN1 Amb27984256 [0,0,0,1,0,0|3,0,0]=4 1714 B8R1.8 NCC[C@H]1CCCN1 Amb32651958 [0,0,0,1,0,0|3,0,0]=4 1715 B8R1.8 NCC[C@H]1CCCO1 Amb32664981 [0,0,0,1,0,0|2,1,0]=4 1716 B8R1.8 NCC[C@H]1CCCO1 Amb32670639 [0,0,0,1,0,0|2,1,0]=4 1717 B8R1.8 NC\C=C1/CCCS1 Amb27469674 [0,0,0,1,0,0|2,0,1]=4 1718 B8R1.8 NC\C=C1\CCCS1 Amb28059808 [0,0,0,1,0,0|2,0,1]=4 1719 B8R1.8 NNCC1CCCS1 Amb24575294 [0,0,0,1,0,0|3,0,0]=4 1720 B8R1.8 NOCC1CCCS1 Amb33415857 [0,0,0,1,0,0|3,0,0]=4 1721 B8R1.8 O=CCC1CCCS1 Amb25195330 [0,0,0,1,0,0|2,0,1]=4 1722 B8R1.8 OCCC1CCCC1 Amb2721230 [0,0,0,1,0,0|3,0,0]=4 1723 B8R1.8 OCCC1CCCN1 Amb22754588 [0,0,0,1,0,0|3,0,0]=4 1724 B8R1.8 OCCC1CCCN1 Amb8630850 [0,0,0,1,0,0|3,0,0]=4 1725 B8R1.8 OCCC1CCCO1 Amb20622383 [0,0,0,1,0,0|2,1,0]=4 1726 B8R1.8 OCCC1CCCS1 Amb25998759 [0,0,0,1,0,0|2,0,0]=3 1727 B8R1.8 OCCC1NCCS1 Amb24446611 [0,0,0,1,0,0|3,0,0]=4 1728 B8R1.8 OCCN1CCCC1 Amb22002207 [0,0,0,1,0,0|3,0,0]=4 1729 B8R1.8 OCCN1CCCC1 Amb535402 [0,0,0,1,0,0|3,0,0]=4 1730 B8R1.8 OCC[C@@H]1CCCN1 Amb8630851 [0,0,0,1,0,0|3,0,0]=4 1731 B8R1.8 OCC[C@@H]1CCCO1 Amb27836253 [0,0,0,1,0,0|2,1,0]=4 1732 B8R1.8 OCC[C@H]1CCCO1 Amb27431469 [0,0,0,1,0,0|2,1,0]=4 1733 B8R1.8 ONCC1CCCS1 Amb33416564 [0,0,0,1,0,0|3,0,0]=4 1734 B8R1.8 SCCC1CCCC1 Amb26475267 [0,0,0,1,0,0|3,0,0]=4 1735 B8R1.8 SCCC1CCCO1 Amb27220272 [0,0,0,1,0,0|2,1,0]=4 1736 B8R1.8 SCCC1CCCS1 Amb33415373 [0,0,0,1,0,0|2,0,0]=3 1737 B8R1.8 SCCN1CCCC1 Amb7776944 [0,0,0,1,0,0|3,0,0]=4 1738 B8R1.8 [C-]#[N+]CC1CCCS1 Amb33415865 [0,0,0,1,0,0|2,0,1]=4 1739 B8R1.9 CC1CC1CCCBr Amb33431531 [0,0,0,1,0,0|3,0,0]=4 1740 B8R1.9 CC1CC1CCCN Amb33224007 [0,0,0,1,0,0|3,0,0]=4 1741 B8R1.9 CC1CC1CCCO Amb33213606 [0,0,0,1,0,0|3,0,0]=4 1742 B8R1.9 CC1CC1CCCS Amb33143845 [0,0,0,1,0,0|3,0,0]=4 1743 B8R1.9 CC1CC1NCCF Amb27765088 [0,0,0,1,0,0|3,0,0]=4 1744 B8R1.9 CC1CC1NCCO Amb18298792 [0,0,0,1,0,0|3,0,0]=4 1745 B8R1.9 CC1CC1OCCN Amb33144888 [0,0,0,1,0,0|2,1,0]=4 1746 B8R1.9 CCCCC1CC1N Amb25989937 [0,0,0,1,0,0|3,0,0]=4 1747 B8R1.9 CCCC[C@@H]1C[C@@H]1Cl Amb27857045 [0,0,0,1,0,0|3,0,0]=4 1748 B8R1.9 CCCC[C@@H]1C[C@H]1N Amb27188372 [0,0,0,1,0,0|3,0,0]=4 1749 B8R1.9 CCCO[C@@H]1C[C@H]1N Amb33347099 [0,0,0,1,0,0|2,1,0]=4 1750 B8R1.9 CNCCC1CC1C Amb33359776 [0,0,0,1,0,0|3,0,0]=4 1751 B8R1.9 C[C@@H]1C[C@H]1NCCO Amb35750313 [0,0,0,1,0,0|3,0,0]=4 1752 B8R1.9 C[C@@H]1C[C@H]1OCCO Amb28430706 [0,0,0,1,0,0|2,1,0]=4 1753 B8R1.9 C[C@H]1C[C@H]1OCCCl Amb27420175 [0,0,0,1,0,0|2,1,0]=4 1754 B8R1.10 BrCCCC1CCC1 Amb25756718 [0,0,0,1,0,0|3,0,0]=4 1755 B8R1.10 BrCCCN1CCC1 Amb24412145 [0,0,0,1,0,0|3,0,0]=4 1756 B8R1.10 BrCCNC1CCC1 Amb27227343 [0,0,0,1,0,0|3,0,0]=4 1757 B8R1.10 BrCCOC1CCC1 Amb18796095 [0,0,0,1,0,0|2,1,0]=4 1758 B8R1.10 CCCCC1CCN1 Amb25353385 [0,0,0,1,0,0|3,0,0]=4 1759 B8R1.10 CCCCC1CNC1 Amb27589087 [0,0,0,1,0,0|3,0,0]=4 1760 B8R1.10 CCCNC1CCC1 Amb18989245 [0,0,0,1,0,0|2,0,0]=3 1761 B8R1.10 CCCNC1CNC1 Amb24374352 [0,0,0,1,0,0|3,0,0]=4 1762 B8R1.10 CCCNC1COC1 Amb15693523 [0,0,0,1,0,0|3,0,0]=4 1763 B8R1.10 CCCOC1CNC1 Amb18301144 [0,0,0,1,0,0|2,1,0]=4 1764 B8R1.10 CCCOC1CNC1 Amb22489787 [0,0,0,1,0,0|2,1,0]=4 1765 B8R1.10 CCNCC1CCC1 Amb33545240 [0,0,0,1,0,0|3,0,0]=4 1766 B8R1.10 CCNCC1CCC1 Amb8853715 [0,0,0,1,0,0|3,0,0]=4 1767 B8R1.10 CCSCC1CCC1 Amb27838037 [0,0,0,1,0,0|3,0,0]=4 1768 B8R1.10 CNCCC1CCC1 Amb23580285 [0,0,0,1,0,0|3,0,0]=4 1769 B8R1.10 CNCCN1CCC1 Amb26612442 [0,0,0,1,0,0|3,0,0]=4 1770 B8R1.10 CSCOC1CCC1 Amb27956432 [0,0,0,1,0,0|2,1,0]=4 1771 B8R1.10 ClCCCN1CCC1 Amb27220226 [0,0,0,1,0,0|3,0,0]=4 1772 B8R1.10 ClCCOC1CCC1 Amb25277094 [0,0,0,1,0,0|2,1,0]=4 1773 B8R1.10 ICCCC1CCC1 Amb29849579 [0,0,0,1,0,0|3,0,0]=4 1774 B8R1.10 ICCOC1CCC1 Amb35626247 [0,0,0,1,0,0|2,1,0]=4 1775 B8R1.10 NCCCC1CCC1 Amb23570814 [0,0,0,1,0,0|3,0,0]=4 1776 B8R1.10 NCCCC1CCC1 Amb28934907 [0,0,0,1,0,0|3,0,0]=4 1777 B8R1.10 NCCCN1CCC1 Amb22039460 [0,0,0,1,0,0|3,0,0]=4 1778 B8R1.10 NCCNC1CCC1 Amb18989453 [0,0,0,1,0,0|3,0,0]=4 1779 B8R1.10 NCCOC1CCC1 Amb18993208 [0,0,0,1,0,0|2,1,0]=4 1780 B8R1.10 NCCOC1CCC1 Amb28990915 [0,0,0,1,0,0|2,1,0]=4 1781 B8R1.10 NCCSC1CCC1 Amb28049037 [0,0,0,1,0,0|2,0,0]=3 1782 B8R1.10 OCCCC1CCC1 Amb23570813 [0,0,0,1,0,0|3,0,0]=4 1783 B8R1.10 OCCCN1CCC1 Amb22292344 [0,0,0,1,0,0|3,0,0]=4 1784 B8R1.10 OCCNC1CCC1 Amb18982433 [0,0,0,1,0,0|3,0,0]=4 1785 B8R1.10 OCCOC1CCC1 Amb20622528 [0,0,0,1,0,0|2,1,0]=4 1786 B8R1.10 OCCSC1CCC1 Amb27424672 [0,0,0,1,0,0|2,0,0]=3 1787 B8R1.10 SCCCC1CCC1 Amb33197136 [0,0,0,1,0,0|3,0,0]=4 1788 B8R1.10 SCCOC1CCC1 Amb27424228 [0,0,0,1,0,0|2,1,0]=4 1789 B8R1.11 CC1CCCC1CBr Amb27484135 [0,0,0,1,0,0|3,0,0]=4 1790 B8R1.11 CC1CCCC1CN Amb28990978 [0,0,0,1,0,0|3,0,0]=4 1791 B8R1.11 CC1CCCC1CN Amb33527076 [0,0,0,1,0,0|3,0,0]=4 1792 B8R1.11 CC1CCNC1CN Amb28256754 [0,0,0,1,0,0|3,0,0]=4 1793 B8R1.11 CC1CCNC1CO Amb23441154 [0,0,0,1,0,0|3,0,0]=4 1794 B8R1.11 CC1CCOC1CCl Amb27780309 [0,0,0,1,0,0|2,1,0]=4 1795 B8R1.11 CC1CCOC1CI Amb28287052 [0,0,0,1,0,0|2,1,0]=4 1796 B8R1.11 CC1CNCC1CCl Amb27467789 [0,0,0,1,0,0|3,0,0]=4 1797 B8R1.11 CC1CNCC1CN Amb2696276 [0,0,0,1,0,0|3,0,0]=4 1798 B8R1.11 CC1CNCC1CO Amb25739981 [0,0,0,1,0,0|3,0,0]=4 1799 B8R1.11 CC1CNCC1CO Amb29083427 [0,0,0,1,0,0|3,0,0]=4 1800 B8R1.11 CC1COCC1CBr Amb35616316 [0,0,0,1,0,0|2,1,0]=4 1801 B8R1.11 CC1COCC1CCl Amb25889386 [0,0,0,1,0,0|2,1,0]=4 1802 B8R1.11 CC1COCC1CO Amb23399676 [0,0,0,1,0,0|2,1,0]=4 1803 B8R1.11 CCC1=CCCC1C Amb26515704 [0,0,0,1,0,0|2,0,1]=4 1804 B8R1.11 CCC1=NCCC1C Amb26621065 [0,0,0,1,0,0|2,0,1]=4 1805 B8R1.11 CCC1C=CCC1Br Amb27794804 [0,0,0,1,0,0|3,0,0]=4 1806 B8R1.11 CCC1CCCC1C Amb25788505 [0,0,0,1,0,0|2,0,0]=3 1807 B8R1.11 CCC1CCCC1N Amb9776220 [0,0,0,1,0,0|3,0,0]=4 1808 B8R1.11 CCC1CCCC1O Amb20621081 [0,0,0,1,0,0|3,0,0]=4 1809 B8R1.11 CCC1CCCC1S Amb24759652 [0,0,0,1,0,0|3,0,0]=4 1810 B8R1.11 CCC1CCNC1C Amb28934809 [0,0,0,1,0,0|3,0,0]=4 1811 B8R1.11 CCC1CNCC1C Amb28346924 [0,0,0,1,0,0|2,0,0]=3 1812 B8R1.11 CCC1CNCC1F Amb27167810 [0,0,0,1,0,0|3,0,0]=4 1813 B8R1.11 CCC1CNCC1N Amb26993384 [0,0,0,1,0,0|3,0,0]=4 1814 B8R1.11 CCC1CNCC1O Amb28245846 [0,0,0,1,0,0|3,0,0]=4 1815 B8R1.11 CCC1COCC1Br Amb35736875 [0,0,0,1,0,0|2,1,0]=4 1816 B8R1.11 CCC1COCC1Cl Amb35631935 [0,0,0,1,0,0|2,1,0]=4 1817 B8R1.11 CCC1COCC1N Amb29866237 [0,0,0,1,0,0|2,1,0]=4 1818 B8R1.11 CCC1COCC1O Amb24675632 [0,0,0,1,0,0|2,1,0]=4 1819 B8R1.11 CCC1COCC1S Amb32788757 [0,0,0,1,0,0|2,1,0]=4 1820 B8R1.11 CCC1CSCC1Cl Amb28316137 [0,0,0,1,0,0|2,0,0]=3 1821 B8R1.11 CCC1CSCC1N Amb18202902 [0,0,0,1,0,0|2,0,0]=3 1822 B8R1.11 CCC1CSCC1O Amb28316138 [0,0,0,1,0,0|2,0,0]=3 1823 B8R1.11 CCC1NCCC1C Amb28934808 [0,0,0,1,0,0|2,0,0]=3 1824 B8R1.11 CCC1NCCC1N Amb18203353 [0,0,0,1,0,0|3,0,0]=4 1825 B8R1.11 CCC1NCCC1O Amb18833009 [0,0,0,1,0,0|3,0,0]=4 1826 B8R1.11 CCC1NCCC1O Amb32411997 [0,0,0,1,0,0|3,0,0]=4 1827 B8R1.11 CCC1NN=CC1C Amb27204804 [0,0,0,1,0,0|2,0,1]=4 1828 B8R1.11 CCC1OCCC1N Amb25702085 [0,0,0,1,0,0|2,1,0]=4 1829 B8R1.11 CCC1OCCC1O Amb27197541 [0,0,0,1,0,0|2,1,0]=4 1830 B8R1.11 CCC1SCCC1=O Amb27825839 [0,0,0,1,0,0|2,0,1]=4 1831 B8R1.11 CCC1SCCC1Br Amb28285217 [0,0,0,1,0,0|2,0,0]=3 1832 B8R1.11 CCC1SCCC1O Amb27409767 [0,0,0,1,0,0|2,0,0]=3 1833 B8R1.11 CC[C@@H]1C=CC[C@H]1Br Amb27965412 [0,0,0,1,0,0|3,0,0]=4 1834 B8R1.11 CC[C@@H]1C=CC[C@H]1O Amb27208141 [0,0,0,1,0,0|3,0,0]=4 1835 B8R1.11 CC[C@@H]1CCC[C@@H]1N Amb27786242 [0,0,0,1,0,0|3,0,0]=4 1836 B8R1.11 CC[C@@H]1CCC[C@H]1N Amb27786896 [0,0,0,1,0,0|3,0,0]=4 1837 B8R1.11 CC[C@@H]1CCC[C@H]1O Amb26421340 [0,0,0,1,0,0|3,0,0]=4 1838 B8R1.11 CC[C@@H]1CNC[C@@H]1N Amb25186818 [0,0,0,1,0,0|3,0,0]=4 1839 B8R1.11 CC[C@@H]1CNC[C@H]1N Amb27627282 [0,0,0,1,0,0|3,0,0]=4 1840 B8R1.11 CC[C@@H]1CNC[C@H]1O Amb24560816 [0,0,0,1,0,0|3,0,0]=4 1841 B8R1.11 CC[C@@H]1COC[C@H]1O Amb32944586 [0,0,0,1,0,0|2,1,0]=4 1842 B8R1.11 CC[C@@H]1NCC[C@H]1C Amb18833052 [0,0,0,1,0,0|2,0,0]=3 1843 B8R1.11 CC[C@@H]1NCC[C@H]1O Amb25168928 [0,0,0,1,0,0|3,0,0]=4 1844 B8R1.11 CC[C@@H]1NCC[C@H]1O Amb33379057 [0,0,0,1,0,0|3,0,0]=4 1845 B8R1.11 CC[C@@H]1OCC[C@H]1Br Amb27634877 [0,0,0,1,0,0|2,1,0]=4 1846 B8R1.11 CC[C@@H]1OCC[C@H]1N Amb24401717 [0,0,0,1,0,0|2,1,0]=4 1847 B8R1.11 CC[C@H]1C=CC[C@@H]1O Amb27653157 [0,0,0,1,0,0|3,0,0]=4 1848 B8R1.11 CC[C@H]1CCC[C@@H]1C Amb26430749 [0,0,0,1,0,0|2,0,0]=3 1849 B8R1.11 CC[C@H]1CCC[C@H]1C Amb28194950 [0,0,0,1,0,0|2,0,0]=3 1850 B8R1.11 CC[C@H]1CNC[C@H]1O Amb27459736 [0,0,0,1,0,0|3,0,0]=4 1851 B8R1.11 CC[C@H]1OCC[C@H]1O Amb28435763 [0,0,0,1,0,0|2,1,0]=4 1852 B8R1.11 CC[C@H]1SCC[C@H]1O Amb27625677 [0,0,0,1,0,0|2,0,0]=3 1853 B8R1.11 CN1CSCC1CO Amb28145118 [0,0,0,1,0,0|3,0,0]=4 1854 B8R1.11 CNC1CCCC1C Amb18276776 [0,0,0,1,0,0|3,0,0]=4 1855 B8R1.11 CNC1COCC1C Amb35632266 [0,0,0,1,0,0|2,1,0]=4 1856 B8R1.11 CNC1CSCC1C Amb27234038 [0,0,0,1,0,0|2,0,0]=3 1857 B8R1.11 CN[C@@H]1CNC[C@H]1C Amb28388700 [0,0,0,1,0,0|3,0,0]=4 1858 B8R1.11 COC1SCCC1Br Amb27794715 [0,0,0,1,0,0|3,0,0]=4 1859 B8R1.11 C[C@@H]1CCC[C@H]1CBr Amb24603453 [0,0,0,1,0,0|3,0,0]=4 1860 B8R1.11 C[C@@H]1CCC[C@H]1CO Amb25258782 [0,0,0,1,0,0|3,0,0]=4 1861 B8R1.11 C[C@@H]1CCO[C@@H]1CBr Amb33328854 [0,0,0,1,0,0|2,1,0]=4 1862 B8R1.11 C[C@@H]1CCO[C@@H]1CN Amb33329080 [0,0,0,1,0,0|2,1,0]=4 1863 B8R1.11 C[C@@H]1CCO[C@@H]1CN Amb33331033 [0,0,0,1,0,0|2,1,0]=4 1864 B8R1.11 C[C@@H]1CCO[C@@H]1CO Amb33328615 [0,0,0,1,0,0|2,1,0]=4 1865 B8R1.11 C[C@@H]1CNC[C@H]1CN Amb28062618 [0,0,0,1,0,0|3,0,0]=4 1866 B8R1.11 C[C@@H]1CNC[C@H]1CO Amb13883444 [0,0,0,1,0,0|3,0,0]=4 1867 B8R1.11 C[C@@H]1COC[C@H]1CO Amb28346310 [0,0,0,1,0,0|2,1,0]=4 1868 B8R1.11 C[C@H]1CCC[C@@H]1CN Amb28423931 [0,0,0,1,0,0|3,0,0]=4 1869 B8R1.11 C[C@H]1CCN[C@@H]1CO Amb27631283 [0,0,0,1,0,0|3,0,0]=4 1870 B8R1.11 C[C@H]1CNC[C@@H]1CO Amb22232058 [0,0,0,1,0,0|3,0,0]=4 1871 B8R1.11 C[C@H]1CNC[C@@H]1CO Amb34159412 [0,0,0,1,0,0|3,0,0]=4 1872 B8R1.11 C[C@H]1CNC[C@H]1CN Amb32672061 [0,0,0,1,0,0|3,0,0]=4 1873 B8R1.11 NCC1CSCC1O Amb18203161 [0,0,0,1,0,0|3,0,0]=4 1874 B8R1.12 CCC1C=CC1CO Amb28285219 [0,0,0,1,0,0|3,0,0]=4 1875 B8R1.12 CCC1CCC1CBr Amb33512084 [0,0,0,1,0,0|3,0,0]=4 1876 B8R1.12 CCC1CCC1CN Amb24483083 [0,0,0,1,0,0|3,0,0]=4 1877 B8R1.12 CCC1CCC1NC Amb27247645 [0,0,0,1,0,0|3,0,0]=4 1878 B8R1.12 CCC1CCN1CC Amb27833239 [0,0,0,1,0,0|3,0,0]=4 1879 B8R1.12 CCC1COC1CO Amb25948271 [0,0,0,1,0,0|2,1,0]=4 1880 B8R1.13 CC1CCC1CCN Amb28049312 [0,0,0,1,0,0|3,0,0]=4 1881 B8R1.13 CCCC1CCC1O Amb24359183 [0,0,0,1,0,0|3,0,0]=4 1882 B8R1.13 CCCC1SCC1O Amb27803103 [0,0,0,1,0,0|2,0,0]=3 1883 B8R1.17 CCC1C[C@H]1CCO Amb28429951 [0,0,0,1,0,0|3,0,0]=4 1884 B8R1.17 CCC1OC1CCO Amb25144428 [0,0,0,1,0,0|2,1,0]=4 1885 B8R1.17 CCCC1=CC1CO Amb27804429 [0,0,0,1,0,0|3,0,0]=4 1886 B8R1.17 CCCC1CC1CC Amb25784549 [0,0,0,1,0,0|2,0,0]=3 1887 B8R1.17 CCCC1CC1NC Amb28131197 [0,0,0,1,0,0|3,0,0]=4 1888 B8R1.17 CCCC1SC1CO Amb27751937 [0,0,0,1,0,0|2,0,0]=3 1889 B8R1.17 CCC[C@@H]1C[C@H]1CN Amb33209408 [0,0,0,1,0,0|3,0,0]=4 1890 B8R1.17 CCC[C@@H]1C[C@H]1CN Amb33465479 [0,0,0,1,0,0|3,0,0]=4 1891 B8R1.17 CCC[C@@H]1C[C@H]1CO Amb24533879 [0,0,0,1,0,0|3,0,0]=4 1892 B8R1.17 CCC[C@@H]1O[C@@H]1CO Amb26564240 [0,0,0,1,0,0|2,1,0]=4 1893 B8R1.17 CCC[C@@H]1O[C@H]1CBr Amb28319242 [0,0,0,1,0,0|2,1,0]=4 1894 B8R1.17 CCC[C@H]1C[C@H]1CO Amb28345377 [0,0,0,1,0,0|3,0,0]=4 1895 B8R1.17 CCC[C@H]1S[C@@H]1CO Amb27977865 [0,0,0,1,0,0|2,0,0]=3 1896 B8R1.17 CC[C@@H]1C[C@H]1CCN Amb32697069 [0,0,0,1,0,0|3,0,0]=4 1897 B8R1.17 CC[C@@H]1O[C@H]1CCCl Amb28436373 [0,0,0,1,0,0|2,1,0]=4 1898 B8R1.17 CC[C@@H]1O[C@H]1CCN Amb27810614 [0,0,0,1,0,0|2,1,0]=4 1899 B8R1.17 CC[C@H]1O[C@@H]1CCBr Amb28247992 [0,0,0,1,0,0|2,1,0]=4 1900 B8R1.17 CC[C@H]1O[C@@H]1CCN Amb28369654 [0,0,0,1,0,0|2,1,0]=4 1901 B8R1.17 CC[C@H]1O[C@H]1CCBr Amb27640561 [0,0,0,1,0,0|2,1,0]=4 1902 B8R1.17 CC[C@H]1O[C@H]1CCCl Amb27630507 [0,0,0,1,0,0|2,1,0]=4 1903 B8R1.22 BrC1CCCCCC1 Amb3940357 [0,0,0,1,0,0|3,0,0]=4 1904 B8R1.22 BrC1CCCOCC1 Amb24753175 [0,0,0,1,0,0|2,1,0]=4 1905 B8R1.22 BrC1CCCSCC1 Amb35627432 [0,0,0,1,0,0|2,0,0]=3 1906 B8R1.22 C=C1CCCSCC1 Amb35674113 [0,0,0,1,0,0|1,0,2]=4 1907 B8R1.22 CC1CCCCCN1 Amb18943961 [0,0,0,1,0,0|3,0,0]=4 1908 B8R1.22 CC1CCCCCN1 Amb22055352 [0,0,0,1,0,0|3,0,0]=4 1909 B8R1.22 CC1CCCCCO1 Amb22364798 [0,0,0,1,0,0|3,0,0]=4 1910 B8R1.22 CC1CCCCNC1 Amb22886304 [0,0,0,1,0,0|2,0,0]=3 1911 B8R1.22 CC1CCCCNC1 Amb27202179 [0,0,0,1,0,0|2,0,0]=3 1912 B8R1.22 CC1CCCNCC1 Amb22546367 [0,0,0,1,0,0|2,0,0]=3 1913 B8R1.22 CC1CCCNCC1 Amb9316855 [0,0,0,1,0,0|2,0,0]=3 1914 B8R1.22 CC1CCCOCO1 Amb28046311 [0,0,0,1,0,0|2,1,0]=4 1915 B8R1.22 CC1CCNCCN1 Amb24053173 [0,0,0,1,0,0|3,0,0]=4 1916 B8R1.22 CC1CCNCCN1 Amb8630390 [0,0,0,1,0,0|3,0,0]=4 1917 B8R1.22 CC1CCNCCO1 Amb26412871 [0,0,0,1,0,0|3,0,0]=4 1918 B8R1.22 CC1CCNCCO1 Amb30585117 [0,0,0,1,0,0|3,0,0]=4 1919 B8R1.22 CC1CCNCCS1 Amb33530238 [0,0,0,1,0,0|3,0,0]=4 1920 B8R1.22 CC1CCOCCN1 Amb25108477 [0,0,0,1,0,0|2,1,0]=4 1921 B8R1.22 CC1CCOCCN1 Amb30585116 [0,0,0,1,0,0|2,1,0]=4 1922 B8R1.22 CC1CCSCCN1 Amb28934844 [0,0,0,1,0,0|2,0,0]=3 1923 B8R1.22 CC1CCSCCN1 Amb33540166 [0,0,0,1,0,0|2,0,0]=3 1924 B8R1.22 CC1CNCCCN1 Amb33544983 [0,0,0,1,0,0|3,0,0]=4 1925 B8R1.22 CC1CNCCCO1 Amb22886427 [0,0,0,1,0,0|3,0,0]=4 1926 B8R1.22 CC1CNCCCO1 Amb9358449 [0,0,0,1,0,0|3,0,0]=4 1927 B8R1.22 CC1CNCCCS1 Amb27238313 [0,0,0,1,0,0|3,0,0]=4 1928 B8R1.22 CC1CNCCNC1 Amb10608863 [0,0,0,1,0,0|3,0,0]=4 1929 B8R1.22 CC1CNCCNC1 Amb8630420 [0,0,0,1,0,0|3,0,0]=4 1930 B8R1.22 CC1CNCCOC1 Amb22886318 [0,0,0,1,0,0|2,1,0]=4 1931 B8R1.22 CC1CNCCOC1 Amb33545514 [0,0,0,1,0,0|2,1,0]=4 1932 B8R1.22 CC1CNCCSC1 Amb22642304 [0,0,0,1,0,0|2,0,0]=3 1933 B8R1.22 CC1COCCCN1 Amb18624880 [0,0,0,1,0,0|2,1,0]=4 1934 B8R1.22 CC1CSCCCN1 Amb25870575 [0,0,0,1,0,0|2,0,0]=3 1935 B8R1.22 CC1CSCCCN1 Amb30585125 [0,0,0,1,0,0|2,0,0]=3 1936 B8R1.22 CN1CCCCCC1 Amb22729377 [0,0,0,1,0,0|3,0,0]=4 1937 B8R1.22 CN1CCCNCC1 Amb22167533 [0,0,0,1,0,0|3,0,0]=4 1938 B8R1.22 CN1CCCNCC1 Amb3939085 [0,0,0,1,0,0|3,0,0]=4 1939 B8R1.22 C[C@@H]1CCCCCN1 Amb27391648 [0,0,0,1,0,0|3,0,0]=4 1940 B8R1.22 C[C@@H]1CCNCCO1 Amb27624211 [0,0,0,1,0,0|3,0,0]=4 1941 B8R1.22 C[C@@H]1CNCCCN1 Amb35825205 [0,0,0,1,0,0|3,0,0]=4 1942 B8R1.22 C[C@@H]1COCCCN1 Amb27881643 [0,0,0,1,0,0|2,1,0]=4 1943 B8R1.22 C[C@H]1CNCCCN1 Amb26461498 [0,0,0,1,0,0|3,0,0]=4 1944 B8R1.22 C[C@H]1CNCCCO1 Amb35752396 [0,0,0,1,0,0|3,0,0]=4 1945 B8R1.22 ClC1CCCCNC1 Amb28048243 [0,0,0,1,0,0|3,0,0]=4 1946 B8R1.22 ClC1CCCCOC1 Amb27409037 [0,0,0,1,0,0|2,1,0]=4 1947 B8R1.22 ClC1CCCOCC1 Amb27471515 [0,0,0,1,0,0|2,1,0]=4 1948 B8R1.22 ClC1CCCSCC1 Amb35650778 [0,0,0,1,0,0|2,0,0]=3 1949 B8R1.22 FC1CCCCCC1 Amb28049012 [0,0,0,1,0,0|3,0,0]=4 1950 B8R1.22 FC1CCCCNC1 Amb13953139 [0,0,0,1,0,0|3,0,0]=4 1951 B8R1.22 FC1CCCCNC1 Amb22886275 [0,0,0,1,0,0|3,0,0]=4 1952 B8R1.22 FC1CCCNCC1 Amb22886243 [0,0,0,1,0,0|3,0,0]=4 1953 B8R1.22 FC1CCCNCC1 Amb27453588 [0,0,0,1,0,0|3,0,0]=4 1954 B8R1.22 IC1CCCOCC1 Amb26563301 [0,0,0,1,0,0|2,1,0]=4 1955 B8R1.22 NC1CC=CCCC1 Amb27408037 [0,0,0,1,0,0|3,0,0]=4 1956 B8R1.22 NC1CCCCCC1 Amb2720336 [0,0,0,1,0,0|3,0,0]=4 1957 B8R1.22 NC1CCCCNC1 Amb2684433 [0,0,0,1,0,0|3,0,0]=4 1958 B8R1.22 NC1CCCCNC1 Amb8631384 [0,0,0,1,0,0|3,0,0]=4 1959 B8R1.22 NC1CCCNCC1 Amb4296999 [0,0,0,1,0,0|3,0,0]=4 1960 B8R1.22 NC1CCCOCC1 Amb33547346 [0,0,0,1,0,0|2,1,0]=4 1961 B8R1.22 NC1CCCSCC1 Amb18199477 [0,0,0,1,0,0|2,0,0]=3 1962 B8R1.22 NC1CCCSCC1 Amb33328660 [0,0,0,1,0,0|2,0,0]=3 1963 B8R1.22 NC1CSCCSC1 Amb27252120 [0,0,0,1,0,0|3,0,0]=4 1964 B8R1.22 N[C@@H]1CCCCNC1 Amb16185497 [0,0,0,1,0,0|3,0,0]=4 1965 B8R1.22 N[C@H]1CCCCNC1 Amb22744950 [0,0,0,1,0,0|3,0,0]=4 1966 B8R1.22 O=C1CCCSCC1 Amb25318842 [0,0,0,1,0,0|2,0,1]=4 1967 B8R1.22 OC1CCCCCC1 Amb3940358 [0,0,0,1,0,0|3,0,0]=4 1968 B8R1.22 OC1CCCCNC1 Amb22371121 [0,0,0,1,0,0|3,0,0]=4 1969 B8R1.22 OC1CCCCNC1 Amb22886250 [0,0,0,1,0,0|3,0,0]=4 1970 B8R1.22 OC1CCCCOC1 Amb27424901 [0,0,0,1,0,0|2,1,0]=4 1971 B8R1.22 OC1CCCNCC1 Amb19958701 [0,0,0,1,0,0|3,0,0]=4 1972 B8R1.22 OC1CCCNCC1 Amb2695607 [0,0,0,1,0,0|3,0,0]=4 1973 B8R1.22 OC1CCCOCC1 Amb18202762 [0,0,0,1,0,0|2,1,0]=4 1974 B8R1.22 OC1CCCSCC1 Amb18202861 [0,0,0,1,0,0|2,0,0]=3 1975 B8R1.22 O[C@@H]1CCCCOC1 Amb28125793 [0,0,0,1,0,0|2,1,0]=4 1976 B8R1.22 O[C@H]1CCCOCC1 Amb28058426 [0,0,0,1,0,0|2,1,0]=4 1977 B8R1.22 SC1CCCCCC1 Amb9208052 [0,0,0,1,0,0|3,0,0]=4 1978 B8R1.22 SC1CCCNCC1 Amb32788297 [0,0,0,1,0,0|3,0,0]=4 1979 B8R1.22 SC1CCCOCC1 Amb25189775 [0,0,0,1,0,0|2,1,0]=4 1980 B8R1.22 SC1CCCSCC1 Amb32788173 [0,0,0,1,0,0|2,0,0]=3 1981 B8R1.36 BrCCC#CC1CC1 Amb28458509 [0,0,0,1,0,0|3,0,0]=4 1982 B8R1.36 BrCCCCC1CC1 Amb27220703 [0,0,0,1,0,0|3,0,0]=4 1983 B8R1.36 BrCCOCC1CC1 Amb6681170 [0,0,0,1,0,0|2,1,0]=4 1984 B8R1.36 C#CCSCC1CC1 Amb28188282 [0,0,0,1,0,0|1,0,2]=4 1985 B8R1.36 CCCCCC1CC1 Amb27203905 [0,0,0,1,0,0|2,0,0]=3 1986 B8R1.36 CCCCCC1CO1 Amb19892425 [0,0,0,1,0,0|3,0,0]=4 1987 B8R1.36 CCCCC[C@@H]1CO1 Amb27862379 [0,0,0,1,0,0|3,0,0]=4 1988 B8R1.36 CCCCNC1CC1 Amb1128506 [0,0,0,1,0,0|2,0,0]=3 1989 B8R1.36 CCCCNC1CC1 Amb6892806 [0,0,0,1,0,0|2,0,0]=3 1990 B8R1.36 CCCNCC1CC1 Amb3939845 [0,0,0,1,0,0|2,0,0]=3 1991 B8R1.36 CCC\C=C\C1CO1 Amb33475203 [0,0,0,1,0,0|3,0,0]=4 1992 B8R1.36 CCC\C=C\[C@@H]1CO1 Amb33373326 [0,0,0,1,0,0|3,0,0]=4 1993 B8R1.36 CCC\C=C\[C@H]1CO1 Amb33373327 [0,0,0,1,0,0|3,0,0]=4 1994 B8R1.36 CCNCCC1CC1 Amb19018993 [0,0,0,1,0,0|3,0,0]=4 1995 B8R1.36 CNCCCC1CC1 Amb26658568 [0,0,0,1,0,0|3,0,0]=4 1996 B8R1.36 CNCCNC1CC1 Amb2691995 [0,0,0,1,0,0|3,0,0]=4 1997 B8R1.36 CNCCOC1CC1 Amb25831972 [0,0,0,1,0,0|2,1,0]=4 1998 B8R1.36 COCCNC1CC1 Amb24271078 [0,0,0,1,0,0|3,0,0]=4 1999 B8R1.36 COCCNC1CC1 Amb6247358 [0,0,0,1,0,0|3,0,0]=4 2000 B8R1.36 COCOCC1CC1 Amb27972311 [0,0,0,1,0,0|2,1,0]=4 2001 B8R1.36 ClCCCCC1CC1 Amb27422896 [0,0,0,1,0,0|3,0,0]=4 2002 B8R1.36 ClCCOCC1CC1 Amb8828487 [0,0,0,1,0,0|2,1,0]=4 2003 B8R1.36 FCCNCC1CC1 Amb27829483 [0,0,0,1,0,0|3,0,0]=4 2004 B8R1.36 ICCNCC1CC1 Amb27801832 [0,0,0,1,0,0|3,0,0]=4 2005 B8R1.36 NCCCCC1CC1 Amb18833054 [0,0,0,1,0,0|3,0,0]=4 2006 B8R1.36 NCCCNC1CC1 Amb17315307 [0,0,0,1,0,0|3,0,0]=4 2007 B8R1.36 NCCCOC1CC1 Amb28436320 [0,0,0,1,0,0|2,1,0]=4 2008 B8R1.36 NCCNCC1CC1 Amb18523825 [0,0,0,1,0,0|3,0,0]=4 2009 B8R1.36 NCCNCC1CC1 Amb30585085 [0,0,0,1,0,0|3,0,0]=4 2010 B8R1.36 NCCOCC1CC1 Amb33545837 [0,0,0,1,0,0|2,1,0]=4 2011 B8R1.36 NCCOCC1CC1 Amb6681126 [0,0,0,1,0,0|2,1,0]=4 2012 B8R1.36 NCCSCC1CC1 Amb6760936 [0,0,0,1,0,0|2,0,0]=3 2013 B8R1.36 NCC\N=C\C1CC1 Amb27599822 [0,0,0,1,0,0|3,0,0]=4 2014 B8R1.36 OCCCCC1CC1 Amb26059385 [0,0,0,1,0,0|3,0,0]=4 2015 B8R1.36 OCCCNC1CC1 Amb17317872 [0,0,0,1,0,0|3,0,0]=4 2016 B8R1.36 OCCCOC1CC1 Amb27260208 [0,0,0,1,0,0|2,1,0]=4 2017 B8R1.36 OCCCSC1CC1 Amb28284998 [0,0,0,1,0,0|2,0,0]=3 2018 B8R1.36 OCCNCC1CC1 Amb30640115 [0,0,0,1,0,0|3,0,0]=4 2019 B8R1.36 OCCNCC1CC1 Amb6707494 [0,0,0,1,0,0|3,0,0]=4 2020 B8R1.36 OCCOCC1CC1 Amb24729221 [0,0,0,1,0,0|2,1,0]=4 2021 B8R1.36 OCCSCC1CC1 Amb9423411 [0,0,0,1,0,0|2,0,0]=3 2022 B8R1.36 SCCCCC1CC1 Amb32788277 [0,0,0,1,0,0|3,0,0]=4 2023 B8R1.49 C1=CCCCCCC1 Amb8513502 [0,0,0,1,0,0|2,0,0]=3 2024 B8R1.49 C1=CCCNCCC1 Amb28346195 [0,0,0,1,0,0|3,0,0]=4 2025 B8R1.49 C1=CCNCCCC1 Amb33038369 [0,0,0,1,0,0|3,0,0]=4 2026 B8R1.49 C1=CCNCCCC1 Amb33038370 [0,0,0,1,0,0|3,0,0]=4 2027 B8R1.49 C1CCCNCCC1 Amb3997183 [0,0,0,1,0,0|2,0,0]=3 2028 B8R1.49 C1CCNCCNC1 Amb24428659 [0,0,0,1,0,0|3,0,0]=4 2029 B8R1.49 C1CNCCCNC1 Amb6740292 [0,0,0,1,0,0|3,0,0]=4 2030 B8R1.49 C1CNCCCOC1 Amb26627441 [0,0,0,1,0,0|2,1,0]=4 2031 B5R0.2 BrCCCCBr Amb2686718 [2,0,0,0,0,0|2,0,0]=4 2032 B5R0.2 BrCCCCI Amb25861429 [2,0,0,0,0,0|2,0,0]=4 2033 B5R0.2 C#CCCCC Amb4135448 [2,0,0,0,0,0|0,0,2]=4 2034 B5R0.2 C#CCSCC Amb3941533 [2,0,0,0,0,0|0,0,2]=4 2035 B5R0.2 C#NCCCC Amb31132446 [2,0,0,0,0,0|1,0,1]=4 2036 B5R0.2 C=CCCCC Amb3940497 [2,0,0,0,0,0|0,0,2]=4 2037 B5R0.2 C=CCSCC Amb6366495 [2,0,0,0,0,0|0,0,2]=4 2038 B5R0.2 C=CCSSC Amb22730604 [2,0,0,0,0,0|0,0,2]=4 2039 B5R0.2 CC#CCCC Amb8515369 [2,0,0,0,0,0|0,0,2]=4 2040 B5R0.2 CCC#CCC Amb8515372 [2,0,0,0,0,0|0,0,2]=4 2041 B5R0.2 CCCCC#N Amb6662839 [2,0,0,0,0,0|1,0,1]=4 2042 B5R0.2 CCCCC=O Amb3939655 [2,0,0,0,0,0|1,0,1]=4 2043 B5R0.2 CCCCCBr Amb3940084 [2,0,0,0,0,0|1,0,0]=3 2044 B5R0.2 CCCCCC Amb2447471 [2,0,0,0,0,0|0,0,0]=2 2045 B5R0.2 CCCCCCl Amb8514576 [2,0,0,0,0,0|1,0,0]=3 2046 B5R0.2 CCCCCF Amb10838686 [2,0,0,0,0,0|1,0,0]=3 2047 B5R0.2 CCCCCI Amb6891946 [2,0,0,0,0,0|1,0,0]=3 2048 B5R0.2 CCCCCN Amb3939830 [2,0,0,0,0,0|1,0,0]=3 2049 B5R0.2 CCCCCO Amb3939051 [2,0,0,0,0,0|1,0,0]=3 2050 B5R0.2 CCCCCS Amb8513287 [2,0,0,0,0,0|1,0,0]=3 2051 B5R0.2 CCCCC[SiH3] Amb19893989 [2,0,0,0,0,0|0,1,0]=3 2052 B5R0.2 CCCCNC Amb3939351 [2,0,0,0,0,0|1,0,0]=3 2053 B5R0.2 CCCCNN Amb1105203 [2,0,0,0,0,0|2,0,0]=4 2054 B5R0.2 CCCCNN Amb22230363 [2,0,0,0,0,0|2,0,0]=4 2055 B5R0.2 CCCCNN Amb33055062 [2,0,0,0,0,0|2,0,0]=4 2056 B5R0.2 CCCCNO Amb24686451 [2,0,0,0,0,0|2,0,0]=4 2057 B5R0.2 CCCCNO Amb32687485 [2,0,0,0,0,0|2,0,0]=4 2058 B5R0.2 CCCCON Amb17101066 [2,0,0,0,0,0|2,0,0]=4 2059 B5R0.2 CCCCON Amb6308542 [2,0,0,0,0,0|2,0,0]=4 2060 B5R0.2 CCCCSC Amb4036342 [2,0,0,0,0,0|1,0,0]=3 2061 B5R0.2 CCCNCC Amb3939843 [2,0,0,0,0,0|1,0,0]=3 2062 B5R0.2 CCCNNC Amb25283190 [2,0,0,0,0,0|2,0,0]=4 2063 B5R0.2 CCCOCBr Amb25351883 [2,0,0,0,0,0|1,1,0]=4 2064 B5R0.2 CCCOCC Amb17673668 [2,0,0,0,0,0|0,1,0]=3 2065 B5R0.2 CCCOCCl Amb22002403 [2,0,0,0,0,0|1,1,0]=4 2066 B5R0.2 CCCSCC Amb22168047 [2,0,0,0,0,0|0,0,0]=2 2067 B5R0.2 CCCSCCl Amb28146719 [2,0,0,0,0,0|1,0,0]=3 2068 B5R0.2 CCNCCBr Amb27950012 [2,0,0,0,0,0|2,0,0]=4 2069 B5R0.2 CCNCCCl Amb17334050 [2,0,0,0,0,0|2,0,0]=4 2070 B5R0.2 CCNCCCl Amb33869917 [2,0,0,0,0,0|2,0,0]=4 2071 B5R0.2 CCNCCF Amb27858242 [2,0,0,0,0,0|2,0,0]=4 2072 B5R0.2 CCNCCI Amb27856942 [2,0,0,0,0,0|2,0,0]=4 2073 B5R0.2 CCNCCN Amb6297789 [2,0,0,0,0,0|2,0,0]=4 2074 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|2,0,0]=4 2075 B5R0.2 CCNCCO Amb3940070 [2,0,0,0,0,0|2,0,0]=4 2076 B5R0.2 CCNCCP Amb27188285 [2,0,0,0,0,0|2,0,0]=4 2077 B5R0.2 CCNNCC Amb16233609 [2,0,0,0,0,0|2,0,0]=4 2078 B5R0.2 CCNOCC Amb26852166 [2,0,0,0,0,0|1,1,0]=4 2079 B5R0.2 CCNOCC Amb32655926 [2,0,0,0,0,0|1,1,0]=4 2080 B5R0.2 CCOCCBr Amb1158671 [2,0,0,0,0,0|1,1,0]=4 2081 B5R0.2 CCOCCCl Amb8390350 [2,0,0,0,0,0|1,1,0]=4 2082 B5R0.2 CCOCCI Amb25117446 [2,0,0,0,0,0|1,1,0]=4 2083 B5R0.2 CCOCCN Amb1130918 [2,0,0,0,0,0|1,1,0]=4 2084 B5R0.2 CCOCCN Amb29844456 [2,0,0,0,0,0|1,1,0]=4 2085 B5R0.2 CCOCCO Amb3939142 [2,0,0,0,0,0|1,1,0]=4 2086 B5R0.2 CCOCCS Amb9316644 [2,0,0,0,0,0|1,1,0]=4 2087 B5R0.2 CCSCC#N Amb6680684 [2,0,0,0,0,0|1,0,1]=4 2088 B5R0.2 CCSCC=O Amb17940620 [2,0,0,0,0,0|1,0,1]=4 2089 B5R0.2 CCSCCBr Amb2685158 [2,0,0,0,0,0|1,0,0]=3 2090 B5R0.2 CCSCCCl Amb3940261 [2,0,0,0,0,0|1,0,0]=3 2091 B5R0.2 CCSCCN Amb2687948 [2,0,0,0,0,0|1,0,0]=3 2092 B5R0.2 CCSCCN Amb9825826 [2,0,0,0,0,0|1,0,0]=3 2093 B5R0.2 CCSCCO Amb1085958 [2,0,0,0,0,0|1,0,0]=3 2094 B5R0.2 CCSCCS Amb27167723 [2,0,0,0,0,0|1,0,0]=3 2095 B5R0.2 CCSSCC Amb8516624 [2,0,0,0,0,0|0,0,0]=2 2096 B5R0.2 CCSSCCl Amb28350437 [2,0,0,0,0,0|1,0,0]=3 2097 B5R0.2 CCSSSC Amb25073645 [2,0,0,0,0,0|1,0,0]=3 2098 B5R0.2 CC[Se][Se]CC Amb17670683 [2,0,0,0,0,0|0,2,0]=4 2099 B5R0.2 CC\C=C/CC Amb8517211 [2,0,0,0,0,0|0,0,2]=4 2100 B5R0.2 CC\C=C\CC Amb4016243 [2,0,0,0,0,0|0,0,2]=4 2101 B5R0.2 CC\N=N/CC Amb27851864 [2,0,0,0,0,0|2,0,0]=4 2102 B5R0.2 CC\N=N\CC Amb17940073 [2,0,0,0,0,0|2,0,0]=4 2103 B5R0.2 CNCCCBr Amb28291325 [2,0,0,0,0,0|2,0,0]=4 2104 B5R0.2 CNCCCBr Amb33473632 [2,0,0,0,0,0|2,0,0]=4 2105 B5R0.2 CNCCCCl Amb22002154 [2,0,0,0,0,0|2,0,0]=4 2106 B5R0.2 CNCCCCl Amb3941419 [2,0,0,0,0,0|2,0,0]=4 2107 B5R0.2 CNCCCF Amb27405698 [2,0,0,0,0,0|2,0,0]=4 2108 B5R0.2 CNCCCN Amb2698065 [2,0,0,0,0,0|2,0,0]=4 2109 B5R0.2 CNCCCO Amb9246656 [2,0,0,0,0,0|2,0,0]=4 2110 B5R0.2 CNCCNC Amb4037059 [2,0,0,0,0,0|2,0,0]=4 2111 B5R0.2 CNCCOC Amb10609606 [2,0,0,0,0,0|2,0,0]=4 2112 B5R0.2 CNCCOC Amb2689126 [2,0,0,0,0,0|2,0,0]=4 2113 B5R0.2 CNCCSC Amb15701319 [2,0,0,0,0,0|2,0,0]=4 2114 B5R0.2 CNCCSC Amb20625111 [2,0,0,0,0,0|2,0,0]=4 2115 B5R0.2 COCCCBr Amb8828205 [2,0,0,0,0,0|2,0,0]=4 2116 B5R0.2 COCCCCl Amb6255994 [2,0,0,0,0,0|2,0,0]=4 2117 B5R0.2 COCCCF Amb22007998 [2,0,0,0,0,0|2,0,0]=4 2118 B5R0.2 COCCCI Amb33546474 [2,0,0,0,0,0|2,0,0]=4 2119 B5R0.2 COCCCN Amb3939346 [2,0,0,0,0,0|2,0,0]=4 2120 B5R0.2 COCCCO Amb8385593 [2,0,0,0,0,0|2,0,0]=4 2121 B5R0.2 COCCCS Amb13952794 [2,0,0,0,0,0|2,0,0]=4 2122 B5R0.2 COCCOC Amb6741456 [2,0,0,0,0,0|2,0,0]=4 2123 B5R0.2 COCCSC Amb4020919 [2,0,0,0,0,0|2,0,0]=4 2124 B5R0.2 CSCCCBr Amb18180189 [2,0,0,0,0,0|2,0,0]=4 2125 B5R0.2 CSCCCCl Amb10602296 [2,0,0,0,0,0|2,0,0]=4 2126 B5R0.2 CSCCCN Amb33801570 [2,0,0,0,0,0|2,0,0]=4 2127 B5R0.2 CSCCCN Amb6718923 [2,0,0,0,0,0|2,0,0]=4 2128 B5R0.2 CSCCCO Amb3939523 [2,0,0,0,0,0|2,0,0]=4 2129 B5R0.2 CSCCCS Amb25744031 [2,0,0,0,0,0|2,0,0]=4 2130 B5R0.2 CSCCSC Amb25101746 [2,0,0,0,0,0|2,0,0]=4 2131 B5R0.2 CSCSSC Amb25798526 [2,0,0,0,0,0|1,0,0]=3 2132 B5R0.2 CSSCCN Amb26850738 [2,0,0,0,0,0|1,0,0]=3 2133 B5R0.2 CSSCCN Amb32652424 [2,0,0,0,0,0|1,0,0]=3 2134 B5R0.2 C[SiH2]CCCN Amb28049027 [2,0,0,0,0,0|1,1,0]=4 2135 B5R0.2 C\C=C/CCC Amb6366719 [2,0,0,0,0,0|0,0,2]=4 2136 B5R0.2 C\C=C\SSC Amb9790327 [2,0,0,0,0,0|0,0,2]=4 2137 B5R0.2 C\C=N\CCC Amb27954749 [2,0,0,0,0,0|1,0,1]=4 2138 B5R0.2 ClCCCCBr Amb8391065 [2,0,0,0,0,0|2,0,0]=4 2139 B5R0.2 ClCCCCCl Amb6608890 [2,0,0,0,0,0|2,0,0]=4 2140 B5R0.2 ClCCCCI Amb8517518 [2,0,0,0,0,0|2,0,0]=4 2141 B5R0.2 ClCCSSBr Amb33352019 [2,0,0,0,0,0|2,0,0]=4 2142 B5R0.2 ClCCSSCl Amb25261492 [2,0,0,0,0,0|2,0,0]=4 2143 B5R0.2 FCCCCBr Amb2685210 [2,0,0,0,0,0|2,0,0]=4 2144 B5R0.2 FCCCCCl Amb27655616 [2,0,0,0,0,0|2,0,0]=4 2145 B5R0.2 FCCCCF Amb10839858 [2,0,0,0,0,0|2,0,0]=4 2146 B5R0.2 FCCCCI Amb28283837 [2,0,0,0,0,0|2,0,0]=4 2147 B5R0.2 FCCCCS Amb25065453 [2,0,0,0,0,0|2,0,0]=4 2148 B5R0.2 FCSCCCl Amb28252688 [2,0,0,0,0,0|2,0,0]=4 2149 B5R0.2 ICCCCI Amb17672573 [2,0,0,0,0,0|2,0,0]=4 2150 B5R0.2 NCCCCBr Amb21858985 [2,0,0,0,0,0|2,0,0]=4 2151 B5R0.2 NCCCCCl Amb18640687 [2,0,0,0,0,0|2,0,0]=4 2152 B5R0.2 NCCCCCl Amb22233734 [2,0,0,0,0,0|2,0,0]=4 2153 B5R0.2 NCCCCF Amb26017241 [2,0,0,0,0,0|2,0,0]=4 2154 B5R0.2 NCCCCF Amb28555328 [2,0,0,0,0,0|2,0,0]=4 2155 B5R0.2 NCCCCI Amb27837961 [2,0,0,0,0,0|2,0,0]=4 2156 B5R0.2 NCCCCN Amb22489528 [2,0,0,0,0,0|2,0,0]=4 2157 B5R0.2 NCCCCN Amb6608640 [2,0,0,0,0,0|2,0,0]=4 2158 B5R0.2 NCCCCN Amb8514498 [2,0,0,0,0,0|2,0,0]=4 2159 B5R0.2 NCCCCO Amb3939336 [2,0,0,0,0,0|2,0,0]=4 2160 B5R0.2 NCCCCS Amb17500976 [2,0,0,0,0,0|2,0,0]=4 2161 B5R0.2 NCCCCS Amb22546260 [2,0,0,0,0,0|2,0,0]=4 2162 B5R0.2 NCSSCN Amb28340867 [2,0,0,0,0,0|2,0,0]=4 2163 B5R0.2 OCCCCBr Amb8395353 [2,0,0,0,0,0|2,0,0]=4 2164 B5R0.2 OCCCCCl Amb1101976 [2,0,0,0,0,0|2,0,0]=4 2165 B5R0.2 OCCCCF Amb17593046 [2,0,0,0,0,0|2,0,0]=4 2166 B5R0.2 OCCCCO Amb2793029 [2,0,0,0,0,0|2,0,0]=4 2167 B5R0.2 SCCCCS Amb8513069 [2,0,0,0,0,0|2,0,0]=4 2168 B5R0.2 [C-]#[N+]CCCC Amb2235001 [2,0,0,0,0,0|1,0,1]=4 2169 B7R0.3 C=C(CC)CCCC Amb9787281 [1,1,0,0,0,0|1,0,1]=4 2170 B7R0.3 C=C(CC)CSCC Amb28291726 [1,1,0,0,0,0|1,0,1]=4 2171 B7R0.3 C=CCSC(C)CC Amb3940675 [1,1,0,0,0,0|0,0,2]=4 2172 B7R0.3 CC(CCl)SCCF Amb28316249 [1,1,0,0,0,0|2,0,0]=4 2173 B7R0.3 CC(CN)SCCF Amb27863124 [1,1,0,0,0,0|2,0,0]=4 2174 B7R0.3 CC(CN)SCCN Amb27265449 [1,1,0,0,0,0|2,0,0]=4 2175 B7R0.3 CC(CO)SCCO Amb27440688 [1,1,0,0,0,0|2,0,0]=4 2176 B7R0.3 CCC#CC(Br)CC Amb27232694 [1,1,0,0,0,0|1,0,1]=4 2177 B7R0.3 CCC#CC(C)CC Amb27860422 [1,1,0,0,0,0|1,0,1]=4 2178 B7R0.3 CCC#CC(O)CC Amb2721491 [1,1,0,0,0,0|1,0,1]=4 2179 B7R0.3 CCC#C[C@H](O)CC Amb28400640 [1,1,0,0,0,0|1,0,1]=4 2180 B7R0.3 CCC(=O)SCCBr Amb27865550 [1,1,0,0,0,0|1,0,1]=4 2181 B7R0.3 CCC(=S)SCCCl Amb27461164 [1,1,0,0,0,0|1,0,1]=4 2182 B7R0.3 CCC(C)CCCBr Amb18184302 [1,1,0,0,0,0|2,0,0]=4 2183 B7R0.3 CCC(C)CCCCl Amb25094579 [1,1,0,0,0,0|2,0,0]=4 2184 B7R0.3 CCC(C)CCCN Amb17569898 [1,1,0,0,0,0|2,0,0]=4 2185 B7R0.3 CCC(C)CCCO Amb28070020 [1,1,0,0,0,0|2,0,0]=4 2186 B7R0.3 CCC(C)CCCS Amb33318441 [1,1,0,0,0,0|2,0,0]=4 2187 B7R0.3 CCC(C)CCNC Amb18523839 [1,1,0,0,0,0|2,0,0]=4 2188 B7R0.3 CCC(C)NCCBr Amb27641912 [1,1,0,0,0,0|2,0,0]=4 2189 B7R0.3 CCC(C)NCCCl Amb17334146 [1,1,0,0,0,0|2,0,0]=4 2190 B7R0.3 CCC(C)NCCN Amb29844468 [1,1,0,0,0,0|2,0,0]=4 2191 B7R0.3 CCC(C)NCCN Amb4016515 [1,1,0,0,0,0|2,0,0]=4 2192 B7R0.3 CCC(C)NCCO Amb6707239 [1,1,0,0,0,0|2,0,0]=4 2193 B7R0.3 CCC(C)OCCN Amb18307952 [1,1,0,0,0,0|1,1,0]=4 2194 B7R0.3 CCC(C)OCCS Amb27228171 [1,1,0,0,0,0|1,1,0]=4 2195 B7R0.3 CCC(C)SCCN Amb6680221 [1,1,0,0,0,0|1,0,0]=3 2196 B7R0.3 CCC(C)SCCS Amb27424484 [1,1,0,0,0,0|1,0,0]=3 2197 B7R0.3 CCC(Cl)CCCCl Amb19959959 [1,1,0,0,0,0|2,0,0]=4 2198 B7R0.3 CCC(Cl)CCNC Amb27197718 [1,1,0,0,0,0|2,0,0]=4 2199 B7R0.3 CCC(Cl)CCOC Amb27811831 [1,1,0,0,0,0|2,0,0]=4 2200 B7R0.3 CCC(Cl)OCCCl Amb27803657 [1,1,0,0,0,0|1,1,0]=4 2201 B7R0.3 CCC(N)CCCN Amb27392660 [1,1,0,0,0,0|2,0,0]=4 2202 B7R0.3 CCC(N)CCCO Amb18641929 [1,1,0,0,0,0|2,0,0]=4 2203 B7R0.3 CCC(N)CCNC Amb28048985 [1,1,0,0,0,0|2,0,0]=4 2204 B7R0.3 CCC(N)CCOC Amb19016193 [1,1,0,0,0,0|2,0,0]=4 2205 B7R0.3 CCC(N)CCSC Amb28048993 [1,1,0,0,0,0|2,0,0]=4 2206 B7R0.3 CCC(N)NCCN Amb27438454 [1,1,0,0,0,0|2,0,0]=4 2207 B7R0.3 CCC(O)CCCN Amb18202667 [1,1,0,0,0,0|2,0,0]=4 2208 B7R0.3 CCC(O)CCCN Amb19374975 [1,1,0,0,0,0|2,0,0]=4 2209 B7R0.3 CCC(O)CCCO Amb17593216 [1,1,0,0,0,0|2,0,0]=4 2210 B7R0.3 CCC(O)CCOC Amb22058972 [1,1,0,0,0,0|2,0,0]=4 2211 B7R0.3 CCCCC(=O)CC Amb4605999 [1,1,0,0,0,0|1,0,1]=4 2212 B7R0.3 CCCCC(Br)CBr Amb8517633 [1,1,0,0,0,0|2,0,0]=4 2213 B7R0.3 CCCCC(Br)CC Amb18804679 [1,1,0,0,0,0|1,0,0]=3 2214 B7R0.3 CCCCC(Br)CF Amb28410717 [1,1,0,0,0,0|2,0,0]=4 2215 B7R0.3 CCCCC(C)CBr Amb22227886 [1,1,0,0,0,0|2,0,0]=4 2216 B7R0.3 CCCCC(C)CC Amb10071971 [1,1,0,0,0,0|1,0,0]=3 2217 B7R0.3 CCCCC(C)CCl Amb24481359 [1,1,0,0,0,0|2,0,0]=4 2218 B7R0.3 CCCCC(C)CN Amb18311071 [1,1,0,0,0,0|2,0,0]=4 2219 B7R0.3 CCCCC(C)CO Amb17593205 [1,1,0,0,0,0|2,0,0]=4 2220 B7R0.3 CCCCC(C)NC Amb9620956 [1,1,0,0,0,0|2,0,0]=4 2221 B7R0.3 CCCCC(Cl)CBr Amb27490970 [1,1,0,0,0,0|2,0,0]=4 2222 B7R0.3 CCCCC(Cl)CC Amb25361621 [1,1,0,0,0,0|1,0,0]=3 2223 B7R0.3 CCCCC(Cl)CCl Amb9787250 [1,1,0,0,0,0|2,0,0]=4 2224 B7R0.3 CCCCC(Cl)CN Amb31030967 [1,1,0,0,0,0|2,0,0]=4 2225 B7R0.3 CCCCC(F)CBr Amb27758689 [1,1,0,0,0,0|2,0,0]=4 2226 B7R0.3 CCCCC(F)CN Amb24117055 [1,1,0,0,0,0|2,0,0]=4 2227 B7R0.3 CCCCC(N)CC Amb33527796 [1,1,0,0,0,0|1,0,0]=3 2228 B7R0.3 CCCCC(N)CC Amb9031866 [1,1,0,0,0,0|1,0,0]=3 2229 B7R0.3 CCCCC(N)CN Amb19009750 [1,1,0,0,0,0|2,0,0]=4 2230 B7R0.3 CCCCC(N)CO Amb3939373 [1,1,0,0,0,0|2,0,0]=4 2231 B7R0.3 CCCCC(N)CS Amb27961155 [1,1,0,0,0,0|2,0,0]=4 2232 B7R0.3 CCCCC(O)CBr Amb25233429 [1,1,0,0,0,0|2,0,0]=4 2233 B7R0.3 CCCCC(O)CC Amb10844720 [1,1,0,0,0,0|1,0,0]=3 2234 B7R0.3 CCCCC(O)CCl Amb24481415 [1,1,0,0,0,0|2,0,0]=4 2235 B7R0.3 CCCCC(O)CF Amb27807497 [1,1,0,0,0,0|2,0,0]=4 2236 B7R0.3 CCCCC(O)CN Amb8630130 [1,1,0,0,0,0|2,0,0]=4 2237 B7R0.3 CCCCC(O)CO Amb8390318 [1,1,0,0,0,0|2,0,0]=4 2238 B7R0.3 CCCCC(S)CC Amb25314909 [1,1,0,0,0,0|1,0,0]=3 2239 B7R0.3 CCCCC(S)CN Amb27643759 [1,1,0,0,0,0|2,0,0]=4 2240 B7R0.3 CCCCN(N)CC Amb17593206 [1,1,0,0,0,0|2,0,0]=4 2241 B7R0.3 CCCCN(O)CC Amb27230146 [1,1,0,0,0,0|2,0,0]=4 2242 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [1,1,0,0,0,0|2,0,0]=4 2243 B7R0.3 CCCC[C@@H](C)CN Amb27780030 [1,1,0,0,0,0|2,0,0]=4 2244 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [1,1,0,0,0,0|2,0,0]=4 2245 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [1,1,0,0,0,0|2,0,0]=4 2246 B7R0.3 CCCC[C@@H](N)CC Amb28461624 [1,1,0,0,0,0|1,0,0]=3 2247 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [1,1,0,0,0,0|2,0,0]=4 2248 B7R0.3 CCCC[C@@H](O)CN Amb33428417 [1,1,0,0,0,0|2,0,0]=4 2249 B7R0.3 CCCC[C@H](C)CN Amb25889982 [1,1,0,0,0,0|2,0,0]=4 2250 B7R0.3 CCCC[C@H](C)CO Amb26370424 [1,1,0,0,0,0|2,0,0]=4 2251 B7R0.3 CCCC[C@H](F)CO Amb28315208 [1,1,0,0,0,0|2,0,0]=4 2252 B7R0.3 CCCC[C@H](N)CO Amb3941478 [1,1,0,0,0,0|2,0,0]=4 2253 B7R0.3 CCCC[C@H](O)CF Amb27656199 [1,1,0,0,0,0|2,0,0]=4 2254 B7R0.3 CCCC[C@H](O)CN Amb33428416 [1,1,0,0,0,0|2,0,0]=4 2255 B7R0.3 CCCC[C@H](S)CO Amb27804425 [1,1,0,0,0,0|2,0,0]=4 2256 B7R0.3 CCCNC(=O)CC Amb5797516 [1,1,0,0,0,0|1,0,1]=4 2257 B7R0.3 CCCNC(C)CC Amb3939844 [1,1,0,0,0,0|1,0,0]=3 2258 B7R0.3 CCCNC(C)CO Amb9359690 [1,1,0,0,0,0|2,0,0]=4 2259 B7R0.3 CCCOC(C)CC Amb27250865 [1,1,0,0,0,0|0,1,0]=3 2260 B7R0.3 CCCOC(C)CN Amb10608199 [1,1,0,0,0,0|1,1,0]=4 2261 B7R0.3 CCCOC(C)CN Amb21956046 [1,1,0,0,0,0|1,1,0]=4 2262 B7R0.3 CCCOC(C)CO Amb26370350 [1,1,0,0,0,0|1,1,0]=4 2263 B7R0.3 CCCSC(=O)CBr Amb28385643 [1,1,0,0,0,0|1,0,1]=4 2264 B7R0.3 CCCSC(=O)CC Amb25882938 [1,1,0,0,0,0|0,0,1]=3 2265 B7R0.3 CCCSC(=O)NC Amb27788550 [1,1,0,0,0,0|1,0,1]=4 2266 B7R0.3 CCCSC(C)C#N Amb27483846 [1,1,0,0,0,0|1,0,1]=4 2267 B7R0.3 CCCSC(C)C=O Amb18124367 [1,1,0,0,0,0|1,0,1]=4 2268 B7R0.3 CCCSC(C)CC Amb4017932 [1,1,0,0,0,0|0,0,0]=2 2269 B7R0.3 CCCSC(C)CCl Amb27817405 [1,1,0,0,0,0|1,0,0]=3 2270 B7R0.3 CCCSC(C)CN Amb17485962 [1,1,0,0,0,0|1,0,0]=3 2271 B7R0.3 CCCSC(C)CO Amb27593226 [1,1,0,0,0,0|1,0,0]=3 2272 B7R0.3 CCC\C=C(/C)CC Amb25260956 [1,1,0,0,0,0|1,0,1]=4 2273 B7R0.3 CCNCC(C)CC Amb20623802 [1,1,0,0,0,0|2,0,0]=4 2274 B7R0.3 CCNCC(C)CC Amb6719189 [1,1,0,0,0,0|2,0,0]=4 2275 B7R0.3 CCNCC(Cl)CC Amb28049008 [1,1,0,0,0,0|2,0,0]=4 2276 B7R0.3 CCNCC(N)CC Amb18304998 [1,1,0,0,0,0|2,0,0]=4 2277 B7R0.3 CCNCC(O)CC Amb9870468 [1,1,0,0,0,0|2,0,0]=4 2278 B7R0.3 CCNC[C@@H](N)CC Amb27588708 [1,1,0,0,0,0|2,0,0]=4 2279 B7R0.3 CCNC[C@@H](O)CC Amb28129052 [1,1,0,0,0,0|2,0,0]=4 2280 B7R0.3 CCNC[C@H](O)CC Amb26984963 [1,1,0,0,0,0|2,0,0]=4 2281 B7R0.3 CCOCC(N)CC Amb17485991 [1,1,0,0,0,0|1,1,0]=4 2282 B7R0.3 CCOC[C@H](N)CC Amb28400800 [1,1,0,0,0,0|1,1,0]=4 2283 B7R0.3 CCSCC(C)CBr Amb26852087 [1,1,0,0,0,0|2,0,0]=4 2284 B7R0.3 CCSCC(C)CC Amb27395876 [1,1,0,0,0,0|1,0,0]=3 2285 B7R0.3 CCSCC(C)CCl Amb27469104 [1,1,0,0,0,0|2,0,0]=4 2286 B7R0.3 CCSCC(C)CN Amb9391465 [1,1,0,0,0,0|2,0,0]=4 2287 B7R0.3 CCSCC(C)NC Amb19149257 [1,1,0,0,0,0|2,0,0]=4 2288 B7R0.3 CCSCC(F)CN Amb33324013 [1,1,0,0,0,0|2,0,0]=4 2289 B7R0.3 CCSCC(N)CC Amb17485958 [1,1,0,0,0,0|1,0,0]=3 2290 B7R0.3 CCSCC(N)CO Amb18643038 [1,1,0,0,0,0|2,0,0]=4 2291 B7R0.3 CCSCC(O)CBr Amb26957421 [1,1,0,0,0,0|2,0,0]=4 2292 B7R0.3 CCSCC(O)CC Amb27827536 [1,1,0,0,0,0|1,0,0]=3 2293 B7R0.3 CCSCC(O)CCl Amb17593873 [1,1,0,0,0,0|2,0,0]=4 2294 B7R0.3 CCSCC(O)CF Amb28062913 [1,1,0,0,0,0|2,0,0]=4 2295 B7R0.3 CCSCC(O)CN Amb6680865 [1,1,0,0,0,0|2,0,0]=4 2296 B7R0.3 CCSCC(O)CO Amb4019001 [1,1,0,0,0,0|2,0,0]=4 2297 B7R0.3 CCSCS(=O)CC Amb4014439 [1,1,0,0,0,0|2,0,0]=4 2298 B7R0.3 CCSC[C@@H](N)CO Amb26504944 [1,1,0,0,0,0|2,0,0]=4 2299 B7R0.3 CCSC[C@@H](O)CN Amb26370394 [1,1,0,0,0,0|2,0,0]=4 2300 B7R0.3 CCSC[C@H](N)CC Amb27987520 [1,1,0,0,0,0|1,0,0]=3 2301 B7R0.3 CCSC[C@H](N)CO Amb26564857 [1,1,0,0,0,0|2,0,0]=4 2302 B7R0.3 CCSC[C@H](O)CN Amb27213896 [1,1,0,0,0,0|2,0,0]=4 2303 B7R0.3 CCSSC(C)CC Amb28284462 [1,1,0,0,0,0|0,0,0]=2 2304 B7R0.3 CC[C@@H](C)CCCCl Amb27166913 [1,1,0,0,0,0|2,0,0]=4 2305 B7R0.3 CC[C@@H](C)CCCO Amb22799989 [1,1,0,0,0,0|2,0,0]=4 2306 B7R0.3 CC[C@H](C)CCCBr Amb27619630 [1,1,0,0,0,0|2,0,0]=4 2307 B7R0.3 CC[C@H](C)CCCO Amb22226203 [1,1,0,0,0,0|2,0,0]=4 2308 B7R0.3 CC[C@H](N)CCOC Amb28123823 [1,1,0,0,0,0|2,0,0]=4 2309 B7R0.3 CC\C=C\C(C)CC Amb26433198 [1,1,0,0,0,0|1,0,1]=4 2310 B7R0.3 CC\C=C\C(O)CC Amb27619562 [1,1,0,0,0,0|1,0,1]=4 2311 B7R0.3 CC\C=C\[C@@H](O)CC Amb28188274 [1,1,0,0,0,0|1,0,1]=4 2312 B7R0.3 COCSC(C)CCl Amb28345548 [1,1,0,0,0,0|2,0,0]=4 2313 B7R0.3 COCSC(C)CO Amb28284985 [1,1,0,0,0,0|2,0,0]=4 2314 B7R0.3 C\C=C\SC(Cl)CC Amb28138039 [1,1,0,0,0,0|0,0,2]=4 2315 B7R0.4 C=C(C)CCCCC Amb6298938 [1,1,0,0,0,0|1,0,1]=4 2316 B7R0.4 C=C(C)CNCCC Amb17308631 [1,1,0,0,0,0|1,0,1]=4 2317 B7R0.4 C=C(C)CSCCC Amb27449649 [1,1,0,0,0,0|0,0,1]=3 2318 B7R0.4 C=C(C)CSCCN Amb6259178 [1,1,0,0,0,0|1,0,1]=4 2319 B7R0.4 C=CCSCC(C)C Amb28049003 [1,1,0,0,0,0|0,0,2]=4 2320 B7R0.4 C=CCSCC(C)O Amb28065376 [1,1,0,0,0,0|0,0,2]=4 2321 B7R0.4 C=CCSC[C@@H](C)N Amb28401212 [1,1,0,0,0,0|0,0,2]=4 2322 B7R0.4 C=CCSC[C@H](C)N Amb27752407 [1,1,0,0,0,0|0,0,2]=4 2323 B7R0.4 C=CCSC[C@H](C)O Amb27220310 [1,1,0,0,0,0|0,0,2]=4 2324 B7R0.4 CC(=O)CSCCF Amb24621173 [1,1,0,0,0,0|1,0,1]=4 2325 B7R0.4 CC(=O)CSCCN Amb17500454 [1,1,0,0,0,0|1,0,1]=4 2326 B7R0.4 CC(=O)CSCCO Amb4165952 [1,1,0,0,0,0|1,0,1]=4 2327 B7R0.4 CC(Br)CCCCCl Amb27858670 [1,1,0,0,0,0|2,0,0]=4 2328 B7R0.4 CC(C)CCCCBr Amb2721514 [1,1,0,0,0,0|2,0,0]=4 2329 B7R0.4 CC(C)CCCCCl Amb20670590 [1,1,0,0,0,0|2,0,0]=4 2330 B7R0.4 CC(C)CCCCN Amb33548422 [1,1,0,0,0,0|2,0,0]=4 2331 B7R0.4 CC(C)CCCCN Amb9304907 [1,1,0,0,0,0|2,0,0]=4 2332 B7R0.4 CC(C)CCCCO Amb3939382 [1,1,0,0,0,0|2,0,0]=4 2333 B7R0.4 CC(C)CCCCS Amb32788388 [1,1,0,0,0,0|2,0,0]=4 2334 B7R0.4 CC(C)CNCCCl Amb17334145 [1,1,0,0,0,0|2,0,0]=4 2335 B7R0.4 CC(C)CNCCI Amb27801831 [1,1,0,0,0,0|2,0,0]=4 2336 B7R0.4 CC(C)CNCCN Amb17091016 [1,1,0,0,0,0|2,0,0]=4 2337 B7R0.4 CC(C)CNCCO Amb22587152 [1,1,0,0,0,0|2,0,0]=4 2338 B7R0.4 CC(C)CNCCO Amb6707299 [1,1,0,0,0,0|2,0,0]=4 2339 B7R0.4 CC(C)CNCCS Amb24616771 [1,1,0,0,0,0|2,0,0]=4 2340 B7R0.4 CC(C)COCCBr Amb6255231 [1,1,0,0,0,0|1,1,0]=4 2341 B7R0.4 CC(C)COCCN Amb33548979 [1,1,0,0,0,0|1,1,0]=4 2342 B7R0.4 CC(C)COCCN Amb6247554 [1,1,0,0,0,0|1,1,0]=4 2343 B7R0.4 CC(C)COCCO Amb3939640 [1,1,0,0,0,0|1,1,0]=4 2344 B7R0.4 CC(C)COCCS Amb24589392 [1,1,0,0,0,0|1,1,0]=4 2345 B7R0.4 CC(C)CSCCCl Amb9304957 [1,1,0,0,0,0|1,0,0]=3 2346 B7R0.4 CC(C)CSCCN Amb28934790 [1,1,0,0,0,0|1,0,0]=3 2347 B7R0.4 CC(C)CSCCN Amb6274135 [1,1,0,0,0,0|1,0,0]=3 2348 B7R0.4 CC(C)SCCCBr Amb19053955 [1,1,0,0,0,0|2,0,0]=4 2349 B7R0.4 CC(C)SCCCN Amb10075505 [1,1,0,0,0,0|2,0,0]=4 2350 B7R0.4 CC(C)SCCCO Amb17502841 [1,1,0,0,0,0|2,0,0]=4 2351 B7R0.4 CC(Cl)CNCCCl Amb24442200 [1,1,0,0,0,0|2,0,0]=4 2352 B7R0.4 CC(Cl)CNCCCl Amb32653331 [1,1,0,0,0,0|2,0,0]=4 2353 B7R0.4 CC(Cl)CSSSCl Amb27614274 [1,1,0,0,0,0|2,0,0]=4 2354 B7R0.4 CC(F)CCCCCl Amb27596141 [1,1,0,0,0,0|2,0,0]=4 2355 B7R0.4 CC(F)CSCC#N Amb28368838 [1,1,0,0,0,0|1,0,1]=4 2356 B7R0.4 CC(F)CSCCN Amb27782477 [1,1,0,0,0,0|1,0,0]=3 2357 B7R0.4 CC(N)CCCCBr Amb27814547 [1,1,0,0,0,0|2,0,0]=4 2358 B7R0.4 CC(N)CCCCCl Amb27867737 [1,1,0,0,0,0|2,0,0]=4 2359 B7R0.4 CC(N)CCCCF Amb25954668 [1,1,0,0,0,0|2,0,0]=4 2360 B7R0.4 CC(N)CCCCN Amb25214697 [1,1,0,0,0,0|2,0,0]=4 2361 B7R0.4 CC(N)CCCCN Amb33551364 [1,1,0,0,0,0|2,0,0]=4 2362 B7R0.4 CC(N)CCCCO Amb17569907 [1,1,0,0,0,0|2,0,0]=4 2363 B7R0.4 CC(N)CCCCO Amb28934868 [1,1,0,0,0,0|2,0,0]=4 2364 B7R0.4 CC(N)CNCCN Amb28198270 [1,1,0,0,0,0|2,0,0]=4 2365 B7R0.4 CC(N)CSCCF Amb27233247 [1,1,0,0,0,0|1,0,0]=3 2366 B7R0.4 CC(O)CCCCF Amb27486303 [1,1,0,0,0,0|2,0,0]=4 2367 B7R0.4 CC(O)CCCCN Amb17569903 [1,1,0,0,0,0|2,0,0]=4 2368 B7R0.4 CC(O)CCCCO Amb22227757 [1,1,0,0,0,0|2,0,0]=4 2369 B7R0.4 CC(O)CCCC[SiH3] Amb28322353 [1,1,0,0,0,0|1,1,0]=4 2370 B7R0.4 CC(O)CNCCN Amb4034606 [1,1,0,0,0,0|2,0,0]=4 2371 B7R0.4 CC(O)CNCCO Amb4020001 [1,1,0,0,0,0|2,0,0]=4 2372 B7R0.4 CC(O)CNCCS Amb27838396 [1,1,0,0,0,0|2,0,0]=4 2373 B7R0.4 CC(O)COCCCl Amb27410199 [1,1,0,0,0,0|1,1,0]=4 2374 B7R0.4 CC(O)COCCN Amb27404532 [1,1,0,0,0,0|1,1,0]=4 2375 B7R0.4 CC(O)CSCCO Amb22055428 [1,1,0,0,0,0|1,0,0]=3 2376 B7R0.4 CC(O)CSCCS Amb28074830 [1,1,0,0,0,0|1,0,0]=3 2377 B7R0.4 CC(S)CCCCN Amb32788406 [1,1,0,0,0,0|2,0,0]=4 2378 B7R0.4 CC(S)COCCN Amb32788415 [1,1,0,0,0,0|1,1,0]=4 2379 B7R0.4 CCC#CCC(C)C Amb6336495 [1,1,0,0,0,0|1,0,1]=4 2380 B7R0.4 CCC#CCC(C)O Amb22045231 [1,1,0,0,0,0|1,0,1]=4 2381 B7R0.4 CCC#CC[C@@H](C)O Amb27659866 [1,1,0,0,0,0|1,0,1]=4 2382 B7R0.4 CCCC#CC(C)Br Amb28384079 [1,1,0,0,0,0|1,0,1]=4 2383 B7R0.4 CCCC#CC(C)O Amb24273363 [1,1,0,0,0,0|1,0,1]=4 2384 B7R0.4 CCCC#C[C@@H](C)O Amb27826359 [1,1,0,0,0,0|1,0,1]=4 2385 B7R0.4 CCCCCC(C)=O Amb6608885 [1,1,0,0,0,0|1,0,1]=4 2386 B7R0.4 CCCCCC(C)Br Amb3940202 [1,1,0,0,0,0|1,0,0]=3 2387 B7R0.4 CCCCCC(C)C Amb8513253 [1,1,0,0,0,0|1,0,0]=3 2388 B7R0.4 CCCCCC(C)Cl Amb22228752 [1,1,0,0,0,0|1,0,0]=3 2389 B7R0.4 CCCCCC(C)N Amb21962698 [1,1,0,0,0,0|1,0,0]=3 2390 B7R0.4 CCCCCC(C)N Amb3939364 [1,1,0,0,0,0|1,0,0]=3 2391 B7R0.4 CCCCCC(C)O Amb8383668 [1,1,0,0,0,0|1,0,0]=3 2392 B7R0.4 CCCCCC(C)S Amb17939452 [1,1,0,0,0,0|1,0,0]=3 2393 B7R0.4 CCCCCC(Cl)Cl Amb27206941 [1,1,0,0,0,0|2,0,0]=4 2394 B7R0.4 CCCCCC(F)Br Amb24641242 [1,1,0,0,0,0|2,0,0]=4 2395 B7R0.4 CCCCCC(O)Cl Amb27232933 [1,1,0,0,0,0|2,0,0]=4 2396 B7R0.4 CCCCCC(O)O Amb25921998 [1,1,0,0,0,0|2,0,0]=4 2397 B7R0.4 CCCCCN(C)O Amb33428427 [1,1,0,0,0,0|2,0,0]=4 2398 B7R0.4 CCCCCS(C)=O Amb27457494 [1,1,0,0,0,0|2,0,0]=4 2399 B7R0.4 CCCCC[C@@H](C)N Amb3941400 [1,1,0,0,0,0|1,0,0]=3 2400 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,1,0,0,0,0|1,0,0]=3 2401 B7R0.4 CCCCC[C@H](C)N Amb8516349 [1,1,0,0,0,0|1,0,0]=3 2402 B7R0.4 CCCCC[C@H](C)O Amb8395591 [1,1,0,0,0,0|1,0,0]=3 2403 B7R0.4 CCCCNC(C)C Amb2111112 [1,1,0,0,0,0|2,0,0]=4 2404 B7R0.4 CCCCNC(C)C Amb6251422 [1,1,0,0,0,0|2,0,0]=4 2405 B7R0.4 CCCCOC(C)Cl Amb17689402 [1,1,0,0,0,0|1,1,0]=4 2406 B7R0.4 CCCCOC(C)O Amb26537694 [1,1,0,0,0,0|1,1,0]=4 2407 B7R0.4 CCCCSC(C)C Amb4020661 [1,1,0,0,0,0|1,0,0]=3 2408 B7R0.4 CCCCSC(C)O Amb27191967 [1,1,0,0,0,0|1,0,0]=3 2409 B7R0.4 CCCNCC(C)=O Amb26954588 [1,1,0,0,0,0|1,0,1]=4 2410 B7R0.4 CCCNCC(C)C Amb6258024 [1,1,0,0,0,0|1,0,0]=3 2411 B7R0.4 CCCNCC(C)O Amb9359420 [1,1,0,0,0,0|1,0,0]=3 2412 B7R0.4 CCCNCC(C)S Amb18124358 [1,1,0,0,0,0|1,0,0]=3 2413 B7R0.4 CCCNCC(Cl)Cl Amb28064059 [1,1,0,0,0,0|2,0,0]=4 2414 B7R0.4 CCCNCC(F)F Amb13951924 [1,1,0,0,0,0|2,0,0]=4 2415 B7R0.4 CCCNCC(F)F Amb8853727 [1,1,0,0,0,0|2,0,0]=4 2416 B7R0.4 CCCNC[C@@H](C)N Amb27835548 [1,1,0,0,0,0|1,0,0]=3 2417 B7R0.4 CCCNOC(C)C Amb27203616 [1,1,0,0,0,0|1,1,0]=4 2418 B7R0.4 CCCOC[C@@H](C)N Amb28048953 [1,1,0,0,0,0|0,1,0]=3 2419 B7R0.4 CCCOC[C@@H](C)O Amb28048955 [1,1,0,0,0,0|0,1,0]=3 2420 B7R0.4 CCCSCC(=O)O Amb1137113 [1,1,0,0,0,0|1,0,1]=4 2421 B7R0.4 CCCSCC(C)=O Amb9668676 [1,1,0,0,0,0|0,0,1]=3 2422 B7R0.4 CCCSCC(C)C Amb4017817 [1,1,0,0,0,0|0,0,0]=2 2423 B7R0.4 CCCSCC(C)O Amb27463818 [1,1,0,0,0,0|0,0,0]=2 2424 B7R0.4 CCCSCC(C)S Amb32788151 [1,1,0,0,0,0|0,0,0]=2 2425 B7R0.4 CCCSCC(N)=O Amb27424658 [1,1,0,0,0,0|1,0,1]=4 2426 B7R0.4 CCCSC[C@@H](C)O Amb27641885 [1,1,0,0,0,0|0,0,0]=2 2427 B7R0.4 CCCSSC(C)C Amb25952313 [1,1,0,0,0,0|0,0,0]=2 2428 B7R0.4 CCC\C=C\C(C)C Amb4019553 [1,1,0,0,0,0|1,0,1]=4 2429 B7R0.4 CCC\C=C\C(C)N Amb33374704 [1,1,0,0,0,0|1,0,1]=4 2430 B7R0.4 CCC\C=C\C(C)O Amb25083446 [1,1,0,0,0,0|1,0,1]=4 2431 B7R0.4 CCC\C=C\[C@@H](C)N Amb33327161 [1,1,0,0,0,0|1,0,1]=4 2432 B7R0.4 CCC\C=C\[C@@H](C)O Amb33429966 [1,1,0,0,0,0|1,0,1]=4 2433 B7R0.4 CCC\C=C\[C@H](C)N Amb33327160 [1,1,0,0,0,0|1,0,1]=4 2434 B7R0.4 CCC\C=C\[C@H](C)O Amb27857282 [1,1,0,0,0,0|1,0,1]=4 2435 B7R0.4 CCNCCC(C)C Amb6244455 [1,1,0,0,0,0|2,0,0]=4 2436 B7R0.4 CCNCCC(C)O Amb27239293 [1,1,0,0,0,0|2,0,0]=4 2437 B7R0.4 CCOCCC(C)Cl Amb28422675 [1,1,0,0,0,0|1,1,0]=4 2438 B7R0.4 CCOCCC(C)N Amb7772189 [1,1,0,0,0,0|1,1,0]=4 2439 B7R0.4 CCOCCC(C)O Amb27852957 [1,1,0,0,0,0|1,1,0]=4 2440 B7R0.4 CCOCC[C@H](C)N Amb24439507 [1,1,0,0,0,0|1,1,0]=4 2441 B7R0.4 CCOCC[C@H](C)O Amb27946039 [1,1,0,0,0,0|1,1,0]=4 2442 B7R0.4 CCSCCC(C)=O Amb9655821 [1,1,0,0,0,0|1,0,1]=4 2443 B7R0.4 CCSCCC(C)Br Amb33435746 [1,1,0,0,0,0|1,0,0]=3 2444 B7R0.4 CCSCCC(C)C Amb22230685 [1,1,0,0,0,0|1,0,0]=3 2445 B7R0.4 CCSCCC(C)Cl Amb28458510 [1,1,0,0,0,0|1,0,0]=3 2446 B7R0.4 CCSCCC(C)N Amb19149259 [1,1,0,0,0,0|1,0,0]=3 2447 B7R0.4 CCSCCC(C)O Amb28048927 [1,1,0,0,0,0|1,0,0]=3 2448 B7R0.4 CCSCCN(C)C Amb27198418 [1,1,0,0,0,0|2,0,0]=4 2449 B7R0.4 CCSCCN(C)O Amb33324043 [1,1,0,0,0,0|2,0,0]=4 2450 B7R0.4 CCSCC[C@@H](C)N Amb33323734 [1,1,0,0,0,0|1,0,0]=3 2451 B7R0.4 CCSCC[C@@H](C)O Amb33223925 [1,1,0,0,0,0|1,0,0]=3 2452 B7R0.4 CCSCC[C@H](C)N Amb33323728 [1,1,0,0,0,0|1,0,0]=3 2453 B7R0.4 CCSCC[C@H](C)O Amb33323733 [1,1,0,0,0,0|1,0,0]=3 2454 B7R0.4 CCSSCC(C)=O Amb28316151 [1,1,0,0,0,0|0,0,1]=3 2455 B7R0.4 CC\C=C\CC(C)Br Amb33009075 [1,1,0,0,0,0|1,0,1]=4 2456 B7R0.4 CC\C=C\CC(C)C Amb4016285 [1,1,0,0,0,0|1,0,1]=4 2457 B7R0.4 CC\C=C\CC(C)N Amb25357984 [1,1,0,0,0,0|1,0,1]=4 2458 B7R0.4 CC\C=C\CC(C)O Amb33079090 [1,1,0,0,0,0|1,0,1]=4 2459 B7R0.4 CC\C=C\C[C@@H](C)N Amb33225016 [1,1,0,0,0,0|1,0,1]=4 2460 B7R0.4 CC\C=C\C[C@@H](C)O Amb33359513 [1,1,0,0,0,0|1,0,1]=4 2461 B7R0.4 CC\C=C\C[C@H](C)N Amb33267988 [1,1,0,0,0,0|1,0,1]=4 2462 B7R0.4 CC\C=C\C[C@H](C)O Amb33474377 [1,1,0,0,0,0|1,0,1]=4 2463 B7R0.4 CNCCCC(C)C Amb32757651 [1,1,0,0,0,0|2,0,0]=4 2464 B7R0.4 CNCCCC(C)C Amb8853654 [1,1,0,0,0,0|2,0,0]=4 2465 B7R0.4 CNCCCC(C)O Amb17569899 [1,1,0,0,0,0|2,0,0]=4 2466 B7R0.4 CNCCC[C@@H](C)O Amb27784601 [1,1,0,0,0,0|2,0,0]=4 2467 B7R0.4 CNCCSC(C)C Amb19024679 [1,1,0,0,0,0|2,0,0]=4 2468 B7R0.4 COCCCC(C)Br Amb18185551 [1,1,0,0,0,0|2,0,0]=4 2469 B7R0.4 COCCCC(C)Cl Amb26489622 [1,1,0,0,0,0|2,0,0]=4 2470 B7R0.4 COCCCC(C)N Amb9031757 [1,1,0,0,0,0|2,0,0]=4 2471 B7R0.4 COCCCC(C)O Amb4020863 [1,1,0,0,0,0|2,0,0]=4 2472 B7R0.4 COCCCC(C)S Amb25810805 [1,1,0,0,0,0|2,0,0]=4 2473 B7R0.4 COCCC[C@@H](C)Cl Amb27590769 [1,1,0,0,0,0|2,0,0]=4 2474 B7R0.4 COCCC[C@@H](C)N Amb24749054 [1,1,0,0,0,0|2,0,0]=4 2475 B7R0.4 COCCC[C@@H](C)O Amb33428680 [1,1,0,0,0,0|2,0,0]=4 2476 B7R0.4 COCCC[C@H](C)N Amb27164382 [1,1,0,0,0,0|2,0,0]=4 2477 B7R0.4 COCCC[C@H](C)O Amb27396064 [1,1,0,0,0,0|2,0,0]=4 2478 B7R0.4 COCSCC(C)C Amb28142603 [1,1,0,0,0,0|1,0,0]=3 2479 B7R0.4 COCSCC(C)Cl Amb27401952 [1,1,0,0,0,0|1,0,0]=3 2480 B7R0.4 CSCCCC(C)Br Amb27798199 [1,1,0,0,0,0|2,0,0]=4 2481 B7R0.4 CSCCCC(C)C Amb28289938 [1,1,0,0,0,0|2,0,0]=4 2482 B7R0.4 CSCCCC(C)N Amb18124381 [1,1,0,0,0,0|2,0,0]=4 2483 B7R0.4 CSCCCC(C)O Amb25958947 [1,1,0,0,0,0|2,0,0]=4 2484 B7R0.4 CSCCC[C@@H](C)N Amb33200177 [1,1,0,0,0,0|2,0,0]=4 2485 B7R0.4 CSCCC[C@@H](C)O Amb33198286 [1,1,0,0,0,0|2,0,0]=4 2486 B7R0.4 CSCCC[C@H](C)N Amb33200176 [1,1,0,0,0,0|2,0,0]=4 2487 B7R0.4 CSCCC[C@H](C)O Amb33198288 [1,1,0,0,0,0|2,0,0]=4 2488 B7R0.4 CSCSCC(C)C Amb28324036 [1,1,0,0,0,0|1,0,0]=3 2489 B7R0.4 CSSCCC(C)N Amb28316247 [1,1,0,0,0,0|2,0,0]=4 2490 B7R0.4 C[C@@H](N)CCCCF Amb33196127 [1,1,0,0,0,0|2,0,0]=4 2491 B7R0.4 C[C@@H](O)CCCCBr Amb28343132 [1,1,0,0,0,0|2,0,0]=4 2492 B7R0.4 C[C@@H](O)CCCCCl Amb8517538 [1,1,0,0,0,0|2,0,0]=4 2493 B7R0.4 C[C@@H](O)CCCCF Amb33196128 [1,1,0,0,0,0|2,0,0]=4 2494 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [1,1,0,0,0,0|2,0,0]=4 2495 B7R0.4 C[C@@H](O)CNCCF Amb27486911 [1,1,0,0,0,0|2,0,0]=4 2496 B7R0.4 C[C@H](F)CCCCO Amb27945000 [1,1,0,0,0,0|2,0,0]=4 2497 B7R0.4 C[C@H](N)CCCCF Amb33480694 [1,1,0,0,0,0|2,0,0]=4 2498 B7R0.4 C[C@H](N)CNCCF Amb27449099 [1,1,0,0,0,0|2,0,0]=4 2499 B7R0.4 C[C@H](O)CCCCF Amb33196129 [1,1,0,0,0,0|2,0,0]=4 2500 B7R0.4 C[C@H](O)CCCCO Amb28381637 [1,1,0,0,0,0|2,0,0]=4 2501 B7R0.4 FC(Cl)CSCCCl Amb27184550 [1,1,0,0,0,0|2,0,0]=4 2502 B7R0.4 NCCSCC(F)F Amb19373690 [1,1,0,0,0,0|2,0,0]=4 2503 B7R0.7 C=C(CCC)CCC Amb25088297 [1,1,0,0,0,0|1,0,0]=3 2504 B7R0.7 C=C(CCC)CCN Amb33374808 [1,1,0,0,0,0|2,0,0]=4 2505 B7R0.7 C=C(CCC)CCO Amb27642086 [1,1,0,0,0,0|2,0,0]=4 2506 B7R0.7 CCCC(=N)OCC Amb20672875 [1,1,0,0,0,0|1,1,0]=4 2507 B7R0.7 CCCC(=N)OCC Amb25070806 [1,1,0,0,0,0|1,1,0]=4 2508 B7R0.7 CCCC(=O)CCBr Amb27845324 [1,1,0,0,0,0|2,0,0]=4 2509 B7R0.7 CCCC(=O)CCC Amb6608653 [1,1,0,0,0,0|1,0,0]=3 2510 B7R0.7 CCCC(=O)CCCl Amb17593421 [1,1,0,0,0,0|2,0,0]=4 2511 B7R0.7 CCCC(=O)CCN Amb25104618 [1,1,0,0,0,0|2,0,0]=4 2512 B7R0.7 CCCC(=O)CNC Amb27251893 [1,1,0,0,0,0|2,0,0]=4 2513 B7R0.7 CCCC(=O)OCC Amb3940136 [1,1,0,0,0,0|1,1,0]=4 2514 B7R0.7 CCCC(=S)OCC Amb22168045 [1,1,0,0,0,0|1,1,0]=4 2515 B7R0.7 CCCC(Br)CCC Amb8968455 [1,1,0,0,0,0|1,0,0]=3 2516 B7R0.7 CCCC(Br)CCCl Amb27472207 [1,1,0,0,0,0|2,0,0]=4 2517 B7R0.7 CCCC(C)CCBr Amb24526467 [1,1,0,0,0,0|2,0,0]=4 2518 B7R0.7 CCCC(C)CCC Amb22229829 [1,1,0,0,0,0|1,0,0]=3 2519 B7R0.7 CCCC(C)CCCl Amb24333870 [1,1,0,0,0,0|2,0,0]=4 2520 B7R0.7 CCCC(C)CCN Amb31145475 [1,1,0,0,0,0|2,0,0]=4 2521 B7R0.7 CCCC(C)CCN Amb839082 [1,1,0,0,0,0|2,0,0]=4 2522 B7R0.7 CCCC(C)CCO Amb22733616 [1,1,0,0,0,0|2,0,0]=4 2523 B7R0.7 CCCC(C)CCS Amb33320804 [1,1,0,0,0,0|2,0,0]=4 2524 B7R0.7 CCCC(C)CNC Amb33330634 [1,1,0,0,0,0|2,0,0]=4 2525 B7R0.7 CCCC(C)CNC Amb6719001 [1,1,0,0,0,0|2,0,0]=4 2526 B7R0.7 CCCC(C)NCC Amb22586730 [1,1,0,0,0,0|2,0,0]=4 2527 B7R0.7 CCCC(C)NCC Amb9726218 [1,1,0,0,0,0|2,0,0]=4 2528 B7R0.7 CCCC(C)OCC Amb22733741 [1,1,0,0,0,0|1,1,0]=4 2529 B7R0.7 CCCC(Cl)CSC Amb27966841 [1,1,0,0,0,0|2,0,0]=4 2530 B7R0.7 CCCC(F)CCN Amb25869704 [1,1,0,0,0,0|2,0,0]=4 2531 B7R0.7 CCCC(F)CCO Amb27662632 [1,1,0,0,0,0|2,0,0]=4 2532 B7R0.7 CCCC(N)CCC Amb1102706 [1,1,0,0,0,0|1,0,0]=3 2533 B7R0.7 CCCC(N)CCN Amb27838332 [1,1,0,0,0,0|2,0,0]=4 2534 B7R0.7 CCCC(N)CCO Amb22050841 [1,1,0,0,0,0|2,0,0]=4 2535 B7R0.7 CCCC(N)CSC Amb18313615 [1,1,0,0,0,0|2,0,0]=4 2536 B7R0.7 CCCC(O)CCC Amb4035747 [1,1,0,0,0,0|1,0,0]=3 2537 B7R0.7 CCCC(O)CCN Amb22642684 [1,1,0,0,0,0|2,0,0]=4 2538 B7R0.7 CCCC(O)CCO Amb24181777 [1,1,0,0,0,0|2,0,0]=4 2539 B7R0.7 CCCC(O)CNC Amb18314672 [1,1,0,0,0,0|2,0,0]=4 2540 B7R0.7 CCCC(O)COC Amb28347497 [1,1,0,0,0,0|2,0,0]=4 2541 B7R0.7 CCCC(S)CCC Amb7784733 [1,1,0,0,0,0|1,0,0]=3 2542 B7R0.7 CCCN(C)CCBr Amb18178281 [1,1,0,0,0,0|2,0,0]=4 2543 B7R0.7 CCCN(C)CCC Amb9787750 [1,1,0,0,0,0|1,0,0]=3 2544 B7R0.7 CCCN(C)CCCl Amb17334148 [1,1,0,0,0,0|2,0,0]=4 2545 B7R0.7 CCCN(C)CCF Amb27951092 [1,1,0,0,0,0|2,0,0]=4 2546 B7R0.7 CCCN(C)CCN Amb8898636 [1,1,0,0,0,0|2,0,0]=4 2547 B7R0.7 CCCN(C)CCO Amb3204757 [1,1,0,0,0,0|2,0,0]=4 2548 B7R0.7 CCCN(N)CCC Amb17593208 [1,1,0,0,0,0|1,0,0]=3 2549 B7R0.7 CCCN(N)CCO Amb27424310 [1,1,0,0,0,0|2,0,0]=4 2550 B7R0.7 CCCP(Cl)CCC Amb24120641 [1,1,0,0,0,0|1,0,0]=3 2551 B7R0.7 CCCS(=O)CCC Amb6366329 [1,1,0,0,0,0|0,0,1]=3 2552 B7R0.7 CCCS(=O)NCC Amb28062922 [1,1,0,0,0,0|1,0,1]=4 2553 B7R0.7 CCC[C@@H](C)CCBr Amb28363763 [1,1,0,0,0,0|2,0,0]=4 2554 B7R0.7 CCC[C@@H](N)CCO Amb22746035 [1,1,0,0,0,0|2,0,0]=4 2555 B7R0.7 CCC[C@@H](N)CNC Amb27452197 [1,1,0,0,0,0|2,0,0]=4 2556 B7R0.7 CCC[C@@H](O)CCN Amb33204237 [1,1,0,0,0,0|2,0,0]=4 2557 B7R0.7 CCC[C@@H](O)CCO Amb24422125 [1,1,0,0,0,0|2,0,0]=4 2558 B7R0.7 CCC[C@H](N)CCO Amb25889377 [1,1,0,0,0,0|2,0,0]=4 2559 B7R0.7 CCC[C@H](N)CCO Amb32409602 [1,1,0,0,0,0|2,0,0]=4 2560 B7R0.7 CCC[C@H](N)COC Amb28316177 [1,1,0,0,0,0|2,0,0]=4 2561 B7R0.7 CCC[C@H](N)CSC Amb28206579 [1,1,0,0,0,0|2,0,0]=4 2562 B7R0.7 CCC[C@H](O)CCN Amb33204238 [1,1,0,0,0,0|2,0,0]=4 2563 B7R0.7 CCC[PH](=O)CCC Amb26366296 [1,1,0,0,0,0|1,0,0]=3 2564 B7R0.7 CCNC(=O)SCC Amb24271089 [1,1,0,0,0,0|2,0,0]=4 2565 B7R0.7 CCNC(=S)SCC Amb27839147 [1,1,0,0,0,0|2,0,0]=4 2566 B7R0.7 CCOC(=S)SCC Amb17939407 [1,1,0,0,0,0|2,0,0]=4 2567 B7R0.7 CCOC(O)SCC Amb27653105 [1,1,0,0,0,0|2,0,0]=4 2568 B7R0.7 CCSC(=O)CCN Amb28043103 [1,1,0,0,0,0|2,0,0]=4 2569 B7R0.7 CCSC(=O)CCO Amb28044792 [1,1,0,0,0,0|2,0,0]=4 2570 B7R0.7 CCSC(=O)SCC Amb3986705 [1,1,0,0,0,0|2,0,0]=4 2571 B7R0.7 CCSC(=S)SCC Amb25771412 [1,1,0,0,0,0|2,0,0]=4 2572 B7R0.7 CCSC(C)CCCl Amb27880855 [1,1,0,0,0,0|2,0,0]=4 2573 B7R0.7 CCSC(C)CCO Amb26655908 [1,1,0,0,0,0|2,0,0]=4 2574 B7R0.7 CC\C=C(/C)CCC Amb28140596 [1,1,0,0,0,0|1,0,1]=4 2575 B7R0.7 CC\N=C(/N)SCC Amb24623199 [1,1,0,0,0,0|2,0,0]=4 2576 B7R0.7 CC\N=C(/N)SCC Amb27809281 [1,1,0,0,0,0|2,0,0]=4 2577 B7R0.7 CC\N=C(/N)SCC Amb28344791 [1,1,0,0,0,0|2,0,0]=4 2578 B9R0.4 CCCCC(=O)CC(C)Cl Amb27984861 [0,2,0,0,0,0|2,0,0]=4 2579 B9R0.4 CCCCC(C)CC(C)Cl Amb27972096 [0,2,0,0,0,0|2,0,0]=4 2580 B9R0.4 CCCCC(C)CC(C)N Amb27618079 [0,2,0,0,0,0|2,0,0]=4 2581 B9R0.4 CCCCC(C)CC(C)O Amb27839043 [0,2,0,0,0,0|2,0,0]=4 2582 B9R0.4 CCCCC(Cl)CC(C)C Amb27758354 [0,2,0,0,0,0|2,0,0]=4 2583 B9R0.4 CCCCC(N)CC(C)C Amb27168956 [0,2,0,0,0,0|2,0,0]=4 2584 B9R0.4 CCCCC(O)CC(C)C Amb22734801 [0,2,0,0,0,0|2,0,0]=4 2585 B9R0.4 CCCCN(C)CC(C)N Amb6661193 [0,2,0,0,0,0|2,0,0]=4 2586 B9R0.4 CCCCN(C)C[C@@H](C)N Amb18014373 [0,2,0,0,0,0|2,0,0]=4 2587 B9R0.4 CCCCN(C)C[C@H](C)N Amb5782063 [0,2,0,0,0,0|2,0,0]=4 2588 B9R0.4 CCCC[C@@H](O)CC(C)C Amb27399625 [0,2,0,0,0,0|2,0,0]=4 2589 B9R0.4 CCCC[C@@H](O)C[C@@H](C)O Amb27394748 [0,2,0,0,0,0|2,0,0]=4 2590 B9R0.4 CCCC[C@H](O)CC(C)C Amb28429013 [0,2,0,0,0,0|2,0,0]=4 2591 B9R0.4 CCCC[C@H](O)C[C@@H](C)O Amb27833061 [0,2,0,0,0,0|2,0,0]=4 2592 B9R0.4 CCCC[C@H](O)C[C@H](C)O Amb27594737 [0,2,0,0,0,0|2,0,0]=4 2593 B9R0.4 CCCNC(=N)CC(C)C Amb27490279 [0,2,0,0,0,0|2,0,0]=4 2594 B9R0.4 CCCNC(C)CC(C)Br Amb27860452 [0,2,0,0,0,0|2,0,0]=4 2595 B9R0.4 CCCOC(=O)CC(C)C Amb4035815 [0,2,0,0,0,0|1,1,0]=4 2596 B9R0.4 CCCOC(=O)CC(C)Cl Amb27668995 [0,2,0,0,0,0|1,1,0]=4 2597 B9R0.4 CCCSC(=O)CC(C)=O Amb28126646 [0,2,0,0,0,0|1,0,1]=4 2598 B9R0.4 CCCSC(=O)NC(C)C Amb28053187 [0,2,0,0,0,0|2,0,0]=4 2599 B9R0.5 C=C(CCC)CCCCCl Amb27835284 [0,2,0,0,0,0|2,0,0]=4 2600 B9R0.5 C=CCC(N)CSCCC Amb27763084 [0,2,0,0,0,0|1,0,1]=4 2601 B9R0.5 CC(CCN)SCCCN Amb27954527 [0,2,0,0,0,0|2,0,0]=4 2602 B9R0.5 CCCC#CC(O)CCCl Amb28195028 [0,2,0,0,0,0|2,0,0]=4 2603 B9R0.5 CCCC(=N)NCCSC Amb27412292 [0,2,0,0,0,0|2,0,0]=4 2604 B9R0.5 CCCC(=O)CCCCN Amb28058184 [0,2,0,0,0,0|2,0,0]=4 2605 B9R0.5 CCCC(=O)CCCSC Amb27758287 [0,2,0,0,0,0|2,0,0]=4 2606 B9R0.5 CCCC(=O)CSCCO Amb18800667 [0,2,0,0,0,0|2,0,0]=4 2607 B9R0.5 CCCC(=O)NCCSC Amb8504701 [0,2,0,0,0,0|2,0,0]=4 2608 B9R0.5 CCCC(=O)OCCCN Amb27272615 [0,2,0,0,0,0|1,1,0]=4 2609 B9R0.5 CCCC(=O)OCCCO Amb28292589 [0,2,0,0,0,0|1,1,0]=4 2610 B9R0.5 CCCC(Br)CCOCC Amb27392491 [0,2,0,0,0,0|2,0,0]=4 2611 B9R0.5 CCCC(C)CCCCCl Amb27626477 [0,2,0,0,0,0|2,0,0]=4 2612 B9R0.5 CCCC(C)CCCCN Amb25950864 [0,2,0,0,0,0|2,0,0]=4 2613 B9R0.5 CCCC(C)CCCCO Amb28046661 [0,2,0,0,0,0|2,0,0]=4 2614 B9R0.5 CCCC(C)CCNCC Amb27615018 [0,2,0,0,0,0|2,0,0]=4 2615 B9R0.5 CCCC(C)NCCCBr Amb27223537 [0,2,0,0,0,0|2,0,0]=4 2616 B9R0.5 CCCC(C)OCCCCl Amb27442914 [0,2,0,0,0,0|1,1,0]=4 2617 B9R0.5 CCCC(C)OCCCN Amb26057752 [0,2,0,0,0,0|1,1,0]=4 2618 B9R0.5 CCCC(C)OCCCS Amb27234480 [0,2,0,0,0,0|1,1,0]=4 2619 B9R0.5 CCCC(C)SCCCCl Amb27812508 [0,2,0,0,0,0|1,0,0]=3 2620 B9R0.5 CCCC(C)SCCOC Amb27827232 [0,2,0,0,0,0|1,0,0]=3 2621 B9R0.5 CCCC(Cl)CCCCCl Amb27823562 [0,2,0,0,0,0|2,0,0]=4 2622 B9R0.5 CCCC(F)CCCCO Amb27856506 [0,2,0,0,0,0|2,0,0]=4 2623 B9R0.5 CCCC(N)CCOCC Amb27816889 [0,2,0,0,0,0|2,0,0]=4 2624 B9R0.5 CCCC(N)CCSCC Amb27480968 [0,2,0,0,0,0|2,0,0]=4 2625 B9R0.5 CCCC(N)CSCCO Amb27968788 [0,2,0,0,0,0|2,0,0]=4 2626 B9R0.5 CCCC(O)CCNCC Amb28050120 [0,2,0,0,0,0|2,0,0]=4 2627 B9R0.5 CCCCCC(=O)CCC Amb2720457 [0,2,0,0,0,0|2,0,0]=4 2628 B9R0.5 CCCCCC(Br)CCC Amb28318288 [0,2,0,0,0,0|2,0,0]=4 2629 B9R0.5 CCCCCC(Br)COC Amb27849558 [0,2,0,0,0,0|2,0,0]=4 2630 B9R0.5 CCCCCC(C)CCBr Amb26637488 [0,2,0,0,0,0|2,0,0]=4 2631 B9R0.5 CCCCCC(C)CCC Amb4035718 [0,2,0,0,0,0|2,0,0]=4 2632 B9R0.5 CCCCCC(C)CCCl Amb27392063 [0,2,0,0,0,0|2,0,0]=4 2633 B9R0.5 CCCCCC(C)CCN Amb24738346 [0,2,0,0,0,0|2,0,0]=4 2634 B9R0.5 CCCCCC(C)CCO Amb24733660 [0,2,0,0,0,0|2,0,0]=4 2635 B9R0.5 CCCCCC(Cl)CCCl Amb27831205 [0,2,0,0,0,0|2,0,0]=4 2636 B9R0.5 CCCCCC(Cl)COC Amb18798379 [0,2,0,0,0,0|2,0,0]=4 2637 B9R0.5 CCCCCC(N)CCC Amb8869705 [0,2,0,0,0,0|2,0,0]=4 2638 B9R0.5 CCCCCC(N)COC Amb27206898 [0,2,0,0,0,0|2,0,0]=4 2639 B9R0.5 CCCCCC(O)CCN Amb24730197 [0,2,0,0,0,0|2,0,0]=4 2640 B9R0.5 CCCCCC(O)CCO Amb22270100 [0,2,0,0,0,0|2,0,0]=4 2641 B9R0.5 CCCCCC(O)CNC Amb27973914 [0,2,0,0,0,0|2,0,0]=4 2642 B9R0.5 CCCCC[C@@H](O)CCO Amb27946548 [0,2,0,0,0,0|2,0,0]=4 2643 B9R0.5 CCCCC[C@H](C)CCO Amb26861853 [0,2,0,0,0,0|2,0,0]=4 2644 B9R0.5 CCCCC[C@H](O)CCC Amb27652271 [0,2,0,0,0,0|2,0,0]=4 2645 B9R0.5 CCCCNC(=O)CCC Amb5797594 [0,2,0,0,0,0|2,0,0]=4 2646 B9R0.5 CCCCNC(C)CCBr Amb27403208 [0,2,0,0,0,0|2,0,0]=4 2647 B9R0.5 CCCCNC(C)CCO Amb27594265 [0,2,0,0,0,0|2,0,0]=4 2648 B9R0.5 CCCCOC(C)OCC Amb4019615 [0,2,0,0,0,0|1,1,0]=4 2649 B9R0.5 CCCCOC(O)CCC Amb27839284 [0,2,0,0,0,0|1,1,0]=4 2650 B9R0.5 CCCCSC(=O)NCC Amb27462695 [0,2,0,0,0,0|1,0,1]=4 2651 B9R0.5 CCCCSC(C)CCCl Amb27848679 [0,2,0,0,0,0|1,0,0]=3 2652 B9R0.5 CCCCSC(C)CCN Amb9174079 [0,2,0,0,0,0|1,0,0]=3 2653 B9R0.5 CCCCSC(C)COC Amb28078829 [0,2,0,0,0,0|1,0,0]=3 2654 B9R0.5 CCCN(C)CCCCF Amb27946988 [0,2,0,0,0,0|2,0,0]=4 2655 B9R0.5 CCCN(C)CCCCS Amb28049591 [0,2,0,0,0,0|2,0,0]=4 2656 B9R0.5 CCCNCC(C)CCCl Amb27877425 [0,2,0,0,0,0|2,0,0]=4 2657 B9R0.5 CCCNCC(N)COC Amb28137479 [0,2,0,0,0,0|2,0,0]=4 2658 B9R0.5 CCCNCC(O)CCO Amb27453664 [0,2,0,0,0,0|2,0,0]=4 2659 B9R0.5 CCCNC[C@@H](N)CCC Amb27877347 [0,2,0,0,0,0|2,0,0]=4 2660 B9R0.5 CCCNC[C@H](O)COC Amb28126305 [0,2,0,0,0,0|2,0,0]=4 2661 B9R0.5 CCCOCC(N)COC Amb27807201 [0,2,0,0,0,0|1,1,0]=4 2662 B9R0.5 CCCS(=O)NCCCCl Amb28319346 [0,2,0,0,0,0|1,0,1]=4 2663 B9R0.5 CCCS(=O)NCCCI Amb27212778 [0,2,0,0,0,0|1,0,1]=4 2664 B9R0.5 CCCSCC(=O)CCC Amb18800477 [0,2,0,0,0,0|1,0,0]=3 2665 B9R0.5 CCCSCC(N)CCC Amb27218055 [0,2,0,0,0,0|1,0,0]=3 2666 B9R0.5 CCCSCC(O)CC#N Amb18645236 [0,2,0,0,0,0|1,0,1]=4 2667 B9R0.5 CCCSCC(O)COC Amb27620692 [0,2,0,0,0,0|1,0,0]=3 2668 B9R0.5 CCCSC[C@@H](N)CCC Amb27755000 [0,2,0,0,0,0|1,0,0]=3 2669 B9R0.5 CCC[C@@H](C)CCCCBr Amb27956034 [0,2,0,0,0,0|2,0,0]=4 2670 B9R0.5 CCC[C@@H](F)CCCCO Amb27617034 [0,2,0,0,0,0|2,0,0]=4 2671 B9R0.5 CCC[C@@H](N)CCCOC Amb27167802 [0,2,0,0,0,0|2,0,0]=4 2672 B9R0.5 CCC[C@@H](N)CCOCC Amb27839454 [0,2,0,0,0,0|2,0,0]=4 2673 B9R0.5 CCC[C@H](C)CCCCO Amb27972560 [0,2,0,0,0,0|2,0,0]=4 2674 B9R0.5 CCC[C@H](C)OCCCO Amb27839315 [0,2,0,0,0,0|1,1,0]=4 2675 B9R0.5 CCC[C@H](F)CCCCO Amb27835909 [0,2,0,0,0,0|2,0,0]=4 2676 B9R0.5 CCC[C@H](N)CCCCO Amb27799723 [0,2,0,0,0,0|2,0,0]=4 2677 B9R0.5 CCC[C@H](N)CCOCC Amb28239931 [0,2,0,0,0,0|2,0,0]=4 2678 B9R0.5 CCC\C(C)=N\CCCN Amb27469410 [0,2,0,0,0,0|2,0,0]=4 2679 B9R0.5 CCC\C=C/C(O)CCCl Amb27173673 [0,2,0,0,0,0|2,0,0]=4 2680 B9R0.5 CCC\C=C\C(=O)CCC Amb17593554 [0,2,0,0,0,0|2,0,0]=4 2681 B9R0.5 CCC\C=C\C(C)CCN Amb33327174 [0,2,0,0,0,0|2,0,0]=4 2682 B9R0.5 CCC\C=C\C(F)CCN Amb33424859 [0,2,0,0,0,0|2,0,0]=4 2683 B9R0.5 CCC\C=C\C(N)CCO Amb33327183 [0,2,0,0,0,0|2,0,0]=4 2684 B9R0.5 CCC\C=C\C(O)CCC Amb27839603 [0,2,0,0,0,0|2,0,0]=4 2685 B9R0.5 CCC\C=C\C(O)CCN Amb33327184 [0,2,0,0,0,0|2,0,0]=4 2686 B9R0.5 CCC\C=C\C(O)CCO Amb27456608 [0,2,0,0,0,0|2,0,0]=4 2687 B9R0.5 CCC\C=C\C(O)CNC Amb33327173 [0,2,0,0,0,0|2,0,0]=4 2688 B9R0.5 CCC\C=C\[C@@H](O)CCN Amb33424860 [0,2,0,0,0,0|2,0,0]=4 2689 B9R0.5 CCC\C=C\[C@H](O)CCN Amb33424861 [0,2,0,0,0,0|2,0,0]=4 2690 B9R0.5 CCOCSC(C)CCN Amb27777128 [0,2,0,0,0,0|2,0,0]=4 2691 B9R0.5 COCC(C)SCCCN Amb27669037 [0,2,0,0,0,0|2,0,0]=4 2692 B9R0.5 COCC(N)CSCCO Amb28315396 [0,2,0,0,0,0|2,0,0]=4 2693 B9R0.5 COCCSC(C)CCN Amb18792519 [0,2,0,0,0,0|2,0,0]=4 2694 B9R0.5 CSCC(O)CSCCO Amb27989135 [0,2,0,0,0,0|2,0,0]=4 2695 B9R0.5 CSCCSC(C)CCO Amb28456145 [0,2,0,0,0,0|2,0,0]=4 2696 B9R0.5 NC(CCO)CSCCO Amb27262281 [0,2,0,0,0,0|2,0,0]=4 2697 B9R0.5 NCCSCC(O)CCN Amb27393782 [0,2,0,0,0,0|2,0,0]=4 2698 B9R0.8 C=C(CCCC)[C@@H](O)CC Amb28138626 [0,2,0,0,0,0|2,0,0]=4 2699 B9R0.8 CCC(C)C(C)SCCN Amb28313467 [0,2,0,0,0,0|2,0,0]=4 2700 B9R0.8 CCC(C)C(C)SCCO Amb28342503 [0,2,0,0,0,0|2,0,0]=4 2701 B9R0.8 CCC(N)C(C)SCCO Amb28045310 [0,2,0,0,0,0|2,0,0]=4 2702 B9R0.8 CCCCC(=O)C(N)CC Amb28341962 [0,2,0,0,0,0|2,0,0]=4 2703 B9R0.8 CCCCC(=O)[C@H](F)CC Amb28253956 [0,2,0,0,0,0|2,0,0]=4 2704 B9R0.8 CCCCC(Cl)C(Cl)CC Amb26948736 [0,2,0,0,0,0|2,0,0]=4 2705 B9R0.8 CCCCC(O)C(C)CC Amb4020074 [0,2,0,0,0,0|2,0,0]=4 2706 B9R0.8 CCCC[C@@H](C)[C@@H](O)CC Amb27981905 [0,2,0,0,0,0|2,0,0]=4 2707 B9R0.8 CCCC[C@@H](C)[C@H](O)CC Amb27980692 [0,2,0,0,0,0|2,0,0]=4 2708 B9R0.8 CCCC[C@@H](N)[C@@H](C)CC Amb27240864 [0,2,0,0,0,0|2,0,0]=4 2709 B9R0.8 CCCC[C@@H](O)[C@@H](C)CC Amb27839219 [0,2,0,0,0,0|2,0,0]=4 2710 B9R0.8 CCCNC(=O)C(Br)CC Amb9174115 [0,2,0,0,0,0|2,0,0]=4 2711 B9R0.8 CCCNC(=O)[C@@H](N)CC Amb26398899 [0,2,0,0,0,0|2,0,0]=4 2712 B9R0.8 CCCNC(=O)[C@@H](N)CC Amb35751627 [0,2,0,0,0,0|2,0,0]=4 2713 B9R0.8 CCCNC(=O)[C@H](N)CC Amb27455202 [0,2,0,0,0,0|2,0,0]=4 2714 B9R0.8 CCCNC(=O)[C@H](N)CC Amb35749766 [0,2,0,0,0,0|2,0,0]=4 2715 B9R0.8 CCCNC(C)C(C)CC Amb6719115 [0,2,0,0,0,0|2,0,0]=4 2716 B9R0.8 CCCOC(=O)C(Br)CC Amb18090817 [0,2,0,0,0,0|1,1,0]=4 2717 B9R0.8 CCCOC(=O)C(Cl)CC Amb27865645 [0,2,0,0,0,0|1,1,0]=4 2718 B9R0.8 CCCOC(=O)C(O)CC Amb28281680 [0,2,0,0,0,0|1,1,0]=4 2719 B9R0.8 CCCOC(C)C(N)CC Amb8874669 [0,2,0,0,0,0|1,1,0]=4 2720 B9R0.18 C=C(CCCC)CCCC Amb22641581 [0,2,0,0,0,0|2,0,0]=4 2721 B9R0.18 C=C(CCCC)CCCN Amb27168161 [0,2,0,0,0,0|2,0,0]=4 2722 B9R0.18 C=C(CCCC)CCCO Amb28318705 [0,2,0,0,0,0|2,0,0]=4 2723 B9R0.18 CC(SCCO)SCCO Amb27652984 [0,2,0,0,0,0|2,0,0]=4 2724 B9R0.18 CCCCB(O)CCCC Amb25797237 [0,2,0,0,0,0|2,0,0]=4 2725 B9R0.18 CCCCC(=O)CCCC Amb534166 [0,2,0,0,0,0|2,0,0]=4 2726 B9R0.18 CCCCC(=O)CCCCl Amb26353274 [0,2,0,0,0,0|2,0,0]=4 2727 B9R0.18 CCCCC(=O)CCCN Amb28050428 [0,2,0,0,0,0|2,0,0]=4 2728 B9R0.18 CCCCC(=O)CCCO Amb25146585 [0,2,0,0,0,0|2,0,0]=4 2729 B9R0.18 CCCCC(=O)CCNC Amb27771104 [0,2,0,0,0,0|2,0,0]=4 2730 B9R0.18 CCCCC(=O)COCC Amb26504310 [0,2,0,0,0,0|2,0,0]=4 2731 B9R0.18 CCCCC(C)CCCO Amb28256728 [0,2,0,0,0,0|2,0,0]=4 2732 B9R0.18 CCCCC(Cl)CCCC Amb26844527 [0,2,0,0,0,0|2,0,0]=4 2733 B9R0.18 CCCCC(Cl)CCCCl Amb28313997 [0,2,0,0,0,0|2,0,0]=4 2734 B9R0.18 CCCCC(Cl)CCCO Amb24482147 [0,2,0,0,0,0|2,0,0]=4 2735 B9R0.18 CCCCC(N)CCCC Amb22229936 [0,2,0,0,0,0|2,0,0]=4 2736 B9R0.18 CCCCC(N)CCSC Amb27466169 [0,2,0,0,0,0|2,0,0]=4 2737 B9R0.18 CCCCC(N)COCC Amb28138872 [0,2,0,0,0,0|2,0,0]=4 2738 B9R0.18 CCCCC(N)CSCC Amb27966627 [0,2,0,0,0,0|2,0,0]=4 2739 B9R0.18 CCCCC(O)CCCF Amb28345334 [0,2,0,0,0,0|2,0,0]=4 2740 B9R0.18 CCCCC(O)CCCO Amb27952639 [0,2,0,0,0,0|2,0,0]=4 2741 B9R0.18 CCCCC(O)CCCS Amb27431295 [0,2,0,0,0,0|2,0,0]=4 2742 B9R0.18 CCCCC(O)CCOC Amb27410357 [0,2,0,0,0,0|2,0,0]=4 2743 B9R0.18 CCCCN(C)CCCC Amb8515459 [0,2,0,0,0,0|2,0,0]=4 2744 B9R0.18 CCCCN(C)CCCCl Amb17334590 [0,2,0,0,0,0|2,0,0]=4 2745 B9R0.18 CCCCN(C)CCCN Amb1108729 [0,2,0,0,0,0|2,0,0]=4 2746 B9R0.18 CCCCN(N)CCCC Amb836806 [0,2,0,0,0,0|2,0,0]=4 2747 B9R0.18 CCCCN(O)CCCC Amb28062392 [0,2,0,0,0,0|2,0,0]=4 2748 B9R0.18 CCCCP(Cl)CCCC Amb22353630 [0,2,0,0,0,0|2,0,0]=4 2749 B9R0.18 CCCC[C@@H](C)CCCO Amb27598602 [0,2,0,0,0,0|2,0,0]=4 2750 B9R0.18 CCCC[C@H](C)CCCBr Amb27646432 [0,2,0,0,0,0|2,0,0]=4 2751 B9R0.18 CCCC[C@H](C)CCCO Amb27869929 [0,2,0,0,0,0|2,0,0]=4 2752 B9R0.18 CCCC[C@H](N)CNCC Amb27828439 [0,2,0,0,0,0|2,0,0]=4 2753 B9R0.18 CCCC[NH+](C)CCCC Amb33512914 [0,2,0,0,0,0|2,0,0]=4 2754 B9R0.18 CCCC[PH-](=O)CCCC Amb27230858 [0,2,0,0,0,0|2,0,0]=4 2755 B9R0.18 CCCC[PH](=O)CCCC Amb4297292 [0,2,0,0,0,0|2,0,0]=4 2756 B9R0.18 CCCC[Sn](=O)CCCC Amb8513797 [0,2,0,0,0,0|2,0,0]=4 2757 B9R0.18 CCCNC(=O)CCCCl Amb1135964 [0,2,0,0,0,0|2,0,0]=4 2758 B9R0.18 CCCNC(=O)CCCS Amb27802904 [0,2,0,0,0,0|2,0,0]=4 2759 B9R0.18 CCCNC(=O)CCOC Amb24480776 [0,2,0,0,0,0|2,0,0]=4 2760 B9R0.18 CCCNC(=O)CCSC Amb27630777 [0,2,0,0,0,0|2,0,0]=4 2761 B9R0.18 CCCNC(=O)NCCC Amb9825634 [0,2,0,0,0,0|2,0,0]=4 2762 B9R0.18 CCCNC(=O)OCCC Amb24460257 [0,2,0,0,0,0|1,1,0]=4 2763 B9R0.18 CCCNC(=O)SCCC Amb27442946 [0,2,0,0,0,0|1,0,0]=3 2764 B9R0.18 CCCNC(=O)SCCN Amb27421868 [0,2,0,0,0,0|2,0,0]=4 2765 B9R0.18 CCCNC(=S)NCCC Amb2720876 [0,2,0,0,0,0|2,0,0]=4 2766 B9R0.18 CCCNC(=S)OCCC Amb28068732 [0,2,0,0,0,0|1,1,0]=4 2767 B9R0.18 CCCNC(C)CCOC Amb27768598 [0,2,0,0,0,0|2,0,0]=4 2768 B9R0.18 CCCNC(C)CNCC Amb28281328 [0,2,0,0,0,0|2,0,0]=4 2769 B9R0.18 CCCOC(=N)OCCC Amb24698422 [0,2,0,0,0,0|0,2,0]=4 2770 B9R0.18 CCCOC(=O)CCCBr Amb28287770 [0,2,0,0,0,0|1,1,0]=4 2771 B9R0.18 CCCOC(=O)CCCS Amb27466699 [0,2,0,0,0,0|1,1,0]=4 2772 B9R0.18 CCCOC(=O)CCNC Amb28074901 [0,2,0,0,0,0|1,1,0]=4 2773 B9R0.18 CCCOC(=O)COCC Amb9243004 [0,2,0,0,0,0|1,1,0]=4 2774 B9R0.18 CCCOC(=O)OCCC Amb22336422 [0,2,0,0,0,0|0,2,0]=4 2775 B9R0.18 CCCOC(C)CNCC Amb27644225 [0,2,0,0,0,0|1,1,0]=4 2776 B9R0.18 CCCOC(C)OCCC Amb22729236 [0,2,0,0,0,0|0,2,0]=4 2777 B9R0.18 CCCOP(O)OCCC Amb10606107 [0,2,0,0,0,0|0,2,0]=4 2778 B9R0.18 CCCOS(=O)OCCC Amb10807470 [0,2,0,0,0,0|0,1,1]=4 2779 B9R0.18 CCCSP(C)SCCC Amb25143636 [0,2,0,0,0,0|0,0,0]=2 2780 B9R0.18 CCCS\C(Cl)=N\CCCl Amb27252222 [0,2,0,0,0,0|2,0,0]=4 2781 B9R0.18 CCNSC(=O)SCCN Amb27869918 [0,2,0,0,0,0|2,0,0]=4 2782 B9R0.18 COCCC(C)SCCN Amb27617183 [0,2,0,0,0,0|2,0,0]=4 2783 B9R0.18 OCCSC(=S)SCCO Amb28044416 [0,2,0,0,0,0|2,0,0]=4 2784 B9R0.34 CCC(C)SC(C)CNC Amb18798060 [0,2,0,0,0,0|2,0,0]=4 2785 B9R0.34 CCCC(=O)CC(N)CC Amb27247540 [0,2,0,0,0,0|2,0,0]=4 2786 B9R0.34 CCCC(=O)C[C@@H](C)CC Amb28351517 [0,2,0,0,0,0|2,0,0]=4 2787 B9R0.34 CCCC(=O)C[C@H](O)CC Amb27434206 [0,2,0,0,0,0|2,0,0]=4 2788 B9R0.34 CCCC(=O)OC(C)CC Amb22732903 [0,2,0,0,0,0|1,1,0]=4 2789 B9R0.34 CCCC(Br)CC(C)CC Amb28320357 [0,2,0,0,0,0|2,0,0]=4 2790 B9R0.34 CCCC(C)CC(O)CC Amb27946318 [0,2,0,0,0,0|2,0,0]=4 2791 B9R0.34 CCCC(Cl)CC(C)CC Amb27779055 [0,2,0,0,0,0|2,0,0]=4 2792 B9R0.34 CCCC(N)CC(C)CC Amb27667483 [0,2,0,0,0,0|2,0,0]=4 2793 B9R0.34 CCCC(O)CC(O)CC Amb9134757 [0,2,0,0,0,0|2,0,0]=4 2794 B9R0.34 CCCC(O)C[C@@H](C)CC Amb27470864 [0,2,0,0,0,0|2,0,0]=4 2795 B9R0.34 CCCN(C)CC(F)CC Amb27456100 [0,2,0,0,0,0|2,0,0]=4 2796 B9R0.34 CCCN(C)CC(N)CC Amb9514565 [0,2,0,0,0,0|2,0,0]=4 2797 B9R0.34 CCCS(=O)NC(C)CC Amb28144513 [0,2,0,0,0,0|1,0,1]=4 2798 B9R0.34 CCNC(=O)SC(C)CC Amb28049868 [0,2,0,0,0,0|2,0,0]=4 2799 B9R0.35 C=C(CCC)C(O)CCC Amb27598582 [0,2,0,0,0,0|2,0,0]=4 2800 B9R0.35 CCCC(=O)C(=O)CCC Amb22732205 [0,2,0,0,0,0|2,0,0]=4 2801 B9R0.35 CCCC(=O)C(C)CCC Amb22230010 [0,2,0,0,0,0|2,0,0]=4 2802 B9R0.35 CCCC(=O)C(Cl)CCC Amb28384164 [0,2,0,0,0,0|2,0,0]=4 2803 B9R0.35 CCCC(=O)C(O)CCC Amb2721183 [0,2,0,0,0,0|2,0,0]=4 2804 B9R0.35 CCCC(=O)N(N)CCC Amb33191584 [0,2,0,0,0,0|2,0,0]=4 2805 B9R0.35 CCCC(=O)[C@@H](O)CCC Amb27613184 [0,2,0,0,0,0|2,0,0]=4 2806 B9R0.35 CCCC(C)C(Br)CCC Amb28049951 [0,2,0,0,0,0|2,0,0]=4 2807 B9R0.35 CCCC(C)C(C)CCC Amb10069377 [0,2,0,0,0,0|2,0,0]=4 2808 B9R0.35 CCCC(C)C(O)CCC Amb22229849 [0,2,0,0,0,0|2,0,0]=4 2809 B9R0.35 CCCC(F)C(Br)CCC Amb27855476 [0,2,0,0,0,0|2,0,0]=4 2810 B9R0.35 CCCC(O)C(Cl)CCC Amb27454832 [0,2,0,0,0,0|2,0,0]=4 2811 B9R0.35 CCC[C@@H](C)[C@H](O)CCC Amb28050718 [0,2,0,0,0,0|2,0,0]=4 2812 B9R0.35 CCC[C@@H](Cl)[C@H](Cl)CCC Amb28365860 [0,2,0,0,0,0|2,0,0]=4 2813 B9R0.35 CCC[C@H](Cl)[C@H](Cl)CCC Amb27228458 [0,2,0,0,0,0|2,0,0]=4 2814 B9R0.35 CCC[C@H](N)[C@H](N)CCC Amb27617082 [0,2,0,0,0,0|2,0,0]=4 2815 B9R0.35 CCC[C@H](O)[C@H](Br)CCC Amb27439075 [0,2,0,0,0,0|2,0,0]=4 2816 B9R0.35 CCC[C@H](O)[C@H](O)CCC Amb28428987 [0,2,0,0,0,0|2,0,0]=4 2817 B9R0.40 C#CC(CCC)NCCC Amb27770399 [0,2,0,0,0,0|2,0,0]=4 2818 B9R0.40 CCCC(C#N)SCCCl Amb27873416 [0,2,0,0,0,0|2,0,0]=4 2819 B9R0.40 CCCC(C#N)SCCO Amb28400841 [0,2,0,0,0,0|2,0,0]=4 2820 B9R0.40 CCCC(CC)SCCF Amb27775287 [0,2,0,0,0,0|2,0,0]=4 2821 B9R0.40 CCCC(CC)SCSC Amb27458759 [0,2,0,0,0,0|2,0,0]=4 2822 B9R0.40 CCCCC(C=O)CCC Amb27237029 [0,2,0,0,0,0|2,0,0]=4 2823 B9R0.40 CCCCC(CBr)CCC Amb26369676 [0,2,0,0,0,0|2,0,0]=4 2824 B9R0.40 CCCCC(CC)CCC Amb25335776 [0,2,0,0,0,0|2,0,0]=4 2825 B9R0.40 CCCCC(CCC)ON Amb28292987 [0,2,0,0,0,0|2,0,0]=4 2826 B9R0.40 CCCCC(CCl)CCC Amb25206828 [0,2,0,0,0,0|2,0,0]=4 2827 B9R0.40 CCCCC(CN)CCC Amb20632050 [0,2,0,0,0,0|2,0,0]=4 2828 B9R0.40 CCCCC(CO)CCC Amb26011965 [0,2,0,0,0,0|2,0,0]=4 2829 B9R0.40 CCCCN(CCC)N=O Amb26462487 [0,2,0,0,0,0|2,0,0]=4 2830 B9R0.40 CCCNC(C#N)CCC Amb9205143 [0,2,0,0,0,0|2,0,0]=4 2831 B9R0.40 CCCNC(CC)CCC Amb28064267 [0,2,0,0,0,0|2,0,0]=4 2832 B9R0.40 CCCN[C@H](CO)CCC Amb27195642 [0,2,0,0,0,0|2,0,0]=4 2833 B9R0.40 CCCN\C(CCC)=N\O Amb27428034 [0,2,0,0,0,0|2,0,0]=4 2834 B9R0.48 CCCC(=O)CCC(C)C Amb9031590 [0,2,0,0,0,0|2,0,0]=4 2835 B9R0.48 CCCC(=O)CCC(C)N Amb27866591 [0,2,0,0,0,0|2,0,0]=4 2836 B9R0.48 CCCC(=O)NCC(C)Br Amb27167202 [0,2,0,0,0,0|2,0,0]=4 2837 B9R0.48 CCCC(=O)NCC(C)O Amb9275481 [0,2,0,0,0,0|2,0,0]=4 2838 B9R0.48 CCCC(=O)OCC(C)Br Amb25887822 [0,2,0,0,0,0|1,1,0]=4 2839 B9R0.48 CCCC(=O)OCC(C)C Amb4017886 [0,2,0,0,0,0|1,1,0]=4 2840 B9R0.48 CCCC(=O)OCC(C)O Amb26603876 [0,2,0,0,0,0|1,1,0]=4 2841 B9R0.48 CCCC(Br)CCC(C)C Amb28063055 [0,2,0,0,0,0|2,0,0]=4 2842 B9R0.48 CCCC(C)CCC(C)N Amb25775537 [0,2,0,0,0,0|2,0,0]=4 2843 B9R0.48 CCCC(C)CCC(C)O Amb26868390 [0,2,0,0,0,0|2,0,0]=4 2844 B9R0.48 CCCC(C)CC[C@@H](C)N Amb33223658 [0,2,0,0,0,0|2,0,0]=4 2845 B9R0.48 CCCC(C)CC[C@@H](C)O Amb33321144 [0,2,0,0,0,0|2,0,0]=4 2846 B9R0.48 CCCC(C)CC[C@H](C)N Amb33321143 [0,2,0,0,0,0|2,0,0]=4 2847 B9R0.48 CCCC(C)CC[C@H](C)O Amb33321145 [0,2,0,0,0,0|2,0,0]=4 2848 B9R0.48 CCCC(C)NC[C@H](C)O Amb27442940 [0,2,0,0,0,0|2,0,0]=4 2849 B9R0.48 CCCC(C)OCC(C)N Amb28077537 [0,2,0,0,0,0|1,1,0]=4 2850 B9R0.48 CCCC(C)OC[C@H](C)N Amb27424873 [0,2,0,0,0,0|1,1,0]=4 2851 B9R0.48 CCCC(C)OC[C@H](C)O Amb27424875 [0,2,0,0,0,0|1,1,0]=4 2852 B9R0.48 CCCC(C)SCC(C)=O Amb28280192 [0,2,0,0,0,0|1,0,1]=4 2853 B9R0.48 CCCC(Cl)OCC(C)C Amb28050900 [0,2,0,0,0,0|1,1,0]=4 2854 B9R0.48 CCCC(O)CCC(C)C Amb27971606 [0,2,0,0,0,0|2,0,0]=4 2855 B9R0.48 CCCN(C)CCC(C)Br Amb27224607 [0,2,0,0,0,0|2,0,0]=4 2856 B9R0.48 CCCN(C)CCC(C)Cl Amb28186132 [0,2,0,0,0,0|2,0,0]=4 2857 B9R0.48 CCCS(=O)NC[C@@H](C)O Amb27613575 [0,2,0,0,0,0|1,0,1]=4 2858 B9R0.48 CCC[C@@H](N)CCC(C)C Amb28050311 [0,2,0,0,0,0|2,0,0]=4 2859 B9R0.48 CCNC(=S)SCC(C)C Amb27185507 [0,2,0,0,0,0|2,0,0]=4 2860 B9R0.66 CCCCC(C)(C)CCC Amb22052712 [0,2,0,0,0,0|2,0,0]=4 2861 B9R0.66 CCCCC(C)(Cl)CCC Amb25840834 [0,2,0,0,0,0|2,0,0]=4 2862 B9R0.66 CCCS(=O)(=O)SCCN Amb27244725 [0,2,0,0,0,0|1,0,1]=4 2863 B9R0.66 CCCSP(=S)(Cl)OCC Amb22168175 [0,2,0,0,0,0|2,0,0]=4 2864 B9R0.66 CCCSP(C)(=O)OCC Amb348490 [0,2,0,0,0,0|2,0,0]=4 2865 B9R0.66 CCCSS(=O)(=O)CCC Amb25300950 [0,2,0,0,0,0|0,0,1]=3 2866 B9R0.2 C#CCCCSCC(C)C Amb27770468 [0,2,0,0,0,0|1,0,1]=4 2867 B9R0.2 C=C(C)CCCCCCC Amb6298940 [0,2,0,0,0,0|2,0,0]=4 2868 B9R0.2 C=C(C)CCSCCCC Amb27199306 [0,2,0,0,0,0|1,0,0]=3 2869 B9R0.2 C=C(C)CCSCCCN Amb27615176 [0,2,0,0,0,0|1,0,1]=4 2870 B9R0.2 C=C(C)CSCCCCC Amb27977453 [0,2,0,0,0,0|1,0,1]=4 2871 B9R0.2 C=C(C)CSCCCCN Amb17500961 [0,2,0,0,0,0|1,0,1]=4 2872 B9R0.2 C=C(C)CSCCSCC Amb27970745 [0,2,0,0,0,0|1,0,1]=4 2873 B9R0.2 CC#CCCSCC(C)C Amb27831843 [0,2,0,0,0,0|1,0,1]=4 2874 B9R0.2 CC#CCCSCC(C)N Amb27615160 [0,2,0,0,0,0|1,0,1]=4 2875 B9R0.2 CC#CCSCCC(C)C Amb27757782 [0,2,0,0,0,0|1,0,1]=4 2876 B9R0.2 CC#CCSCCC(C)N Amb27201547 [0,2,0,0,0,0|1,0,1]=4 2877 B9R0.2 CC(=O)CCCSCCO Amb9660259 [0,2,0,0,0,0|2,0,0]=4 2878 B9R0.2 CC(=O)CSCCCCF Amb27952719 [0,2,0,0,0,0|1,0,1]=4 2879 B9R0.2 CC(=O)CSCCCCN Amb17500952 [0,2,0,0,0,0|1,0,1]=4 2880 B9R0.2 CC(C)CCCCCCBr Amb20240805 [0,2,0,0,0,0|2,0,0]=4 2881 B9R0.2 CC(C)CCCCCCN Amb6608741 [0,2,0,0,0,0|2,0,0]=4 2882 B9R0.2 CC(C)CCNCCCCl Amb27466095 [0,2,0,0,0,0|2,0,0]=4 2883 B9R0.2 CC(C)CCNCCCN Amb17315309 [0,2,0,0,0,0|2,0,0]=4 2884 B9R0.2 CC(C)CCNCCCO Amb6733599 [0,2,0,0,0,0|2,0,0]=4 2885 B9R0.2 CC(C)CCOCCCN Amb6248634 [0,2,0,0,0,0|1,1,0]=4 2886 B9R0.2 CC(C)CCOCCCS Amb27594404 [0,2,0,0,0,0|1,1,0]=4 2887 B9R0.2 CC(C)CCSCCC=O Amb27589044 [0,2,0,0,0,0|1,0,1]=4 2888 B9R0.2 CC(C)CCSCCCN Amb17500699 [0,2,0,0,0,0|1,0,0]=3 2889 B9R0.2 CC(C)CCSCCCO Amb17502843 [0,2,0,0,0,0|1,0,0]=3 2890 B9R0.2 CC(C)CCSCCON Amb28062828 [0,2,0,0,0,0|2,0,0]=4 2891 B9R0.2 CC(C)CNCCCCBr Amb27839561 [0,2,0,0,0,0|2,0,0]=4 2892 B9R0.2 CC(C)CNCCCCN Amb17334222 [0,2,0,0,0,0|2,0,0]=4 2893 B9R0.2 CC(C)CNCCCCO Amb17334252 [0,2,0,0,0,0|2,0,0]=4 2894 B9R0.2 CC(C)COCCCCBr Amb8855451 [0,2,0,0,0,0|1,1,0]=4 2895 B9R0.2 CC(C)COCCCCCl Amb18798375 [0,2,0,0,0,0|1,1,0]=4 2896 B9R0.2 CC(C)COCCCCO Amb27617219 [0,2,0,0,0,0|1,1,0]=4 2897 B9R0.2 CC(C)CONCCCF Amb27425111 [0,2,0,0,0,0|1,1,0]=4 2898 B9R0.2 CC(C)CONCCCN Amb27227696 [0,2,0,0,0,0|1,1,0]=4 2899 B9R0.2 CC(C)CSCCCC#N Amb7764593 [0,2,0,0,0,0|1,0,1]=4 2900 B9R0.2 CC(C)CSCCCCN Amb9391257 [0,2,0,0,0,0|1,0,0]=3 2901 B9R0.2 CC(C)NCCSCCN Amb18798167 [0,2,0,0,0,0|2,0,0]=4 2902 B9R0.2 CC(C)OCCSCCO Amb18800853 [0,2,0,0,0,0|2,0,0]=4 2903 B9R0.2 CC(C)OCSCCCN Amb27169800 [0,2,0,0,0,0|2,0,0]=4 2904 B9R0.2 CC(C)SCCSCCO Amb27603017 [0,2,0,0,0,0|2,0,0]=4 2905 B9R0.2 CC(Cl)CCCCCCN Amb28137853 [0,2,0,0,0,0|2,0,0]=4 2906 B9R0.2 CC(N)CCSCCCN Amb27755582 [0,2,0,0,0,0|1,0,0]=3 2907 B9R0.2 CC(N)CSCCCC#N Amb27231289 [0,2,0,0,0,0|1,0,1]=4 2908 B9R0.2 CC(N)CSCCCCO Amb27801506 [0,2,0,0,0,0|1,0,0]=3 2909 B9R0.2 CC(N)C\C=C\CCCN Amb27420122 [0,2,0,0,0,0|2,0,0]=4 2910 B9R0.2 CC(O)CC#CCCCO Amb28050415 [0,2,0,0,0,0|2,0,0]=4 2911 B9R0.2 CC(O)CCCCCCO Amb27272851 [0,2,0,0,0,0|2,0,0]=4 2912 B9R0.2 CC(O)CCNCCCF Amb27817504 [0,2,0,0,0,0|2,0,0]=4 2913 B9R0.2 CC(O)COCCCCN Amb28246831 [0,2,0,0,0,0|1,1,0]=4 2914 B9R0.2 CCCC=C=CCC(C)O Amb27826112 [0,2,0,0,0,0|2,0,0]=4 2915 B9R0.2 CCCCC#CCC(C)O Amb28190297 [0,2,0,0,0,0|2,0,0]=4 2916 B9R0.2 CCCCC#CC[C@@H](C)O Amb27812433 [0,2,0,0,0,0|2,0,0]=4 2917 B9R0.2 CCCCC#CC[C@H](C)O Amb27755474 [0,2,0,0,0,0|2,0,0]=4 2918 B9R0.2 CCCCCCCC(C)=O Amb6891951 [0,2,0,0,0,0|2,0,0]=4 2919 B9R0.2 CCCCCCCC(C)Br Amb3940567 [0,2,0,0,0,0|2,0,0]=4 2920 B9R0.2 CCCCCCCC(C)C Amb6366303 [0,2,0,0,0,0|2,0,0]=4 2921 B9R0.2 CCCCCCCC(C)S Amb7795228 [0,2,0,0,0,0|2,0,0]=4 2922 B9R0.2 CCCCCCC[C@@H](C)Br Amb28252396 [0,2,0,0,0,0|2,0,0]=4 2923 B9R0.2 CCCCCCC[C@@H](C)N Amb22042159 [0,2,0,0,0,0|2,0,0]=4 2924 B9R0.2 CCCCCCC[C@@H](C)O Amb22362646 [0,2,0,0,0,0|2,0,0]=4 2925 B9R0.2 CCCCCCC[C@H](C)N Amb22042160 [0,2,0,0,0,0|2,0,0]=4 2926 B9R0.2 CCCCCCC[C@H](C)O Amb22362633 [0,2,0,0,0,0|2,0,0]=4 2927 B9R0.2 CCCCCCOC(C)C Amb28320041 [0,2,0,0,0,0|2,0,0]=4 2928 B9R0.2 CCCCCCOC(C)Cl Amb25662692 [0,2,0,0,0,0|2,0,0]=4 2929 B9R0.2 CCCCCCOC(C)O Amb28347016 [0,2,0,0,0,0|2,0,0]=4 2930 B9R0.2 CCCCCCSC(C)C Amb28315852 [0,2,0,0,0,0|2,0,0]=4 2931 B9R0.2 CCCCCOCC(C)N Amb8902896 [0,2,0,0,0,0|1,1,0]=4 2932 B9R0.2 CCCCCOC[C@@H](C)N Amb27490460 [0,2,0,0,0,0|1,1,0]=4 2933 B9R0.2 CCCCCOC[C@H](C)O Amb27620605 [0,2,0,0,0,0|1,1,0]=4 2934 B9R0.2 CCCCNCCC(C)=O Amb26381876 [0,2,0,0,0,0|2,0,0]=4 2935 B9R0.2 CCCCNCCC(C)O Amb27986026 [0,2,0,0,0,0|2,0,0]=4 2936 B9R0.2 CCCCNCCN(C)C Amb1124804 [0,2,0,0,0,0|2,0,0]=4 2937 B9R0.2 CCCCOCCC(Cl)Cl Amb27232855 [0,2,0,0,0,0|1,1,0]=4 2938 B9R0.2 CCCCOCCN(C)C Amb27192355 [0,2,0,0,0,0|1,1,0]=4 2939 B9R0.2 CCCCSCCC(=O)O Amb1032992 [0,2,0,0,0,0|1,0,1]=4 2940 B9R0.2 CCCCSCCC(C)C Amb27651351 [0,2,0,0,0,0|1,0,0]=3 2941 B9R0.2 CCCCSCCC(C)N Amb28189560 [0,2,0,0,0,0|1,0,0]=3 2942 B9R0.2 CCCCSCCC(N)=S Amb17503251 [0,2,0,0,0,0|1,0,1]=4 2943 B9R0.2 CCCC\C=C\CC(C)O Amb27839464 [0,2,0,0,0,0|2,0,0]=4 2944 B9R0.2 CCCNCCCC(C)C Amb8853733 [0,2,0,0,0,0|2,0,0]=4 2945 B9R0.2 CCCNCCCC(C)N Amb27475709 [0,2,0,0,0,0|2,0,0]=4 2946 B9R0.2 CCCNCCCN(C)C Amb6699374 [0,2,0,0,0,0|2,0,0]=4 2947 B9R0.2 CCCN\N=C\CC(C)C Amb27603038 [0,2,0,0,0,0|2,0,0]=4 2948 B9R0.2 CCCOCCCC(C)Cl Amb27795432 [0,2,0,0,0,0|1,1,0]=4 2949 B9R0.2 CCCONCCC(C)C Amb28396906 [0,2,0,0,0,0|1,1,0]=4 2950 B9R0.2 CCCONCCC(C)O Amb27244555 [0,2,0,0,0,0|1,1,0]=4 2951 B9R0.2 CCCSCCCC(=O)O Amb6680215 [0,2,0,0,0,0|1,0,1]=4 2952 B9R0.2 CCCSCCCC(C)=O Amb9660304 [0,2,0,0,0,0|1,0,0]=3 2953 B9R0.2 CCCSCCCC(C)N Amb27838926 [0,2,0,0,0,0|1,0,0]=3 2954 B9R0.2 CCC\C=C\CCC(C)=O Amb33359154 [0,2,0,0,0,0|2,0,0]=4 2955 B9R0.2 CCC\C=C\CCC(C)N Amb33424850 [0,2,0,0,0,0|2,0,0]=4 2956 B9R0.2 CCC\C=C\CCC(C)O Amb33424849 [0,2,0,0,0,0|2,0,0]=4 2957 B9R0.2 CCC\C=C\CC[C@@H](C)N Amb33424844 [0,2,0,0,0,0|2,0,0]=4 2958 B9R0.2 CCC\C=C\CC[C@@H](C)O Amb33424845 [0,2,0,0,0,0|2,0,0]=4 2959 B9R0.2 CCC\C=C\CC[C@H](C)N Amb33424843 [0,2,0,0,0,0|2,0,0]=4 2960 B9R0.2 CCC\C=C\CC[C@H](C)O Amb33424847 [0,2,0,0,0,0|2,0,0]=4 2961 B9R0.2 CCC\C=N\NCC(C)C Amb27977635 [0,2,0,0,0,0|2,0,0]=4 2962 B9R0.2 CCC\C=N\OCC(C)C Amb27660759 [0,2,0,0,0,0|1,1,0]=4 2963 B9R0.2 CCNCCNCC(C)C Amb27232336 [0,2,0,0,0,0|2,0,0]=4 2964 B9R0.2 CCNCCOCC(C)C Amb27834453 [0,2,0,0,0,0|1,1,0]=4 2965 B9R0.2 CCNCCSCC(C)N Amb27467377 [0,2,0,0,0,0|1,0,0]=3 2966 B9R0.2 CCOCCNCC(C)C Amb9241020 [0,2,0,0,0,0|2,0,0]=4 2967 B9R0.2 CCOCCOCC(C)O Amb9787531 [0,2,0,0,0,0|1,1,0]=4 2968 B9R0.2 CCSCCCCC(C)Br Amb27867199 [0,2,0,0,0,0|2,0,0]=4 2969 B9R0.2 CCSCCNC[C@H](C)O Amb27972582 [0,2,0,0,0,0|2,0,0]=4 2970 B9R0.2 CN(C)CCCSCCN Amb28050313 [0,2,0,0,0,0|2,0,0]=4 2971 B9R0.2 CN(C)CCSCCCBr Amb27458103 [0,2,0,0,0,0|2,0,0]=4 2972 B9R0.2 CN(C)CCSCCCCl Amb27981147 [0,2,0,0,0,0|2,0,0]=4 2973 B9R0.2 CN(C)CCSCCCS Amb27179966 [0,2,0,0,0,0|2,0,0]=4 2974 B9R0.2 CNCCCNCC(C)C Amb28193252 [0,2,0,0,0,0|2,0,0]=4 2975 B9R0.2 CNCCCSCC(C)N Amb27815759 [0,2,0,0,0,0|1,0,0]=3 2976 B9R0.2 CNCCSCCC(C)N Amb27404073 [0,2,0,0,0,0|1,0,0]=3 2977 B9R0.2 CNCCSCCN(C)C Amb27837823 [0,2,0,0,0,0|2,0,0]=4 2978 B9R0.2 CNCCSCCS(C)=O Amb27856345 [0,2,0,0,0,0|2,0,0]=4 2979 B9R0.2 CNCC\C=C/CC(C)C Amb27413055 [0,2,0,0,0,0|2,0,0]=4 2980 B9R0.2 COCCCNCC(C)C Amb6730181 [0,2,0,0,0,0|2,0,0]=4 2981 B9R0.2 COCCCNCC(C)N Amb28281327 [0,2,0,0,0,0|2,0,0]=4 2982 B9R0.2 COCCCNCC(C)O Amb17138417 [0,2,0,0,0,0|2,0,0]=4 2983 B9R0.2 COCCCOCC(C)N Amb27837579 [0,2,0,0,0,0|1,1,0]=4 2984 B9R0.2 COCCCOCC(C)O Amb27600623 [0,2,0,0,0,0|1,1,0]=4 2985 B9R0.2 COCCCOC[C@@H](C)N Amb28382568 [0,2,0,0,0,0|1,1,0]=4 2986 B9R0.2 COCCCSC[C@H](C)N Amb28344655 [0,2,0,0,0,0|1,0,0]=3 2987 B9R0.2 COCCNCCC(C)Cl Amb28369525 [0,2,0,0,0,0|2,0,0]=4 2988 B9R0.2 COCCONC[C@@H](C)O Amb27823230 [0,2,0,0,0,0|1,1,0]=4 2989 B9R0.2 COCCSCCC(C)F Amb27457248 [0,2,0,0,0,0|1,0,0]=3 2990 B9R0.2 COCCSCCS(C)=O Amb28078807 [0,2,0,0,0,0|2,0,0]=4 2991 B9R0.2 COCC\C=C\C[C@H](C)O Amb28044299 [0,2,0,0,0,0|2,0,0]=4 2992 B9R0.2 CS(=O)CCSCCCCl Amb27653763 [0,2,0,0,0,0|2,0,0]=4 2993 B9R0.2 CSCCCNC[C@@H](C)O Amb27449650 [0,2,0,0,0,0|2,0,0]=4 2994 B9R0.2 CSCCCSCC(C)=O Amb28059012 [0,2,0,0,0,0|1,0,1]=4 2995 B9R0.2 CSCCCSCC(C)C Amb27253070 [0,2,0,0,0,0|1,0,0]=3 2996 B9R0.2 CSCCCSC[C@H](C)N Amb27482910 [0,2,0,0,0,0|1,0,0]=3 2997 B9R0.2 CSCCCSC[C@H](C)O Amb27875476 [0,2,0,0,0,0|1,0,0]=3 2998 B9R0.2 CSCCNCCC(C)C Amb18800588 [0,2,0,0,0,0|2,0,0]=4 2999 B9R0.2 CSCCNOCC(C)C Amb27167542 [0,2,0,0,0,0|1,1,0]=4 3000 B9R0.2 C[C@@H](O)CCCCCCO Amb27406493 [0,2,0,0,0,0|2,0,0]=4 3001 B9R0.2 C[C@@H](O)CNCCCCO Amb27235176 [0,2,0,0,0,0|2,0,0]=4 3002 B9R0.2 C[C@H](O)CC#CCCCO Amb28344979 [0,2,0,0,0,0|2,0,0]=4 3003 B9R0.2 NCCSSCCC(=O)O Amb17608062 [0,2,0,0,0,0|1,0,1]=4 3004 B9R0.2 O=C(O)CCSSCCO Amb17615366 [0,2,0,0,0,0|1,0,1]=4 3005 B9R0.45 BrCCCCCCCCBr Amb2725461 [0,2,0,0,0,0|2,0,0]=4 3006 B9R0.45 BrCCSCCSCCBr Amb25890188 [0,2,0,0,0,0|2,0,0]=4 3007 B9R0.45 C#CCCCCCCCC Amb2721541 [0,2,0,0,0,0|2,0,0]=4 3008 B9R0.45 C#CCCCNCCCC Amb27413122 [0,2,0,0,0,0|2,0,0]=4 3009 B9R0.45 C#CCCSCCCOC Amb27454502 [0,2,0,0,0,0|1,0,1]=4 3010 B9R0.45 C#CCNCCSCCC Amb18182317 [0,2,0,0,0,0|1,0,1]=4 3011 B9R0.45 C=CCCCCCCCC Amb3940503 [0,2,0,0,0,0|2,0,0]=4 3012 B9R0.45 C=CCCCCNCCC Amb26576689 [0,2,0,0,0,0|2,0,0]=4 3013 B9R0.45 C=CCCCNCCCC Amb27799206 [0,2,0,0,0,0|2,0,0]=4 3014 B9R0.45 C=CCCCSCCOC Amb27424920 [0,2,0,0,0,0|1,0,1]=4 3015 B9R0.45 C=CCCSCCCOC Amb28280277 [0,2,0,0,0,0|1,0,1]=4 3016 B9R0.45 C=CCCSCCSCC Amb27197363 [0,2,0,0,0,0|1,0,1]=4 3017 B9R0.45 CC#CCCCCCCC Amb2721539 [0,2,0,0,0,0|2,0,0]=4 3018 B9R0.45 CC#CCCNOCCC Amb27824900 [0,2,0,0,0,0|1,1,0]=4 3019 B9R0.45 CC#CCCSCCCO Amb28383676 [0,2,0,0,0,0|1,0,1]=4 3020 B9R0.45 CC#CCSCCCCF Amb27757783 [0,2,0,0,0,0|1,0,1]=4 3021 B9R0.45 CC#CCSCCSCC Amb27457218 [0,2,0,0,0,0|1,0,1]=4 3022 B9R0.45 CCC#CCCCCCC Amb2721540 [0,2,0,0,0,0|2,0,0]=4 3023 B9R0.45 CCC#CCNCCCC Amb28437319 [0,2,0,0,0,0|2,0,0]=4 3024 B9R0.45 CCCC#CC#CCCC Amb2721535 [0,2,0,0,0,0|2,0,0]=4 3025 B9R0.45 CCCC#CCCCCC Amb2721550 [0,2,0,0,0,0|2,0,0]=4 3026 B9R0.45 CCCC=C=CCCCO Amb27839599 [0,2,0,0,0,0|2,0,0]=4 3027 B9R0.45 CCCCC#CCCCC Amb2721554 [0,2,0,0,0,0|2,0,0]=4 3028 B9R0.45 CCCCC#CCCCCl Amb2721557 [0,2,0,0,0,0|2,0,0]=4 3029 B9R0.45 CCCCC#CCCCN Amb26348518 [0,2,0,0,0,0|2,0,0]=4 3030 B9R0.45 CCCCCCCCC#N Amb7764626 [0,2,0,0,0,0|2,0,0]=4 3031 B9R0.45 CCCCCCCCCBr Amb3940224 [0,2,0,0,0,0|2,0,0]=4 3032 B9R0.45 CCCCCCCCCC Amb7757835 [0,2,0,0,0,0|2,0,0]=4 3033 B9R0.45 CCCCCCCCCCl Amb6652537 [0,2,0,0,0,0|2,0,0]=4 3034 B9R0.45 CCCCCCCCCF Amb8515361 [0,2,0,0,0,0|2,0,0]=4 3035 B9R0.45 CCCCCCCCCI Amb3940284 [0,2,0,0,0,0|2,0,0]=4 3036 B9R0.45 CCCCCCCCCN Amb3987584 [0,2,0,0,0,0|2,0,0]=4 3037 B9R0.45 CCCCCCCCCO Amb3940342 [0,2,0,0,0,0|2,0,0]=4 3038 B9R0.45 CCCCCCCCC[Mg+] Amb22351330 [0,2,0,0,0,0|2,0,0]=4 3039 B9R0.45 CCCCCCCCNC Amb7757640 [0,2,0,0,0,0|2,0,0]=4 3040 B9R0.45 CCCCCCCCNN Amb7786451 [0,2,0,0,0,0|2,0,0]=4 3041 B9R0.45 CCCCCCCCNO Amb28069968 [0,2,0,0,0,0|2,0,0]=4 3042 B9R0.45 CCCCCCCCON Amb2818885 [0,2,0,0,0,0|2,0,0]=4 3043 B9R0.45 CCCCCCCCSC Amb10553780 [0,2,0,0,0,0|2,0,0]=4 3044 B9R0.45 CCCCCCCOCC Amb26332517 [0,2,0,0,0,0|2,0,0]=4 3045 B9R0.45 CCCCCCNCCC Amb6730565 [0,2,0,0,0,0|2,0,0]=4 3046 B9R0.45 CCCCCCNCCCl Amb27175028 [0,2,0,0,0,0|2,0,0]=4 3047 B9R0.45 CCCCCCNCCN Amb33611669 [0,2,0,0,0,0|2,0,0]=4 3048 B9R0.45 CCCCCCNCCN Amb9786764 [0,2,0,0,0,0|2,0,0]=4 3049 B9R0.45 CCCCCCNCCO Amb2720857 [0,2,0,0,0,0|2,0,0]=4 3050 B9R0.45 CCCCCCOCCC Amb27838831 [0,2,0,0,0,0|1,1,0]=4 3051 B9R0.45 CCCCCCOCCCl Amb8828502 [0,2,0,0,0,0|2,0,0]=4 3052 B9R0.45 CCCCCCOCCO Amb9787183 [0,2,0,0,0,0|2,0,0]=4 3053 B9R0.45 CCCCCCPCCN Amb28121064 [0,2,0,0,0,0|2,0,0]=4 3054 B9R0.45 CCCCCCSCCCl Amb22228746 [0,2,0,0,0,0|2,0,0]=4 3055 B9R0.45 CCCCCCSCCN Amb7794935 [0,2,0,0,0,0|2,0,0]=4 3056 B9R0.45 CCCCCNCCCBr Amb27171159 [0,2,0,0,0,0|2,0,0]=4 3057 B9R0.45 CCCCCNCCCC Amb6688183 [0,2,0,0,0,0|2,0,0]=4 3058 B9R0.45 CCCCCNCCCF Amb27757655 [0,2,0,0,0,0|2,0,0]=4 3059 B9R0.45 CCCCCNCCCN Amb17315271 [0,2,0,0,0,0|2,0,0]=4 3060 B9R0.45 CCCCCNCCCO Amb6733807 [0,2,0,0,0,0|2,0,0]=4 3061 B9R0.45 CCCCCNCCNC Amb2691992 [0,2,0,0,0,0|2,0,0]=4 3062 B9R0.45 CCCCCNCCOC Amb6708081 [0,2,0,0,0,0|2,0,0]=4 3063 B9R0.45 CCCCCSCCCF Amb28204722 [0,2,0,0,0,0|1,0,0]=3 3064 B9R0.45 CCCCCSCCCN Amb17500694 [0,2,0,0,0,0|1,0,0]=3 3065 B9R0.45 CCCCCSCCCO Amb17502837 [0,2,0,0,0,0|1,0,0]=3 3066 B9R0.45 CCCCCSCCSC Amb28282346 [0,2,0,0,0,0|1,0,0]=3 3067 B9R0.45 CCCCNCCCC#N Amb6709574 [0,2,0,0,0,0|2,0,0]=4 3068 B9R0.45 CCCCNCCCCBr Amb27403712 [0,2,0,0,0,0|2,0,0]=4 3069 B9R0.45 CCCCNCCCNC Amb24502382 [0,2,0,0,0,0|2,0,0]=4 3070 B9R0.45 CCCCNCCCOC Amb6730310 [0,2,0,0,0,0|2,0,0]=4 3071 B9R0.45 CCCCNCCOCC Amb9241010 [0,2,0,0,0,0|2,0,0]=4 3072 B9R0.45 CCCCNCCSSC Amb27975856 [0,2,0,0,0,0|2,0,0]=4 3073 B9R0.45 CCCCOCCCC#N Amb8895274 [0,2,0,0,0,0|1,1,0]=4 3074 B9R0.45 CCCCOCCCCBr Amb8895240 [0,2,0,0,0,0|1,1,0]=4 3075 B9R0.45 CCCCOCCCCCl Amb18798377 [0,2,0,0,0,0|1,1,0]=4 3076 B9R0.45 CCCCOCCCCO Amb19375051 [0,2,0,0,0,0|1,1,0]=4 3077 B9R0.45 CCCCOCCCON Amb27212384 [0,2,0,0,0,0|1,1,0]=4 3078 B9R0.45 CCCCOCCOCC Amb25248413 [0,2,0,0,0,0|1,1,0]=4 3079 B9R0.45 CCCCOCCOCCl Amb28399346 [0,2,0,0,0,0|1,1,0]=4 3080 B9R0.45 CCCCSCCCCN Amb9480126 [0,2,0,0,0,0|1,0,0]=3 3081 B9R0.45 CCCCSCCCCS Amb28206440 [0,2,0,0,0,0|1,0,0]=3 3082 B9R0.45 CCCCSCCCOC Amb27651352 [0,2,0,0,0,0|1,0,0]=3 3083 B9R0.45 CCCCSCCOCC Amb10669603 [0,2,0,0,0,0|1,0,0]=3 3084 B9R0.45 CCCCSC\C=C\CO Amb28205928 [0,2,0,0,0,0|1,0,1]=4 3085 B9R0.45 CCCCSC\C=C\CS Amb27632116 [0,2,0,0,0,0|1,0,1]=4 3086 B9R0.45 CCCCSSCCCC Amb8513071 [0,2,0,0,0,0|0,0,0]=2 3087 B9R0.45 CCCC[Te][Te]CCCC Amb8515301 [0,2,0,0,0,0|0,2,0]=4 3088 B9R0.45 CCCC\C=C/CCCC Amb27196227 [0,2,0,0,0,0|2,0,0]=4 3089 B9R0.45 CCCC\C=C\CCCC Amb2721542 [0,2,0,0,0,0|2,0,0]=4 3090 B9R0.45 CCCNCCCCCBr Amb27614955 [0,2,0,0,0,0|2,0,0]=4 3091 B9R0.45 CCCNCCCCCO Amb17334254 [0,2,0,0,0,0|2,0,0]=4 3092 B9R0.45 CCCNCCCCSC Amb18798068 [0,2,0,0,0,0|2,0,0]=4 3093 B9R0.45 CCCNCCCSCC Amb18177748 [0,2,0,0,0,0|2,0,0]=4 3094 B9R0.45 CCCNCCNCCF Amb27945344 [0,2,0,0,0,0|2,0,0]=4 3095 B9R0.45 CCCNCCNCCO Amb24644910 [0,2,0,0,0,0|2,0,0]=4 3096 B9R0.45 CCCNCCOCCCl Amb27652262 [0,2,0,0,0,0|2,0,0]=4 3097 B9R0.45 CCCNCCOCCF Amb27794080 [0,2,0,0,0,0|2,0,0]=4 3098 B9R0.45 CCCNCCOCCO Amb6736235 [0,2,0,0,0,0|2,0,0]=4 3099 B9R0.45 CCCNCCSCCN Amb28192624 [0,2,0,0,0,0|2,0,0]=4 3100 B9R0.45 CCCN\N=C\CCSC Amb27804700 [0,2,0,0,0,0|2,0,0]=4 3101 B9R0.45 CCCOCCCCCBr Amb27494337 [0,2,0,0,0,0|1,1,0]=4 3102 B9R0.45 CCCOCCCCCN Amb27869443 [0,2,0,0,0,0|1,1,0]=4 3103 B9R0.45 CCCOCCNCCBr Amb28281047 [0,2,0,0,0,0|1,1,0]=4 3104 B9R0.45 CCCOCCNOCC Amb27617220 [0,2,0,0,0,0|1,1,0]=4 3105 B9R0.45 CCCOCCOCCC Amb27441214 [0,2,0,0,0,0|0,2,0]=4 3106 B9R0.45 CCCOCCOCCO Amb22351569 [0,2,0,0,0,0|1,1,0]=4 3107 B9R0.45 CCCO\N=C\CCCO Amb27604558 [0,2,0,0,0,0|1,1,0]=4 3108 B9R0.45 CCCSCCCCC#N Amb18178253 [0,2,0,0,0,0|1,0,0]=3 3109 B9R0.45 CCCSCCCCCBr Amb27603024 [0,2,0,0,0,0|1,0,0]=3 3110 B9R0.45 CCCSCCCCCCl Amb9304986 [0,2,0,0,0,0|1,0,0]=3 3111 B9R0.45 CCCSCCCCCS Amb27431515 [0,2,0,0,0,0|1,0,0]=3 3112 B9R0.45 CCCSCCNCC#N Amb27190636 [0,2,0,0,0,0|1,0,1]=4 3113 B9R0.45 CCCSCCNCCN Amb27400239 [0,2,0,0,0,0|1,0,0]=3 3114 B9R0.45 CCCSCCNCCO Amb27618844 [0,2,0,0,0,0|1,0,0]=3 3115 B9R0.45 CCCSCCOCCCl Amb27764394 [0,2,0,0,0,0|1,0,0]=3 3116 B9R0.45 CCCSCCOCCN Amb17501983 [0,2,0,0,0,0|1,0,0]=3 3117 B9R0.45 CCCSCCOCCS Amb27833892 [0,2,0,0,0,0|1,0,0]=3 3118 B9R0.45 CCCSCCSCCC Amb4019972 [0,2,0,0,0,0|0,0,0]=2 3119 B9R0.45 CCCSCCSCCCl Amb28076466 [0,2,0,0,0,0|1,0,0]=3 3120 B9R0.45 CCCSCCSCCO Amb27433297 [0,2,0,0,0,0|1,0,0]=3 3121 B9R0.45 CCCSSSSCCC Amb28050414 [0,2,0,0,0,0|0,0,0]=2 3122 B9R0.45 CCCS\C=C\SCCC Amb24634666 [0,2,0,0,0,0|0,0,0]=2 3123 B9R0.45 CCC\C=C\C=C\CCC Amb22641685 [0,2,0,0,0,0|2,0,0]=4 3124 B9R0.45 CCC\C=C\CCCC=O Amb33361614 [0,2,0,0,0,0|2,0,0]=4 3125 B9R0.45 CCC\C=C\CCCCC Amb22231673 [0,2,0,0,0,0|2,0,0]=4 3126 B9R0.45 CCC\C=C\CCCCN Amb33373745 [0,2,0,0,0,0|2,0,0]=4 3127 B9R0.45 CCC\C=N\NCCCO Amb27396709 [0,2,0,0,0,0|2,0,0]=4 3128 B9R0.45 CCC\C=N\OCCSC Amb27411002 [0,2,0,0,0,0|1,1,0]=4 3129 B9R0.45 CCNCC#CCNCC Amb4017659 [0,2,0,0,0,0|2,0,0]=4 3130 B9R0.45 CCNCCCCCCN Amb25855319 [0,2,0,0,0,0|2,0,0]=4 3131 B9R0.45 CCNCCCCCOC Amb28186272 [0,2,0,0,0,0|2,0,0]=4 3132 B9R0.45 CCNCCCCCSC Amb27167121 [0,2,0,0,0,0|2,0,0]=4 3133 B9R0.45 CCNCCCCNCC Amb20621746 [0,2,0,0,0,0|2,0,0]=4 3134 B9R0.45 CCNCCOCCOC Amb24672932 [0,2,0,0,0,0|1,1,0]=4 3135 B9R0.45 CCNCCSCCOC Amb18788239 [0,2,0,0,0,0|1,0,0]=3 3136 B9R0.45 CCOCCCCCCS Amb27834959 [0,2,0,0,0,0|2,0,0]=4 3137 B9R0.45 CCOCCCCOCC Amb10807403 [0,2,0,0,0,0|2,0,0]=4 3138 B9R0.45 CCOCCNCCCBr Amb28049448 [0,2,0,0,0,0|2,0,0]=4 3139 B9R0.45 CCOCCNCCCN Amb27391621 [0,2,0,0,0,0|2,0,0]=4 3140 B9R0.45 CCOCCNCCNC Amb28382584 [0,2,0,0,0,0|2,0,0]=4 3141 B9R0.45 CCOCCNCCSC Amb18183509 [0,2,0,0,0,0|2,0,0]=4 3142 B9R0.45 CCOCCOCCCBr Amb8828207 [0,2,0,0,0,0|1,1,0]=4 3143 B9R0.45 CCOCCOCCCN Amb6246853 [0,2,0,0,0,0|1,1,0]=4 3144 B9R0.45 CCOCCOCCNC Amb28049307 [0,2,0,0,0,0|1,1,0]=4 3145 B9R0.45 CCOCCOCCOC Amb8394637 [0,2,0,0,0,0|1,1,0]=4 3146 B9R0.45 CCOCCSCCCO Amb27830336 [0,2,0,0,0,0|1,0,0]=3 3147 B9R0.45 CCOCCSCCNC Amb28146212 [0,2,0,0,0,0|1,0,0]=3 3148 B9R0.45 CCOCCSCSCC Amb27179618 [0,2,0,0,0,0|1,0,0]=3 3149 B9R0.45 CCOCOCCCCBr Amb28388750 [0,2,0,0,0,0|1,1,0]=4 3150 B9R0.45 CCSCCCCCCCl Amb18186755 [0,2,0,0,0,0|2,0,0]=4 3151 B9R0.45 CCSCCCCSCC Amb4017492 [0,2,0,0,0,0|2,0,0]=4 3152 B9R0.45 CCSCCNCCCBr Amb27171099 [0,2,0,0,0,0|2,0,0]=4 3153 B9R0.45 CCSCCNCCCF Amb27165285 [0,2,0,0,0,0|2,0,0]=4 3154 B9R0.45 CCSCCNCCCO Amb27797112 [0,2,0,0,0,0|2,0,0]=4 3155 B9R0.45 CCSCCOCCCS Amb27971481 [0,2,0,0,0,0|1,1,0]=4 3156 B9R0.45 CCSCCSCCCO Amb27489348 [0,2,0,0,0,0|1,0,0]=3 3157 B9R0.45 CCSCCSCCSC Amb28062167 [0,2,0,0,0,0|1,0,0]=3 3158 B9R0.45 CC\C=C\CCCCCC Amb22231672 [0,2,0,0,0,0|2,0,0]=4 3159 B9R0.45 CC\C=C\COCCCC Amb25912010 [0,2,0,0,0,0|1,1,0]=4 3160 B9R0.45 CNCCCCCCNC Amb9826092 [0,2,0,0,0,0|2,0,0]=4 3161 B9R0.45 CNCCCNCCCN Amb27617090 [0,2,0,0,0,0|2,0,0]=4 3162 B9R0.45 CNCCCNCCOC Amb20171974 [0,2,0,0,0,0|2,0,0]=4 3163 B9R0.45 CNCCCOCCOC Amb27768848 [0,2,0,0,0,0|1,1,0]=4 3164 B9R0.45 CNCCCSCCSC Amb27165838 [0,2,0,0,0,0|1,0,0]=3 3165 B9R0.45 CNCCOCCCOC Amb21954035 [0,2,0,0,0,0|1,1,0]=4 3166 B9R0.45 CNCCOCCCSC Amb27650781 [0,2,0,0,0,0|1,1,0]=4 3167 B9R0.45 CNCCSCCCCO Amb28193864 [0,2,0,0,0,0|1,0,0]=3 3168 B9R0.45 CNCCSSCCNC Amb26988780 [0,2,0,0,0,0|0,0,0]=2 3169 B9R0.45 COCCCCCCCCl Amb28066514 [0,2,0,0,0,0|2,0,0]=4 3170 B9R0.45 COCCCCCCOC Amb10807404 [0,2,0,0,0,0|2,0,0]=4 3171 B9R0.45 COCCCCSCCN Amb27951686 [0,2,0,0,0,0|2,0,0]=4 3172 B9R0.45 COCCCNCCCN Amb17315264 [0,2,0,0,0,0|2,0,0]=4 3173 B9R0.45 COCCCNCCCO Amb17308606 [0,2,0,0,0,0|2,0,0]=4 3174 B9R0.45 COCCCNCCOC Amb8841615 [0,2,0,0,0,0|2,0,0]=4 3175 B9R0.45 COCCCNCCSC Amb18800727 [0,2,0,0,0,0|2,0,0]=4 3176 B9R0.45 COCCCOCCCN Amb28196278 [0,2,0,0,0,0|1,1,0]=4 3177 B9R0.45 COCCCOCCCO Amb20242414 [0,2,0,0,0,0|1,1,0]=4 3178 B9R0.45 COCCCSCCC#N Amb28287619 [0,2,0,0,0,0|1,0,1]=4 3179 B9R0.45 COCCCSCCCCl Amb27393495 [0,2,0,0,0,0|1,0,0]=3 3180 B9R0.45 COCCCSCCCS Amb28058832 [0,2,0,0,0,0|1,0,0]=3 3181 B9R0.45 COCCCSCCOC Amb28064860 [0,2,0,0,0,0|1,0,0]=3 3182 B9R0.45 COCCNCCCSC Amb6719616 [0,2,0,0,0,0|2,0,0]=4 3183 B9R0.45 COCCOCCCCBr Amb8855450 [0,2,0,0,0,0|1,1,0]=4 3184 B9R0.45 COCCOCCCCCl Amb18798737 [0,2,0,0,0,0|1,1,0]=4 3185 B9R0.45 COCCOCCCCN Amb6250163 [0,2,0,0,0,0|1,1,0]=4 3186 B9R0.45 COCCONCCCF Amb27632576 [0,2,0,0,0,0|1,1,0]=4 3187 B9R0.45 COCCONCCCO Amb27477812 [0,2,0,0,0,0|1,1,0]=4 3188 B9R0.45 COCCSCCCC#N Amb9305283 [0,2,0,0,0,0|1,0,1]=4 3189 B9R0.45 COCCSCCCCF Amb28064856 [0,2,0,0,0,0|1,0,0]=3 3190 B9R0.45 COCCSCCCON Amb27199029 [0,2,0,0,0,0|2,0,0]=4 3191 B9R0.45 COCCSCCOCCl Amb28184961 [0,2,0,0,0,0|2,0,0]=4 3192 B9R0.45 CSCCCCCCCN Amb27860341 [0,2,0,0,0,0|2,0,0]=4 3193 B9R0.45 CSCCCCCCSC Amb6366244 [0,2,0,0,0,0|2,0,0]=4 3194 B9R0.45 CSCCCNCCCBr Amb27235561 [0,2,0,0,0,0|2,0,0]=4 3195 B9R0.45 CSCCCSCCCF Amb27171622 [0,2,0,0,0,0|1,0,0]=3 3196 B9R0.45 CSCCCSCCCO Amb28132547 [0,2,0,0,0,0|1,0,0]=3 3197 B9R0.45 CSCCCSCCON Amb27402152 [0,2,0,0,0,0|2,0,0]=4 3198 B9R0.45 CSCCOCCCCCl Amb28041418 [0,2,0,0,0,0|1,1,0]=4 3199 B9R0.45 CSCCOCCCCS Amb27834483 [0,2,0,0,0,0|1,1,0]=4 3200 B9R0.45 CSCCSCCCCBr Amb27758249 [0,2,0,0,0,0|1,0,0]=3 3201 B9R0.45 CSCCSCCCCS Amb28382933 [0,2,0,0,0,0|1,0,0]=3 3202 B9R0.45 C\C=C/CCCCCCC Amb26019969 [0,2,0,0,0,0|2,0,0]=4 3203 B9R0.45 C\C=C\CCNCCCC Amb27789929 [0,2,0,0,0,0|2,0,0]=4 3204 B9R0.45 ClCCCC#CCCCCl Amb27955879 [0,2,0,0,0,0|2,0,0]=4 3205 B9R0.45 ClCCCCCCCCCl Amb2721447 [0,2,0,0,0,0|2,0,0]=4 3206 B9R0.45 FCCCCCCCCBr Amb27265588 [0,2,0,0,0,0|2,0,0]=4 3207 B9R0.45 FCCCCCCCCCl Amb28067739 [0,2,0,0,0,0|2,0,0]=4 3208 B9R0.45 FCCCCCCCCF Amb22641491 [0,2,0,0,0,0|2,0,0]=4 3209 B9R0.45 FCCCCCSCCCl Amb28063270 [0,2,0,0,0,0|2,0,0]=4 3210 B9R0.45 FCCCCNCCCBr Amb27263407 [0,2,0,0,0,0|2,0,0]=4 3211 B9R0.45 FCCCNCCCCBr Amb27199870 [0,2,0,0,0,0|2,0,0]=4 3212 B9R0.45 N#CCCCCSCCN Amb8876140 [0,2,0,0,0,0|2,0,0]=4 3213 B9R0.45 N#CCCSSCCC#N Amb22337919 [0,2,0,0,0,0|0,0,2]=4 3214 B9R0.45 NCCCCCCCCN Amb8387247 [0,2,0,0,0,0|2,0,0]=4 3215 B9R0.45 NCCCCCCCCO Amb24116967 [0,2,0,0,0,0|2,0,0]=4 3216 B9R0.45 NCCCCNCCCCl Amb24117237 [0,2,0,0,0,0|2,0,0]=4 3217 B9R0.45 NCCCCNCCCCl Amb28067741 [0,2,0,0,0,0|2,0,0]=4 3218 B9R0.45 NCCCCNCCCF Amb26506888 [0,2,0,0,0,0|2,0,0]=4 3219 B9R0.45 NCCCCNCCCN Amb8514497 [0,2,0,0,0,0|2,0,0]=4 3220 B9R0.45 NCCCCNCCCO Amb27473423 [0,2,0,0,0,0|2,0,0]=4 3221 B9R0.45 NCCCCSCCCO Amb17500966 [0,2,0,0,0,0|1,0,0]=3 3222 B9R0.45 NCCCOCCCCO Amb28454517 [0,2,0,0,0,0|1,1,0]=4 3223 B9R0.45 NCCCSCCCCF Amb27770557 [0,2,0,0,0,0|1,0,0]=3 3224 B9R0.45 NCCCSCCCON Amb27857566 [0,2,0,0,0,0|2,0,0]=4 3225 B9R0.45 NCCCSSCCCN Amb27843359 [0,2,0,0,0,0|0,0,0]=2 3226 B9R0.45 NCCC\C=C\CCCN Amb25075576 [0,2,0,0,0,0|2,0,0]=4 3227 B9R0.45 NCCNCCSCCN Amb28384901 [0,2,0,0,0,0|2,0,0]=4 3228 B9R0.45 NCCOCCSCCO Amb17501998 [0,2,0,0,0,0|2,0,0]=4 3229 B9R0.45 NCCSCCOCCO Amb18792709 [0,2,0,0,0,0|2,0,0]=4 3230 B9R0.45 NCCSCCSCCN Amb21953303 [0,2,0,0,0,0|2,0,0]=4 3231 B9R0.45 NCCSCCSCCN Amb27858857 [0,2,0,0,0,0|2,0,0]=4 3232 B9R0.45 OCCCC#CCCCO Amb26558079 [0,2,0,0,0,0|2,0,0]=4 3233 B9R0.45 OCCCCCCCCBr Amb4296902 [0,2,0,0,0,0|2,0,0]=4 3234 B9R0.45 OCCCCCCCCCl Amb6366711 [0,2,0,0,0,0|2,0,0]=4 3235 B9R0.45 OCCCCCCCCF Amb25330666 [0,2,0,0,0,0|2,0,0]=4 3236 B9R0.45 OCCCCCCCCI Amb32411246 [0,2,0,0,0,0|2,0,0]=4 3237 B9R0.45 OCCCCCCCCO Amb8383419 [0,2,0,0,0,0|2,0,0]=4 3238 B9R0.45 OCCCCCCCCS Amb28046913 [0,2,0,0,0,0|2,0,0]=4 3239 B9R0.45 OCCCCCSCCO Amb18800854 [0,2,0,0,0,0|2,0,0]=4 3240 B9R0.45 OCCCCOCCCO Amb27218138 [0,2,0,0,0,0|1,1,0]=4 3241 B9R0.45 OCCCNCCCCF Amb27752581 [0,2,0,0,0,0|2,0,0]=4 3242 B9R0.45 OCCCSCCCCF Amb28204584 [0,2,0,0,0,0|1,0,0]=3 3243 B9R0.45 OCCCSCCCCS Amb27452872 [0,2,0,0,0,0|1,0,0]=3 3244 B9R0.45 OCCCSSCCCO Amb24573663 [0,2,0,0,0,0|0,0,0]=2 3245 B9R0.45 OCCC\C=C/CCCCl Amb27437510 [0,2,0,0,0,0|2,0,0]=4 3246 B9R0.45 OCCOCCSCCO Amb18180098 [0,2,0,0,0,0|2,0,0]=4 3247 B9R0.45 OCCSCCOCCCl Amb28118946 [0,2,0,0,0,0|2,0,0]=4 3248 B9R0.45 OCCSCCOCCS Amb28050612 [0,2,0,0,0,0|2,0,0]=4 3249 B9R0.45 OCCSCCSCCCl Amb27455143 [0,2,0,0,0,0|2,0,0]=4 3250 B9R0.45 OCCSCCSCCO Amb1200412 [0,2,0,0,0,0|2,0,0]=4 3251 B9R0.45 [C-]#[N+]CCCOCCCC Amb3973111 [0,2,0,0,0,0|1,1,0]=4 3252 B9R0.45 [N-]=[N+]=NCCSSCCN Amb24550198 [0,2,0,0,0,0|2,0,0]=4 3253 B9R0.45 [N-]=[N+]=NCCSSCCO Amb27211201 [0,2,0,0,0,0|2,0,0]=4 3254 B9R0.45 [NH3+]CCCCCCCC[NH3+] Amb16234024 [0,2,0,0,0,0|2,0,0]=4 3255 B9R0.46 C#CCCSCC(C)CC Amb27766820 [0,2,0,0,0,0|1,0,1]=4 3256 B9R0.46 C#CCCSCC(N)CC Amb27607634 [0,2,0,0,0,0|1,0,1]=4 3257 B9R0.46 C=C(CC)CSCCCC Amb28370393 [0,2,0,0,0,0|1,0,0]=3 3258 B9R0.46 C=C(CC)CSCCCF Amb27424941 [0,2,0,0,0,0|1,0,1]=4 3259 B9R0.46 C=C(CC)CSCCNC Amb27228403 [0,2,0,0,0,0|1,0,1]=4 3260 B9R0.46 C=CC(C)CNCCCC Amb27785858 [0,2,0,0,0,0|2,0,0]=4 3261 B9R0.46 C=CCCSCC(C)CC Amb28138309 [0,2,0,0,0,0|1,0,1]=4 3262 B9R0.46 C=CCCSCC(N)CC Amb27763096 [0,2,0,0,0,0|1,0,1]=4 3263 B9R0.46 CC#CCSCC(N)CC Amb27629129 [0,2,0,0,0,0|1,0,1]=4 3264 B9R0.46 CC(CN)CSCCCN Amb27623009 [0,2,0,0,0,0|2,0,0]=4 3265 B9R0.46 CCC(=S)SCCCCCl Amb27477889 [0,2,0,0,0,0|1,0,1]=4 3266 B9R0.46 CCC(C)CCCCCBr Amb28428516 [0,2,0,0,0,0|2,0,0]=4 3267 B9R0.46 CCC(C)CCCCCN Amb28385774 [0,2,0,0,0,0|2,0,0]=4 3268 B9R0.46 CCC(C)CCCCCO Amb21963913 [0,2,0,0,0,0|2,0,0]=4 3269 B9R0.46 CCC(C)CNCCCBr Amb28049449 [0,2,0,0,0,0|2,0,0]=4 3270 B9R0.46 CCC(C)CNCCCCl Amb27763526 [0,2,0,0,0,0|2,0,0]=4 3271 B9R0.46 CCC(C)CNCCCF Amb27425077 [0,2,0,0,0,0|2,0,0]=4 3272 B9R0.46 CCC(C)COCCCBr Amb27875135 [0,2,0,0,0,0|1,1,0]=4 3273 B9R0.46 CCC(C)COCCCN Amb27768706 [0,2,0,0,0,0|1,1,0]=4 3274 B9R0.46 CCC(C)CSCCC=O Amb27809578 [0,2,0,0,0,0|1,0,1]=4 3275 B9R0.46 CCC(C)NCCCCF Amb27766784 [0,2,0,0,0,0|2,0,0]=4 3276 B9R0.46 CCC(C)NCCCOC Amb6730317 [0,2,0,0,0,0|2,0,0]=4 3277 B9R0.46 CCC(C)NCCCSC Amb6719664 [0,2,0,0,0,0|2,0,0]=4 3278 B9R0.46 CCC(C)OCCCCS Amb27588540 [0,2,0,0,0,0|1,1,0]=4 3279 B9R0.46 CCC(C)SCCCCN Amb9391446 [0,2,0,0,0,0|1,0,0]=3 3280 B9R0.46 CCC(C)SCCCCS Amb27801732 [0,2,0,0,0,0|1,0,0]=3 3281 B9R0.46 CCC(C)SCCCOC Amb28400490 [0,2,0,0,0,0|1,0,0]=3 3282 B9R0.46 CCC(C)SCCCON Amb28193724 [0,2,0,0,0,0|2,0,0]=4 3283 B9R0.46 CCC(C)\C=C\CCCCl Amb26918358 [0,2,0,0,0,0|2,0,0]=4 3284 B9R0.46 CCC(Cl)CCCCOC Amb18800866 [0,2,0,0,0,0|2,0,0]=4 3285 B9R0.46 CCC(N)CCCCCO Amb26865511 [0,2,0,0,0,0|2,0,0]=4 3286 B9R0.46 CCC(N)CNCCOC Amb25375423 [0,2,0,0,0,0|2,0,0]=4 3287 B9R0.46 CCC(N)COCCOC Amb27618093 [0,2,0,0,0,0|1,1,0]=4 3288 B9R0.46 CCC(N)CSCCCO Amb28344434 [0,2,0,0,0,0|1,0,0]=3 3289 B9R0.46 CCC(N)CSCCON Amb27843898 [0,2,0,0,0,0|2,0,0]=4 3290 B9R0.46 CCC(O)CCCCNC Amb28193277 [0,2,0,0,0,0|2,0,0]=4 3291 B9R0.46 CCC(O)CNCCCS Amb27985489 [0,2,0,0,0,0|2,0,0]=4 3292 B9R0.46 CCC(O)COCCOC Amb26506871 [0,2,0,0,0,0|1,1,0]=4 3293 B9R0.46 CCC(O)CSCCCN Amb27615088 [0,2,0,0,0,0|1,0,0]=3 3294 B9R0.46 CCC(O)CSCCSC Amb27233915 [0,2,0,0,0,0|1,0,0]=3 3295 B9R0.46 CCC(O)\C=C\CCCCl Amb24610794 [0,2,0,0,0,0|2,0,0]=4 3296 B9R0.46 CCCC#CCC(O)CC Amb2721744 [0,2,0,0,0,0|2,0,0]=4 3297 B9R0.46 CCCCCCC(=O)CC Amb2720775 [0,2,0,0,0,0|2,0,0]=4 3298 B9R0.46 CCCCCCC(Br)CBr Amb17845325 [0,2,0,0,0,0|2,0,0]=4 3299 B9R0.46 CCCCCCC(Br)CN Amb27626902 [0,2,0,0,0,0|2,0,0]=4 3300 B9R0.46 CCCCCCC(Br)CO Amb28126801 [0,2,0,0,0,0|2,0,0]=4 3301 B9R0.46 CCCCCCC(C)C#N Amb8950096 [0,2,0,0,0,0|2,0,0]=4 3302 B9R0.46 CCCCCCC(C)CBr Amb20240804 [0,2,0,0,0,0|2,0,0]=4 3303 B9R0.46 CCCCCCC(C)CC Amb6366304 [0,2,0,0,0,0|2,0,0]=4 3304 B9R0.46 CCCCCCC(C)CCl Amb26403332 [0,2,0,0,0,0|2,0,0]=4 3305 B9R0.46 CCCCCCC(C)CO Amb22728084 [0,2,0,0,0,0|2,0,0]=4 3306 B9R0.46 CCCCCCC(C)NN Amb20623338 [0,2,0,0,0,0|2,0,0]=4 3307 B9R0.46 CCCCCCC(C)NN Amb7795640 [0,2,0,0,0,0|2,0,0]=4 3308 B9R0.46 CCCCCCC(Cl)CC Amb27872816 [0,2,0,0,0,0|2,0,0]=4 3309 B9R0.46 CCCCCCC(Cl)CCl Amb9787127 [0,2,0,0,0,0|2,0,0]=4 3310 B9R0.46 CCCCCCC(N)CBr Amb27614898 [0,2,0,0,0,0|2,0,0]=4 3311 B9R0.46 CCCCCCC(N)CO Amb27770563 [0,2,0,0,0,0|2,0,0]=4 3312 B9R0.46 CCCCCCC(O)CC Amb10068521 [0,2,0,0,0,0|2,0,0]=4 3313 B9R0.46 CCCCCCC(O)CF Amb22325236 [0,2,0,0,0,0|2,0,0]=4 3314 B9R0.46 CCCCCCC(O)CO Amb8514191 [0,2,0,0,0,0|2,0,0]=4 3315 B9R0.46 CCCCCCC(O)CS Amb27823218 [0,2,0,0,0,0|2,0,0]=4 3316 B9R0.46 CCCCCCC(S)CS Amb16232249 [0,2,0,0,0,0|2,0,0]=4 3317 B9R0.46 CCCCCC[C@@H](C)CBr Amb27224123 [0,2,0,0,0,0|2,0,0]=4 3318 B9R0.46 CCCCCC[C@@H](Cl)CC Amb27185588 [0,2,0,0,0,0|2,0,0]=4 3319 B9R0.46 CCCCCC[C@@H](F)CBr Amb27872246 [0,2,0,0,0,0|2,0,0]=4 3320 B9R0.46 CCCCCC[C@@H](F)CO Amb27213919 [0,2,0,0,0,0|2,0,0]=4 3321 B9R0.46 CCCCCC[C@@H](N)CO Amb27812823 [0,2,0,0,0,0|2,0,0]=4 3322 B9R0.46 CCCCCC[C@@H](O)CBr Amb27214043 [0,2,0,0,0,0|2,0,0]=4 3323 B9R0.46 CCCCCC[C@@H](O)CCl Amb27630055 [0,2,0,0,0,0|2,0,0]=4 3324 B9R0.46 CCCCCC[C@@H](O)CF Amb22225126 [0,2,0,0,0,0|2,0,0]=4 3325 B9R0.46 CCCCCC[C@@H](O)CO Amb22225132 [0,2,0,0,0,0|2,0,0]=4 3326 B9R0.46 CCCCCC[C@H](N)CO Amb28126944 [0,2,0,0,0,0|2,0,0]=4 3327 B9R0.46 CCCCCC[C@H](O)CF Amb27480605 [0,2,0,0,0,0|2,0,0]=4 3328 B9R0.46 CCCCCC[C@H](O)CN Amb27413021 [0,2,0,0,0,0|2,0,0]=4 3329 B9R0.46 CCCCCNC(C)CC Amb6688188 [0,2,0,0,0,0|2,0,0]=4 3330 B9R0.46 CCCCNCC(C)CCl Amb27424764 [0,2,0,0,0,0|2,0,0]=4 3331 B9R0.46 CCCCNCC(Cl)CC Amb27242061 [0,2,0,0,0,0|2,0,0]=4 3332 B9R0.46 CCCCNCC(N)CC Amb27806280 [0,2,0,0,0,0|2,0,0]=4 3333 B9R0.46 CCCCNCC(O)CC Amb27591960 [0,2,0,0,0,0|2,0,0]=4 3334 B9R0.46 CCCCNCC(O)CO Amb17308645 [0,2,0,0,0,0|2,0,0]=4 3335 B9R0.46 CCCCNCC(S)CS Amb27487335 [0,2,0,0,0,0|2,0,0]=4 3336 B9R0.46 CCCCNC[C@H](O)CC Amb28144394 [0,2,0,0,0,0|2,0,0]=4 3337 B9R0.46 CCCCOCC(C)CC Amb27803945 [0,2,0,0,0,0|1,1,0]=4 3338 B9R0.46 CCCCOCC(C)CCl Amb27228843 [0,2,0,0,0,0|1,1,0]=4 3339 B9R0.46 CCCCOCC(N)CC Amb17485997 [0,2,0,0,0,0|1,1,0]=4 3340 B9R0.46 CCCCOCC(N)CO Amb27839156 [0,2,0,0,0,0|1,1,0]=4 3341 B9R0.46 CCCCOCC(O)CCl Amb9787120 [0,2,0,0,0,0|1,1,0]=4 3342 B9R0.46 CCCCOCC(O)CN Amb8895238 [0,2,0,0,0,0|1,1,0]=4 3343 B9R0.46 CCCCOCC(O)CS Amb28050761 [0,2,0,0,0,0|1,1,0]=4 3344 B9R0.46 CCCCOC[C@@H](O)CC Amb27615814 [0,2,0,0,0,0|1,1,0]=4 3345 B9R0.46 CCCCOC[C@H](N)CO Amb28130815 [0,2,0,0,0,0|1,1,0]=4 3346 B9R0.46 CCCCSCC(=O)OC Amb9262932 [0,2,0,0,0,0|1,0,1]=4 3347 B9R0.46 CCCCSCC(C)C=O Amb27837938 [0,2,0,0,0,0|1,0,0]=3 3348 B9R0.46 CCCCSCC(Cl)C#N Amb27395189 [0,2,0,0,0,0|1,0,1]=4 3349 B9R0.46 CCCCSCC(N)CO Amb24480393 [0,2,0,0,0,0|1,0,0]=3 3350 B9R0.46 CCCCSCC(O)CO Amb10669577 [0,2,0,0,0,0|1,0,0]=3 3351 B9R0.46 CCCCSC[C@H](O)CN Amb27221761 [0,2,0,0,0,0|1,0,0]=3 3352 B9R0.46 CCCCSC\C(C)=C\Cl Amb27397514 [0,2,0,0,0,0|1,0,1]=4 3353 B9R0.46 CCCC\N=C\C(O)CC Amb28050660 [0,2,0,0,0,0|2,0,0]=4 3354 B9R0.46 CCCNCCC(C)CC Amb28124478 [0,2,0,0,0,0|2,0,0]=4 3355 B9R0.46 CCCNCCC(N)CC Amb28123553 [0,2,0,0,0,0|2,0,0]=4 3356 B9R0.46 CCCNCCC(O)CO Amb32645150 [0,2,0,0,0,0|2,0,0]=4 3357 B9R0.46 CCCNCC[C@H](O)CC Amb27770360 [0,2,0,0,0,0|2,0,0]=4 3358 B9R0.46 CCCOCCC(C)CBr Amb26369433 [0,2,0,0,0,0|1,1,0]=4 3359 B9R0.46 CCCOCCC(C)CCl Amb25921281 [0,2,0,0,0,0|1,1,0]=4 3360 B9R0.46 CCCOCCC(C)NC Amb28070797 [0,2,0,0,0,0|1,1,0]=4 3361 B9R0.46 CCCOCCC(C)NN Amb28288881 [0,2,0,0,0,0|1,1,0]=4 3362 B9R0.46 CCCOCCC(O)CN Amb27454686 [0,2,0,0,0,0|1,1,0]=4 3363 B9R0.46 CCCONCC(C)C#N Amb28186051 [0,2,0,0,0,0|1,1,0]=4 3364 B9R0.46 CCCONCC(C)CN Amb27985329 [0,2,0,0,0,0|1,1,0]=4 3365 B9R0.46 CCCONCC(C)OC Amb27246429 [0,2,0,0,0,0|1,1,0]=4 3366 B9R0.46 CCCSCCC(N)CO Amb27839116 [0,2,0,0,0,0|1,0,0]=3 3367 B9R0.46 CCC\C=C\CC(=O)CC Amb26948943 [0,2,0,0,0,0|2,0,0]=4 3368 B9R0.46 CCC\C=C\CC(N)CC Amb27198430 [0,2,0,0,0,0|2,0,0]=4 3369 B9R0.46 CCC\C=C\CC(N)CO Amb26848586 [0,2,0,0,0,0|2,0,0]=4 3370 B9R0.46 CCC\C=C\CC(O)CN Amb33422858 [0,2,0,0,0,0|2,0,0]=4 3371 B9R0.46 CCC\C=C\C[C@@H](O)CO Amb27484703 [0,2,0,0,0,0|2,0,0]=4 3372 B9R0.46 CCC\C=N\OC(C)CC Amb28293977 [0,2,0,0,0,0|1,1,0]=4 3373 B9R0.46 CCNCCCC(O)CC Amb27618908 [0,2,0,0,0,0|2,0,0]=4 3374 B9R0.46 CCNCCSC(C)CO Amb28079466 [0,2,0,0,0,0|2,0,0]=4 3375 B9R0.46 CCOCCSC(C)CCl Amb27212971 [0,2,0,0,0,0|2,0,0]=4 3376 B9R0.46 CCOCCSC(C)CN Amb28077667 [0,2,0,0,0,0|2,0,0]=4 3377 B9R0.46 CCOCCSC(C)CO Amb27771669 [0,2,0,0,0,0|2,0,0]=4 3378 B9R0.46 CCOCOCC(N)CC Amb27859010 [0,2,0,0,0,0|1,1,0]=4 3379 B9R0.46 CCOCSCC(C)CN Amb28041933 [0,2,0,0,0,0|2,0,0]=4 3380 B9R0.46 CCSCCCC(Br)CC Amb27652366 [0,2,0,0,0,0|2,0,0]=4 3381 B9R0.46 CCSCCCC(Cl)CC Amb28044995 [0,2,0,0,0,0|2,0,0]=4 3382 B9R0.46 CCSCCSC(C)CN Amb27791495 [0,2,0,0,0,0|2,0,0]=4 3383 B9R0.46 CCSCCSC(C)CO Amb27620222 [0,2,0,0,0,0|2,0,0]=4 3384 B9R0.46 CCSCSCC(O)CO Amb27432512 [0,2,0,0,0,0|2,0,0]=4 3385 B9R0.46 CC[C@@H](N)CNCCCF Amb27828441 [0,2,0,0,0,0|2,0,0]=4 3386 B9R0.46 CC[C@@H](O)CNCCCF Amb27212129 [0,2,0,0,0,0|2,0,0]=4 3387 B9R0.46 CC[C@@H](O)CNCCCN Amb27823263 [0,2,0,0,0,0|2,0,0]=4 3388 B9R0.46 CC[C@@H](O)CNCCCO Amb27256818 [0,2,0,0,0,0|2,0,0]=4 3389 B9R0.46 CC[C@H](C)CCCCCO Amb19944689 [0,2,0,0,0,0|2,0,0]=4 3390 B9R0.46 CC[C@H](N)CNCCCF Amb27259964 [0,2,0,0,0,0|2,0,0]=4 3391 B9R0.46 CC[C@H](N)CNCCOC Amb27259962 [0,2,0,0,0,0|2,0,0]=4 3392 B9R0.46 CC[C@H](O)CCCCCF Amb27651955 [0,2,0,0,0,0|2,0,0]=4 3393 B9R0.46 CC[C@H](O)CSCCOC Amb27433227 [0,2,0,0,0,0|1,0,0]=3 3394 B9R0.46 CNCCSCC(C)OC Amb27434606 [0,2,0,0,0,0|2,0,0]=4 3395 B9R0.46 COC(=O)CSSCCO Amb26922212 [0,2,0,0,0,0|1,0,1]=4 3396 B9R0.46 COC(=O)SSCCCO Amb28065222 [0,2,0,0,0,0|1,0,1]=4 3397 B9R0.46 COC(C)CSCCCCl Amb27234548 [0,2,0,0,0,0|2,0,0]=4 3398 B9R0.46 COC(C)CSCCCN Amb28068618 [0,2,0,0,0,0|2,0,0]=4 3399 B9R0.46 COCCSCC(C)CBr Amb27754626 [0,2,0,0,0,0|2,0,0]=4 3400 B9R0.46 COCCSCC(C)CN Amb9391276 [0,2,0,0,0,0|2,0,0]=4 3401 B9R0.46 COCCSCC(C)CS Amb27614888 [0,2,0,0,0,0|2,0,0]=4 3402 B9R0.46 COCCSCC(C)OC Amb28256683 [0,2,0,0,0,0|2,0,0]=4 3403 B9R0.46 COCCSCC(O)CN Amb9305325 [0,2,0,0,0,0|2,0,0]=4 3404 B9R0.46 CSCCCSC(C)CCl Amb28131146 [0,2,0,0,0,0|2,0,0]=4 3405 B9R0.46 CSCCSCC(C)C#N Amb27392657 [0,2,0,0,0,0|2,0,0]=4 3406 B9R0.46 CSCCSCC(O)CF Amb27491697 [0,2,0,0,0,0|2,0,0]=4 3407 B9R0.46 CSCCSCC(O)CO Amb27817441 [0,2,0,0,0,0|2,0,0]=4 3408 B9R0.46 CSCCSC[C@H](O)CN Amb27409404 [0,2,0,0,0,0|2,0,0]=4 3409 B9R0.46 NCCCSCC(O)CO Amb27486689 [0,2,0,0,0,0|2,0,0]=4 3410 B9R0.46 OCCCSCC(O)CCl Amb28385596 [0,2,0,0,0,0|2,0,0]=4 3411 B9R0.46 OCCCSCC(O)CO Amb27390520 [0,2,0,0,0,0|2,0,0]=4 3412 B9R0.46 [C-]#[N+]C(C)CCCCCC Amb2688921 [0,2,0,0,0,0|2,0,0]=4 3413 B9R0.1 C=C(C)CSCC(F)CC Amb28126249 [0,2,0,0,0,0|1,0,1]=4 3414 B9R0.1 C=C(C)CSCC(N)CC Amb27210754 [0,2,0,0,0,0|1,0,1]=4 3415 B9R0.1 C=C(CC)CSCC(C)C Amb27756996 [0,2,0,0,0,0|1,0,1]=4 3416 B9R0.1 CC(C)CSCC(C)CS Amb27837878 [0,2,0,0,0,0|2,0,0]=4 3417 B9R0.1 CC(C)CSCC(N)CO Amb27799380 [0,2,0,0,0,0|2,0,0]=4 3418 B9R0.1 CC(N)CCSC(C)CN Amb27602011 [0,2,0,0,0,0|2,0,0]=4 3419 B9R0.1 CC(N)CSCC(O)CF Amb28062219 [0,2,0,0,0,0|2,0,0]=4 3420 B9R0.1 CC(N)CSCC(O)CN Amb27867061 [0,2,0,0,0,0|2,0,0]=4 3421 B9R0.1 CC(N)CSCC(O)CO Amb28248541 [0,2,0,0,0,0|2,0,0]=4 3422 B9R0.1 CC(O)CSCC(C)CO Amb27425054 [0,2,0,0,0,0|2,0,0]=4 3423 B9R0.1 CCC(=O)CSCC(C)C Amb18800475 [0,2,0,0,0,0|1,0,1]=4 3424 B9R0.1 CCC(C)CCCC(C)Br Amb28313037 [0,2,0,0,0,0|2,0,0]=4 3425 B9R0.1 CCC(C)CCCC(C)C Amb4036389 [0,2,0,0,0,0|2,0,0]=4 3426 B9R0.1 CCC(C)CCCC(C)N Amb26516233 [0,2,0,0,0,0|2,0,0]=4 3427 B9R0.1 CCC(C)CCC[C@@H](C)N Amb33731287 [0,2,0,0,0,0|2,0,0]=4 3428 B9R0.1 CCC(C)CCC[C@H](C)N Amb33729331 [0,2,0,0,0,0|2,0,0]=4 3429 B9R0.1 CCC(C)CNCC(C)C Amb6719710 [0,2,0,0,0,0|2,0,0]=4 3430 B9R0.1 CCC(C)CNCC(C)N Amb27261520 [0,2,0,0,0,0|2,0,0]=4 3431 B9R0.1 CCC(C)CNC[C@H](C)N Amb28135566 [0,2,0,0,0,0|2,0,0]=4 3432 B9R0.1 CCC(C)CSCC(C)=O Amb27590937 [0,2,0,0,0,0|1,0,1]=4 3433 B9R0.1 CCC(C)NCCC(C)Cl Amb28246887 [0,2,0,0,0,0|2,0,0]=4 3434 B9R0.1 CCC(C)NCCC(C)N Amb27185683 [0,2,0,0,0,0|2,0,0]=4 3435 B9R0.1 CCC(F)CSCC(C)=O Amb27804706 [0,2,0,0,0,0|1,0,1]=4 3436 B9R0.1 CCC(F)CSCC(C)C Amb28126923 [0,2,0,0,0,0|1,0,0]=3 3437 B9R0.1 CCC(N)CNCC(C)C Amb25083649 [0,2,0,0,0,0|2,0,0]=4 3438 B9R0.1 CCC(N)CSCC(C)C Amb28050870 [0,2,0,0,0,0|1,0,0]=3 3439 B9R0.1 CCC(N)CSCC(C)O Amb27867791 [0,2,0,0,0,0|1,0,0]=3 3440 B9R0.1 CCC(N)CSCC(F)F Amb27792560 [0,2,0,0,0,0|2,0,0]=4 3441 B9R0.1 CCC(O)CNCC(C)O Amb28344778 [0,2,0,0,0,0|2,0,0]=4 3442 B9R0.1 CCC(O)CNC[C@H](C)O Amb27772022 [0,2,0,0,0,0|2,0,0]=4 3443 B9R0.1 CCC(O)CSCC(C)C Amb18792450 [0,2,0,0,0,0|1,0,0]=3 3444 B9R0.1 CC[C@@H](O)CNCC(C)O Amb27770562 [0,2,0,0,0,0|2,0,0]=4 3445 B9R0.1 CC[C@@H](O)CSCC(C)C Amb28381554 [0,2,0,0,0,0|1,0,0]=3 3446 B9R0.1 CC[C@H](N)CSCC(C)C Amb27771983 [0,2,0,0,0,0|1,0,0]=3 3447 B9R0.1 COC(C)CSCC(C)C Amb28049301 [0,2,0,0,0,0|2,0,0]=4 3448 B9R0.1 C[C@H](N)CSCC(O)CO Amb27809787 [0,2,0,0,0,0|2,0,0]=4 3449 B9R0.20 CCC(C)(O)CSCCN Amb27457085 [0,2,0,0,0,0|2,0,0]=4 3450 B9R0.20 CCCCCC(C)(C)CC Amb22052710 [0,2,0,0,0,0|2,0,0]=4 3451 B9R0.20 CCCCCC(C)(Cl)CC Amb22229257 [0,2,0,0,0,0|2,0,0]=4 3452 B9R0.20 CCCCCC(C)(N)CC Amb27799493 [0,2,0,0,0,0|2,0,0]=4 3453 B9R0.20 CCCCCC(C)(O)CC Amb4017959 [0,2,0,0,0,0|2,0,0]=4 3454 B9R0.20 CCCCSC(C)(C)CCl Amb27480208 [0,2,0,0,0,0|2,0,0]=4 3455 B9R0.20 CCCNCC(C)(N)CC Amb27837742 [0,2,0,0,0,0|2,0,0]=4 3456 B9R0.20 CCCSCC(C)(C)CBr Amb27754952 [0,2,0,0,0,0|2,0,0]=4 3457 B9R0.20 CCCSCC(C)(N)CO Amb27851558 [0,2,0,0,0,0|2,0,0]=4 3458 B9R0.20 CCCSCC(C)(O)CC Amb27406273 [0,2,0,0,0,0|1,0,0]=3 3459 B9R0.24 CC(CN)SSC(C)CN Amb27233637 [0,2,0,0,0,0|2,0,0]=4 3460 B9R0.24 CCC(=O)CSC(C)CC Amb18800476 [0,2,0,0,0,0|1,0,1]=4 3461 B9R0.24 CCC(C)C#CC(O)CC Amb27651904 [0,2,0,0,0,0|2,0,0]=4 3462 B9R0.24 CCC(C)CCC(N)CC Amb27436682 [0,2,0,0,0,0|2,0,0]=4 3463 B9R0.24 CCC(C)CNC(C)CC Amb6719670 [0,2,0,0,0,0|2,0,0]=4 3464 B9R0.24 CCC(C)CSC(C)CN Amb28202833 [0,2,0,0,0,0|2,0,0]=4 3465 B9R0.24 CCC(C)NC[C@@H](O)CC Amb27802859 [0,2,0,0,0,0|2,0,0]=4 3466 B9R0.24 CCC(C)SCC(C)CS Amb27837881 [0,2,0,0,0,0|2,0,0]=4 3467 B9R0.24 CCC(C)SCC(O)CO Amb28049667 [0,2,0,0,0,0|2,0,0]=4 3468 B9R0.24 CCC(C)SC[C@@H](O)CN Amb28048046 [0,2,0,0,0,0|2,0,0]=4 3469 B9R0.24 CCC(C)SSC(C)CC Amb22231431 [0,2,0,0,0,0|0,0,0]=2 3470 B9R0.24 CCC(Cl)CNC(C)CC Amb27656286 [0,2,0,0,0,0|2,0,0]=4 3471 B9R0.24 CCC(N)CCC(N)CC Amb28388809 [0,2,0,0,0,0|2,0,0]=4 3472 B9R0.24 CCC(N)CNC(C)CC Amb24477987 [0,2,0,0,0,0|2,0,0]=4 3473 B9R0.24 CCC(N)CSC(C)CC Amb28140085 [0,2,0,0,0,0|1,0,0]=3 3474 B9R0.24 CCC(O)CCC(O)CC Amb27218701 [0,2,0,0,0,0|2,0,0]=4 3475 B9R0.24 CCC(O)CSC(C)CN Amb28195768 [0,2,0,0,0,0|2,0,0]=4 3476 B9R0.24 CCC(O)CSC(C)CO Amb27460957 [0,2,0,0,0,0|2,0,0]=4 3477 B9R0.24 CCC(O)\C=C\C(O)CC Amb27659815 [0,2,0,0,0,0|2,0,0]=4 3478 B9R0.24 CC[C@@H](O)C#C[C@H](O)CC Amb28044143 [0,2,0,0,0,0|2,0,0]=4 3479 B9R0.24 CC[C@@H](O)CC[C@H](O)CC Amb8516406 [0,2,0,0,0,0|2,0,0]=4 3480 B9R0.24 CC[C@@H](O)\C=C\[C@H](O)CC Amb27456680 [0,2,0,0,0,0|2,0,0]=4 3481 B9R0.24 CC[C@H](O)C#C[C@H](O)CC Amb28065294 [0,2,0,0,0,0|2,0,0]=4 3482 B9R0.24 CC[C@H](O)CC[C@@H](O)CC Amb8516407 [0,2,0,0,0,0|2,0,0]=4 3483 B9R0.24 CC[C@H](O)CSC(C)CO Amb27226500 [0,2,0,0,0,0|2,0,0]=4 3484 B9R0.24 CC[C@H](O)\C=C\[C@H](O)CC Amb27972735 [0,2,0,0,0,0|2,0,0]=4 3485 B9R0.24 C[C@@H](CN)SS[C@@H](C)CN Amb27482971 [0,2,0,0,0,0|2,0,0]=4 3486 B9R0.47 CC(C)C(C)SCCCCl Amb28207665 [0,2,0,0,0,0|2,0,0]=4 3487 B9R0.47 CC(C)C(C)SCCCN Amb27753406 [0,2,0,0,0,0|2,0,0]=4 3488 B9R0.47 CC(N)C(C)SCCCO Amb27471461 [0,2,0,0,0,0|2,0,0]=4 3489 B9R0.47 CC(O)C(C)SCCCF Amb27763099 [0,2,0,0,0,0|2,0,0]=4 3490 B9R0.47 CCCC#CC(O)C(C)C Amb27839218 [0,2,0,0,0,0|2,0,0]=4 3491 B9R0.47 CCCCCC(Br)C(C)C Amb27877198 [0,2,0,0,0,0|2,0,0]=4 3492 B9R0.47 CCCCCC(Br)C(C)F Amb27947488 [0,2,0,0,0,0|2,0,0]=4 3493 B9R0.47 CCCCCC(Br)C(C)O Amb28049966 [0,2,0,0,0,0|2,0,0]=4 3494 B9R0.47 CCCCCC(C)C(C)C Amb10069375 [0,2,0,0,0,0|2,0,0]=4 3495 B9R0.47 CCCCCC(C)C(C)N Amb27155602 [0,2,0,0,0,0|2,0,0]=4 3496 B9R0.47 CCCCCC(C)[C@@H](C)N Amb33738432 [0,2,0,0,0,0|2,0,0]=4 3497 B9R0.47 CCCCCC(C)[C@H](C)N Amb33745259 [0,2,0,0,0,0|2,0,0]=4 3498 B9R0.47 CCCCCC(F)C(C)O Amb27769908 [0,2,0,0,0,0|2,0,0]=4 3499 B9R0.47 CCCCCC(O)C(C)C Amb4036433 [0,2,0,0,0,0|2,0,0]=4 3500 B9R0.47 CCCCCC(O)C(C)O Amb27835134 [0,2,0,0,0,0|2,0,0]=4 3501 B9R0.47 CCCCC[C@@H](O)[C@H](C)Br Amb28049949 [0,2,0,0,0,0|2,0,0]=4 3502 B9R0.47 CCCCC[C@H](Br)[C@H](C)O Amb27830165 [0,2,0,0,0,0|2,0,0]=4 3503 B9R0.47 CCCCC[C@H](N)[C@H](C)O Amb28250851 [0,2,0,0,0,0|2,0,0]=4 3504 B9R0.47 CCCCC[C@H](O)C(C)C Amb28064175 [0,2,0,0,0,0|2,0,0]=4 3505 B9R0.47 CCCCC[C@H](O)[C@@H](C)N Amb27488726 [0,2,0,0,0,0|2,0,0]=4 3506 B9R0.47 CCCCC[C@H](O)[C@@H](C)O Amb27979805 [0,2,0,0,0,0|2,0,0]=4 3507 B9R0.47 CCCCNC(C)C(C)Cl Amb27424247 [0,2,0,0,0,0|2,0,0]=4 3508 B9R0.47 CCCCNC(C)C(C)O Amb27874111 [0,2,0,0,0,0|2,0,0]=4 3509 B9R0.47 CCCCOC(C)C(C)Cl Amb28383768 [0,2,0,0,0,0|1,1,0]=4 3510 B9R0.47 CCCCOC(C)[C@@H](C)N Amb27201179 [0,2,0,0,0,0|1,1,0]=4 3511 B9R0.47 CCCCOC(O)C(C)C Amb27764938 [0,2,0,0,0,0|1,1,0]=4 3512 B9R0.47 CCCCO[C@@H](C)[C@@H](C)O Amb28050639 [0,2,0,0,0,0|1,1,0]=4 3513 B9R0.47 CCCCO[C@@H](C)[C@H](C)O Amb27790251 [0,2,0,0,0,0|1,1,0]=4 3514 B9R0.47 CCCCSC(C)C(C)Cl Amb27424775 [0,2,0,0,0,0|1,0,0]=3 3515 B9R0.47 CCCCS[C@H](C)[C@@H](C)O Amb27835113 [0,2,0,0,0,0|1,0,0]=3 3516 B9R0.47 CCCNCC(Cl)C(C)C Amb27207030 [0,2,0,0,0,0|2,0,0]=4 3517 B9R0.47 CCCNCC(O)C(C)C Amb27427929 [0,2,0,0,0,0|2,0,0]=4 3518 B9R0.47 CCCOCC(Cl)C(C)Cl Amb27659302 [0,2,0,0,0,0|1,1,0]=4 3519 B9R0.47 CCCOCC(N)C(C)C Amb22009215 [0,2,0,0,0,0|1,1,0]=4 3520 B9R0.47 CCCONC(C)C(C)O Amb28397524 [0,2,0,0,0,0|1,1,0]=4 3521 B9R0.47 CCCSCC(C)C(C)=O Amb27262876 [0,2,0,0,0,0|1,0,1]=4 3522 B9R0.47 CCCSCC(N)C(C)C Amb27649482 [0,2,0,0,0,0|1,0,0]=3 3523 B9R0.47 CCCSC[C@H](C)N(C)C Amb28349583 [0,2,0,0,0,0|2,0,0]=4 3524 B9R0.47 CCOCSC(C)C(C)C Amb27842953 [0,2,0,0,0,0|2,0,0]=4 3525 B9R0.47 CSCCSC(C)C(C)C Amb27783978 [0,2,0,0,0,0|2,0,0]=4 3526 B9R0.47 CSCCSC(C)C(C)N Amb27402149 [0,2,0,0,0,0|2,0,0]=4 3527 B9R0.50 C#CC(CC)NCCCC Amb28137650 [0,2,0,0,0,0|2,0,0]=4 3528 B9R0.50 CCC(C#N)SCCCN Amb27184060 [0,2,0,0,0,0|2,0,0]=4 3529 B9R0.50 CCC(C#N)SCCCO Amb28386291 [0,2,0,0,0,0|2,0,0]=4 3530 B9R0.50 CCC(CC)CSCCO Amb27874567 [0,2,0,0,0,0|2,0,0]=4 3531 B9R0.50 CCC(CC)SCCCO Amb28364480 [0,2,0,0,0,0|2,0,0]=4 3532 B9R0.50 CCC(CSCCO)NC Amb28182647 [0,2,0,0,0,0|2,0,0]=4 3533 B9R0.50 CCC(CSCCO)OC Amb27195641 [0,2,0,0,0,0|2,0,0]=4 3534 B9R0.50 CCCCCC(C=O)CC Amb25883306 [0,2,0,0,0,0|2,0,0]=4 3535 B9R0.50 CCCCCC(CC)CBr Amb26369673 [0,2,0,0,0,0|2,0,0]=4 3536 B9R0.50 CCCCCC(CC)CC Amb22229275 [0,2,0,0,0,0|2,0,0]=4 3537 B9R0.50 CCCCCC(CC)CCl Amb26369462 [0,2,0,0,0,0|2,0,0]=4 3538 B9R0.50 CCCCCC(CC)CO Amb27831173 [0,2,0,0,0,0|2,0,0]=4 3539 B9R0.50 CCCCCC(CC)NN Amb28072731 [0,2,0,0,0,0|2,0,0]=4 3540 B9R0.50 CCCCCC(CC)OC Amb27425019 [0,2,0,0,0,0|2,0,0]=4 3541 B9R0.50 CCCCCC(CC)ON Amb28292988 [0,2,0,0,0,0|2,0,0]=4 3542 B9R0.50 CCCCC[C@@H](C=O)CC Amb27792864 [0,2,0,0,0,0|2,0,0]=4 3543 B9R0.50 CCCCC[C@@H](CC)CO Amb28050752 [0,2,0,0,0,0|2,0,0]=4 3544 B9R0.50 CCCCNC(C#N)CC Amb27424952 [0,2,0,0,0,0|2,0,0]=4 3545 B9R0.50 CCCCNC(CC)CBr Amb28198883 [0,2,0,0,0,0|2,0,0]=4 3546 B9R0.50 CCCCNC(CC)CO Amb4304056 [0,2,0,0,0,0|2,0,0]=4 3547 B9R0.50 CCCCN[C@@H](CC)CO Amb28369528 [0,2,0,0,0,0|2,0,0]=4 3548 B9R0.50 CCCCOC(C#N)CC Amb28066543 [0,2,0,0,0,0|1,1,0]=4 3549 B9R0.50 CCCCOC(CC)CBr Amb5494000 [0,2,0,0,0,0|1,1,0]=4 3550 B9R0.50 CCCCOC(CC)CO Amb26324075 [0,2,0,0,0,0|1,1,0]=4 3551 B9R0.50 CCCCSC(C=O)CC Amb27799813 [0,2,0,0,0,0|1,0,0]=3 3552 B9R0.50 CCCCSC(CC)CC Amb28349735 [0,2,0,0,0,0|1,0,0]=3 3553 B9R0.50 CCCCSC(CCl)CCl Amb28121934 [0,2,0,0,0,0|2,0,0]=4 3554 B9R0.50 CCCNCC(CC)CC Amb6262228 [0,2,0,0,0,0|2,0,0]=4 3555 B9R0.50 CCCNCC(CC)OC Amb27229568 [0,2,0,0,0,0|2,0,0]=4 3556 B9R0.50 CCCOCC(CC)CBr Amb26554699 [0,2,0,0,0,0|1,1,0]=4 3557 B9R0.50 CCCOCC(CC)CCl Amb32689897 [0,2,0,0,0,0|1,1,0]=4 3558 B9R0.50 CCCONC(CC)CC Amb27875478 [0,2,0,0,0,0|1,1,0]=4 3559 B9R0.50 CCCSCC(CO)NC Amb27839117 [0,2,0,0,0,0|2,0,0]=4 3560 B9R0.50 CCCSCC(OC)OC Amb28421666 [0,2,0,0,0,0|2,0,0]=4 3561 B9R0.38 CC(C)(C)CCSCCCl Amb28347862 [0,2,0,0,0,0|2,0,0]=4 3562 B9R0.38 CC(C)(C)CCSCCN Amb8876133 [0,2,0,0,0,0|2,0,0]=4 3563 B9R0.38 CC(C)(C)CSCCCF Amb27806264 [0,2,0,0,0,0|2,0,0]=4 3564 B9R0.38 CC(C)(C)SSSCCO Amb27603218 [0,2,0,0,0,0|2,0,0]=4 3565 B9R0.38 CC(F)(F)CCSCCN Amb27199896 [0,2,0,0,0,0|2,0,0]=4 3566 B9R0.38 CC(F)(F)CSCCCN Amb27796349 [0,2,0,0,0,0|2,0,0]=4 3567 B9R0.38 CCCCCCC(C)(C)C Amb10069374 [0,2,0,0,0,0|2,0,0]=4 3568 B9R0.38 CCCCCCC(C)(C)Cl Amb22228729 [0,2,0,0,0,0|2,0,0]=4 3569 B9R0.38 CCCCCCC(C)(C)N Amb26336797 [0,2,0,0,0,0|2,0,0]=4 3570 B9R0.38 CCCCCCC(C)(C)S Amb6366514 [0,2,0,0,0,0|2,0,0]=4 3571 B9R0.38 CCCCNCC(C)(C)Br Amb27838125 [0,2,0,0,0,0|2,0,0]=4 3572 B9R0.38 CCCCNCC(C)(C)F Amb27453060 [0,2,0,0,0,0|2,0,0]=4 3573 B9R0.38 CCCCOCC(C)(C)N Amb17485999 [0,2,0,0,0,0|1,1,0]=4 3574 B9R0.38 CCCCSCC(C)(C)N Amb28422265 [0,2,0,0,0,0|1,0,0]=3 3575 B9R0.38 CCCCSCC(C)(C)O Amb18792455 [0,2,0,0,0,0|1,0,0]=3 3576 B9R0.38 CCCNCCC(C)(C)C Amb9204027 [0,2,0,0,0,0|2,0,0]=4 3577 B9R0.38 CCCNCCC(C)(C)N Amb27839014 [0,2,0,0,0,0|2,0,0]=4 3578 B9R0.38 CCCNCCC(C)(C)O Amb27786325 [0,2,0,0,0,0|2,0,0]=4 3579 B9R0.38 CCCONCC(C)(C)N Amb28143126 [0,2,0,0,0,0|1,1,0]=4 3580 B9R0.38 CCCSCCC(C)(C)O Amb28254020 [0,2,0,0,0,0|1,0,0]=3 3581 B9R0.38 CCC\C=C\CC(C)(C)N Amb33224619 [0,2,0,0,0,0|2,0,0]=4 3582 B9R0.38 CCC\C=C\CC(C)(C)O Amb33327140 [0,2,0,0,0,0|2,0,0]=4 3583 B9R0.38 CCSCSCC(C)(C)C Amb27854841 [0,2,0,0,0,0|2,0,0]=4 3584 B9R0.38 COCCSCC(C)(C)N Amb27607635 [0,2,0,0,0,0|2,0,0]=4 3585 B9R0.38 COCCSCC(C)(C)O Amb18792608 [0,2,0,0,0,0|2,0,0]=4 3586 B9R0.38 CSCCSCC(C)(C)C Amb28318985 [0,2,0,0,0,0|2,0,0]=4 3587 B9R0.55 CC(=O)CCSCC(C)C Amb9283499 [0,2,0,0,0,0|1,0,1]=4 3588 B9R0.55 CC(=O)CSCCC(C)C Amb27614926 [0,2,0,0,0,0|1,0,1]=4 3589 B9R0.55 CC(C)CCCCC(C)C Amb22043289 [0,2,0,0,0,0|2,0,0]=4 3590 B9R0.55 CC(C)CCCCC(C)N Amb27830700 [0,2,0,0,0,0|2,0,0]=4 3591 B9R0.55 CC(C)CCCC[C@@H](C)N Amb33731285 [0,2,0,0,0,0|2,0,0]=4 3592 B9R0.55 CC(C)CCCC[C@H](C)N Amb33729329 [0,2,0,0,0,0|2,0,0]=4 3593 B9R0.55 CC(C)CCNCC(C)C Amb6692732 [0,2,0,0,0,0|2,0,0]=4 3594 B9R0.55 CC(C)CCNC[C@@H](C)O Amb27812132 [0,2,0,0,0,0|2,0,0]=4 3595 B9R0.55 CC(C)CCOCC(C)N Amb6661416 [0,2,0,0,0,0|1,1,0]=4 3596 B9R0.55 CC(C)CCOC[C@@H](C)O Amb28145728 [0,2,0,0,0,0|1,1,0]=4 3597 B9R0.55 CC(C)CCOC[C@H](C)N Amb28255350 [0,2,0,0,0,0|1,1,0]=4 3598 B9R0.55 CC(C)CCSCC(C)N Amb28128185 [0,2,0,0,0,0|1,0,0]=3 3599 B9R0.55 CC(C)CNCCC(C)Cl Amb28256358 [0,2,0,0,0,0|2,0,0]=4 3600 B9R0.55 CC(C)CNCC[C@@H](C)N Amb27216669 [0,2,0,0,0,0|2,0,0]=4 3601 B9R0.55 CC(C)CNCC[C@H](C)N Amb27804036 [0,2,0,0,0,0|2,0,0]=4 3602 B9R0.55 CC(C)CONC[C@@H](C)O Amb28200140 [0,2,0,0,0,0|1,1,0]=4 3603 B9R0.55 CC(C)CONC[C@H](C)O Amb27859515 [0,2,0,0,0,0|1,1,0]=4 3604 B9R0.55 CC(C)CSCCC(C)F Amb27484345 [0,2,0,0,0,0|1,0,0]=3 3605 B9R0.55 CC(C)CSSCC(=O)O Amb27865411 [0,2,0,0,0,0|1,0,1]=4 3606 B9R0.55 CC(C)C\C=C\CC(C)Cl Amb27408340 [0,2,0,0,0,0|2,0,0]=4 3607 B9R0.55 CC(C)C\C=C\CC(C)O Amb27968433 [0,2,0,0,0,0|2,0,0]=4 3608 B9R0.55 CC(C)SSSSC(C)C Amb24469620 [0,2,0,0,0,0|2,0,0]=4 3609 B9R0.55 CC(Cl)CSCCN(C)C Amb27478039 [0,2,0,0,0,0|2,0,0]=4 3610 B9R0.55 CC(N)CCSCC(C)N Amb27771520 [0,2,0,0,0,0|1,0,0]=3 3611 B9R0.55 CC(N)CCSCC(C)O Amb27975275 [0,2,0,0,0,0|1,0,0]=3 3612 B9R0.55 CC(N)CCSCC(F)F Amb27201182 [0,2,0,0,0,0|2,0,0]=4 3613 B9R0.55 CC(N)CSSCC(C)N Amb27879235 [0,2,0,0,0,0|0,0,0]=2 3614 B9R0.55 CC(O)CCCCC(C)O Amb27839243 [0,2,0,0,0,0|2,0,0]=4 3615 B9R0.55 CC(O)CCNCC(C)O Amb28382659 [0,2,0,0,0,0|2,0,0]=4 3616 B9R0.55 CC(O)CNNCC(C)O Amb27839323 [0,2,0,0,0,0|2,0,0]=4 3617 B9R0.55 CC(O)CSSCC(C)O Amb27618453 [0,2,0,0,0,0|0,0,0]=2 3618 B9R0.55 C[C@H](N)CSCCN(C)C Amb27852712 [0,2,0,0,0,0|2,0,0]=4 3619 B9R0.55 C[C@H](O)CSSC[C@H](C)O Amb27977693 [0,2,0,0,0,0|0,0,0]=2 3620 B7R1.1 BrCC1CCCC1 Amb8631537 [1,0,0,1,0,0|2,0,0]=4 3621 B7R1.1 BrCC1CCCN1 Amb20618588 [1,0,0,1,0,0|2,0,0]=4 3622 B7R1.1 BrCC1CCCN1 Amb21962027 [1,0,0,1,0,0|2,0,0]=4 3623 B7R1.1 BrCC1CCCN1 Amb32411817 [1,0,0,1,0,0|2,0,0]=4 3624 B7R1.1 BrCC1CCCO1 Amb9703505 [1,0,0,1,0,0|1,1,0]=4 3625 B7R1.1 BrCC1CCCS1 Amb27832399 [1,0,0,1,0,0|1,0,0]=3 3626 B7R1.1 BrCC1CCSC1 Amb27630698 [1,0,0,1,0,0|2,0,0]=4 3627 B7R1.1 BrC[C@@H]1CCCN1 Amb25809414 [1,0,0,1,0,0|2,0,0]=4 3628 B7R1.1 BrC[C@@H]1CCCN1 Amb32668728 [1,0,0,1,0,0|2,0,0]=4 3629 B7R1.1 BrC[C@@H]1CCCO1 Amb24046261 [1,0,0,1,0,0|1,1,0]=4 3630 B7R1.1 BrC[C@H]1CCCO1 Amb26844489 [1,0,0,1,0,0|1,1,0]=4 3631 B7R1.1 C#CC1CCCS1 Amb33169129 [1,0,0,1,0,0|0,0,2]=4 3632 B7R1.1 C=CC1CCCS1 Amb33415623 [1,0,0,1,0,0|0,0,2]=4 3633 B7R1.1 CCC1=CCCC1 Amb4035875 [1,0,0,1,0,0|1,0,1]=4 3634 B7R1.1 CCC1=NCCC1 Amb22055207 [1,0,0,1,0,0|1,0,1]=4 3635 B7R1.1 CCC1=NCCS1 Amb28141823 [1,0,0,1,0,0|1,0,1]=4 3636 B7R1.1 CCC1C=CCC1 Amb4020582 [1,0,0,1,0,0|1,0,1]=4 3637 B7R1.1 CCC1CCCC1 Amb22053788 [1,0,0,1,0,0|1,0,0]=3 3638 B7R1.1 CCC1CCCN1 Amb19515009 [1,0,0,1,0,0|1,0,0]=3 3639 B7R1.1 CCC1CCCN1 Amb3788096 [1,0,0,1,0,0|1,0,0]=3 3640 B7R1.1 CCC1CCCS1 Amb17939242 [1,0,0,1,0,0|0,0,0]=2 3641 B7R1.1 CCC1CCC[Cl+]1 Amb28076649 [1,0,0,1,0,0|1,0,0]=3 3642 B7R1.1 CCC1CCNC1 Amb18946548 [1,0,0,1,0,0|2,0,0]=4 3643 B7R1.1 CCC1CCNC1 Amb20630619 [1,0,0,1,0,0|2,0,0]=4 3644 B7R1.1 CCC1COCO1 Amb24567580 [1,0,0,1,0,0|1,1,0]=4 3645 B7R1.1 CCC1NCCO1 Amb17506183 [1,0,0,1,0,0|1,1,0]=4 3646 B7R1.1 CCC1OCCO1 Amb19892413 [1,0,0,1,0,0|1,1,0]=4 3647 B7R1.1 CCN1CCCC1 Amb17938866 [1,0,0,1,0,0|2,0,0]=4 3648 B7R1.1 CCN1CCCN1 Amb27776139 [1,0,0,1,0,0|2,0,0]=4 3649 B7R1.1 CC[C@@H]1CCCN1 Amb22747053 [1,0,0,1,0,0|1,0,0]=3 3650 B7R1.1 CC[C@@H]1CCNC1 Amb33801216 [1,0,0,1,0,0|2,0,0]=4 3651 B7R1.1 CC[C@H]1CCCN1 Amb25822206 [1,0,0,1,0,0|1,0,0]=3 3652 B7R1.1 CC[C@H]1CCNC1 Amb27458282 [1,0,0,1,0,0|2,0,0]=4 3653 B7R1.1 CC[C@H]1CCNC1 Amb30594227 [1,0,0,1,0,0|2,0,0]=4 3654 B7R1.1 CNC1CCCC1 Amb1223228 [1,0,0,1,0,0|2,0,0]=4 3655 B7R1.1 CNC1CCCC1 Amb9677383 [1,0,0,1,0,0|2,0,0]=4 3656 B7R1.1 CNC1CCCO1 Amb27254048 [1,0,0,1,0,0|1,1,0]=4 3657 B7R1.1 CNC1CCSC1 Amb22741543 [1,0,0,1,0,0|2,0,0]=4 3658 B7R1.1 CNC1CCSC1 Amb31291647 [1,0,0,1,0,0|2,0,0]=4 3659 B7R1.1 CNC1CCSC1 Amb9711007 [1,0,0,1,0,0|2,0,0]=4 3660 B7R1.1 CNC1NCCS1 Amb27413044 [1,0,0,1,0,0|2,0,0]=4 3661 B7R1.1 COC1CCCC1 Amb8517656 [1,0,0,1,0,0|2,0,0]=4 3662 B7R1.1 COC1CCCO1 Amb22505257 [1,0,0,1,0,0|1,1,0]=4 3663 B7R1.1 CO[C@@H]1CCCN1 Amb27948785 [1,0,0,1,0,0|2,0,0]=4 3664 B7R1.1 CSC1CCCC1 Amb22230463 [1,0,0,1,0,0|2,0,0]=4 3665 B7R1.1 ClCC1CCCC1 Amb9004338 [1,0,0,1,0,0|2,0,0]=4 3666 B7R1.1 ClCC1CCCN1 Amb1102532 [1,0,0,1,0,0|2,0,0]=4 3667 B7R1.1 ClCC1CCCN1 Amb22228750 [1,0,0,1,0,0|2,0,0]=4 3668 B7R1.1 ClCC1CCCO1 Amb5716848 [1,0,0,1,0,0|1,1,0]=4 3669 B7R1.1 ClCC1CCCS1 Amb25339278 [1,0,0,1,0,0|1,0,0]=3 3670 B7R1.1 ClCC1CCSC1 Amb28423424 [1,0,0,1,0,0|2,0,0]=4 3671 B7R1.1 ClCC1SCCS1 Amb25872759 [1,0,0,1,0,0|2,0,0]=4 3672 B7R1.1 ClC[C@@H]1CCCN1 Amb22226498 [1,0,0,1,0,0|2,0,0]=4 3673 B7R1.1 ClC[C@@H]1CCCN1 Amb22232498 [1,0,0,1,0,0|2,0,0]=4 3674 B7R1.1 ClC[C@H]1CCCN1 Amb26577168 [1,0,0,1,0,0|2,0,0]=4 3675 B7R1.1 FCC1CCCN1 Amb13953136 [1,0,0,1,0,0|2,0,0]=4 3676 B7R1.1 FCC1CCCN1 Amb28827628 [1,0,0,1,0,0|2,0,0]=4 3677 B7R1.1 FC[C@@H]1CCCN1 Amb22405982 [1,0,0,1,0,0|2,0,0]=4 3678 B7R1.1 FC[C@@H]1CCCN1 Amb27973462 [1,0,0,1,0,0|2,0,0]=4 3679 B7R1.1 FC[C@H]1CCCN1 Amb27602129 [1,0,0,1,0,0|2,0,0]=4 3680 B7R1.1 FC[C@H]1CCCN1 Amb32409431 [1,0,0,1,0,0|2,0,0]=4 3681 B7R1.1 ICC1CCCC1 Amb8517132 [1,0,0,1,0,0|2,0,0]=4 3682 B7R1.1 ICC1CCCO1 Amb24060886 [1,0,0,1,0,0|1,1,0]=4 3683 B7R1.1 N#CC1CCCS1 Amb20171416 [1,0,0,1,0,0|1,0,1]=4 3684 B7R1.1 NCC1CCCC1 Amb1127194 [1,0,0,1,0,0|2,0,0]=4 3685 B7R1.1 NCC1CCCC1 Amb13951760 [1,0,0,1,0,0|2,0,0]=4 3686 B7R1.1 NCC1CCCC1 Amb6892868 [1,0,0,1,0,0|2,0,0]=4 3687 B7R1.1 NCC1CCCN1 Amb19516137 [1,0,0,1,0,0|2,0,0]=4 3688 B7R1.1 NCC1CCCN1 Amb4418336 [1,0,0,1,0,0|2,0,0]=4 3689 B7R1.1 NCC1CCCO1 Amb2568046 [1,0,0,1,0,0|1,1,0]=4 3690 B7R1.1 NCC1CCCO1 Amb3903680 [1,0,0,1,0,0|1,1,0]=4 3691 B7R1.1 NCC1CCCS1 Amb20668756 [1,0,0,1,0,0|1,0,0]=3 3692 B7R1.1 NCC1CCSC1 Amb18198289 [1,0,0,1,0,0|2,0,0]=4 3693 B7R1.1 NCC1OCCS1 Amb23447046 [1,0,0,1,0,0|2,0,0]=4 3694 B7R1.1 NCC1SCCS1 Amb22011832 [1,0,0,1,0,0|2,0,0]=4 3695 B7R1.1 NCC1SCCS1 Amb32667432 [1,0,0,1,0,0|2,0,0]=4 3696 B7R1.1 NC[C@@H]1CCCN1 Amb22405933 [1,0,0,1,0,0|2,0,0]=4 3697 B7R1.1 NC[C@@H]1CCCO1 Amb32661832 [1,0,0,1,0,0|1,1,0]=4 3698 B7R1.1 NC[C@@H]1CCCO1 Amb3940181 [1,0,0,1,0,0|1,1,0]=4 3699 B7R1.1 NC[C@H]1CCCN1 Amb2699509 [1,0,0,1,0,0|2,0,0]=4 3700 B7R1.1 NC[C@H]1CCCN1 Amb30584681 [1,0,0,1,0,0|2,0,0]=4 3701 B7R1.1 NC[C@H]1CCCO1 Amb33859030 [1,0,0,1,0,0|1,1,0]=4 3702 B7R1.1 NC[C@H]1CCCO1 Amb3940188 [1,0,0,1,0,0|1,1,0]=4 3703 B7R1.1 O=CC1CCCS1 Amb27214645 [1,0,0,1,0,0|1,0,1]=4 3704 B7R1.1 O=C[C@@H]1CCCS1 Amb28130403 [1,0,0,1,0,0|1,0,1]=4 3705 B7R1.1 OCC1CCCC1 Amb2721271 [1,0,0,1,0,0|2,0,0]=4 3706 B7R1.1 OCC1CCCN1 Amb2237182 [1,0,0,1,0,0|2,0,0]=4 3707 B7R1.1 OCC1CCCO1 Amb3939084 [1,0,0,1,0,0|1,1,0]=4 3708 B7R1.1 OCC1CCCS1 Amb33545363 [1,0,0,1,0,0|1,0,0]=3 3709 B7R1.1 OCC1CCSC1 Amb18203349 [1,0,0,1,0,0|2,0,0]=4 3710 B7R1.1 OCC1NCCS1 Amb25821150 [1,0,0,1,0,0|2,0,0]=4 3711 B7R1.1 OC[C@@H]1CCCN1 Amb22748614 [1,0,0,1,0,0|2,0,0]=4 3712 B7R1.1 OC[C@@H]1CCCN1 Amb3938965 [1,0,0,1,0,0|2,0,0]=4 3713 B7R1.1 OC[C@@H]1CCCO1 Amb10601543 [1,0,0,1,0,0|1,1,0]=4 3714 B7R1.1 OC[C@@H]1OCCS1 Amb22748777 [1,0,0,1,0,0|2,0,0]=4 3715 B7R1.1 OC[C@H]1CCCN1 Amb2235512 [1,0,0,1,0,0|2,0,0]=4 3716 B7R1.1 OC[C@H]1CCCN1 Amb30874072 [1,0,0,1,0,0|2,0,0]=4 3717 B7R1.1 OC[C@H]1CCCO1 Amb16185506 [1,0,0,1,0,0|1,1,0]=4 3718 B7R1.1 SCC1CCCC1 Amb19514712 [1,0,0,1,0,0|2,0,0]=4 3719 B7R1.1 SCC1CCCN1 Amb25874415 [1,0,0,1,0,0|2,0,0]=4 3720 B7R1.1 SCC1CCCN1 Amb35752888 [1,0,0,1,0,0|2,0,0]=4 3721 B7R1.1 SCC1CCCO1 Amb33531279 [1,0,0,1,0,0|1,1,0]=4 3722 B7R1.1 SCC1CCCS1 Amb33416783 [1,0,0,1,0,0|1,0,0]=3 3723 B7R1.1 SCC1CCSC1 Amb32788496 [1,0,0,1,0,0|2,0,0]=4 3724 B7R1.1 SC[C@H]1CCCN1 Amb29854514 [1,0,0,1,0,0|2,0,0]=4 3725 B7R1.1 [C-]#[N+]C1CCCS1 Amb27481891 [1,0,0,1,0,0|1,0,1]=4 3726 B7R1.3 BrC1CCCCC1 Amb3940351 [1,0,0,1,0,0|2,0,0]=4 3727 B7R1.3 BrC1CCCNC1 Amb22497824 [1,0,0,1,0,0|2,0,0]=4 3728 B7R1.3 BrC1CCCNC1 Amb8629039 [1,0,0,1,0,0|2,0,0]=4 3729 B7R1.3 BrC1CCCOC1 Amb9173669 [1,0,0,1,0,0|1,1,0]=4 3730 B7R1.3 BrC1CCCSC1 Amb26545490 [1,0,0,1,0,0|1,0,0]=3 3731 B7R1.3 BrC1CCSCC1 Amb18181050 [1,0,0,1,0,0|2,0,0]=4 3732 B7R1.3 C=C1CCCSC1 Amb22494848 [1,0,0,1,0,0|0,0,2]=4 3733 B7R1.3 CC1C=CCCC1 Amb8515346 [1,0,0,1,0,0|1,0,1]=4 3734 B7R1.3 CC1CC=NCC1 Amb27453017 [1,0,0,1,0,0|2,0,0]=4 3735 B7R1.3 CC1CCCCN1 Amb2792828 [1,0,0,1,0,0|2,0,0]=4 3736 B7R1.3 CC1CCCCO1 Amb4035049 [1,0,0,1,0,0|1,1,0]=4 3737 B7R1.3 CC1CCCCS1 Amb17666899 [1,0,0,1,0,0|1,0,0]=3 3738 B7R1.3 CC1CCCNC1 Amb22491688 [1,0,0,1,0,0|1,0,0]=3 3739 B7R1.3 CC1CCCNC1 Amb9703089 [1,0,0,1,0,0|1,0,0]=3 3740 B7R1.3 CC1CCCOC1 Amb22347806 [1,0,0,1,0,0|0,1,0]=3 3741 B7R1.3 CC1CCNCC1 Amb2689655 [1,0,0,1,0,0|2,0,0]=4 3742 B7R1.3 CC1CCOCC1 Amb22043825 [1,0,0,1,0,0|1,1,0]=4 3743 B7R1.3 CC1CCSCC1 Amb27436849 [1,0,0,1,0,0|1,0,0]=3 3744 B7R1.3 CC1CNCCN1 Amb32666272 [1,0,0,1,0,0|2,0,0]=4 3745 B7R1.3 CC1CNCCN1 Amb9702774 [1,0,0,1,0,0|2,0,0]=4 3746 B7R1.3 CC1CNCCO1 Amb20621613 [1,0,0,1,0,0|2,0,0]=4 3747 B7R1.3 CC1CNCCO1 Amb32666325 [1,0,0,1,0,0|2,0,0]=4 3748 B7R1.3 CC1CNCCO1 Amb9703073 [1,0,0,1,0,0|2,0,0]=4 3749 B7R1.3 CC1CNCCS1 Amb32753223 [1,0,0,1,0,0|2,0,0]=4 3750 B7R1.3 CC1CNCCS1 Amb6683465 [1,0,0,1,0,0|2,0,0]=4 3751 B7R1.3 CC1COCCN1 Amb22728071 [1,0,0,1,0,0|1,1,0]=4 3752 B7R1.3 CC1COCCN1 Amb6740293 [1,0,0,1,0,0|1,1,0]=4 3753 B7R1.3 CC1CSCCN1 Amb9735876 [1,0,0,1,0,0|1,0,0]=3 3754 B7R1.3 CC1SCCCS1 Amb10071965 [1,0,0,1,0,0|2,0,0]=4 3755 B7R1.3 CC1SCCSS1 Amb27488273 [1,0,0,1,0,0|1,0,0]=3 3756 B7R1.3 CN1CCCCC1 Amb8387007 [1,0,0,1,0,0|2,0,0]=4 3757 B7R1.3 CN1CCCNC1 Amb18121429 [1,0,0,1,0,0|2,0,0]=4 3758 B7R1.3 CN1CSCSC1 Amb10552429 [1,0,0,1,0,0|2,0,0]=4 3759 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [1,0,0,1,0,0|2,0,0]=4 3760 B7R1.3 C[C@@H]1CCCCN1 Amb3939006 [1,0,0,1,0,0|2,0,0]=4 3761 B7R1.3 C[C@@H]1CCCNC1 Amb24461444 [1,0,0,1,0,0|1,0,0]=3 3762 B7R1.3 C[C@@H]1CCCNC1 Amb33801279 [1,0,0,1,0,0|1,0,0]=3 3763 B7R1.3 C[C@@H]1CNCCN1 Amb23399598 [1,0,0,1,0,0|2,0,0]=4 3764 B7R1.3 C[C@@H]1CNCCN1 Amb33716484 [1,0,0,1,0,0|2,0,0]=4 3765 B7R1.3 C[C@@H]1CNCCN1 Amb8396882 [1,0,0,1,0,0|2,0,0]=4 3766 B7R1.3 C[C@@H]1CNCCO1 Amb10603219 [1,0,0,1,0,0|2,0,0]=4 3767 B7R1.3 C[C@@H]1CNCCO1 Amb15690754 [1,0,0,1,0,0|2,0,0]=4 3768 B7R1.3 C[C@@H]1CNCCS1 Amb28423156 [1,0,0,1,0,0|2,0,0]=4 3769 B7R1.3 C[C@@H]1CNCCS1 Amb32671471 [1,0,0,1,0,0|2,0,0]=4 3770 B7R1.3 C[C@@H]1COCCN1 Amb10066948 [1,0,0,1,0,0|1,1,0]=4 3771 B7R1.3 C[C@@H]1COCCN1 Amb22169654 [1,0,0,1,0,0|1,1,0]=4 3772 B7R1.3 C[C@@H]1CSCCN1 Amb25241759 [1,0,0,1,0,0|1,0,0]=3 3773 B7R1.3 C[C@H]1CCCCN1 Amb8387006 [1,0,0,1,0,0|2,0,0]=4 3774 B7R1.3 C[C@H]1CCCNC1 Amb22745835 [1,0,0,1,0,0|1,0,0]=3 3775 B7R1.3 C[C@H]1CCCNC1 Amb8387001 [1,0,0,1,0,0|1,0,0]=3 3776 B7R1.3 C[C@H]1CNCCN1 Amb6306665 [1,0,0,1,0,0|2,0,0]=4 3777 B7R1.3 C[C@H]1CNCCO1 Amb10603261 [1,0,0,1,0,0|2,0,0]=4 3778 B7R1.3 C[C@H]1CNCCO1 Amb20241673 [1,0,0,1,0,0|2,0,0]=4 3779 B7R1.3 C[C@H]1CNCCO1 Amb32661569 [1,0,0,1,0,0|2,0,0]=4 3780 B7R1.3 C[C@H]1CNCCO1 Amb34916143 [1,0,0,1,0,0|2,0,0]=4 3781 B7R1.3 C[C@H]1COCCN1 Amb10066947 [1,0,0,1,0,0|1,1,0]=4 3782 B7R1.3 C[C@H]1COCCN1 Amb19516190 [1,0,0,1,0,0|1,1,0]=4 3783 B7R1.3 C[C@H]1CSCCN1 Amb25212371 [1,0,0,1,0,0|1,0,0]=3 3784 B7R1.3 ClC1CCCCC1 Amb3940352 [1,0,0,1,0,0|2,0,0]=4 3785 B7R1.3 ClC1CCCCS1 Amb28123985 [1,0,0,1,0,0|2,0,0]=4 3786 B7R1.3 ClC1CCCOC1 Amb20622589 [1,0,0,1,0,0|1,1,0]=4 3787 B7R1.3 ClC1CSCCS1 Amb27659242 [1,0,0,1,0,0|2,0,0]=4 3788 B7R1.3 ClC1CSCSC1 Amb28385897 [1,0,0,1,0,0|2,0,0]=4 3789 B7R1.3 FC1CCCCC1 Amb2688084 [1,0,0,1,0,0|2,0,0]=4 3790 B7R1.3 FC1CCCNC1 Amb13953137 [1,0,0,1,0,0|2,0,0]=4 3791 B7R1.3 FC1CCCNC1 Amb2688404 [1,0,0,1,0,0|2,0,0]=4 3792 B7R1.3 FC1CCCOC1 Amb24322825 [1,0,0,1,0,0|1,1,0]=4 3793 B7R1.3 FC1CCC[NH2+]C1 Amb22042691 [1,0,0,1,0,0|2,0,0]=4 3794 B7R1.3 F[C@@H]1CCCNC1 Amb20242276 [1,0,0,1,0,0|2,0,0]=4 3795 B7R1.3 F[C@@H]1CCCNC1 Amb27619341 [1,0,0,1,0,0|2,0,0]=4 3796 B7R1.3 F[C@H]1CCCNC1 Amb20242275 [1,0,0,1,0,0|2,0,0]=4 3797 B7R1.3 IC1CCCCC1 Amb6608670 [1,0,0,1,0,0|2,0,0]=4 3798 B7R1.3 IC1CCCNC1 Amb22496356 [1,0,0,1,0,0|2,0,0]=4 3799 B7R1.3 IC1CCCOC1 Amb22831295 [1,0,0,1,0,0|1,1,0]=4 3800 B7R1.3 IC1CCSCC1 Amb2724105 [1,0,0,1,0,0|2,0,0]=4 3801 B7R1.3 NC1CCCCC1 Amb2792843 [1,0,0,1,0,0|2,0,0]=4 3802 B7R1.3 NC1CCCCC1 Amb4035820 [1,0,0,1,0,0|2,0,0]=4 3803 B7R1.3 NC1CCCCC1 Amb6366094 [1,0,0,1,0,0|2,0,0]=4 3804 B7R1.3 NC1CCCCS1 Amb28052869 [1,0,0,1,0,0|2,0,0]=4 3805 B7R1.3 NC1CCCNC1 Amb2694718 [1,0,0,1,0,0|2,0,0]=4 3806 B7R1.3 NC1CCCNC1 Amb2720311 [1,0,0,1,0,0|2,0,0]=4 3807 B7R1.3 NC1CCCNC1 Amb8385620 [1,0,0,1,0,0|2,0,0]=4 3808 B7R1.3 NC1CCCOC1 Amb1091859 [1,0,0,1,0,0|1,1,0]=4 3809 B7R1.3 NC1CCCOC1 Amb19889218 [1,0,0,1,0,0|1,1,0]=4 3810 B7R1.3 NC1CCCSC1 Amb13953228 [1,0,0,1,0,0|1,0,0]=3 3811 B7R1.3 NC1CCCSC1 Amb32660970 [1,0,0,1,0,0|1,0,0]=3 3812 B7R1.3 NC1CCSCC1 Amb13952147 [1,0,0,1,0,0|2,0,0]=4 3813 B7R1.3 NC1CCSCC1 Amb2724106 [1,0,0,1,0,0|2,0,0]=4 3814 B7R1.3 NC1CSCSC1 Amb19148038 [1,0,0,1,0,0|2,0,0]=4 3815 B7R1.3 N[C@@H]1CCCNC1 Amb16233705 [1,0,0,1,0,0|2,0,0]=4 3816 B7R1.3 N[C@@H]1CCCNC1 Amb2695443 [1,0,0,1,0,0|2,0,0]=4 3817 B7R1.3 N[C@@H]1CCCOC1 Amb19516292 [1,0,0,1,0,0|1,1,0]=4 3818 B7R1.3 N[C@@H]1CCCOC1 Amb20241267 [1,0,0,1,0,0|1,1,0]=4 3819 B7R1.3 N[C@H]1CCCNC1 Amb17134809 [1,0,0,1,0,0|2,0,0]=4 3820 B7R1.3 N[C@H]1CCCNC1 Amb2695444 [1,0,0,1,0,0|2,0,0]=4 3821 B7R1.3 N[C@H]1CCCOC1 Amb19516313 [1,0,0,1,0,0|1,1,0]=4 3822 B7R1.3 N[C@H]1CCCOC1 Amb20241266 [1,0,0,1,0,0|1,1,0]=4 3823 B7R1.3 N[C@H]1CCCOC1 Amb34916114 [1,0,0,1,0,0|1,1,0]=4 3824 B7R1.3 O=C1CCCSC1 Amb13952257 [1,0,0,1,0,0|1,0,1]=4 3825 B7R1.3 OC1CCCCC1 Amb4605832 [1,0,0,1,0,0|2,0,0]=4 3826 B7R1.3 OC1CCCNC1 Amb3939221 [1,0,0,1,0,0|2,0,0]=4 3827 B7R1.3 OC1CCCNC1 Amb4036802 [1,0,0,1,0,0|2,0,0]=4 3828 B7R1.3 OC1CCCOC1 Amb16192108 [1,0,0,1,0,0|1,1,0]=4 3829 B7R1.3 OC1CCCSC1 Amb4034626 [1,0,0,1,0,0|1,0,0]=3 3830 B7R1.3 OC1CCSCC1 Amb2610612 [1,0,0,1,0,0|2,0,0]=4 3831 B7R1.3 O[C@@H]1CCCNC1 Amb20241315 [1,0,0,1,0,0|2,0,0]=4 3832 B7R1.3 O[C@@H]1CCCNC1 Amb8628462 [1,0,0,1,0,0|2,0,0]=4 3833 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [1,0,0,1,0,0|1,1,0]=4 3834 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [1,0,0,1,0,0|2,0,0]=4 3835 B7R1.3 O[C@H]1CCCNC1 Amb2688784 [1,0,0,1,0,0|2,0,0]=4 3836 B7R1.3 O[C@H]1CCCOC1 Amb20241306 [1,0,0,1,0,0|1,1,0]=4 3837 B7R1.3 SC1CCCCC1 Amb6608750 [1,0,0,1,0,0|2,0,0]=4 3838 B7R1.3 SC1CCCNC1 Amb22371077 [1,0,0,1,0,0|2,0,0]=4 3839 B7R1.3 SC1CCCNC1 Amb27453630 [1,0,0,1,0,0|2,0,0]=4 3840 B7R1.3 SC1CCCOC1 Amb24066221 [1,0,0,1,0,0|1,1,0]=4 3841 B7R1.3 SC1CCCSC1 Amb27480711 [1,0,0,1,0,0|1,0,0]=3 3842 B7R1.3 SC1CCSCC1 Amb26045860 [1,0,0,1,0,0|2,0,0]=4 3843 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [1,0,0,1,0,0|2,0,0]=4 3844 B7R1.4 BrC1CSCC1Br Amb27423459 [1,0,0,1,0,0|2,0,0]=4 3845 B7R1.4 CC1C=CCC1C Amb27454828 [1,0,0,1,0,0|1,0,1]=4 3846 B7R1.4 CC1CCCC1Br Amb18180261 [1,0,0,1,0,0|2,0,0]=4 3847 B7R1.4 CC1CCCC1C Amb4019559 [1,0,0,1,0,0|1,0,0]=3 3848 B7R1.4 CC1CCCC1Cl Amb27853965 [1,0,0,1,0,0|2,0,0]=4 3849 B7R1.4 CC1CCCC1N Amb33548666 [1,0,0,1,0,0|2,0,0]=4 3850 B7R1.4 CC1CCCC1N Amb9776219 [1,0,0,1,0,0|2,0,0]=4 3851 B7R1.4 CC1CCCC1O Amb22052652 [1,0,0,1,0,0|2,0,0]=4 3852 B7R1.4 CC1CCCC1S Amb26021537 [1,0,0,1,0,0|2,0,0]=4 3853 B7R1.4 CC1CCNC1C Amb18277375 [1,0,0,1,0,0|2,0,0]=4 3854 B7R1.4 CC1CCNC1C Amb20623813 [1,0,0,1,0,0|2,0,0]=4 3855 B7R1.4 CC1CNCC1C Amb18121224 [1,0,0,1,0,0|1,0,0]=3 3856 B7R1.4 CC1CNCC1C Amb19149226 [1,0,0,1,0,0|1,0,0]=3 3857 B7R1.4 CC1CNCC1F Amb27595797 [1,0,0,1,0,0|2,0,0]=4 3858 B7R1.4 CC1CNCC1N Amb24070522 [1,0,0,1,0,0|2,0,0]=4 3859 B7R1.4 CC1CNCC1N Amb32682475 [1,0,0,1,0,0|2,0,0]=4 3860 B7R1.4 CC1CNCC1O Amb22886911 [1,0,0,1,0,0|2,0,0]=4 3861 B7R1.4 CC1CNCC1O Amb25792196 [1,0,0,1,0,0|2,0,0]=4 3862 B7R1.4 CC1COCC1Br Amb35736874 [1,0,0,1,0,0|1,1,0]=4 3863 B7R1.4 CC1COCC1Cl Amb35631934 [1,0,0,1,0,0|1,1,0]=4 3864 B7R1.4 CC1COCC1N Amb26929448 [1,0,0,1,0,0|1,1,0]=4 3865 B7R1.4 CC1COCC1O Amb26864629 [1,0,0,1,0,0|1,1,0]=4 3866 B7R1.4 CC1COCC1S Amb32788669 [1,0,0,1,0,0|1,1,0]=4 3867 B7R1.4 CC1CSCC1=O Amb21964769 [1,0,0,1,0,0|1,0,1]=4 3868 B7R1.4 CC1CSCC1Br Amb27252722 [1,0,0,1,0,0|1,0,0]=3 3869 B7R1.4 CC1CSCC1N Amb18202602 [1,0,0,1,0,0|1,0,0]=3 3870 B7R1.4 CC1CSCC1S Amb24386420 [1,0,0,1,0,0|1,0,0]=3 3871 B7R1.4 CC1SCCC1Cl Amb28144167 [1,0,0,1,0,0|2,0,0]=4 3872 B7R1.4 CC1SCCC1N Amb20623835 [1,0,0,1,0,0|2,0,0]=4 3873 B7R1.4 CC1SCCC1N Amb28827634 [1,0,0,1,0,0|2,0,0]=4 3874 B7R1.4 CC1SCCC1O Amb20623836 [1,0,0,1,0,0|2,0,0]=4 3875 B7R1.4 CC1SCCC1S Amb26335064 [1,0,0,1,0,0|2,0,0]=4 3876 B7R1.4 CC1SCC[C@@H]1O Amb20623838 [1,0,0,1,0,0|2,0,0]=4 3877 B7R1.4 CC1SCC[C@H]1O Amb20623837 [1,0,0,1,0,0|2,0,0]=4 3878 B7R1.4 C[C@@H]1C=CC[C@H]1C Amb25957944 [1,0,0,1,0,0|1,0,1]=4 3879 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb22886234 [1,0,0,1,0,0|2,0,0]=4 3880 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb24540316 [1,0,0,1,0,0|2,0,0]=4 3881 B7R1.4 C[C@@H]1CCC[C@@H]1O Amb22886799 [1,0,0,1,0,0|2,0,0]=4 3882 B7R1.4 C[C@@H]1CCC[C@H]1C Amb22227630 [1,0,0,1,0,0|1,0,0]=3 3883 B7R1.4 C[C@@H]1CCC[C@H]1N Amb27858497 [1,0,0,1,0,0|2,0,0]=4 3884 B7R1.4 C[C@@H]1CCC[C@H]1O Amb8513780 [1,0,0,1,0,0|2,0,0]=4 3885 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [1,0,0,1,0,0|2,0,0]=4 3886 B7R1.4 C[C@@H]1CNC[C@@H]1C Amb22757862 [1,0,0,1,0,0|1,0,0]=3 3887 B7R1.4 C[C@@H]1CNC[C@@H]1F Amb22886189 [1,0,0,1,0,0|2,0,0]=4 3888 B7R1.4 C[C@@H]1CNC[C@@H]1F Amb25947246 [1,0,0,1,0,0|2,0,0]=4 3889 B7R1.4 C[C@@H]1CNC[C@@H]1N Amb25988639 [1,0,0,1,0,0|2,0,0]=4 3890 B7R1.4 C[C@@H]1CNC[C@@H]1O Amb22886215 [1,0,0,1,0,0|2,0,0]=4 3891 B7R1.4 C[C@@H]1CNC[C@H]1C Amb22757861 [1,0,0,1,0,0|1,0,0]=3 3892 B7R1.4 C[C@@H]1CNC[C@H]1O Amb22886846 [1,0,0,1,0,0|2,0,0]=4 3893 B7R1.4 C[C@@H]1CNC[C@H]1O Amb25110287 [1,0,0,1,0,0|2,0,0]=4 3894 B7R1.4 C[C@@H]1COC[C@@H]1O Amb22886816 [1,0,0,1,0,0|1,1,0]=4 3895 B7R1.4 C[C@@H]1COC[C@H]1N Amb24353575 [1,0,0,1,0,0|1,1,0]=4 3896 B7R1.4 C[C@@H]1COC[C@H]1N Amb30869718 [1,0,0,1,0,0|1,1,0]=4 3897 B7R1.4 C[C@@H]1COC[C@H]1O Amb22886616 [1,0,0,1,0,0|1,1,0]=4 3898 B7R1.4 C[C@@H]1CSC[C@@H]1O Amb27422447 [1,0,0,1,0,0|1,0,0]=3 3899 B7R1.4 C[C@@H]1NCC[C@H]1C Amb32412685 [1,0,0,1,0,0|2,0,0]=4 3900 B7R1.4 C[C@@H]1SCC[C@@H]1O Amb28144028 [1,0,0,1,0,0|2,0,0]=4 3901 B7R1.4 C[C@@H]1SCC[C@H]1O Amb27853254 [1,0,0,1,0,0|2,0,0]=4 3902 B7R1.4 C[C@H]1CCC[C@@H]1C Amb25286917 [1,0,0,1,0,0|1,0,0]=3 3903 B7R1.4 C[C@H]1CCC[C@@H]1O Amb10844719 [1,0,0,1,0,0|2,0,0]=4 3904 B7R1.4 C[C@H]1CCC[C@H]1C Amb22230410 [1,0,0,1,0,0|1,0,0]=3 3905 B7R1.4 C[C@H]1CCC[C@H]1I Amb28135188 [1,0,0,1,0,0|2,0,0]=4 3906 B7R1.4 C[C@H]1CCC[C@H]1O Amb26012367 [1,0,0,1,0,0|2,0,0]=4 3907 B7R1.4 C[C@H]1CCN[C@H]1C Amb27879886 [1,0,0,1,0,0|2,0,0]=4 3908 B7R1.4 C[C@H]1CNC[C@@H]1O Amb33805301 [1,0,0,1,0,0|2,0,0]=4 3909 B7R1.4 C[C@H]1CNC[C@H]1N Amb25174297 [1,0,0,1,0,0|2,0,0]=4 3910 B7R1.4 C[C@H]1CNC[C@H]1O Amb27203947 [1,0,0,1,0,0|2,0,0]=4 3911 B7R1.4 C[C@H]1CNC[C@H]1O Amb33871574 [1,0,0,1,0,0|2,0,0]=4 3912 B7R1.4 C[C@H]1COC[C@@H]1N Amb33805302 [1,0,0,1,0,0|1,1,0]=4 3913 B7R1.4 C[C@H]1COC[C@@H]1O Amb24609705 [1,0,0,1,0,0|1,1,0]=4 3914 B7R1.4 C[C@H]1COC[C@H]1N Amb27202968 [1,0,0,1,0,0|1,1,0]=4 3915 B7R1.4 C[C@H]1COC[C@H]1O Amb26400701 [1,0,0,1,0,0|1,1,0]=4 3916 B7R1.4 C[C@H]1CSC[C@H]1N Amb27961505 [1,0,0,1,0,0|1,0,0]=3 3917 B7R1.4 C[C@H]1CSC[C@H]1O Amb27448475 [1,0,0,1,0,0|1,0,0]=3 3918 B7R1.4 C[C@H]1SCC[C@@H]1O Amb27441450 [1,0,0,1,0,0|2,0,0]=4 3919 B7R1.4 Cl[C@@H]1CSC[C@H]1Cl Amb25061457 [1,0,0,1,0,0|2,0,0]=4 3920 B7R1.4 NC1CSCC1F Amb28280927 [1,0,0,1,0,0|2,0,0]=4 3921 B7R1.4 NC1CSCC1O Amb2693597 [1,0,0,1,0,0|2,0,0]=4 3922 B7R1.4 NC1CSCC1O Amb5634210 [1,0,0,1,0,0|2,0,0]=4 3923 B7R1.4 NC1CSCC1O Amb8565080 [1,0,0,1,0,0|2,0,0]=4 3924 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb23482790 [1,0,0,1,0,0|2,0,0]=4 3925 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb532933 [1,0,0,1,0,0|2,0,0]=4 3926 B7R1.4 N[C@@H]1CSC[C@H]1O Amb1099355 [1,0,0,1,0,0|2,0,0]=4 3927 B7R1.4 OC1CSCC1O Amb17593233 [1,0,0,1,0,0|2,0,0]=4 3928 B7R1.4 O[C@@H]1CSC[C@@H]1O Amb28455182 [1,0,0,1,0,0|2,0,0]=4 3929 B7R1.4 O[C@@H]1CSC[C@@H]1S Amb27422639 [1,0,0,1,0,0|2,0,0]=4 3930 B7R1.4 O[C@@H]1CSC[C@H]1S Amb27981741 [1,0,0,1,0,0|2,0,0]=4 3931 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O Amb4269724 [1,0,0,1,0,0|2,0,0]=4 3932 B7R1.5 CC1CC1CCBr Amb26055211 [1,0,0,1,0,0|2,0,0]=4 3933 B7R1.5 CC1CC1CCN Amb27835415 [1,0,0,1,0,0|2,0,0]=4 3934 B7R1.5 CC1CC1CCO Amb25026465 [1,0,0,1,0,0|2,0,0]=4 3935 B7R1.5 CC1CC1CCS Amb33143846 [1,0,0,1,0,0|2,0,0]=4 3936 B7R1.5 CCCC1CC1Cl Amb28193341 [1,0,0,1,0,0|2,0,0]=4 3937 B7R1.5 CCCC1CC1N Amb18523756 [1,0,0,1,0,0|2,0,0]=4 3938 B7R1.5 CCCC1CC1N Amb20623324 [1,0,0,1,0,0|2,0,0]=4 3939 B7R1.5 CCC[C@@H]1C[C@@H]1N Amb34915319 [1,0,0,1,0,0|2,0,0]=4 3940 B7R1.5 CCC[C@@H]1C[C@H]1N Amb27488941 [1,0,0,1,0,0|2,0,0]=4 3941 B7R1.5 CCC[C@@H]1C[C@H]1N Amb33032253 [1,0,0,1,0,0|2,0,0]=4 3942 B7R1.5 CNCC1CC1C Amb35789304 [1,0,0,1,0,0|2,0,0]=4 3943 B7R1.5 CNCC1CC1C Amb8853678 [1,0,0,1,0,0|2,0,0]=4 3944 B7R1.5 CNC[C@@H]1C[C@H]1C Amb27214669 [1,0,0,1,0,0|2,0,0]=4 3945 B7R1.5 C[C@@H]1C[C@@H]1CCBr Amb27454257 [1,0,0,1,0,0|2,0,0]=4 3946 B7R1.5 C[C@@H]1C[C@@H]1CCO Amb26012892 [1,0,0,1,0,0|2,0,0]=4 3947 B7R1.5 C[C@H]1C[C@H]1CCCl Amb27630412 [1,0,0,1,0,0|2,0,0]=4 3948 B7R1.6 BrCCC1CCC1 Amb25930029 [1,0,0,1,0,0|2,0,0]=4 3949 B7R1.6 BrCCN1CCC1 Amb25830678 [1,0,0,1,0,0|2,0,0]=4 3950 B7R1.6 BrCCN1CCC1 Amb33456334 [1,0,0,1,0,0|2,0,0]=4 3951 B7R1.6 CCC=C1CCC1 Amb28120199 [1,0,0,1,0,0|1,0,1]=4 3952 B7R1.6 CCCC1CCN1 Amb33543494 [1,0,0,1,0,0|2,0,0]=4 3953 B7R1.6 CCCC1CCS1 Amb26614197 [1,0,0,1,0,0|1,0,0]=3 3954 B7R1.6 CCCC1CNC1 Amb25297768 [1,0,0,1,0,0|2,0,0]=4 3955 B7R1.6 CCCC1CNC1 Amb33802188 [1,0,0,1,0,0|2,0,0]=4 3956 B7R1.6 CCCC1COC1 Amb27147877 [1,0,0,1,0,0|2,0,0]=4 3957 B7R1.6 CCNC1CCC1 Amb18960935 [1,0,0,1,0,0|2,0,0]=4 3958 B7R1.6 CCNC1CCC1 Amb19515593 [1,0,0,1,0,0|2,0,0]=4 3959 B7R1.6 CCSC1CNC1 Amb22395437 [1,0,0,1,0,0|2,0,0]=4 3960 B7R1.6 CCSC1CNC1 Amb26073964 [1,0,0,1,0,0|2,0,0]=4 3961 B7R1.6 CNCC1CCC1 Amb19373005 [1,0,0,1,0,0|2,0,0]=4 3962 B7R1.6 CNCC1CCC1 Amb9214718 [1,0,0,1,0,0|2,0,0]=4 3963 B7R1.6 ClCCC1CCC1 Amb27831996 [1,0,0,1,0,0|2,0,0]=4 3964 B7R1.6 ClCCN1CCC1 Amb10069966 [1,0,0,1,0,0|2,0,0]=4 3965 B7R1.6 FCCN1CCC1 Amb28280056 [1,0,0,1,0,0|2,0,0]=4 3966 B7R1.6 NCCC1CCC1 Amb19516795 [1,0,0,1,0,0|2,0,0]=4 3967 B7R1.6 NCCC1CCC1 Amb20667967 [1,0,0,1,0,0|2,0,0]=4 3968 B7R1.6 NCCN1CCC1 Amb20622304 [1,0,0,1,0,0|2,0,0]=4 3969 B7R1.6 OCCC1CCC1 Amb33543947 [1,0,0,1,0,0|2,0,0]=4 3970 B7R1.6 OCCN1CCC1 Amb22002602 [1,0,0,1,0,0|2,0,0]=4 3971 B7R1.6 SCCC1CCC1 Amb24581445 [1,0,0,1,0,0|2,0,0]=4 3972 B7R1.7 BrCCCC1CC1 Amb24606733 [1,0,0,1,0,0|2,0,0]=4 3973 B7R1.7 BrCCOC1CC1 Amb32667448 [1,0,0,1,0,0|1,1,0]=4 3974 B7R1.7 CCCCC1CO1 Amb17771532 [1,0,0,1,0,0|2,0,0]=4 3975 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [1,0,0,1,0,0|2,0,0]=4 3976 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [1,0,0,1,0,0|2,0,0]=4 3977 B7R1.7 CCCNC1CC1 Amb1135100 [1,0,0,1,0,0|1,0,0]=3 3978 B7R1.7 CCCNC1CC1 Amb32644830 [1,0,0,1,0,0|1,0,0]=3 3979 B7R1.7 CCNCC1CC1 Amb30584675 [1,0,0,1,0,0|2,0,0]=4 3980 B7R1.7 CCNCC1CC1 Amb6686877 [1,0,0,1,0,0|2,0,0]=4 3981 B7R1.7 CCSCC1CC1 Amb27206075 [1,0,0,1,0,0|1,0,0]=3 3982 B7R1.7 CCSCC1CO1 Amb6680858 [1,0,0,1,0,0|2,0,0]=4 3983 B7R1.7 CCSC[C@@H]1CO1 Amb25721898 [1,0,0,1,0,0|2,0,0]=4 3984 B7R1.7 CCSC[C@H]1CO1 Amb24747272 [1,0,0,1,0,0|2,0,0]=4 3985 B7R1.7 CNCCC1CC1 Amb18979588 [1,0,0,1,0,0|2,0,0]=4 3986 B7R1.7 CNCCC1CC1 Amb33550263 [1,0,0,1,0,0|2,0,0]=4 3987 B7R1.7 COCNC1CC1 Amb22168850 [1,0,0,1,0,0|2,0,0]=4 3988 B7R1.7 CSCCC1CC1 Amb28079007 [1,0,0,1,0,0|2,0,0]=4 3989 B7R1.7 ClCCNC1CC1 Amb17334071 [1,0,0,1,0,0|2,0,0]=4 3990 B7R1.7 ClCCNC1CC1 Amb32664797 [1,0,0,1,0,0|2,0,0]=4 3991 B7R1.7 ClCCOC1CC1 Amb10603117 [1,0,0,1,0,0|1,1,0]=4 3992 B7R1.7 FCCOC1CC1 Amb27436850 [1,0,0,1,0,0|1,1,0]=4 3993 B7R1.7 ICCCC1CC1 Amb35720662 [1,0,0,1,0,0|2,0,0]=4 3994 B7R1.7 NCCCC1CC1 Amb18296303 [1,0,0,1,0,0|2,0,0]=4 3995 B7R1.7 NCCCC1CC1 Amb33548306 [1,0,0,1,0,0|2,0,0]=4 3996 B7R1.7 NCCNC1CC1 Amb13951961 [1,0,0,1,0,0|2,0,0]=4 3997 B7R1.7 NCCOC1CC1 Amb26943548 [1,0,0,1,0,0|1,1,0]=4 3998 B7R1.7 NCCOC1CC1 Amb30584692 [1,0,0,1,0,0|1,1,0]=4 3999 B7R1.7 OCCCC1CC1 Amb19888792 [1,0,0,1,0,0|2,0,0]=4 4000 B7R1.7 OCCNC1CC1 Amb6251502 [1,0,0,1,0,0|2,0,0]=4 4001 B7R1.7 OCCOC1CC1 Amb26852318 [1,0,0,1,0,0|1,1,0]=4 4002 B7R1.7 SCCCC1CC1 Amb28244922 [1,0,0,1,0,0|2,0,0]=4 4003 B7R1.7 SCCNC1CC1 Amb35639655 [1,0,0,1,0,0|2,0,0]=4 4004 B7R1.8 CC1CCC1CBr Amb28076923 [1,0,0,1,0,0|2,0,0]=4 4005 B7R1.8 CC1CCC1CCl Amb28436122 [1,0,0,1,0,0|2,0,0]=4 4006 B7R1.8 CC1CCC1CI Amb27792871 [1,0,0,1,0,0|2,0,0]=4 4007 B7R1.8 CC1CCC1CN Amb23512778 [1,0,0,1,0,0|2,0,0]=4 4008 B7R1.8 CC1CCC1CO Amb23512661 [1,0,0,1,0,0|2,0,0]=4 4009 B7R1.8 CCC1CCC1N Amb28135225 [1,0,0,1,0,0|2,0,0]=4 4010 B7R1.8 CCC1CCC1O Amb27249737 [1,0,0,1,0,0|2,0,0]=4 4011 B7R1.8 CCC1NCC1F Amb27206479 [1,0,0,1,0,0|2,0,0]=4 4012 B7R1.8 CC[C@@H]1CC[C@@H]1O Amb27268529 [1,0,0,1,0,0|2,0,0]=4 4013 B7R1.8 CC[C@@H]1CC[C@H]1O Amb27798172 [1,0,0,1,0,0|2,0,0]=4 4014 B7R1.8 CC[C@@H]1NC[C@@H]1N Amb25102070 [1,0,0,1,0,0|2,0,0]=4 4015 B7R1.8 C[C@@H]1CC[C@@H]1CBr Amb27484113 [1,0,0,1,0,0|2,0,0]=4 4016 B7R1.8 C[C@@H]1CC[C@H]1CBr Amb27424101 [1,0,0,1,0,0|2,0,0]=4 4017 B7R1.8 C[C@H]1CC[C@H]1CBr Amb28429571 [1,0,0,1,0,0|2,0,0]=4 4018 B7R1.8 C[C@H]1CC[C@H]1CCl Amb28387678 [1,0,0,1,0,0|2,0,0]=4 4019 B7R1.8 C[C@H]1CC[C@H]1CO Amb27196739 [1,0,0,1,0,0|2,0,0]=4 4020 B7R1.8 OC[C@H]1SC[C@@H]1O Amb28136441 [1,0,0,1,0,0|2,0,0]=4 4021 B7R1.8 OC[C@H]1SC[C@H]1O Amb27195387 [1,0,0,1,0,0|2,0,0]=4 4022 B7R1.9 CCC1CC1CBr Amb28050452 [1,0,0,1,0,0|2,0,0]=4 4023 B7R1.9 CCC1CC1CC Amb27445028 [1,0,0,1,0,0|1,0,0]=3 4024 B7R1.9 CCC1CC1CN Amb18963643 [1,0,0,1,0,0|2,0,0]=4 4025 B7R1.9 CCC1CC1CN Amb32662776 [1,0,0,1,0,0|2,0,0]=4 4026 B7R1.9 CCC1OC1CBr Amb28385701 [1,0,0,1,0,0|1,1,0]=4 4027 B7R1.9 CCC1OC1CC Amb27407235 [1,0,0,1,0,0|0,1,0]=3 4028 B7R1.9 CC[C@@H]1C[C@@H]1CN Amb34916256 [1,0,0,1,0,0|2,0,0]=4 4029 B7R1.9 CC[C@@H]1C[C@@H]1CO Amb24519658 [1,0,0,1,0,0|2,0,0]=4 4030 B7R1.9 CC[C@@H]1C[C@H]1CBr Amb24545997 [1,0,0,1,0,0|2,0,0]=4 4031 B7R1.9 CC[C@@H]1C[C@H]1CCl Amb28284868 [1,0,0,1,0,0|2,0,0]=4 4032 B7R1.9 CC[C@@H]1C[C@H]1CN Amb26431153 [1,0,0,1,0,0|2,0,0]=4 4033 B7R1.9 CC[C@@H]1C[C@H]1CN Amb28920814 [1,0,0,1,0,0|2,0,0]=4 4034 B7R1.9 CC[C@@H]1C[C@H]1CO Amb24586149 [1,0,0,1,0,0|2,0,0]=4 4035 B7R1.9 CC[C@@H]1O[C@@H]1CO Amb28198173 [1,0,0,1,0,0|1,1,0]=4 4036 B7R1.9 CC[C@H]1C[C@H]1CC Amb27391419 [1,0,0,1,0,0|1,0,0]=3 4037 B7R1.24 C1=CCCCCC1 Amb8515344 [1,0,0,1,0,0|1,0,1]=4 4038 B7R1.24 C1=NCCCCC1 Amb27445210 [1,0,0,1,0,0|1,0,1]=4 4039 B7R1.24 C1CCCNCC1 Amb2792842 [1,0,0,1,0,0|1,0,0]=3 4040 B7R1.24 C1CCCOCC1 Amb22045221 [1,0,0,1,0,0|0,1,0]=3 4041 B7R1.24 C1CCNNCC1 Amb18061998 [1,0,0,1,0,0|2,0,0]=4 4042 B7R1.24 C1CCNOCC1 Amb28769693 [1,0,0,1,0,0|1,1,0]=4 4043 B7R1.24 C1CCSCSC1 Amb22227736 [1,0,0,1,0,0|1,0,0]=3 4044 B7R1.24 C1CNCCNC1 Amb2688726 [1,0,0,1,0,0|2,0,0]=4 4045 B7R1.24 C1CNCCNC1 Amb29844598 [1,0,0,1,0,0|2,0,0]=4 4046 B7R1.24 C1CNCCOC1 Amb19889085 [1,0,0,1,0,0|1,1,0]=4 4047 B7R1.24 C1CNCCOC1 Amb7094907 [1,0,0,1,0,0|1,1,0]=4 4048 B7R1.24 C1CNCCSC1 Amb13951191 [1,0,0,1,0,0|1,0,0]=3 4049 B7R1.24 C1CNCCSC1 Amb9176341 [1,0,0,1,0,0|1,0,0]=3 4050 B7R1.24 C1CSSCCN1 Amb24381772 [1,0,0,1,0,0|1,0,0]=3 4051 B7R1.24 C1CSSCCN1 Amb32674818 [1,0,0,1,0,0|1,0,0]=3 4052 B7R1.24 C1CSSCCO1 Amb10565588 [1,0,0,1,0,0|1,0,0]=3 4053 B7R1.24 C1CSSCCS1 Amb33352020 [1,0,0,1,0,0|1,0,0]=3 4054 B9R1.2 CC1CSCC(CO)O1 Amb27969010 [0,1,0,1,0,0|2,0,0]=4 4055 B9R1.2 CCC1CC(=O)CCS1 Amb27838781 [0,1,0,1,0,0|1,0,1]=4 4056 B9R1.2 CCC1CC(C)CCN1 Amb27263401 [0,1,0,1,0,0|2,0,0]=4 4057 B9R1.2 CCC1CC(Cl)CCO1 Amb28458111 [0,1,0,1,0,0|1,1,0]=4 4058 B9R1.2 CCC1CC(N)CCN1 Amb25320367 [0,1,0,1,0,0|2,0,0]=4 4059 B9R1.2 CCC1CC(N)CCO1 Amb19373927 [0,1,0,1,0,0|1,1,0]=4 4060 B9R1.2 CCC1CC(O)CCO1 Amb24391236 [0,1,0,1,0,0|1,1,0]=4 4061 B9R1.2 CCC1CC(S)CCO1 Amb25724681 [0,1,0,1,0,0|1,1,0]=4 4062 B9R1.2 CCC1CCCC(=O)C1 Amb19335038 [0,1,0,1,0,0|2,0,0]=4 4063 B9R1.2 CCC1CCCC(=O)N1 Amb13883424 [0,1,0,1,0,0|2,0,0]=4 4064 B9R1.2 CCC1CCCC(=O)O1 Amb27242548 [0,1,0,1,0,0|1,1,0]=4 4065 B9R1.2 CCC1CCCC(C)C1 Amb27267046 [0,1,0,1,0,0|2,0,0]=4 4066 B9R1.2 CCC1CCCC(C)N1 Amb25146110 [0,1,0,1,0,0|2,0,0]=4 4067 B9R1.2 CCC1CCCC(N)=N1 Amb27407342 [0,1,0,1,0,0|2,0,0]=4 4068 B9R1.2 CCC1CCCC(N)C1 Amb19374220 [0,1,0,1,0,0|2,0,0]=4 4069 B9R1.2 CCC1CCCC(O)C1 Amb17593352 [0,1,0,1,0,0|2,0,0]=4 4070 B9R1.2 CCC1CCCC(S)C1 Amb25861249 [0,1,0,1,0,0|2,0,0]=4 4071 B9R1.2 CCC1CCCN(N)C1 Amb25974186 [0,1,0,1,0,0|2,0,0]=4 4072 B9R1.2 CCC1CNCC(C)C1 Amb24477764 [0,1,0,1,0,0|2,0,0]=4 4073 B9R1.2 CCC1CNCC(C)N1 Amb26512115 [0,1,0,1,0,0|2,0,0]=4 4074 B9R1.2 CCC1CNCC(C)O1 Amb9028109 [0,1,0,1,0,0|2,0,0]=4 4075 B9R1.2 CCC1CNCC(C)S1 Amb26033062 [0,1,0,1,0,0|2,0,0]=4 4076 B9R1.2 CCC1CNCC(N)C1 Amb33275585 [0,1,0,1,0,0|2,0,0]=4 4077 B9R1.2 CCC1COCC(C)N1 Amb18063152 [0,1,0,1,0,0|1,1,0]=4 4078 B9R1.2 CCC1NC(C)CCO1 Amb33194316 [0,1,0,1,0,0|1,1,0]=4 4079 B9R1.2 CCC1NCCC(C)O1 Amb33193306 [0,1,0,1,0,0|2,0,0]=4 4080 B9R1.2 CCC1NCCC(C)S1 Amb27792488 [0,1,0,1,0,0|2,0,0]=4 4081 B9R1.2 CC[C@@H]1CCC[C@@H](C)N1 Amb27216626 [0,1,0,1,0,0|2,0,0]=4 4082 B9R1.2 CC[C@@H]1CCC[C@@H](O)C1 Amb28319548 [0,1,0,1,0,0|2,0,0]=4 4083 B9R1.2 CC[C@@H]1CCC[C@H](C)N1 Amb24562231 [0,1,0,1,0,0|2,0,0]=4 4084 B9R1.2 CC[C@@H]1CCC[C@H](O)C1 Amb27491475 [0,1,0,1,0,0|2,0,0]=4 4085 B9R1.2 CC[C@@H]1CNC[C@H](C)N1 Amb28904227 [0,1,0,1,0,0|2,0,0]=4 4086 B9R1.2 CC[C@@H]1C[C@@H](O)CCN1 Amb32434781 [0,1,0,1,0,0|2,0,0]=4 4087 B9R1.2 CC[C@@H]1C[C@H](N)CCO1 Amb27248320 [0,1,0,1,0,0|1,1,0]=4 4088 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb27460205 [0,1,0,1,0,0|2,0,0]=4 4089 B9R1.2 CC[C@@H]1C[C@H](O)CCN1 Amb32434779 [0,1,0,1,0,0|2,0,0]=4 4090 B9R1.2 CC[C@H]1CCCC(=O)N1 Amb28049339 [0,1,0,1,0,0|2,0,0]=4 4091 B9R1.2 CC[C@H]1CCCC(O)O1 Amb27180648 [0,1,0,1,0,0|1,1,0]=4 4092 B9R1.2 CC[C@H]1CCC[C@@H](C)N1 Amb32667683 [0,1,0,1,0,0|2,0,0]=4 4093 B9R1.2 CC[C@H]1CCC[C@H](O)C1 Amb28207111 [0,1,0,1,0,0|2,0,0]=4 4094 B9R1.2 CC[C@H]1COC[C@H](C)N1 Amb27781190 [0,1,0,1,0,0|1,1,0]=4 4095 B9R1.2 CC[C@H]1C[C@H](O)CCS1 Amb27451909 [0,1,0,1,0,0|1,0,0]=3 4096 B9R1.2 C[C@H]1CSC[C@@H](CO)O1 Amb27775963 [0,1,0,1,0,0|2,0,0]=4 4097 B9R1.2 N[C@H]1CSC[C@@H](CO)C1 Amb27787680 [0,1,0,1,0,0|2,0,0]=4 4098 B9R1.7 CCCC1=CCC(O)C1 Amb28453475 [0,1,0,1,0,0|2,0,0]=4 4099 B9R1.7 CCCC1=C[C@@H](O)CC1 Amb27424842 [0,1,0,1,0,0|2,0,0]=4 4100 B9R1.7 CCCC1CC(=O)CS1 Amb28132012 [0,1,0,1,0,0|1,0,1]=4 4101 B9R1.7 CCCC1CC(N)CO1 Amb35584876 [0,1,0,1,0,0|1,1,0]=4 4102 B9R1.7 CCCC1CC(O)CO1 Amb35584946 [0,1,0,1,0,0|1,1,0]=4 4103 B9R1.7 CCCC1CCC(Cl)C1 Amb28201166 [0,1,0,1,0,0|2,0,0]=4 4104 B9R1.7 CCCC1CCC(Cl)O1 Amb27424623 [0,1,0,1,0,0|1,1,0]=4 4105 B9R1.7 CCCC1CCC(N)C1 Amb26963448 [0,1,0,1,0,0|2,0,0]=4 4106 B9R1.7 CCCC1CCC(O)O1 Amb27589536 [0,1,0,1,0,0|1,1,0]=4 4107 B9R1.7 CCCC1OCC(C)O1 Amb4017566 [0,1,0,1,0,0|1,1,0]=4 4108 B9R1.7 CCCN1CCC(N)C1 Amb32412600 [0,1,0,1,0,0|2,0,0]=4 4109 B9R1.7 CCCN1CCC(N)C1 Amb8948567 [0,1,0,1,0,0|2,0,0]=4 4110 B9R1.7 CCCN1CCC(S)C1 Amb27251142 [0,1,0,1,0,0|2,0,0]=4 4111 B9R1.7 CCCN1CC[C@@H](N)C1 Amb27838584 [0,1,0,1,0,0|2,0,0]=4 4112 B9R1.7 CCCN1CC[C@H](N)C1 Amb27596602 [0,1,0,1,0,0|2,0,0]=4 4113 B9R1.7 CCC[C@@H]1CC[C@H](C)N1 Amb27473308 [0,1,0,1,0,0|2,0,0]=4 4114 B9R1.7 COCC1NC(C)CS1 Amb27657433 [0,1,0,1,0,0|2,0,0]=4 4115 B9R1.8 BrCCC1CCCCC1 Amb3940145 [0,1,0,1,0,0|2,0,0]=4 4116 B9R1.8 BrCCC1CCCCN1 Amb1102639 [0,1,0,1,0,0|2,0,0]=4 4117 B9R1.8 BrCCC1CCCCN1 Amb22284142 [0,1,0,1,0,0|2,0,0]=4 4118 B9R1.8 BrCCC1CCCCO1 Amb24480305 [0,1,0,1,0,0|1,1,0]=4 4119 B9R1.8 BrCCC1CCCNC1 Amb22274545 [0,1,0,1,0,0|2,0,0]=4 4120 B9R1.8 BrCCC1CCCNC1 Amb32412708 [0,1,0,1,0,0|2,0,0]=4 4121 B9R1.8 BrCCC1CCCOC1 Amb33546512 [0,1,0,1,0,0|1,1,0]=4 4122 B9R1.8 BrCCC1CCCSC1 Amb33008117 [0,1,0,1,0,0|1,0,0]=3 4123 B9R1.8 C#CCC1CCCSC1 Amb32726226 [0,1,0,1,0,0|1,0,1]=4 4124 B9R1.8 C=CC[C@@H]1CCCSC1 Amb28285315 [0,1,0,1,0,0|1,0,1]=4 4125 B9R1.8 CCCC1=NCCCC1 Amb27266018 [0,1,0,1,0,0|2,0,0]=4 4126 B9R1.8 CCCC1=NCCCS1 Amb27830709 [0,1,0,1,0,0|1,0,0]=3 4127 B9R1.8 CCCC1C=CCCC1 Amb27644637 [0,1,0,1,0,0|2,0,0]=4 4128 B9R1.8 CCCC1CCCCC1 Amb22336542 [0,1,0,1,0,0|2,0,0]=4 4129 B9R1.8 CCCC1CCCCN1 Amb2235347 [0,1,0,1,0,0|2,0,0]=4 4130 B9R1.8 CCCC1CCCCN1 Amb33549801 [0,1,0,1,0,0|2,0,0]=4 4131 B9R1.8 CCCC1CCCNC1 Amb18285007 [0,1,0,1,0,0|2,0,0]=4 4132 B9R1.8 CCCC1CCCNC1 Amb33551237 [0,1,0,1,0,0|2,0,0]=4 4133 B9R1.8 CCCC1CCNCC1 Amb10553113 [0,1,0,1,0,0|2,0,0]=4 4134 B9R1.8 CCCC1CCNCC1 Amb33529751 [0,1,0,1,0,0|2,0,0]=4 4135 B9R1.8 CCCC1CNCCN1 Amb20667630 [0,1,0,1,0,0|2,0,0]=4 4136 B9R1.8 CCCC1CNCCO1 Amb22059500 [0,1,0,1,0,0|1,1,0]=4 4137 B9R1.8 CCCC1COCCN1 Amb10607878 [0,1,0,1,0,0|2,0,0]=4 4138 B9R1.8 CCCC1NCCCS1 Amb4032842 [0,1,0,1,0,0|1,0,0]=3 4139 B9R1.8 CCCN1CCCCN1 Amb27783473 [0,1,0,1,0,0|2,0,0]=4 4140 B9R1.8 CCCN1CCCOC1 Amb27628068 [0,1,0,1,0,0|1,1,0]=4 4141 B9R1.8 CCCN1CCNCC1 Amb1995335 [0,1,0,1,0,0|2,0,0]=4 4142 B9R1.8 CCCN1CCNCC1 Amb32427978 [0,1,0,1,0,0|2,0,0]=4 4143 B9R1.8 CCCN1CCNCC1 Amb6366065 [0,1,0,1,0,0|2,0,0]=4 4144 B9R1.8 CCCN1CCNCC1 Amb6609051 [0,1,0,1,0,0|2,0,0]=4 4145 B9R1.8 CCCN1CCOCC1 Amb9787481 [0,1,0,1,0,0|2,0,0]=4 4146 B9R1.8 CCC[C@@H]1CNCCO1 Amb27974093 [0,1,0,1,0,0|1,1,0]=4 4147 B9R1.8 CCC[C@H]1CNCCN1 Amb28067104 [0,1,0,1,0,0|2,0,0]=4 4148 B9R1.8 CCC[C@H]1CNCCO1 Amb28385328 [0,1,0,1,0,0|1,1,0]=4 4149 B9R1.8 CCNC1CCCCC1 Amb3939154 [0,1,0,1,0,0|2,0,0]=4 4150 B9R1.8 CCNC1CCCCC1 Amb532241 [0,1,0,1,0,0|2,0,0]=4 4151 B9R1.8 CCNC1CCCOC1 Amb27837490 [0,1,0,1,0,0|1,1,0]=4 4152 B9R1.8 CCNC1CCCOC1 Amb28934972 [0,1,0,1,0,0|1,1,0]=4 4153 B9R1.8 CCN[C@@H]1CCCNC1 Amb27882911 [0,1,0,1,0,0|2,0,0]=4 4154 B9R1.8 CCOC1CCCCN1 Amb27765495 [0,1,0,1,0,0|2,0,0]=4 4155 B9R1.8 CCOC1CCCCO1 Amb4016388 [0,1,0,1,0,0|1,1,0]=4 4156 B9R1.8 CCOC1CCCNC1 Amb19889821 [0,1,0,1,0,0|2,0,0]=4 4157 B9R1.8 CCOC1CCCNC1 Amb9752811 [0,1,0,1,0,0|2,0,0]=4 4158 B9R1.8 CCO[C@@H]1CCCNC1 Amb24559280 [0,1,0,1,0,0|2,0,0]=4 4159 B9R1.8 CCO[C@H]1CCCNC1 Amb24478793 [0,1,0,1,0,0|2,0,0]=4 4160 B9R1.8 CCSC1CCCNC1 Amb18956223 [0,1,0,1,0,0|2,0,0]=4 4161 B9R1.8 CNCC1CCCCC1 Amb1117772 [0,1,0,1,0,0|2,0,0]=4 4162 B9R1.8 CNCC1CCCCC1 Amb2119455 [0,1,0,1,0,0|2,0,0]=4 4163 B9R1.8 CNCC1CCCCN1 Amb18281799 [0,1,0,1,0,0|2,0,0]=4 4164 B9R1.8 CNCC1CCCCN1 Amb32752949 [0,1,0,1,0,0|2,0,0]=4 4165 B9R1.8 CNCC1CCCCO1 Amb8503254 [0,1,0,1,0,0|1,1,0]=4 4166 B9R1.8 CNCC1CCCCO1 Amb9258705 [0,1,0,1,0,0|1,1,0]=4 4167 B9R1.8 CNCC1CCCCS1 Amb27826766 [0,1,0,1,0,0|1,0,0]=3 4168 B9R1.8 CNCC1CCCNC1 Amb16186636 [0,1,0,1,0,0|2,0,0]=4 4169 B9R1.8 CNCC1CCCNC1 Amb21959752 [0,1,0,1,0,0|2,0,0]=4 4170 B9R1.8 CNCC1CCCOC1 Amb18288267 [0,1,0,1,0,0|1,1,0]=4 4171 B9R1.8 CNCC1CCCOC1 Amb30869456 [0,1,0,1,0,0|1,1,0]=4 4172 B9R1.8 CNCC1CCCSC1 Amb27956471 [0,1,0,1,0,0|1,0,0]=3 4173 B9R1.8 CNCC1CSCCO1 Amb27394771 [0,1,0,1,0,0|2,0,0]=4 4174 B9R1.8 CNCC1CSCCS1 Amb28352315 [0,1,0,1,0,0|2,0,0]=4 4175 B9R1.8 CNC[C@@H]1CCCCN1 Amb24477709 [0,1,0,1,0,0|2,0,0]=4 4176 B9R1.8 CNC[C@@H]1CCCCN1 Amb32660930 [0,1,0,1,0,0|2,0,0]=4 4177 B9R1.8 CNC[C@@H]1CCCNC1 Amb27425112 [0,1,0,1,0,0|2,0,0]=4 4178 B9R1.8 CNC[C@@H]1CCCNC1 Amb32659594 [0,1,0,1,0,0|2,0,0]=4 4179 B9R1.8 CNC[C@H]1CCCCN1 Amb25115403 [0,1,0,1,0,0|2,0,0]=4 4180 B9R1.8 CNC[C@H]1CCCCN1 Amb32671018 [0,1,0,1,0,0|2,0,0]=4 4181 B9R1.8 CNC[C@H]1CCCNC1 Amb27982338 [0,1,0,1,0,0|2,0,0]=4 4182 B9R1.8 CNC[C@H]1CCCNC1 Amb32656286 [0,1,0,1,0,0|2,0,0]=4 4183 B9R1.8 COCC1CCCCC1 Amb27858995 [0,1,0,1,0,0|2,0,0]=4 4184 B9R1.8 COCC1CCCCN1 Amb8503235 [0,1,0,1,0,0|2,0,0]=4 4185 B9R1.8 COCC1CCCCN1 Amb9722134 [0,1,0,1,0,0|2,0,0]=4 4186 B9R1.8 COCC1CCCNC1 Amb2140573 [0,1,0,1,0,0|2,0,0]=4 4187 B9R1.8 COCC1CCCNC1 Amb9719115 [0,1,0,1,0,0|2,0,0]=4 4188 B9R1.8 COCC1CNCCS1 Amb27224153 [0,1,0,1,0,0|2,0,0]=4 4189 B9R1.8 COC[C@@H]1CCCCN1 Amb22748820 [0,1,0,1,0,0|2,0,0]=4 4190 B9R1.8 COC[C@@H]1CCCNC1 Amb34158327 [0,1,0,1,0,0|2,0,0]=4 4191 B9R1.8 COC[C@H]1CCCCN1 Amb33871620 [0,1,0,1,0,0|2,0,0]=4 4192 B9R1.8 COC[C@H]1CCCNC1 Amb34155960 [0,1,0,1,0,0|2,0,0]=4 4193 B9R1.8 CSCC1CCCCN1 Amb2235851 [0,1,0,1,0,0|2,0,0]=4 4194 B9R1.8 CSCC1CCCCN1 Amb2237237 [0,1,0,1,0,0|2,0,0]=4 4195 B9R1.8 CSCC1CCCNC1 Amb17503123 [0,1,0,1,0,0|2,0,0]=4 4196 B9R1.8 CSCC1CCCNC1 Amb21959895 [0,1,0,1,0,0|2,0,0]=4 4197 B9R1.8 ClCCC1C=CCCC1 Amb17672831 [0,1,0,1,0,0|2,0,0]=4 4198 B9R1.8 ClCCC1CCCCC1 Amb9004316 [0,1,0,1,0,0|2,0,0]=4 4199 B9R1.8 ClCCC1CCCCN1 Amb6740274 [0,1,0,1,0,0|2,0,0]=4 4200 B9R1.8 ClCCC1CCCCN1 Amb8629028 [0,1,0,1,0,0|2,0,0]=4 4201 B9R1.8 ClCCC1CCCCO1 Amb27168293 [0,1,0,1,0,0|1,1,0]=4 4202 B9R1.8 ClCCC1CCCNC1 Amb22299848 [0,1,0,1,0,0|2,0,0]=4 4203 B9R1.8 FCCC1CCCCN1 Amb26516169 [0,1,0,1,0,0|2,0,0]=4 4204 B9R1.8 FCCC1CCCNC1 Amb21959219 [0,1,0,1,0,0|2,0,0]=4 4205 B9R1.8 FCCC1CCCNC1 Amb32667207 [0,1,0,1,0,0|2,0,0]=4 4206 B9R1.8 FCCC1CNCCS1 Amb28135752 [0,1,0,1,0,0|2,0,0]=4 4207 B9R1.8 ICCC1CCCCC1 Amb25046814 [0,1,0,1,0,0|2,0,0]=4 4208 B9R1.8 ICCC1CCCCO1 Amb35655392 [0,1,0,1,0,0|1,1,0]=4 4209 B9R1.8 N#CCC1CCCSC1 Amb32726308 [0,1,0,1,0,0|1,0,1]=4 4210 B9R1.8 NCCC1=NCCCS1 Amb28051709 [0,1,0,1,0,0|2,0,0]=4 4211 B9R1.8 NCCC1C=CCCC1 Amb25707655 [0,1,0,1,0,0|2,0,0]=4 4212 B9R1.8 NCCC1CCCCC1 Amb6565256 [0,1,0,1,0,0|2,0,0]=4 4213 B9R1.8 NCCC1CCCCC1 Amb839081 [0,1,0,1,0,0|2,0,0]=4 4214 B9R1.8 NCCC1CCCCN1 Amb16233732 [0,1,0,1,0,0|2,0,0]=4 4215 B9R1.8 NCCC1CCCCO1 Amb10067654 [0,1,0,1,0,0|1,1,0]=4 4216 B9R1.8 NCCC1CCCCO1 Amb2607669 [0,1,0,1,0,0|1,1,0]=4 4217 B9R1.8 NCCC1CCCNC1 Amb16186592 [0,1,0,1,0,0|2,0,0]=4 4218 B9R1.8 NCCC1CCCOC1 Amb10072965 [0,1,0,1,0,0|1,1,0]=4 4219 B9R1.8 NCCC1CCCSC1 Amb18199319 [0,1,0,1,0,0|1,0,0]=3 4220 B9R1.8 NCCC1CSCCN1 Amb18559611 [0,1,0,1,0,0|2,0,0]=4 4221 B9R1.8 NCC[C@H]1CCCCN1 Amb25041454 [0,1,0,1,0,0|2,0,0]=4 4222 B9R1.8 NNCC1CCCCS1 Amb27779017 [0,1,0,1,0,0|2,0,0]=4 4223 B9R1.8 NNCC1CCCSC1 Amb26478878 [0,1,0,1,0,0|2,0,0]=4 4224 B9R1.8 NOCC1CCCSC1 Amb33224513 [0,1,0,1,0,0|2,0,0]=4 4225 B9R1.8 O=CCC1CCCSC1 Amb27433487 [0,1,0,1,0,0|1,0,1]=4 4226 B9R1.8 OCCC1C=CCCC1 Amb17593314 [0,1,0,1,0,0|2,0,0]=4 4227 B9R1.8 OCCC1CCCCC1 Amb3939314 [0,1,0,1,0,0|2,0,0]=4 4228 B9R1.8 OCCC1CCCCN1 Amb22492461 [0,1,0,1,0,0|2,0,0]=4 4229 B9R1.8 OCCC1CCCCN1 Amb9702818 [0,1,0,1,0,0|2,0,0]=4 4230 B9R1.8 OCCC1CCCCO1 Amb5846625 [0,1,0,1,0,0|1,1,0]=4 4231 B9R1.8 OCCC1CCCNC1 Amb19308093 [0,1,0,1,0,0|2,0,0]=4 4232 B9R1.8 OCCC1CCCNC1 Amb2694770 [0,1,0,1,0,0|2,0,0]=4 4233 B9R1.8 OCCC1CCCOC1 Amb33544109 [0,1,0,1,0,0|1,1,0]=4 4234 B9R1.8 OCCC1CCCSC1 Amb18202274 [0,1,0,1,0,0|1,0,0]=3 4235 B9R1.8 OCCC1CSCCN1 Amb20667793 [0,1,0,1,0,0|2,0,0]=4 4236 B9R1.8 OCCC1NCCCS1 Amb27185552 [0,1,0,1,0,0|2,0,0]=4 4237 B9R1.8 OCC[C@@H]1CCCCN1 Amb22168885 [0,1,0,1,0,0|2,0,0]=4 4238 B9R1.8 OCC[C@@H]1CCCCN1 Amb8628480 [0,1,0,1,0,0|2,0,0]=4 4239 B9R1.8 OCC[C@H]1CCCCN1 Amb17619440 [0,1,0,1,0,0|2,0,0]=4 4240 B9R1.8 OCC[C@H]1CCCCN1 Amb33788981 [0,1,0,1,0,0|2,0,0]=4 4241 B9R1.8 OCC[C@H]1CCCNC1 Amb26629279 [0,1,0,1,0,0|2,0,0]=4 4242 B9R1.8 ONCC1CCCSC1 Amb26652449 [0,1,0,1,0,0|2,0,0]=4 4243 B9R1.8 SCCC1CCCCC1 Amb24368740 [0,1,0,1,0,0|2,0,0]=4 4244 B9R1.8 SCCC1CCCCN1 Amb17503520 [0,1,0,1,0,0|2,0,0]=4 4245 B9R1.8 SCCC1CCCCO1 Amb33377389 [0,1,0,1,0,0|1,1,0]=4 4246 B9R1.8 SCCC1CCCNC1 Amb22298478 [0,1,0,1,0,0|2,0,0]=4 4247 B9R1.8 SCCC1CCCOC1 Amb33321789 [0,1,0,1,0,0|1,1,0]=4 4248 B9R1.8 SCCC1CCCSC1 Amb33224506 [0,1,0,1,0,0|1,0,0]=3 4249 B9R1.8 [C-]#[N+]CC1CCCSC1 Amb32726265 [0,1,0,1,0,0|1,0,1]=4 4250 B9R1.9 CCCC=C1CC(N)C1 Amb27476310 [0,1,0,1,0,0|2,0,0]=4 4251 B9R1.9 CCCCC1CC(O)C1 Amb27956599 [0,1,0,1,0,0|2,0,0]=4 4252 B9R1.9 CCCCN1CC(O)C1 Amb27837475 [0,1,0,1,0,0|2,0,0]=4 4253 B9R1.9 CCCC[C@H]1C[C@H](Br)C1 Amb28121167 [0,1,0,1,0,0|2,0,0]=4 4254 B9R1.9 CCCSC1CC(O)C1 Amb32753276 [0,1,0,1,0,0|1,0,0]=3 4255 B9R1.9 CCCS[C@H]1C[C@@H](O)C1 Amb32674541 [0,1,0,1,0,0|1,0,0]=3 4256 B9R1.12 BrCCCC1=CCCC1 Amb24415910 [0,1,0,1,0,0|2,0,0]=4 4257 B9R1.12 BrCCCC1CCCC1 Amb19073227 [0,1,0,1,0,0|2,0,0]=4 4258 B9R1.12 BrCCCC1CCCO1 Amb18324625 [0,1,0,1,0,0|1,1,0]=4 4259 B9R1.12 BrCCCC1CCCS1 Amb32688088 [0,1,0,1,0,0|1,0,0]=3 4260 B9R1.12 BrCCCN1CCCC1 Amb8387805 [0,1,0,1,0,0|2,0,0]=4 4261 B9R1.12 BrCCCN1CCCC1 Amb8387806 [0,1,0,1,0,0|2,0,0]=4 4262 B9R1.12 BrCCC[C@@H]1CCCO1 Amb32688086 [0,1,0,1,0,0|1,1,0]=4 4263 B9R1.12 BrCCC[C@H]1CCCO1 Amb32688084 [0,1,0,1,0,0|1,1,0]=4 4264 B9R1.12 BrCCSC1CCCC1 Amb27219138 [0,1,0,1,0,0|2,0,0]=4 4265 B9R1.12 C#CCCC1CCCS1 Amb33415383 [0,1,0,1,0,0|1,0,1]=4 4266 B9R1.12 CCCCC1=CCCC1 Amb22227915 [0,1,0,1,0,0|2,0,0]=4 4267 B9R1.12 CCCCC1=NCCC1 Amb24053774 [0,1,0,1,0,0|2,0,0]=4 4268 B9R1.12 CCCCC1=NCCS1 Amb26872627 [0,1,0,1,0,0|2,0,0]=4 4269 B9R1.12 CCCCC1CCCC1 Amb22053873 [0,1,0,1,0,0|2,0,0]=4 4270 B9R1.12 CCCCC1CCCN1 Amb22587191 [0,1,0,1,0,0|2,0,0]=4 4271 B9R1.12 CCCCC1CCCN1 Amb9712880 [0,1,0,1,0,0|2,0,0]=4 4272 B9R1.12 CCCCC1CCCO1 Amb25238477 [0,1,0,1,0,0|1,1,0]=4 4273 B9R1.12 CCCCC1CCNC1 Amb2237160 [0,1,0,1,0,0|2,0,0]=4 4274 B9R1.12 CCCCN1CCCC1 Amb8389335 [0,1,0,1,0,0|2,0,0]=4 4275 B9R1.12 CCCCN1CCCN1 Amb27778675 [0,1,0,1,0,0|2,0,0]=4 4276 B9R1.12 CCCCN1CCCO1 Amb28049539 [0,1,0,1,0,0|1,1,0]=4 4277 B9R1.12 CCCCN1CCOC1 Amb27838563 [0,1,0,1,0,0|2,0,0]=4 4278 B9R1.12 CCCCP1CCCC1 Amb28251357 [0,1,0,1,0,0|2,0,0]=4 4279 B9R1.12 CCCCP1CCNC1 Amb27872319 [0,1,0,1,0,0|2,0,0]=4 4280 B9R1.12 CCCNC1CCCC1 Amb2097979 [0,1,0,1,0,0|2,0,0]=4 4281 B9R1.12 CCCNC1CCCC1 Amb6259295 [0,1,0,1,0,0|2,0,0]=4 4282 B9R1.12 CCCN[C@H]1CCNC1 Amb29892385 [0,1,0,1,0,0|2,0,0]=4 4283 B9R1.12 CCCOC1CCNC1 Amb17191402 [0,1,0,1,0,0|1,1,0]=4 4284 B9R1.12 CCCOC1CCNC1 Amb33801509 [0,1,0,1,0,0|1,1,0]=4 4285 B9R1.12 CCCO[C@@H]1CCNC1 Amb26490598 [0,1,0,1,0,0|1,1,0]=4 4286 B9R1.12 CCCO[C@@H]1CCNC1 Amb34912491 [0,1,0,1,0,0|1,1,0]=4 4287 B9R1.12 CCCO[C@H]1CCNC1 Amb22752856 [0,1,0,1,0,0|1,1,0]=4 4288 B9R1.12 CCCO[C@H]1CCNC1 Amb34913934 [0,1,0,1,0,0|1,1,0]=4 4289 B9R1.12 CCCSC1CCNC1 Amb18292979 [0,1,0,1,0,0|1,0,0]=3 4290 B9R1.12 CCNCC1CCCC1 Amb8853714 [0,1,0,1,0,0|2,0,0]=4 4291 B9R1.12 CCNCC1CCCN1 Amb17231855 [0,1,0,1,0,0|2,0,0]=4 4292 B9R1.12 CCNCC1CCCO1 Amb10610065 [0,1,0,1,0,0|1,1,0]=4 4293 B9R1.12 CCNCC1CCCO1 Amb9712607 [0,1,0,1,0,0|1,1,0]=4 4294 B9R1.12 CCNCC1SCCS1 Amb35659030 [0,1,0,1,0,0|2,0,0]=4 4295 B9R1.12 CCNCN1CCCC1 Amb28250778 [0,1,0,1,0,0|2,0,0]=4 4296 B9R1.12 CCNC[C@@H]1CCCN1 Amb27446159 [0,1,0,1,0,0|2,0,0]=4 4297 B9R1.12 CCOCC1CCCN1 Amb10608177 [0,1,0,1,0,0|2,0,0]=4 4298 B9R1.12 CCOCC1CCCO1 Amb4034438 [0,1,0,1,0,0|1,1,0]=4 4299 B9R1.12 CCOC[C@@H]1CCCN1 Amb17061648 [0,1,0,1,0,0|2,0,0]=4 4300 B9R1.12 CCSCC1CCCC1 Amb28285763 [0,1,0,1,0,0|2,0,0]=4 4301 B9R1.12 CCSCC1CCCN1 Amb18985026 [0,1,0,1,0,0|2,0,0]=4 4302 B9R1.12 CCSCC1CCCN1 Amb35745872 [0,1,0,1,0,0|2,0,0]=4 4303 B9R1.12 CCSC[C@@H]1CCCN1 Amb27470265 [0,1,0,1,0,0|2,0,0]=4 4304 B9R1.12 CNCCC1=CCCC1 Amb27603103 [0,1,0,1,0,0|2,0,0]=4 4305 B9R1.12 CNCCC1CCCC1 Amb18523811 [0,1,0,1,0,0|2,0,0]=4 4306 B9R1.12 CNCCC1CCCC1 Amb34913786 [0,1,0,1,0,0|2,0,0]=4 4307 B9R1.12 CNCCC1CCCO1 Amb18300050 [0,1,0,1,0,0|1,1,0]=4 4308 B9R1.12 CNCCC1CCCO1 Amb33553009 [0,1,0,1,0,0|1,1,0]=4 4309 B9R1.12 CNCCC1CCCS1 Amb28198750 [0,1,0,1,0,0|1,0,0]=3 4310 B9R1.12 CNCCC1SCCS1 Amb30025858 [0,1,0,1,0,0|2,0,0]=4 4311 B9R1.12 CNCCN1CCCC1 Amb19115418 [0,1,0,1,0,0|2,0,0]=4 4312 B9R1.12 CNCCN1CCCC1 Amb5493956 [0,1,0,1,0,0|2,0,0]=4 4313 B9R1.12 COCCC1CCCN1 Amb17436678 [0,1,0,1,0,0|2,0,0]=4 4314 B9R1.12 COCCC1SCCS1 Amb27243135 [0,1,0,1,0,0|2,0,0]=4 4315 B9R1.12 COCC[C@@H]1CCCN1 Amb26917553 [0,1,0,1,0,0|2,0,0]=4 4316 B9R1.12 COCSC1=NCCS1 Amb27837674 [0,1,0,1,0,0|2,0,0]=4 4317 B9R1.12 CSCCC1CCCN1 Amb4134987 [0,1,0,1,0,0|2,0,0]=4 4318 B9R1.12 CSCCC1NCCS1 Amb18792524 [0,1,0,1,0,0|2,0,0]=4 4319 B9R1.12 CSCCN1CCCC1 Amb27222532 [0,1,0,1,0,0|2,0,0]=4 4320 B9R1.12 CSCSC1=NCCS1 Amb27810410 [0,1,0,1,0,0|2,0,0]=4 4321 B9R1.12 ClCCCC1=CCCC1 Amb25689736 [0,1,0,1,0,0|2,0,0]=4 4322 B9R1.12 ClCCCC1CCCC1 Amb9004331 [0,1,0,1,0,0|2,0,0]=4 4323 B9R1.12 ClCCCC1CCCO1 Amb27852668 [0,1,0,1,0,0|1,1,0]=4 4324 B9R1.12 ClCCCC1CCCS1 Amb32688087 [0,1,0,1,0,0|1,0,0]=3 4325 B9R1.12 ClCCCN1CCCC1 Amb31308048 [0,1,0,1,0,0|2,0,0]=4 4326 B9R1.12 ClCCCN1CCCC1 Amb8387803 [0,1,0,1,0,0|2,0,0]=4 4327 B9R1.12 ClCCCN1CCCC1 Amb8387804 [0,1,0,1,0,0|2,0,0]=4 4328 B9R1.12 ClCCC[C@@H]1CCCO1 Amb32688085 [0,1,0,1,0,0|1,1,0]=4 4329 B9R1.12 ClCCC[C@H]1CCCO1 Amb32688083 [0,1,0,1,0,0|1,1,0]=4 4330 B9R1.12 ClCCSC1CCCC1 Amb27837448 [0,1,0,1,0,0|2,0,0]=4 4331 B9R1.12 ClCCSC1CCOC1 Amb28370409 [0,1,0,1,0,0|2,0,0]=4 4332 B9R1.12 ClCCSC1CCSC1 Amb35688975 [0,1,0,1,0,0|2,0,0]=4 4333 B9R1.12 FCCCC1CCCN1 Amb27778370 [0,1,0,1,0,0|2,0,0]=4 4334 B9R1.12 ICCCC1CCCC1 Amb27969560 [0,1,0,1,0,0|2,0,0]=4 4335 B9R1.12 ICCCN1CCCC1 Amb25147182 [0,1,0,1,0,0|2,0,0]=4 4336 B9R1.12 ICCCN1CCCC1 Amb33734657 [0,1,0,1,0,0|2,0,0]=4 4337 B9R1.12 N#CCCC1CCCS1 Amb33416219 [0,1,0,1,0,0|1,0,1]=4 4338 B9R1.12 NCCCC1CCCC1 Amb10609767 [0,1,0,1,0,0|2,0,0]=4 4339 B9R1.12 NCCCC1CCCC1 Amb6662634 [0,1,0,1,0,0|2,0,0]=4 4340 B9R1.12 NCCCC1CCCN1 Amb18642686 [0,1,0,1,0,0|2,0,0]=4 4341 B9R1.12 NCCCC1CCCO1 Amb18301442 [0,1,0,1,0,0|1,1,0]=4 4342 B9R1.12 NCCCC1CCCS1 Amb33416228 [0,1,0,1,0,0|1,0,0]=3 4343 B9R1.12 NCCCC1SCCS1 Amb27637636 [0,1,0,1,0,0|2,0,0]=4 4344 B9R1.12 NCCCN1CCCC1 Amb1154419 [0,1,0,1,0,0|2,0,0]=4 4345 B9R1.12 NCCC[C@@H]1CCCO1 Amb33620903 [0,1,0,1,0,0|1,1,0]=4 4346 B9R1.12 NCCC[C@@H]1CCCO1 Amb33747126 [0,1,0,1,0,0|1,1,0]=4 4347 B9R1.12 NCCC[C@H]1CCCO1 Amb33620902 [0,1,0,1,0,0|1,1,0]=4 4348 B9R1.12 NCCC[C@H]1CCCO1 Amb33736454 [0,1,0,1,0,0|1,1,0]=4 4349 B9R1.12 NCCSC1=NCCS1 Amb18251614 [0,1,0,1,0,0|2,0,0]=4 4350 B9R1.12 NCCSC1=NCCS1 Amb32662382 [0,1,0,1,0,0|2,0,0]=4 4351 B9R1.12 NCCSC1CCCC1 Amb19389681 [0,1,0,1,0,0|2,0,0]=4 4352 B9R1.12 NCCSC1CCCC1 Amb6267365 [0,1,0,1,0,0|2,0,0]=4 4353 B9R1.12 NCCSC1CCSC1 Amb29863178 [0,1,0,1,0,0|2,0,0]=4 4354 B9R1.12 NCCSC1NCCS1 Amb28056304 [0,1,0,1,0,0|2,0,0]=4 4355 B9R1.12 NOCCC1CCCS1 Amb33415856 [0,1,0,1,0,0|2,0,0]=4 4356 B9R1.12 O=CCCC1CCCS1 Amb33415402 [0,1,0,1,0,0|1,0,1]=4 4357 B9R1.12 OCCCC1=CCCC1 Amb24457013 [0,1,0,1,0,0|2,0,0]=4 4358 B9R1.12 OCCCC1=NCCC1 Amb24558706 [0,1,0,1,0,0|2,0,0]=4 4359 B9R1.12 OCCCC1CCCC1 Amb3939088 [0,1,0,1,0,0|2,0,0]=4 4360 B9R1.12 OCCCC1CCCN1 Amb8630848 [0,1,0,1,0,0|2,0,0]=4 4361 B9R1.12 OCCCC1CCCO1 Amb17939196 [0,1,0,1,0,0|1,1,0]=4 4362 B9R1.12 OCCCC1CCCS1 Amb33416795 [0,1,0,1,0,0|1,0,0]=3 4363 B9R1.12 OCCCN1CCCC1 Amb8387818 [0,1,0,1,0,0|2,0,0]=4 4364 B9R1.12 OCCC[C@@H]1CCCN1 Amb25145987 [0,1,0,1,0,0|2,0,0]=4 4365 B9R1.12 OCCC[C@@H]1CCCN1 Amb33309673 [0,1,0,1,0,0|2,0,0]=4 4366 B9R1.12 OCCC[C@@H]1CCCO1 Amb27631987 [0,1,0,1,0,0|1,1,0]=4 4367 B9R1.12 OCCC[C@H]1CCCN1 Amb27879933 [0,1,0,1,0,0|2,0,0]=4 4368 B9R1.12 OCCC[C@H]1CCCN1 Amb33309582 [0,1,0,1,0,0|2,0,0]=4 4369 B9R1.12 OCCC[C@H]1CCCO1 Amb27617649 [0,1,0,1,0,0|1,1,0]=4 4370 B9R1.12 OCCSC1=NCCS1 Amb26913368 [0,1,0,1,0,0|2,0,0]=4 4371 B9R1.12 OCCSC1CCCC1 Amb9362979 [0,1,0,1,0,0|2,0,0]=4 4372 B9R1.12 OCCSC1CCNC1 Amb18988573 [0,1,0,1,0,0|2,0,0]=4 4373 B9R1.12 OCCSC1CCSC1 Amb29863338 [0,1,0,1,0,0|2,0,0]=4 4374 B9R1.12 SCCCC1CCCC1 Amb27764782 [0,1,0,1,0,0|2,0,0]=4 4375 B9R1.12 SCCCC1CCCO1 Amb26321954 [0,1,0,1,0,0|1,1,0]=4 4376 B9R1.12 SCCCC1CCCS1 Amb33415368 [0,1,0,1,0,0|1,0,0]=3 4377 B9R1.12 SCCCN1CCCC1 Amb27197407 [0,1,0,1,0,0|2,0,0]=4 4378 B9R1.12 SCCSC1CCCC1 Amb27184805 [0,1,0,1,0,0|2,0,0]=4 4379 B9R1.12 [C-]#[N+]CCC1CCCS1 Amb33415871 [0,1,0,1,0,0|1,0,1]=4 4380 B9R1.15 C=C1CCCCC1CC Amb27952112 [0,1,0,1,0,0|2,0,0]=4 4381 B9R1.15 CC1CC=CCC1CO Amb3939090 [0,1,0,1,0,0|2,0,0]=4 4382 B9R1.15 CC1CCCCC1CBr Amb28458445 [0,1,0,1,0,0|2,0,0]=4 4383 B9R1.15 CC1CCCCC1CN Amb10610368 [0,1,0,1,0,0|2,0,0]=4 4384 B9R1.15 CC1CCCCC1CN Amb8950173 [0,1,0,1,0,0|2,0,0]=4 4385 B9R1.15 CC1CCCCC1CO Amb25804856 [0,1,0,1,0,0|2,0,0]=4 4386 B9R1.15 CC1CCCCC1CS Amb27231870 [0,1,0,1,0,0|2,0,0]=4 4387 B9R1.15 CC1CCNCC1CO Amb24117064 [0,1,0,1,0,0|2,0,0]=4 4388 B9R1.15 CC1CCOCC1CN Amb27607222 [0,1,0,1,0,0|1,1,0]=4 4389 B9R1.15 CC1CNCCC1CN Amb28206827 [0,1,0,1,0,0|2,0,0]=4 4390 B9R1.15 CC1CNCCC1CO Amb27766043 [0,1,0,1,0,0|2,0,0]=4 4391 B9R1.15 CC1COCCC1CN Amb25274303 [0,1,0,1,0,0|1,1,0]=4 4392 B9R1.15 CC1COCCC1CN Amb32652895 [0,1,0,1,0,0|1,1,0]=4 4393 B9R1.15 CC1OCCSC1CN Amb28052761 [0,1,0,1,0,0|2,0,0]=4 4394 B9R1.15 CCC1CCCCC1=O Amb22002104 [0,1,0,1,0,0|2,0,0]=4 4395 B9R1.15 CCC1CCCCC1Br Amb19076564 [0,1,0,1,0,0|2,0,0]=4 4396 B9R1.15 CCC1CCCCC1C Amb22232355 [0,1,0,1,0,0|2,0,0]=4 4397 B9R1.15 CCC1CCCCC1Cl Amb27751430 [0,1,0,1,0,0|2,0,0]=4 4398 B9R1.15 CCC1CCCCC1N Amb9776218 [0,1,0,1,0,0|2,0,0]=4 4399 B9R1.15 CCC1CCCCC1O Amb6608702 [0,1,0,1,0,0|2,0,0]=4 4400 B9R1.15 CCC1CCCCC1S Amb25360773 [0,1,0,1,0,0|2,0,0]=4 4401 B9R1.15 CCC1CCCCN1N Amb836844 [0,1,0,1,0,0|2,0,0]=4 4402 B9R1.15 CCC1CCCCN1O Amb27483076 [0,1,0,1,0,0|2,0,0]=4 4403 B9R1.15 CCC1CCCNC1=N Amb27252267 [0,1,0,1,0,0|2,0,0]=4 4404 B9R1.15 CCC1CCCNC1=O Amb22276357 [0,1,0,1,0,0|2,0,0]=4 4405 B9R1.15 CCC1CCCNC1C Amb25727319 [0,1,0,1,0,0|2,0,0]=4 4406 B9R1.15 CCC1CCNCC1C Amb28287502 [0,1,0,1,0,0|2,0,0]=4 4407 B9R1.15 CCC1CNCCC1C Amb18642547 [0,1,0,1,0,0|2,0,0]=4 4408 B9R1.15 CCC1CNCCC1F Amb27634236 [0,1,0,1,0,0|2,0,0]=4 4409 B9R1.15 CCC1CNCCC1N Amb24101086 [0,1,0,1,0,0|2,0,0]=4 4410 B9R1.15 CCC1CNCCN1C Amb10607749 [0,1,0,1,0,0|2,0,0]=4 4411 B9R1.15 CCC1CNCCN1C Amb22587615 [0,1,0,1,0,0|2,0,0]=4 4412 B9R1.15 CCC1NCCCC1C Amb6259877 [0,1,0,1,0,0|2,0,0]=4 4413 B9R1.15 CCC1NCCCC1N Amb33275583 [0,1,0,1,0,0|2,0,0]=4 4414 B9R1.15 CCC1NCCNC1C Amb27607606 [0,1,0,1,0,0|2,0,0]=4 4415 B9R1.15 CCC1OCCCC1Br Amb27490966 [0,1,0,1,0,0|1,1,0]=4 4416 B9R1.15 CCC1OCCNC1C Amb9004253 [0,1,0,1,0,0|1,1,0]=4 4417 B9R1.15 CCN1CCNCC1C Amb2694472 [0,1,0,1,0,0|2,0,0]=4 4418 B9R1.15 CCN1CCNC[C@@H]1C Amb25774363 [0,1,0,1,0,0|2,0,0]=4 4419 B9R1.15 CCN1CCNC[C@H]1C Amb26491936 [0,1,0,1,0,0|2,0,0]=4 4420 B9R1.15 CCN1CCNC[C@H]1C Amb34912507 [0,1,0,1,0,0|2,0,0]=4 4421 B9R1.15 CC[C@@H]1C=CCC[C@H]1O Amb27632001 [0,1,0,1,0,0|2,0,0]=4 4422 B9R1.15 CC[C@@H]1CCCCC1=O Amb25706912 [0,1,0,1,0,0|2,0,0]=4 4423 B9R1.15 CC[C@@H]1CCCC[C@@H]1N Amb27438938 [0,1,0,1,0,0|2,0,0]=4 4424 B9R1.15 CC[C@@H]1CCCC[C@H]1O Amb24671850 [0,1,0,1,0,0|2,0,0]=4 4425 B9R1.15 CC[C@@H]1CCCNC1=O Amb28436118 [0,1,0,1,0,0|2,0,0]=4 4426 B9R1.15 CC[C@@H]1CCCOC1=O Amb26601602 [0,1,0,1,0,0|1,1,0]=4 4427 B9R1.15 CC[C@@H]1CNCCN1C Amb22587563 [0,1,0,1,0,0|2,0,0]=4 4428 B9R1.15 CC[C@@H]1CNCCN1C Amb23385293 [0,1,0,1,0,0|2,0,0]=4 4429 B9R1.15 CC[C@@H]1COCC[C@@H]1Br Amb27632469 [0,1,0,1,0,0|1,1,0]=4 4430 B9R1.15 CC[C@H]1CCCCC1N Amb27412189 [0,1,0,1,0,0|2,0,0]=4 4431 B9R1.15 CC[C@H]1CCCCN1Cl Amb27653574 [0,1,0,1,0,0|2,0,0]=4 4432 B9R1.15 CC[C@H]1CCCC[C@@H]1C Amb25911410 [0,1,0,1,0,0|2,0,0]=4 4433 B9R1.15 CC[C@H]1CCCC[C@@H]1O Amb27852810 [0,1,0,1,0,0|2,0,0]=4 4434 B9R1.15 CC[C@H]1CCCC[C@H]1C Amb25294655 [0,1,0,1,0,0|2,0,0]=4 4435 B9R1.15 CC[C@H]1CCCC[C@H]1N Amb27848812 [0,1,0,1,0,0|2,0,0]=4 4436 B9R1.15 CC[C@H]1CCCC[C@H]1O Amb28061782 [0,1,0,1,0,0|2,0,0]=4 4437 B9R1.15 CC[C@H]1CCCOC1=O Amb24477860 [0,1,0,1,0,0|1,1,0]=4 4438 B9R1.15 CC[C@H]1CNCCN1C Amb23385284 [0,1,0,1,0,0|2,0,0]=4 4439 B9R1.15 CN1CCSCC1CCl Amb27781921 [0,1,0,1,0,0|2,0,0]=4 4440 B9R1.15 CNC1CCCCC1C Amb1116060 [0,1,0,1,0,0|2,0,0]=4 4441 B9R1.15 CNC1CCCCC1C Amb6239354 [0,1,0,1,0,0|2,0,0]=4 4442 B9R1.15 CNC1CCNCC1C Amb24376691 [0,1,0,1,0,0|2,0,0]=4 4443 B9R1.15 CNC1CCOCC1C Amb22301329 [0,1,0,1,0,0|1,1,0]=4 4444 B9R1.15 CNC1CCSCC1C Amb27792108 [0,1,0,1,0,0|1,0,0]=3 4445 B9R1.15 CN[C@@H]1CCCC[C@@H]1C Amb25742534 [0,1,0,1,0,0|2,0,0]=4 4446 B9R1.15 CN[C@@H]1CNCC[C@@H]1C Amb27645757 [0,1,0,1,0,0|2,0,0]=4 4447 B9R1.15 CN[C@H]1CCCC[C@@H]1C Amb27195019 [0,1,0,1,0,0|2,0,0]=4 4448 B9R1.15 CN[C@H]1CNCC[C@H]1C Amb26564267 [0,1,0,1,0,0|2,0,0]=4 4449 B9R1.15 COC1CCNCC1C Amb22755833 [0,1,0,1,0,0|2,0,0]=4 4450 B9R1.15 COC1CCNCC1C Amb28934978 [0,1,0,1,0,0|2,0,0]=4 4451 B9R1.15 COC1CNCCC1C Amb25889761 [0,1,0,1,0,0|2,0,0]=4 4452 B9R1.15 COC1CNCCC1C Amb32758728 [0,1,0,1,0,0|2,0,0]=4 4453 B9R1.15 CO[C@@H]1CNCC[C@H]1C Amb33456121 [0,1,0,1,0,0|2,0,0]=4 4454 B9R1.15 CO[C@@H]1CNCC[C@H]1C Amb33621064 [0,1,0,1,0,0|2,0,0]=4 4455 B9R1.15 CO[C@@H]1CSSC[C@H]1O Amb27446137 [0,1,0,1,0,0|1,0,0]=3 4456 B9R1.15 C[C@@H]1CCCC[C@H]1CO Amb27205665 [0,1,0,1,0,0|2,0,0]=4 4457 B9R1.15 C[C@H]1CC=CC[C@@H]1CO Amb27853895 [0,1,0,1,0,0|2,0,0]=4 4458 B9R1.15 C[C@H]1CC=CC[C@H]1CO Amb27422301 [0,1,0,1,0,0|2,0,0]=4 4459 B9R1.15 C[C@H]1CCCC[C@H]1CO Amb28250858 [0,1,0,1,0,0|2,0,0]=4 4460 B9R1.15 C[C@H]1COCC[C@@H]1CN Amb27784540 [0,1,0,1,0,0|1,1,0]=4 4461 B9R1.15 NCC1CSCCC1O Amb18202213 [0,1,0,1,0,0|2,0,0]=4 4462 B9R1.15 OC1CCSCC1CBr Amb28133902 [0,1,0,1,0,0|2,0,0]=4 4463 B9R1.15 OCC1CSCC[C@@H]1O Amb27806578 [0,1,0,1,0,0|2,0,0]=4 4464 B9R1.18 CCCC1CC1NCC Amb28367904 [0,1,0,1,0,0|2,0,0]=4 4465 B9R1.18 CCCC1OC1CCO Amb28455016 [0,1,0,1,0,0|1,1,0]=4 4466 B9R1.18 CCC[C@H]1O[C@H]1CCO Amb27667122 [0,1,0,1,0,0|1,1,0]=4 4467 B9R1.20 CCC1CC1CCCO Amb32951059 [0,1,0,1,0,0|2,0,0]=4 4468 B9R1.20 CCC1OC1CCOC Amb27433793 [0,1,0,1,0,0|1,1,0]=4 4469 B9R1.20 CCCCC1CC1CN Amb33428098 [0,1,0,1,0,0|2,0,0]=4 4470 B9R1.20 CCCC[C@@H]1C[C@H]1CN Amb33428099 [0,1,0,1,0,0|2,0,0]=4 4471 B9R1.20 CCCC[C@@H]1C[C@H]1CO Amb27857307 [0,1,0,1,0,0|2,0,0]=4 4472 B9R1.20 CCCC[C@H]1C[C@@H]1CO Amb27457988 [0,1,0,1,0,0|2,0,0]=4 4473 B9R1.20 CCC\C=C1\CC1CO Amb27858002 [0,1,0,1,0,0|2,0,0]=4 4474 B9R1.20 CCNCC1CC1CC Amb18523852 [0,1,0,1,0,0|2,0,0]=4 4475 B9R1.20 CC[C@@H]1C[C@H]1CCCO Amb33213083 [0,1,0,1,0,0|2,0,0]=4 4476 B9R1.22 CCC1NC(=N)CC1C Amb27221739 [0,1,0,1,0,0|2,0,0]=4 4477 B9R1.22 CCC1NC(=O)CC1C Amb24578188 [0,1,0,1,0,0|2,0,0]=4 4478 B9R1.22 CCC1OC(O)CC1C Amb27792433 [0,1,0,1,0,0|1,1,0]=4 4479 B9R1.22 CCC1SC(C)=NC1C Amb24716975 [0,1,0,1,0,0|2,0,0]=4 4480 B9R1.22 CC[C@H]1OC(O)C[C@@H]1C Amb27775528 [0,1,0,1,0,0|1,1,0]=4 4481 B9R1.27 CCC1C(C)CNC1C Amb4016498 [0,1,0,1,0,0|2,0,0]=4 4482 B9R1.27 CC[C@@H]1C(=O)CC[C@H]1C Amb27256164 [0,1,0,1,0,0|2,0,0]=4 4483 B9R1.27 CC[C@H]1C(Br)=CC[C@@H]1C Amb25175093 [0,1,0,1,0,0|2,0,0]=4 4484 B9R1.33 CC1CCNC1CCO Amb25865855 [0,1,0,1,0,0|2,0,0]=4 4485 B9R1.33 CC1CCOC1CCBr Amb33742803 [0,1,0,1,0,0|1,1,0]=4 4486 B9R1.33 CC1CCOC1CCN Amb33329020 [0,1,0,1,0,0|1,1,0]=4 4487 B9R1.33 CC1CCOC1CCO Amb33741891 [0,1,0,1,0,0|1,1,0]=4 4488 B9R1.33 CC1COCC1CCN Amb35635553 [0,1,0,1,0,0|1,1,0]=4 4489 B9R1.33 CC1NCSC1CCO Amb27185591 [0,1,0,1,0,0|2,0,0]=4 4490 B9R1.33 CCCC1CCCC1=O Amb8503562 [0,1,0,1,0,0|2,0,0]=4 4491 B9R1.33 CCCC1CCCC1N Amb18954322 [0,1,0,1,0,0|2,0,0]=4 4492 B9R1.33 CCCC1CCCC1O Amb26922499 [0,1,0,1,0,0|2,0,0]=4 4493 B9R1.33 CCCC1CCCN1N Amb25700027 [0,1,0,1,0,0|2,0,0]=4 4494 B9R1.33 CCCC1CCNC1C Amb18961055 [0,1,0,1,0,0|2,0,0]=4 4495 B9R1.33 CCCC1CNCC1C Amb27856203 [0,1,0,1,0,0|2,0,0]=4 4496 B9R1.33 CCCC1CSCC1Br Amb27656182 [0,1,0,1,0,0|2,0,0]=4 4497 B9R1.33 CCCC1NCCC1F Amb28053585 [0,1,0,1,0,0|2,0,0]=4 4498 B9R1.33 CCCC1OCCC1Cl Amb28320772 [0,1,0,1,0,0|1,1,0]=4 4499 B9R1.33 CCCC1SCCC1O Amb27171321 [0,1,0,1,0,0|1,0,0]=3 4500 B9R1.33 CCCN1CCCC1=O Amb15691721 [0,1,0,1,0,0|2,0,0]=4 4501 B9R1.33 CCC[C@@H]1CCCC1=O Amb28054357 [0,1,0,1,0,0|2,0,0]=4 4502 B9R1.33 CCC[C@@H]1CCC[C@H]1O Amb24519919 [0,1,0,1,0,0|2,0,0]=4 4503 B9R1.33 CCC[C@@H]1OCC[C@H]1Cl Amb27626973 [0,1,0,1,0,0|1,1,0]=4 4504 B9R1.33 CCC[C@@H]1SCC[C@@H]1O Amb27443600 [0,1,0,1,0,0|1,0,0]=3 4505 B9R1.33 CCC[C@@H]1SCC[C@H]1O Amb28206535 [0,1,0,1,0,0|1,0,0]=3 4506 B9R1.33 CCNC1COCC1C Amb35632011 [0,1,0,1,0,0|1,1,0]=4 4507 B9R1.33 CNCC1CNCC1C Amb27946471 [0,1,0,1,0,0|2,0,0]=4 4508 B9R1.33 CNCC1COCC1C Amb35635594 [0,1,0,1,0,0|1,1,0]=4 4509 B9R1.33 COCC1CNCC1C Amb29083431 [0,1,0,1,0,0|2,0,0]=4 4510 B9R1.33 CONC1CSCC1C Amb28313408 [0,1,0,1,0,0|2,0,0]=4 4511 B9R1.33 CSC[C@@H]1NCC[C@@H]1C Amb27216180 [0,1,0,1,0,0|2,0,0]=4 4512 B9R1.33 CSC[C@@H]1NCC[C@H]1C Amb28423462 [0,1,0,1,0,0|2,0,0]=4 4513 B9R1.33 C[C@@H]1CCC[C@H]1CCO Amb27207721 [0,1,0,1,0,0|2,0,0]=4 4514 B9R1.33 C[C@@H]1CCO[C@@H]1CCN Amb33483077 [0,1,0,1,0,0|1,1,0]=4 4515 B9R1.33 OCCC1CSCC1O Amb27663939 [0,1,0,1,0,0|2,0,0]=4 4516 B9R1.48 CC1CCCCC(=O)C1 Amb17593325 [0,1,0,1,0,0|2,0,0]=4 4517 B9R1.48 CC1CCCCC(Br)C1 Amb27640824 [0,1,0,1,0,0|2,0,0]=4 4518 B9R1.48 CC1CCCCC(C)N1 Amb27859477 [0,1,0,1,0,0|2,0,0]=4 4519 B9R1.48 CC1CCCCC(O)C1 Amb28051128 [0,1,0,1,0,0|2,0,0]=4 4520 B9R1.48 CC1CCCCN(C)C1 Amb27211471 [0,1,0,1,0,0|2,0,0]=4 4521 B9R1.48 CC1CCCNC(=O)C1 Amb28364919 [0,1,0,1,0,0|2,0,0]=4 4522 B9R1.48 CC1CCCSC(N)=N1 Amb27950002 [0,1,0,1,0,0|2,0,0]=4 4523 B9R1.48 CC1CCNCC(C)C1 Amb20622727 [0,1,0,1,0,0|2,0,0]=4 4524 B9R1.48 CC1CCNCC(C)O1 Amb32666605 [0,1,0,1,0,0|2,0,0]=4 4525 B9R1.48 CC1CCOCC(C)N1 Amb27812547 [0,1,0,1,0,0|1,1,0]=4 4526 B9R1.48 CC1CCSCC(C)N1 Amb28124099 [0,1,0,1,0,0|1,0,0]=3 4527 B9R1.48 C[C@@H]1CCCCC(=O)C1 Amb26030783 [0,1,0,1,0,0|2,0,0]=4 4528 B9R1.48 C[C@@H]1CCCNC(=O)C1 Amb28241573 [0,1,0,1,0,0|2,0,0]=4 4529 B9R1.48 C[C@@H]1CCNC[C@H](C)C1 Amb35746843 [0,1,0,1,0,0|2,0,0]=4 4530 B9R1.48 C[C@H]1CCCNC(=O)C1 Amb27174761 [0,1,0,1,0,0|2,0,0]=4 4531 B9R1.48 C[C@H]1CCNC[C@@H](C)O1 Amb32667163 [0,1,0,1,0,0|2,0,0]=4 4532 B9R1.49 C=C1CCCC(C)CC1 Amb22364866 [0,1,0,1,0,0|2,0,0]=4 4533 B9R1.49 CC1CCCC(=O)CC1 Amb27265770 [0,1,0,1,0,0|2,0,0]=4 4534 B9R1.49 CC1CCCC(C)NC1 Amb19148123 [0,1,0,1,0,0|2,0,0]=4 4535 B9R1.49 CC1CCCC(Cl)CC1 Amb27860130 [0,1,0,1,0,0|2,0,0]=4 4536 B9R1.49 CC1CCCC(N)CC1 Amb25178098 [0,1,0,1,0,0|2,0,0]=4 4537 B9R1.49 CC1CCCC(O)CC1 Amb25146901 [0,1,0,1,0,0|2,0,0]=4 4538 B9R1.49 CC1CCCC(S)CC1 Amb26326403 [0,1,0,1,0,0|2,0,0]=4 4539 B9R1.49 CC1CCCN(C)CC1 Amb27837612 [0,1,0,1,0,0|2,0,0]=4 4540 B9R1.49 CC1CCCN(N)CC1 Amb27424632 [0,1,0,1,0,0|2,0,0]=4 4541 B9R1.49 C[C@@H]1CC=C[C@@H](Cl)CC1 Amb27472012 [0,1,0,1,0,0|2,0,0]=4 4542 B9R1.49 C[C@@H]1CC=C[C@H](Cl)CC1 Amb27232720 [0,1,0,1,0,0|2,0,0]=4 4543 B9R1.49 C[C@@H]1CCCC(=O)CC1 Amb26483475 [0,1,0,1,0,0|2,0,0]=4 4544 B9R1.49 C[C@@H]1CCCC(=O)NC1 Amb27814970 [0,1,0,1,0,0|2,0,0]=4 4545 B9R1.49 C[C@H]1CCCC(=O)CC1 Amb28199901 [0,1,0,1,0,0|2,0,0]=4 4546 B9R1.49 C[C@H]1CCC[C@@H](O)CC1 Amb27661374 [0,1,0,1,0,0|2,0,0]=4 4547 B9R1.49 C[C@H]1CCC[C@H](O)CC1 Amb27220545 [0,1,0,1,0,0|2,0,0]=4 4548 B9R1.49 OC1CCC(O)CSC1 Amb25316350 [0,1,0,1,0,0|2,0,0]=4 4549 B9R1.49 O[C@H]1CC[C@H](O)CSC1 Amb27220536 [0,1,0,1,0,0|2,0,0]=4 4550 B9R1.50 BrC1=CCCCCCC1 Amb23590920 [0,1,0,1,0,0|2,0,0]=4 4551 B9R1.50 BrC1C=CCCCCC1 Amb24480205 [0,1,0,1,0,0|2,0,0]=4 4552 B9R1.50 BrC1CCC=CCCC1 Amb24355370 [0,1,0,1,0,0|2,0,0]=4 4553 B9R1.50 BrC1CCCCCCC1 Amb6366088 [0,1,0,1,0,0|2,0,0]=4 4554 B9R1.50 CC1CCCCCCC1 Amb22230834 [0,1,0,1,0,0|2,0,0]=4 4555 B9R1.50 CC1CCCCCCN1 Amb26579162 [0,1,0,1,0,0|2,0,0]=4 4556 B9R1.50 CC1CCNCCCN1 Amb18832588 [0,1,0,1,0,0|2,0,0]=4 4557 B9R1.50 CC1CNCCCCN1 Amb28067733 [0,1,0,1,0,0|2,0,0]=4 4558 B9R1.50 CN1CCCCCCC1 Amb26406289 [0,1,0,1,0,0|2,0,0]=4 4559 B9R1.50 CN1CCCNCCC1 Amb18276963 [0,1,0,1,0,0|2,0,0]=4 4560 B9R1.50 CN1CCCNCCC1 Amb33483191 [0,1,0,1,0,0|2,0,0]=4 4561 B9R1.50 ClC1C=CCCCCC1 Amb27484094 [0,1,0,1,0,0|2,0,0]=4 4562 B9R1.50 ClC1CCC=CCCC1 Amb28118846 [0,1,0,1,0,0|2,0,0]=4 4563 B9R1.50 ClC1CCCCCCC1 Amb4018627 [0,1,0,1,0,0|2,0,0]=4 4564 B9R1.50 ClC1CCCCOCC1 Amb27984820 [0,1,0,1,0,0|1,1,0]=4 4565 B9R1.50 NC1C=CCCCCC1 Amb22410845 [0,1,0,1,0,0|2,0,0]=4 4566 B9R1.50 NC1C=CCCCCC1 Amb32652668 [0,1,0,1,0,0|2,0,0]=4 4567 B9R1.50 NC1CCC=CCCC1 Amb27814669 [0,1,0,1,0,0|2,0,0]=4 4568 B9R1.50 NC1CCC=CCCC1 Amb33307000 [0,1,0,1,0,0|2,0,0]=4 4569 B9R1.50 NC1CCCCCCC1 Amb2720323 [0,1,0,1,0,0|2,0,0]=4 4570 B9R1.50 NC1CCCCCNC1 Amb24447204 [0,1,0,1,0,0|2,0,0]=4 4571 B9R1.50 NC1CCCCCNC1 Amb32686531 [0,1,0,1,0,0|2,0,0]=4 4572 B9R1.50 NN1CCCCCCC1 Amb27203446 [0,1,0,1,0,0|2,0,0]=4 4573 B9R1.50 N[C@@H]1C=CCCCCC1 Amb27423065 [0,1,0,1,0,0|2,0,0]=4 4574 B9R1.50 O=C1CCCCCCC1 Amb2721546 [0,1,0,1,0,0|2,0,0]=4 4575 B9R1.50 O=C1CCCCCCN1 Amb2780498 [0,1,0,1,0,0|2,0,0]=4 4576 B9R1.50 O=C1CCCCCCO1 Amb27468239 [0,1,0,1,0,0|1,1,0]=4 4577 B9R1.50 O=C1CCCSCCC1 Amb17593637 [0,1,0,1,0,0|1,0,1]=4 4578 B9R1.50 OC1C=CCCCCC1 Amb22364937 [0,1,0,1,0,0|2,0,0]=4 4579 B9R1.50 OC1CC#CCCCC1 Amb27956638 [0,1,0,1,0,0|2,0,0]=4 4580 B9R1.50 OC1CCC=CCCC1 Amb21858009 [0,1,0,1,0,0|2,0,0]=4 4581 B9R1.50 OC1CCCCCCC1 Amb6608643 [0,1,0,1,0,0|2,0,0]=4 4582 B9R1.50 OC1CCCCCCO1 Amb27970488 [0,1,0,1,0,0|1,1,0]=4 4583 B9R1.50 OC1CCCCCOC1 Amb22364795 [0,1,0,1,0,0|1,1,0]=4 4584 B9R1.50 OC1CCCCSCC1 Amb28315547 [0,1,0,1,0,0|1,0,0]=3 4585 B9R1.50 OC1CSCCCSC1 Amb9799330 [0,1,0,1,0,0|2,0,0]=4 4586 B9R1.50 O[C@@H]1C=CCCCCC1 Amb27826413 [0,1,0,1,0,0|2,0,0]=4 4587 B9R1.50 O[C@@H]1CCC=CCCC1 Amb25781269 [0,1,0,1,0,0|2,0,0]=4 4588 B9R1.50 O[C@H]1CCC=CCCC1 Amb24481888 [0,1,0,1,0,0|2,0,0]=4 4589 B9R1.50 SC1CCCCCCC1 Amb7784772 [0,1,0,1,0,0|2,0,0]=4 4590 B9R1.69 CC1CC(=N)NC[C@@H]1C Amb27213704 [0,1,0,1,0,0|2,0,0]=4 4591 B9R1.69 CC1CC(=O)CC[C@H]1C Amb28141697 [0,1,0,1,0,0|2,0,0]=4 4592 B9R1.69 CC1CC(C)C(C)CN1 Amb33328513 [0,1,0,1,0,0|2,0,0]=4 4593 B9R1.69 CC1CCC(=O)CC1C Amb22732216 [0,1,0,1,0,0|2,0,0]=4 4594 B9R1.69 CC1CCC(Br)CC1C Amb25838066 [0,1,0,1,0,0|2,0,0]=4 4595 B9R1.69 CC1CCC(C)C(C)C1 Amb4017852 [0,1,0,1,0,0|2,0,0]=4 4596 B9R1.69 CC1CCC(Cl)CC1C Amb26562244 [0,1,0,1,0,0|2,0,0]=4 4597 B9R1.69 CC1CCC(N)CC1C Amb33543352 [0,1,0,1,0,0|2,0,0]=4 4598 B9R1.69 CC1CCC(O)CC1C Amb10844787 [0,1,0,1,0,0|2,0,0]=4 4599 B9R1.69 CC1CCC(S)CC1C Amb27589824 [0,1,0,1,0,0|2,0,0]=4 4600 B9R1.69 CC1CNC(=N)CC1C Amb25960293 [0,1,0,1,0,0|2,0,0]=4 4601 B9R1.69 C[C@@H]1CCC(O)C[C@H]1C Amb27445019 [0,1,0,1,0,0|2,0,0]=4 4602 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](C)C1 Amb28061313 [0,1,0,1,0,0|2,0,0]=4 4603 B9R1.69 C[C@@H]1CC[C@@H](O)C[C@H]1C Amb28053499 [0,1,0,1,0,0|2,0,0]=4 4604 B9R1.69 C[C@H]1CC(=O)CC[C@H]1C Amb25363978 [0,1,0,1,0,0|2,0,0]=4 4605 B9R1.69 C[C@H]1CCC(=O)C[C@@H]1C Amb26440377 [0,1,0,1,0,0|2,0,0]=4 4606 B9R1.69 C[C@H]1CCC(=O)C[C@H]1C Amb26910681 [0,1,0,1,0,0|2,0,0]=4 4607 B9R1.69 C[C@H]1CC[C@@H](O)C[C@@H]1C Amb27452456 [0,1,0,1,0,0|2,0,0]=4 4608 B9R1.69 C[C@H]1CC[C@@H](O)C[C@H]1C Amb28247082 [0,1,0,1,0,0|2,0,0]=4 4609 B9R1.69 C[C@H]1CC[C@H](O)C[C@H]1C Amb28134680 [0,1,0,1,0,0|2,0,0]=4 4610 B9R1.69 C[C@H]1C[C@@H](O)CC[C@H]1C Amb27978914 [0,1,0,1,0,0|2,0,0]=4 4611 B9R1.69 C[C@H]1C[C@H](C)CC[C@H]1C Amb26026793 [0,1,0,1,0,0|2,0,0]=4 4612 B9R1.73 CCCC(=O)C1CCC1 Amb24390209 [0,1,0,1,0,0|2,0,0]=4 4613 B9R1.73 CCCC(=O)N1CCC1 Amb28241546 [0,1,0,1,0,0|2,0,0]=4 4614 B9R1.73 CCCC(Br)C1CCC1 Amb27669631 [0,1,0,1,0,0|2,0,0]=4 4615 B9R1.73 CCCC(N)C1CCC1 Amb25374014 [0,1,0,1,0,0|2,0,0]=4 4616 B9R1.73 CCCC(O)C1CCC1 Amb27202614 [0,1,0,1,0,0|2,0,0]=4 4617 B9R1.73 CCCC(S)C1CCC1 Amb27954339 [0,1,0,1,0,0|2,0,0]=4 4618 B9R1.75 CC(CCN)SC1CC1 Amb27825874 [0,1,0,1,0,0|2,0,0]=4 4619 B9R1.75 CCCC(=O)CC1CC1 Amb28285122 [0,1,0,1,0,0|2,0,0]=4 4620 B9R1.75 CCCC(C)NC1CC1 Amb6249427 [0,1,0,1,0,0|2,0,0]=4 4621 B9R1.75 CCCN(N)CC1CC1 Amb27806119 [0,1,0,1,0,0|2,0,0]=4 4622 B9R1.75 CCC[C@@H](N)CC1CC1 Amb27657336 [0,1,0,1,0,0|2,0,0]=4 4623 B9R1.90 CCC1NC(=O)C1CC Amb22364987 [0,1,0,1,0,0|2,0,0]=4 4624 B9R1.90 CC[C@@H]1NC(=O)[C@@H]1CC Amb28325086 [0,1,0,1,0,0|2,0,0]=4 4625 B9R1.90 CC[C@@H]1NC(=O)[C@H]1CC Amb27458919 [0,1,0,1,0,0|2,0,0]=4 4626 B9R1.100 CCCCC(Br)C1CC1 Amb27826788 [0,1,0,1,0,0|2,0,0]=4 4627 B9R1.100 CCCCC(C)C1CC1 Amb25286937 [0,1,0,1,0,0|2,0,0]=4 4628 B9R1.100 CCCCC(Cl)C1CC1 Amb27837489 [0,1,0,1,0,0|2,0,0]=4 4629 B9R1.100 CCCCC(N)C1CC1 Amb3788101 [0,1,0,1,0,0|2,0,0]=4 4630 B9R1.100 CCCCC(O)C1CC1 Amb27837486 [0,1,0,1,0,0|2,0,0]=4 4631 B9R1.100 CCCCN(N)C1CC1 Amb27838595 [0,1,0,1,0,0|2,0,0]=4 4632 B9R1.100 CCCC[C@H](N)C1CC1 Amb28388893 [0,1,0,1,0,0|2,0,0]=4 4633 B9R1.117 CCCCC1(N)CCC1 Amb24420313 [0,1,0,1,0,0|2,0,0]=4 4634 B9R1.117 CCCCC1(O)CCC1 Amb28400142 [0,1,0,1,0,0|2,0,0]=4 4635 B9R1.134 CCCC1(C)CCCN1 Amb27950524 [0,1,0,1,0,0|2,0,0]=4 4636 B9R1.134 CCCC1(O)CCCC1 Amb4017707 [0,1,0,1,0,0|2,0,0]=4 4637 B9R1.134 CCC[N+]1(C)CCCC1 Amb28066652 [0,1,0,1,0,0|2,0,0]=4 4638 B9R1.154 CCCC1C(=O)CC1C Amb27838721 [0,1,0,1,0,0|2,0,0]=4 4639 B9R1.154 CCCN1C(C)CC1C Amb27651261 [0,1,0,1,0,0|2,0,0]=4 4640 B9R1.154 CCC[C@@H]1C(=O)C[C@H]1C Amb27261959 [0,1,0,1,0,0|2,0,0]=4 4641 B9R1.178 CCCC1(O)CC1CC Amb27664514 [0,1,0,1,0,0|2,0,0]=4 4642 B9R1.183 CCCC(O)C1CC1C Amb27494272 [0,1,0,1,0,0|2,0,0]=4 4643 B9R1.183 CCCC(O)[C@@H]1C[C@H]1C Amb27423183 [0,1,0,1,0,0|2,0,0]=4 4644 B9R1.183 CCC[C@@H](O)C1CC1C Amb27658419 [0,1,0,1,0,0|2,0,0]=4 4645 B9R1.4 CCCC1CCC1CBr Amb33512086 [0,1,0,1,0,0|2,0,0]=4 4646 B9R1.4 CCCC1CCC1CN Amb27252657 [0,1,0,1,0,0|2,0,0]=4 4647 B9R1.4 CCCN1CCC1CN Amb33251947 [0,1,0,1,0,0|2,0,0]=4 4648 B9R1.4 CC[C@@H]1CC[C@H]1CCO Amb27981762 [0,1,0,1,0,0|2,0,0]=4 4649 B9R1.4 CC[C@H]1CC[C@H]1CCO Amb27632068 [0,1,0,1,0,0|2,0,0]=4 4650 B9R1.5 CC1CCCCCC1Br Amb18329569 [0,1,0,1,0,0|2,0,0]=4 4651 B9R1.5 CC1CCCCCC1Cl Amb27164800 [0,1,0,1,0,0|2,0,0]=4 4652 B9R1.5 CC1CCCCCC1N Amb33539533 [0,1,0,1,0,0|2,0,0]=4 4653 B9R1.5 CC1CCCCCC1O Amb27243169 [0,1,0,1,0,0|2,0,0]=4 4654 B9R1.5 CC1CCCCCC1S Amb32788094 [0,1,0,1,0,0|2,0,0]=4 4655 B9R1.5 CC1CCCNCC1C Amb22886370 [0,1,0,1,0,0|2,0,0]=4 4656 B9R1.5 CC1CCNCCC1O Amb22886251 [0,1,0,1,0,0|2,0,0]=4 4657 B9R1.5 CC1CCNCCC1O Amb27430480 [0,1,0,1,0,0|2,0,0]=4 4658 B9R1.5 CC1CCNCCN1C Amb17578107 [0,1,0,1,0,0|2,0,0]=4 4659 B9R1.5 CC1CNCCCC1O Amb22886276 [0,1,0,1,0,0|2,0,0]=4 4660 B9R1.5 CC1CNCCCC1O Amb25959907 [0,1,0,1,0,0|2,0,0]=4 4661 B9R1.5 CC1CNCCCN1C Amb17578105 [0,1,0,1,0,0|2,0,0]=4 4662 B9R1.5 CC1CNCCOC1C Amb32679918 [0,1,0,1,0,0|2,0,0]=4 4663 B9R1.5 C[C@@H]1CCCCC[C@@H]1N Amb28346949 [0,1,0,1,0,0|2,0,0]=4 4664 B9R1.5 C[C@@H]1CCCCC[C@H]1O Amb28248774 [0,1,0,1,0,0|2,0,0]=4 4665 B9R1.5 C[C@@H]1CNCCCN1C Amb27231500 [0,1,0,1,0,0|2,0,0]=4 4666 B9R1.5 C[C@H]1CCCCC[C@@H]1O Amb27844354 [0,1,0,1,0,0|2,0,0]=4 4667 B9R1.5 C[C@H]1CCCCC[C@H]1Br Amb28428934 [0,1,0,1,0,0|2,0,0]=4 4668 B9R1.5 C[C@H]1CCCCC[C@H]1N Amb28388330 [0,1,0,1,0,0|2,0,0]=4 4669 B9R1.5 C[C@H]1CCCCC[C@H]1O Amb28139666 [0,1,0,1,0,0|2,0,0]=4 4670 B9R1.5 N[C@@H]1CSCCC[C@H]1O Amb27231398 [0,1,0,1,0,0|2,0,0]=4 4671 B9R1.14 CCC1CCCC1CBr Amb27955021 [0,1,0,1,0,0|2,0,0]=4 4672 B9R1.14 CCC1CCCC1CC Amb27236275 [0,1,0,1,0,0|2,0,0]=4 4673 B9R1.14 CCC1CCCC1CN Amb25145993 [0,1,0,1,0,0|2,0,0]=4 4674 B9R1.14 CCC1CCCC1CN Amb32662607 [0,1,0,1,0,0|2,0,0]=4 4675 B9R1.14 CCC1CCCC1NC Amb18282856 [0,1,0,1,0,0|2,0,0]=4 4676 B9R1.14 CCC1CCNC1CC Amb3788100 [0,1,0,1,0,0|2,0,0]=4 4677 B9R1.14 CCC1CNCC1CC Amb22371139 [0,1,0,1,0,0|2,0,0]=4 4678 B9R1.14 CCC1CNCC1CN Amb26003960 [0,1,0,1,0,0|2,0,0]=4 4679 B9R1.14 CCC1CNCC1CO Amb27441323 [0,1,0,1,0,0|2,0,0]=4 4680 B9R1.14 CCC1CNCC1OC Amb27246480 [0,1,0,1,0,0|2,0,0]=4 4681 B9R1.14 CCC1COCC1CBr Amb35632077 [0,1,0,1,0,0|1,1,0]=4 4682 B9R1.14 CCC1COCC1CCl Amb35632076 [0,1,0,1,0,0|1,1,0]=4 4683 B9R1.14 CCC1COCC1CO Amb35651599 [0,1,0,1,0,0|1,1,0]=4 4684 B9R1.14 CCC1COCC1NC Amb35632267 [0,1,0,1,0,0|1,1,0]=4 4685 B9R1.14 CCC1CSCC1CN Amb28456030 [0,1,0,1,0,0|1,0,0]=3 4686 B9R1.14 CCC1NCCC1CN Amb18832605 [0,1,0,1,0,0|2,0,0]=4 4687 B9R1.14 CCC1NCCC1CO Amb26643148 [0,1,0,1,0,0|2,0,0]=4 4688 B9R1.14 CCC1OCCC1CBr Amb28387646 [0,1,0,1,0,0|1,1,0]=4 4689 B9R1.14 CCC1OCCC1CCl Amb27869227 [0,1,0,1,0,0|1,1,0]=4 4690 B9R1.14 CCC1OCCC1CO Amb27975537 [0,1,0,1,0,0|1,1,0]=4 4691 B9R1.14 CC[C@@H]1CCC[C@H]1CC Amb22231650 [0,1,0,1,0,0|2,0,0]=4 4692 B9R1.14 CC[C@@H]1CNC[C@H]1CN Amb32672062 [0,1,0,1,0,0|2,0,0]=4 4693 B9R1.14 CC[C@@H]1NCC[C@@H]1CO Amb27800143 [0,1,0,1,0,0|2,0,0]=4 4694 B9R1.14 CC[C@H]1CNC[C@@H]1CO Amb33871489 [0,1,0,1,0,0|2,0,0]=4 4695 B9R1.16 CC1CC1CCCCN Amb33143911 [0,1,0,1,0,0|2,0,0]=4 4696 B9R1.16 CC1CC1NCCCN Amb19022472 [0,1,0,1,0,0|2,0,0]=4 4697 B9R1.16 CC1CC1NCCCO Amb19022443 [0,1,0,1,0,0|2,0,0]=4 4698 B9R1.16 CC1CC1OCCCN Amb33144883 [0,1,0,1,0,0|1,1,0]=4 4699 B9R1.16 CCCCCC1CC1Br Amb27408601 [0,1,0,1,0,0|2,0,0]=4 4700 B9R1.16 CCCCCC1CC1Cl Amb27477799 [0,1,0,1,0,0|2,0,0]=4 4701 B9R1.16 CCCCCC1CC1N Amb27872129 [0,1,0,1,0,0|2,0,0]=4 4702 B9R1.16 CCCCCC1OC1C Amb25888870 [0,1,0,1,0,0|2,0,0]=4 4703 B9R1.16 CCCCC[C@@H]1C[C@H]1F Amb27849384 [0,1,0,1,0,0|2,0,0]=4 4704 B9R1.16 CCCCC[C@H]1C[C@H]1O Amb28292777 [0,1,0,1,0,0|2,0,0]=4 4705 B9R1.16 CCCCNC1CC1C Amb19022375 [0,1,0,1,0,0|2,0,0]=4 4706 B9R1.16 CCCCO[C@@H]1C[C@@H]1Cl Amb27243377 [0,1,0,1,0,0|1,1,0]=4 4707 B9R1.16 CCCCO[C@@H]1C[C@H]1N Amb25366599 [0,1,0,1,0,0|1,1,0]=4 4708 B9R1.16 CCCCO[C@H]1C[C@H]1Cl Amb28384496 [0,1,0,1,0,0|1,1,0]=4 4709 B9R1.16 CCCNCC1CC1C Amb8853760 [0,1,0,1,0,0|2,0,0]=4 4710 B9R1.16 CCC\C=C\C1CC1N Amb33327143 [0,1,0,1,0,0|2,0,0]=4 4711 B9R1.16 CCC\C=C\[C@@H]1C[C@H]1N Amb33327154 [0,1,0,1,0,0|2,0,0]=4 4712 B9R1.16 CNCCNC1CC1C Amb19022475 [0,1,0,1,0,0|2,0,0]=4 4713 B9R1.16 COCCNC1CC1C Amb19022449 [0,1,0,1,0,0|2,0,0]=4 4714 B9R1.16 CSCCNC1CC1C Amb27246063 [0,1,0,1,0,0|2,0,0]=4 4715 B9R1.17 BrCCCCN1CCC1 Amb27870431 [0,1,0,1,0,0|2,0,0]=4 4716 B9R1.17 BrCCCOC1CCC1 Amb18321012 [0,1,0,1,0,0|1,1,0]=4 4717 B9R1.17 CCCCCC1CCN1 Amb28387630 [0,1,0,1,0,0|2,0,0]=4 4718 B9R1.17 CCCCCC1CNC1 Amb27599832 [0,1,0,1,0,0|2,0,0]=4 4719 B9R1.17 CCCCCC1CNC1 Amb33141041 [0,1,0,1,0,0|2,0,0]=4 4720 B9R1.17 CCCCOC1CNC1 Amb19031045 [0,1,0,1,0,0|1,1,0]=4 4721 B9R1.17 CCCNCC1CNC1 Amb27265692 [0,1,0,1,0,0|2,0,0]=4 4722 B9R1.17 CCCONC1COC1 Amb27793965 [0,1,0,1,0,0|1,1,0]=4 4723 B9R1.17 CCCSCC1CCC1 Amb28134469 [0,1,0,1,0,0|1,0,0]=3 4724 B9R1.17 CCC\C=C\C1CCN1 Amb33327127 [0,1,0,1,0,0|2,0,0]=4 4725 B9R1.17 CCC\C=C\C1CNC1 Amb33327128 [0,1,0,1,0,0|2,0,0]=4 4726 B9R1.17 CNCCNC1CCC1 Amb19022298 [0,1,0,1,0,0|2,0,0]=4 4727 B9R1.17 CNCCOC1CCC1 Amb19024861 [0,1,0,1,0,0|1,1,0]=4 4728 B9R1.17 CNCCSC1CCC1 Amb27669181 [0,1,0,1,0,0|1,0,0]=3 4729 B9R1.17 CNCCSC1COC1 Amb27443701 [0,1,0,1,0,0|2,0,0]=4 4730 B9R1.17 COCCNC1CCC1 Amb23597827 [0,1,0,1,0,0|2,0,0]=4 4731 B9R1.17 COCCSC1CNC1 Amb28241396 [0,1,0,1,0,0|2,0,0]=4 4732 B9R1.17 ClCCCCN1CCC1 Amb27790623 [0,1,0,1,0,0|2,0,0]=4 4733 B9R1.17 FCCCCN1CCC1 Amb28381307 [0,1,0,1,0,0|2,0,0]=4 4734 B9R1.17 NCCCCC1CCC1 Amb25888956 [0,1,0,1,0,0|2,0,0]=4 4735 B9R1.17 NCCCCN1CCC1 Amb27838494 [0,1,0,1,0,0|2,0,0]=4 4736 B9R1.17 NCCCNC1CCC1 Amb19021296 [0,1,0,1,0,0|2,0,0]=4 4737 B9R1.17 NCCCOC1CCC1 Amb26878582 [0,1,0,1,0,0|1,1,0]=4 4738 B9R1.17 OCCCCC1CCC1 Amb32945992 [0,1,0,1,0,0|2,0,0]=4 4739 B9R1.17 OCCCNC1CCC1 Amb22229279 [0,1,0,1,0,0|2,0,0]=4 4740 B9R1.17 OCCCOC1CCC1 Amb27948159 [0,1,0,1,0,0|1,1,0]=4 4741 B9R1.17 OCCCSC1COC1 Amb27982347 [0,1,0,1,0,0|2,0,0]=4 4742 B9R1.39 CCCCC1CCC1N Amb27193785 [0,1,0,1,0,0|2,0,0]=4 4743 B9R1.39 CCCCC1CCC1O Amb32950020 [0,1,0,1,0,0|2,0,0]=4 4744 B9R1.39 CCCNC1CCC1C Amb28188610 [0,1,0,1,0,0|2,0,0]=4 4745 B9R1.39 CCCO[C@@H]1CC[C@@H]1N Amb33495617 [0,1,0,1,0,0|1,1,0]=4 4746 B9R1.39 CCCO[C@@H]1CC[C@H]1O Amb33495605 [0,1,0,1,0,0|1,1,0]=4 4747 B9R1.39 CCNCC1CCC1C Amb23512036 [0,1,0,1,0,0|2,0,0]=4 4748 B9R1.83 BrCCCCCC1CC1 Amb32992758 [0,1,0,1,0,0|2,0,0]=4 4749 B9R1.83 BrCCCNCC1CC1 Amb27971427 [0,1,0,1,0,0|2,0,0]=4 4750 B9R1.83 BrCCCOCC1CC1 Amb9209737 [0,1,0,1,0,0|1,1,0]=4 4751 B9R1.83 C=CCCSCC1CC1 Amb27956578 [0,1,0,1,0,0|1,0,1]=4 4752 B9R1.83 CCCCCCC1CO1 Amb17771533 [0,1,0,1,0,0|2,0,0]=4 4753 B9R1.83 CCCCCCC1CS1 Amb27873363 [0,1,0,1,0,0|2,0,0]=4 4754 B9R1.83 CCCCCC[C@@H]1CO1 Amb22225139 [0,1,0,1,0,0|2,0,0]=4 4755 B9R1.83 CCCCCC[C@H]1CO1 Amb24529260 [0,1,0,1,0,0|2,0,0]=4 4756 B9R1.83 CCCCCC[C@H]1CS1 Amb22367053 [0,1,0,1,0,0|2,0,0]=4 4757 B9R1.83 CCCCCNC1CC1 Amb6248403 [0,1,0,1,0,0|2,0,0]=4 4758 B9R1.83 CCCCNCC1CC1 Amb6686876 [0,1,0,1,0,0|2,0,0]=4 4759 B9R1.83 CCCCNCC1CO1 Amb27950731 [0,1,0,1,0,0|2,0,0]=4 4760 B9R1.83 CCCCOCC1CO1 Amb534220 [0,1,0,1,0,0|1,1,0]=4 4761 B9R1.83 CCCCOC[C@@H]1CO1 Amb16185838 [0,1,0,1,0,0|1,1,0]=4 4762 B9R1.83 CCCCOC[C@H]1CO1 Amb26926784 [0,1,0,1,0,0|1,1,0]=4 4763 B9R1.83 CCCCSC[C@H]1CO1 Amb27753323 [0,1,0,1,0,0|1,0,0]=3 4764 B9R1.83 CCCNCCC1CC1 Amb25921074 [0,1,0,1,0,0|2,0,0]=4 4765 B9R1.83 CCCSCCC1CC1 Amb28349579 [0,1,0,1,0,0|1,0,0]=3 4766 B9R1.83 CCCSCCC1CO1 Amb27256622 [0,1,0,1,0,0|1,0,0]=3 4767 B9R1.83 CCC\C=C\CC1CO1 Amb33424832 [0,1,0,1,0,0|2,0,0]=4 4768 B9R1.83 CCNCCCC1CC1 Amb25147174 [0,1,0,1,0,0|2,0,0]=4 4769 B9R1.83 CNCCOCC1CC1 Amb20622213 [0,1,0,1,0,0|1,1,0]=4 4770 B9R1.83 COCCCNC1CC1 Amb17231857 [0,1,0,1,0,0|2,0,0]=4 4771 B9R1.83 COCCNCC1CC1 Amb6707453 [0,1,0,1,0,0|2,0,0]=4 4772 B9R1.83 COCC\C=C\C1CC1 Amb22365293 [0,1,0,1,0,0|2,0,0]=4 4773 B9R1.83 C\C=C\CSCC1CC1 Amb27837621 [0,1,0,1,0,0|1,0,1]=4 4774 B9R1.83 ClCCCOCC1CC1 Amb6681169 [0,1,0,1,0,0|1,1,0]=4 4775 B9R1.83 ClCCCSCC1CC1 Amb27826511 [0,1,0,1,0,0|1,0,0]=3 4776 B9R1.83 FCCCCNC1CC1 Amb27641511 [0,1,0,1,0,0|2,0,0]=4 4777 B9R1.83 FCCCNCC1CC1 Amb27838486 [0,1,0,1,0,0|2,0,0]=4 4778 B9R1.83 ICCCNCC1CC1 Amb27242288 [0,1,0,1,0,0|2,0,0]=4 4779 B9R1.83 NCCCCCC1CC1 Amb18832667 [0,1,0,1,0,0|2,0,0]=4 4780 B9R1.83 NCCCCNC1CC1 Amb17334101 [0,1,0,1,0,0|2,0,0]=4 4781 B9R1.83 NCCCCSC1CC1 Amb27259066 [0,1,0,1,0,0|1,0,0]=3 4782 B9R1.83 NCCCNCC1CC1 Amb27465877 [0,1,0,1,0,0|2,0,0]=4 4783 B9R1.83 NCCCOCC1CC1 Amb1216862 [0,1,0,1,0,0|1,1,0]=4 4784 B9R1.83 NCCCSCC1CC1 Amb28422208 [0,1,0,1,0,0|1,0,0]=3 4785 B9R1.83 OCCCC#CC1CC1 Amb32950253 [0,1,0,1,0,0|2,0,0]=4 4786 B9R1.83 OCCCCNC1CC1 Amb17334108 [0,1,0,1,0,0|2,0,0]=4 4787 B9R1.83 OCCCNCC1CC1 Amb9423145 [0,1,0,1,0,0|2,0,0]=4 4788 B9R1.83 OCCCOCC1CC1 Amb27622883 [0,1,0,1,0,0|1,1,0]=4 4789 B9R1.83 OCCCSCC1CC1 Amb24478768 [0,1,0,1,0,0|1,0,0]=3 4790 B9R1.83 SCCCOCC1CC1 Amb27761385 [0,1,0,1,0,0|1,1,0]=4 4791 B9R1.89 BrCC1CCCCCC1 Amb19073228 [0,1,0,1,0,0|2,0,0]=4 4792 B9R1.89 BrCC1CCCCNC1 Amb29854399 [0,1,0,1,0,0|2,0,0]=4 4793 B9R1.89 BrCC1CCCSCC1 Amb30031350 [0,1,0,1,0,0|1,0,0]=3 4794 B9R1.89 CCC1CCCCCC1 Amb26390826 [0,1,0,1,0,0|2,0,0]=4 4795 B9R1.89 CCC1CCCCCN1 Amb3788103 [0,1,0,1,0,0|2,0,0]=4 4796 B9R1.89 CCC1CCCNCC1 Amb9316856 [0,1,0,1,0,0|2,0,0]=4 4797 B9R1.89 CCC1CCNCCO1 Amb25367816 [0,1,0,1,0,0|1,1,0]=4 4798 B9R1.89 CCC1CCNCCO1 Amb33482722 [0,1,0,1,0,0|1,1,0]=4 4799 B9R1.89 CCC1CCOCCN1 Amb26348068 [0,1,0,1,0,0|2,0,0]=4 4800 B9R1.89 CCC1CCOCCN1 Amb33482721 [0,1,0,1,0,0|2,0,0]=4 4801 B9R1.89 CCC1CNCCCN1 Amb27194045 [0,1,0,1,0,0|2,0,0]=4 4802 B9R1.89 CCC1CNCCCO1 Amb9358448 [0,1,0,1,0,0|1,1,0]=4 4803 B9R1.89 CCC1CNCCOC1 Amb28400754 [0,1,0,1,0,0|1,1,0]=4 4804 B9R1.89 CCC1COCCCN1 Amb18106727 [0,1,0,1,0,0|1,1,0]=4 4805 B9R1.89 CCN1CCCCCC1 Amb16231374 [0,1,0,1,0,0|2,0,0]=4 4806 B9R1.89 CCN1CCCNCC1 Amb1139329 [0,1,0,1,0,0|2,0,0]=4 4807 B9R1.89 CCN1CCCNCC1 Amb22586917 [0,1,0,1,0,0|2,0,0]=4 4808 B9R1.89 CC[C@@H]1CCCCCN1 Amb28136573 [0,1,0,1,0,0|2,0,0]=4 4809 B9R1.89 CC[C@H]1CCCCCN1 Amb27459025 [0,1,0,1,0,0|2,0,0]=4 4810 B9R1.89 CC[C@H]1CNCCCN1 Amb33620812 [0,1,0,1,0,0|2,0,0]=4 4811 B9R1.89 CNC1CCCCCC1 Amb1106215 [0,1,0,1,0,0|2,0,0]=4 4812 B9R1.89 CNC1CCCCCC1 Amb22587117 [0,1,0,1,0,0|2,0,0]=4 4813 B9R1.89 CNC1CCCCNC1 Amb10576552 [0,1,0,1,0,0|2,0,0]=4 4814 B9R1.89 CNC1CCCNCC1 Amb22059341 [0,1,0,1,0,0|2,0,0]=4 4815 B9R1.89 CNC1CCCSCC1 Amb35692797 [0,1,0,1,0,0|1,0,0]=3 4816 B9R1.89 CN[C@@H]1CCCCNC1 Amb27630678 [0,1,0,1,0,0|2,0,0]=4 4817 B9R1.89 COC1CCCNCC1 Amb22405875 [0,1,0,1,0,0|2,0,0]=4 4818 B9R1.89 COC1CCCNCC1 Amb22405876 [0,1,0,1,0,0|2,0,0]=4 4819 B9R1.89 CSC1CCCCNC1 Amb20668460 [0,1,0,1,0,0|2,0,0]=4 4820 B9R1.89 CSC1CCCNCC1 Amb24457994 [0,1,0,1,0,0|2,0,0]=4 4821 B9R1.89 ClCC1CCCCCC1 Amb26317790 [0,1,0,1,0,0|2,0,0]=4 4822 B9R1.89 ClCC1CCCCNC1 Amb29854216 [0,1,0,1,0,0|2,0,0]=4 4823 B9R1.89 ClCC1CCCSCC1 Amb30031349 [0,1,0,1,0,0|1,0,0]=3 4824 B9R1.89 ClCC1CSCCCS1 Amb27760500 [0,1,0,1,0,0|2,0,0]=4 4825 B9R1.89 ClCC1SCCCCS1 Amb22265160 [0,1,0,1,0,0|2,0,0]=4 4826 B9R1.89 FCC1CCCCNC1 Amb29849262 [0,1,0,1,0,0|2,0,0]=4 4827 B9R1.89 ICC1CCCCCC1 Amb27596090 [0,1,0,1,0,0|2,0,0]=4 4828 B9R1.89 N#CC1CCCSCC1 Amb29860973 [0,1,0,1,0,0|1,0,1]=4 4829 B9R1.89 NCC1CCCCCC1 Amb22001955 [0,1,0,1,0,0|2,0,0]=4 4830 B9R1.89 NCC1CCCCCC1 Amb8943673 [0,1,0,1,0,0|2,0,0]=4 4831 B9R1.89 NCC1CCCCNC1 Amb28314020 [0,1,0,1,0,0|2,0,0]=4 4832 B9R1.89 NCC1CCCCNC1 Amb32653390 [0,1,0,1,0,0|2,0,0]=4 4833 B9R1.89 NCC1CCCOCC1 Amb18203218 [0,1,0,1,0,0|1,1,0]=4 4834 B9R1.89 NCC1CCCSCC1 Amb18198731 [0,1,0,1,0,0|1,0,0]=3 4835 B9R1.89 NCC1CCCSCC1 Amb31156302 [0,1,0,1,0,0|1,0,0]=3 4836 B9R1.89 NNC1CCCSCC1 Amb27843720 [0,1,0,1,0,0|2,0,0]=4 4837 B9R1.89 O=CC1CCCSCC1 Amb18202390 [0,1,0,1,0,0|1,0,1]=4 4838 B9R1.89 OCC1CCCCCC1 Amb20240529 [0,1,0,1,0,0|2,0,0]=4 4839 B9R1.89 OCC1CCCCCC1 Amb34916703 [0,1,0,1,0,0|2,0,0]=4 4840 B9R1.89 OCC1CCCCNC1 Amb19149352 [0,1,0,1,0,0|2,0,0]=4 4841 B9R1.89 OCC1CCCCNC1 Amb8630389 [0,1,0,1,0,0|2,0,0]=4 4842 B9R1.89 OCC1CCCNCC1 Amb22886282 [0,1,0,1,0,0|2,0,0]=4 4843 B9R1.89 OCC1CCCNCC1 Amb33545032 [0,1,0,1,0,0|2,0,0]=4 4844 B9R1.89 OCC1CCCOCC1 Amb18203196 [0,1,0,1,0,0|1,1,0]=4 4845 B9R1.89 OCC1CCCSCC1 Amb18202263 [0,1,0,1,0,0|1,0,0]=3 4846 B9R1.89 OCC1CCSCCN1 Amb27778584 [0,1,0,1,0,0|2,0,0]=4 4847 B9R1.89 OC[C@@H]1CCCCNC1 Amb28315456 [0,1,0,1,0,0|2,0,0]=4 4848 B9R1.89 ONC1CCCSCC1 Amb35692798 [0,1,0,1,0,0|2,0,0]=4 4849 B9R1.89 SCC1CCCCCC1 Amb25960657 [0,1,0,1,0,0|2,0,0]=4 4850 B9R1.89 SCC1CCCCNC1 Amb35611336 [0,1,0,1,0,0|2,0,0]=4 4851 B9R1.103 C1=CCOCCCCC1 Amb29838311 [0,1,0,1,0,0|2,0,0]=4 4852 B9R1.103 C1CCCCNCCC1 Amb21963016 [0,1,0,1,0,0|2,0,0]=4 4853 B9R1.103 C1CCCCNCCC1 Amb32662942 [0,1,0,1,0,0|2,0,0]=4 4854 B9R1.103 C1CCNCCNCC1 Amb28046834 [0,1,0,1,0,0|2,0,0]=4 4855 B9R1.103 C1CNCCSCCN1 Amb21953151 [0,1,0,1,0,0|2,0,0]=4 4856 B9R1.103 C1CNCCSCCN1 Amb21953197 [0,1,0,1,0,0|2,0,0]=4 4857 B9R1.103 C1CSCCSCCN1 Amb27200295 [0,1,0,1,0,0|2,0,0]=4 4858 B9R1.103 C1CSCCSCCO1 Amb24647700 [0,1,0,1,0,0|2,0,0]=4 4859 B9R1.103 C1CSCCSCCS1 Amb9825898 [0,1,0,1,0,0|2,0,0]=4 4860 B9R1.1 CCC1CCC(Br)CC1 Amb8835445 [0,1,0,1,0,0|2,0,0]=4 4861 B9R1.1 CCC1CCC(C)CC1 Amb22227949 [0,1,0,1,0,0|2,0,0]=4 4862 B9R1.1 CCC1CCC(C)CN1 Amb27668440 [0,1,0,1,0,0|2,0,0]=4 4863 B9R1.1 CCC1CCC(C)NC1 Amb2782904 [0,1,0,1,0,0|2,0,0]=4 4864 B9R1.1 CCC1CCC(C)NC1 Amb28934993 [0,1,0,1,0,0|2,0,0]=4 4865 B9R1.1 CCC1CCC(N)CC1 Amb1117745 [0,1,0,1,0,0|2,0,0]=4 4866 B9R1.1 CCC1CCC(N)CC1 Amb32661500 [0,1,0,1,0,0|2,0,0]=4 4867 B9R1.1 CCC1CCC(N)CN1 Amb33275542 [0,1,0,1,0,0|2,0,0]=4 4868 B9R1.1 CCC1CCC(S)CC1 Amb9208051 [0,1,0,1,0,0|2,0,0]=4 4869 B9R1.1 CC[C@@H]1C=C[C@H](O)CC1 Amb27443552 [0,1,0,1,0,0|2,0,0]=4 4870 B9R1.1 CC[C@@H]1CC[C@@H](C)NC1 Amb32665354 [0,1,0,1,0,0|2,0,0]=4 4871 B9R1.1 CC[C@@H]1CC[C@@H](C)NC1 Amb33484385 [0,1,0,1,0,0|2,0,0]=4 4872 B9R1.1 CC[C@@H]1CC[C@H](C)NC1 Amb26423925 [0,1,0,1,0,0|2,0,0]=4 4873 B9R1.1 CC[C@H]1CCC(C)NC1 Amb28196699 [0,1,0,1,0,0|2,0,0]=4 4874 B9R1.1 CC[C@H]1CC[C@@H](C)CC1 Amb22230416 [0,1,0,1,0,0|2,0,0]=4 4875 B9R1.1 CC[C@H]1CC[C@@H](C)NC1 Amb26528612 [0,1,0,1,0,0|2,0,0]=4 4876 B9R1.1 CC[C@H]1CC[C@@H](C)NC1 Amb32652730 [0,1,0,1,0,0|2,0,0]=4 4877 B9R1.1 CC[C@H]1CC[C@H](N)CC1 Amb27759922 [0,1,0,1,0,0|2,0,0]=4 4878 B9R1.1 CC[C@H]1CC[C@H](N)CC1 Amb28935024 [0,1,0,1,0,0|2,0,0]=4 4879 B9R1.1 CC[C@H]1CC[C@H](O)CC1 Amb22231677 [0,1,0,1,0,0|2,0,0]=4 4880 B9R1.1 CNC1CCC(C)SC1 Amb35698163 [0,1,0,1,0,0|2,0,0]=4 4881 B9R1.1 ClCC1CCC(Cl)CS1 Amb27454127 [0,1,0,1,0,0|2,0,0]=4 4882 B9R1.1 ClC[C@@H]1CC[C@H](Cl)CS1 Amb27659299 [0,1,0,1,0,0|2,0,0]=4 4883 B9R1.3 CC1C=CCC(C)C1C Amb26068926 [0,1,0,1,0,0|2,0,0]=4 4884 B9R1.3 CC1CCCC(C)C1C Amb22227691 [0,1,0,1,0,0|2,0,0]=4 4885 B9R1.3 CC1CCCC(N)C1C Amb3939985 [0,1,0,1,0,0|2,0,0]=4 4886 B9R1.3 CC1CCCC(O)C1C Amb9825841 [0,1,0,1,0,0|2,0,0]=4 4887 B9R1.3 CC1CCCC(S)C1C Amb25731166 [0,1,0,1,0,0|2,0,0]=4 4888 B9R1.3 CC1CSCC(O)C1O Amb28069518 [0,1,0,1,0,0|2,0,0]=4 4889 B9R1.3 CC1[C@H](C)CCC[C@H]1C Amb27493255 [0,1,0,1,0,0|2,0,0]=4 4890 B9R1.3 C[C@@H]1C(O)CCC[C@H]1C Amb27451971 [0,1,0,1,0,0|2,0,0]=4 4891 B9R1.3 C[C@@H]1CCCC(O)[C@@H]1C Amb27664284 [0,1,0,1,0,0|2,0,0]=4 4892 B9R1.3 C[C@@H]1CCC[C@@H](O)[C@@H]1C Amb27876256 [0,1,0,1,0,0|2,0,0]=4 4893 B9R1.3 C[C@@H]1CCC[C@H](N)[C@@H]1C Amb28055489 [0,1,0,1,0,0|2,0,0]=4 4894 B9R1.3 C[C@@H]1CSC[C@H](O)[C@@H]1O Amb27662365 [0,1,0,1,0,0|2,0,0]=4 4895 B9R1.3 C[C@H]1CCC[C@@H](C)[C@H]1C Amb25245256 [0,1,0,1,0,0|2,0,0]=4 4896 B9R1.3 C[C@H]1CCC[C@@H](N)[C@H]1C Amb27253637 [0,1,0,1,0,0|2,0,0]=4 4897 B9R1.3 C[C@H]1CCC[C@@H](O)[C@H]1C Amb27980719 [0,1,0,1,0,0|2,0,0]=4 4898 B9R1.3 C[C@H]1[C@H](C)CCC[C@H]1N Amb28055501 [0,1,0,1,0,0|2,0,0]=4 4899 B9R1.11 CC(CBr)C1CCCS1 Amb33432870 [0,1,0,1,0,0|2,0,0]=4 4900 B9R1.11 CC(CN)C1CCCS1 Amb26892211 [0,1,0,1,0,0|2,0,0]=4 4901 B9R1.11 CCC(C)C1=NCCC1 Amb27482646 [0,1,0,1,0,0|2,0,0]=4 4902 B9R1.11 CCC(C)C1=NCCS1 Amb22057414 [0,1,0,1,0,0|2,0,0]=4 4903 B9R1.11 CCC(C)C1CCCC1 Amb17689395 [0,1,0,1,0,0|2,0,0]=4 4904 B9R1.11 CCC(C)C1CCCN1 Amb35789368 [0,1,0,1,0,0|2,0,0]=4 4905 B9R1.11 CCC(C)C1CCCN1 Amb9714968 [0,1,0,1,0,0|2,0,0]=4 4906 B9R1.11 CCC(C)N1CCCN1 Amb27779904 [0,1,0,1,0,0|2,0,0]=4 4907 B9R1.11 CCC(N)C1=CCCC1 Amb18965361 [0,1,0,1,0,0|2,0,0]=4 4908 B9R1.11 CCC(N)C1CCCC1 Amb18281187 [0,1,0,1,0,0|2,0,0]=4 4909 B9R1.11 CCC(N)C1CCCN1 Amb26918433 [0,1,0,1,0,0|2,0,0]=4 4910 B9R1.11 CCC(N)C1CCCO1 Amb22059669 [0,1,0,1,0,0|1,1,0]=4 4911 B9R1.11 CCC(N)C1CCCS1 Amb27202616 [0,1,0,1,0,0|1,0,0]=3 4912 B9R1.11 CCC(O)C1=CCCC1 Amb27257752 [0,1,0,1,0,0|2,0,0]=4 4913 B9R1.11 CCC(O)C1CCCN1 Amb17231861 [0,1,0,1,0,0|2,0,0]=4 4914 B9R1.11 CCC(O)[C@@H]1CCCN1 Amb28340949 [0,1,0,1,0,0|2,0,0]=4 4915 B9R1.11 CCC(O)[C@@H]1CCCN1 Amb33734033 [0,1,0,1,0,0|2,0,0]=4 4916 B9R1.11 CCC(O)[C@H]1CCCN1 Amb29891705 [0,1,0,1,0,0|2,0,0]=4 4917 B9R1.11 CCC(O)[C@H]1CCCN1 Amb33734032 [0,1,0,1,0,0|2,0,0]=4 4918 B9R1.11 CCC(O)[C@H]1CCCO1 Amb28435654 [0,1,0,1,0,0|1,1,0]=4 4919 B9R1.11 CCC(S)C1CCCC1 Amb25984964 [0,1,0,1,0,0|2,0,0]=4 4920 B9R1.11 CC[C@@H](N)C1CCCO1 Amb27838765 [0,1,0,1,0,0|1,1,0]=4 4921 B9R1.11 CC[C@@H](O)[C@@H]1CCCO1 Amb27463124 [0,1,0,1,0,0|1,1,0]=4 4922 B9R1.11 CC[C@@H](O)[C@H]1CCCO1 Amb27980675 [0,1,0,1,0,0|1,1,0]=4 4923 B9R1.11 CC[C@H](N)C1CCCC1 Amb27436954 [0,1,0,1,0,0|2,0,0]=4 4924 B9R1.11 CC[C@H](O)C1=CCCC1 Amb27765409 [0,1,0,1,0,0|2,0,0]=4 4925 B9R1.11 CC[C@H](O)C1CCCC1 Amb27758989 [0,1,0,1,0,0|2,0,0]=4 4926 B9R1.11 CC[C@H](O)C1CCCO1 Amb27815999 [0,1,0,1,0,0|1,1,0]=4 4927 B9R1.11 CC[C@H](O)[C@H]1CCCO1 Amb27432283 [0,1,0,1,0,0|1,1,0]=4 4928 B9R1.11 CNC(C)C1CCCS1 Amb27838475 [0,1,0,1,0,0|2,0,0]=4 4929 B9R1.11 NC(CO)C1CCCS1 Amb27185967 [0,1,0,1,0,0|2,0,0]=4 4930 B9R1.11 NCC(F)C1CCCS1 Amb33415863 [0,1,0,1,0,0|2,0,0]=4 4931 B9R1.11 NCC(O)C1CCCS1 Amb33416250 [0,1,0,1,0,0|2,0,0]=4 4932 B9R1.11 NC[C@@H](O)C1CCCS1 Amb33415867 [0,1,0,1,0,0|2,0,0]=4 4933 B9R1.11 NC[C@H](O)C1CCCS1 Amb33415868 [0,1,0,1,0,0|2,0,0]=4 4934 B9R1.11 N[C@@H](CO)C1CCCS1 Amb33416835 [0,1,0,1,0,0|2,0,0]=4 4935 B9R1.11 N[C@H](CO)C1CCCS1 Amb33416836 [0,1,0,1,0,0|2,0,0]=4 4936 B9R1.11 OC(CBr)C1CCCS1 Amb33432874 [0,1,0,1,0,0|2,0,0]=4 4937 B9R1.11 OC(CF)C1CCCS1 Amb33415840 [0,1,0,1,0,0|2,0,0]=4 4938 B9R1.11 OCC(O)C1CCCS1 Amb33415617 [0,1,0,1,0,0|2,0,0]=4 4939 B9R1.21 CCC1=NC(CC)CS1 Amb25244083 [0,1,0,1,0,0|1,0,1]=4 4940 B9R1.21 CCC1C=NC(CC)S1 Amb25737510 [0,1,0,1,0,0|2,0,0]=4 4941 B9R1.21 CCC1CCC(CC)N1 Amb26430315 [0,1,0,1,0,0|2,0,0]=4 4942 B9R1.21 CCC1CCC(CC)O1 Amb17672310 [0,1,0,1,0,0|2,0,0]=4 4943 B9R1.21 CCC1NC(CO)CS1 Amb28071194 [0,1,0,1,0,0|2,0,0]=4 4944 B9R1.21 CCC1SSC(CC)S1 Amb20621012 [0,1,0,1,0,0|0,0,0]=2 4945 B9R1.60 CCCC1CC1(N)CC Amb27442943 [0,1,0,1,0,0|2,0,0]=4 4946 B9R1.79 CC(CO)SC1CCC1 Amb27964125 [0,1,0,1,0,0|2,0,0]=4 4947 B9R1.79 CCC(C)SC1CNC1 Amb27837532 [0,1,0,1,0,0|2,0,0]=4 4948 B9R1.79 CCC(F)CN1CCC1 Amb28293777 [0,1,0,1,0,0|2,0,0]=4 4949 B9R1.79 CCC(O)CN1CCC1 Amb28255802 [0,1,0,1,0,0|2,0,0]=4 4950 B9R1.79 CC[C@@H](N)CN1CCC1 Amb27637451 [0,1,0,1,0,0|2,0,0]=4 4951 B9R1.79 CC[C@H](N)CN1CCC1 Amb27793891 [0,1,0,1,0,0|2,0,0]=4 4952 B9R1.80 CC(CCl)SCC1CC1 Amb28248818 [0,1,0,1,0,0|2,0,0]=4 4953 B9R1.80 CC(CO)CSC1CC1 Amb27825875 [0,1,0,1,0,0|2,0,0]=4 4954 B9R1.80 CCC(Br)CCC1CC1 Amb27448483 [0,1,0,1,0,0|2,0,0]=4 4955 B9R1.80 CCC(C)CNC1CC1 Amb32414501 [0,1,0,1,0,0|2,0,0]=4 4956 B9R1.80 CCC(C)NCC1CC1 Amb6686885 [0,1,0,1,0,0|2,0,0]=4 4957 B9R1.80 CCC(C)SCC1CO1 Amb6680857 [0,1,0,1,0,0|2,0,0]=4 4958 B9R1.80 CCC(C)SC[C@H]1CO1 Amb27801672 [0,1,0,1,0,0|2,0,0]=4 4959 B9R1.80 CCC(Cl)CCC1CC1 Amb27807280 [0,1,0,1,0,0|2,0,0]=4 4960 B9R1.80 CCC(N)CNC1CC1 Amb18303276 [0,1,0,1,0,0|2,0,0]=4 4961 B9R1.80 CCC(O)CNC1CC1 Amb18304015 [0,1,0,1,0,0|2,0,0]=4 4962 B9R1.80 CC[C@@H](N)CNC1CC1 Amb27657028 [0,1,0,1,0,0|2,0,0]=4 4963 B9R1.80 CC[C@H](O)CCC1CC1 Amb27192177 [0,1,0,1,0,0|2,0,0]=4 4964 B9R1.80 OCC(O)CSC1CC1 Amb27593987 [0,1,0,1,0,0|2,0,0]=4 4965 B9R1.81 CCC(Cl)C1CCC1C Amb28201338 [0,1,0,1,0,0|2,0,0]=4 4966 B9R1.88 CCC(O)C1OC1CC Amb27956541 [0,1,0,1,0,0|1,1,0]=4 4967 B9R1.99 CCCCCC1(N)CC1 Amb24623686 [0,1,0,1,0,0|2,0,0]=4 4968 B9R1.99 CCCCCC1(O)CC1 Amb27218085 [0,1,0,1,0,0|2,0,0]=4 4969 B9R1.99 CCCCNC1(C)CC1 Amb27475801 [0,1,0,1,0,0|2,0,0]=4 4970 B9R1.99 CCCNCC1(N)CC1 Amb27847328 [0,1,0,1,0,0|2,0,0]=4 4971 B9R1.99 CCCSCC1(C)CO1 Amb28399684 [0,1,0,1,0,0|2,0,0]=4 4972 B9R1.99 CCC\C=C\C1(N)CC1 Amb33327436 [0,1,0,1,0,0|2,0,0]=4 4973 B9R1.99 CCC\C=C\C1(O)CC1 Amb33327168 [0,1,0,1,0,0|2,0,0]=4 4974 B9R1.118 CC1(CN)CCCSC1 Amb27636604 [0,1,0,1,0,0|2,0,0]=4 4975 B9R1.118 CCC1(C)CCCCC1 Amb22227942 [0,1,0,1,0,0|2,0,0]=4 4976 B9R1.118 CCC1(C)CCCCN1 Amb26346096 [0,1,0,1,0,0|2,0,0]=4 4977 B9R1.118 CCC1(C)CCCNC1 Amb17622028 [0,1,0,1,0,0|2,0,0]=4 4978 B9R1.118 CCC1(C)CCCNC1 Amb22587423 [0,1,0,1,0,0|2,0,0]=4 4979 B9R1.118 CCC1(C)NCCCS1 Amb27412169 [0,1,0,1,0,0|2,0,0]=4 4980 B9R1.118 CCC1(Cl)CCCCC1 Amb4017937 [0,1,0,1,0,0|2,0,0]=4 4981 B9R1.118 CCC1(N)CCCCC1 Amb33552085 [0,1,0,1,0,0|2,0,0]=4 4982 B9R1.118 CCC1(N)CCCCC1 Amb9676113 [0,1,0,1,0,0|2,0,0]=4 4983 B9R1.118 CCC1(N)CCCOC1 Amb24524297 [0,1,0,1,0,0|1,1,0]=4 4984 B9R1.118 CCC1(O)C=CCCC1 Amb27652373 [0,1,0,1,0,0|2,0,0]=4 4985 B9R1.118 CCC1(O)CCCCC1 Amb1019962 [0,1,0,1,0,0|2,0,0]=4 4986 B9R1.118 CCC1(O)CCCNC1 Amb10607740 [0,1,0,1,0,0|2,0,0]=4 4987 B9R1.118 CCC1(O)CCCNC1 Amb22491665 [0,1,0,1,0,0|2,0,0]=4 4988 B9R1.118 CCC1(O)CCCOC1 Amb25872686 [0,1,0,1,0,0|1,1,0]=4 4989 B9R1.118 CCC1(O)CCCSC1 Amb29857708 [0,1,0,1,0,0|1,0,0]=3 4990 B9R1.118 CC[C@]1(C)CCCNC1 Amb22757832 [0,1,0,1,0,0|2,0,0]=4 4991 B9R1.118 NC1(CF)CCCSC1 Amb27211030 [0,1,0,1,0,0|2,0,0]=4 4992 B9R1.132 CCC1CCC(Cl)C1C Amb27656345 [0,1,0,1,0,0|2,0,0]=4 4993 B9R1.132 CCC1CCC(N)C1C Amb27654008 [0,1,0,1,0,0|2,0,0]=4 4994 B9R1.132 CCC1CNC(C)C1C Amb27949665 [0,1,0,1,0,0|2,0,0]=4 4995 B9R1.132 CCC1NCC(C)C1C Amb28056287 [0,1,0,1,0,0|2,0,0]=4 4996 B9R1.202 CC1CSCC1(N)CO Amb27492811 [0,1,0,1,0,0|2,0,0]=4 4997 B9R1.202 CC1CSCC1(O)CN Amb27956492 [0,1,0,1,0,0|2,0,0]=4 4998 B9R1.202 CCC1(O)CCCC1C Amb24474369 [0,1,0,1,0,0|2,0,0]=4 4999 B9R1.202 CCC1(O)COCC1C Amb35608135 [0,1,0,1,0,0|1,1,0]=4 5000 B9R1.202 CCC1(O)CSCC1C Amb27666206 [0,1,0,1,0,0|1,0,0]=3 5001 B9R1.6 CC(=O)C1CCCCS1 Amb23568664 [0,1,0,1,0,0|1,0,1]=4 5002 B9R1.6 CC(Br)C1CCCCC1 Amb9672122 [0,1,0,1,0,0|2,0,0]=4 5003 B9R1.6 CC(C)C1CCCCN1 Amb2235858 [0,1,0,1,0,0|2,0,0]=4 5004 B9R1.6 CC(C)C1CCCCN1 Amb2237211 [0,1,0,1,0,0|2,0,0]=4 5005 B9R1.6 CC(C)C1CCCNC1 Amb10607741 [0,1,0,1,0,0|2,0,0]=4 5006 B9R1.6 CC(C)C1CCCNC1 Amb29083221 [0,1,0,1,0,0|2,0,0]=4 5007 B9R1.6 CC(C)C1CNCCS1 Amb19149205 [0,1,0,1,0,0|2,0,0]=4 5008 B9R1.6 CC(C)[C@@H]1CSCCN1 Amb25269723 [0,1,0,1,0,0|2,0,0]=4 5009 B9R1.6 CC(N)C1CCCCC1 Amb22492354 [0,1,0,1,0,0|2,0,0]=4 5010 B9R1.6 CC(N)C1CCCCC1 Amb9283568 [0,1,0,1,0,0|2,0,0]=4 5011 B9R1.6 CC(N)C1CCCCN1 Amb9901744 [0,1,0,1,0,0|2,0,0]=4 5012 B9R1.6 CC(N)C1CCCCO1 Amb27596555 [0,1,0,1,0,0|1,1,0]=4 5013 B9R1.6 CC(N)C1CCCCO1 Amb32666314 [0,1,0,1,0,0|1,1,0]=4 5014 B9R1.6 CC(N)C1CCCCS1 Amb27880783 [0,1,0,1,0,0|1,0,0]=3 5015 B9R1.6 CC(N)C1CCCNC1 Amb18832598 [0,1,0,1,0,0|2,0,0]=4 5016 B9R1.6 CC(N)C1CCCOC1 Amb18832549 [0,1,0,1,0,0|1,1,0]=4 5017 B9R1.6 CC(N)C1CCCOC1 Amb32789650 [0,1,0,1,0,0|1,1,0]=4 5018 B9R1.6 CC(N)C1CCCSC1 Amb18825995 [0,1,0,1,0,0|1,0,0]=3 5019 B9R1.6 CC(O)C1C=CCCC1 Amb22365214 [0,1,0,1,0,0|2,0,0]=4 5020 B9R1.6 CC(O)C1CCCCC1 Amb9283574 [0,1,0,1,0,0|2,0,0]=4 5021 B9R1.6 CC(O)C1CCCCN1 Amb18642713 [0,1,0,1,0,0|2,0,0]=4 5022 B9R1.6 CC(O)C1CCCCO1 Amb23585663 [0,1,0,1,0,0|1,1,0]=4 5023 B9R1.6 CC(O)C1CCCNC1 Amb17593363 [0,1,0,1,0,0|2,0,0]=4 5024 B9R1.6 CC(O)C1CCCNC1 Amb32412170 [0,1,0,1,0,0|2,0,0]=4 5025 B9R1.6 CC(O)C1CNCCS1 Amb35599592 [0,1,0,1,0,0|2,0,0]=4 5026 B9R1.6 CC(O)C1CSCCN1 Amb35583306 [0,1,0,1,0,0|2,0,0]=4 5027 B9R1.6 CC(O)C1CSCCO1 Amb27838575 [0,1,0,1,0,0|2,0,0]=4 5028 B9R1.6 CC(O)C1OCCCS1 Amb27589005 [0,1,0,1,0,0|2,0,0]=4 5029 B9R1.6 CC(O)[C@@H]1CCCCN1 Amb35737461 [0,1,0,1,0,0|2,0,0]=4 5030 B9R1.6 CC(O)[C@@H]1CCCNC1 Amb35588431 [0,1,0,1,0,0|2,0,0]=4 5031 B9R1.6 CC(O)[C@H]1CCCCN1 Amb35617462 [0,1,0,1,0,0|2,0,0]=4 5032 B9R1.6 CC(O)[C@H]1CCCNC1 Amb35617453 [0,1,0,1,0,0|2,0,0]=4 5033 B9R1.6 CC(S)C1CCCCC1 Amb9672127 [0,1,0,1,0,0|2,0,0]=4 5034 B9R1.6 CC(S)C1CCCCN1 Amb25707556 [0,1,0,1,0,0|2,0,0]=4 5035 B9R1.6 CC(S)C1CCCCO1 Amb32788899 [0,1,0,1,0,0|1,1,0]=4 5036 B9R1.6 CC(S)C1CCCNC1 Amb32788620 [0,1,0,1,0,0|2,0,0]=4 5037 B9R1.6 CC(S)C1CCCSC1 Amb32788181 [0,1,0,1,0,0|1,0,0]=3 5038 B9R1.6 C[C@@H](N)C1CCCCC1 Amb3940038 [0,1,0,1,0,0|2,0,0]=4 5039 B9R1.6 C[C@@H](N)C1CCCCO1 Amb26000516 [0,1,0,1,0,0|1,1,0]=4 5040 B9R1.6 C[C@@H](N)C1CCCCO1 Amb31291420 [0,1,0,1,0,0|1,1,0]=4 5041 B9R1.6 C[C@@H](N)C1CCCCS1 Amb27174884 [0,1,0,1,0,0|1,0,0]=3 5042 B9R1.6 C[C@@H](N)C1CCCOC1 Amb25705770 [0,1,0,1,0,0|1,1,0]=4 5043 B9R1.6 C[C@@H](N)C1CCCSC1 Amb32726293 [0,1,0,1,0,0|1,0,0]=3 5044 B9R1.6 C[C@@H](O)C1CCCCO1 Amb33375690 [0,1,0,1,0,0|1,1,0]=4 5045 B9R1.6 C[C@@H](O)C1CCCOC1 Amb26634197 [0,1,0,1,0,0|1,1,0]=4 5046 B9R1.6 C[C@@H](O)C1CCCSC1 Amb32726246 [0,1,0,1,0,0|1,0,0]=3 5047 B9R1.6 C[C@@H](O)C1SCCCS1 Amb28072973 [0,1,0,1,0,0|2,0,0]=4 5048 B9R1.6 C[C@H](N)C1CCCCC1 Amb3939178 [0,1,0,1,0,0|2,0,0]=4 5049 B9R1.6 C[C@H](N)C1CCCCO1 Amb33171840 [0,1,0,1,0,0|1,1,0]=4 5050 B9R1.6 C[C@H](N)C1CCCOC1 Amb25147114 [0,1,0,1,0,0|1,1,0]=4 5051 B9R1.6 C[C@H](N)C1CCCSC1 Amb32726275 [0,1,0,1,0,0|1,0,0]=3 5052 B9R1.6 C[C@H](O)C1CCCCC1 Amb13952949 [0,1,0,1,0,0|2,0,0]=4 5053 B9R1.6 C[C@H](O)C1CCCCO1 Amb33375689 [0,1,0,1,0,0|1,1,0]=4 5054 B9R1.6 C[C@H](O)C1CCCOC1 Amb26324174 [0,1,0,1,0,0|1,1,0]=4 5055 B9R1.6 C[C@H](O)C1CCCSC1 Amb32726302 [0,1,0,1,0,0|1,0,0]=3 5056 B9R1.6 O=C(O)C1CCCSS1 Amb24480090 [0,1,0,1,0,0|1,0,1]=4 5057 B9R1.13 CC(=O)CC1CCCS1 Amb33416251 [0,1,0,1,0,0|1,0,1]=4 5058 B9R1.13 CC(Br)CC1CCCC1 Amb24693833 [0,1,0,1,0,0|2,0,0]=4 5059 B9R1.13 CC(Br)CC1CCCO1 Amb29857136 [0,1,0,1,0,0|1,1,0]=4 5060 B9R1.13 CC(Br)CC1CCCS1 Amb33433064 [0,1,0,1,0,0|1,0,0]=3 5061 B9R1.13 CC(C)CC1=CCCC1 Amb27436258 [0,1,0,1,0,0|2,0,0]=4 5062 B9R1.13 CC(C)CC1CCCC1 Amb22230763 [0,1,0,1,0,0|2,0,0]=4 5063 B9R1.13 CC(C)CC1CCCN1 Amb10068751 [0,1,0,1,0,0|2,0,0]=4 5064 B9R1.13 CC(C)CC1CCCN1 Amb17659147 [0,1,0,1,0,0|2,0,0]=4 5065 B9R1.13 CC(C)CN1CCCC1 Amb17231850 [0,1,0,1,0,0|2,0,0]=4 5066 B9R1.13 CC(C)C[C@@H]1CCCN1 Amb25338158 [0,1,0,1,0,0|2,0,0]=4 5067 B9R1.13 CC(C)C[C@H]1CCCN1 Amb25757364 [0,1,0,1,0,0|2,0,0]=4 5068 B9R1.13 CC(Cl)CC1CCCO1 Amb29857074 [0,1,0,1,0,0|1,1,0]=4 5069 B9R1.13 CC(Cl)CN1CCCC1 Amb27165761 [0,1,0,1,0,0|2,0,0]=4 5070 B9R1.13 CC(N)CC1CCCC1 Amb18962767 [0,1,0,1,0,0|2,0,0]=4 5071 B9R1.13 CC(N)CC1CCCO1 Amb13952622 [0,1,0,1,0,0|1,1,0]=4 5072 B9R1.13 CC(N)CN1CCCC1 Amb33801437 [0,1,0,1,0,0|2,0,0]=4 5073 B9R1.13 CC(N)CN1CCCC1 Amb9710549 [0,1,0,1,0,0|2,0,0]=4 5074 B9R1.13 CC(N)CN1CCCO1 Amb28188827 [0,1,0,1,0,0|1,1,0]=4 5075 B9R1.13 CC(O)CC1=CCCC1 Amb28345352 [0,1,0,1,0,0|2,0,0]=4 5076 B9R1.13 CC(O)CC1=NCCC1 Amb27244692 [0,1,0,1,0,0|2,0,0]=4 5077 B9R1.13 CC(O)CC1=NCCS1 Amb27196626 [0,1,0,1,0,0|2,0,0]=4 5078 B9R1.13 CC(O)CC1CCCC1 Amb26484484 [0,1,0,1,0,0|2,0,0]=4 5079 B9R1.13 CC(O)CC1CCCN1 Amb22059496 [0,1,0,1,0,0|2,0,0]=4 5080 B9R1.13 CC(O)CC1CCCO1 Amb27979742 [0,1,0,1,0,0|1,1,0]=4 5081 B9R1.13 CC(O)CC1CCCS1 Amb25206716 [0,1,0,1,0,0|1,0,0]=3 5082 B9R1.13 CC(O)CN1CCCC1 Amb32665261 [0,1,0,1,0,0|2,0,0]=4 5083 B9R1.13 CC(O)CN1CCCC1 Amb4017595 [0,1,0,1,0,0|2,0,0]=4 5084 B9R1.13 CC(S)CC1CCCC1 Amb29857286 [0,1,0,1,0,0|2,0,0]=4 5085 B9R1.13 CC(S)CC1CCCN1 Amb32788357 [0,1,0,1,0,0|2,0,0]=4 5086 B9R1.13 CC(S)CC1CCCO1 Amb29857287 [0,1,0,1,0,0|1,1,0]=4 5087 B9R1.13 CN(O)CC1CCCS1 Amb33416201 [0,1,0,1,0,0|2,0,0]=4 5088 B9R1.13 C[C@@H](N)CC1CCCC1 Amb28423841 [0,1,0,1,0,0|2,0,0]=4 5089 B9R1.13 C[C@@H](N)CC1CCCO1 Amb25048917 [0,1,0,1,0,0|1,1,0]=4 5090 B9R1.13 C[C@@H](N)CC1CCCS1 Amb33416796 [0,1,0,1,0,0|1,0,0]=3 5091 B9R1.13 C[C@@H](N)CN1CCCC1 Amb25921110 [0,1,0,1,0,0|2,0,0]=4 5092 B9R1.13 C[C@@H](O)CC1=CCCC1 Amb28315475 [0,1,0,1,0,0|2,0,0]=4 5093 B9R1.13 C[C@@H](O)CC1=NCCS1 Amb28315562 [0,1,0,1,0,0|2,0,0]=4 5094 B9R1.13 C[C@@H](O)CC1CCCC1 Amb33315749 [0,1,0,1,0,0|2,0,0]=4 5095 B9R1.13 C[C@@H](O)CC1CCCO1 Amb33318696 [0,1,0,1,0,0|1,1,0]=4 5096 B9R1.13 C[C@@H](O)CC1CCCS1 Amb33415844 [0,1,0,1,0,0|1,0,0]=3 5097 B9R1.13 C[C@@H](O)CC1SCCS1 Amb28049093 [0,1,0,1,0,0|2,0,0]=4 5098 B9R1.13 C[C@@H](O)CN1CCCC1 Amb26069529 [0,1,0,1,0,0|2,0,0]=4 5099 B9R1.13 C[C@@H](O)CN1CCCN1 Amb28060242 [0,1,0,1,0,0|2,0,0]=4 5100 B9R1.13 C[C@@H](O)C[C@@H]1CCCO1 Amb27196849 [0,1,0,1,0,0|1,1,0]=4 5101 B9R1.13 C[C@H](N)CC1CCCC1 Amb27949784 [0,1,0,1,0,0|2,0,0]=4 5102 B9R1.13 C[C@H](N)CC1CCCO1 Amb27804405 [0,1,0,1,0,0|1,1,0]=4 5103 B9R1.13 C[C@H](N)CC1CCCS1 Amb33416790 [0,1,0,1,0,0|1,0,0]=3 5104 B9R1.13 C[C@H](N)CN1CCCC1 Amb27867537 [0,1,0,1,0,0|2,0,0]=4 5105 B9R1.13 C[C@H](O)CC1CCCC1 Amb33315750 [0,1,0,1,0,0|2,0,0]=4 5106 B9R1.13 C[C@H](O)CC1CCCO1 Amb24735204 [0,1,0,1,0,0|1,1,0]=4 5107 B9R1.13 C[C@H](O)CC1CCCS1 Amb33415845 [0,1,0,1,0,0|1,0,0]=3 5108 B9R1.13 C[C@H](O)CN1CCCC1 Amb26477879 [0,1,0,1,0,0|2,0,0]=4 5109 B9R1.13 C[C@H](O)CN1CCCN1 Amb27202924 [0,1,0,1,0,0|2,0,0]=4 5110 B9R1.13 C[C@H](O)C[C@@H]1CCCN1 Amb28428898 [0,1,0,1,0,0|2,0,0]=4 5111 B9R1.13 C[C@H](O)C[C@H]1CCCN1 Amb27786187 [0,1,0,1,0,0|2,0,0]=4 5112 B9R1.13 C[C@H](O)C[C@H]1CCCO1 Amb28206139 [0,1,0,1,0,0|1,1,0]=4 5113 B9R1.24 CCC1CCCC1(C)N Amb32654937 [0,1,0,1,0,0|2,0,0]=4 5114 B9R1.24 CCC1CCCC1(C)N Amb32676685 [0,1,0,1,0,0|2,0,0]=4 5115 B9R1.24 CCC1CNCC1(C)O Amb18642714 [0,1,0,1,0,0|2,0,0]=4 5116 B9R1.24 CCC1COCC1(C)O Amb35612446 [0,1,0,1,0,0|1,1,0]=4 5117 B9R1.40 CC1(C)CCSCC1N Amb27588490 [0,1,0,1,0,0|2,0,0]=4 5118 B9R1.40 CC1(C)CCSCC1O Amb27838561 [0,1,0,1,0,0|2,0,0]=4 5119 B9R1.40 CC1(C)CCSCC1S Amb24448173 [0,1,0,1,0,0|2,0,0]=4 5120 B9R1.40 CC1(C)CSCCC1N Amb27963147 [0,1,0,1,0,0|2,0,0]=4 5121 B9R1.40 CC1(O)CCSCC1N Amb32944498 [0,1,0,1,0,0|2,0,0]=4 5122 B9R1.40 CC1CCCCC1(C)C Amb22227673 [0,1,0,1,0,0|2,0,0]=4 5123 B9R1.40 CC1CCCCC1(C)Cl Amb27789616 [0,1,0,1,0,0|2,0,0]=4 5124 B9R1.40 CC1CCCCC1(C)N Amb9676158 [0,1,0,1,0,0|2,0,0]=4 5125 B9R1.40 CC1CCCCC1(C)O Amb9675954 [0,1,0,1,0,0|2,0,0]=4 5126 B9R1.40 CC1CCNCC1(C)C Amb25091675 [0,1,0,1,0,0|2,0,0]=4 5127 B9R1.40 CC1CCNCC1(C)O Amb27618808 [0,1,0,1,0,0|2,0,0]=4 5128 B9R1.40 CC1CNCCC1(C)F Amb27761977 [0,1,0,1,0,0|2,0,0]=4 5129 B9R1.40 CC1CNCCC1(C)O Amb22886361 [0,1,0,1,0,0|2,0,0]=4 5130 B9R1.40 C[C@@H]1CCCC[C@@]1(C)O Amb32945290 [0,1,0,1,0,0|2,0,0]=4 5131 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O Amb22886386 [0,1,0,1,0,0|2,0,0]=4 5132 B9R1.41 CC(=O)C1CSCC1C Amb32988245 [0,1,0,1,0,0|1,0,1]=4 5133 B9R1.41 CC(Br)C1COCC1C Amb35632052 [0,1,0,1,0,0|1,1,0]=4 5134 B9R1.41 CC(C)[C@@H]1NCC[C@H]1C Amb18832663 [0,1,0,1,0,0|2,0,0]=4 5135 B9R1.41 CC(C)[C@H]1SCC[C@H]1O Amb28350076 [0,1,0,1,0,0|2,0,0]=4 5136 B9R1.41 CC(Cl)C1COCC1C Amb35632051 [0,1,0,1,0,0|1,1,0]=4 5137 B9R1.41 CC(N)C1CCCC1C Amb28287560 [0,1,0,1,0,0|2,0,0]=4 5138 B9R1.41 CC(N)C1COCC1C Amb35635621 [0,1,0,1,0,0|1,1,0]=4 5139 B9R1.41 CC(O)C1CNCC1C Amb29849500 [0,1,0,1,0,0|2,0,0]=4 5140 B9R1.41 CC(O)C1COCC1C Amb35651587 [0,1,0,1,0,0|1,1,0]=4 5141 B9R1.41 CC1CCCC1[C@@H](C)N Amb26925525 [0,1,0,1,0,0|2,0,0]=4 5142 B9R1.41 CC1CCCC1[C@@H](C)O Amb28322680 [0,1,0,1,0,0|2,0,0]=4 5143 B9R1.41 CC1CCCC1[C@H](C)N Amb27777943 [0,1,0,1,0,0|2,0,0]=4 5144 B9R1.46 CC(C)CN[C@@H]1C[C@H]1C Amb28349879 [0,1,0,1,0,0|2,0,0]=4 5145 B9R1.46 CC(N)CCC1CC1C Amb33448587 [0,1,0,1,0,0|2,0,0]=4 5146 B9R1.46 CC(O)CCC1CC1C Amb33172627 [0,1,0,1,0,0|2,0,0]=4 5147 B9R1.46 CC1CC1CC[C@@H](C)N Amb33144244 [0,1,0,1,0,0|2,0,0]=4 5148 B9R1.46 CC1CC1CC[C@@H](C)O Amb33144245 [0,1,0,1,0,0|2,0,0]=4 5149 B9R1.46 CC1CC1CC[C@H](C)N Amb33144243 [0,1,0,1,0,0|2,0,0]=4 5150 B9R1.46 CC1CC1CC[C@H](C)O Amb33144246 [0,1,0,1,0,0|2,0,0]=4 5151 B9R1.59 CCCC1OC1C(C)O Amb26924649 [0,1,0,1,0,0|1,1,0]=4 5152 B9R1.59 CCC[C@@H]1O[C@H]1[C@@H](C)O Amb27255265 [0,1,0,1,0,0|1,1,0]=4 5153 B9R1.67 CC(O)CN1CCC1C Amb27406013 [0,1,0,1,0,0|2,0,0]=4 5154 B9R1.84 CC(Br)CCC1CCC1 Amb28143174 [0,1,0,1,0,0|2,0,0]=4 5155 B9R1.84 CC(C)CCN1CCC1 Amb27805290 [0,1,0,1,0,0|2,0,0]=4 5156 B9R1.84 CC(C)CSC1CCC1 Amb27837695 [0,1,0,1,0,0|1,0,0]=3 5157 B9R1.84 CC(C)CSC1CNC1 Amb22375592 [0,1,0,1,0,0|2,0,0]=4 5158 B9R1.84 CC(C)CSC1CNC1 Amb34164248 [0,1,0,1,0,0|2,0,0]=4 5159 B9R1.84 CC(F)CNC1CCC1 Amb28133092 [0,1,0,1,0,0|2,0,0]=4 5160 B9R1.84 CC(N)CCC1CCC1 Amb25888957 [0,1,0,1,0,0|2,0,0]=4 5161 B9R1.84 CC(N)CCN1CCC1 Amb27404116 [0,1,0,1,0,0|2,0,0]=4 5162 B9R1.84 CC(N)CNC1CCC1 Amb18990486 [0,1,0,1,0,0|2,0,0]=4 5163 B9R1.84 CC(O)CCC1CCC1 Amb27146306 [0,1,0,1,0,0|2,0,0]=4 5164 B9R1.84 CC(O)CNC1CCC1 Amb18989413 [0,1,0,1,0,0|2,0,0]=4 5165 B9R1.84 CC(O)CSC1COC1 Amb28285156 [0,1,0,1,0,0|2,0,0]=4 5166 B9R1.84 C[C@@H](N)CCC1CCC1 Amb33314113 [0,1,0,1,0,0|2,0,0]=4 5167 B9R1.84 C[C@@H](O)CCC1CCC1 Amb33314114 [0,1,0,1,0,0|2,0,0]=4 5168 B9R1.84 C[C@@H](O)COC1CCC1 Amb27607585 [0,1,0,1,0,0|1,1,0]=4 5169 B9R1.84 C[C@H](N)CCC1CCC1 Amb33314112 [0,1,0,1,0,0|2,0,0]=4 5170 B9R1.84 C[C@H](O)CCC1CCC1 Amb33195478 [0,1,0,1,0,0|2,0,0]=4 5171 B9R1.84 C[C@H](O)CSC1COC1 Amb28139851 [0,1,0,1,0,0|2,0,0]=4 5172 B9R1.85 C=C(C)CSCC1CC1 Amb28133272 [0,1,0,1,0,0|1,0,1]=4 5173 B9R1.85 CC(Br)CCCC1CC1 Amb33167096 [0,1,0,1,0,0|2,0,0]=4 5174 B9R1.85 CC(Br)C\C=C\C1CC1 Amb28137875 [0,1,0,1,0,0|2,0,0]=4 5175 B9R1.85 CC(C)CCNC1CC1 Amb1113142 [0,1,0,1,0,0|2,0,0]=4 5176 B9R1.85 CC(C)CCNC1CC1 Amb6239358 [0,1,0,1,0,0|2,0,0]=4 5177 B9R1.85 CC(C)CNCC1CC1 Amb6686738 [0,1,0,1,0,0|2,0,0]=4 5178 B9R1.85 CC(C)CSCC1CC1 Amb28319700 [0,1,0,1,0,0|1,0,0]=3 5179 B9R1.85 CC(C)CSC[C@@H]1CO1 Amb27956612 [0,1,0,1,0,0|2,0,0]=4 5180 B9R1.85 CC(F)CCNC1CC1 Amb27200076 [0,1,0,1,0,0|2,0,0]=4 5181 B9R1.85 CC(N)CCCC1CC1 Amb32675321 [0,1,0,1,0,0|2,0,0]=4 5182 B9R1.85 CC(N)CCNC1CC1 Amb19007235 [0,1,0,1,0,0|2,0,0]=4 5183 B9R1.85 CC(N)CCSC1CC1 Amb28125928 [0,1,0,1,0,0|1,0,0]=3 5184 B9R1.85 CC(N)CNCC1CC1 Amb19009744 [0,1,0,1,0,0|2,0,0]=4 5185 B9R1.85 CC(N)COCC1CC1 Amb6749895 [0,1,0,1,0,0|1,1,0]=4 5186 B9R1.85 CC(N)CSCC1CC1 Amb28204055 [0,1,0,1,0,0|1,0,0]=3 5187 B9R1.85 CC(O)CCCC1CC1 Amb27780444 [0,1,0,1,0,0|2,0,0]=4 5188 B9R1.85 CC(O)CNCC1CC1 Amb9423143 [0,1,0,1,0,0|2,0,0]=4 5189 B9R1.85 CC(O)COCC1CC1 Amb27835307 [0,1,0,1,0,0|1,1,0]=4 5190 B9R1.85 C[C@@H](N)CCCC1CC1 Amb33361296 [0,1,0,1,0,0|2,0,0]=4 5191 B9R1.85 C[C@@H](O)CCCC1CC1 Amb33361223 [0,1,0,1,0,0|2,0,0]=4 5192 B9R1.85 C[C@@H](O)CNCC1CC1 Amb28285299 [0,1,0,1,0,0|2,0,0]=4 5193 B9R1.85 C[C@H](N)CCCC1CC1 Amb33361291 [0,1,0,1,0,0|2,0,0]=4 5194 B9R1.85 C[C@H](N)CNCC1CC1 Amb27956499 [0,1,0,1,0,0|2,0,0]=4 5195 B9R1.85 C[C@H](O)CCCC1CC1 Amb33224926 [0,1,0,1,0,0|2,0,0]=4 5196 B9R1.85 C[C@H](O)COCC1CC1 Amb28397570 [0,1,0,1,0,0|1,1,0]=4 5197 B9R1.86 CCC1OC1CC(C)O Amb28285301 [0,1,0,1,0,0|1,1,0]=4 5198 B9R1.86 CC[C@H]1O[C@H]1C[C@@H](C)O Amb27196630 [0,1,0,1,0,0|1,1,0]=4 5199 B9R1.86 CC[C@H]1O[C@H]1C[C@H](C)O Amb28430621 [0,1,0,1,0,0|1,1,0]=4 5200 B9R1.96 CCC1NCC1C(C)C Amb27249802 [0,1,0,1,0,0|2,0,0]=4 5201 B9R1.148 CC1(C)CCCCNC1 Amb24611736 [0,1,0,1,0,0|2,0,0]=4 5202 B9R1.148 CC1(C)CCCNCC1 Amb18832664 [0,1,0,1,0,0|2,0,0]=4 5203 B9R1.148 CC1(C)CCCNCC1 Amb33715839 [0,1,0,1,0,0|2,0,0]=4 5204 B9R1.148 CC1(F)CCCCNC1 Amb22886308 [0,1,0,1,0,0|2,0,0]=4 5205 B9R1.148 CC1(F)CCCCNC1 Amb24672176 [0,1,0,1,0,0|2,0,0]=4 5206 B9R1.148 CC1(F)CCCNCC1 Amb22886292 [0,1,0,1,0,0|2,0,0]=4 5207 B9R1.148 CC1(N)CCCCCC1 Amb13952349 [0,1,0,1,0,0|2,0,0]=4 5208 B9R1.148 CC1(N)CCCCCC1 Amb9676104 [0,1,0,1,0,0|2,0,0]=4 5209 B9R1.148 CC1(O)CCCCCC1 Amb4017691 [0,1,0,1,0,0|2,0,0]=4 5210 B9R1.148 CC1(O)CCCCNC1 Amb22886278 [0,1,0,1,0,0|2,0,0]=4 5211 B9R1.148 CC1(O)CCCNCC1 Amb19516809 [0,1,0,1,0,0|2,0,0]=4 5212 B9R1.148 CC1(O)CCCNCC1 Amb22886914 [0,1,0,1,0,0|2,0,0]=4 5213 B9R1.148 CC1(O)CCCNCC1 Amb32409389 [0,1,0,1,0,0|2,0,0]=4 5214 B9R1.148 CC1(O)CCCOCC1 Amb20669018 [0,1,0,1,0,0|1,1,0]=4 5215 B9R1.148 CC1(O)CCCSCC1 Amb35692681 [0,1,0,1,0,0|1,0,0]=3 5216 B9R2.24 CC1C2CCC1NC2 Amb28255827 [0,0,0,2,0,0|2,0,0]=4 5217 B9R2.47 CCC1CC2CC2N1 Amb27411817 [0,0,0,2,0,0|2,0,0]=4 5218 B9R2.47 CC[C@H]1C[C@@H]2C[C@@H]2N1 Amb27446310 [0,0,0,2,0,0|2,0,0]=4 5219 B9R2.49 C1CC2CCC1CN2 Amb22728599 [0,0,0,2,0,0|2,0,0]=4 5220 B9R2.49 C1CC2CCC1CN2 Amb27798997 [0,0,0,2,0,0|2,0,0]=4 5221 B9R2.49 C1CC2CCC1N=N2 Amb17844445 [0,0,0,2,0,0|2,0,0]=4 5222 B9R2.49 C1CC2CCC1NN2 Amb28324043 [0,0,0,2,0,0|2,0,0]=4 5223 B9R2.49 C1CC2CCC1NN2 Amb28920693 [0,0,0,2,0,0|2,0,0]=4 5224 B9R2.49 C1CC2CCC1NO2 Amb32660466 [0,0,0,2,0,0|1,1,0]=4 5225 B9R2.49 C1CC2CCC1NO2 Amb32668911 [0,0,0,2,0,0|1,1,0]=4 5226 B9R2.50 C1CC2CCC2CN1 Amb27487622 [0,0,0,2,0,0|2,0,0]=4 5227 B9R2.50 C1CCC2NCC2C1 Amb7808805 [0,0,0,2,0,0|2,0,0]=4 5228 B9R2.50 C1CC[C@@H]2CN[C@H]2C1 Amb27880010 [0,0,0,2,0,0|2,0,0]=4 5229 B9R2.50 C1CC[C@H]2NC[C@H]2C1 Amb25168918 [0,0,0,2,0,0|2,0,0]=4 5230 B9R2.50 C1CNC2CCC2C1 Amb25976807 [0,0,0,2,0,0|2,0,0]=4 5231 B9R2.50 C1CNC2CCC2C1 Amb33457500 [0,0,0,2,0,0|2,0,0]=4 5232 B9R2.50 C1CN[C@@H]2CC[C@@H]2C1 Amb33457600 [0,0,0,2,0,0|2,0,0]=4 5233 B9R2.50 C1CN[C@H]2CC[C@H]2C1 Amb35745819 [0,0,0,2,0,0|2,0,0]=4 5234 B9R2.50 C1CSC2CCC2N1 Amb28645063 [0,0,0,2,0,0|2,0,0]=4 5235 B9R2.50 C1CSC2CCC2N1 Amb32667276 [0,0,0,2,0,0|2,0,0]=4 5236 B9R2.50 C1C[C@H]2CC[C@H]2CN1 Amb27661803 [0,0,0,2,0,0|2,0,0]=4 5237 B9R2.56 CCC12CNCC1C2 Amb30526863 [0,0,0,2,0,0|2,0,0]=4 5238 B9R2.56 CC[C@@]12CNC[C@@H]1C2 Amb30526978 [0,0,0,2,0,0|2,0,0]=4 5239 B9R2.56 CC[C@@]12CNC[C@@H]1C2 Amb35788721 [0,0,0,2,0,0|2,0,0]=4 5240 B9R2.65 CNC1[C@H]2CCS[C@@H]12 Amb27778563 [0,0,0,2,0,0|2,0,0]=4 5241 B9R2.65 OCC1C2CCSC12 Amb28122980 [0,0,0,2,0,0|2,0,0]=4 5242 B9R2.68 C1=C[C@H]2CC[C@@H](C1)C2 Amb26925899 [0,0,0,2,0,0|2,0,0]=4 5243 B9R2.68 C1CC2CCC(C1)N2 Amb10610725 [0,0,0,2,0,0|2,0,0]=4 5244 B9R2.68 C1CC2CCC(C1)N2 Amb19374849 [0,0,0,2,0,0|2,0,0]=4 5245 B9R2.68 C1CC2CCC(C1)O2 Amb22364980 [0,0,0,2,0,0|1,1,0]=4 5246 B9R2.68 C1CC2CCC(C2)N1 Amb18641674 [0,0,0,2,0,0|2,0,0]=4 5247 B9R2.68 C1CC2CCC(C2)N1 Amb35789676 [0,0,0,2,0,0|2,0,0]=4 5248 B9R2.68 C1CC2CCN(C1)C2 Amb27872310 [0,0,0,2,0,0|2,0,0]=4 5249 B9R2.68 C1CC2CNC(C1)C2 Amb3941214 [0,0,0,2,0,0|2,0,0]=4 5250 B9R2.68 C1CC2CNCC1C2 Amb10608778 [0,0,0,2,0,0|2,0,0]=4 5251 B9R2.68 C1CC2CNCC1C2 Amb18124234 [0,0,0,2,0,0|2,0,0]=4 5252 B9R2.68 C1CC2CNCC1S2 Amb27838955 [0,0,0,2,0,0|2,0,0]=4 5253 B9R2.68 C1CC2CSCC1N2 Amb28048978 [0,0,0,2,0,0|2,0,0]=4 5254 B9R2.68 C1CC2CSCC1N2 Amb33465453 [0,0,0,2,0,0|2,0,0]=4 5255 B9R2.68 C1C[C@@H]2CC[C@@H](C1)N2 Amb22405871 [0,0,0,2,0,0|2,0,0]=4 5256 B9R2.68 C1C[C@@H]2CN[C@H](C1)C2 Amb34915801 [0,0,0,2,0,0|2,0,0]=4 5257 B9R2.68 C1C[C@H]2CC[C@@H](C1)N2 Amb33523610 [0,0,0,2,0,0|2,0,0]=4 5258 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 Amb22757909 [0,0,0,2,0,0|2,0,0]=4 5259 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 Amb24392297 [0,0,0,2,0,0|2,0,0]=4 5260 B9R2.68 C1C[C@H]2CON(C1)C2 Amb27435263 [0,0,0,2,0,0|1,1,0]=4 5261 B9R2.68 C1C[C@H]2C[C@@H](C1)CN2 Amb23385228 [0,0,0,2,0,0|2,0,0]=4 5262 B9R2.68 C1NC2CSCC1C2 Amb28434901 [0,0,0,2,0,0|2,0,0]=4 5263 B9R2.68 C1NCC2CC1CS2 Amb24474071 [0,0,0,2,0,0|2,0,0]=4 5264 B9R2.68 C1NCC2CC1CS2 Amb32653103 [0,0,0,2,0,0|2,0,0]=4 5265 B9R2.123 CC1C2CCCCC12 Amb22365158 [0,0,0,2,0,0|2,0,0]=4 5266 B9R2.123 CC1C2CCNCC12 Amb27797303 [0,0,0,2,0,0|2,0,0]=4 5267 B9R2.174 C1CCC2(CC1)CC2 Amb22231454 [0,0,0,2,0,0|2,0,0]=4 5268 B9R2.174 C1CCC2(CC2)NC1 Amb10607947 [0,0,0,2,0,0|2,0,0]=4 5269 B9R2.174 C1CCC2(CC2)NC1 Amb22586669 [0,0,0,2,0,0|2,0,0]=4 5270 B9R2.174 C1CNCC2(C1)CC2 Amb18833098 [0,0,0,2,0,0|2,0,0]=4 5271 B9R2.174 C1CNCC2(C1)CC2 Amb22754138 [0,0,0,2,0,0|2,0,0]=4 5272 B9R2.174 C1CSCC2(CC2)N1 Amb27445929 [0,0,0,2,0,0|2,0,0]=4 5273 B9R2.6 CC12CCNCC1C2 Amb24183542 [0,0,0,2,0,0|2,0,0]=4 5274 B9R2.6 CC12CCNCC1C2 Amb25338129 [0,0,0,2,0,0|2,0,0]=4 5275 B9R2.39 CC1CC2CCC1O2 Amb27202757 [0,0,0,2,0,0|1,1,0]=4 5276 B9R2.39 ClC1CC2CCC1S2 Amb27985955 [0,0,0,2,0,0|2,0,0]=4 5277 B9R2.2 C1CN=C(C2CC2)C1 Amb24053736 [0,0,0,2,0,0|2,0,0]=4 5278 B9R2.2 C1CNC(C2CC2)C1 Amb19372940 [0,0,0,2,0,0|2,0,0]=4 5279 B9R2.2 C1CNC(C2CC2)C1 Amb9716012 [0,0,0,2,0,0|2,0,0]=4 5280 B9R2.2 C1CN[C@@H](C2CC2)C1 Amb27170744 [0,0,0,2,0,0|2,0,0]=4 5281 B9R2.2 C1CN[C@@H](C2CC2)C1 Amb35752734 [0,0,0,2,0,0|2,0,0]=4 5282 B9R2.2 C1CN[C@H](C2CC2)C1 Amb26515751 [0,0,0,2,0,0|2,0,0]=4 5283 B9R2.2 C1CSC(C2CC2)N1 Amb28383188 [0,0,0,2,0,0|2,0,0]=4 5284 B9R2.2 C1CSC(C2CO2)C1 Amb33416209 [0,0,0,2,0,0|2,0,0]=4 5285 B9R2.2 C1CSC([C@@H]2CO2)C1 Amb33415035 [0,0,0,2,0,0|2,0,0]=4 5286 B9R2.2 C1CSC([C@H]2CO2)C1 Amb33415036 [0,0,0,2,0,0|2,0,0]=4 5287 B9R2.3 C1=NCC2CCCC12 Amb25957455 [0,0,0,2,0,0|2,0,0]=4 5288 B9R2.3 C1CC2CCCN2C1 Amb22371122 [0,0,0,2,0,0|2,0,0]=4 5289 B9R2.3 C1CC2CCNC2C1 Amb18641673 [0,0,0,2,0,0|2,0,0]=4 5290 B9R2.3 C1CC2CCNC2C1 Amb32651656 [0,0,0,2,0,0|2,0,0]=4 5291 B9R2.3 C1CC2CNCC2C1 Amb10604048 [0,0,0,2,0,0|2,0,0]=4 5292 B9R2.3 C1CC2CNCC2C1 Amb8387764 [0,0,0,2,0,0|2,0,0]=4 5293 B9R2.3 C1CC2CNOC2C1 Amb23512675 [0,0,0,2,0,0|1,1,0]=4 5294 B9R2.3 C1CC2NCC[C@H]2C1 Amb27489269 [0,0,0,2,0,0|2,0,0]=4 5295 B9R2.3 C1C[C@@H]2CCN[C@@H]2C1 Amb25230592 [0,0,0,2,0,0|2,0,0]=4 5296 B9R2.3 C1C[C@@H]2CNC[C@@H]2C1 Amb22745958 [0,0,0,2,0,0|2,0,0]=4 5297 B9R2.3 C1C[C@@H]2CNC[C@@H]2C1 Amb28985813 [0,0,0,2,0,0|2,0,0]=4 5298 B9R2.3 C1C[C@@H]2NCC[C@H]2C1 Amb18203381 [0,0,0,2,0,0|2,0,0]=4 5299 B9R2.3 C1C[C@H]2CCN[C@H]2C1 Amb25978362 [0,0,0,2,0,0|2,0,0]=4 5300 B9R2.3 C1C[C@H]2CNC[C@@H]2C1 Amb26442837 [0,0,0,2,0,0|2,0,0]=4 5301 B9R2.3 C1C[C@H]2CSC[C@@H]2N1 Amb18832543 [0,0,0,2,0,0|2,0,0]=4 5302 B9R2.3 C1NCC2CSCC12 Amb18832544 [0,0,0,2,0,0|2,0,0]=4 5303 B9R2.3 C1NC[C@@H]2CSC[C@H]12 Amb26960528 [0,0,0,2,0,0|2,0,0]=4 5304 B9R2.3 C1NC[C@@H]2CSC[C@H]12 Amb31308513 [0,0,0,2,0,0|2,0,0]=4 5305 B9R2.173 C1CC2(C1)NCCS2 Amb27413243 [0,0,0,2,0,0|2,0,0]=4 5306 B9R2.173 C1CCC2(C1)CCC2 Amb6296982 [0,0,0,2,0,0|2,0,0]=4 5307 B9R2.173 C1CC[N+]2(C1)CCC2 Amb30666593 [0,0,0,2,0,0|2,0,0]=4 5308 B9R2.173 C1CNC2(C1)CCC2 Amb22229939 [0,0,0,2,0,0|2,0,0]=4 5309 B9R2.173 C1CNC2(C1)CCC2 Amb22406280 [0,0,0,2,0,0|2,0,0]=4 5310 B9R2.173 C1CNC2(C1)CCC2 Amb28934834 [0,0,0,2,0,0|2,0,0]=4 5311 B9R2.173 C1CNC2(C1)CCC2 Amb31307805 [0,0,0,2,0,0|2,0,0]=4 5312 B9R2.173 C1CNC2(C1)CCC2 Amb32683385 [0,0,0,2,0,0|2,0,0]=4 5313 B9R2.21 CC1CCC2OC2C1 Amb1141335 [0,0,0,2,0,0|1,1,0]=4 5314 B9R2.52 C1CC2CC2CCN1 Amb18203386 [0,0,0,2,0,0|2,0,0]=4 5315 B9R2.52 C1CCC2CC2NC1 Amb18203388 [0,0,0,2,0,0|2,0,0]=4 5316 B9R2.52 C1CCC2NC2CC1 Amb10609123 [0,0,0,2,0,0|2,0,0]=4 5317 B9R2.52 C1CCC2OC2CC1 Amb9708770 [0,0,0,2,0,0|1,1,0]=4 5318 B9R2.52 C1CNCC2CC2C1 Amb18203387 [0,0,0,2,0,0|2,0,0]=4 5319 B9R2.51 C1CC2CC(CN1)C2 Amb27224402 [0,0,0,2,0,0|2,0,0]=4 5320 B9R2.91 C1CC(=C2CCC2)C1 Amb25076047 [0,0,0,2,0,0|2,0,0]=4 5321 B9R2.91 C1CC(C2CCC2)C1 Amb27213025 [0,0,0,2,0,0|2,0,0]=4 5322 B9R2.91 C1CC(N2CCC2)C1 Amb28316009 [0,0,0,2,0,0|2,0,0]=4 5323 B9R2.157 C1CC(NC2CC2)C1 Amb16230427 [0,0,0,2,0,0|2,0,0]=4 5324 B9R2.157 C1CC(NC2CC2)C1 Amb30585089 [0,0,0,2,0,0|2,0,0]=4 5325 B9R2.157 C1CC(OC2CC2)C1 Amb28316196 [0,0,0,2,0,0|1,1,0]=4 5326 B9R2.5 CC1CSCC12CO2 Amb33731417 [0,0,0,2,0,0|2,0,0]=4 5327 B9R2.14 CC12CCC1CNC2 Amb26391628 [0,0,0,2,0,0|2,0,0]=4 5328 B9R2.69 C1CC1CNC2CC2 Amb33309482 [0,0,0,2,0,0|2,0,0]=4 5329 B9R2.69 C1CC1CNC2CC2 Amb8853840 [0,0,0,2,0,0|2,0,0]=4 5330 B9R2.69 C1CC1SSC2CC2 Amb10604145 [0,0,0,2,0,0|0,0,0]=2